smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3n[nH]c4c3COCC4)C2=O)cc1 2356135204 TVGNTDGANXXSQN-JOCHJYFZSA-N 394.475 2.593 0 50 GFAA Cc1nc(-c2ccc(C(=O)NCCCc3nn[nH]n3)cc2)c2sccc2n1 2356148379 SXGGXJPEWGFYDP-UHFFFAOYSA-N 379.449 2.542 0 50 GFAA O=C(NCCC(=O)N1CCCC[C@H]1CCN1CCCC1)c1ccccc1F 55359337 YEVWBKIRTKAKAG-KRWDZBQOSA-N 375.488 2.813 0 50 GFAA O=C([C@H]1COCCO1)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67714012 UIVQSPBNUCAPDU-GOSISDBHSA-N 389.835 2.849 0 50 GFAA C[C@H](c1ccccc1)N1CC[C@@H](NS(=O)(=O)CCn2cnc3ccccc32)C1 229623915 WDILYIXRQIWVAJ-IEBWSBKVSA-N 398.532 2.791 0 50 GFAA CCN1CCC[C@@H](C(=O)NCc2cccnc2N2CCc3ccccc3C2)C1 67514253 LCGFLSJHWJHFAF-OAQYLSRUSA-N 378.520 2.992 0 50 GFAA COCCN1CC[C@@H](CN(C)Cc2c[nH]nc2-c2ccc(OC)c(F)c2)C1 23158905 XYXMBYYXCKZSMG-HNNXBMFYSA-N 376.476 2.625 0 50 GFAA Nc1ncccc1CNC(=O)c1coc(COc2ccc3ncccc3c2)n1 67955011 UKSNFQFEBZXVOP-UHFFFAOYSA-N 375.388 2.709 0 50 GFAA Cc1c(C(=O)NCc2cccnc2N2CCOCC2)n(C)c2c(C)cccc12 67674881 CDKLVXPMRMZNTH-UHFFFAOYSA-N 378.476 2.957 0 50 GFAA CN(Cc1ccon1)c1ccc(C(=O)N2CCCC[C@H]2CCn2cccn2)cn1 39455454 VMIGHWKIBZIJAZ-IBGZPJMESA-N 394.479 2.988 0 50 GFAA O=C(Cc1ccccc1F)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2ccccn2)C1 72472787 NDCXEMVFPYIGMJ-GHTZIAJQSA-N 395.478 2.845 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@@H](CCc3ccc(F)cc3F)C2)n1 71755333 ZTGMSHYHINUWEK-HNNXBMFYSA-N 375.419 2.701 0 50 GFAA CC(=O)c1ccc(NC(=O)Cn2ncc(N3CCCCC3)c(Cl)c2=O)cc1 72117626 YSVODIIDQMPMCZ-UHFFFAOYSA-N 388.855 2.728 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)nn1 376572390 GGKKGHZEFHCWJJ-FGTMMUONSA-N 382.464 3.300 0 50 GFAA O=C(C[C@H]1COCCN1C(=O)CC1CCCCC1)Nc1ccc2c(c1)OCO2 72435026 PWNMCPLHMUVIIA-KRWDZBQOSA-N 388.464 2.942 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CC1)CNC(=O)C2)n1cc(C(C)=O)c2ccccc21 77536628 KSONIAZLBRHGIL-SFHVURJKSA-N 381.476 2.924 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c(C(=O)OC)c1C 17080796 OZSUIVWESWOGIQ-QWRGUYRKSA-N 395.433 2.625 0 50 GFAA CC(C)C[C@@H]1C(=O)NCCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1 294013943 WBHLWHWPVSJIJZ-LJQANCHMSA-N 394.475 2.711 0 50 GFAA COCCCN1CC2(CCN(C(=O)CSc3ccccc3)CC2)CC1=O 95367154 VHGYYMXRQYALDA-UHFFFAOYSA-N 376.522 2.656 0 50 GFAA O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1cn(CCc2ccccc2)nn1 294560752 NHKDMWWGWHEKOF-UHFFFAOYSA-N 395.438 2.749 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(Cc4cccc(C)n4)C3)CCC2=O)cn1 91468776 YKYVAQJUJFWELP-JOCHJYFZSA-N 379.508 2.893 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 95513387 NFHZNVKVWPDTSG-UHFFFAOYSA-N 392.503 2.953 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)CCC(=O)N(C)C1CCCCC1)C2 95518107 UCBBLWQFLAWMSE-INIZCTEOSA-N 388.508 2.934 0 50 GFAA O=C(N[C@@H]1CCN(Cc2ccccn2)C[C@H]1O)C1(c2ccccc2)CCCC1 244574869 CSQVLZDVGSEICY-NHCUHLMSSA-N 379.504 2.645 0 50 GFAA Cc1nn(CC(N)=O)c(C)c1-c1ccc(C(=O)N2CCC(F)(F)CC2)cc1 534651212 RHUOJLSBZKYPRF-UHFFFAOYSA-N 376.407 2.524 0 50 GFAA COc1cccc(N2CCN(C(=O)NCc3cnc(C)cc3C)[C@@H](C)C2=O)c1 584891284 DXHFYRNCUDBUHM-INIZCTEOSA-N 382.464 2.654 0 50 GFAA O=C(NC[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)[C@H]1NCCC12CC2 1875287800 ZYVWAGKGHHMXCR-VQTJNVASSA-N 375.472 2.642 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2cc(Cl)nn2-c2ncccc2Cl)c2ncnn21 1875294082 MCTJRCZLWGQTME-WPRPVWTQSA-N 378.223 2.601 0 50 GFAA Cc1sc2nc(-c3cccnc3)nc(N3CC(O)(Cc4cc[nH]n4)C3)c2c1C 1875320646 IZXOLFGWAUCTTG-UHFFFAOYSA-N 392.488 2.887 0 50 GFAA CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NC[C@@H]1COC(C)(C)CO1 1875345433 XPFUQADAJQUHLF-SJORKVTESA-N 396.915 2.795 0 50 GFAA CN(Cc1ccnc2ccccc12)C(=O)C1=NN(c2ccccc2)[C@H](C(=O)O)C1 1875396822 DMMZRQCZJKSNPX-FQEVSTJZSA-N 388.427 2.913 0 50 GFAA Cn1cc(-c2cccc(C(=O)N3CC[C@@H](C4CC4)[C@H]3c3nc(O)n[nH]3)c2)cn1 1875401096 FIOZORPRHMFFDT-IRXDYDNUSA-N 378.436 2.524 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3ccc(F)c(OC)c3)C[C@@H]2NC(C)=O)cc1 1565514869 BQOSXKQUMMFODD-MJGOQNOKSA-N 386.423 2.587 0 50 GFAA Cc1ncccc1Oc1ncnc(N2C[C@H]3CCN(Cc4cnc[nH]4)[C@H]3C2)c1C 1565514170 XNRUWHBBAPBUOG-AEFFLSMTSA-N 391.479 2.715 0 50 GFAA COCC(=O)Nc1ccc(Cl)c(NC(=O)CN(C)Cc2ccccc2)c1 952870164 SZGUXNUHUWLFSB-UHFFFAOYSA-N 375.856 2.995 0 50 GFAA CCc1ccc(S(=O)(=O)[C@@H]2CS(=O)(=O)C[C@H]2NC2CCCCCC2)cc1 55408879 DJSLMQVHDYKZII-RTBURBONSA-N 399.578 2.501 0 50 GFAA Cc1c(C(=O)COC(=O)c2ccc(S(C)(=O)=O)cc2)cnn1-c1ccccc1 1323610379 XWLCKRPMQOPOJM-UHFFFAOYSA-N 398.440 2.624 0 50 GFAA O=C(CCCCCc1ccc(F)cc1)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 274989779 AYWCOVIMPQNKAK-ICSRJNTNSA-N 397.512 2.781 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cc(Br)ccc2Cl)cn1 275644144 TWNBZAWJTVDVDO-ZBFHGGJFSA-N 397.704 2.946 0 50 GFAA Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@H](CO)c1cnn(C)c1 276927448 ZUOODBYMBWZXJO-CQSZACIVSA-N 394.353 2.866 0 50 GFAA C[C@H]1CN(C(=O)c2cc(Cl)cc(Br)c2F)CCS1(=O)=O 278575905 KYORKEVVZVXGQV-ZETCQYMHSA-N 384.654 2.501 0 50 GFAA CC(=O)Nc1ccc(C(=O)N2CCCN(Cc3noc(C(C)(C)C)n3)CC2)cc1 173021981 QUBFJAUKIAOBJN-UHFFFAOYSA-N 399.495 2.674 0 50 GFAA O=C1NCC2(CCN(C[C@H](O)Cn3c4ccccc4c4ccccc43)CC2)O1 782003767 HXFDSHCSICRONE-INIZCTEOSA-N 379.460 2.730 0 50 GFAA O=C(CCc1nnc(CCCCc2ccccc2)o1)NCCN1CCCCC1=O 11874439 VKXXEIYYTUGFTM-UHFFFAOYSA-N 398.507 2.696 0 50 GFAA c1cncc([C@H]2CCCCN2c2nc3nonc3nc2N2CCSCC2)c1 11937036 ODDOOWWHCTZFGO-CQSZACIVSA-N 383.481 2.693 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@@H](C(=O)c3ccccn3)C2)nn1 12454604 KTILXWHOUWDADD-GOSISDBHSA-N 389.459 2.765 0 50 GFAA CCOC(=O)[C@]1(CCOc2ccccc2)CCCN(C(=O)c2ccc[n+]([O-])c2)C1 12459799 AJGGESKXOSATIT-QFIPXVFZSA-N 398.459 2.575 0 50 GFAA Cc1c(CC(=O)N2CCSCC2)c2c(n1C[C@@H]1CCCO1)CCCC2=O 12591407 WAFWXIHWLPCOES-HNNXBMFYSA-N 376.522 2.612 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)[C@@H]2CCCO2)CC1 14973466 DGVDAFOICMSFMD-SFHVURJKSA-N 382.464 2.786 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NC(=O)C3=NN(C)C(=O)CC3)C2)cc1 15064084 LBDNNEGSTWBOTA-LJQANCHMSA-N 384.524 2.574 0 50 GFAA CCOc1cc(/C=C2/NC(=O)NC2=O)ccc1OCc1ccc(C(=O)O)cc1 16156654 MZVADKMZIYEOBN-OQLLNIDSSA-N 382.372 2.543 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(CC(C)(C)C)[C@@H](CCO)C1 19226332 CKWGBYLDZDCPIQ-KRWDZBQOSA-N 380.529 2.627 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3ccncc3)CC2)cc1Br 19558947 PLDKPIFGSPHHKR-UHFFFAOYSA-N 390.281 2.811 0 50 GFAA CCOC(=O)[C@H](Cc1ccccc1)C(=O)N1CCN(Cc2ccccc2)CC1 19787327 MBNBZHWJLOFIPQ-OAQYLSRUSA-N 380.488 2.753 0 50 GFAA Cc1ccc(C(=O)N2CC[C@H](n3cc(-c4nc(C5CC5)no4)nn3)C2)cc1C 169778239 QWIVGVGVIKEYJV-INIZCTEOSA-N 378.436 2.910 0 50 GFAA O=C(Oc1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)c1cccnc1 796545 FIUNUOZFRDQXMK-UHFFFAOYSA-N 379.397 2.862 0 50 GFAA COc1ccc(N([C@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2ccc(C)cc2)cc1 1196341 GZDPKXVLZUMGHP-INIZCTEOSA-N 393.486 2.510 0 50 GFAA COC(=O)COc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1Cl 2850902 IKBAERHYNBHJPS-UHFFFAOYSA-N 383.853 2.713 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(CCC3=C(C)CCCC3(C)C)C[C@]2(CO)C1 1857690036 STCNRXQJVUFBSW-PGRDOPGGSA-N 378.557 2.692 0 50 GFAA O=C1CC2(CCN(Cc3nc(-c4ccc(F)cc4)cs3)CC2)OCCN1 1857692452 FOCPKEJQPLCUDN-UHFFFAOYSA-N 375.469 2.820 0 50 GFAA CC(C)=CCN1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NCCn1ccnn1)C2 1857708334 OKNBISDHIIIJNX-QZNHQXDQSA-N 393.535 2.826 0 50 GFAA O=C(c1ccnn1C1CCCC1)N1CCN(c2ncnc3ccsc23)CC1 330163250 VAUUBTIGJPAKNG-UHFFFAOYSA-N 382.493 2.965 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2cc(-n3cccc3)ccn2)c2ccsc2S1(=O)=O 377347908 VLVLKHDBGYOKQC-WFASDCNBSA-N 387.486 2.971 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c1 124781684 NEIBYMAAPAYWOK-OAHLLOKOSA-N 386.477 2.526 0 50 GFAA O=C(Cc1coc(-c2cccs2)n1)N1CCC(CN2CCOCC2)CC1 264273817 BUBYOHXSBUDVDH-UHFFFAOYSA-N 375.494 2.516 0 50 GFAA C[C@H](NC(=O)N1C[C@@H](N)[C@H](c2cnn(C)c2)C1)c1cccc(OC(F)(F)F)c1 818649128 BEXFKMQLTTWFGC-KNXALSJPSA-N 397.401 2.516 0 50 GFAA Cn1c(CNC(=O)[C@H]2CN(Cc3ccccc3)C(C)(C)C2)nc2cccnc21 2325811637 IOHJZAUBRAKPLY-QGZVFWFLSA-N 377.492 2.885 0 50 GFAA COCCn1c(-c2ccc3c(c2)C(=O)NC3)nnc1N1CC2(CCCC2)C[C@H]1C 2325886004 FTSFPDNZJHFJAS-OAHLLOKOSA-N 395.507 2.994 0 50 GFAA Cc1cccc([C@@H](C)C(=O)NC[C@@H]2C[C@H](C(=O)NCCC(F)(F)F)CO2)c1 2332237678 HMTIUHADFPWSDL-KBMXLJTQSA-N 386.414 2.688 0 50 GFAA COc1ccccc1N1CCN(Cc2nc(N)nc(Nc3ccccc3)n2)CC1 9016043 DNOFXAHPJHHNTA-UHFFFAOYSA-N 391.479 2.528 0 50 GFAA COCCN(C(=O)CCC(=O)c1ccc2c(c1)OCCO2)C1CCSCC1 225566497 DEQQGXFIQHFVEO-UHFFFAOYSA-N 393.505 2.791 0 50 GFAA CS(=O)(=O)N(CC(F)(F)F)C1CCN(Cc2nc3ccccc3o2)CC1 112703314 DDQRZLWAYLUJMY-UHFFFAOYSA-N 391.415 2.616 0 50 GFAA COC1(C(F)(F)F)CCN(C(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)CC1 416965305 XFEKUFLHIUCTIL-UHFFFAOYSA-N 394.415 2.974 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)Cc2ccccc2Cl)n1CCOC 55369474 BBKHUKQMSVREMN-UHFFFAOYSA-N 385.917 2.609 0 50 GFAA CN1CCN(c2ccc(NC(=O)c3ccc(Cn4ccnc4)cc3)cc2)CC1 68232037 TVSAADIPTZJIQY-UHFFFAOYSA-N 375.476 2.936 0 50 GFAA Cc1ccc(Oc2ccc(NC(=O)C(=O)N[C@H]3CCc4cn[nH]c4C3)cn2)cc1 252569021 VUAOSZSJYVWGDD-HNNXBMFYSA-N 391.431 2.518 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)c2cn3ccccc3n2)C1)c1ccc(F)cc1 11935648 DUTKEVFTTVTUSR-HNNXBMFYSA-N 380.423 2.756 0 50 GFAA COC(=O)C1(C)CN(C(=O)c2nc(-c3cccs3)n(-c3ccccc3)n2)C1 425150375 KPZABKIWDPPVMP-UHFFFAOYSA-N 382.445 2.631 0 50 GFAA c1cnc(N2CCN(CCn3ccnc3-c3ccc4ccccc4n3)CC2)nc1 77342451 XGCAGSMSCZIQGN-UHFFFAOYSA-N 385.475 2.711 0 50 GFAA CC(C)N1[C@H]2CC[C@H]1CN(Cc1nc(O)c3cnn(-c4ccccc4)c3n1)CC2 329807180 ONEIMTMWGVQDSZ-WMZOPIPTSA-N 392.507 2.968 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@@H]3CCC[C@@H](C)[C@H]3C)cc2)c(=O)[nH]n1 33026744 QCRJOPWCUWMEKM-ZXYWRSMDSA-N 389.521 2.772 0 50 GFAA CC(=O)N[C@@H](CC(=O)NC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1 363362373 HCSBZNDHEKDASO-GGAORHGYSA-N 393.531 2.935 0 50 GFAA CN(C)c1nc2sc(C(=O)NCc3ccnc(-n4ccnc4)c3)cc2s1 363925342 QJMGRCXZRSACCE-UHFFFAOYSA-N 384.490 2.935 0 50 GFAA CC(C)Oc1cccnc1C(=O)N1CCn2c(Cc3ccccc3)nnc2C1 364173674 DUDKSVPKZGVYSM-UHFFFAOYSA-N 377.448 2.707 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc2c(c1)CN(C(=O)c1ccsc1)CC2 77407897 QQMCDOAWZAUVOC-UHFFFAOYSA-N 378.519 2.976 0 50 GFAA CC(C)n1ncc(NC(=O)Cn2cc(-c3cccc(-n4cccn4)c3)cn2)n1 48501579 OXNIMOHOOTUVPP-UHFFFAOYSA-N 376.424 2.547 0 50 GFAA CC(C)CCN1CC2(CCN(C(=O)[C@H](O)c3ccc(F)cc3)CC2)OC1=O 77358413 AIUWEVGQPSLKDC-QGZVFWFLSA-N 378.444 2.719 0 50 GFAA Cn1cc([C@@]2(C)NC(=O)N(CCCOc3ccc4ccccc4c3)C2=O)cn1 158975244 TUJNDMRIUZPCHS-OAQYLSRUSA-N 378.432 2.809 0 50 GFAA O=C1NCCN1c1cccc(NC(=O)N2CCOC[C@H]2c2ccc(F)cc2)c1 454453220 KOKOXZCSBBXLGL-SFHVURJKSA-N 384.411 2.961 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CC[C@]2(CCCN(CC3CCC3)C2)C1 426493883 AUVRXYQMDUAWLA-QFIPXVFZSA-N 383.492 2.709 0 50 GFAA CCCCc1ncc(CN2C[C@@H]3CC[C@H](C2)N(Cc2c(C)noc2C)C3=O)[nH]1 95523680 LTRMVTQAEZDWQY-FUHWJXTLSA-N 385.512 2.980 0 50 GFAA CCc1noc(CN2CCC3(CC2)CC(=O)N(Cc2cccc(OC)c2)C3)n1 95496514 HSLDNMUFKNAQOW-UHFFFAOYSA-N 384.480 2.655 0 50 GFAA CCCCN1C[C@@]2(CCCN(CCS(=O)(=O)c3ccccc3)C2)CCC1=O 92003149 ATCCABBHDRJPDB-NRFANRHFSA-N 392.565 2.965 0 50 GFAA Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)C[C@@H]3NC(=O)NC3=O)s2)cc1 163061675 AVONBLAGMPSWOH-JSGCOSHPSA-N 386.477 2.544 0 50 GFAA O=C(NCC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccc(Cl)c(Cl)c1 182114030 XFBJFWJDFBDUDV-CYBMUJFWSA-N 382.251 2.595 0 50 GFAA CC(=O)c1ncc(C(=O)NC[C@H]2CCCN(c3cnc4ccccc4n3)C2)s1 828199438 BTJOLLHIPCAIGW-CQSZACIVSA-N 395.488 2.935 0 50 GFAA COc1ccc(C[C@H](N)C(=O)Nc2ccc(OC3CCN(C)CC3)cc2)cc1 824673652 QRSYGWFHVDXARK-NRFANRHFSA-N 383.492 2.677 0 50 GFAA CCc1nc(C)sc1CNC(=O)N1CCc2nc[nH]c2[C@@H]1c1ccccn1 584895206 SGRAGASRCYHYLL-SFHVURJKSA-N 382.493 2.989 0 50 GFAA CCc1ccc(-c2cc(C(=O)N(C)[C@@H]3C[C@@H]4CC(=O)N(C)C[C@@H]4C3)n[nH]2)cc1 1529174255 RPJXSJGCEUNHOY-FGTMMUONSA-N 380.492 2.968 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(Cc2cc(-c3cccnc3)no2)C[C@@H]1O 1704306578 OZGVVDXERLFFHL-RBBKRZOGSA-N 393.443 2.617 0 50 GFAA O=C(c1ccc(CNc2cncc(C(=O)N3CCCC3)n2)cc1)N1CCCCC1 1704299333 JIFFUAWEADKOJY-UHFFFAOYSA-N 393.491 2.951 0 50 GFAA CN1CCC[C@@H](CCNC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704315855 PNFVXHBRJUBTQL-KRWDZBQOSA-N 398.507 2.640 0 50 GFAA COCC(=O)N1C[C@@H]2CN(C3CCSCC3)C[C@@]2(CCc2ccccc2)C1 1772704616 CXBLEBKHWDVUEL-UGKGYDQZSA-N 388.577 2.922 0 50 GFAA CC(C)=CCC[C@@H](C)CN1CCc2nnc(CNC(=O)c3ccncc3)n2CC1 11872524 UFPGFICHHDUOHV-GOSISDBHSA-N 396.539 2.844 0 50 GFAA COc1cccc(-c2cc(CC3(O)CCN(Cc4cnn(C)c4C)CC3)on2)c1 12430500 HXOXQHODYVQFBW-UHFFFAOYSA-N 396.491 2.962 0 50 GFAA Cc1cc(CN(C)C(=O)c2cn(Cc3ccccc3C(F)(F)F)nn2)n[nH]1 12447315 CLVIEVAONWZEMU-UHFFFAOYSA-N 378.358 2.649 0 50 GFAA C[C@H](Cn1cncn1)Nc1ccc(-c2nc(Cc3ccc(F)cc3)no2)cn1 14950877 FLULGLMMTIHUFI-CYBMUJFWSA-N 379.399 2.954 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@@H](C(=O)N4C[C@H](C)O[C@H](C)C4)C3)nc2c1 18213495 YJYSLCQFSBNYFM-HLLBOEOZSA-N 398.507 2.799 0 50 GFAA Cc1nc(CNC(=O)C2(N3C[C@H](C)O[C@H](C)C3)Cc3ccccc3C2)cs1 19229316 PUQABRRFBUEORE-GASCZTMLSA-N 385.533 2.715 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)C[C@@H]2CCO)cc(OC)c1 19743295 ANSQCCOWMWJIPI-NRFANRHFSA-N 384.520 2.815 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)c4ccc(F)cc4)CC3)nn2)n1 169780930 CQZPDPRZZFTJOL-UHFFFAOYSA-N 384.415 2.897 0 50 GFAA O=C1CCO[C@H]2CN(CCOc3ccc(F)cc3)C[C@@H]2N1Cc1ccccc1 1857728896 QLYZCQVLECIKFD-SFTDATJTSA-N 384.451 2.706 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(c3ncc(C(N)=O)cc3Cl)CC2)cc1 301488416 ZZKURADEKODIDZ-UHFFFAOYSA-N 386.883 2.675 0 50 GFAA Cc1cc(C(=O)OCCn2cnc(Br)n2)c2c(C(C)C)noc2n1 813204737 AJSHHMZWIVYENE-UHFFFAOYSA-N 394.229 2.866 0 50 GFAA Cn1cc(S(=O)(=O)NC(=O)CC(C2CCC2)C2CCC2)c(C(F)(F)F)n1 860796538 QFRORDYDTCCGSA-UHFFFAOYSA-N 393.431 2.850 0 50 GFAA N[C@H]1CC12CC(NC(=O)c1cccc(Nc3nccc(C(F)(F)F)n3)c1)C2 1875277845 JPBMGUJBFTYHBQ-JZLYGMAVSA-N 377.370 2.849 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)cn1 1875384886 JSCCJTILBRSWCK-JTWNBILESA-N 381.436 2.585 0 50 GFAA C[C@H]1CCc2[nH]nc(C(=O)N3CC[C@@H](Nc4ncnc5ccccc45)C3)c2C1 1775987010 SHWFXVGSSVKZGO-UONOGXRCSA-N 376.464 2.804 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(C(=O)c3ccc4nnc(-c5cccn5C)n4c3)C2)n1 2100482396 WFQMZZISBXLTMY-QGZVFWFLSA-N 389.463 2.635 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ncccc1-c1ccccn1 2325785692 JFWZIOOXQRNCAU-MORSLUCNSA-N 397.866 2.563 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)N3CCC[C@@H](c4ccccc4)C3)ccc2N1 880982574 MHXIKDFZAHFNMF-OAHLLOKOSA-N 399.472 2.824 0 50 GFAA O=C(NC1CN(c2ccc(C(F)(F)F)cc2)C1)c1nnc(-c2cscn2)o1 902945614 SCMQQUNCQSXMCY-UHFFFAOYSA-N 395.366 2.831 0 50 GFAA O=C(Nc1ccnn1Cc1ccccc1C(F)(F)F)[C@@H]1CCn2ncnc2C1 2356161059 DTXRFPORNSQLQT-GFCCVEGCSA-N 390.369 2.743 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCO2)c1)[C@@H]1CCCN1c1ncnc2ccccc12 229971074 SWPIWCWFTSRGNS-APWZRJJASA-N 392.463 2.613 0 50 GFAA COCCN(Cc1ccc(C)cc1)C(=O)c1ccc(N(C)S(C)(=O)=O)cc1 55073398 XZPGTEGMFCDGRK-UHFFFAOYSA-N 390.505 2.680 0 50 GFAA Cc1nc(C)c(C(=O)NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@@H](C)O3)s1 115921319 XYWAEALJJFZSAO-SSDOTTSWSA-N 386.882 2.855 0 50 GFAA O=C(NC1CCN(Cc2ccccc2F)CC1)N1CCN(c2ccncc2)CC1 56443142 KGFOQQYAJINZRU-UHFFFAOYSA-N 397.498 2.717 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)NCc3cnc4c(C)cccn34)CC2=O)cc1 55575900 HBMPZBYHRPJSTO-GOSISDBHSA-N 376.460 2.616 0 50 GFAA Cc1nc(-c2cccc(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)c2)no1 130003384 JEZIHPMUGDBUKN-LJQANCHMSA-N 390.443 2.966 0 50 GFAA Nc1nc2cc(C(=O)N3CCN(c4nc5ccccc5o4)CC3)ccc2s1 20600545 FAWBDCNDGOVDER-UHFFFAOYSA-N 379.445 2.982 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)cc2)c(=O)[nH]n1 35229551 QCRJOPWCUWMEKM-FRIZHTMISA-N 389.521 2.772 0 50 GFAA CCn1nc(C(=O)O)c2c1CCN(C(=O)[C@H](C)Oc1cccc(Cl)c1)C2 67673532 UAHZNWLVBAMPFA-NSHDSACASA-N 377.828 2.607 0 50 GFAA O=C1CC[C@@H](C(=O)NC2CCN(C(=O)c3ccccc3O)CC2)c2ccccc21 333238941 ICKXTQGRRCSLEU-GOSISDBHSA-N 392.455 2.873 0 50 GFAA O[C@@H]1CN(CC2CCCCC2)CC[C@H]1N1CCN(c2ccccc2F)CC1 12300968 AIZLMHBTAACSBR-FGZHOGPDSA-N 375.532 2.963 0 50 GFAA COc1ccc2nc(NC(=O)[C@H](C)N3C(=O)[C@@H]4CC=CC[C@H]4C3=O)sc2c1 252444111 SJNWATXDASAXKP-CYZMBNFOSA-N 385.445 2.583 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc(-n4cccn4)cc3)CC2=O)c1 72135299 XOZOSBLRPOPTHB-UHFFFAOYSA-N 376.460 2.725 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N[C@@H]2CCCN(C)C2)nc1 71315342 LGKHENYHOBODTH-GOSISDBHSA-N 384.528 2.728 0 50 GFAA O=C(NS(=O)(=O)Cc1c(F)cccc1F)c1cnc([C@H]2CCCO2)s1 129441963 BPCLOVZKNTUOPZ-GFCCVEGCSA-N 388.417 2.533 0 50 GFAA O=C(N[C@H](C(=O)O)c1ccccc1)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 238008813 BAVVXCOFWGUXKC-PXNSSMCTSA-N 398.434 2.549 0 50 GFAA C[C@H]1CN(C(=O)CCOc2ccc(Cl)cc2Cl)C[C@@H](C)N1CCO 456212166 OWKFOVRGPSGYTA-BETUJISGSA-N 375.296 2.676 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NCc1ccnc(N2CCCC2)c1 363096166 ZBDQKSWLMGBSTP-OAQYLSRUSA-N 392.503 2.834 0 50 GFAA CON1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 216048793 MIUSIGVYOUEARI-FQONHMEFSA-N 399.872 2.995 0 50 GFAA CN(C)c1ncccc1CNC(=O)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 376581137 WNYAFTWGIZACMH-AQNXPRMDSA-N 380.492 2.862 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)NCc1ccccc1CN1CC[C@H](O)C1)CCO2 286875863 RQYMYJYTNQOJEW-NRFANRHFSA-N 395.503 2.666 0 50 GFAA COc1ccc(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)c(OC)c1 44904047 XIGDYUITAQASQF-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA O=C(CC1CCCC1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 82098012 BCVWLMOAQXUUAG-LJQANCHMSA-N 375.557 2.892 0 50 GFAA CNC(=O)c1ccnc(N2CC[C@@]3(CCCN(CCc4ccccc4)C3)C2)c1 426563096 BSDKPFCXJVDQCC-HSZRJFAPSA-N 378.520 2.976 0 50 GFAA CC(C)c1ccc(CN2CCC[C@]3(CCN(CCCn4cnnn4)C3)C2=O)cc1 426551987 NMUVCDZNVLLBNQ-JOCHJYFZSA-N 396.539 2.701 0 50 GFAA COc1ccccc1NC(=O)c1cn(C)nc1C(=O)Nc1ccccc1OC 20617150 AUGIFDGYHGFITC-UHFFFAOYSA-N 380.404 2.942 0 50 GFAA C[C@H](C(=O)Oc1cccc2cccnc12)N1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O 239046692 FXERADPWPCNZNP-QDAPTQOFSA-N 388.423 2.582 0 50 GFAA COc1cc(C(=O)N2CC[C@@](C)(C(=O)O)C2)ccc1OCc1cscn1 269023321 JIKLFQHAOGCTOO-GOSISDBHSA-N 376.434 2.668 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc(F)cc1)NCc1cc2n(n1)CCNC2 96166649 YTEYQDJRWAPBGN-NRFANRHFSA-N 378.451 2.964 0 50 GFAA COc1ccccc1CNC(=O)CN1CCC[C@H](c2ccc(C(=O)O)cc2)C1 95372552 DRYKWFKHDWVAQF-IBGZPJMESA-N 382.460 2.889 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CC[C@H](N2CCOCC2)[C@H](CCC(=O)O)C1 91635625 USBUAMDHSXZFLG-QAPCUYQASA-N 394.899 2.676 0 50 GFAA COc1cc(CN2CC=C(C)CC2)ccc1OC[C@@H](O)CN1CCSCC1 95513060 BEDSHMNMBWIZNR-IBGZPJMESA-N 392.565 2.636 0 50 GFAA Cn1cc(C(=O)N2CC[C@H](Cc3cccc(CO)c3)C2)c(=O)c2ccccc21 95373749 FRDJTLYBHLARRM-QGZVFWFLSA-N 376.456 2.736 0 50 GFAA COc1cc(C(=O)N2CCC[C@H]2C(=O)O)ccc1OCc1csc(C)n1 299743046 JPGRDCLHOJOSPD-AWEZNQCLSA-N 376.434 2.728 0 50 GFAA CC(C)Oc1ccccc1CNC(=O)C[C@H]1NC(=O)c2ccccc2N=C1O 252548719 QHMYHZKHWSVTLF-QGZVFWFLSA-N 381.432 2.880 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNC(=O)c2ccc3c(c2)ncn3CCO)C1 828776991 PBJVFVFSBVRSSN-IBGZPJMESA-N 392.503 2.556 0 50 GFAA O=C(c1cnn(-c2ccc(C(F)(F)F)cc2)c1)N1CCC2(CC2)S1(=O)=O 1875285119 CRPHYDGRYKLWAU-UHFFFAOYSA-N 385.367 2.599 0 50 GFAA O=C(Cn1c(Cc2ccc(F)cc2)noc1=O)Nc1ncc(Cl)cc1Cl 1875318999 XENSODHBAYASJY-UHFFFAOYSA-N 397.193 2.907 0 50 GFAA N[C@@H](CCNC(=O)NC[C@@H](c1cccc(O)c1)N1CCCC1)Cc1ccccc1 1875354576 JMBIBNZUPQDQOG-UNMCSNQZSA-N 396.535 2.788 0 50 GFAA O=C(NCC1CCN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1)c1cn2ccccc2n1 952965013 BGOJWQMWVFIMPN-FGTMMUONSA-N 378.476 2.515 0 50 GFAA CCN(Cc1nc(-c2ccc(C)cc2)no1)C(=O)/C=C/c1cnc(N(C)C)nc1 952972087 FFAAUNNDNCSHFS-DHZHZOJOSA-N 392.463 2.963 0 50 GFAA Cc1oc(C)c(C(=O)N[C@@H]2CCCCCN(C(=O)CCCCC(N)=O)C2)c1C 1775993123 ZWDXUUSOHVCERS-QGZVFWFLSA-N 391.512 2.752 0 50 GFAA CCCCC(=O)N1CCCCC[C@@H](NC(=O)[C@]2(CC(C)C)CCNC2=O)C1 1775991135 HOBMZPFQQVUQCR-UTKZUKDTSA-N 379.545 2.616 0 50 GFAA COc1ccc(-c2noc(CCC(=O)NCc3nnc(SC)s3)n2)cc1 170602942 ZGQHCZCTZXKCGU-UHFFFAOYSA-N 391.478 2.568 0 50 GFAA O=C(Cn1nnc(-c2ccc(Br)o2)n1)N1CCC[C@H]2CCCC[C@@H]21 408158834 OOGAGYJAJGFXCB-NEPJUHHUSA-N 394.273 2.877 0 50 GFAA CCC[C@@]1(C(=O)OCC)CCCN1CC(=O)Nc1cccc(NC(C)=O)c1 225536019 WASMVOYZGJTSAS-FQEVSTJZSA-N 375.469 2.781 0 50 GFAA COCCn1cncc1CN1CCCN(C(=O)CCc2ccc(C)cc2)CC1 1772703930 GOPRLGORPHWFJD-UHFFFAOYSA-N 384.524 2.505 0 50 GFAA CC(=O)c1cn([C@@H](C)C(=O)N2CCC3(CC2)CN(C)CCO3)c2ccccc12 1772814780 BHMRIECPGADBNY-INIZCTEOSA-N 383.492 2.728 0 50 GFAA CCN(CCn1cccn1)C(=O)c1cc(COc2c(F)cccc2F)on1 12432437 VKOVBORJSNANPQ-UHFFFAOYSA-N 376.363 2.891 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)C2CCOCC2)C1)NCc1ccccc1F 15073681 IDHVQWXJGYJIOG-MRXNPFEDSA-N 376.472 2.887 0 50 GFAA O=C(c1nc2ccccn2c1CNCc1ccc(Cl)s1)N1CCOCC1 19789748 JNGOTPXGQCGNGT-UHFFFAOYSA-N 390.896 2.811 0 50 GFAA CCCCn1c(CCC(=O)O)nc2cc(S(=O)(=O)N(CC)CC)ccc21 169301489 NYWAELKLKKYXFV-UHFFFAOYSA-N 381.498 2.884 0 50 GFAA CC(C)(C)c1nnc2sc(SCC(=O)Nc3ccc(F)cc3)nn2c1=O 629323 DJSDTTOMMQGIPR-UHFFFAOYSA-N 393.469 2.713 0 50 GFAA O=C(COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)NC1CC1 2879096 KPTNZJAUWNRYIL-UHFFFAOYSA-N 380.853 2.798 0 50 GFAA CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)OC 4764305 WGEUGAFHOWNSBM-IRXDYDNUSA-N 378.469 2.785 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(=O)N1CCCCCC1 4999269 VTLYMIXCDYZZFV-UHFFFAOYSA-N 389.477 2.907 0 50 GFAA COCC(=O)N1CCCC(=O)N2CCCC[C@@H]2CCc2cccc(c2)OCC1 1857696727 NLPNLUNXRXBKLE-LJQANCHMSA-N 388.508 2.648 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(C[C@H]2CCOC2)CC1)N1CCCC1 1857703206 XYQSKJVAUCPQOY-MRXNPFEDSA-N 390.549 2.884 0 50 GFAA CC(C)Cc1cc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)on1 1857707723 HVUAWOPPQUUJNM-KPLVRAHFSA-N 395.459 2.788 0 50 GFAA CC[C@@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-n2nnnc2C)cc1F 450625726 FUCRTNIRJKAMTA-MRXNPFEDSA-N 394.454 2.851 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C2CCN(C(=O)C[C@@H]3CCCO3)CC2)C1 839830158 IWZJIQSYXBDOAU-SQNIBIBYSA-N 396.528 2.866 0 50 GFAA O=C1C[C@H](N2CCN(c3ccccc3Cl)CC2)C(=O)N1c1cccc(F)c1 18182014 KWWYLBZSERMXHT-SFHVURJKSA-N 387.842 2.933 0 50 GFAA CN(C)C[C@@H]1CN(C(=O)N2CCCc3ccc(-c4cnn(C)c4)nc32)CC12CC2 2325798361 VMRPNZSYHPSISP-GOSISDBHSA-N 394.523 2.628 0 50 GFAA Cc1cccc2c1c(CCNC(=O)NCc1nc(-c3ccco3)n[nH]1)cn2C 2325869467 OWPIYDRZMGQMFP-UHFFFAOYSA-N 378.436 2.907 0 50 GFAA C[C@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)c(Br)s2)CCN1C 123818538 GERDQMKLTKEWJC-YUMQZZPRSA-N 387.752 2.925 0 50 GFAA CCC[C@@]1(CO)CN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC[C@H]1O 2356165006 OXWNTLDCKGVJAC-IRLDBZIGSA-N 380.492 2.742 0 50 GFAA COc1ccc(CNC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)cc1 4671842 REWLQWHQGUETOT-UHFFFAOYSA-N 398.484 2.931 0 50 GFAA CCc1cc(-c2cccc(-c3ccn(C[C@H](C)O)n3)c2)nc(N2CCOCC2)n1 23379759 DIIOPVYRIDJKIJ-INIZCTEOSA-N 393.491 2.787 0 50 GFAA OC[C@@]1(CCOc2ccccc2)CCCN(c2nnnn2-c2ccccc2)C1 67714085 YSRRTLUVHOUBGE-OAQYLSRUSA-N 379.464 2.710 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cc1O 67803128 AHMOQETXAJRUPS-IBGZPJMESA-N 399.535 2.640 0 50 GFAA C[C@H](NC(=O)c1cnn(C)c1Cc1ccccc1)c1ccc2c(c1)NC(=O)CO2 444844147 BVZIKEIMZLGQPO-AWEZNQCLSA-N 390.443 2.833 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CCn3ccnc3CC)CC2)OC1=O 77422732 NYPBXTWAFUEPDC-INIZCTEOSA-N 376.501 2.838 0 50 GFAA Cc1cc(C(F)F)nn1CC(=O)N1CCC([C@@H](O)Cc2ccccc2)CC1 77388910 XLVXHWACFNRYLO-SFHVURJKSA-N 377.435 2.971 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc2)C[C@@H](C)O1 131122804 HKFZYLMENPVBJR-VYXDICFBSA-N 380.488 2.684 0 50 GFAA CN(C(=O)c1ccoc1C1(O)CCOCC1)[C@H]1CCCN(c2ccccc2)C1=O 253418620 SZNFAWNCFVLCJK-SFHVURJKSA-N 398.459 2.545 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)Cc3ccc(F)cc3C)CC[C@H]21 72453889 VAUKKOMTVACBLI-PKOBYXMFSA-N 376.472 2.553 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1)N1CCC(F)CC1 71752673 PQFWWDWNZLMSDI-IBGZPJMESA-N 388.531 2.719 0 50 GFAA C[C@H](NC(=O)c1coc(S(=O)(=O)N(C)C)c1)c1ccc2c(c1)CCCC2 159713833 VVPAJZYRLXVGIJ-ZDUSSCGKSA-N 376.478 2.900 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN3CCc4ccccc4C3)C2=O)c1 20455861 AWAQHQMJSDYDGH-QHCPKHFHSA-N 398.478 2.746 0 50 GFAA CCc1nn2c(ncc3c(=O)n(CCC(=O)O)ccc32)c1-c1ccc(F)cc1 40396794 JWHGAFDREBGDJY-UHFFFAOYSA-N 380.379 2.887 0 50 GFAA COc1cccc(-c2ncc(CNC(=O)N3CCCN(C(C)=O)CC3)s2)c1 426498762 UEXGHPSVZBKNBM-UHFFFAOYSA-N 388.493 2.583 0 50 GFAA O=C(c1cc2ccccc2o1)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 180302348 UHIRSOIXDPNEOB-INIZCTEOSA-N 376.478 2.899 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)CCn3ccc(C)n3)[C@@H]3C4CCN(CC4)[C@H]23)c1 95365620 CXVBOFZDOSNDTQ-MDNUFGMLSA-N 394.519 2.679 0 50 GFAA Cc1ccc(NC(=O)NCCCc2ccc(O)cc2)cc1NC(=O)CN(C)C 97117728 JWLOYJVGWWPAMD-UHFFFAOYSA-N 384.480 2.955 0 50 GFAA COc1ccc([C@@H](NC(=O)CCc2nc3ccccc3[nH]2)[C@H]2C[C@@H](O)C2)cn1 244735119 NTDWVXKRVJJBMS-LRAJWGHMSA-N 380.448 2.528 0 50 GFAA Cc1ccc(CNC(=O)N2CCc3nn(Cc4ccccc4)c(=O)cc3C2)cc1 263619138 XDUOVXYSDXUMEY-UHFFFAOYSA-N 388.471 2.868 0 50 GFAA O=C(NCCCSc1ccccc1)N1CCN([C@H]2CN3CCC2CC3)CC1 534589142 SCOMKXKJIPAPOA-FQEVSTJZSA-N 388.581 2.590 0 50 GFAA Cc1cc(N2CCCN(C(=O)NCCSCc3[nH]cnc3C)CC2)ccn1 534660305 PDJCODUUZJZTBZ-UHFFFAOYSA-N 388.541 2.577 0 50 GFAA CC1(CN)CCN(C(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccs2)CC1 1875292603 NPVLMUJYNMZCHY-QGZVFWFLSA-N 385.533 2.677 0 50 GFAA Cc1cc(C)c(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2c(C)noc2C)C3)c(O)n1 1565529910 AQKVQQCICNFDJE-SJORKVTESA-N 384.480 2.745 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H]2CC3(CCN(C)CC3)Oc3ccccc32)CC1 1875371658 INSWHETZACZBOW-LJQANCHMSA-N 397.519 2.515 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)C3)ccc21 1875371783 LZKZJLSXUXJYKX-KRWDZBQOSA-N 399.491 2.891 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)C2(c3ccccc3F)CCC2)C1)c1cncnc1 1875305215 MUWZEUGCSDWLSY-INIZCTEOSA-N 396.466 2.706 0 50 GFAA CNC(=O)c1cccc(S(=O)(=O)N(C)CCCOc2ccccc2Cl)c1 952974005 ZFZFCMQBGXWDFG-UHFFFAOYSA-N 396.896 2.789 0 50 GFAA COCCN(CCOc1ccccc1F)C(=O)c1cccc2c1OCCO2 952978698 ROAKREZZBHDWPU-UHFFFAOYSA-N 375.396 2.765 0 50 GFAA Nc1nc2c(c(C(=O)N3CCC[C@@H]3c3nc4ccc(F)cc4[nH]3)n1)CCCC2 952978947 MDZMICCNGYMGCL-MRXNPFEDSA-N 380.427 2.930 0 50 GFAA COc1ccccc1[C@H](CNC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)N(C)C 888101866 PPDISVSRWBBEQI-SFHVURJKSA-N 385.512 2.815 0 50 GFAA O=C(N1CC[C@H](OC(F)F)C1)[C@@]1(O)CCc2cc(Br)ccc2C1 888100347 BTFYPDVYBOKFCG-XJKSGUPXSA-N 390.224 2.509 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)C(=O)N[C@H]1CCc2[nH]ncc2C1 167601584 XSDFCVNMRQEYHV-HNNXBMFYSA-N 376.416 2.814 0 50 GFAA Cc1ccc(Br)c(S(=O)(=O)N2CCC[C@@H](CC(=O)O)C2)c1 275367893 VVTUHNKSYGPBFX-NSHDSACASA-N 376.272 2.633 0 50 GFAA Cc1ccc(C)c(-n2cnc3cc(C(=O)N4CCNC(=O)C4(C)C)ccc32)c1 409525867 TXAVQADMLSTTIY-UHFFFAOYSA-N 376.460 2.993 0 50 GFAA CC(C)c1nnc2ccc(NC(=O)[C@H]3CCCN3C(=O)c3ccccc3O)cn12 189091865 ZDISCIOUKIYFSJ-MRXNPFEDSA-N 393.447 2.802 0 50 GFAA COc1cccc2c1CCN(C(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1)CC2 193773733 WMFOCQSBDZICQB-GOSISDBHSA-N 387.524 2.700 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCN(Cc2ncccc2C)CC1 1506421961 MCHILTXDVWUBNG-UHFFFAOYSA-N 389.521 2.522 0 50 GFAA Cc1cccc(OC(C)(C)C(=O)N2C[C@H](C(=O)O)C3(CCOCC3)C2)c1C 1800414886 XLGNZNNUCYYLID-MRXNPFEDSA-N 375.465 2.801 0 50 GFAA COc1cccc(CN2CCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)CC2)c1 1772711478 UPWBISCILGSMRW-UHFFFAOYSA-N 391.475 2.828 0 50 GFAA COc1ccc(N[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1OC 12315169 UQYRGIZGIPCSLL-INIZCTEOSA-N 376.478 2.969 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC(C)C)cc2)ccc1OC 13678197 XCMXBTUPKPGVMG-UHFFFAOYSA-N 378.450 2.643 0 50 GFAA O=C(CC[C@]1(Cc2ccco2)CCC(=O)N1)NC[C@H]1CCc2ccccc2O1 14967252 RLQCPMHBQSPBIY-XMSQKQJNSA-N 382.460 2.761 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@H](NCCCSC)C2 19839667 GJMOQOXOMDELSV-HNNXBMFYSA-N 390.553 2.968 0 50 GFAA CN(CCN1CCOCC1)C(=O)c1csc2nc(-c3ccc(F)cc3)cn12 19883350 ANTSTWPIARZUTQ-UHFFFAOYSA-N 388.468 2.606 0 50 GFAA CC(=O)Nc1cccc(C(=O)N2CCC3(CC2)NC(c2ccc(C)cc2)=NO3)c1 169754960 DRCHMPUNQZKFBU-UHFFFAOYSA-N 392.459 2.867 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)C4(c5ccccc5)CC4)CC3)nn2)n1 169777306 OTONSFYDUPCXEG-UHFFFAOYSA-N 378.436 2.532 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(Cl)cc2)S(C)(=O)=O)cc1OC 824308 DDECGFWPFYETGE-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CN(CCCNC(=O)c1ccccc1F)CCCNC(=O)c1ccccc1F 2849760 UOKQOHHBKQFCCG-UHFFFAOYSA-N 389.446 2.837 0 50 GFAA C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(I)cc2)C1 2999266 SLWTVRZAOGZOSR-GHMZBOCLSA-N 379.263 2.958 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccc(F)c(Cl)c2)cc1 4838316 YRWTUULJAWITQU-JTQLQIEISA-N 386.832 2.793 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CC[C@H]2[C@@H]1CC(=O)N2C1Cc2ccccc2C1 1857681207 CDNGZAQSBYWXOU-VXKWHMMOSA-N 390.483 2.694 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(c4nccs4)C[C@]34CC[C@H]2O4)s1 1857717850 BJQMWSVYMRPFTB-HNSFDTNUSA-N 375.519 2.927 0 50 GFAA Cc1ccc(CC(=O)NC[C@H]2[C@H]3CN(c4nccs4)C[C@]34CC[C@H]2O4)cc1 1857718587 LUCFXDVYPLNLFB-XKGFGPFHSA-N 383.517 2.794 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@@H](c2ccccn2)C1 1857728059 LHYBABIYJBRYCM-OAHLLOKOSA-N 381.461 2.771 0 50 GFAA CN(C)c1ncccc1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857731476 RNOMPJXHCURSQJ-UHFFFAOYSA-N 375.476 2.789 0 50 GFAA CC(C)c1ncc(Cl)c(C(=O)N2CCOC[C@@H]2c2noc(C(C)C)n2)n1 329252519 BYGNWEIDSXQKCL-GFCCVEGCSA-N 379.848 2.974 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN1CC[C@H](CNc2ccccn2)C1 128263255 VFWIGHSKUJWUDR-CQSZACIVSA-N 383.418 2.999 0 50 GFAA O=C(Cn1cnc(NC(=O)[C@H](c2ccccc2)C2CC2)n1)NCc1ccccc1 132728259 HOXKINBXKBXOMO-HXUWFJFHSA-N 389.459 2.727 0 50 GFAA Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)N(C)CCC(=O)O 262750760 MRVHUSFBNWVDIO-UHFFFAOYSA-N 394.269 2.857 0 50 GFAA C[C@H]1CC[C@@H](C(=O)O)CN1C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 263243439 RWDVXSFOBHDKCI-XJKSGUPXSA-N 388.851 2.875 0 50 GFAA O=C(COc1ccc(Br)cc1Cl)N1CCC2(CC1)OCCO2 13326009 OIXQRROEGKRJLL-UHFFFAOYSA-N 390.661 2.847 0 50 GFAA COCc1n[nH]c(NC(=O)c2cnn3cc(C)cnc23)c1-c1ccc(OC)cc1 2100483076 PWWAUFIFABDGOW-UHFFFAOYSA-N 392.419 2.835 0 50 GFAA C[C@@H]1NCCn2c(C(=O)Nc3ccc(-c4n[nH]c5c4COCC5)cc3)ccc21 2325774960 KXFSJZCNRJPIBT-ZDUSSCGKSA-N 377.448 2.867 0 50 GFAA Cc1cn2ccnc(C(=O)N(C)C[C@H](C)NC(=O)c3cc(C)c(F)c(C)c3)c2n1 2325793997 NREHIUQUPAILIW-AWEZNQCLSA-N 397.454 2.684 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@H]2CC(=O)N(c3cccc(O)c3)C2)CC1 2356155770 MGAHOUKKESVEBP-KRWDZBQOSA-N 394.471 2.909 0 50 GFAA CN1C[C@H]2C[C@@H](N(C)C(=O)Cn3c(C4CC4)nc4ccccc43)C[C@H]2CC1=O 2356168880 GGDXFWINOZUXCL-BBWFWOEESA-N 380.492 2.629 0 50 GFAA CCCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(Br)cc2)C1 6746640 FZHISVLSVHEIBH-GFCCVEGCSA-N 389.315 2.839 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CCN2CCC[C@H]2CO)c2ccccc2)cc1 245407235 AGZXDBVEMYBRGB-PZJWPPBQSA-N 388.533 2.861 0 50 GFAA Cc1ncc(C[n+]2csc(CCOC(=O)[C@@H]3C[C@H]4CC[C@H]3C4)c2C)c(N)n1 101834499 CYBLJVGBDWMZJC-YQQAZPJKSA-N 387.529 2.595 0 50 GFAA O=C1NCCN(CC2CCCCC2)[C@H]1CC(=O)N1CCC(c2ccncc2)CC1 12303515 ZYUOZHJOQGHQMT-NRFANRHFSA-N 398.551 2.558 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccccc1)CC2 20762208 TWAXKVFHZBGLEJ-XMSQKQJNSA-N 394.471 2.808 0 50 GFAA biogenic O=C(NCc1ccc(F)cc1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 2802711 HTRJSQPFJZSOEN-OAHLLOKOSA-N 394.443 2.682 0 50 GFAA Cc1ccc2oc(CN3CCN(CC4CC4)[C@@H]4CS(=O)(=O)C[C@@H]43)c(C)c2c1 72433261 ZUCMIDMHODKJQF-MOPGFXCFSA-N 388.533 2.743 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CCc3ncccc3C2)nc2cccnc21 77297727 LLEKNPBBPQZCMY-MRXNPFEDSA-N 393.491 2.941 0 50 GFAA C[C@H](Cn1cncn1)NC(=O)c1cc(COc2ccc3c(c2)CCCC3)on1 11662430 ZEGRFAZICJZMBZ-CQSZACIVSA-N 381.436 2.542 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@H](O)c2c(F)cccc2F)n1C 328640328 QANJVHUMNOBBDM-WMZOPIPTSA-N 377.435 2.924 0 50 GFAA Nc1ncc(Cl)cc1S(=O)(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1 333873065 CAFSSTKGFJVHDA-MRXNPFEDSA-N 393.896 2.860 0 50 GFAA O=C(NCC1(c2ccc(Br)s2)CCC1)[C@@H]1CCc2nn[nH]c2C1 375928135 RJIUINOIXUZESS-SNVBAGLBSA-N 395.326 2.972 0 50 GFAA Cc1cc(N2CC[C@@H](N3CC4(CCOCC4)[C@H]3c3ccccc3)C2=O)n(C)n1 333194986 VZEJDYVZXQEATD-UYAOXDASSA-N 380.492 2.688 0 50 GFAA COCCCn1ccc2c(cnc3c(-c4ccccc4)c(COC)nn32)c1=O 40396382 DLKVVGLPTZUDBQ-UHFFFAOYSA-N 378.432 2.894 0 50 GFAA CCc1onc(C)c1NC(=O)N1CCOC[C@H]1c1ncnn1-c1ccccc1 284650713 CQHKLHLUWGNTKK-HNNXBMFYSA-N 382.424 2.732 0 50 GFAA CN(C)Cc1nnc([C@H]2CCCN(C(=O)c3csc4c3CCCC4)C2)n1C 426620049 NGWCHHDPXYDDPT-AWEZNQCLSA-N 387.553 2.837 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)N(Cc2ccccc2)C[C@H]2CCCO2)c1 95519490 WUSJHRQZTPGFMI-QGZVFWFLSA-N 389.477 2.547 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccon3)CC2)CN1Cc1cc(F)cc(F)c1 91526887 IMEZEGBAWDYAMQ-UHFFFAOYSA-N 375.375 2.608 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1cc(C(C)(C)C)n[nH]1)CC2 95520834 JDHPNPCPHATBAB-UHFFFAOYSA-N 384.528 2.716 0 50 GFAA COCC(=O)N1CCC(Oc2ccc(C(=O)N3Cc4ccccc4C3)cc2)CC1 95528830 DPDLWJLDYXDRRG-UHFFFAOYSA-N 394.471 2.859 0 50 GFAA O[C@H](COc1ccc(CN2CC(N3CCCCC3)C2)cc1)CN1CCCCC1 95497110 WTSXKEPVOCXBGX-QFIPXVFZSA-N 387.568 2.582 0 50 GFAA CC(C)c1c(C(=O)Nc2cncc(-c3nncn3C)c2)cnn1-c1ccccn1 162216100 HUTNUNZUVCAFFB-UHFFFAOYSA-N 388.435 2.834 0 50 GFAA CC(C)N1CCN(Cc2cccc(OC[C@H](O)CN3CCCCCC3)c2)CC1 95520563 FZGRMCXUOJLEAI-JOCHJYFZSA-N 389.584 2.828 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CCC(=O)N(CCCN(C)C)C3)CC2)c1 95390399 AZUXNQIDPLNQMM-UHFFFAOYSA-N 385.552 2.720 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95372501 UIUSEZQSCLDWRZ-MTNREXPMSA-N 391.471 2.821 0 50 GFAA COCCOc1ccccc1NC(=O)NC1CCN(Cc2cccnc2)CC1 299782362 PPORWODVTYAIJG-UHFFFAOYSA-N 384.480 2.893 0 50 GFAA CC(C)CCOc1ccccc1CCNC(=O)N1C[C@@H]2CCC[C@H](C1)C(=O)N2 584888762 YIWGJPKYCJTDRC-MOPGFXCFSA-N 387.524 2.964 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CCN(c2ncnc(C)c2C)CC1 952974873 LBKLCUDLIKLJQM-UHFFFAOYSA-N 376.464 2.754 0 50 GFAA COCCn1cncc1CN1CCC[C@@H](CNC(=O)c2cc3ccccc3[nH]2)C1 952868866 BHWDHYZCLZJQNY-KRWDZBQOSA-N 395.507 2.653 0 50 GFAA Cc1cc(-c2cn3cc(C(=O)N[C@H]4C[C@H]5CC[C@@H]4C5)nc3c(=O)n2C)c(C)o1 1565507160 BWPHIGFFQZQVFZ-LZWOXQAQSA-N 380.448 2.828 0 50 GFAA CCc1nnc([C@H]2CN(S(=O)(=O)/C=C/c3ccccc3Cl)CCO2)o1 275387696 ZGHAFCYDUWBAEV-DNGMOHDESA-N 383.857 2.659 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1cc3ccccc3c(OC)n1)C[C@H]2O 169966996 FXQKZFISQVHAGK-QGZVFWFLSA-N 394.427 2.950 0 50 GFAA C[C@](CNC(=O)c1cccc(CN2CCCC2=O)c1)(C(=O)O)c1ccccc1 193079074 UOTPHACQQPSKLF-JOCHJYFZSA-N 380.444 2.581 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCCN(C(=O)c2ccoc2)CC1 1506396238 PXESOVRZUYAQHQ-QGZVFWFLSA-N 392.839 2.915 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N3CC(N4CCCCC4)C3)c(C)s2)n[nH]1 1506398241 ASVCKLJUSITFTF-UHFFFAOYSA-N 380.539 2.614 0 50 GFAA CN(C)CC(=O)Nc1ccc(C(=O)N2CCOc3ccc(Cl)cc3C2)cc1 1506409415 PZFQDEJGFWDPPM-UHFFFAOYSA-N 387.867 2.875 0 50 GFAA CCN(CC)S(=O)(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704302113 CTBPOAMXYKECNO-UHFFFAOYSA-N 377.510 2.618 0 50 GFAA CCCC(=O)c1cn(CC(=O)N2C[C@H]3CCCN3C(=O)[C@@H]2C)c2ccccc12 1772702849 JDHAESULEVQKKU-JKSUJKDBSA-N 381.476 2.846 0 50 GFAA Cc1c([C@@H](C)NC(=O)c2ccccc2N2CCOCC2)cnn1-c1ccccn1 11818438 IBDBGQAKMHGOIV-MRXNPFEDSA-N 391.475 2.903 0 50 GFAA CN(C)CC(=O)N(C)C[C@@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1 11958735 XUROOCWVTHWYTL-KRWDZBQOSA-N 385.474 2.980 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2ccccc2)c1 12138754 NMTQQFCKGVSXJE-QGZVFWFLSA-N 383.473 2.722 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@H]2CCCN(C3CCN(C(C)C)CC3)C2)n1 12433074 SFOVAHJREVXFEQ-FQEVSTJZSA-N 389.588 2.591 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CCN(Cc1c(C)nc3sccn13)C2 14534826 XAFXAHLDWGHLHL-UHFFFAOYSA-N 398.536 2.715 0 50 GFAA O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CCc2ccccc2C1 15338922 BVTSDRUXFIRAAK-UHFFFAOYSA-N 378.881 2.593 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4cccc(F)c4)nnc23)n1 169776051 VNYXKWZOGUWLEG-UHFFFAOYSA-N 380.383 2.801 0 50 GFAA CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O 4535717 BSRAGXJNZJMFMY-XIRDDKMYSA-N 378.469 2.943 0 50 GFAA in-vitro Cc1noc(NS(=O)(=O)c2ccc(N3C(=O)c4ccccc4C3=O)cc2)c1C 1114347 KUVITUNAMCSJJV-UHFFFAOYSA-N 397.412 2.893 0 50 GFAA COc1ccc(C)cc1N(CC(=O)Nc1cccc(C(C)=O)c1)S(C)(=O)=O 1115982 KAZNEKLOPAPHDA-UHFFFAOYSA-N 390.461 2.611 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)Nc1nnc(CCc2ccccc2)s1 2734597 FGJBGHUKKZEHOZ-UHFFFAOYSA-N 392.440 2.558 0 50 GFAA CCCS(=O)(=O)N1CCN(C(=O)C(c2ccccc2)c2ccccc2)CC1 900092 VLCBDRQFWXTUGT-UHFFFAOYSA-N 386.517 2.703 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCc4ccccc4C3)CC2)cc1 1462357 ATBNVRXTIAYPSY-UHFFFAOYSA-N 398.528 2.981 0 50 GFAA Cc1ccn2c(C(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)c(C)nc2c1 1857722933 QDWGONUVOZIEGJ-HSALFYBXSA-N 390.487 2.895 0 50 GFAA CCOc1ccc(CN2CCNC(=O)[C@H]2CC(=O)NCCC2=CCCCC2)cc1 13596303 XLHQNGKDVNIBND-OAQYLSRUSA-N 399.535 2.783 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CNC2CCOCC2)cc1 20785565 WOXNEAPNLCYWLM-JOCHJYFZSA-N 384.520 2.827 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1ccc(C)cc1C(=O)C(F)(F)F)[C@H]1CCOC1 864096435 GAGPQKDVMQPVCN-FZMZJTMJSA-N 395.399 2.533 0 50 GFAA COc1cc2c(cc1F)CC[C@H]2NC(=O)[C@@H](c1ccccc1)n1nnnc1C 1875294450 SHTGLQUSIQOYJC-IEBWSBKVSA-N 381.411 2.522 0 50 GFAA COc1cccc([C@H](CN2C(=O)N3CC(F)(F)C[C@]3(C)C2=O)N2CCCC2)c1 1875291239 SACOLVNKRXRPGO-QFBILLFUSA-N 393.434 2.894 0 50 GFAA CCS(=O)(=O)C1CN(c2nc(-c3cccnc3)nc3sc(C)c(C)c23)C1 1875265632 WWSVDIYULZAMMH-UHFFFAOYSA-N 388.518 2.993 0 50 GFAA Cc1cnoc1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1cccc(F)c1 1875310406 OXDKABOWVCEPBC-QZTJIDSGSA-N 379.391 2.948 0 50 GFAA C[C@H]1CN(C(=O)c2cccc3nc[nH]c23)CC[C@H]1NC(=O)c1ncc(F)cc1F 1875338977 RWJYOVLIONYAMR-XHDPSFHLSA-N 399.401 2.517 0 50 GFAA Cn1nc2c(c1CN[C@@H]1C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]1O)CCC2 1875398654 AEDUSJLKVZZBEH-SAWYMBPVSA-N 391.519 2.702 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2c(C)cccc12)C(=O)N[C@H]1CN(C)C2(CCCC2)C1 1875309811 OTMKBAZWJOBRRA-QUCCMNQESA-N 396.535 2.657 0 50 GFAA CCc1ccc(C2CCN(C(=O)CCc3cccc4c3B(O)OC4)CC2)cc1 1776002798 DSOOJUPRYLMGJJ-UHFFFAOYSA-N 377.293 2.806 0 50 GFAA Cc1nc2c(C(=O)N3CCC[C@@H](c4nc(CC(C)C)no4)C3)ccnc2n1C 2100482454 AIFCGRQIRHVFTE-CQSZACIVSA-N 382.468 2.878 0 50 GFAA COCCCN1C(=O)[C@]2(CCN(C(=O)c3cncc(Cl)c3)C2)c2ccccc21 2100483957 UYTQETAXVWZFSC-NRFANRHFSA-N 399.878 2.902 0 50 GFAA Cc1nc(CN2CCC[C@@]3(CCCN(Cc4nccn4C)[C@H]3C)C2=O)cs1 2100545486 RXTSTMARJVEIMM-MGPUTAFESA-N 387.553 2.978 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c(CC(=O)N3CC[C@H](N)c4ccccc43)c2C)n1 2325769079 GDIGXOPXXAZOBJ-IBGZPJMESA-N 390.491 2.875 0 50 GFAA Cc1ccc(O[C@H](C)C(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c(C)c1 2325772366 GUVRZMKLGLOKID-LSDHHAIUSA-N 376.478 2.596 0 50 GFAA CCc1c(C(=O)N(C)CC(C)(C)CNC(=O)[C@@H]2CCC[C@@H]3C[C@H]32)nnn1CC 2325794792 RNSIEKNPYGUZNW-BZUAXINKSA-N 389.544 2.511 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1[C@@H]2c2[nH]c3ccccc3c2C[C@@H]1C(=O)O 754221 NNRWDPOHSYYGEI-KDOFPFPSSA-N 378.384 2.740 0 50 GFAA biogenic,in-vitro CC(C)Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)cc1 1141489 FRJLHBHWLVCZBM-UHFFFAOYSA-N 376.478 2.625 0 50 GFAA Cn1cnc2nc(N3CCC4(CC3)C[C@H](O)C[C@H](c3ccccc3)O4)ncc21 2356152675 VKNFNWYNUNVKJK-SJLPKXTDSA-N 379.464 2.615 0 50 GFAA COCc1cc(CN2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)ccc1OC 2356159655 LRSCDMFKCARMCC-FYYLOGMGSA-N 399.487 2.722 0 50 GFAA COc1ccc(CC(=O)NCCCCNC(=O)Cc2ccc(OC)cc2)cc1 4712987 VDKSBHHUQDTLRK-UHFFFAOYSA-N 384.476 2.502 0 50 GFAA Cc1ccccc1-n1c(-c2ccc(F)cc2)cn2c3c(=O)[nH]c(=O)n(C)c3nc12 10233754 HUZUGIXEPKLDJX-UHFFFAOYSA-N 389.390 2.780 0 50 GFAA COc1ccc(F)c(-c2nc(CN3CCN(c4ncccn4)CC3)c(C)o2)c1 55053814 WVOWXTPMWCANFF-UHFFFAOYSA-N 383.427 2.910 0 50 GFAA Cn1c(CCNC(=O)C2=NN(c3ccccc3)C(=O)CC2)nc2ccc(F)cc21 109735076 MKSSDDUKGIQBMK-UHFFFAOYSA-N 393.422 2.554 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)c1OC 20255677 HMPUARZYOLUQQY-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1ccccc1I)[C@H]1C=C[C@H]2C12CC2 101362614 KXTANTNNZLNZLA-DMTCVQMQSA-N 391.208 2.993 0 50 GFAA CSCCCN1CCC(N2CCC(C(=O)NCc3cccnc3)CC2)CC1 20454577 DLLMZVTUVYRSGA-UHFFFAOYSA-N 390.597 2.627 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)OC[C@H]2Sc3ccccc3NC2=O)cc1 4107906 RBRROENIHDLYLJ-OAHLLOKOSA-N 392.458 2.523 0 50 GFAA COCCN1CCC(CN2CCC3(CC2)CCN(C(=O)C(C)C)CC3)CC1 72145081 XRKJHVWKGMPJKF-UHFFFAOYSA-N 379.589 2.705 0 50 GFAA CC1(C)Cc2cccc(OCC(=O)N[C@@H]3CCN(c4ncccc4F)C3)c2O1 153390031 VRCKRQPRIWBTCU-OAHLLOKOSA-N 385.439 2.708 0 50 GFAA COc1ccc(F)c(CN2CCC3(CC2)CN(CCCN(C)C)C(=O)O3)c1 72470434 CADUMSABKSEJDE-UHFFFAOYSA-N 379.476 2.573 0 50 GFAA COc1cccc(N2CCC[C@H](NC(=O)c3ccccc3CN(C)C)C2=O)c1 365964114 DZEGSZFFXQWZLP-FQEVSTJZSA-N 381.476 2.682 0 50 GFAA C[C@@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC3(CCC3)S(=O)(=O)CC2)C1=O 334050562 ROIUMRRMSLCKSL-MAUKXSAKSA-N 394.512 2.531 0 50 GFAA Cn1cc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CCC2)c(O)nc1=O 375327872 RNRHEJJOJACESP-AWEZNQCLSA-N 381.354 2.776 0 50 GFAA Cc1cccc(C(=O)Nc2ccccc2C(=O)N[C@H]2CCc3nc(C)nn3C2)c1 171457700 UICHFIJXKNRNTB-KRWDZBQOSA-N 389.459 2.892 0 50 GFAA O=C(Cc1c(F)cccc1Cl)N[C@@H]1CCOC[C@H]1OCc1ccccn1 222421314 ZFKQWOBDAVWEDN-QZTJIDSGSA-N 378.831 2.907 0 50 GFAA Cc1nccc(C2CCN(C(=O)NCc3noc(-c4ccccc4)n3)CC2)n1 426656866 DYQLCDLESJTGGV-UHFFFAOYSA-N 378.436 2.924 0 50 GFAA CC[C@H](C)N1C(=O)[C@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C(=O)NC1=S 229920633 FJMLSUBLPZDWFA-LLJZQGTPSA-N 391.924 2.893 0 50 GFAA O=C(COc1ccccc1)N1CCN(C(=O)NC2(c3ccccc3)CC2)CC1 426527898 NWFQFXMBSQCFRE-UHFFFAOYSA-N 379.460 2.609 0 50 GFAA O=C([C@H]1COCCN1CC(F)F)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 497775472 HCIYBVKHWLZUNN-GOSISDBHSA-N 395.425 2.979 0 50 GFAA CNc1nc(C)cc(N2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)n1 82135197 ZSDSDLPYVLRJQT-OAQYLSRUSA-N 380.496 2.631 0 50 GFAA Cc1ccc(C(=O)N2CCn3cccc3[C@H]2c2ccccn2)cc1OCCN 426490744 RMIDBZJHGLGZSW-OAQYLSRUSA-N 376.460 2.774 0 50 GFAA COC1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)CC1 95616578 HYNBNUYQTQIHJK-UHFFFAOYSA-N 395.434 2.904 0 50 GFAA in-vitro COCCCN1CC2(CCC1=O)CCN(C(=O)C1(c3ccccc3)CC1)CC2 91536930 QWJPJSXYNDCKBC-UHFFFAOYSA-N 384.520 2.986 0 50 GFAA Cc1nnnn1CCC(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1 91562944 VCYNGQQZVQIQLE-UHFFFAOYSA-N 375.476 2.980 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95497003 UTHAGZKEPZELOO-GOSISDBHSA-N 382.489 2.895 0 50 GFAA COc1ccccc1N1CC[C@@H](N2CCC(C(=O)N3CCC(C)CC3)CC2)C1=O 177088598 OPLKWMOHDFCARO-HXUWFJFHSA-N 399.535 2.771 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3cc(C(C)C)no3)CC2)CC1 95512469 ITTYMTLQFZJWRV-UHFFFAOYSA-N 376.545 2.954 0 50 GFAA O=C(CN1CCOCC1)NCC1CCN(Cc2cc3ccccc3s2)CC1 827836834 KALRFQZAXLSORA-UHFFFAOYSA-N 387.549 2.562 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)Cc2cccs2)C1)c1ccc2nc[nH]c2c1 952965000 CIVSJRVQPOXSEQ-AWEZNQCLSA-N 382.489 2.836 0 50 GFAA O=C(CCc1ccc(F)cc1F)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 71589424 JNNHZUSKYUJPHS-UHFFFAOYSA-N 396.397 2.628 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1cnc(O)c2ccccc12 1565516268 CBQXZSHWQCZYJO-ZBFHGGJFSA-N 379.460 2.804 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 268950734 SQBGNDLRKANEHL-PJODQICGSA-N 391.855 2.728 0 50 GFAA Cc1c(-c2cc(CN3CC[C@@H](NC(=O)Nc4ccc(F)cc4)C3)on2)cnn1C 184647573 AHXRTMMYWIBGOH-MRXNPFEDSA-N 398.442 2.919 0 50 GFAA C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1C(=O)[C@H]2COCCN2C1=O 271999460 ACOGILRBPSAINY-RDTXWAMCSA-N 379.416 2.663 0 50 GFAA CC[C@@H](NS(=O)(=O)c1cc(-c2cc(C)[nH]n2)sc1C)c1ccnn1C 1506427248 VQDSBSJZWZNSBM-GFCCVEGCSA-N 379.511 2.918 0 50 GFAA COCCn1cnnc1CN(C)C1CCN(c2ccc(C)c(Cl)c2)CC1 1506406753 GNJNTEHTFSHXQE-UHFFFAOYSA-N 377.920 2.987 0 50 GFAA C[C@H]1Cc2ccccc2N1C(=O)CN1CCC2(CC1)Nc1ccccc1NC2=O 1506418099 PBWKTSRTOXASNQ-INIZCTEOSA-N 390.487 2.863 0 50 GFAA Cc1nc2ccccc2nc1CN1CC[C@H]2[C@@H](C1)CN2CCCn1cccn1 1775983266 UZJBTBVENVLJLD-AVRDEDQJSA-N 376.508 2.731 0 50 GFAA COCCC(=O)N1CCC(CCC(=O)Nc2ccc(OC)cc2OC)CC1 12112021 NPCWHAOPCAJVLL-UHFFFAOYSA-N 378.469 2.698 0 50 GFAA CCc1nnc(NC(=O)[C@@H]2CC(=O)N(CCc3c[nH]c4ccc(C)cc34)C2)s1 12863129 CHBDTYKULFETDZ-CQSZACIVSA-N 397.504 2.920 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCc1ccc3c(c1)OCO3)C2 14746004 DNYKJMPAEQOHKS-INIZCTEOSA-N 396.491 2.515 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCCc1ccc(OC)cc1)C2 14752815 WILRWBHHKOLEJZ-GOSISDBHSA-N 396.535 2.837 0 50 GFAA CCNc1nc(NC(C)C)nc(Oc2ccc(=O)n(Cc3ccccc3)n2)n1 16651709 WWJPNIBXBHSUSL-UHFFFAOYSA-N 381.440 2.521 0 50 GFAA Cc1ccccc1[C@H]1CC(=O)c2c(C)nc(N3CCC(C(N)=O)CC3)nc2C1 19957390 KTFJUNJSALZAGN-MRXNPFEDSA-N 378.476 2.708 0 50 GFAA Cc1nc(N2CCN(C(=O)COc3ccccc3)CC2)cc(C(F)(F)F)n1 169772310 CBLUZTQMCWQHIE-UHFFFAOYSA-N 380.370 2.531 0 50 GFAA Cn1ccc2ccc(NC(=O)C[C@H]3NC(=O)N(CCc4ccccc4)C3=O)cc21 206249024 IXYAVSUFNBJOPW-GOSISDBHSA-N 390.443 2.670 0 50 GFAA CC(C)Cc1nc(-c2ccc3sc(=N)[nH]c3c2)n([C@@H]2CCS(=O)(=O)C2)n1 1857670979 JQNJZRUOQZMVLY-GFCCVEGCSA-N 391.522 2.525 0 50 GFAA CS(=O)(=O)N1CCCCN2CCCC[C@H]2CCc2cccc(c2)OCC1 1857688837 JJGYGNBRBIFLGN-IBGZPJMESA-N 380.554 2.908 0 50 GFAA CC(=O)N1CCC2(CC1)OCCc1cc(C(=O)N[C@H](C)C(F)(F)F)sc12 1857694322 KXYJKRRSYFXQRV-SNVBAGLBSA-N 390.427 2.839 0 50 GFAA CSCC(=O)N1CCC2(CC1)OCCc1cc(C(=O)NCC3CC3)sc12 1857705377 FFUVDNPVQLTUJR-UHFFFAOYSA-N 394.562 2.641 0 50 GFAA COC(=O)c1cc(N2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)ncn1 1857710830 RLRPFYGRRRPIOE-FUHWJXTLSA-N 383.448 2.515 0 50 GFAA C[C@H]1CN2C[C@@H](NC(=O)c3ccccc3OCCc3ccccc3)C[C@H]2CO1 1857715767 HDSZNVUDMVBUTL-IHPCNDPISA-N 380.488 2.900 0 50 GFAA COc1ccc(CN2CCC[C@]3(CCc4c(O)nc(N(C)C)nc43)C2)c(F)c1 1857730506 VCMKGLGVDWGVOU-NRFANRHFSA-N 386.471 2.876 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857739398 RHLCZRVOEAJUIF-UNMCSNQZSA-N 394.519 2.967 0 50 GFAA COc1ccc(CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@@H](O)C2)c(OC)c1C 1875246939 UXCOTLYVCGYQHT-NZQKXSOJSA-N 399.487 2.893 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@H](NC(=O)c2ccc3c(c2)NC(=O)CO3)C1 117190077 OLQNSYXISZTPOU-INIZCTEOSA-N 383.423 2.864 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)c(C)c1 119643128 HEDYWEKOJULUBN-OAHLLOKOSA-N 380.416 2.665 0 50 GFAA CC(C)(C)c1ccc(C(=O)NCc2ccc(S(=O)(=O)CCO)cc2)cc1 239882026 CZXIVMILUVJGEB-UHFFFAOYSA-N 375.490 2.680 0 50 GFAA O=S(=O)(NCc1ncc(-c2ccc(F)cc2)[nH]1)c1cccc2nsnc12 1875258948 VPLGSEIMPWIGMI-UHFFFAOYSA-N 389.437 2.699 0 50 GFAA COc1ccc(CN2C(=O)[C@@]34CC[C@]3(CN(Cc3ccccc3)C4)C2=O)cc1 1875287670 UFISKFQKTYXRFN-GOTSBHOMSA-N 376.456 2.846 0 50 GFAA Cn1cc(CC(=O)N[C@H]2CCC[C@H]2CNCc2ccc(Cl)cc2F)cn1 1875374698 XUROJXXEMXHWMF-YJBOKZPZSA-N 378.879 2.830 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1Cc1ccc(-c2ccccn2)nc1 1875398803 FOVKVBLNAYYRMG-QFBILLFUSA-N 376.464 2.951 0 50 GFAA N[C@@H](C(=O)N1CCC[C@H](NCC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 1875315033 FSSPCQJURMDKGQ-QWHCGFSZSA-N 383.336 2.848 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3ccccc3OCC3CC3)CC1)O2 1875394797 WZRLQKHRULGAKJ-QGZVFWFLSA-N 397.475 2.700 0 50 GFAA COc1ccc(S(=O)(=O)c2nc(-c3ccco3)oc2N2CCOCC2)cc1 4785366 MIXZYGPGUWCZOW-UHFFFAOYSA-N 390.417 2.613 0 50 GFAA O=C(c1ccc(-c2nc(Cn3cnc4ccccc43)no2)cc1)N1CCOCC1 904739557 VGKHGNVSOXPUSZ-UHFFFAOYSA-N 389.415 2.607 0 50 GFAA CN(C)c1cccc2c(S(=O)(=O)N[C@@H](Cc3ccccc3)C(=O)O)cccc12 625679 GPIOGTIFRDHWSB-SFHVURJKSA-N 398.484 2.880 0 50 GFAA in-vitro Cc1ccccc1-n1c(SCC(=O)N2CCOCC2)nc2ccccc2c1=O 1060221 JJWHVTMRWACKPV-UHFFFAOYSA-N 395.484 2.645 0 50 GFAA CCn1ncc(Cl)c1CN(C)C(=O)CCn1cc(Br)c(C)n1 2802365 SMPMCFJJQMFFGF-UHFFFAOYSA-N 388.697 2.873 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCSC)cc(Cl)c1O 4142354 CWAHXMHHBXQGKA-ZDUSSCGKSA-N 386.857 2.588 0 50 GFAA COCCNC(=O)c1cc2nc(-c3ccc(F)cc3)cc(C(F)(F)F)n2n1 4907231 CRWRZAWYMJBSHT-UHFFFAOYSA-N 382.317 2.930 0 50 GFAA CCC[C@H]1CCc2c(sc(NC(=O)C3CCN(C(C)=O)CC3)c2C(N)=O)C1 6725814 FXNYZYYGJQZLKQ-ZDUSSCGKSA-N 391.537 2.949 0 50 GFAA CCCCS(=O)(=O)N1CCC(C(=O)NC23CC4CC(CC(C4)C2)C3)CC1 6743895 FIZOMPKKGXZIOP-UHFFFAOYSA-N 382.570 2.913 0 50 GFAA O=C(c1ccco1)N1CCC(C(=O)N2CCN(c3ccc(F)cc3)CC2)CC1 9748985 CDAPQDZZGMAASQ-UHFFFAOYSA-N 385.439 2.620 0 50 GFAA CN(Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1)CC1CCOCC1 12302276 VGLRBCMQOULMAP-UHFFFAOYSA-N 383.558 2.725 0 50 GFAA CN(CC1CCN(CCc2ccc(F)cc2)CC1)C(=O)CCCn1cncn1 12592821 PFFXBHSGUVSXMD-UHFFFAOYSA-N 387.503 2.611 0 50 GFAA Cc1occc1C(=O)NCc1cccnc1N1CCN(c2ccccn2)CC1 12710258 WUXJZBGUNUJZNN-UHFFFAOYSA-N 377.448 2.635 0 50 GFAA CN(C)C(=O)[C@H]1C[C@@H](C(=O)Nc2ccc(F)cc2)CN(Cc2ccccc2)C1 14747559 QZXXWPIKXDJTMA-MSOLQXFVSA-N 383.467 2.991 0 50 GFAA O=C(NCCSc1c[nH]nn1)c1ccc([C@@H]2CCCN2CC2CC2)s1 23379945 BRWKWZRLAUZQSD-ZDUSSCGKSA-N 377.539 2.935 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc(C)cc(C)c3)CC2)C1 67947986 JZBXAICFWYDLQN-OAQYLSRUSA-N 387.568 2.742 0 50 GFAA O=C(COc1ccc2nncn2n1)N1CCC[C@@H](CCc2ccc(F)cc2)C1 71551765 WHKNGPUEPLFXFD-INIZCTEOSA-N 383.427 2.514 0 50 GFAA CC[C@@H]1CN(C(=O)c2cnc(SC)nc2)CCC(=O)N1Cc1ccccc1 71748347 AXYOCCFNXSPALC-QGZVFWFLSA-N 384.505 2.852 0 50 GFAA O=C(Cn1c(Cc2ccccc2)nn(-c2ccc(Cl)cc2)c1=O)NC1CC1 77428386 YRMKYKWDLWPTMA-UHFFFAOYSA-N 382.851 2.557 0 50 GFAA C[C@]1(Cc2ccc3c(c2)OCO3)CCCN(C(=O)c2cn3cccnc3n2)C1 91434680 DPPCJBZYMVWGIT-OAQYLSRUSA-N 378.432 2.943 0 50 GFAA CN(Cc1ncc[nH]1)C(=O)[C@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 91619901 KYEDYBRNNICIME-AWEZNQCLSA-N 394.397 2.826 0 50 GFAA COc1ccc(F)cc1CN1CCC2(CCC(=O)N(CCCN(C)C)C2)CC1 95386767 MFKQQDXVCYMAHZ-UHFFFAOYSA-N 391.531 2.991 0 50 GFAA CN1C(=O)C[C@@H](C(=O)O)C12CCN(Cc1ccccc1OC1CCCC1)CC2 95387251 MQLXLFNMUMJNNW-SFHVURJKSA-N 386.492 2.906 0 50 GFAA Cc1nnc([C@@H](C)NC(=O)c2cccc(OC3CCN(C(=O)C4CC4)CC3)c2)o1 95498287 BOPKLIKPAAPAHP-CYBMUJFWSA-N 398.463 2.649 0 50 GFAA COc1cccc([C@@]2(C)CCN(CCCn3c(=O)[nH]c4ccccc4c3=O)C2)c1 96027708 DVOUFMDBMYOISV-QHCPKHFHSA-N 393.487 2.752 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)C2C(C)(C)C2(C)C)CC1 96133558 FTOASRRINWKYDZ-UHFFFAOYSA-N 384.528 2.931 0 50 GFAA CC(C)N1CC2(CCC1=O)CCN(C(=O)CC1=CSC3=NCCCN13)CC2 102487575 HJJFQWHYPGQGDT-UHFFFAOYSA-N 390.553 2.666 0 50 GFAA CCc1nc2n(n1)C[C@@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)CC2 114874862 XFTFJVOOLZGUJK-KRWDZBQOSA-N 382.489 2.801 0 50 GFAA O=C(Nc1cccc(Cl)c1-n1cncn1)[C@H]1CN(Cc2ccccc2)CCO1 124861126 OQXAMIZVGQOXTH-GOSISDBHSA-N 397.866 2.760 0 50 GFAA COc1cccc(N2C(=O)[C@H]3[C@@H](c4ccc(Cl)cc4)N4CCCN4[C@H]3C2=O)c1 136730707 UNMMMMJFQWOLTJ-IPMKNSEASA-N 397.862 2.884 0 50 GFAA CC(C)c1nnc2n1C[C@@H](NC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)CC2 176174067 HBGUZINXFYCLAR-ZWKOTPCHSA-N 385.487 2.636 0 50 GFAA Cc1nc(N2CCN(C(=O)c3csc(-c4cnccn4)n3)CC2)sc1C 178868164 ZERDTENHTJHVLT-UHFFFAOYSA-N 386.506 2.636 0 50 GFAA CCn1nccc1N1CCC[C@H](NC(=O)CCc2c[nH]c3c(C)cccc23)C1=O 189921155 UJCGJJJXSRAKGU-SFHVURJKSA-N 393.491 2.937 0 50 GFAA COC[C@H](C)C(=O)NCc1cc(Cl)c(I)cc1OC 225468140 LGVAFJDHIDJRGT-QMMMGPOBSA-N 397.640 2.852 0 50 GFAA COCCN1CC(=O)N(C[C@H]2CCCN(C)[C@@H]2c2cccc(Cl)c2)C1=O 225557807 GQRLDGJQMFOVPI-CRAIPNDOSA-N 379.888 2.634 0 50 GFAA O=C(O)[C@H]1[C@H](C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)[C@H]2CC[C@H]1O2 239305876 GDCZQRJGPIDFRI-KLHDSHLOSA-N 399.274 2.520 0 50 GFAA COCCN1CCCN(C(=O)Nc2ccc(C)c(-c3nc(C)co3)c2)CC1=O 241371298 MMHCPQAHRPLVGN-UHFFFAOYSA-N 386.452 2.671 0 50 GFAA Cc1c(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)nnn1CC1CCCC1 278997140 NFYBROQRBFAHKF-UHFFFAOYSA-N 388.903 2.788 0 50 GFAA Cc1cccc([C@H](NC(=O)CC2CN(C(=O)OC(C)(C)C)C2)C(=O)O)c1C 297199153 QWBPWPSCSAZABL-KRWDZBQOSA-N 376.453 2.802 0 50 GFAA Cc1cccc(NC(=O)CN2CC[C@@H](c3ccc4c(c3)OCO4)[C@H](O)C2)c1C 299778234 QDVJJGCYMFVSDQ-PKOBYXMFSA-N 382.460 2.821 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 376819360 NDTIEMIWGOWJPD-CEXWTWQISA-N 390.447 2.699 0 50 GFAA Cn1nnc2c(C(=O)N[C@@H](c3c(F)cc(F)cc3F)C(F)(F)F)ccnc21 888090917 IBTAMKRPWWYLPT-LBPRGKRZSA-N 389.259 2.814 0 50 GFAA CC(C)[C@@H]1N(c2ncnc3c2ncn3C2CC(CO)(CO)C2)CC12CCCCC2 888097311 HFYPDAFRWMBYLE-SFHVURJKSA-N 399.539 2.927 0 50 GFAA COCCN1CC[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2Cl)C1 952983645 WHZUDYQUIAZNNH-GFCCVEGCSA-N 381.325 2.582 0 50 GFAA C[C@@H]1CCN(CC(=O)N(C)[C@]2(c3ccccc3Cl)CCCCC2=O)C[C@@H]1O 956933823 NQTHJRWZXINVCK-YWMUFLPLSA-N 392.927 2.840 0 50 GFAA CN(C)CCc1nnc(NC(=O)c2cc(-n3cccn3)ccc2Cl)s1 1506399142 ASGMWYKOVCAAQZ-UHFFFAOYSA-N 376.873 2.734 0 50 GFAA CCOc1ccc(CCCC(=O)N2C[C@@H](O)[C@H](Cc3cnccn3)C2)cc1C 1704355007 OIRGVBPPMHMMPM-UYAOXDASSA-N 383.492 2.568 0 50 GFAA COc1ccc(-n2ncnc2[C@H]2CCCN(C(=O)c3cc(C)on3)CC2)cc1 1772804299 LMLCKIGWWJOBMU-HNNXBMFYSA-N 381.436 2.982 0 50 GFAA CN1CCCN(C(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CC1 1857667389 HTSKESALOLRIEX-AWEZNQCLSA-N 376.888 2.862 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(c3nc(-c4ccccc4)no3)C1)CC2 1857711849 OBRBOYOMNMMSMI-OAQYLSRUSA-N 392.463 2.783 0 50 GFAA Cc1ccoc1C(=O)NC[C@H]1[C@H]2CN(Cc3cccnc3C)C[C@]23CC[C@H]1O3 1857733296 DFBIEVYDLPKVAL-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCN(c2ccncc2)CC1 1857741151 FKZZDDZZQGZLOS-UHFFFAOYSA-N 380.477 2.520 0 50 GFAA Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)N[C@@H]1CCC(=O)NC1=O 1857797739 IGWVWTGZSYRIGK-OAHLLOKOSA-N 392.242 2.899 0 50 GFAA C[C@H](NC(=O)Cn1cc(-c2cccc(CO)n2)nn1)c1ccc2c(c1)CCCC2 1875270060 GLDQBDGIFRHVSQ-HNNXBMFYSA-N 391.475 2.589 0 50 GFAA C[C@@H](NC(=O)c1ccc2[nH]nc(C(=O)O)c2c1)c1cccc(-n2cccn2)c1 1875300143 MWYJQMVHPQBURC-GFCCVEGCSA-N 375.388 2.938 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)[C@@H]2C(=O)NC[C@@H]21 1875304145 BJWLSWNRJIDYTI-LYRGGWFBSA-N 388.468 2.861 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N3CCN(c4ccc(F)cc4)CC3)cn12 1940194949 FBLTWLDADWWXLQ-IBGZPJMESA-N 397.454 2.520 0 50 GFAA O=C(N[C@H]1C[C@H](C(=O)NCC2=CCCCC2)C[C@@H]1O)c1c[nH]c2ccccc12 2100545357 QRORUEXUUROSJV-YSSFQJQWSA-N 381.476 2.654 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)c2ccnc3c2nc(C)n3C)CC1 2100547390 IRBHDVGWMGRVBQ-UHFFFAOYSA-N 379.464 2.638 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)[C@@H](Cc3ccccc3)C3CC3)ccc2N1 2325766589 WQROQPVZELLFRN-INIZCTEOSA-N 384.457 2.620 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N[C@H](C(=O)O)[C@@H](O)c3ccncc3)ccc2c1 2325876190 MNGFXDHLPRCGOR-MRFFXTKBSA-N 394.427 2.650 0 50 GFAA COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1ccc(OC)c(OC)c1 603452 MFZKLNJTMNKTLC-UHFFFAOYSA-N 375.421 2.627 0 50 GFAA CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2cccc(C(=O)O)c2)c1 752166 KXMLCHRGGMWPKL-UHFFFAOYSA-N 376.434 2.668 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)c1C 2356135303 XXZNWXHVDAGTTF-JXHRLWIKSA-N 395.503 2.849 0 50 GFAA CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3ccc4c(c3)[nH]c(=O)n4C3CCCC3)[C@H]2C1 245674777 FSKNPEBFMBFIMO-UXPWSPDFSA-N 399.491 2.853 0 50 GFAA O=C(NCc1nc(-c2ccccc2)cs1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 52820943 OUUUWNPVZJZHGH-MRXNPFEDSA-N 392.484 2.870 0 50 GFAA c1ccc([C@H]2CCN(CCn3ccnc3-c3cc4n(n3)CCCNC4)C2)cc1 72480898 IOCYSMAINRBVDY-IBGZPJMESA-N 376.508 2.729 0 50 GFAA CCO[C@@H](C(=O)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1)c1ccccc1 142495196 LJRYRZRUMGWLSQ-HXUWFJFHSA-N 392.459 2.625 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(C)c(C)c3)CC2)C1 67434238 SLGGNQHMQAUNDY-OAQYLSRUSA-N 387.568 2.742 0 50 GFAA COC(=O)[C@@H](NC(=O)c1nc(N2CCCC2)nc2c1CCCC2)c1ccccc1 12091720 UVICQINKYCOOJD-SFHVURJKSA-N 394.475 2.600 0 50 GFAA CO[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc3ccccc3c2O)C1 363092952 RBGUDKRZGXJLJA-QFBILLFUSA-N 382.460 2.787 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)n[nH]1 155859523 LKURDPHMCWAZIQ-TYNSBMGRSA-N 398.551 2.973 0 50 GFAA COc1ccccc1C[C@H](CNC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)O 237269419 PSEKEIVKYCGRRH-UXHICEINSA-N 396.487 2.719 0 50 GFAA CNC(=O)c1cccnc1N[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 72439496 GQVPJCWRBKGRNR-CYBMUJFWSA-N 379.386 2.936 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)NCc3ccc(Cl)cc3)ccc2C1 77525280 IDSDCMICMXRFRP-UHFFFAOYSA-N 378.881 2.723 0 50 GFAA CCOc1nc2ccccc2nc1N1CCC[C@H](C(=O)NCc2cccnc2)C1 44803621 FAPBYLABAKNNAC-KRWDZBQOSA-N 391.475 2.956 0 50 GFAA COc1ccc([C@H](NC(=O)c2cc3cc(F)ccc3n2C)C2CC(O)C2)cn1 222860244 XKTVNJJYZUVBIC-SGHGTVFPSA-N 383.423 2.963 0 50 GFAA CC1(C)CN(C(=O)NCc2ccc(N3CCCCC3)nc2)C[C@]2(CCOC2)O1 280391930 WXQDMFQPMSCJMJ-NRFANRHFSA-N 388.512 2.551 0 50 GFAA CCCOc1ccc2c(c1)CCN(C(=O)[C@H]1CC13CCS(=O)(=O)CC3)C2 284339603 XMSVKNWEIPZTBP-GOSISDBHSA-N 377.506 2.575 0 50 GFAA CCn1cc(S(=O)(=O)N[C@H]2CCCc3nc(-c4ccccc4)ncc32)cn1 91382226 YBPVQYOYJBFOLA-SFHVURJKSA-N 383.477 2.716 0 50 GFAA O=C(NCCN1CCC[C@H](c2ccccc2)C1)N1CCN(c2ccncc2)CC1 426530377 GEURJJPLQHNEHY-NRFANRHFSA-N 393.535 2.793 0 50 GFAA O=C(COc1cccc(F)c1)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 95370087 FSVIYWHTQQEPLN-WMLDXEAASA-N 375.469 2.784 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1 95353873 RJSHAGVSLYLPJQ-FQEVSTJZSA-N 382.508 2.545 0 50 GFAA COCCN1CCC(CN(C[C@@H]2CCCO2)C(=O)c2cc(Cl)cn2C)CC1 96151761 HCOWMDZPHXOAFZ-SFHVURJKSA-N 397.947 2.658 0 50 GFAA COc1cc(CN2CCCOCC2)ccc1OC[C@@H](O)CN1CCCCCC1 95515156 TVIUTONYCYTJKX-FQEVSTJZSA-N 392.540 2.533 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)[C@@H]1CC(=O)Nc3ccc(OC)cc31)CC2 95358447 XMVHOIVTAXDSIB-LJQANCHMSA-N 380.444 2.757 0 50 GFAA Cc1ccc(N2CC[C@H](Nc3cccc(C(=O)N4CCOCC4)c3C)C2=O)cc1 177162645 PEZIOUBVMRTRAV-NRFANRHFSA-N 393.487 2.993 0 50 GFAA CCCN1CCC[C@H](NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C1 91737422 KSHFWMSQMAWTKW-AWEZNQCLSA-N 387.436 2.587 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1CCN(Cc2ncn(-c3ccccc3)n2)CC1 181543373 VIEXTIIDMCCKFR-UHFFFAOYSA-N 395.894 2.808 0 50 GFAA CCOc1ccc(NC(=O)c2ccc3c(c2)CN(CCOC)C(=O)CO3)cc1 263618701 VAJHZHDMHNEWEP-UHFFFAOYSA-N 384.432 2.705 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)NCc1ccccc1Cn1ccnc1)CO2 298307228 NYEHUAWEDJVNRC-IBGZPJMESA-N 377.444 2.808 0 50 GFAA CN(C)c1ncc(/C=C/C(=O)N2CCC[C@H]2c2nc3ccc(F)cc3[nH]2)cn1 826608026 GXXKMKDQXYDGSK-JZLODUJNSA-N 380.427 2.935 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cnn(-c3ccccc3)c2)C1)c1cncs1 828206422 RDNRTWPKAHXQGZ-MRXNPFEDSA-N 381.505 2.971 0 50 GFAA O=C(NCC1CCN(Cc2sccc2Cl)CC1)[C@@H]1CC(=O)N(C2CC2)C1 827693220 ACRWPGJKGNQGMA-CQSZACIVSA-N 395.956 2.741 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)N1CC(Oc2ccccc2)C1 584886412 LLANFAIYUFDPNG-UHFFFAOYSA-N 375.538 2.819 0 50 GFAA Cc1nc([C@H](C)N(C)C(=O)NCc2csc(N3CCOCC3)n2)c(C)s1 584888786 TZUFSLINQFSGGF-NSHDSACASA-N 395.554 2.956 0 50 GFAA CCOc1ccc([C@@H](CC)NS(=O)(=O)c2csc(C(=O)NC)c2)cc1 670438589 OCFOOYWIEZLZLL-OAHLLOKOSA-N 382.507 2.936 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)NCc3n[nH]c4c3CCCCC4)c2n1 670472567 KTPZHNAMQFKPIU-UHFFFAOYSA-N 392.385 2.979 0 50 GFAA COc1ccc(N2C[C@@H](NC(=O)CC3CC(C)(C)NC(C)(C)C3)CC2=O)cc1 952979042 QTAHHWCGDIDYRQ-INIZCTEOSA-N 387.524 2.864 0 50 GFAA O=C(c1csc(-c2ncccn2)n1)N1CCC[C@@H](OCc2ccccn2)C1 952971749 VMPSEXGFXRXQSL-OAHLLOKOSA-N 381.461 2.817 0 50 GFAA COCC(=O)Nc1ccc(OC)cc1NC(=O)[C@@H]1CCCN1Cc1ccccc1 952987580 OQSUTXITQRLWEA-FQEVSTJZSA-N 397.475 2.883 0 50 GFAA CCO[C@H]1[C@H](NC(=O)CC)c2ccccc2C12CCN(Cc1cnc[nH]1)CC2 64031586 PMJAJLGQTASFIO-RTWAWAEBSA-N 382.508 2.930 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cc(O)nc3ccc(Br)cc23)C1 165542135 NRRIGIBTSAIVLJ-VIFPVBQESA-N 379.210 2.640 0 50 GFAA Cc1ccc(CC(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2scnc2C)cn1 275552666 VNTVXDIREQAIPK-IRXDYDNUSA-N 376.501 2.768 0 50 GFAA NC(=O)c1ccc(NC(=O)CN2CCCC[C@H]2CCc2cccc(O)c2)cc1 1529112238 HDRBPRPOCSWBNZ-IBGZPJMESA-N 381.476 2.917 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2ccc(NC(=O)CN(C)C)cc2)C[C@H](C2CC2)O1 1529153403 AYFINVJCBPZEML-WOJBJXKFSA-N 387.524 2.997 0 50 GFAA CC(=O)c1cc(C(=O)N2CCCN(C(=O)Cc3ccsc3)CC2)cs1 1772706847 RPUKAEYGWVKQEJ-UHFFFAOYSA-N 376.503 2.929 0 50 GFAA CCCCn1nc(COc2ccccc2)nc1[C@@H]1CCCN(C(=O)CO)CC1 1772816634 XQENKCSCHMNVON-QGZVFWFLSA-N 386.496 2.746 0 50 GFAA COc1cc(CNCc2ccc(C)o2)ccc1OC[C@@H](O)CN(C)C(C)C 12203365 ZDISCHVDDPEXOT-SFHVURJKSA-N 376.497 2.966 0 50 GFAA O=C(NCc1nc2ccccc2s1)[C@H]1CCC(=O)N(Cc2ccccn2)C1 12447943 ZUEFYJXZHIVMDV-AWEZNQCLSA-N 380.473 2.746 0 50 GFAA c1ccc2c(c1)nc1n2[C@]2(N3CCOCC3)CCCC[C@H]2[C@H]1N1CCOCC1 12523763 NNKLHIKTXJPZQM-UCNVEGJOSA-N 382.508 2.598 0 50 GFAA Cc1cc(N2CCN(c3ccc(F)cc3)CC2)n2nc(-c3cccnc3)nc2n1 16489541 FFXDBHSJRLRCAV-UHFFFAOYSA-N 389.438 2.960 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@@H](NCc1ccncc1)C2 19227521 VDIGIBZNNTYHLN-QGZVFWFLSA-N 393.491 2.810 0 50 GFAA Cc1oc(-c2cc(F)ccc2F)nc1CN1CCN(Cc2nccn2C)CC1 19884400 FNRAJNQGFHJTCM-UHFFFAOYSA-N 387.434 2.980 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cc(OC)ccc3OC)n2)cc1 3055902 IGDPUOQNRMKWRB-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA COc1cc(C2=N/C(=C\c3ccc4c(c3)OCCO4)C(=O)O2)cc(OC)c1OC 4746805 NVESQCNDYJSMMH-ZSOIEALJSA-N 397.383 2.828 0 50 GFAA COc1cc(CN2CCN(c3ccccn3)CC2)cc(Br)c1O 4990251 QXTVKPNMDIYJNN-UHFFFAOYSA-N 378.270 2.881 0 50 GFAA CC[C@@]1(C(=O)NCc2nonc2C)C[C@@H]2CC[C@H]1N2C(=O)c1cc(C)oc1C 1857667101 SARKSWJXDVQBEL-JNAXZKDPSA-N 386.452 2.678 0 50 GFAA CCc1ccccc1C(=O)N1CCC[C@]2(C1)CN(c1cnccn1)CC[C@H]2O 1857682331 JBMROYPIPQWAFK-DENIHFKCSA-N 380.492 2.533 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)Cc3ccc(O)c(Cl)c3)C1)CC2 1857703021 FJESCGNEIAFORD-FQEVSTJZSA-N 387.867 2.899 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCO[C@@H](CN2CCCCC2)[C@@H]1c1cnn(C)c1 1857721856 JCFFYISKKMIYJK-SFTDATJTSA-N 398.507 2.502 0 50 GFAA O=C(NCCCc1nc2ccccc2s1)[C@@H]1CC(=O)N(c2nccs2)C1 1857739865 WQAVUHYEEQCXGW-GFCCVEGCSA-N 386.502 2.855 0 50 GFAA Cc1nc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)nn1-c1ccc(Cl)cc1 237681282 NCGRRYYPTKVBEQ-KRWDZBQOSA-N 396.834 2.881 0 50 GFAA CC(C)(CC(=O)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1)c1ccccc1 135867949 UOULPQOYIZODTC-LJQANCHMSA-N 386.517 2.965 0 50 GFAA COc1ccccc1[C@H](CNC(=O)N1CC[C@H](O)CC12CC2)N1CCCCC1 1875288997 OUKCFDAZOBIZKT-HKUYNNGSSA-N 387.524 2.921 0 50 GFAA CC12CC(C(=O)O)(C1)C1(CCN(C(=O)[C@@]3(c4ccccc4)CCCO3)CC1)O2 1875392894 YVOBJJDGPHVZCN-AOMIVXANSA-N 385.460 2.707 0 50 GFAA Cc1cc([C@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)oc1C 1875398074 ZXSQJGFDYCNSQL-DOTOQJQBSA-N 385.512 2.935 0 50 GFAA CC1(CS(C)(=O)=O)CN(c2ncncc2-c2ccc(Br)cc2)C1 1875404645 POIMMWAJRBPMKR-UHFFFAOYSA-N 396.310 2.777 0 50 GFAA Cn1ccnc1[C@H]1CCCN(C(=O)Nc2cccc([C@]3(C)COC(=O)N3)c2)C1 881105827 KAWMKAOTLUFNLR-XOBRGWDASA-N 383.452 2.787 0 50 GFAA COc1ccc(CN(C(=O)[C@H]2C[C@@H]2C(=O)O)c2ccc3c(c2)OCO3)c(OC)c1 1775965305 SQSIMGNPNDHDOI-HOTGVXAUSA-N 399.399 2.686 0 50 GFAA NCc1ccc2c(c1)CC[C@H]2NC(=O)c1nc(C(F)(F)F)n2ccncc12 2325795227 RDMMFTJCNNABQW-CYBMUJFWSA-N 375.354 2.624 0 50 GFAA C[C@H](NC(=O)[C@H]1Cc2ccc(Cl)cc2C(=O)O1)[C@H](O)c1c(F)cccc1F 2325860443 IPCZQTSLBGQUJS-UMPCLBKJSA-N 395.789 2.938 0 50 GFAA COC(=O)[C@@H](N)CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1 146329694 UCQDBJAVRDPJIH-NRFANRHFSA-N 388.467 2.985 0 50 GFAA O=C(NC1CCN(c2ccccn2)CC1)N1CCOC[C@H]1c1ccc(F)cc1 457782561 ICZKUKGWRTZILB-IBGZPJMESA-N 384.455 2.973 0 50 GFAA CCOc1ncccc1C(=O)N=c1cc(-c2cc(OC)c(OC)c(OC)c2)[nH][nH]1 2356134309 IYHXIOMHQDGGCF-UHFFFAOYSA-N 398.419 2.570 0 50 GFAA O=C(c1cccc(-c2cnc3c(N4CC[C@H](O)C4)nccn23)c1)N1CCCCC1 2356144670 IKWIJEFMHQGYQO-SFHVURJKSA-N 391.475 2.593 0 50 GFAA CCc1c(C(=O)COc2c(OC)cc(CCO)cc2OC)[nH]c(C)c1C(C)=O 225655175 QOGHMZDWBDAVOT-UHFFFAOYSA-N 389.448 2.902 0 50 GFAA C[C@H](N[C@@H]1CCC[C@H]2OCC[C@@H]12)C(=O)NC1CCN(Cc2ccccc2)CC1 245794545 XVMHIKIYAUYQJF-GUGJDKNPSA-N 385.552 2.703 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)CC1 23359133 ZGYMLCPHDOXHEO-IBGZPJMESA-N 381.511 2.706 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N(C)C3Cc4ccccc4C3)cnn2c1 67849878 IKQZRVZOANJGHO-UHFFFAOYSA-N 377.492 2.811 0 50 GFAA CNC(=O)C(C)(C)N(C)Cc1cccc(C(=O)Nc2cccc3cn[nH]c23)c1 67654222 MMYBDYNVLKPHFX-UHFFFAOYSA-N 379.464 2.772 0 50 GFAA O=c1[nH]c2ccc(S(=O)(=O)N3CCC(c4nc5ccccc5[nH]4)CC3)cc2o1 170551142 SRIPOLCHWNGSET-UHFFFAOYSA-N 398.444 2.566 0 50 GFAA CCOc1cc(CNC(=O)N[C@@H]2CCN(c3ncccc3F)C2)ccc1OC 120007565 HYQHWNZWEYOQLY-OAHLLOKOSA-N 388.443 2.706 0 50 GFAA CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NC[C@H]1CCCNC1 170676597 RGZDAGWJKJUUMP-PGRDOPGGSA-N 381.520 2.639 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1 363128467 QTHQYFHSRPYXFR-QRWLVFNGSA-N 382.508 2.779 0 50 GFAA O=C(C[C@H]1COCCN1C(=O)c1n[nH]c2ccccc12)NCCC1=CCCCC1 72456717 NEZMXYGRKIAEFQ-KRWDZBQOSA-N 396.491 2.801 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCc2cnn(C)c2)(Cc2ccccc2)c2ccccc21 71774865 OGTZRXGVSXEGBX-HSZRJFAPSA-N 388.471 2.584 0 50 GFAA O=C(N[C@@H]1CCOC2(CCCCC2)C1)N1CCCC[C@H]1CN1CCOCC1 157846268 NJKDMCGYPBOGEB-MOPGFXCFSA-N 379.545 2.765 0 50 GFAA C[C@@H](CC(C)(C)O)N1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 72473098 DIVXAGBWZHKDOK-KRWDZBQOSA-N 376.497 2.902 0 50 GFAA CCc1nc(CN2CCC[C@@H](NC(=O)[C@@H](C)c3c(F)cccc3F)C2)no1 378321304 XLHRQAJOFYPSNR-QWHCGFSZSA-N 378.423 2.795 0 50 GFAA Cc1ccc(CNC(=O)N2CCOc3cc(O)ccc3C2)c(O[C@@H]2CCOC2)c1 376874105 MWOJWKYYUXVSIM-LJQANCHMSA-N 398.459 2.973 0 50 GFAA CCc1csc([C@@H]2CCCN(C(=O)c3nnn(C4CCNCC4)c3C)C2)n1 237113948 JRZNTAYLNSXLJP-CQSZACIVSA-N 388.541 2.550 0 50 GFAA O=C(N[C@H]1CC(=O)N(CCc2ccccc2)C1)c1cc(-c2ccccc2)no1 72145006 VMVZHUCKXLZOBE-SFHVURJKSA-N 375.428 2.915 0 50 GFAA CC(C)Cc1cn(C[C@@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)nn1 48436170 YLZUZCFVDUOGDF-MRXNPFEDSA-N 378.480 2.972 0 50 GFAA COc1ccc(C(=O)N[C@@H]2COCC[C@@H]2Oc2cccc(F)c2)c(OC)c1 223111047 AGKIDYZEJFOQEH-MSOLQXFVSA-N 375.396 2.809 0 50 GFAA O=C(CSCC1CC1)N1CCC[C@]2(CCC(=O)N(Cc3ccncc3)C2)C1 82155560 PLFHRXCJQUJKHZ-NRFANRHFSA-N 387.549 2.956 0 50 GFAA Cc1nccn1CC[C@@H]1CCCCN1C(=O)NCCSc1nccn1C 426575076 VFSRUPNBAFWFKA-INIZCTEOSA-N 376.530 2.672 0 50 GFAA O=C([C@@H]1CCCN1C(=O)NCc1cnn(-c2ccccc2)c1)N1CCCCC1 426584685 KYDYJDPXWQSWIS-IBGZPJMESA-N 381.480 2.559 0 50 GFAA Cn1c(-c2cccc3nonc23)nc2cc(S(=O)(=O)N3CCCC3)ccc21 82109254 OITJJMBNXPZZDP-UHFFFAOYSA-N 383.433 2.561 0 50 GFAA Cc1cccc(-n2cc(CN3CCC[C@H](c4ccn(CC(=O)O)n4)C3)cn2)c1 426370182 VNARNXMOFVNJJH-SFHVURJKSA-N 379.464 2.841 0 50 GFAA CNC(=O)c1ccc(-c2ccc(C(=O)N[C@@H](C)Cn3nc(C)cc3C)cc2)o1 426486098 VWISPEFSURISQU-AWEZNQCLSA-N 380.448 2.938 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccccn2)C(=O)Nc2ccnn2C2CCCC2)N1 96136726 IHBDHICOQFRENL-INIZCTEOSA-N 382.468 2.706 0 50 GFAA Cn1cnnc1SCCNC(=O)c1ccc2nc(-c3ccccc3)cn2c1 95365878 CNMIOMJEBMINEZ-UHFFFAOYSA-N 378.461 2.652 0 50 GFAA COCCc1nc(CSc2nnc(C)s2)n(-c2ccc(OC)cc2)n1 96162626 VMWJUEMNQINEFF-UHFFFAOYSA-N 377.495 2.917 0 50 GFAA O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)[C@@H]1CCCN1C(=O)c1ccccc1 177432812 UQTGPTRQBDUFFV-AEFFLSMTSA-N 398.894 2.735 0 50 GFAA O=C(CN1CC[C@](CO)(c2ccccc2)C1)Nc1ccc(N2CCCCC2)nc1 291357428 YMICUKYGXBOREY-QHCPKHFHSA-N 394.519 2.646 0 50 GFAA C[C@H](NC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1)c1ncon1 294626699 QIKHZWAFWABGMX-JTQLQIEISA-N 375.816 2.958 0 50 GFAA Cc1ccc2[nH]c([C@H]3CCCN(S(=O)(=O)c4c(C)nn(C)c4C)C3)nc2c1 182496805 LOODGXVKSFKUPF-HNNXBMFYSA-N 387.509 2.790 0 50 GFAA CN(C)C[C@@](C)(O)c1ccc2c(c1)CN(Cc1nc3ccccc3[nH]1)CCO2 299765282 DUEKVDWXDBTRBX-JOCHJYFZSA-N 380.492 2.727 0 50 GFAA CCNC(=O)c1ccc(NC(=O)c2ccc(N3CCN(C)CC3)cc2)c(C)c1 823128422 NQOMQLLUTCYTJS-UHFFFAOYSA-N 380.492 2.749 0 50 GFAA CCCc1nc(C(=O)NC[C@@H]2CCCN(C(=O)c3oc(C)nc3C)C2)cs1 823023323 JSRZLZDLZOACQE-AWEZNQCLSA-N 390.509 2.983 0 50 GFAA CCOC(=O)c1cccc(-c2cccc(C(=O)N[C@H](C)c3ncnn3C)c2)n1 584895017 QWRQNJJLVGBJHC-CYBMUJFWSA-N 379.420 2.545 0 50 GFAA CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccoc2C2(O)CCOCC2)C1 1326482905 PZZBAVTYIIVDJD-SFHVURJKSA-N 384.476 2.624 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCC[C@@H]2CN)CC1 1342087106 KHAJGGRXABCUES-NQIIRXRSSA-N 396.535 2.583 0 50 GFAA CC(C)CN1CCN(S(=O)(=O)c2cccc3ccccc23)C[C@H]1CCO 952873702 NCEVKCVKEJPYAV-GOSISDBHSA-N 376.522 2.553 0 50 GFAA COc1ccc(NC(=O)N2CCOC[C@H]2C)c(I)c1 278259080 YZZNCQYYFRZOEV-SECBINFHSA-N 376.194 2.552 0 50 GFAA CC(=O)N1CCN(c2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1 759808646 ACMJMDYPEHAXCV-OAQYLSRUSA-N 387.911 2.832 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC([C@H](O)c3ccccn3)CC2)cc1Cl 1506400744 WQWZGJKHYISITF-SFHVURJKSA-N 396.896 2.878 0 50 GFAA Cn1nc(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)c2c1CCC(=O)C2 1506419578 SNOIYVLCKITBRB-CYBMUJFWSA-N 378.432 2.639 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)c2ccc(CCN)cc2)CC1 1704324722 DMMXDWJWYHWTJI-UHFFFAOYSA-N 380.488 2.901 0 50 GFAA COc1ccc2[nH]c3c(N4C[C@H]5C[C@H](C4)c4cccc(=O)n4C5)ncnc3c2c1 1772492169 LBXOVHSMBNPCRC-ZIAGYGMSSA-N 387.443 2.905 0 50 GFAA O=C(c1ccc[nH]1)N1C[C@@H]2CN(Cc3cc[nH]n3)C[C@]2(CCc2ccccc2)C1 1772804577 ATIHXWWXSYXZTD-WMZHIEFXSA-N 389.503 2.945 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(C(=O)C3CC3)CC2)O1)c1c(F)ccc(F)c1F 11881171 LDORPWRTQBUPBR-CYBMUJFWSA-N 396.409 2.784 0 50 GFAA Cc1nc[nH]c1CN1CC(=O)N(CC(C)C)C[C@@H](OCc2cccc(F)c2)C1 14531755 NZTKWXHZUPJANM-IBGZPJMESA-N 388.487 2.743 0 50 GFAA COc1cccc(CN2C[C@@H](C(=O)NCCCc3ccncc3)CCC2=O)c1 15069523 PBZAHVBYEITZIY-IBGZPJMESA-N 381.476 2.578 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCC[C@@H](OC)C2)n1CCc1ccccc1 15078655 NJRISOJYZYPJSF-LJQANCHMSA-N 391.537 2.530 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1)[C@@H]1CCCO1 1054574 MYGZRAACDCICHL-IBGZPJMESA-N 386.473 2.946 0 50 GFAA O=C1c2ccccc2S(=O)(=O)N1c1ccccc1I 1121398 ZTEKQRQFOJWRJJ-UHFFFAOYSA-N 385.182 2.640 0 50 GFAA CC(=O)c1cccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1 1163078 HJQJOJPMEDUFAG-UHFFFAOYSA-N 380.853 2.802 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N1CC[C@@]23OC[C@@H](C(C)C)N2C(=O)C[C@@H]13 1857738507 LBVXYLNTCTVEHG-VPWXQRGCSA-N 392.883 2.612 0 50 GFAA COc1ccccc1CC(=O)N1CC[C@@]23O[C@H](c4ccccc4)CN2C(=O)C[C@@H]13 1875239805 MGYUPEWHOJWLNY-MZKRTTBSSA-N 392.455 2.539 0 50 GFAA Cc1cc(C)c(Br)c(C(=O)N2C[C@H](O)C[C@@H]2c2nc(C)no2)c1 408172331 VLKPVBLZHJFEDT-DGCLKSJQSA-N 380.242 2.705 0 50 GFAA COc1cc2nc(N3CCN(C(C)=O)C4(CCCCC4)C3)nc(N)c2cc1OC 497557498 BXYGRYVMCJMIQB-UHFFFAOYSA-N 399.495 2.601 0 50 GFAA Cn1ccc(C(=O)N(Cc2cccnc2)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1 800555211 REWCYSWNLUGHAR-KRWDZBQOSA-N 399.495 2.715 0 50 GFAA CN1CCOc2ccc(C(=O)Nc3cccc4c3CCN(CC(C)(C)O)C4)cc21 807225201 CRTDISGPAOEDFD-UHFFFAOYSA-N 395.503 2.897 0 50 GFAA CCNC(=O)N1CCc2ccc(NS(=O)(=O)c3cccc(Cl)c3O)cc21 821178339 QZRQYFQLVULNNC-UHFFFAOYSA-N 395.868 2.938 0 50 GFAA COc1ccc(CNC(=O)N2CCN(c3nsc4ccccc34)CC2)nc1 1875278384 UYMCBLCUXWTVLQ-UHFFFAOYSA-N 383.477 2.732 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1Cc1ccc(-c2ccccn2)nc1 1875398804 FOVKVBLNAYYRMG-VQIMIIECSA-N 376.464 2.951 0 50 GFAA C[C@@H](C(=O)Nc1nc2n(c1C(=O)O)CCOC2)c1ccccc1C(F)(F)F 1875300622 KUEJPIBYTPSIKH-SECBINFHSA-N 383.326 2.873 0 50 GFAA O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@@H]3C2)C1 886091320 POZZXGOCULESEG-BPLDGKMQSA-N 394.878 2.828 0 50 GFAA COc1ccc2[nH]cc(CCN[C@@H]3CC(=O)N(c4ccccc4F)C3=O)c2c1 19932124 CXNNSPURFODXSU-GOSISDBHSA-N 381.407 2.780 0 50 GFAA O=C(NC[C@@H]1CCC[C@@H]1N1CCCS1(=O)=O)c1ccc(-c2ccccc2)nc1 2325768133 QHIUVXJTEIGMBI-PXNSSMCTSA-N 399.516 2.683 0 50 GFAA Cc1cnn(C2CCN(S(=O)(=O)c3cn(C)nc3-c3ccccc3)CC2)c1 2325775772 JILGMFCLJMRTQX-UHFFFAOYSA-N 385.493 2.618 0 50 GFAA CC(C)[C@H](NC(=O)c1nnc2c(F)cccc2c1O)C(=O)NC1CCCCC1 2325842340 VKJTWAOZMBXKLS-HNNXBMFYSA-N 388.443 2.678 0 50 GFAA C[C@H](NC(=O)C(=O)NCc1ccc(C(=O)O)cc1)c1cccc(C(F)(F)F)c1 2325870817 QSYZQWFFUARDCB-NSHDSACASA-N 394.349 2.897 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)CCCc2ccc(F)cc2)C1=O 2356134974 KWMPMLADNVUMIA-OAQYLSRUSA-N 376.472 2.778 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc(C)n1 2356169992 PQDCSHHTYFIJDV-IPJJNNNSSA-N 385.508 2.599 0 50 GFAA O=C(O[C@H](NC(=O)N1CCOCC1)C(Cl)(Cl)Cl)c1ccccc1 4831812 NAAMEVUCUQRNJA-LBPRGKRZSA-N 381.643 2.582 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@H]1O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 246184004 HMWNQOWDRXIDLH-NSISKUIASA-N 379.460 2.705 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@H](c4[nH]ncc4-c4ccccc4)C3)nnc2n1 67947769 SVJSBGTZCNIXEP-INIZCTEOSA-N 387.447 2.843 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 136507866 DQRKLJLCGIJAQU-UZLBHIALSA-N 390.487 2.984 0 50 GFAA C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N(C)C[C@H]1CCCN1c1cccnn1 118742950 HIXFTTBDRPNGFS-ZIAGYGMSSA-N 376.407 2.650 0 50 GFAA O=S1(=O)CC[C@@H](Cc2nnc(SCCCOCc3ccccc3)o2)C1 170594896 PGXMLYSGWRRYFX-HNNXBMFYSA-N 382.507 2.746 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(C)cc3F)CC2)C1 67820066 LEZGTEWDTQXOGE-IBGZPJMESA-N 391.531 2.573 0 50 GFAA CC(C)[C@@H]1CN(c2cc(NCCO)ncn2)CCCN1Cc1ccc(F)cc1 71763339 NOKVZHWKRZVZQS-IBGZPJMESA-N 387.503 2.757 0 50 GFAA C1CC[C@H](c2nnc(N3CCOC[C@H](C4CCC4)C3)n2C[C@H]2CCCO2)OC1 428192472 QYINATAYQHFNOK-GUDVDZBRSA-N 390.528 2.952 0 50 GFAA C[C@H](CN1CC2(CCN(C(=O)c3ccnn3C)CC2)OC1=O)c1ccccc1 77487977 JDDWESRFKXOMCF-MRXNPFEDSA-N 382.464 2.651 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(c2cc(C3CC(N)C3)ncn2)CC1 219871369 QSYKDNBTFUKYFF-UHFFFAOYSA-N 379.508 2.556 0 50 GFAA COc1ccc2c(CC(=O)Nc3ccc(OC)c(-n4nnnc4C)c3)coc2c1 363197426 NGZLYMXGICSDHS-UHFFFAOYSA-N 393.403 2.915 0 50 GFAA OCC[C@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1Cc1ccccc1F 76922194 FISKBNHOSSBUQU-IBGZPJMESA-N 386.467 2.666 0 50 GFAA NC(=O)[C@@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)c1ccc(F)cc1 363820244 MLLFWLGIDKDGDF-IBGZPJMESA-N 390.503 2.696 0 50 GFAA CCc1ccc2nc(C)cc(C(=O)N3CCN(Cc4nccn4C)CC3)c2c1 77406004 KCXBJCUIWXDHFS-UHFFFAOYSA-N 377.492 2.797 0 50 GFAA CCCc1nn(-c2ccccc2)c(=O)n1CC(=O)N[C@H](C)c1nc(C)cs1 77287945 HPOFRLGERBXRIA-CQSZACIVSA-N 385.493 2.629 0 50 GFAA COc1nc2c(cc1CNC(=O)[C@@]1(C)CCCCO1)C(=O)N(C1CCCC1)C2 71498962 ONFUWUQVLFYOII-OAQYLSRUSA-N 387.480 2.564 0 50 GFAA CCn1nccc1C(=O)N1CCN(CCOc2ccc(Cl)cc2C)CC1 215330352 BLYIMELTBFQBMR-UHFFFAOYSA-N 376.888 2.702 0 50 GFAA CC(=O)Nc1ccc(CN2CCC3(CC2)C(=O)N(C)C(=O)N3CC(C)C)cc1 14537134 DZPVGOBULICTHJ-UHFFFAOYSA-N 386.496 2.530 0 50 GFAA Cn1cc([C@@H]2CN([C@H]3CCN(c4ccc(F)cc4)C3=O)CC23CCOCC3)cn1 334058964 XLYMNZDQRWTTFD-PMACEKPBSA-N 398.482 2.561 0 50 GFAA Cc1c(C(=O)N(CC(=O)O)C2CCOCC2)cnn1-c1ccccc1Cl 237727604 HDXPJUBVRWHVMZ-UHFFFAOYSA-N 377.828 2.540 0 50 GFAA C[C@H](O)CN1CCN(C(=O)[C@H](C)Sc2nc3ccccc3s2)[C@@H](C)C1 240465969 GBTOFXCRADURRN-IHRRRGAJSA-N 379.551 2.690 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCCN(C)C4(CCNCC4)C3)c2)cn1 426689874 NXOIXJSEWMPMRH-UHFFFAOYSA-N 378.520 2.957 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)NCc2ccc3c(c2)CCCO3)CC1=O 223742065 KJAIRILZOKDRFG-QGZVFWFLSA-N 380.444 2.690 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)o1 91468545 YBHQBPOROWOLAX-UHFFFAOYSA-N 394.471 2.993 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)C[C@H](N)c1ccc(OC)c(OC)c1)CC2 95372954 VOMKIYCGIJEZEP-IBGZPJMESA-N 384.476 2.730 0 50 GFAA COc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2cc3ncccn3n2)cc1 97698756 UQKNGKWIQGIJIC-SFHVURJKSA-N 380.448 2.602 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCC[C@]3(CCC(=O)N(CCC(C)C)C3)C2)CC1 95508255 ZPJVIDMBFMTLJR-JOCHJYFZSA-N 391.556 2.522 0 50 GFAA C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1nc(-c2ncccn2)no1 91745346 NIGHCLBIFFTDJV-ZDUSSCGKSA-N 375.388 2.764 0 50 GFAA O=C(NC[C@H](c1ccncc1)N1CCOCC1)c1c[nH]nc1C1CCCCC1 91690842 QXVMHMYJKQYDKR-LJQANCHMSA-N 383.496 2.656 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)N3CCC[C@@H](Nc4ccc(F)cc4)C3)nn2)CC1 247708997 HMEGWJYOGTZWKO-NXHRZFHOSA-N 386.475 2.576 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4ccc(F)cc4)c3CO2)cc1 263618540 UGLOYGIVNKPXLY-SFHVURJKSA-N 382.395 2.627 0 50 GFAA COc1ccc(OC)c(NC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)c1 263615455 CMQIRZRAWDQYFV-GOSISDBHSA-N 398.394 2.958 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CCCN(c3ccc(F)cc3)CC2)c1C 952963986 KPOGCJAWCKKDMF-UHFFFAOYSA-N 386.471 2.971 0 50 GFAA O=C(CCn1cnc2ccccc21)NC1CCN(Cc2cccc(O)c2)CC1 952977280 AJOUMKLYOCCSGN-UHFFFAOYSA-N 378.476 2.913 0 50 GFAA Cc1ccc(-c2ccc(CCC(=O)N[C@H]3CCOC[C@@H]3OCC(=O)O)o2)cc1 1565515470 ZQPXKSZHOMEKRM-HKUYNNGSSA-N 387.432 2.563 0 50 GFAA COCc1ccccc1CNC(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 190194028 WWBSHDMHFZNUJH-QHCPKHFHSA-N 397.519 2.611 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 194928148 MTWZCXZERNTIAN-UYAOXDASSA-N 384.451 2.850 0 50 GFAA Cc1cc(CN(C)S(=O)(=O)c2ccc(-c3cc(C(F)(F)F)n[nH]3)o2)no1 1506417322 PRISEJFAJBJHAT-UHFFFAOYSA-N 390.343 2.806 0 50 GFAA O=C(CN1C[C@@H]2CNC[C@@]2(CCc2ccccc2)C1)N1CCc2ccccc21 1772804340 MYBBYXLZWSIGAQ-URXFXBBRSA-N 375.516 2.730 0 50 GFAA Cc1cc2c(c(-c3cnccn3)c1)O[C@@H](CNC(=O)Cc1c(C)noc1C)C2 12080192 SROBWNKLNRHDOU-MRXNPFEDSA-N 378.432 2.719 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](CNC(=O)c3cc4ccccc4[nH]3)C2)nc(C)n1 12206771 WIFZSSDXKZDCNN-MRXNPFEDSA-N 391.475 2.857 0 50 GFAA CCCCc1nc(CN2CCC(CCC(=O)N3CCN(CC)CC3)CC2)c[nH]1 12300397 JNBMEMXUMKFDRM-UHFFFAOYSA-N 389.588 2.909 0 50 GFAA CC1(CNC(=O)[C@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)COC1 12459164 KXJCJSJUKAEHGV-FQEVSTJZSA-N 385.552 2.516 0 50 GFAA CC(C)CN1C[C@H](OCc2cccc(F)c2)CN(C(=O)c2ccncc2)CC1=O 14534959 KTWYRWPTSUTRBY-FQEVSTJZSA-N 399.466 2.747 0 50 GFAA CCn1nc(C(=O)N2CCN(C)CC2)c2c1CC[C@H](NCCC1=CCCCC1)C2 14752216 QRLOEEKRWZVLQA-IBGZPJMESA-N 399.583 2.628 0 50 GFAA CC(C)CCN1CCc2nnc([C@H](C)NC(=O)CCc3ccccc3)n2CC1 14881450 BJQZWOUCANHSGO-SFHVURJKSA-N 383.540 2.992 0 50 GFAA COc1ccc(CNC(=O)Cn2c(-c3ccc(F)cc3)nc(C)cc2=O)cc1 169752664 ANLMGYHXBSITFJ-UHFFFAOYSA-N 381.407 2.683 0 50 GFAA CC1(C(=O)N[C@@H]2CCC[C@@H](NC(=O)CCCc3ccc(F)cc3)C2)COC1 1857682400 KAGSVMJLGAFGRR-QZTJIDSGSA-N 376.472 2.729 0 50 GFAA Cc1cccc(CC(=O)N2CCC[C@]3(C2)CN(c2ccncc2)CC[C@H]3O)c1 1857693904 RKFINFJCTHGBKO-FYYLOGMGSA-N 379.504 2.813 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)Cc3ccc(CO)cc3)CC2)O1 1857731152 AUZFMMRBKMNTNT-RTBURBONSA-N 375.509 2.669 0 50 GFAA CC(C)=CCN1C[C@@H]2[C@H](CNC(=O)c3ccc(N(C)C)cc3)[C@H]3CC[C@]2(C1)O3 1857734720 OHIWEQJAOSCGML-ZZLPTCMGSA-N 383.536 2.928 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)Cc2cccnc2)CC1 1857738711 UXELYFBPMJGKNQ-UHFFFAOYSA-N 380.492 2.924 0 50 GFAA O=C(C[C@H]1CCCC[C@@H]1O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1 241776920 RTNQNFFYHXAKPA-NEWSRXKRSA-N 380.916 2.771 0 50 GFAA C[C@@H]1CCCCN1CCNC(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 252467392 HSVGTSSLVJADAG-HZPDHXFCSA-N 380.483 2.965 0 50 GFAA CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NC1CCC2(CC1)OCCO2 266682264 REQCULDXUWDRDW-LJQANCHMSA-N 387.524 2.836 0 50 GFAA C[C@H]1CC[C@@H](CN)N(C(=O)c2cnc3sc(Cc4ccccc4)cn3c2=O)C1 1875278035 URPYJTUQSINECQ-HOCLYGCPSA-N 396.516 2.546 0 50 GFAA O=C(NCC1CCOCC1)N1CCN(Cc2cc3c(s2)CCCC3)CC1 1875255967 UMFCCQNBKDAMIB-UHFFFAOYSA-N 377.554 2.881 0 50 GFAA CC(C)[C@@H](Oc1ccc(Br)cc1)c1noc(Cn2ncnn2)n1 1875286333 QKAMKVXOIQJENQ-CYBMUJFWSA-N 379.218 2.643 0 50 GFAA O=C(NC[C@H]1CC2(CCNCC2)C(=O)O1)N1CC[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 1875392233 SEXQYVKCRDAMAQ-YSTOQKLRSA-N 397.519 2.507 0 50 GFAA Cc1cccc2nc(CNC(=O)N3CCC[C@@]34CCC[S@@](=N)(=O)C4)cn12 1875393148 HTRXSKYWTJSEIV-HFJWLAOPSA-N 375.498 2.527 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CCC[C@@]2(C[C@@H]2C(=O)O)C1 1875304800 VNLYPOWHWFWNCS-MNRXQERYSA-N 387.402 2.879 0 50 GFAA O=C(CNC1CC1)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100556722 QRWVQVOWIRWKGA-JOCHJYFZSA-N 379.504 2.703 0 50 GFAA C[C@@]12C=C[C@@](CO)(O1)[C@H]1C(=O)N(c3cc(C(F)(F)F)ccc3Cl)C(=O)[C@H]12 1167820 PPIVCBCOLCHEFG-VZAMPYOESA-N 387.741 2.554 0 50 GFAA Cc1cccc(-n2cc(CN3CCc4nc(C5CCOCC5)nn4CC3)cn2)c1 2356137171 RDKIXFFRMKJNBY-UHFFFAOYSA-N 392.507 2.725 0 50 GFAA O=C(O)CCCNC(=O)CCCNC(=O)C(c1ccccc1)c1ccccc1 4729252 MWGVPTZCGPXBHQ-UHFFFAOYSA-N 382.460 2.696 0 50 GFAA CN(c1cccnn1)C1CCN(C(=O)c2cnc(-c3ccccn3)s2)CC1 109641891 UJSMKOLZJFMZTA-UHFFFAOYSA-N 380.477 2.736 0 50 GFAA CC(C)Cc1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)n[nH]1 23129332 XAYWTQBIUHLTKC-IBGZPJMESA-N 392.494 2.955 0 50 GFAA OCC[C@@H]1CN(Cc2cccc3nccnc23)CCN1Cc1ccc(F)c(F)c1 20500117 RGIHQPNXDXVYNX-GOSISDBHSA-N 398.457 2.977 0 50 GFAA COc1cccc(-c2n[nH]c3c2CN(C(=O)C2(Cn4cccn4)CC2)CC3)c1 67654983 AZOUIHSSAKJFAR-UHFFFAOYSA-N 377.448 2.647 0 50 GFAA Cc1ccc(F)cc1NC(=O)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2795268 ZEDAACCFMPIMHA-UHFFFAOYSA-N 377.383 2.742 0 50 GFAA CCN(CC)C(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H]2CCCN2C)cc1 363520186 OMZWPNSNXJFFDR-UXHICEINSA-N 386.540 2.937 0 50 GFAA CN1CCCN(C(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71524428 YWVAPTMIJDVLIY-XMMPIXPASA-N 391.515 2.698 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCC2(CO)CCC2)(Cc2ccccc2)c2ccccc21 71753231 UPPVCFSTYRUISF-XMMPIXPASA-N 392.499 2.812 0 50 GFAA CS(=O)(=O)Cc1noc(CN2CC[C@H](Cc3ccc(C(F)F)cc3)C2)n1 375158319 ILGZFFOQWMWOHB-CYBMUJFWSA-N 385.436 2.616 0 50 GFAA Cc1ccc(CNC(=O)c2cnn3ccc(C)nc23)c(OC[C@H]2CCOC2)c1 126985382 QPQWWWWHPVWQRO-INIZCTEOSA-N 380.448 2.691 0 50 GFAA O=C(NC1CCN(C(=O)c2ccncc2)CC1)c1ccccc1OCC1CC1 194607640 PDKDSNYILZWVNM-UHFFFAOYSA-N 379.460 2.905 0 50 GFAA O=C1CN(Cc2ccc(OCCn3ccnc3)cc2)CCN1c1ccccc1 82083392 XAFLTGGIPPUNLA-UHFFFAOYSA-N 376.460 2.811 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)N2CCC[C@@H](c3noc(C)n3)C2)c1 96138370 HQECSOIUMPNHTP-CQSZACIVSA-N 387.440 2.683 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CC[C@@H](n2cc(Cl)cn2)C1 291000420 QZLLQULRBFNNEF-MSOLQXFVSA-N 386.883 2.544 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1cnc3c(c1)CCCC3)CC2 92003240 PXQMDZIIVSJPKX-UHFFFAOYSA-N 379.508 2.693 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)c2c(F)cccc2OC)CC1 96164339 ULVJDDYGFAPQCR-UHFFFAOYSA-N 389.475 2.527 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cnn(Cc3ccccc3)c1)C2 95506231 FTGZNNSLMSJAOP-KRWDZBQOSA-N 377.444 2.921 0 50 GFAA COc1ccc(CN2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)cc1 96137604 BHOUZGYJUQJZHV-UHFFFAOYSA-N 380.496 2.757 0 50 GFAA Cn1c(CC2CCNCC2)nnc1SCc1cnn(-c2ccccc2F)c1 91574134 ZCXPCPUNQGAMER-UHFFFAOYSA-N 386.500 2.974 0 50 GFAA Cc1nc(CN2CCC(C(=O)NC[C@@](C)(O)c3cccs3)CC2)cs1 177914891 COSXAACEPBJKHT-GOSISDBHSA-N 379.551 2.749 0 50 GFAA Cn1nccc1C(=O)N1CCC2(CC1)CC(=O)N(C/C=C/c1ccccc1)C2 91585973 DBVFHGPKBKLLFC-VMPITWQZSA-N 378.476 2.588 0 50 GFAA COc1cncc([C@@H](NC(=O)c2ccc(N3CCCC3)cc2)[C@H]2C[C@@H](O)C2)c1 244852919 VBRZXTQYBCPBQA-SCWSEQNSSA-N 381.476 2.932 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(-c2ncn(C)n2)c1 183679476 YZVQXGHBLFQFNU-UHFFFAOYSA-N 384.461 2.918 0 50 GFAA COc1cccc(C(=O)N2CCN(c3nccn4nc5c(c34)CCCC5)CC2)c1 263617173 MLDPVYBVOVKFIH-UHFFFAOYSA-N 391.475 2.579 0 50 GFAA CCn1ncnc1CN1CCC(CNC(=O)[C@@H]2C(C)=C2c2ccccc2)CC1 823609757 MBDWRCUJYLNPIZ-OAQYLSRUSA-N 379.508 2.730 0 50 GFAA CN(C)CC(=O)Nc1ccccc1NC(=O)COc1ccc(F)c(Cl)c1 952978753 FFNABOURMRFWGS-UHFFFAOYSA-N 379.819 2.997 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)c3ccc(C)c4ncccc34)CCO2)cn1 189221971 CFUUFITVHQPJRD-QGZVFWFLSA-N 386.477 2.522 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2cccc3nsnc23)[C@H](c2ccccc2)CO1 194789661 APDTXAYTPTZMRU-DOMZBBRYSA-N 375.475 2.842 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3ccc(OCc4ccccn4)cc3)C[C@@H]2O)on1 1529099205 ULIXVKCKDJQFKB-GCJKJVERSA-N 379.460 2.992 0 50 GFAA OCCN1C[C@@H]2CN(Cc3nc4ccccc4[nH]3)C[C@@]2(CCc2ccccc2)C1 1772804948 FGNIRRQXFMYWGJ-HYBUGGRVSA-N 390.531 2.922 0 50 GFAA CCNC(=O)c1cn([C@H](C)CC)cc(C(=O)NCc2cc(F)ccc2C)c1=O 11788648 AGMXMUXTYONVPC-CQSZACIVSA-N 387.455 2.947 0 50 GFAA CCN(CC)C[C@H](O)COc1cc(CNCCc2cccnc2)ccc1OC 12448946 IXARNTWZBWBHEA-FQEVSTJZSA-N 387.524 2.504 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)N2CCc3ccccc32)cc1 12843553 LJMPAXLEMAFFPK-HXUWFJFHSA-N 379.460 2.687 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)c4cccc(Cl)c4)CC3)nn2)n1 13008908 LVOBSVXGKKPBQU-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCCc1ccccc1F)C2 14532606 LAXHRVIMMUPBJM-QGZVFWFLSA-N 384.499 2.875 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CNC(C)(C)CO 15064996 OWESWXCXANLVKG-UHFFFAOYSA-N 386.521 2.571 0 50 GFAA CC(C)NC(=O)c1cn(Cc2ccccc2)cc(C(=O)NC2CCCC2)c1=O 15071996 RSCTUGYPJMDAID-UHFFFAOYSA-N 381.476 2.707 0 50 GFAA CN(Cc1ccccn1)c1ccc(C(=O)N2CCC[C@H](Cn3ccnc3)C2)cn1 19148360 WQBSWKSWHFRLBN-GOSISDBHSA-N 390.491 2.862 0 50 GFAA CC(C)[C@H](NC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccco1)C(=O)O 5092755 IEWONSUFAFFPGT-DKGMDFAASA-N 390.823 2.929 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(c3nccc(C(F)(F)F)n3)C1)CC2 1857672166 AFTIYZKVMPUHKH-QGZVFWFLSA-N 394.401 2.541 0 50 GFAA Cc1ccc(OCC(=O)N2CC[C@H]3[C@@H]2CC(=O)N3Cc2nc(C)c(C)s2)cc1 1857693200 MMMWZDGEHLHGIM-ROUUACIJSA-N 399.516 2.849 0 50 GFAA Cc1ccnc(N2CCC(N3C[C@@H](COc4ccc(F)cc4)OCC3=O)CC2)c1 1857698424 QVVDXHSXCMDPRD-FQEVSTJZSA-N 399.466 2.804 0 50 GFAA Cc1nc(C)c(C(=O)N[C@H]2CC[C@@H](NC(=O)c3nn(C)c4ccccc34)C2)s1 1857703285 PHQAEPMJGWQYOY-KGLIPLIRSA-N 397.504 2.728 0 50 GFAA CC(=O)c1cc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cs1 1857729227 ATWZUPAETWIFKM-CDXJDZJCSA-N 396.468 2.865 0 50 GFAA CCN1CCN(c2ccc(C(=O)N[C@@H](C(=O)O)c3ccccc3)cc2F)CC1 236996684 KBLSURSIQNGUGK-LJQANCHMSA-N 385.439 2.523 0 50 GFAA O=C(NC1CC1)c1cn(CC[C@H]2CCCCN2C(=O)/C=C/c2cccs2)nn1 14990880 OUVYMERKFGIIBT-ROJDOSBLSA-N 399.520 2.716 0 50 GFAA COc1ccc(NC(=O)Cc2coc(-c3ccc(F)cc3)n2)cc1OCC(N)=O 363342699 HDCOQBIHDXASJZ-UHFFFAOYSA-N 399.378 2.535 0 50 GFAA CNS(=O)(=O)c1csc(-c2nc(C3(c4cccc(OC)c4)CC3)no2)c1 809517299 DBQDRLRTDHYPRT-UHFFFAOYSA-N 391.474 2.795 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1ccc(C)cc1C(=O)C(F)(F)F)[C@@H]1CCOC1 864096436 GAGPQKDVMQPVCN-RISCZKNCSA-N 395.399 2.533 0 50 GFAA CCCOc1ccc(CCC(=O)NC[C@@H]2C[C@H](OC)CN2c2ccncn2)cc1 864337178 IVNVOTTVJVAGAN-ICSRJNTNSA-N 398.507 2.608 0 50 GFAA O=C(c1ccc(N2CCCC2=O)cc1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 1875274528 GCOOTJAZLUHNND-IBGZPJMESA-N 398.484 2.502 0 50 GFAA CCOc1cccnc1S(=O)(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 1875298849 POMMTFGNTIUJHN-AEFFLSMTSA-N 376.478 2.927 0 50 GFAA CC1(CN)CCN(C(=O)[C@H](Cc2ccccc2)NC(=O)c2cccs2)CC1 1875292602 NPVLMUJYNMZCHY-KRWDZBQOSA-N 385.533 2.677 0 50 GFAA C=CC(=O)NCC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(C(F)(F)F)c1 1875301421 JKXGLPDOGCPOFA-TXEJJXNPSA-N 385.386 2.560 0 50 GFAA O=C(O)C[C@@H](CO)C(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 1875313626 RKKUSHNQQCFOTP-JTQLQIEISA-N 388.367 2.774 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)CC1 1875314826 VCDZUDFLHCNCSF-CABCVRRESA-N 398.507 2.850 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@@H](C)[C@](C)(CO)C1 888101817 XGRBCOCPQUOXJA-BZNIZROVSA-N 376.375 2.754 0 50 GFAA Cn1c(=O)c2c(nc(Oc3ccc(F)cc3)n2Cc2ccccc2F)n(C)c1=O 875865 QSCBKVHQJANHPL-UHFFFAOYSA-N 398.369 2.553 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2100545074 PCRIEYUHNZXXCG-YLJYHZDGSA-N 389.835 2.566 0 50 GFAA CC(C)c1cc(NC(=O)C[C@@H]2Cc3ccccc3CN2)n(-c2ncccn2)n1 2325774835 XTKAUWBCTCYENF-KRWDZBQOSA-N 376.464 2.829 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2ccccc2)cn1 2325786164 JYUMTTHBVHLUCU-CWFSZBLJSA-N 378.432 2.640 0 50 GFAA FC(F)(F)Cn1ccc(Cc2noc([C@H]3CC(C4CCOCC4)=NO3)n2)n1 2325789967 ZFLSTSZZUPKQKT-CYBMUJFWSA-N 385.346 2.663 0 50 GFAA CCn1c(CN2CCN(CCc3ccncc3)CC2)nc2cc(C(=O)O)ccc21 2325803692 WBOIAGNAIWFSEL-UHFFFAOYSA-N 393.491 2.510 0 50 GFAA COC(=O)c1cc(C(=O)NS(=O)(=O)c2cc(Cl)cc(Cl)c2)cs1 2325875220 KGGQTCTZOHEINN-UHFFFAOYSA-N 394.257 2.960 0 50 GFAA O=C1CN(Cc2n[nH]cc2Br)C(=O)N1CCCc1ccccc1F 2325890446 AWMFURDVLMGSFT-UHFFFAOYSA-N 395.232 2.708 0 50 GFAA Cc1nc(O)[nH]c1C(=O)N[C@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 1450297494 XOPTXNJGFTUBAF-CRAIPNDOSA-N 397.406 2.744 0 50 GFAA CC(C)(C)c1ncc(C(=O)N2CSC[C@H]2C(=O)N2CCSCC2)s1 140557671 JQGANYXKTWPQPB-NSHDSACASA-N 385.580 2.531 0 50 GFAA COc1ccc(CCCn2ncc3c2nc(N)n2nc(-c4ccco4)nc32)cc1 602847 AEULVFLPCJOBCE-UHFFFAOYSA-N 389.419 2.958 0 50 GFAA in-vivo COc1ccc([C@@H]2C(C(N)=S)=C(N)Oc3c2c(=O)oc2ccccc32)cc1 626063 GVPMMSQBEUIDEA-AWEZNQCLSA-N 380.425 2.782 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)cc1 801325 FSUKCLQTJMASRG-KRWDZBQOSA-N 378.425 2.626 0 50 GFAA CCc1ccc(C(=O)Nc2ccc(N3CCN(S(C)(=O)=O)CC3)cc2)cc1 1110480 OBCGHNFJSWHROZ-UHFFFAOYSA-N 387.505 2.583 0 50 GFAA CCOc1ccc(/C=c2\sc3nc(-c4cccs4)nn3c2=O)cc1OC 1130761 RQOZKFZAXPLRFX-GDNBJRDFSA-N 385.470 2.835 0 50 GFAA CCOc1cccc(NC(=O)CN(c2ccc(F)c(F)c2)S(C)(=O)=O)c1 10294834 TXSCPILVAVCYQD-UHFFFAOYSA-N 384.404 2.768 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 11842690 HWSWJCAIINOADS-OAQYLSRUSA-N 393.478 2.807 0 50 GFAA Cc1nc(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)sc1C 12299079 XRGGRKHPUIPASL-HNNXBMFYSA-N 375.469 2.954 0 50 GFAA O=C1N(Cc2cccnc2)CCC[C@@]12CCN(C1CSCCSC1)C2 12308377 QQZBEEJJUXFTBE-IBGZPJMESA-N 377.579 2.745 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)s1 12590548 DOCCGLSCQCTWIO-QGZVFWFLSA-N 389.565 2.786 0 50 GFAA Cc1cccc(Cn2c(Sc3nc(C)cs3)nc3c2c(=O)[nH]c(=O)n3C)c1 12647539 ULHJIRJOLUYHRA-UHFFFAOYSA-N 399.501 2.696 0 50 GFAA COc1cccc(-c2nn(-c3ccccc3)cc2CN2CCNC(=O)CC2)c1 12706273 CQYKDZCSMZRUGJ-UHFFFAOYSA-N 376.460 2.870 0 50 GFAA CCn1cc([C@@H]2C[C@H]3CN(Cc4ccccc4OC)C(=O)[C@]34CCCN24)cn1 12707987 JSFUAZIFWRGACR-IPJJNNNSSA-N 380.492 2.850 0 50 GFAA COc1ccc(-c2cc(C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)no2)cc1 28403964 HZZCARCKFTVBKR-UHFFFAOYSA-N 379.372 2.958 0 50 GFAA CCS(=O)(=O)N1CCN(C(=O)c2ccc(-c3ccccc3Cl)o2)CC1 52052112 AFFUVXVDNVOUSA-UHFFFAOYSA-N 382.869 2.708 0 50 GFAA O=C(c1cccc(O)c1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCCc1ccc(F)cc1 67695191 WVSVOCSMCNVVRE-RBUKOAKNSA-N 384.407 2.809 0 50 GFAA Cc1ccc2nc(-c3cc4n(n3)CCCN(C(=O)[C@H]3CCCO3)C4)[nH]c2c1C 67742111 QIXXKBRVJMYQEP-GOSISDBHSA-N 379.464 2.955 0 50 GFAA CCNc1ncc(CN2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)cn1 92020402 AGYSGPDJLKCBCB-JOCHJYFZSA-N 394.523 2.708 0 50 GFAA CNc1nc(C)cc(N[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)n1 92046414 WFSKGLNRCLHJSV-HNNXBMFYSA-N 383.500 2.579 0 50 GFAA Cc1nc2n(c1C(=O)N(C)C)CCN(C(=O)Nc1cccc3c1CCCC3)C2 95496929 IQPDTSVQHNRBJK-UHFFFAOYSA-N 381.480 2.820 0 50 GFAA COCc1cccc(C(=O)N2CCC[C@H](c3nccn3Cc3ccncc3)C2)n1 95512412 MJXYBUIYKSFFEW-SFHVURJKSA-N 391.475 2.888 0 50 GFAA CN1CCC(N(Cc2ccco2)C(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)CC1 124179573 NKMWESKMKXKGLH-GOSISDBHSA-N 385.439 2.968 0 50 GFAA O=C(NCc1cccnc1OC1CCCC1)N1CCN(Cc2ccccn2)CC1 159113963 VHFCLAWXGUNGLC-UHFFFAOYSA-N 395.507 2.825 0 50 GFAA Cn1cc(Nc2cccc(C(=O)N3CCN(c4cccc(F)c4)C(=O)C3)c2)cn1 170596256 ITTVSYAKRFGSJT-UHFFFAOYSA-N 393.422 2.792 0 50 GFAA Cc1c(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)cnn1C1CCCC1 183397780 AICSCRGUOYTSLA-HXUWFJFHSA-N 382.508 2.803 0 50 GFAA CCc1nn(C)c2[nH]nc(NC(=O)c3cnn(-c4ccc(OC)cc4)c3CC)c12 185736790 VCPPIMLQSAVOFZ-UHFFFAOYSA-N 393.451 2.868 0 50 GFAA COc1ccc(-n2nnc(C(=O)N3CCOC[C@@H]3c3nc(C)cs3)c2C)cc1 188624938 IBWCYZAGJXWVEV-MRXNPFEDSA-N 399.476 2.563 0 50 GFAA COCCn1ccc(C(=O)N(C[C@H]2CCCO2)c2nc3ccccc3s2)n1 190393629 XDSWBKODHHJTMV-CQSZACIVSA-N 386.477 2.965 0 50 GFAA O=C(CN1C[C@H]2CCC[C@H]21)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 230172201 XEGBLBTVPANGKR-CZUORRHYSA-N 383.414 2.965 0 50 GFAA C[C@H]1CN(C(=O)CN2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@H]32)C[C@@H](C)O1 244701001 JYDXYVGSSITSRJ-JUJSEWBNSA-N 386.536 2.775 0 50 GFAA CCC1(CC)[C@H](NC(=O)C2CCN(C(=O)N3CCCC3)CC2)[C@H](C)[C@H]1OC 245619699 QWHIXXWYIZYUPE-CGTJXYLNSA-N 379.545 2.870 0 50 GFAA O=C(Nc1ccnn1Cc1ccccc1)N[C@H]1CCCN(c2ncccn2)C1 299789879 AQUFTGBTIGJXPQ-KRWDZBQOSA-N 377.452 2.512 0 50 GFAA CCCOc1ccc(Cl)cc1C(=O)NC1CCN([C@@H]2CCN(C)C2=O)CC1 332329050 SBTBGLYWUMVJDZ-QGZVFWFLSA-N 393.915 2.554 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)s1 333719250 JMESCHVAFFIGDC-INIZCTEOSA-N 398.550 2.642 0 50 GFAA C[C@@H](C[S@](C)=O)NC(=O)NCC1(c2ccc(Br)s2)CCC1 376442455 QAZRMVXSAWLPCG-CWKPULSASA-N 393.372 2.999 0 50 GFAA O=C1N[C@@H]2CN(Cc3ccc(-c4ccccc4F)o3)CC[C@H]2N1C1CCNCC1 415143260 SLNRWKWWNHXFHO-WOJBJXKFSA-N 398.482 2.806 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)N(Cc1ccccn1)C[C@H]1CCCO1 426368304 LTKYZAOMKGSGRL-QGZVFWFLSA-N 383.496 2.964 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCN(CC(C)C)[C@@H](CCO)C3)cc2)nn1 426442824 COGSUOOEPZSTJE-FQEVSTJZSA-N 382.508 2.617 0 50 GFAA CC(=O)NCc1cc2n(n1)CCN(C(=O)[C@@H](C)Oc1cc(C)ccc1C(C)C)C2 426475305 BFOMZIAXVVQGGH-MRXNPFEDSA-N 398.507 2.761 0 50 GFAA CCCn1nc(C)c(CNC(=O)N2CCN(c3cc(C)nc(C)c3)CC2)c1C 584895807 ZKBAHQVKCMYICE-UHFFFAOYSA-N 384.528 2.954 0 50 GFAA CN(C[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)NCCc1ccc(N(C)C)cc1 584896161 CIQXMKLNKHHTSS-SFHVURJKSA-N 386.540 2.728 0 50 GFAA COc1ccc(C2=NO[C@@H](CNC(=O)c3c[nH]nc3-c3ccncc3)C2)cc1F 801351174 JECONZIFTWTDBG-CQSZACIVSA-N 395.394 2.542 0 50 GFAA Cc1ccccc1N1CC[C@H](CNC(=O)CCS(=O)(=O)c2ccccc2)C1 827819929 HEWAKVPOTHQRPQ-GOSISDBHSA-N 386.517 2.802 0 50 GFAA Cc1c(CN2CCC[C@@H](CNC(=O)CCCn3cncn3)C2)[nH]c2ccccc12 828022168 CYAZODNXCKNLTQ-SFHVURJKSA-N 394.523 2.876 0 50 GFAA O=C(C[C@@H]1Oc2ccccc2NC1=O)Nc1cccc([C@H]2CCCC(=O)N2)c1 895189020 RCPRTOHDRFVNFU-QAPCUYQASA-N 379.416 2.756 0 50 GFAA O=C(NC[C@H]1CCCN(S(=O)(=O)Cc2ccccc2F)C1)c1cccs1 952976336 NONAIWRJFWWNHZ-CQSZACIVSA-N 396.509 2.859 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCc2c(OC)ccc3ccccc23)C1 1506397990 ZTRXYSXRXFRGOH-OAHLLOKOSA-N 378.494 2.541 0 50 GFAA CCCC[C@H]1CN(C(=O)Cc2ccc(S(C)(=O)=O)cc2)C[C@@H](C2CC2)O1 1616085222 ZCBMSTBAZQECSG-HKUYNNGSSA-N 379.522 2.829 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N(C)C[C@H]2CCCNC2)ccc1F 1704307574 ALVBVRUXUABJTK-ZDUSSCGKSA-N 390.459 2.627 0 50 GFAA COc1cc2nc(N3CCC(O)(CN4CCCC4)CC3)cc(C)c2cc1OC 1704356799 LDPITRKLEIUGKF-UHFFFAOYSA-N 385.508 2.988 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N[C@@H]1CCC[C@H](NC(=O)C2CCOCC2)C1 1857688564 QHSIZEIKDDYHPX-MSOLQXFVSA-N 378.900 2.853 0 50 GFAA Nc1ncccc1CN1CCC2(CC1)CN(Cc1cccc(F)c1)C(=O)CCO2 1857710506 AGFRUKTYHUSDNP-UHFFFAOYSA-N 398.482 2.587 0 50 GFAA COc1cc(CN2CC[C@H](CO)[C@@H](O)C2)ccc1OCc1ccccc1F 1857712917 WWBMTPDXTKMMSZ-APWZRJJASA-N 375.440 2.588 0 50 GFAA CCCOc1cccc(CNC(=O)[C@@H]2CC(=O)N(c3nnc(CC)s3)C2)c1 1857722920 PONUBZLBNMGSDZ-CQSZACIVSA-N 388.493 2.559 0 50 GFAA O=C(CCCc1nc2ccccc2s1)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857727598 VTYVSTCRFCSIPS-UZLBHIALSA-N 385.489 2.569 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c(OC)c1 1857733013 QVAMLFLZWBPRTC-XQBPLPMBSA-N 396.487 2.577 0 50 GFAA C[C@]1(c2ccc(NC(=O)N3CCc4c(O)nc(O)nc4C3)cc2)CC1(F)F 1875306530 JKMJJJUVIYYDEV-QGZVFWFLSA-N 376.363 2.775 0 50 GFAA C[C@H](C(=O)N1C[C@@H](Cc2ccccc2)[C@H](C(=O)O)C1)n1cnc2ccccc21 1875349786 MSZLUKNPVXPEAD-KBAYOESNSA-N 377.444 2.999 0 50 GFAA CCn1cc(S(=O)(=O)NC(=O)[C@H](c2cccs2)C2CCCCC2)nn1 1875393436 FGALMJFEQJPLBY-HNNXBMFYSA-N 382.511 2.529 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1NCc1cc2n(n1)CCC2 1875399294 VFDAUEDFTVUSJH-ZLGUVYLKSA-N 377.492 2.622 0 50 GFAA COCCn1cncc1CN1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356151321 CTZRFEMKLIJDOT-JOCHJYFZSA-N 382.508 2.687 0 50 GFAA Cc1ccc(F)c(NC(=O)CCC(=O)NC[C@H](O)COC2CCCCC2)c1 55133047 YDKMQPLVRMBINH-HNNXBMFYSA-N 380.460 2.679 0 50 GFAA CCOc1ccccc1OCCN(C)Cc1ccc(S(=O)(=O)NC)cc1 55166036 CTFIYEZGCFKFKP-UHFFFAOYSA-N 378.494 2.504 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)NC[C@@H]3CCCO3)CC2)CC1 55182835 MPCXFRROFGMLFH-QHCPKHFHSA-N 399.579 2.967 0 50 GFAA O=C1CC[C@@H]2C(=O)N(CC(=O)N(C3CCCCC3)C3CCCCC3)C(=O)[C@H]2C1 100564890 HFEILMMQYYVLAH-OALUTQOASA-N 388.508 2.835 0 50 GFAA Cc1cc(C)nc(N2CCC[C@H](C(=O)NC[C@@H]3CCCN4CCCC[C@@H]34)C2)n1 170613642 ZALXBUPLKWCELC-UFYCRDLUSA-N 385.556 2.691 0 50 GFAA Cc1noc(-c2ccc(N3CC[C@@H](c4ccc5c(c4)OCO5)[C@H](O)C3)nc2)n1 65376159 KOECQAHWPULYDQ-JKSUJKDBSA-N 380.404 2.524 0 50 GFAA COc1cccc(-c2cnnc(N3CCN(Cc4ccc(C)cc4)C(=O)C3)n2)c1 12072335 LWRGVXQWFQBMFW-UHFFFAOYSA-N 389.459 2.704 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CC3(CCN(C(=O)C4CC4)CC3)C[C@@H]2C(=O)O)c1 72412208 ASECGHUKRFRTCV-LJQANCHMSA-N 398.503 2.550 0 50 GFAA Cn1c(C(=O)N[C@@H]2c3ccccc3C3(CCNCC3)[C@H]2O)cc2ccccc21 72161649 KLANMKGTBSOJFA-RTWAWAEBSA-N 375.472 2.645 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1CC(=O)Nc1ccccc1S(C)(=O)=O 152989905 ZYBSZZRUSCGZDF-UHFFFAOYSA-N 389.399 2.647 0 50 GFAA COC(=O)c1ccc(NC(=O)Cn2nc(-c3ccccc3Cl)ccc2=O)cc1 71283037 QWUFOAQUIHQUAJ-UHFFFAOYSA-N 397.818 2.989 0 50 GFAA O=C(c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N1CC[C@H](O)[C@@H](O)C1 72146708 NZAGNXSPEHTQAQ-OALUTQOASA-N 397.862 2.760 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)[C@H]1CCCN1C(=O)c1ccccc1 177432828 UQTGPTRQBDUFFV-FUHWJXTLSA-N 398.894 2.735 0 50 GFAA Cc1nc2n(n1)C[C@@H](NC(=O)N1CCC(c3noc4cc(F)ccc34)CC1)CC2 291417724 YIYDTTKXUMYTGY-HNNXBMFYSA-N 398.442 2.771 0 50 GFAA COCc1cc(CN2C[C@@H]3c4ccccc4OC[C@]3(C(=O)O)C2)ccc1OC 95502919 UHZRKPMOWWQUFN-XMSQKQJNSA-N 383.444 2.904 0 50 GFAA COc1cc(N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)ncn1 95388792 ZQKZZBDGUBFNDY-UHFFFAOYSA-N 380.492 2.937 0 50 GFAA C[C@@H]1Oc2cc(NC(=O)N(C)Cc3noc4c3CCCC4)ccc2N(C)C1=O 95523880 BMZULDOZHNIWNK-LBPRGKRZSA-N 384.436 2.961 0 50 GFAA CCc1ccccc1OC1CN(C(=O)[C@@H]2CC(=O)N(c3cccc(O)c3)C2)C1 96149306 XRDXGHWMIDNETK-MRXNPFEDSA-N 380.444 2.597 0 50 GFAA CS[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91320048 BETVIKJUFMIWPN-INIZCTEOSA-N 375.538 2.607 0 50 GFAA COCCN1CCC(CN(Cc2ccncc2)C(=O)c2ccncc2F)CC1 95523288 VPXCDNODGQFMRZ-UHFFFAOYSA-N 386.471 2.617 0 50 GFAA CCCSCC(=O)N1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1 92038121 HKGKQQAWLQTRHY-UHFFFAOYSA-N 390.553 2.659 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)c3ccc4c(c3)ncn4CCO)C2)cc1 95372149 CZJJYQFTLYOKEL-SFHVURJKSA-N 393.443 2.747 0 50 GFAA CC(C)(C)c1oc(C(N)=O)cc1CN1CCN(C(=O)c2cccs2)CC1 241081864 YRLGSJZXKLJATL-UHFFFAOYSA-N 375.494 2.696 0 50 GFAA COc1ccccc1C(=O)N1CCC([C@@]2(CCC(C)C)NC(=O)NC2=O)CC1 299756800 FWQVVKAOCDAQLP-OAQYLSRUSA-N 387.480 2.562 0 50 GFAA COc1nc(-c2cccc(C(=O)N3CCC(c4ccncc4)CC3)c2)nn1C 299797631 BORYXTYUJMLLET-UHFFFAOYSA-N 377.448 2.906 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)c2ccco2)C1)c1cc(O)nc2cc(F)ccc12 670449163 BWHCGPIAUQCUOW-ZDUSSCGKSA-N 383.379 2.707 0 50 GFAA O=C(O[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1=O)c1nc[nH]c2nccc1-2 1875267225 VZOXWKRAHHUJOZ-IAGOWNOFSA-N 376.416 2.745 0 50 GFAA Cc1cc(C)c(C(=O)NC[C@@H]2CCN(C(=O)Cn3c(C)nc4ccccc43)C2)[nH]1 1875310450 PSAPTWDSJCJTEX-KRWDZBQOSA-N 393.491 2.568 0 50 GFAA CCc1ccnc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccc3n[nH]cc3c2)c1 1875310707 ZLUCIQHFHJUQAK-GOSISDBHSA-N 391.475 2.945 0 50 GFAA COc1nccnc1N1CCC[C@@H](CNC(=O)c2ccnc3ccccc23)C1 952974310 UANRJQMBZUNJKB-HNNXBMFYSA-N 377.448 2.680 0 50 GFAA CC(C)n1cc(S(=O)(=O)Nc2ccc(F)cc2Cn2ccsc2=O)cn1 888096599 CCEKLTCHOAAFKS-UHFFFAOYSA-N 396.469 2.675 0 50 GFAA CC[C@H](C)n1nc(C)cc1NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O 1506424104 AMERIKAPUYWNJS-ZDUSSCGKSA-N 382.461 2.706 0 50 GFAA Fc1cnc(NC[C@@H]2CCCN(CCc3ccccc3)C2)nc1N1CCOCC1 1529089624 QTOWPZKXZGMAEU-IBGZPJMESA-N 399.514 2.819 0 50 GFAA O=C(c1cncc(F)c1)N1CCCN(Cc2ccccc2Cn2cccn2)CC1 1775978552 FBBUEEJOFNGONV-UHFFFAOYSA-N 393.466 2.814 0 50 GFAA COc1c(S(=O)(=O)N2CCC[C@H](C3(O)CC3)C2)ccc(Cl)c1Cl 1772819402 KTRLMNLPHAROSK-JTQLQIEISA-N 380.293 2.928 0 50 GFAA Cn1nccc1-n1nc(C2CCOCC2)nc1[C@H]1CCCN(c2ccccn2)C1 1772819782 SZKVWWUDHNQJSK-KRWDZBQOSA-N 393.495 2.674 0 50 GFAA CCN(CCN(C)C)C(=O)c1cnn(-c2nccc(-c3ccco3)n2)c1C1CC1 12158998 WZEQPZZALBQGAS-UHFFFAOYSA-N 394.479 2.823 0 50 GFAA CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCCN(C(=O)Cn2cncn2)C1 12571845 MKLGVOXJZGTPFU-VMLCMGRWSA-N 382.464 2.554 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1cccc(F)c1F 12597132 HCAFLFBAZHSLIX-QGZVFWFLSA-N 384.390 2.544 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)ccc1OC 13679233 NHKNFZATBOABJT-UHFFFAOYSA-N 388.367 2.874 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@@H](c4ccccc4)N4CCCN4[C@]3(C)C2=O)cc1 19170531 HADLUEXZIMKMLH-JQVVWYNYSA-N 377.444 2.621 0 50 GFAA C/C(Cl)=C/Cn1c(SC/C=C(\C)Cl)nc2c1c(=O)[nH]c(=O)n2C 829830 AJPCDTNVOWVUTL-MVTUOISNSA-N 375.281 2.801 0 50 GFAA CCNS(=O)(=O)c1ccc(NC(=O)c2cccc(NC(=O)C(C)C)c2)cc1 2877531 ALYDUPXDNSZDMV-UHFFFAOYSA-N 389.477 2.832 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)N1CCC(C2CCNCC2)CC1 1857677155 QTBDKJPNGPQJHW-UHFFFAOYSA-N 382.508 2.809 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCc4[nH]nc(-c5ccccc5)c4CC3)cc2n1 1857698483 TZKXLUSBQINYBJ-UHFFFAOYSA-N 386.459 2.977 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)N2CCC(OC)CC2)CC[C@@H]1Nc1ncc(F)cn1 1857704504 VFLPRAHIQPSQCV-WBAXXEDZSA-N 394.491 2.629 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC(C2CCN(Cc3nccn3C)CC2)CC1 1857710049 FSMJLTAXJLVOBC-UHFFFAOYSA-N 396.539 2.591 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)NCCCc3ccccc3F)CC2=O)s1 1857716673 OSAYAABUJBNQRX-CQSZACIVSA-N 390.484 2.903 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3cccc(C(F)(F)F)c3)C[C@H]2CO1 1857728580 IDSISYFOQMAHIB-ULQDDVLXSA-N 381.398 2.966 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)nnn1Cc1cccc(F)c1 225697095 PPHPORXEUVYDQZ-CQSZACIVSA-N 399.392 2.987 0 50 GFAA Cc1nn(C)c2ncc(CNC[C@@H]3CCc4nc(C(F)(F)F)cn4C3)cc12 328651793 WAWXRBMQZLWATJ-LBPRGKRZSA-N 378.402 2.844 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)s1 1704301313 UKKDAVYBVXQIDD-HXUWFJFHSA-N 384.505 2.927 0 50 GFAA CSCCN1C(=O)N[C@H](c2cnoc2C(C)(C)C)C(C(=O)N(C)C)=C1C 2325778422 YSMPRXQLMGZXBM-CQSZACIVSA-N 380.514 2.764 0 50 GFAA O=C(N=c1cc(-c2cccc(F)c2F)[nH][nH]1)c1cccnc1C1CCNCC1 2325808269 LRCLGUHVMGMNMF-UHFFFAOYSA-N 383.402 2.891 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1 943612 IHGWFWITJKUFDZ-UHFFFAOYSA-N 380.400 2.877 0 50 GFAA CC(=O)c1ccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1 1108943 ASDLAPZLIISTRP-UHFFFAOYSA-N 396.852 2.516 0 50 GFAA O=C(NC(=S)Nc1ccccn1)c1cccc(I)c1 1169995 PQEJJPKGEIQMPH-UHFFFAOYSA-N 383.214 2.813 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2cnn(-c3cccc(F)c3)c2)C1=O 2356138489 NEVGASHFISOEQF-OAQYLSRUSA-N 386.471 2.615 0 50 GFAA Cc1cc(N2CCCC2=O)cc(C)c1S(=O)(=O)NCCOc1ccccc1 2171084 GDFYWRDQXKENEG-UHFFFAOYSA-N 388.489 2.788 0 50 GFAA CCOC(=O)c1sc(NC(=S)NC(=O)c2ccc(OC)cc2)nc1C 2982152 ODJCEABWKSKZPN-UHFFFAOYSA-N 379.463 2.764 0 50 GFAA Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1C 7805506 LAQQAPLAVMPJJE-UHFFFAOYSA-N 376.453 2.589 0 50 GFAA C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC[C@H](c2ccnc(N)n2)C1 225674235 MUPOAQNQOQBHTP-MXKNLSCSSA-N 383.540 2.712 0 50 GFAA COc1ccc2ccccc2c1CN1CCN(C2CCN(C)CC2)[C@H](CCO)C1 104493366 IQKAIMIICRKBCD-OAQYLSRUSA-N 397.563 2.811 0 50 GFAA COc1coc(C(=O)N2CCC[C@H](c3[nH]ncc3Cc3ccccc3)C2)cc1=O 67696659 KVAXFIDZPUHXPL-INIZCTEOSA-N 393.443 2.982 0 50 GFAA O=C(NCCc1cn2cccnc2n1)c1coc(COc2cccc(F)c2F)n1 12316923 GSWZDDXPSNWQNI-UHFFFAOYSA-N 399.357 2.547 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN(C)Cc2cccnc2)cc1OC 12319401 OQQOVOWCAUMEFU-FQEVSTJZSA-N 387.524 2.804 0 50 GFAA CN1C(=O)/C(=C/c2ccc(OCC(=O)O)cc2)c2cc(Br)cnc21 373544602 CHLDMOIZKLMPIT-MKMNVTDBSA-N 389.205 2.825 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N(Cc1ccccc1)C[C@H]1CCCO1 72419395 USVXBKGCLYODHH-OAQYLSRUSA-N 382.508 2.517 0 50 GFAA COc1cccc(OC)c1-c1cc(C(=O)O)cc(S(=O)(=O)N2CCCC2)c1 71764311 PMLSNONFVHUISO-UHFFFAOYSA-N 391.445 2.854 0 50 GFAA C[C@@H](CN1CC2(CCN(C(=O)c3cnccn3)CC2)OC1=O)c1ccccc1 77391936 FOABDNHJUPKBKY-INIZCTEOSA-N 380.448 2.707 0 50 GFAA COc1cc(N)c(Cl)cc1C(=O)NCCCS(=O)(=O)Cc1ccccc1 237227788 JLCMOGQTSGLZKO-UHFFFAOYSA-N 396.896 2.666 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(c3nccc4ccccc34)CC2)CN1C(=O)C1CC1 72475174 CJNGQJRAQNHLHO-SFHVURJKSA-N 379.460 2.917 0 50 GFAA CC[C@@]1(c2cnn(C)c2)NC(=O)N(Cc2nc(-c3ccccc3)oc2C)C1=O 126742274 XJXPSUORZNYLPZ-FQEVSTJZSA-N 379.420 2.741 0 50 GFAA Nc1cc(C(=O)N2CCOC[C@@H]2c2nnc(-c3ccccc3)o2)cc(Cl)n1 375935891 UAMHHGDVXOYTMU-CYBMUJFWSA-N 385.811 2.581 0 50 GFAA CC[C@@H](NC(=O)COCc1nc2cc(F)ccc2[nH]1)c1cn2cccnc2n1 219353746 VUFFLSJNQYUWTA-CYBMUJFWSA-N 382.399 2.529 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3CCC(c4cnc[nH]4)CC3)n2)cc1 378088866 RSCLWXNTTOQEDX-UHFFFAOYSA-N 381.436 2.807 0 50 GFAA CCOc1cc(C(=O)N[C@H]2CCO[C@H](CC(C)C)C2)ccc1OCC(=O)O 262717525 DCEOEAMITNOPSK-JKSUJKDBSA-N 379.453 2.872 0 50 GFAA Cc1cccc2ncc(C(=O)N3CCC[C@H](Nc4ccc(F)cc4)C3)c(=O)n12 72133106 SFANCGGUWQFZHV-KRWDZBQOSA-N 380.423 2.859 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)NC2CCOCC2)CC1 426667363 JKYXSNXCIAERLW-UHFFFAOYSA-N 381.904 2.533 0 50 GFAA Cc1cc(=O)c(C2=Nc3c(C(N)=O)cnn3[C@@H](c3cccc(Cl)c3)C2)c(O)o1 198833052 AJJMWUZHONHYTM-CQSZACIVSA-N 398.806 2.717 0 50 GFAA Cc1cc2nc(CCC(=O)N[C@@H]3CCCN(c4cnccn4)C3)[nH]c2cc1C 426723856 JASCKJHKGAHPBA-MRXNPFEDSA-N 378.480 2.688 0 50 GFAA NS(=O)(=O)c1ccc2c(c1)N(Cc1ccn(-c3ccc(F)cc3)n1)CCC2 174681893 YASVHWWXSSLXFU-UHFFFAOYSA-N 386.452 2.612 0 50 GFAA COc1cc(C(=O)O)cc(C(=O)NC[C@H](c2cccnc2)N2CCCCC2)c1 426612645 UHQGHZKMXWQSJP-LJQANCHMSA-N 383.448 2.745 0 50 GFAA CCN1C[C@]2(CCCN(C(=O)c3ccc(-c4ccccc4)[nH]c3=O)C2)CCC1=O 82115843 QZKADBXBZSIAPF-QHCPKHFHSA-N 393.487 2.907 0 50 GFAA Cc1cc(-c2ccc(C(=O)NCCn3ccnc3)cc2)nc(N2CCCC2)n1 426551938 FNSHJFYSCXMMNW-UHFFFAOYSA-N 376.464 2.679 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)C3CCN(C4CCCCC4)CC3)C2)cc(=O)[nH]1 95389208 JBJPAJMEKGPPAI-SFHVURJKSA-N 386.540 2.829 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95521073 UFOORGCGWPISSI-INIZCTEOSA-N 387.447 2.618 0 50 GFAA COc1ccc(Br)c(C(=O)N(CCC(=O)O)C2CCOCC2)c1 299748364 HCRVNJLSPKFWJJ-UHFFFAOYSA-N 386.242 2.554 0 50 GFAA CCc1nc2ccccc2n1C1CCN(Cc2cc(=O)n3nccc3[nH]2)CC1 180968598 SBRCMRCXNPNJBG-UHFFFAOYSA-N 376.464 2.772 0 50 GFAA COc1ccc(S(=O)(=O)NCCCc2csc(N)n2)c2c1CCCC2 670451721 FWAYIWMXFNFCLK-UHFFFAOYSA-N 381.523 2.524 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CC[C@@H]2OCc3cnnn3[C@@H]2C1 1076070756 CLZQNAVSUOBDBS-MOPGFXCFSA-N 375.432 2.635 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)NCc1csc(-c2ncccn2)n1 952964789 PMMVALSCJGEXJA-UHFFFAOYSA-N 378.461 2.965 0 50 GFAA Cc1ccn2cc(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)nc2c1 952986799 KROKRTWVHDZNEA-UHFFFAOYSA-N 375.432 2.682 0 50 GFAA Fc1cccc(-n2cc(CNCc3cnc(NC[C@@H]4CCCO4)nc3)cn2)c1 952965704 SUZSUBPOKDWMJJ-IBGZPJMESA-N 382.443 2.682 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1C[C@@H]2COc3ccccc3C[C@]2(CO)C1 1565527656 ZHTLHLGOAUTRQB-IIBYNOLFSA-N 387.863 2.791 0 50 GFAA CC(C)=CCN1C[C@H](NC(=O)CCc2cccs2)C[C@H]1C(=O)NC(C)C 96142220 VUWZWGBTOFKXGM-AEFFLSMTSA-N 377.554 2.731 0 50 GFAA C[C@@H](CS(=O)(=O)NC(=O)c1csc([C@@H]2CCCO2)n1)c1ccccc1 167003794 GVDJSUAJJODQQL-WFASDCNBSA-N 380.491 2.858 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cccc2c1OC(C)(C)C2 192640909 WZCLGIACAPETNA-AWEZNQCLSA-N 390.509 2.928 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N[C@H]1COC[C@@H]1Cc1ccncc1 1616070725 WCNXMOHDZSAJTF-HKUYNNGSSA-N 378.476 2.758 0 50 GFAA O=C1CC[C@@H](N2CCCN(C(=O)C3CCC3)CC2)CCN1Cc1ccccc1 1258586669 GWMRHUHGMFOPPO-OAQYLSRUSA-N 383.536 2.902 0 50 GFAA CC(C)N(CCO)C(=O)c1ccccc1OC1CCN(Cc2ccccn2)CC1 11661564 XPMSMCOSBRCUKP-UHFFFAOYSA-N 397.519 2.968 0 50 GFAA O=C(CCc1nnc(-c2ccc3c(c2)OCO3)o1)N(CC1CC1)C[C@@H]1CCCO1 11843310 UIXCPLJMQGYMHJ-INIZCTEOSA-N 399.447 2.816 0 50 GFAA O=C(CCc1nnc(-c2ccc3c(c2)OCO3)o1)N(CC1CC1)C[C@H]1CCCO1 11843311 UIXCPLJMQGYMHJ-MRXNPFEDSA-N 399.447 2.816 0 50 GFAA COc1cc(CNS(=O)(=O)c2ccc(NC(C)=O)cc2)ccc1OC(C)C 12382788 ANTUURCLWQTKRL-UHFFFAOYSA-N 392.477 2.919 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)[C@H]1CCC(=O)N(CCc2ccccc2)C1 12441724 VRAOPXIQMSWBFW-IBGZPJMESA-N 382.508 2.638 0 50 GFAA O=C(NC1CC1)[C@H]1C[C@@H](C(=O)Nc2ccc(F)cc2)CN(Cc2ccncc2)C1 14531221 DRBUPNNKODRBMN-SJORKVTESA-N 396.466 2.576 0 50 GFAA O=C(CCCn1cncn1)N1CCC([C@@H]2CCN(CCc3ccccc3)C2)CC1 15074033 JQHJQBMVQKCVMV-JOCHJYFZSA-N 395.551 2.862 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@H](NCc1ccncc1)C2 19227520 VDIGIBZNNTYHLN-KRWDZBQOSA-N 393.491 2.810 0 50 GFAA C[C@H](C1CCN(Cc2nc(Cc3cccc(F)c3)no2)CC1)N1CCOCC1 19229295 LBAKMJMVOJYEKO-MRXNPFEDSA-N 388.487 2.732 0 50 GFAA Clc1ccc(-n2cc(-c3ccnc(NCCN4CCOCC4)n3)cn2)cc1 19782170 CJNJHIDTAXUYCD-UHFFFAOYSA-N 384.871 2.727 0 50 GFAA CN=[S@@]1(=O)CCC[C@@]2(CCCN2C(=O)c2cc(OC)c(C)c(OC)c2)C1 1857527972 NTBOQPCTXDZHAK-AFMDSPMNSA-N 380.510 2.879 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NCCCc1nnc2ccccn12 1857730319 QNROEKNUNDWFFI-UHFFFAOYSA-N 393.476 2.568 0 50 GFAA O=C(c1cn2cc(Cl)ccc2n1)N1CCC([C@H](O)CN2CCCCC2)CC1 1857741283 LSLILUGRCVJTCD-GOSISDBHSA-N 390.915 2.687 0 50 GFAA C[C@@H]1CCN(C(=O)NCC(C)(C)c2c(F)cccc2Cl)CCS1(=O)=O 428633240 OOKFKLCSPFXYIG-GFCCVEGCSA-N 390.908 2.975 0 50 GFAA CCCCc1nc(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2c(C)noc2C)c[nH]1 248191887 LTRMVTQAEZDWQY-AEFFLSMTSA-N 385.512 2.980 0 50 GFAA Cc1ccc(-n2cc(C(=O)N3C[C@H]4[C@@H](C3)OCCN4C)c(C(C)(C)C)n2)cc1 151914099 RIUACZPFQUOKSK-RBUKOAKNSA-N 382.508 2.633 0 50 GFAA CN1CCN(C(=O)CC2CCN(Cc3nnc(-c4ccccc4)s3)CC2)CC1 155555489 KGHBUANCFNHXFC-UHFFFAOYSA-N 399.564 2.581 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccn2)CN(C(=O)c2ccc3nc[nH]c3n2)C1 952894346 ZRRGZUFICYNNGD-UHFFFAOYSA-N 387.447 2.763 0 50 GFAA Cc1nnc(SCC(=O)NCC(C)(C)N2CCCC2)n1Cc1ccccc1 1875254162 JYVRWNPRYSTOGS-UHFFFAOYSA-N 387.553 2.718 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H]3CCCCCC3(F)F)C2)c1C 1875397886 RRYFRRTXAZWRGR-HZPDHXFCSA-N 395.498 2.932 0 50 GFAA O=C(Nc1c(Br)cnn1C1CC1)N1CC2(CC(C3CC3)=NO2)C1 1875396706 RNPNLHJJJCKZKV-UHFFFAOYSA-N 380.246 2.753 0 50 GFAA Brc1cncc(-c2nccc(=NC[C@@H]3COc4ccccc4O3)[nH]2)c1 1875332770 JPBOAHQKHWIVIU-CQSZACIVSA-N 399.248 2.975 0 50 GFAA COc1cc(C(=O)O)sc1S(=O)(=O)N1C[C@@H](F)[C@@H](c2ccccc2)C1 1875392538 HKLSNQHQENDQHW-VXGBXAGGSA-N 385.438 2.581 0 50 GFAA Cn1cnc(C(=O)N2CCN([C@H](COc3ccccc3)c3ccccc3)CC2)c1 2100544856 MEDYAIIVEPMRAH-JOCHJYFZSA-N 390.487 2.998 0 50 GFAA Cc1cc(S(=O)(=O)Nc2ccc(CN(C)C)c(C(F)(F)F)c2)n(C)n1 2325771059 DQEWQQIWTWXLHX-UHFFFAOYSA-N 376.404 2.610 0 50 GFAA O=C1c2sc3nnc(-c4ccccc4)c(=O)n3c2C(=O)N1Cc1ccccc1 946907 APTVVINAHHLPQV-UHFFFAOYSA-N 388.408 2.614 0 50 GFAA Cc1cc(C)nc(SCc2nnc(SCC(=O)Nc3nccs3)o2)n1 1820535 YPKZHCHPRPWOMK-UHFFFAOYSA-N 394.507 2.956 0 50 GFAA CC[C@H](C)NC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1 2960123 BCCAMGZDMILMDL-INIZCTEOSA-N 390.505 2.801 0 50 GFAA CCc1ccc(CN2CCC3(CC[C@@H](CNC(=O)[C@@H]4CCCO4)O3)CC2)o1 11966619 QECGDOWTEFFQFL-HKUYNNGSSA-N 376.497 2.651 0 50 GFAA O=C1CCCCN1c1ccc(S(=O)(=O)NCCc2ccccc2F)cc1 12002247 VYURXKSVAKYOBR-UHFFFAOYSA-N 376.453 2.864 0 50 GFAA CN(CCCNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2F)C1)C1CCCC1 12441546 CKXLTLMUQGTBLA-SFHVURJKSA-N 389.515 2.945 0 50 GFAA CC1=C(C(=O)N(C)CC2CCN(CCc3ccc(F)cc3)CC2)OCCO1 12593232 WXTIYESZIMXYDU-UHFFFAOYSA-N 376.472 2.817 0 50 GFAA Cc1noc(C)c1CCCNC(=O)c1ccc(N2CCN(CC3CC3)CC2)nc1 12709531 UTLPXJLHSZMJCO-UHFFFAOYSA-N 397.523 2.581 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2F)CN(C(=O)c2ccccn2)CC1=O 14741500 XYEUNLKXQHGHSC-GOSISDBHSA-N 399.466 2.747 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCN(c2ccccc2)CC1 15669551 KGFAXKCHQNNBOM-UHFFFAOYSA-N 377.448 2.803 0 50 GFAA CC(C)CCN(C)c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 20203164 IWHVXDDNKPYGLH-UHFFFAOYSA-N 382.512 2.706 0 50 GFAA COC(=O)c1cc(C)sc1NC(=O)CN1CCN(Cc2ccccc2)CC1 20344854 VMOBLGYYEKQLTO-UHFFFAOYSA-N 387.505 2.599 0 50 GFAA Cc1nnc(SCCC(=O)N2CCC[C@H]2c2ccc(C(N)=O)s2)s1 23153459 FIXVRWRPJHGNTD-JTQLQIEISA-N 382.536 2.853 0 50 GFAA Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)Cn3cnc(N)c4ncnc3-4)C[C@@H]1O2 40935534 GACPZBUVEBGCNP-FFSVYQOJSA-N 393.447 2.903 0 50 GFAA CC(=O)Nc1ncc(C(=O)N2CCC[C@@H](N(C)CCc3ccccc3)C2)s1 72143302 SXYQNOWMNYSISL-QGZVFWFLSA-N 386.521 2.881 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2cn3cc(Cl)cnc3n2)CCCN1CC1CC1 72146249 MRXFGYRPXBZRJL-KRWDZBQOSA-N 375.904 2.965 0 50 GFAA NC(=O)c1cccnc1N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 72154370 OXVDLPZNXFEYNM-NRFANRHFSA-N 386.446 2.951 0 50 GFAA C[C@H](C(=O)O)N1CC2(CCC1=O)CCN(C(=O)Nc1ccc(F)cc1)CC2 91691039 FVGFHWDSKSEAJE-CYBMUJFWSA-N 377.416 2.535 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1C[C@H]2CC[C@@H]1CN(Cc1ccccn1)C2 95354153 MYOFGZXTYHKVEZ-FUHWJXTLSA-N 388.475 2.603 0 50 GFAA Cc1ncncc1C(=O)N1CCC2(CC1)CC(=O)N(CCCc1ccccc1)C2 95385312 WHCIAPZLDXWLPE-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN(C(=O)N2CCCC2)CC1 95498138 JVENJOQBKOBMNH-UHFFFAOYSA-N 387.480 2.646 0 50 GFAA COC1CCN(Cc2cccc(OC[C@@H](O)CN3CCCCCC3)c2)CC1 95517685 WBQQPSNMCKBAMC-FQEVSTJZSA-N 376.541 2.913 0 50 GFAA COc1cc(C(=O)NC[C@H](C)N)ccc1OC1CCN(C2CCCC2)CC1 95522132 LYYIPEXNOHCWKB-HNNXBMFYSA-N 375.513 2.558 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN2CCC3(CCO3)CC2)cc1OC 95525675 VTBBQNKLUADUTL-IBGZPJMESA-N 392.540 2.532 0 50 GFAA CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N2CCNC(=O)[C@@H]2C(C)C)c1 96139474 INSCQBBICGFKJM-HNNXBMFYSA-N 381.860 2.894 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)N(C)Cc2ccncc2C)cc1 96152379 LMNOPMKOHAUNRW-UHFFFAOYSA-N 376.482 2.742 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)c1ccnc2ccccc12 121973379 SKBXYPQGOSTOQD-CQSZACIVSA-N 396.472 2.921 0 50 GFAA Cc1ccc(CNC(=O)c2cnn3ccc(C)nc23)c(OC[C@@H]2CCOC2)c1 126985159 QPQWWWWHPVWQRO-MRXNPFEDSA-N 380.448 2.691 0 50 GFAA Cc1c(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cnn1-c1ccccn1 153238665 FHCKVDZJNKJPSH-KRWDZBQOSA-N 393.422 2.640 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N[C@H](C)CCc1ccccc1)CCCC3 169778274 BCBGLNMDABZTHC-MRXNPFEDSA-N 392.503 2.980 0 50 GFAA C[Si](C)(CNC(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccccc1 170609682 LVIHVXRXEYWGRQ-UHFFFAOYSA-N 395.535 2.612 0 50 GFAA O=C(NCCn1ccc2ccccc21)[C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 170622170 BTJZYDCLFGAAME-INIZCTEOSA-N 387.443 2.687 0 50 GFAA CC(C)(C)C(=O)Cn1cc(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)nn1 174715496 YXDDMJKLOIUQNV-MRXNPFEDSA-N 390.871 2.760 0 50 GFAA COc1ccccc1N1CC[C@H](N(C)Cc2ccccc2N2CCOCC2)C1=O 176957710 XHAFBFJEYHVZIL-NRFANRHFSA-N 395.503 2.769 0 50 GFAA Cn1cnc(-c2ccc(NC(=O)CCN3CCN(c4ccccc4)CC3)cc2)n1 183717197 SAXMSUDKRKJVFJ-UHFFFAOYSA-N 390.491 2.633 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@H](C)[C@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237346682 ACVVRMGSLVHFKT-AUUYWEPGSA-N 385.464 2.804 0 50 GFAA O=C(c1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)c1)N1CCCCC1 239322008 JAYJDNGAUOGCSR-YDRVBMSGSA-N 376.456 2.870 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2Cl)cc1)C(=O)N1CC(n2ccnn2)C1 239667966 BSJAXGBSGSXCAU-UHFFFAOYSA-N 397.822 2.746 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@@H]1C=Cc3cc(F)ccc3N1[C@H]2C(=O)c1ccc(Cl)cc1 247800739 FODXHQMLJQBXRZ-WNRNVDISSA-N 396.805 2.835 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)NCc1ccc(N3CCO[C@@H](C)C3)nc1)CCO2 286790876 XXDKTBBJYDVATP-KRWDZBQOSA-N 396.491 2.719 0 50 GFAA Cc1cccc([C@@H](NC(=O)CC2CN(C(=O)OC(C)(C)C)C2)C(=O)O)c1C 297199162 QWBPWPSCSAZABL-QGZVFWFLSA-N 376.453 2.802 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)NC3CCN(c4cnccn4)CC3)cc2)o1 299766733 RPPCSKOZFHXAEE-UHFFFAOYSA-N 379.424 2.626 0 50 GFAA CCc1nc(N2CCC(Oc3ccnc(C(N)=O)c3)CC2)c2ccsc2n1 301947590 ANIYZIZOCSIYJY-UHFFFAOYSA-N 383.477 2.795 0 50 GFAA Cc1ncccc1CNC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1 328608543 ZLMWFDKLWPDRRG-NZQKXSOJSA-N 389.503 2.944 0 50 GFAA O=C(c1ccn2ccnc2c1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328624001 JOUQVAAOUOYDTO-QGZVFWFLSA-N 377.448 2.623 0 50 GFAA CN(CCOCCO)C(=O)NCC1(c2ccc(Br)s2)CCC1 377231548 CJZNOXBNLIJYBQ-UHFFFAOYSA-N 391.331 2.583 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cn1)N1CCCN2c3ccccc3C[C@@H]2C1 377842697 LENMPPVTPUIDGF-LJQANCHMSA-N 393.491 2.587 0 50 GFAA CC(C)n1cnnc1CNC(=O)N1CCC[C@@H](COc2ccc(F)cc2)C1 584897832 XFSCNNSTKNFPGW-OAHLLOKOSA-N 375.448 2.999 0 50 GFAA COc1cccc(-c2cc(-c3c(C)nn(C)c3C)nc(N3CC[C@@H](N)C3)n2)c1 824789999 YEWURMAMKIMOMS-MRXNPFEDSA-N 378.480 2.707 0 50 GFAA Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H](C(=O)O)C2)C1 888095924 FIBXZAOTTICNBT-XHSDSOJGSA-N 379.526 2.623 0 50 GFAA C[C@H](CC(=O)N[C@@H](CO)[C@H](O)c1cccnc1)c1ccc(Br)cc1 913565487 KKZBOJTZVAOCEM-PZPSRYQVSA-N 393.281 2.548 0 50 GFAA NCC(F)(F)CC(=O)N1CCC(c2nccc(-c3ccc(F)cc3)n2)CC1 952892659 BMXYXNVPNYXBOA-UHFFFAOYSA-N 378.398 2.973 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccnc2)C(=O)Cc2c(F)cccc2Cl)N1 1506405703 NKNLPKSRHOJJHX-AWEZNQCLSA-N 375.831 2.724 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)CCc2scnc2C)CC1=O 1506428288 OIQBHYPBKRMQCQ-INIZCTEOSA-N 387.505 2.510 0 50 GFAA O=C(N1C[C@H](O)[C@@H](F)C1)C1(c2ccccc2)CCN(Cc2ccccc2)CC1 1615750660 CMDFSWVJQBBBMO-SFTDATJTSA-N 382.479 2.762 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3cnc(C4CC4)nc3O)CC1)OCC2 1704300544 YJRMSHOFWQNYEP-UHFFFAOYSA-N 395.459 2.772 0 50 GFAA Cc1ccc2c(C(=O)NC3CCN(C(=O)NC4CCCCC4)CC3)cnn2c1 1772707572 WBCCMULDCOWCRN-UHFFFAOYSA-N 383.496 2.879 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)N1C[C@@H]3CC[C@H](C1)[C@@H]3N)C2 1772807847 CJUIYXYVVJIJAM-ZXTQRBJTSA-N 386.521 2.716 0 50 GFAA O=C(NC[C@@H](c1ccccc1)N1CCCCCC1)c1cc(N2CCOCC2)no1 1772813034 TYUAMSNVHFCQLQ-IBGZPJMESA-N 398.507 2.858 0 50 GFAA COC(=O)C1(NC(=O)C[C@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)CC1 1857671526 HARLJGONXMBZMV-GFCCVEGCSA-N 391.855 2.910 0 50 GFAA CNC(=O)Cc1ccc(-n2ccnc2-c2cc3c(cc2OC)OCCO3)cc1 1857671594 KFSHQEKNZZQBFH-UHFFFAOYSA-N 379.416 2.608 0 50 GFAA O=C(O)[C@H]1CN(C/C=C/c2ccccc2)CC12CCN(Cc1cc[nH]n1)CC2 1857693993 WBAQIWQDSLKMOM-WWPOYFSUSA-N 380.492 2.722 0 50 GFAA Cc1cnc(C)c(-c2cc3c(s2)C2(CCN(C(=O)[C@@H](C)O)CC2)OCC3)n1 1857715063 ZISGSJBZVKOGTP-CQSZACIVSA-N 387.505 2.593 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NC[C@@H](C)Oc4cccnc4)CC3)nc2n1 1857740772 YXKMSVGPTNVZLX-OAHLLOKOSA-N 395.463 2.726 0 50 GFAA COc1nc2ccccc2cc1-c1ccccc1OC[C@H](O)CN1CCOCC1 1875242258 PVKYAGHUJKZNDS-GOSISDBHSA-N 394.471 2.982 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)Cc3ccsc3)[C@H]3CC[C@]2(C1)O3 1875243323 BEZSTZQHWHXPQD-XKGFGPFHSA-N 383.517 2.794 0 50 GFAA COc1ccc(-c2nccn2[C@H](CO)c2ccc(F)cc2)c(C(=O)O)c1OC 1875245447 AEWQAQLQDFIQIO-OAHLLOKOSA-N 386.379 2.986 0 50 GFAA O=C(NC[C@@H]1CNCc2ccccc21)[C@H]1CCCN1c1ncnc2sccc12 1875268127 FZCNLFUTZATVQT-MAUKXSAKSA-N 393.516 2.663 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@]2(CNC(=O)[C@@H]3CCC=CO3)C[C@@]2(C(F)(F)F)C1 1875274462 AJQGEBYNRMYAQN-AFAVFJNCSA-N 390.402 2.985 0 50 GFAA Cc1nnc([C@H]2CCCN2C(=O)[C@H]2C[C@@](F)(CNC(=O)OC(C)(C)C)C2)o1 1875293292 KTYDSRCXBCBJMN-SNUQEOBHSA-N 382.436 2.685 0 50 GFAA O=C(Nc1nc2cc3c(cc2s1)OCO3)[C@@H]1CCCN1C1CCOCC1 1875297185 FSOOZISOZTVSKF-ZDUSSCGKSA-N 375.450 2.607 0 50 GFAA NC(=O)CCN1CCC(NC(=O)C[C@H](Cc2ccccc2)c2ccccc2)CC1 1875319839 UYWWNVZMNVWFHV-NRFANRHFSA-N 393.531 2.859 0 50 GFAA COc1cccc(N(C)c2ccnc(N[C@@H]3C[C@H](Cn4ccnc4)C[C@H]3O)n2)c1 1875398976 KQRQDPBMDUKNAN-KFKAGJAMSA-N 394.479 2.701 0 50 GFAA NC(=O)[C@@H](OC(=O)c1ccc2c(c1)COCC2)c1cccc(Br)c1 2325870667 JSFQKUXXXRXUEQ-INIZCTEOSA-N 390.233 2.905 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)nn1C 2356163707 OFDOLACXAMCJCE-QFIPXVFZSA-N 380.492 2.568 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N1C[C@H](C)O[C@@H](C)C1 4667268 MKOLLYPARQRULR-QWRGUYRKSA-N 378.288 2.564 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 6702908 AQEPQYRIEWAZRH-UHFFFAOYSA-N 384.501 2.985 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)[nH]n2)c(C)c1 6876720 ITZYAAQXIPNISB-UHFFFAOYSA-N 378.432 2.885 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(I)cc1)[C@H]1C=C[C@H]2C12CC2 101362856 SXBUIFRWYXAUGI-MQYQWHSLSA-N 391.208 2.993 0 50 GFAA C[C@H](C(=O)OCCOc1ccccc1Cl)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 249695571 RCILBTYZIVHXSO-MGPQQGTHSA-N 379.840 2.826 0 50 GFAA O=C(CN1CCc2[nH]nc(-c3ccc(F)c(F)c3)c2C1)Nc1nccs1 67433815 JDRNLOJMNMRTMR-UHFFFAOYSA-N 375.404 2.808 0 50 GFAA CC(C)(C)OC(=O)NCCN(CCO)C(=O)c1ccc(SC(F)F)cc1 170596860 MCUQTBBWFGKLTE-UHFFFAOYSA-N 390.452 2.961 0 50 GFAA CCCCNC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1 2762527 LJTLYQFPMFGXIZ-UHFFFAOYSA-N 383.861 2.852 0 50 GFAA CN(C)[C@H](CNc1ncnc2ccc(S(C)(=O)=O)cc12)c1ccc(F)cc1 252501550 UHFXSYJBPKXASK-GOSISDBHSA-N 388.468 2.887 0 50 GFAA COc1cccc(C(=O)N2CCCN(CCc3nc4ccccc4n3C)CC2)c1 252538072 MPHWXALQMGXYQP-UHFFFAOYSA-N 392.503 2.973 0 50 GFAA Cc1c(Br)cnn1[C@@H](C)C(=O)N(C)Cc1cn2ccccc2n1 6527571 AFDSWWUBTDXUPC-LBPRGKRZSA-N 376.258 2.821 0 50 GFAA COc1cc(/C=C/C(=O)N(C)Cc2cc(C(=O)O)c(C)o2)cc2c1OCCO2 328595083 KIVPPJFAAIJTTJ-SNAWJCMRSA-N 387.388 2.738 0 50 GFAA CC(C)(C)c1nsc(N2CCC[C@@H](c3n[nH]cc3CN3CCOCC3)C2)n1 328642304 YKPYIERELUGPCE-CQSZACIVSA-N 390.557 2.775 0 50 GFAA O=C(CCCN1CCOCC1)N1CC[C@]2(CCCN(CC3CCCCC3)C2)C1 12596129 RREUKYXGTHYXSK-QHCPKHFHSA-N 391.600 2.994 0 50 GFAA CC1CCN(C[C@@H]2CCCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)CC1 363474512 NDODYCUAEJMOFZ-FQEVSTJZSA-N 396.539 2.921 0 50 GFAA CN(CCCC(=O)O)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71761320 QYTYQQPDUDJTCV-HSZRJFAPSA-N 394.471 2.857 0 50 GFAA CC(C)c1nc(C2CCN(C(=O)[C@@H]3CN(C)C(=O)c4ccccc43)CC2)no1 366439425 NJUATBGXIASOAX-QGZVFWFLSA-N 382.464 2.768 0 50 GFAA O=C1COc2cc(NC(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)c(Cl)cc2N1 369036816 RCIIRGCZVXCFMY-JYILRKAJSA-N 390.745 2.965 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)nn1C1CCCCC1 333062668 DLOZCYXLCYJGDJ-IBGZPJMESA-N 394.541 3.129 0 50 GFAA CN(C)C(=O)c1cccc(NC(=O)CN2CCO[C@@]3(CCc4ccccc43)C2)c1 158711092 KPYGXWWCCCQGEC-QHCPKHFHSA-N 393.487 2.501 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CC[C@@H](Cc4ccc(C(=O)O)cc4)C3)cc2n1 72432263 MVOGJHRBDVITOO-INIZCTEOSA-N 378.432 2.749 0 50 GFAA Cc1cc(C)n(-c2ccc3nnc(CCC(=O)Nc4ccccc4F)n3n2)n1 71279407 STUPHGNEDOPYSW-UHFFFAOYSA-N 379.399 2.637 0 50 GFAA O=C(CCC(=O)N1CCN(c2ccccn2)CC1)Nc1ccc2[nH]ccc2c1 40267680 OZLXQXKOOHPAQC-UHFFFAOYSA-N 377.448 2.630 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cnn(Cc2cccc(C(F)(F)F)c2)c1 226567765 ZRRYLPVTISPRSX-WCVJEAGWSA-N 391.349 2.617 0 50 GFAA Cn1nc2c(cc1=O)CN(C(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1)CC2 174081795 XXTVTZWMVQEVEW-HXUWFJFHSA-N 384.455 2.919 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(c3cc([C@H]4CCOC4)ncn3)CC2)cc1 426409299 KAAQFHDHMDZHFE-IBGZPJMESA-N 380.492 2.822 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Nc3ccc(Cl)cc3)[C@@H]3OC(C)(C)O[C@H]3[C@H]2O1 239433193 XINPLTKQOKCZLO-SSZWKKLZSA-N 383.828 2.675 0 50 GFAA O=C1NC[C@H](c2ccc(F)cc2)Cc2[nH]c(-c3nnc4n3CCCCC4)nc21 95362599 IKZSQRHIWVOQIX-CYBMUJFWSA-N 380.427 2.603 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(Cc1nc3ccccc3[nH]1)CC2 95529513 LONNERCEPAOKMF-UHFFFAOYSA-N 390.491 2.572 0 50 GFAA CCc1nnc(N2CCC(c3nnc(Cn4ccnc4)n3C3CC3)CC2)s1 96161897 OPFKHHPJESIANT-UHFFFAOYSA-N 384.513 2.656 0 50 GFAA Cc1nc(N)nc(C)c1CC(=O)N1CCC(c2nc3c(C)cccc3[nH]2)CC1 95359248 FKXIXMXKCDLFCE-UHFFFAOYSA-N 378.480 2.809 0 50 GFAA Cc1cccc(CN2CCN(Cc3c(F)ccc(F)c3F)C[C@@H]2CCO)n1 91306619 VHPUWCYHKBRBNL-INIZCTEOSA-N 379.426 2.876 0 50 GFAA COc1ccc2c(C)c(C(=O)NC[C@H](c3ccncc3)N3CCOCC3)oc2c1 91468394 BGVKKWSBZIRXOJ-LJQANCHMSA-N 395.459 2.948 0 50 GFAA Cc1ccc(NC(=O)N2Cc3ccccc3O[C@@H](C)C2)cc1N1C(=O)CNC1=O 297660979 YWKZGPPGQCYAPF-AWEZNQCLSA-N 394.431 2.866 0 50 GFAA Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 298618449 VCHGGTMDKPDHGA-IBGZPJMESA-N 382.464 2.867 0 50 GFAA CN1CCO[C@H](CNC(=O)c2cccc(-c3ccc4nccc(N)c4c3)c2)C1 534589572 XZZZPRWYOMZNCK-GOSISDBHSA-N 376.460 2.544 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)NCc2ccc3c(c2)nc(C)n3C)CC1=O 824822741 QQKUXDMCIWYAES-MRXNPFEDSA-N 392.459 2.560 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)/C=C/c3ccccc3Cl)CCO2)cn1 275339277 RHXMVYVEGFKKQO-PYUISTEWSA-N 381.885 2.930 0 50 GFAA COc1ccccc1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 277613669 UGUGPBIMZUQUEO-IFXJQAMLSA-N 384.480 2.547 0 50 GFAA CC1(C)CN(Cc2ccc(OCc3ccccc3F)nc2)CCS1(=O)=O 187155104 XSXXWUVOWKUUQY-UHFFFAOYSA-N 378.469 2.809 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)NCc1ccc(CN2CCCC2=O)cc1 193704310 NNVKQXNWDUPQDE-UHFFFAOYSA-N 388.471 2.854 0 50 GFAA COc1ccc(CN2C[C@H](Cc3cnccn3)[C@@H](O)C2)c2c(OC)cccc12 1616077954 KVIOYVAJKVPCQU-LPHOPBHVSA-N 379.460 2.682 0 50 GFAA CSCCN1CCC(NS(=O)(=O)c2cc(C)c(F)cc2Cl)CC1 1506401449 DTQRXIXJQKGCDC-UHFFFAOYSA-N 380.938 2.893 0 50 GFAA CCOC(C)(C)C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704298897 OHEKRYHGSUDHKP-UHFFFAOYSA-N 377.481 2.909 0 50 GFAA CC1=C(CN2C[C@@H]3CN(c4cc(C)nc(N)n4)C[C@]3(CO)C2)C(C)(C)CCC1 1772810261 FKAVZCJLALYXRT-VGSWGCGISA-N 385.556 2.624 0 50 GFAA CC(=O)N1C[C@H]2CN(C(=O)Cc3c(C)noc3C)C[C@@]2(CCc2ccccc2)C1 1772708731 JAECZNAZIBSJOB-NZQKXSOJSA-N 395.503 2.774 0 50 GFAA COc1ccc(-c2nccn2-c2ccc3c(c2)C(=O)NCC3)c(OC)c1OC 1772811396 UGBFWRNJGFXHNM-UHFFFAOYSA-N 379.416 2.851 0 50 GFAA CC(C)CCN[C@@H]1CCc2c(sc3ncn(Cc4cnn(C)c4)c(=O)c23)C1 12218560 AZFORPNMQQWQQL-OAHLLOKOSA-N 385.537 2.733 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)n1 14954161 PSOQYFGYOTYXLP-GOSISDBHSA-N 386.471 2.584 0 50 GFAA COc1ccc(Cn2cc(C(=O)N(C)CC[C@@H](O)c3ccccc3)nn2)cc1 14981014 OHSVGVVXXVDJSX-HXUWFJFHSA-N 380.448 2.531 0 50 GFAA COc1cc2cc(CNCCCO)c(=O)n(Cc3ccc(C)cc3)c2cc1OC 14987194 VGWPFAVHHKLWGI-UHFFFAOYSA-N 396.487 2.847 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccccn4)C3)C2=O)c1 15069933 IGKUFJZHOVYCLW-JOCHJYFZSA-N 379.460 2.745 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CCN(C)[C@@H](C)C2)no1 15071919 OJZQWOYFDKHSEE-LBPRGKRZSA-N 379.844 2.692 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1csnn1 15074853 YSORCCQQVQZEIX-UHFFFAOYSA-N 392.500 2.678 0 50 GFAA C[C@@H](NC(=O)N1CCC(N2CCCC2=O)CC1)c1ccccc1-n1cccn1 154565348 NJPGHKGADZAGRC-MRXNPFEDSA-N 381.480 2.730 0 50 GFAA O=C1[C@@H](n2cc(CNc3nccs3)nn2)CCN1c1c(F)cccc1F 1857527126 IMJJWOCJLCHEPE-ZDUSSCGKSA-N 376.392 2.603 0 50 GFAA COC(=O)N1CCCC[C@H]1C(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857674045 PDHFBXCBAMOTJL-SFHVURJKSA-N 382.464 2.625 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3[nH]c4c(c3C)C(=O)CCC4)C1)CC2 1857698222 JAXFMYAHNRWPKI-JOCHJYFZSA-N 394.475 2.766 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N[C@H]1C[C@H]2CO[C@@H](C(C)C)CN2C1 1857729668 GQPABFAXVUQQSC-OKZBNKHCSA-N 386.471 2.752 0 50 GFAA Cc1ccc(CNC(=O)c2nn(C)c(C)c2Cl)c(-n2cc(Cl)cn2)n1 421509539 RVYJXFSCICXGQG-UHFFFAOYSA-N 379.251 2.854 0 50 GFAA Cc1cc(C(=O)N(CCC(=O)O)C2CCOCC2)c(C)n1-c1nccs1 237671854 WFLZICODHCHDRT-UHFFFAOYSA-N 377.466 2.647 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1nnc(-c2ccc(F)cc2F)o1)C1CCCC1 864096374 ADFVNYQXNFLNEG-CQSZACIVSA-N 387.408 2.962 0 50 GFAA Oc1ccc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cn1 952895913 XVNQIEUQQVEHQF-INIZCTEOSA-N 377.326 2.943 0 50 GFAA COc1nc(C)c(Br)cc1-c1noc([C@@H]2CCCc3nn[nH]c32)n1 952894714 PNNAGNXBJKFCMX-MRVPVSSYSA-N 391.229 2.797 0 50 GFAA c1cc2c(cc1-c1noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n1)CCO2 952892719 BWKLAAHUGGCJEY-OAHLLOKOSA-N 393.447 2.887 0 50 GFAA C[C@@](NC(=O)CCCN1Cc2ccccc2C1=O)(C(N)=O)c1cccc(Cl)c1 1875283367 PGLGXWOTYQNTCB-NRFANRHFSA-N 399.878 2.593 0 50 GFAA CC[C@@H](CO)N(Cc1ccccc1)C(=O)NCCc1ccc(N2CCC2)nc1 1875302412 PGEVTVRMUUJBKX-FQEVSTJZSA-N 382.508 2.817 0 50 GFAA CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NC[C@@H]1COC(C)(C)CO1 1875345431 XPFUQADAJQUHLF-IAGOWNOFSA-N 396.915 2.795 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](CN)CC23CCC3)c2ccccc12 1875305376 BULJGWPETHJLCA-OAHLLOKOSA-N 387.505 2.690 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1N=c1[nH]nc(-c2ccco2)cc1C(F)(F)F 1875398367 MYNPSLJLXRTWRK-UXIGCNINSA-N 393.369 2.625 0 50 GFAA COCC1(NCc2coc(-c3ccccc3Br)n2)CCNCC1 2325805104 PNIPCMHAEAESCS-UHFFFAOYSA-N 380.286 2.962 0 50 GFAA CN1CCN(c2ccnc3c(Br)cnn23)C[C@H]1Cc1ccccc1 2325858652 WBAFYHRZGRCOCP-OAHLLOKOSA-N 386.297 2.855 0 50 GFAA CCC[C@H](CNS(=O)(=O)c1c(OC)ccc(Br)c1F)OC 2325874470 NRHSIZBGODVCJN-SECBINFHSA-N 384.267 2.690 0 50 GFAA Cc1sc(CC(=O)N[C@H]2CCCN3CCSC[C@@H]23)nc1-c1ccco1 928082967 YFRPUZZLEHPRTK-KBPBESRZSA-N 377.535 2.950 0 50 GFAA Cc1cc(=O)oc2cc(OCC(=O)Nc3nnc([C@H]4CCCO4)s3)ccc12 959141 JIKXROFULWIXNB-CYBMUJFWSA-N 387.417 2.822 0 50 GFAA biogenic COc1ccc(N2C(=O)N(c3ccc(Cl)cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 1110140 CESBMHZTHWVGEY-SJORKVTESA-N 392.864 2.961 0 50 GFAA C[C@]12CC[C@H](O)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O 4023037 QJPCKAJTLHDNCS-FBAXFMHRSA-N 390.520 2.719 0 50 GFAA biogenic,in-vitro CCCCNC(=O)c1ccccc1NC(=O)CS(=O)(=O)Cc1ccccc1 4740567 IPNAGYCZUHSVAX-UHFFFAOYSA-N 388.489 2.770 0 50 GFAA O=C(Nc1cnccn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 10435145 MVKNRNWUILNXHT-UHFFFAOYSA-N 380.857 2.557 0 50 GFAA O=C(Nc1ncccn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 10435160 CALMRWWSLOULDG-UHFFFAOYSA-N 394.884 2.947 0 50 GFAA CSCCC(=O)N1CCC2(CC[C@@H](CNC(=O)c3ccccc3F)O2)CC1 11881267 DDTGCEIEQTYCKT-HNNXBMFYSA-N 394.512 2.849 0 50 GFAA Cc1ccc(CN2CCN(C(=O)c3cn(C4CCCCC4)nn3)CC2=O)cc1C 12023517 FHHPCSLGNFRAIJ-UHFFFAOYSA-N 395.507 2.885 0 50 GFAA Cc1ccn(CCC(=O)NC[C@@H]2Cc3cc(F)cc(-c4cccnc4)c3O2)n1 12079595 WKKDENFYADUCDQ-SFHVURJKSA-N 380.423 2.903 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)CC3CCCC3)C2)nn1 12201879 VLPYPIVICKYCNH-KRWDZBQOSA-N 375.517 2.579 0 50 GFAA COC[C@@H](C)NC(=O)c1cn(C2CCCCC2)cc(C(=O)NCC(C)C)c1=O 12327473 QMYKGYDBYCKAMP-OAHLLOKOSA-N 391.512 2.504 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCCn1cncn1 12430203 KSPZQVFHSLPKIR-LJQANCHMSA-N 387.503 2.611 0 50 GFAA O[C@H]1CCCN(C2CCN(Cc3nc(-c4ccc(Cl)cc4)no3)CC2)C1 12588000 HAQCMVVWWNMKRA-KRWDZBQOSA-N 376.888 2.811 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCC([C@H]2CCN(CC(C)(C)C)C2)CC1 14948892 XAAPWOVWGWTHQK-KRWDZBQOSA-N 382.574 2.795 0 50 GFAA Cc1nonc1CNC(=O)COc1ccc(-c2ccccc2)cc1CN(C)C 14955965 NTMDUOYQSMSMJJ-UHFFFAOYSA-N 380.448 2.802 0 50 GFAA C[C@@H](c1ccccc1)n1nccc1NC(=O)Cn1cc(-c2cnn(C)c2)cn1 23312404 YKTGSVLZZFVLFM-HNNXBMFYSA-N 375.436 2.728 0 50 GFAA CC(C)N(CCO)C(=O)c1cc(CN2CCC(Cc3ccccc3)CC2)on1 67587446 QTXVFPRELGWOHU-UHFFFAOYSA-N 385.508 2.972 0 50 GFAA C[C@H](C(=O)N1CCc2ccccc2C1)N(c1cccc(F)c1)S(C)(=O)=O 67630154 AQSRAVXXEJVRLZ-CQSZACIVSA-N 376.453 2.565 0 50 GFAA O=C(c1ccc(NCc2ccccc2)nc1)N1CCC(N2CCOCC2)CC1 67689191 WMPYRMDPSKGONR-UHFFFAOYSA-N 380.492 2.631 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(NCCc3ncc[nH]3)nc2)C1 67771401 VRJBCOLYJSVDFH-KRWDZBQOSA-N 383.496 2.927 0 50 GFAA COc1ccc(C2(C(=O)N[C@H]3CC(=O)N(C4Cc5ccccc5C4)C3)CC2)cc1 72142168 GXBTVVZQZNKAKI-IBGZPJMESA-N 390.483 2.611 0 50 GFAA CC(C)c1nc2ccccc2n1CC(=O)N[C@H]1CCCN(c2ncccn2)C1 72143052 UEKAFKVJAZEFJA-INIZCTEOSA-N 378.480 2.735 0 50 GFAA O=C(CCn1cnc2ccccc21)N1CCC2(CC1)c1ccccc1C[C@H]2O 72146393 LLGRMPIHYDFAOO-OAQYLSRUSA-N 375.472 2.904 0 50 GFAA CCc1ccccc1C(=O)N1CCC2(CC1)C[C@H](C(=O)O)N(C(=O)C1CC1)C2 72423836 DLSCOXRRIWAQGL-GOSISDBHSA-N 384.476 2.567 0 50 GFAA Cc1nn(CC(=O)N2CC[C@@H]2c2ccccc2)c(=O)n1CCc1ccccc1 77485662 OWUQFOPZFLCCHL-HXUWFJFHSA-N 376.460 2.570 0 50 GFAA CS[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91320052 BETVIKJUFMIWPN-MRXNPFEDSA-N 375.538 2.607 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC1CCN(C(=O)c3ccncc3)CC1)C2 91547353 UGBXPHRWSHWKBS-MRXNPFEDSA-N 381.476 2.536 0 50 GFAA O=C1NC2(CCN(Cc3nnc(-c4ccco4)o3)CC2)C[C@@H]1c1ccccc1 95366266 XBSXZACXMPRSAX-MRXNPFEDSA-N 378.432 2.968 0 50 GFAA O=C1N[C@H]2CCC[C@@H]1CN(C1CCN(c3ccc(C(F)(F)F)cn3)CC1)C2 95381102 YKEFFEXKGPRHPV-HIFRSBDPSA-N 382.430 2.670 0 50 GFAA O=C1NC(=O)[C@H](CCC(=O)N2CCCC(c3ccccc3)(c3ccccc3)C2)N1 95516958 AZKBZSPBJJSEBO-IBGZPJMESA-N 391.471 2.583 0 50 GFAA CCn1nc(C)c(CCNC(=O)Nc2cc(C(=O)NC)ccc2Cl)c1C 96137346 BTUTVYHEQLZTOT-UHFFFAOYSA-N 377.876 2.897 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC2(C=Cc3ccccc32)CC1 96148543 GELCXUZOYODUIH-UHFFFAOYSA-N 382.485 2.843 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N[C@@H]3CCN(c4c(F)cccc4F)C3=O)c2c1 123422046 UYJHGJPCBKKBGT-GOSISDBHSA-N 399.397 2.919 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)N1CC[C@@H](Oc2ccncc2)C1 153595902 BQKXKSFAAFAODB-LJQANCHMSA-N 380.448 2.571 0 50 GFAA CCOc1ccc(NC(=O)Cn2ccn3nc4c(c3c2=O)C[C@@H](C)CC4)cc1 169760100 CVVASLVJMGTAHX-AWEZNQCLSA-N 380.448 2.658 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)Cc4ccccc4Cl)nnc23)n1 169776021 ZWICXOWTGMIYNK-UHFFFAOYSA-N 396.838 2.854 0 50 GFAA CCCCN(C)C(=O)c1ccccc1S(=O)(=O)NCCc1cscn1 173512886 XYFDGQGFJGDGAG-UHFFFAOYSA-N 381.523 2.536 0 50 GFAA Cc1nc2n(n1)CCC[C@H]2NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 176288790 AYIYQEAXOWITEB-OAHLLOKOSA-N 380.452 2.610 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 182456208 JNFDJWCUANHTLO-MJGOQNOKSA-N 383.839 2.505 0 50 GFAA O=C(Cc1nc(-c2ccc(F)cc2)cs1)N1CCN(c2cnccn2)CC1 184640157 RZGWGAIUKIFLEV-UHFFFAOYSA-N 383.452 2.631 0 50 GFAA COCC(=O)N1CCc2cc(NS(=O)(=O)c3c(F)cccc3Cl)ccc21 187821848 VBKVHCDEFAYOSS-UHFFFAOYSA-N 398.843 2.815 0 50 GFAA O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1CCC(c2ccncc2)CC1 190587302 OLMHBNYTXHVNLZ-LEWJYISDSA-N 386.540 2.739 0 50 GFAA COCc1ccc(C(=O)N[C@@H]2COCC[C@@H]2OCc2c(C)noc2C)s1 222626984 RETNYRXRHSSIDR-CVEARBPZSA-N 380.466 2.603 0 50 GFAA CCN(CC)CC[C@@H](CO)NC(=O)Nc1cccc(COCCOC(C)C)c1 225524013 WXXZSHIAYQUKGH-FQEVSTJZSA-N 395.544 2.843 0 50 GFAA C[C@@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 237513778 YOGPDOJTFVMEGR-HZMBPMFUSA-N 387.263 2.968 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cc(-c3ccccc3)on2)[C@H]2C[C@@H](O)C2)c1 243932474 BVQSCOJZZUDZLT-NBQZKYEYSA-N 379.416 2.987 0 50 GFAA O=C1N[C@H](CC(=O)N2CCc3c([nH]c4ccccc34)C2)C(O)=Nc2ccccc21 252538240 MSQAGVDYLHYVER-GOSISDBHSA-N 388.427 2.843 0 50 GFAA COCc1ncsc1C(=O)N1CCOC[C@@H]1c1nc(-c2ccccc2)no1 284556989 DUIQKEWVVUHKFZ-CQSZACIVSA-N 386.433 2.553 0 50 GFAA C[C@](O)(CCNc1cc(S(=O)(=O)N2CCCC2)ccn1)c1ccccc1 286814615 XRJIEPXGQNCQHG-IBGZPJMESA-N 375.494 2.576 0 50 GFAA CC(=O)c1c(C)nn([C@@H](C)CC(=O)NCCc2nc(C)c3c(n2)CCC3)c1C 426441756 KTIGXQAGUNSFNO-LBPRGKRZSA-N 383.496 2.600 0 50 GFAA CC(=O)c1c(C)nn([C@@H](C)CC(=O)N2CCCN(Cc3cccnc3)CC2)c1C 426545507 XCOCLPREYZYBSQ-INIZCTEOSA-N 397.523 2.783 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)C3CC3)C[C@@H]1N(Cc1csc(C(C)=O)c1)CC2 534578998 CBMFDCHNOITTLM-IMFGXOCKSA-N 376.522 2.989 0 50 GFAA COc1ccc2[nH]c(CNC(=O)c3ccc(C(=O)N4CCOCC4)cc3)cc2c1 670436988 ATGMOAOIXMLDAU-UHFFFAOYSA-N 393.443 2.579 0 50 GFAA Cc1cc(C(C)(C)C(=O)NC[C@H](O)c2ccnn2C)ccc1Br 886248088 HYTYVWAFWPGWAD-HNNXBMFYSA-N 380.286 2.618 0 50 GFAA O=C(OCCOCCO)[C@H](NCC(F)(F)F)c1cc(Cl)cc(Cl)c1 888096771 LXZFQYKAENAFNU-GFCCVEGCSA-N 390.185 2.739 0 50 GFAA COc1ccc2nc(CNCc3ccc(OCC(=O)N4CCCC4)cc3)[nH]c2c1 952862911 RUQIVAQMPZKALS-UHFFFAOYSA-N 394.475 2.863 0 50 GFAA FC(F)COCCN1CC[C@@](c2nc(-c3cccnc3)no2)(C(F)(F)F)C1 952891403 DJEFTOKGPNBGFC-OAHLLOKOSA-N 392.328 2.919 0 50 GFAA COCC(=O)Nc1cc(NC(=O)[C@H](c2cccc(F)c2)N(C)C)ccc1OC 952966914 HJRJZQXWTXUUDL-IBGZPJMESA-N 389.427 2.661 0 50 GFAA CN(Cc1cc(-c2cccnc2)no1)C(=O)c1csc(-c2ncccn2)n1 952978990 FKELXHBNULPWJU-UHFFFAOYSA-N 378.417 2.922 0 50 GFAA CC[C@@H](NC(=O)/C=C/c1cc(CO)cs1)c1ccc(S(C)(=O)=O)cc1 1506414225 DLUDMQHZNJWEHU-RCMYXZNBSA-N 379.503 2.925 0 50 GFAA Cc1cccn2cc(C(=O)N3C[C@@H](O)[C@H](Cc4ccc5ccccc5n4)C3)nc12 1529152813 YEIWOZPVIQNVME-DYESRHJHSA-N 386.455 2.867 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCc3cc(C)no3)cc12 1857705545 LULXBUSWSSNZRI-UHFFFAOYSA-N 375.494 2.858 0 50 GFAA COc1cccc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1OC 1857707510 VKFBHGKZCFNKIR-QFIPXVFZSA-N 396.443 2.593 0 50 GFAA CN1CCn2nc(C(=O)N3C[C@H](C(C)(C)C)O[C@H](c4ccccc4)C3)cc2C1=O 1857722104 BSHOYYYJQLZPGK-RBUKOAKNSA-N 396.491 2.597 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CC3CCCCC3)CC(=O)N2[C@H]1c1ccccc1 1857738916 DOOSPTMHPLRRMG-IPJJNNNSSA-N 398.503 2.930 0 50 GFAA CCC[C@H]1CCCN(C(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)CC1 1875252852 CVAYMOQQWLUUCG-YCRPNKLZSA-N 386.496 2.853 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N3CC[C@]4(C)[C@@H](C3)C4(F)F)CC2=O)cc1OC 1875255903 FRCQVPQYNDVTSX-SMNXXWJPSA-N 394.418 2.560 0 50 GFAA COC[C@H](NC(=O)NCc1nc(-c2ccco2)n[nH]1)c1ccc(F)c(F)c1 1875256432 OUGYUGQSLHFSPF-ZDUSSCGKSA-N 377.351 2.530 0 50 GFAA O=C(CNc1ccccc1Sc1ccccc1)NC[C@@H]1CCS(=O)(=O)C1 1875262150 VZCFKTLZPLIBCD-HNNXBMFYSA-N 390.530 2.801 0 50 GFAA O[C@@H]1CCCN(c2cc(CNc3nccn4nc(C(F)(F)F)cc34)ccn2)C1 1875272008 GPAIGWQCHNVNLS-CYBMUJFWSA-N 392.385 2.716 0 50 GFAA C[C@@H](NC(=O)N1CC[C@@H](C)S(=O)(=O)CC1)c1ncc(-c2ccc(F)cc2)o1 1875301317 FCTUORUQABAOHP-CHWSQXEVSA-N 395.456 2.760 0 50 GFAA COC[C@H](Cc1ccc(F)cc1F)NC(=O)[C@@H]1CCCN1Cc1ccccn1 1875320012 CJTCZIYIMLQSPG-ICSRJNTNSA-N 389.446 2.698 0 50 GFAA COc1cc2c(=N[C@@H](C)c3ccc(OCC(N)=O)cc3)[nH]c(C)nc2cc1F 1875320242 MKRRSCBCRDSOCO-NSHDSACASA-N 384.411 2.545 0 50 GFAA Cc1noc(C(C)(C)NC(=O)C[C@H]2CN(C[C@H]3CC3(C)C)C3(CCC3)CO2)n1 2325785276 NIPMLDAKLHJHOV-CVEARBPZSA-N 390.528 2.789 0 50 GFAA C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1cnc2n1CCNC2 2325786371 GNNSNYBPMNHHQD-CQSZACIVSA-N 377.448 2.783 0 50 GFAA C[C@H](N)Cn1cc(CNc2ccnc3cc(F)c(Br)cc23)nn1 2325787270 OQVHPJCPKMWGGN-VIFPVBQESA-N 379.237 2.687 0 50 GFAA C[C@H]1[C@H](NC(=O)C23CCC(CC2)C3)CCN1C(=O)c1cc2ccccc2nn1 2325793483 WKWYLILVSHAPRI-ZBDDPSFOSA-N 378.476 2.929 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CC[C@](CO)(C(=O)O)C1 2325803217 YHNJEQLABUXJMF-MZKRTTBSSA-N 395.455 2.665 0 50 GFAA O=C([C@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC[C@@H](N2CCCC2)CC1 2325807664 KZDXGUFIXMNDIS-QUCCMNQESA-N 394.523 2.764 0 50 GFAA CCCc1cc(=O)oc2cc(OCC(=O)OCC)cc(OCC(=O)OCC)c12 644121 FLNKJQRWJYEJTF-UHFFFAOYSA-N 392.404 2.629 0 50 GFAA O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1)N1CCOCC1 822921 NNPYYVQBRSALBL-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA COc1ccc(N2C(=S)N(c3ccc(F)cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 1018779 AKHWBOCJQGZDQH-IRXDYDNUSA-N 392.477 2.611 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)c2cc3c(s2)C2(CCNCC2)OCC3)n1 2356134761 AYQGZBFEHYDPEV-CQSZACIVSA-N 388.537 2.531 0 50 GFAA N=c1ncc(CN2C[C@H](c3ccc4c(c3)OCO4)O[C@H](c3ccccc3)C2)c[nH]1 2356148651 KHKIZJQIEIWKFP-LEWJYISDSA-N 390.443 2.933 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCC[C@]34CCCN(C)C4=O)cc2)n1 2356164699 CUCCLAAWIHDIFS-QFIPXVFZSA-N 380.492 2.775 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)c1ccc2nnc([C@H](O)C(C)C)n2c1 2356166139 PIKXNIJTZPMYEG-QGZVFWFLSA-N 398.467 2.732 0 50 GFAA COCCOc1ccc([C@@H](C)N(C)C[C@@H](O)COCCOC(C)C)cc1OC 221904473 ZBGIHTDKKDFJDV-IEBWSBKVSA-N 399.528 2.516 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3sccc3Cl)C2)CC1 59471977 CZANRUAPSCBWDO-ZDUSSCGKSA-N 385.917 2.780 0 50 GFAA CC(C)N1CC[C@H](NC(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)C1=O 114835662 HOKUKWAUNXHNKR-HOTGVXAUSA-N 383.851 2.571 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1cncc(-c3ccc(OC)cc3)c1)CC2 135581667 RXAWNSZSVWWGCY-KRWDZBQOSA-N 377.448 2.656 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@H]1CCCC[C@H]1CO 170590995 GBYQFLLILXWCIC-JSGCOSHPSA-N 380.901 2.555 0 50 GFAA CC(=O)c1ccc(OCc2cc(C(=O)N3CCN4CCCC[C@H]4C3)no2)cc1 67674872 LZLGVDMLANJYST-KRWDZBQOSA-N 383.448 2.767 0 50 GFAA CN(C[C@@H]1CCc2nccn2C1)S(=O)(=O)Cc1ccccc1C(F)(F)F 328618899 FDPXXYZGTXTLIS-ZDUSSCGKSA-N 387.427 2.926 0 50 GFAA CCN(C(=O)NCCC(=O)N1C[C@H](C)O[C@@H](C)C1)[C@H](C)c1ccc(F)cc1 230218450 FVZDMJVUQOXYSL-HRCADAONSA-N 379.476 2.944 0 50 GFAA CN1CCCN(Cc2c(C(=O)N(C)Cc3ccccc3)nc3ccccn23)CC1 71764322 AJJGTCAOFWNWJK-UHFFFAOYSA-N 391.519 2.744 0 50 GFAA CCN(CC(C)(C)C)C(=O)C[C@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71748116 JTVFYWSXFIOYJQ-INIZCTEOSA-N 375.513 2.870 0 50 GFAA C[C@]1(C2CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)NC(=O)NC1=O 170651695 DTQLYDULKGDIAU-JOCHJYFZSA-N 395.459 2.716 0 50 GFAA COC(=O)C1(CNC(=O)c2ccc3c(c2)C[C@@H](c2ccccc2)OC3=O)CC1 170600864 UBFJZKKIJGQJDL-SFHVURJKSA-N 379.412 2.824 0 50 GFAA COc1cc(CCC(=O)N2CCC[C@H](C(=O)O)C2)ccc1OCC(F)(F)F 261818634 NGBABIDVQKOPSX-ZDUSSCGKSA-N 389.370 2.892 0 50 GFAA C[C@@]1(CNC(=O)CCn2c(S)nnc2-c2cccs2)CCCC[C@H]1O 129924470 LLEIHDPQRYREGH-DYVFJYSZSA-N 380.539 2.743 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)C1 158613748 GUFKVQCFDDJPBW-AEFFLSMTSA-N 399.495 2.719 0 50 GFAA COc1cc(F)c(C(=O)N2CCC[C@@H](Cn3nc(C)nc3C)C2)cc1OC 130875979 WTDZZYQXFCDJIN-CQSZACIVSA-N 376.432 2.604 0 50 GFAA Cc1ccc(N2CCC3(CCCN3CCn3c(=O)oc4ccccc43)CC2)nn1 72425636 CPHQXDPCDQJCHF-UHFFFAOYSA-N 393.491 2.828 0 50 GFAA COc1cc(NC(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)ncn1 378636237 WQVFYEFCVNIQPV-UHFFFAOYSA-N 380.408 2.947 0 50 GFAA Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NCC1CCN(CCO)CC1 241409082 NELHJLOFWZIUAQ-KRWDZBQOSA-N 385.512 2.627 0 50 GFAA C[C@](CO)(CNC(=O)c1ccc(OCC(F)(F)F)nc1)Cc1ccccc1 241634567 PNMTZMMINFMQQG-GOSISDBHSA-N 382.382 2.994 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)sc2c1CCC2 17076987 WKSIYLJMSIUWGQ-RYUDHWBXSA-N 376.478 2.959 0 50 GFAA COc1ccccc1C(=O)N1CCN(C(=O)NC[C@H](C)c2ccccc2)CC1 43306064 YXXFDJILBWRIQL-KRWDZBQOSA-N 381.476 2.966 0 50 GFAA C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N(C)C[C@@H]2CCCCO2)c1 133980187 XOAFJOUHTHDRBM-AEFFLSMTSA-N 394.537 2.891 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C1 174160159 BAHNZMOCXBRWTR-VQTJNVASSA-N 395.503 2.789 0 50 GFAA CC[C@H](O)CN1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CC1 175334904 FVYBYAVYJNZHLA-KRWDZBQOSA-N 388.443 2.933 0 50 GFAA CN(CCn1ccc2ccccc21)C(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 91872445 SUPGETJRYFNSNO-SFHVURJKSA-N 376.460 2.543 0 50 GFAA O=C(Nc1ccccc1Oc1cccnc1)[C@@H]1CCCN1C(=O)c1ccnnc1 95530347 MOVWDSSRKGOUFD-SFHVURJKSA-N 389.415 2.907 0 50 GFAA Cc1nc(CNC(=O)N(C)Cc2c(C)nc3ccccn23)nc2c1CCCC2 426370758 PAUXGYRUCMIZTG-UHFFFAOYSA-N 378.480 2.962 0 50 GFAA CN(C)C(=O)CC[C@H]1CCCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)C1 95359321 PFIKJBRHELBEBN-MRXNPFEDSA-N 381.476 2.763 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(c3cccc(O)c3)CC2)CN1Cc1ccccn1 97551271 HZUBOFKKYCAECR-GOSISDBHSA-N 379.460 2.542 0 50 GFAA COc1ccc(CN(C)Cc2ccccn2)cc1OC[C@H](O)CN1CCCC1 95525800 YECLBMNMUAZZDG-HXUWFJFHSA-N 385.508 2.558 0 50 GFAA COc1cccc(N2CCC(N3CC[C@H](N(C)C)[C@H](CCC(=O)O)C3)CC2)c1 91474515 LMDOACFHQYEYLW-UTKZUKDTSA-N 389.540 2.781 0 50 GFAA Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)N(C)[C@H]1CCNC1 179084106 GYPPTPVHZOVFLN-INIZCTEOSA-N 391.313 2.745 0 50 GFAA CN(C[C@H]1CCCN2CCCC[C@H]12)C(=O)CCn1cnc2ccccc2c1=O 299754394 HGHIKYSUAQJXSW-YLJYHZDGSA-N 382.508 2.510 0 50 GFAA biogenic O=C1CCN(C(=O)C2(c3ccc(Cl)cc3)CC2)CCN1CCN1CCCC1 299799930 WLPVPSUCJPFEIB-UHFFFAOYSA-N 389.927 2.528 0 50 GFAA O=C(CCn1cccn1)NC[C@H]1CCCN(Cc2ccnc3ccccc23)C1 827822440 QYLMSUPWYLTPOX-GOSISDBHSA-N 377.492 2.850 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNC(=O)C2CCN(C3CCOCC3)CC2)C1 670438662 NTJDLTYEFVTBIN-NRFANRHFSA-N 399.579 2.792 0 50 GFAA CCCO[C@H]1CCCN(S(=O)(=O)c2cc(-c3ccno3)ccc2OC)C1 952966452 WEOJSNGHORMHOO-HNNXBMFYSA-N 380.466 2.930 0 50 GFAA O=C(CCc1cn[nH]c1)N1CCC[C@@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1 952975616 ZYVOJSKAIMFGQW-JLEDNIFVSA-N 398.551 2.914 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)[C@@H]1CCCN(Cc2ccco2)C1 952975307 XHJWMJIMOQJLAY-HXUWFJFHSA-N 395.503 2.930 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3nn(C)c(C)c3Cl)C[C@@H]2N(C)C)cc1 1565511035 GAVCIAVSVIUULF-CVEARBPZSA-N 376.888 2.560 0 50 GFAA COCC(=O)N1CCc2c(NS(=O)(=O)c3cc(F)ccc3Cl)cccc21 184670110 YZLIAFSOGNUSEB-UHFFFAOYSA-N 398.843 2.815 0 50 GFAA CC(C)COc1ccc(CC(=O)N2CCC[C@@H](N(C)CC(=O)O)CC2)cc1 186647471 ZQTWKKRXRGNPQT-GOSISDBHSA-N 376.497 2.661 0 50 GFAA Cc1ccc(C(=O)N2CCN([C@H]3CCc4ccccc4NC3=O)CC2)cc1F 191950771 DLPQKSIVNYSDCH-FQEVSTJZSA-N 381.451 2.845 0 50 GFAA O=C(c1cccnc1)N1CCC(NC[C@@H]2CCN(c3ccc(F)cc3)C2)CC1 1506398364 YUIIGYFVDUOVTR-KRWDZBQOSA-N 382.483 2.941 0 50 GFAA C[C@H](c1ccccc1)n1c(CN2C[C@@H]3[C@@H](C2)C3(CO)CO)nc2ccccc21 1772811089 ORDJYIDFZOEIFO-BHIYHBOVSA-N 377.488 2.678 0 50 GFAA COc1cccc(CNC2CCCCCC2)c1OC[C@@H](O)CN1CCOCC1 11753795 LESYKIMINXSROZ-FQEVSTJZSA-N 392.540 2.580 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc(NC(=S)NC(=O)C2CCCCC2)cc1 12138797 YJWFSLDEHOTZRM-KRWDZBQOSA-N 389.521 2.989 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)c2cccc(N3CCCC3=O)c2)C1)c1ccco1 19740298 WEKOWVGKGLXQRG-INIZCTEOSA-N 395.459 2.689 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2ccccc2)N3)cc1F 169779832 MTEXERMGRXMSSL-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA CC[C@@]1(C(=O)NCCc2cc[nH]n2)C[C@@H]2CC[C@H]1N2C(=O)c1ccc(F)cc1 1857696879 PEKPQNBAHCYMSG-WAOWUJCRSA-N 384.455 2.681 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1CCO[C@H]2C[C@H](CO)C[C@@H]21 1857698487 UGLZHTPSQWTJBD-CBQOVEMMSA-N 381.472 2.920 0 50 GFAA CCCOc1ccccc1C(=O)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857719943 ZRDQFAOTEWQLOW-ZVXPMLRVSA-N 381.472 2.684 0 50 GFAA COc1ccc(OC)c2c(C)cc(N3C[C@H](O)[C@H](Cc4cc(C)[nH]n4)C3)nc12 1857722483 JPMGSZKETQFMCJ-ZBFHGGJFSA-N 382.464 2.632 0 50 GFAA CC(C)[C@H]1CN2C[C@@H](NC(=O)c3ccc(CN4CCCCC4)cc3)C[C@H]2CO1 1857722518 KJYAVMUWXIXQBF-FDFHNCONSA-N 385.552 2.900 0 50 GFAA O=C(CCOc1ccccc1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857730557 RHOTXYJZSPNAEG-MZKRTTBSSA-N 392.455 2.757 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)c2ccccc2F)cn1 1857738714 VBBMOGOTZGMFCU-PMACEKPBSA-N 386.471 2.627 0 50 GFAA COCCN1CCC[C@@H]1CNC(=O)N1CCC(c2nc3ccccc3o2)CC1 111867208 GMFBHYYPZJFRBG-QGZVFWFLSA-N 386.496 2.828 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)Nc1cccc3c1C(=O)NC3)CC2 121983098 FPTASDIWSAHJKR-SNVBAGLBSA-N 390.365 2.791 0 50 GFAA c1cc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c2[nH]ccc2c1 264842414 HDBFYTFXZHABME-LJQANCHMSA-N 392.507 2.553 0 50 GFAA Cc1cc(Br)cc(C)c1S(=O)(=O)N1CCC[C@H](n2cncn2)C1 266280738 JDJZYCOUOHVJEV-AWEZNQCLSA-N 399.314 2.683 0 50 GFAA O=C(NOC1CCCCC1)C(=O)Nc1cccc2c1CCN(CC(F)(F)F)C2 952875993 JWBBZLVYTBDBNH-UHFFFAOYSA-N 399.413 2.926 0 50 GFAA CC(C)C[C@H](CNC(=O)N(C)C[C@H]1CCS(=O)(=O)C1)Cc1ccccc1 1875295042 CLLGIXQJNHMXON-MOPGFXCFSA-N 380.554 2.968 0 50 GFAA COc1cc2nc(N3CCC[C@H](Cc4cccnc4)C3)[nH]c(=N)c2cc1OC 1875341272 NDPGZYTZSLXSHD-OAHLLOKOSA-N 379.464 2.914 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2c(C)cccc12)C(=O)N[C@@H]1CN(C)C2(CCCC2)C1 1875309810 OTMKBAZWJOBRRA-ICSRJNTNSA-N 396.535 2.657 0 50 GFAA Cc1ccc(Cn2c(Oc3ccc(F)cc3)nc3c2c(=O)n(C)c(=O)n3C)cc1 680555 MPKYGNKUEUONAY-UHFFFAOYSA-N 394.406 2.722 0 50 GFAA CN(C)CC1CCN(c2ccccc2NC(=O)c2cccc3nncn23)CC1 2325779998 XZNPBCRFXGAOGD-UHFFFAOYSA-N 378.480 2.760 0 50 GFAA CC1(C)SCCN(C(=O)[C@@H]2CCn3c(cnc3-c3ccccc3)C2)[C@H]1CO 2325810885 MGQORYJJRQBNOA-AEFFLSMTSA-N 385.533 2.827 0 50 GFAA O=C(C[C@H]1Oc2ccccc2NC1=O)Nc1cccc([C@@H]2CCCC(=O)N2)c1 895189019 RCPRTOHDRFVNFU-MAUKXSAKSA-N 379.416 2.756 0 50 GFAA CCOc1cc([C@@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)ccc1O 1111655 HACHBZVYAOVIHE-GOSISDBHSA-N 392.419 2.705 0 50 GFAA O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCN(c2ccccc2F)CC1 1115988 PRMMZRCJBLYKHX-UHFFFAOYSA-N 395.434 2.551 0 50 GFAA CCOc1ccc(N([C@@H](C)C(=O)NCc2ccc(C)cc2)S(C)(=O)=O)cc1 1139865 QMNBBWPYISOPIL-INIZCTEOSA-N 390.505 2.865 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1 1141937 FQBDMANXBULLKD-UHFFFAOYSA-N 376.434 2.511 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)cc1C 1173378 FEMCIURLOWBRFE-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA Cc1ccc(-c2ccc(C(=O)O)c(N3CCC[C@]4(CNCC[C@@H]4O)C3)n2)s1 2356147841 SPUURWHFJQMSHX-PXNSSMCTSA-N 387.505 2.758 0 50 GFAA Cc1ccc(CSCCNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 4181134 XBBMKQPLLMALHV-UHFFFAOYSA-N 379.503 2.978 0 50 GFAA COc1cccc(OCc2cc(C(=O)NCCc3cn4ccccc4n3)no2)c1 20906569 FKSJGTMXDVPIMS-UHFFFAOYSA-N 392.415 2.882 0 50 GFAA O=C(N[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1cccc(-c2noc(C3CC3)n2)c1 173677336 NGELKCDGWMXNEB-CYBMUJFWSA-N 394.353 2.507 0 50 GFAA CCC[C@@H](C)c1cc(NS(=O)(=O)c2ccc(C(=O)OC)cc2OC)n[nH]1 442829686 PUJBSVWUCCBROK-LLVKDONJSA-N 381.454 2.909 0 50 GFAA Cn1ncc2c1ncn1nc(-c3ccnn3COc3ccccc3Cl)nc21 2802732 AGXAGYPOGHURKA-UHFFFAOYSA-N 380.799 2.564 0 50 GFAA O=C(NCc1ccnc(OC2CCCC2)c1)c1cc(N2CCOCC2)ccn1 129443042 WOQKGIKDLYYPBS-UHFFFAOYSA-N 382.464 2.565 0 50 GFAA COc1coc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1=O 253429140 BWOBGFRVNYRFAH-UHFFFAOYSA-N 378.384 2.831 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2)n1cccn1 72454072 GCAQWKMSXMRHJW-IBGZPJMESA-N 380.492 2.876 0 50 GFAA O=C(NCC(=O)N1CC(Cc2ccc(F)c(F)c2)C1)c1cc(F)cc(F)c1 363609884 CEPJFDLTHWEJRB-UHFFFAOYSA-N 380.341 2.674 0 50 GFAA O=C(C[C@H]1CN(Cc2ccccc2)CCO1)N1CC[C@H](Cc2ccncc2)C1 363703827 VFASTZSAPBJROH-YADHBBJMSA-N 379.504 2.764 0 50 GFAA COc1ccc2c(c1)CN(C(=O)CCS(C)(=O)=O)[C@H](C1CCCCC1)C2 364026273 UDQOXGZBYACJAS-IBGZPJMESA-N 379.522 2.964 0 50 GFAA CS(=O)(=O)N1CC[C@H](CN[C@H]2CCCOc3cc4c(cc32)CCCC4)C1 373138930 JOTBUBRZXVMTIT-BEFAXECRSA-N 378.538 2.650 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)c1 158141695 LXPMVMPUMCUDEW-QFBILLFUSA-N 395.511 2.841 0 50 GFAA CC(C)CN(CC(C)C)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1 72152909 NBCMMOHGWXEXAZ-IBGZPJMESA-N 377.504 2.657 0 50 GFAA COCCOC[C@@H]1CCN(C(=O)NCc2ccncc2OCc2ccccc2)C1 286980988 PXUQJYCZKYPPCM-LJQANCHMSA-N 399.491 2.855 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)N2CCN(CCc3ccccc3)CC2)ccn1 293033834 KCFDKDRWVWLVIR-UHFFFAOYSA-N 380.492 2.677 0 50 GFAA Cc1nc(-c2ccccc2CN2CCC(CN3CCCC3=O)CC2)[nH]c(=O)c1C 48148111 BOTVMMZDXOQNKT-UHFFFAOYSA-N 394.519 2.888 0 50 GFAA Cc1nn(CC(=O)NCc2cnn(C)c2)c2nc(C3CC3)cc(C(F)(F)F)c12 20602530 KARZTSOSVBVZMD-UHFFFAOYSA-N 392.385 2.686 0 50 GFAA O=C(CN1CCC[C@@H]1C(=O)O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 294153669 AHKRMOLLHWCPFL-GHTZIAJQSA-N 391.471 2.965 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCc1noc(Cc3cccs3)n1)C2 91973803 PNAFOFIWKHMPQK-ZDUSSCGKSA-N 385.445 2.598 0 50 GFAA Cc1nonc1OCCNC(=O)c1ccc2nc(-c3ccc(F)cc3)cn2c1 95383431 YMNCGVRZWKHJKP-UHFFFAOYSA-N 381.367 2.641 0 50 GFAA O=C1NCCN2CCN(C(=O)Nc3cccc(-c4cccc(Cl)c4)c3)C[C@H]12 97099408 UDGLGAQNTTVYLT-GOSISDBHSA-N 384.867 2.655 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NCCc1csc(CSC)n1)C2 95516707 MIWBHPDXYPYSAR-ZDUSSCGKSA-N 378.519 2.925 0 50 GFAA Cc1[nH]nc(CCC(=O)N2CCC[C@H](CNC(=O)c3ccc(F)cc3)C2)c1C 95526212 WDYIXZHSJGSPHE-MRXNPFEDSA-N 386.471 2.767 0 50 GFAA CN1C(=O)C[C@@H](C(=O)NC2CCC(C(=O)O)CC2)[C@@H]1c1cccc(Cl)c1 299746118 VJVVBLXLRGWOMZ-OAYKNQQBSA-N 378.856 2.619 0 50 GFAA NC(=O)C[C@@H](c1ccc(F)c(F)c1)c1oc(CN2CCCCC2)cc(=O)c1O 252495920 PDLUZRKTLCCIMZ-AWEZNQCLSA-N 392.402 2.617 0 50 GFAA CCCO[C@@H]1CCCN(C(=O)c2cccc(-c3cnn(C)c3C(=O)OC)c2)C1 534585007 FGQUJOLSEYYAPZ-QGZVFWFLSA-N 385.464 2.905 0 50 GFAA COC[C@@H](NC(=O)N(C)Cc1ccc(OC)c2ncccc12)c1ccnn1C 534648590 ZHJXCANLZCMQNZ-MRXNPFEDSA-N 383.452 2.506 0 50 GFAA Nc1cc(-c2cccc(C(=O)N3CCC(CCn4cccn4)CC3)c2)ncn1 299802656 VCEBIDMEXVSGLT-UHFFFAOYSA-N 376.464 2.865 0 50 GFAA CC(=O)c1ncc(C(=O)NC[C@@H]2CCCN(c3cnc4ccccc4n3)C2)s1 828199436 BTJOLLHIPCAIGW-AWEZNQCLSA-N 395.488 2.935 0 50 GFAA O=C(NCCOc1cccc2cccnc12)N1CCC[C@H](Cn2ccnc2)C1 584891460 FCIYOXKMWKJYGP-QGZVFWFLSA-N 379.464 2.932 0 50 GFAA COc1ccc(-c2noc([C@@H](C)NC(=O)N3CCC(F)CC3)n2)cc1OC 584899586 PTDWOFYRQPGTHZ-LLVKDONJSA-N 378.404 2.958 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=O)N[C@@H]2C[C@@H](C)c3ccccc32)C1 1875255020 JFDPGHJAVZLCOZ-DTDBQYNISA-N 392.463 2.844 0 50 GFAA O=C(NC[C@H](O)c1ccc(O)cc1)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@H]21 1875322969 QAJVJXMNHTZGRO-DZJNRPSUSA-N 388.261 2.890 0 50 GFAA Cc1nc[nH]c1CC(=O)N1CCC[C@@H]1CNC(=O)c1cc2cc(F)ccc2o1 1875310175 HKELTTXFLGYIST-OAHLLOKOSA-N 384.411 2.567 0 50 GFAA O=C1NCC[C@@H](NC(=O)N2CCC[C@H](c3cccc(O)c3F)C2)c2cc[nH]c21 1875301162 BRPWBEUNVQMHIE-SWLSCSKDSA-N 386.427 2.623 0 50 GFAA O=C(NOCc1ccc(F)cc1)N1CCCS(=O)(=O)C[C@@H]1c1ccccc1 1343097018 DZFZKDUMJLNXDG-GOSISDBHSA-N 392.452 2.829 0 50 GFAA C[C@H](C(=O)NC[C@@](C)(O)C1CCCC1)n1c(S)nnc1-c1cccs1 170645164 GIGWDTAJFXDCRU-PIGZYNQJSA-N 380.539 2.914 0 50 GFAA O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1cccc(Cn2cccn2)c1 193428847 LURSUVMUKDOEQG-UHFFFAOYSA-N 397.500 2.528 0 50 GFAA COCCN1C(=O)[C@H](CC(=O)Nc2ccc(C)cc2)Cn2c1nc1ccccc12 1848443073 UMOICYPIBPCNRJ-MRXNPFEDSA-N 392.459 2.983 0 50 GFAA O=C1CCC2(CCN(C(=O)[C@@H]3CCc4sc(-c5ccncc5)nc4C3)CC2)N1 1772811193 UJVTWZWPUHVTDW-OAHLLOKOSA-N 396.516 2.581 0 50 GFAA COc1cc2c(cc1OC)[C@H]([C@H]1c3cc4c(cc3CCN1C)OCO4)OC2=O 13154191 FLMLIWNNRKBNAQ-WOJBJXKFSA-N 383.400 2.873 0 50 GFAA O=C(NCc1ccon1)[C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 14954800 VBESBNIJKFZCCF-LJQANCHMSA-N 382.508 2.667 0 50 GFAA CCOC(=O)[C@@]1(CCCc2ccccc2)CCCN(C(=O)c2ccc(O)nn2)C1 14973033 LBHAOCXQFMBNOC-QFIPXVFZSA-N 397.475 2.991 0 50 GFAA Cc1ccc(C[C@@]2(CCC(=O)NC[C@@H](C)Oc3cccnc3)CCC(=O)N2)cc1 15066692 HXBQBYLWBAZZPD-WZONZLPQSA-N 395.503 2.945 0 50 GFAA COc1ccccc1N1CCN([C@H]2CCCN(C(=O)c3c(C)noc3C)C2)CC1 15075033 LGHDJYADYFWBIW-SFHVURJKSA-N 398.507 2.727 0 50 GFAA O=C(c1ccccc1NS(=O)(=O)Cc1ccccc1Cl)N1CCOCC1 16579394 BDYKATRHCQNJJN-UHFFFAOYSA-N 394.880 2.754 0 50 GFAA COCCNC(=O)c1ccccc1NC(=O)C1CCN(Cc2ccccc2)CC1 16607042 UYFKRXIXCLHKQF-UHFFFAOYSA-N 395.503 2.914 0 50 GFAA NC(=O)c1ccc([C@H]2CCCN2C(=O)COCc2nc3ccccc3[nH]2)s1 19114322 BLQHQUVDWAACLJ-CQSZACIVSA-N 384.461 2.604 0 50 GFAA COc1cccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 169779729 NVGIIXCGUNZOKO-UHFFFAOYSA-N 378.432 2.589 0 50 GFAA Cc1cccc(F)c1C(=O)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857668466 BPALGVSTQUDEFS-OALUTQOASA-N 382.435 2.776 0 50 GFAA c1ccc(-c2nc(CN3CC[C@@]4(CN(Cc5cccnc5)CCO4)C3)no2)cc1 1857684475 PAAOJOJTXDTXOE-QFIPXVFZSA-N 391.475 2.609 0 50 GFAA CCN(C)c1nc(N(C)C)nc2c1CCC21CCN(Cc2nccs2)CC1 1857685910 ZQOOFHZWILVHON-UHFFFAOYSA-N 386.569 2.935 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)N1CCO[C@@H]2C[C@H](CO)C[C@@H]21 1857713032 AGJQPNVAVURKMT-KAGYGMCKSA-N 381.472 2.806 0 50 GFAA COc1nc2c(cc1Cn1ccnc1-c1[nH]cnc1C)C(=O)N(C1CCCC1)C2 1875244632 WXVULGNYLODINQ-UHFFFAOYSA-N 392.463 2.932 0 50 GFAA CCOc1ccnc(N2CCN(Cc3ncc(-c4ccccc4F)o3)CC2)n1 119212407 KGAWHADCPQVNQB-UHFFFAOYSA-N 383.427 2.992 0 50 GFAA Cc1ccn2cc(CN3C[C@@H]4CC[C@H](C3)C(=O)N4Cc3cscn3)nc2c1 247859949 ZLLSTFYEAURRHW-QAPCUYQASA-N 381.505 2.722 0 50 GFAA Cc1c(NCC(=O)N2c3ccccc3C[C@@H]2C)cccc1C(=O)N1CCOCC1 149360972 KUGAZKHNGAELIC-INIZCTEOSA-N 393.487 2.857 0 50 GFAA COC(=O)c1ccc(N2C(=O)c3cccc(Br)c3C2=O)cc1O 755693 YHDRHHURRRRWBX-UHFFFAOYSA-N 376.162 2.742 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NC(=O)c2ccccc2Br)cc1 1298471 PZGKZPNRBQUEPL-UHFFFAOYSA-N 383.267 2.952 0 50 GFAA CC(C)SCC(=O)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 2356134703 YMKASWJEGKJQSA-YLJYHZDGSA-N 379.522 2.815 0 50 GFAA COC(=O)c1cnc(N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)cn1 2356139930 MUSLLVPBOFYSAY-UHFFFAOYSA-N 378.432 2.813 0 50 GFAA Cc1ccn2cc(CNC(=O)c3cc4c(s3)CCOC43CCNCC3)nc2c1 2356146650 OOERHUYMBXKHII-UHFFFAOYSA-N 396.516 2.786 0 50 GFAA COc1ccc(NC(=O)CCc2nnc3ccc(N4CCC(C)CC4)nn23)cc1 6867838 BEVXMPAXGQCMAL-UHFFFAOYSA-N 394.479 2.941 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc4ncccc4c3)C[C@H]2CCO)CC1 104432627 QSMAHQZHFIPNQF-HSZRJFAPSA-N 396.579 2.976 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)NCCc2nc3ccccc3[nH]2)CC1 55065358 JMOXPHXRPVTTTL-UHFFFAOYSA-N 377.492 2.941 0 50 GFAA COc1cc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(OC)cc1Cl 100099827 DDSKZNRHZAQHLF-TXEJJXNPSA-N 392.839 2.637 0 50 GFAA Cc1csc(CN(C)C[C@@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)n1 55133328 QPLYGDGBXORNHP-IBGZPJMESA-N 395.475 2.715 0 50 GFAA Cc1ccc2c(C(=O)N3CCSCC3)cc(-c3cnn(CCO)c3)nc2c1C 63884317 LHCYQDXSPFKTRH-UHFFFAOYSA-N 396.516 2.896 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCN(c2nccs2)CC1 29986877 NJOABCMHZCUZLG-UHFFFAOYSA-N 381.505 2.837 0 50 GFAA O=C(O)CNc1ccccc1C(=O)N(Cc1cccnc1)Cc1cccnc1 65404635 WHMWMBCWKAMTNY-UHFFFAOYSA-N 376.416 2.816 0 50 GFAA COCCC(=O)N1CCC(n2nccc2NC(=O)CCc2ccccc2)CC1 12459718 YJFNBCANTAMBBV-UHFFFAOYSA-N 384.480 2.654 0 50 GFAA O=C(c1cc(Br)ccc1O)N1N=C(C(F)F)C[C@]1(O)C(F)F 8376953 KZZLCWLDNBFCAY-LBPRGKRZSA-N 385.111 2.575 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)CN(CCN(C)C)C(=O)O3)cc1Cl 77458013 ASKJVCDKMXXPFC-UHFFFAOYSA-N 379.888 2.637 0 50 GFAA COc1ccc(NC(=O)Cc2c(C)[nH]c3ccccc23)cc1-n1nnnc1C 363372677 SEYDMNNTVGDFMP-UHFFFAOYSA-N 376.420 2.950 0 50 GFAA Cc1ccc(CN(C)C(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)o1 71748077 VUVVFMYEFPHXDI-SFHVURJKSA-N 387.524 2.659 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N[C@@H](c1ccccc1)c1ccccn1 72478679 KHTNVDDKGCLGFQ-QFIPXVFZSA-N 375.476 2.610 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C[C@@H]2OCCc3ccccc32)cc1 129658627 DMDPXNGJHNGCKK-JXFKEZNVSA-N 387.501 2.978 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)[C@H]3C[C@@H]3c3cccnc3)cc(Cl)c2O1 127368158 ZGEQMSSRRRYPOO-KMUNFCNLSA-N 392.864 2.667 0 50 GFAA COc1nc2c(cc1CNC(=O)c1c(C)noc1C)C(=O)N(C1CCCC1)C2 71765480 QVJJXMQJXYLOPG-UHFFFAOYSA-N 384.436 2.523 0 50 GFAA CC(C)(C)c1ccc([C@@H](CC(=O)O)NC(=O)Cn2c(=O)[nH]c3ccccc32)cc1 236695170 CILPEAGYWNGLNL-QGZVFWFLSA-N 395.459 2.959 0 50 GFAA Cc1cc(OCC(=O)O)ccc1NC(=O)[C@H](NC(=O)Cc1ccccc1)C(C)C 262943313 HYRKGJJQTYMURV-OAQYLSRUSA-N 398.459 2.780 0 50 GFAA Cc1c(C(=O)O)cnn1C1CCN(C(=O)c2cc(-c3ccccc3)[nH]n2)CC1 263092622 DTDURWXHEFVHJV-UHFFFAOYSA-N 379.420 2.757 0 50 GFAA COc1ccc([C@@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)cc1 130669661 FLHAVYAXFZGUTQ-IBGZPJMESA-N 391.493 2.769 0 50 GFAA Cc1nc(CN2CCN(C(=O)c3ccc(-c4cccc(O)c4)cc3)CC2)no1 426396088 ZNVIFQKENABXPY-UHFFFAOYSA-N 378.432 2.709 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@]3(CCN(CCN4CCOCC4)C3)C2=O)cc1 426485748 MVHJMZUSWOLJIG-DEOSSOPVSA-N 399.579 2.957 0 50 GFAA Cc1cc(OC[C@@H](O)CNC(=O)NCC(C)(C)N2CCCC2)ccc1Cl 426422033 TYEPLQHPYNNCOA-HNNXBMFYSA-N 383.920 2.562 0 50 GFAA Cc1nc(C(=O)N[C@@H](C)c2ccccc2Cl)nn1-c1nnc(C(F)(F)F)[nH]1 174895384 MCOHTJDCDIGPMV-ZETCQYMHSA-N 399.764 2.857 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@@H]4CCN(C)C4)csc3C2)nc1 426369447 WPJOKVUTEGNNRN-QGZVFWFLSA-N 384.549 2.698 0 50 GFAA O=C(CCc1cccnc1)N[C@H]1CN(C(=O)c2ccc(F)cc2)C[C@@H]1C1CC1 95353219 XTLINCSFYFSMDD-UXHICEINSA-N 381.451 2.820 0 50 GFAA CC(C)c1nnc(CN2CCC[C@]3(CCC(=O)N(Cc4ccccn4)C3)C2)o1 92028838 VCWNCBGYKYVWGH-NRFANRHFSA-N 383.496 2.993 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2c(C)noc2C)C3=O)cc1 91818797 VKVONAQCWJOEQF-DLBZAZTESA-N 383.448 2.563 0 50 GFAA CC(C)N1CCC[C@@]2(CCN(C(=O)c3cc(=O)[nH]c4ccc(F)cc34)C2)C1=O 91644158 HBCPNGOHYDZPNF-NRFANRHFSA-N 385.439 2.530 0 50 GFAA Nc1cc(N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C2CC2)C3)ncn1 91586182 LLHFFQYLYLDXBP-GOSISDBHSA-N 377.492 2.824 0 50 GFAA CCn1nc(C)c(CC(=O)N2CCOC[C@H]2c2nc(-c3ccccc3)no2)c1C 294832697 YOACWNTWBVAEFP-SFHVURJKSA-N 395.463 2.712 0 50 GFAA COC(=O)c1cn(Cc2nc3ccccc3n2CC(C)C)cc2c(=O)[nH]nc1-2 263588289 RGMIFKAMWYFTFZ-UHFFFAOYSA-N 379.420 2.517 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)C(=O)NCC[C@@H](C)N1CCOCC1 534672435 CTFREAQTLLDJCZ-QGZVFWFLSA-N 387.528 2.556 0 50 GFAA C[C@H](C(=O)N(CCN1CCOCC1)Cc1ccco1)n1cnc2ccccc21 457033175 WYLNWTCBXFIHDO-QGZVFWFLSA-N 382.464 2.551 0 50 GFAA CC(=O)N[C@H]1CCN(C(=O)c2cccc(-c3ccc(N(C)C(C)=O)cc3)c2)C1 299790769 CBUFSCLWCJHVGN-FQEVSTJZSA-N 379.460 2.687 0 50 GFAA O=C(Nc1cc(N2CCCC2=O)ccc1F)c1ccc(Cn2ccnn2)cc1 1355008116 TZXYLLAZGGJDNS-UHFFFAOYSA-N 379.395 2.845 0 50 GFAA O=C(c1ccco1)N1CCC2(CC1)CN(c1ncc(Cl)cc1F)CCO2 952970571 ALRSEJCVUQGDIJ-UHFFFAOYSA-N 379.819 2.979 0 50 GFAA COCCN(CCOc1ccccc1F)C(=O)[C@H]1CC(=O)OC12CCCC2 952868097 BLCSOGNSURONFG-OAHLLOKOSA-N 379.428 2.555 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)cc1 952983751 RAFUCZXBAQXWTJ-UHFFFAOYSA-N 378.411 2.792 0 50 GFAA C[C@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 192566466 HBVPHAXSOXGVAQ-QRWLVFNGSA-N 398.434 2.729 0 50 GFAA CC1(C)C(=O)Nc2ccc(S(=O)(=O)Nc3nnc(CC4CCCC4)o3)cc21 194900157 YDWRZCMVSPKPMH-UHFFFAOYSA-N 390.465 2.833 0 50 GFAA NC(=O)[C@@H]1CC=CC[C@H]1NCc1cc(-c2cccs2)ccc1OCC(=O)O 1506399002 VNEMPIBVAZNTEA-HZPDHXFCSA-N 386.473 2.788 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(-c4ccccc4Cl)o3)C[C@@H]2O)CC1 206866252 ZJJCRQUAHUCQPE-PMACEKPBSA-N 389.927 2.783 0 50 GFAA CC(C)CCN1CCNC(=O)[C@H]1CC(=O)N(C)Cc1ccc(C(F)(F)F)cc1 11843094 WEWXEKZRXPFBDC-QGZVFWFLSA-N 399.457 2.900 0 50 GFAA CC[C@H](COC)NC(=O)c1cnn(-c2ncc3c(n2)-c2ccccc2CC3)c1C 12048013 RZQMEPYKLRTAHJ-QGZVFWFLSA-N 391.475 2.891 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NC(=O)CN2CCCC2=O)cc1 12051243 ZMAZDZZREIVGJK-GOSISDBHSA-N 380.492 2.933 0 50 GFAA COC(=O)CCC(=O)N1CCC2(CC1)C[C@H]2C(=O)Nc1ccc(SC)cc1 12129072 MNQUJGOBPHIXQE-INIZCTEOSA-N 390.505 2.929 0 50 GFAA C[C@@H](CN1CCc2nnc(CCNC(=O)c3ccco3)n2CC1)c1ccccc1 12279003 BCHNYFZXJUCBKA-KRWDZBQOSA-N 393.491 2.505 0 50 GFAA COc1ccc(CN2CC(=O)N(C3CCCCC3)C[C@H](O)C2)c(Cl)c1OC 14530512 NHGHEHZRCQJFNB-MRXNPFEDSA-N 396.915 2.695 0 50 GFAA O=C(c1cc(COc2ccccc2)on1)N1CCN(Cc2ccccn2)CC1 19744137 IUBCRFCQUNACKL-UHFFFAOYSA-N 378.432 2.607 0 50 GFAA CSCC[C@H](CO)NC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1 155008098 PFASVGDQUVFJEJ-CQSZACIVSA-N 388.468 2.646 0 50 GFAA O=C(c1ccc(F)cc1)N1CCC[C@@]2(CN(Cc3nccs3)CC[C@H]2O)C1 1857683385 WKOYXVIBJLKGBD-YLJYHZDGSA-N 389.496 2.771 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2C[C@@H]3C[C@H](C2)[C@@H]2CCCCN2C3)cn1 1857695339 FNMAZBVVTNRTFI-LMMKCTJWSA-N 380.492 2.827 0 50 GFAA CN(C)C(=O)C[C@H]1CN2C[C@H](n3ccnc3-c3ccc4[nH]ccc4c3)C[C@H]2CO1 1857730485 TYIHDMJXJMFOPO-QYZOEREBSA-N 393.491 2.524 0 50 GFAA Cn1ccc([C@H](NC(=O)N2CCCc3c(cnn3C)C2)c2ccc(F)cc2)n1 413428643 QKXAHQGWKVTUND-LJQANCHMSA-N 382.443 2.540 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)[C@@H]2CCCN2C(=O)NC(C)C)CC1 125797817 PVFGSGITNWBASB-FQEVSTJZSA-N 386.540 2.658 0 50 GFAA C[C@@]1(O)CCOC2(CCN(Cc3cc(C(F)(F)F)ccc3F)CC2)[C@H]1O 1704300759 ZEGHBAXJSBQCGN-JKSUJKDBSA-N 377.378 2.711 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)[C@@H](O)c3ccc(Cl)cc3F)CC2)s1 813418814 UUJIYYJDHHFBAE-INIZCTEOSA-N 396.871 2.867 0 50 GFAA O=S(=O)(c1ccsc1C(F)(F)F)N1C[C@@H](O)[C@H](Cc2ccccc2)C1 1875396349 CMTUZQPLKDKPBT-CHWSQXEVSA-N 391.436 2.991 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@@H](CCC(=O)OC(C)(C)C)C2)CC1 1875365828 MYORTNZADLFTLX-INIZCTEOSA-N 378.513 2.772 0 50 GFAA NC(=O)C[C@H]1CC[C@H](CNC(=O)c2cn3cccc(Br)c3n2)CC1 1875329129 GXHNTPWBOOAWDF-HAQNSBGRSA-N 393.285 2.508 0 50 GFAA CC(C(=O)N1CC2(CCN(C(=O)c3ocnc3C)CC2)[C@@H]2COC[C@@H]21)=C1CCC1 1775997098 VJFQSALQMSTYJE-MSOLQXFVSA-N 399.491 2.563 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N(C)Cc3nc4ccccc4n3C)cn12 2100545128 QCLHCGHMXRLMRE-LJQANCHMSA-N 392.463 2.578 0 50 GFAA Cc1nccc(CCC(=O)N[C@@H](C)CN(C)C(=O)C/C=C/c2ccc(F)cc2)n1 2325793370 ROGMAGOCYZETFK-APHBUQMISA-N 398.482 2.923 0 50 GFAA Cc1nc2ncnn2c(N(C)CCN(C(=O)[C@@H]2CCCC23CC3)C(C)C)c1C 2325793854 KBDDFPAEKRBCSY-KRWDZBQOSA-N 384.528 2.995 0 50 GFAA CC(=O)N[C@@H](CC(=O)Nc1cccc2c1NC(=O)CO2)c1ccc(F)cc1F 1462384278 INPJSEVKIVWGHO-HNNXBMFYSA-N 389.358 2.502 0 50 GFAA COc1ccc(C[C@]2(O)C(=O)Nc3ccc(Br)cc32)cc1OC 780322 DEWLINGAFLJUOP-QGZVFWFLSA-N 378.222 2.849 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1CCN(C(=O)c2ccccc2F)CC1 782989 SPGQHVSGRWYMHN-UHFFFAOYSA-N 376.815 2.843 0 50 GFAA Cc1cccc2c(=O)oc(-c3ccc4c(c3)C(=O)N(C[C@H]3CCCO3)C4=O)nc12 1123279 HAAWQHNQRSWMLW-CQSZACIVSA-N 390.395 2.938 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CCC(=O)NC1=NCCS1 2778491 YCIDEPSPHIRWNR-UHFFFAOYSA-N 385.209 2.582 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1)c1cccs1 2756005 QFKAJPAXVLDNIG-UHFFFAOYSA-N 382.445 2.659 0 50 GFAA COc1ccc([C@@H]2N[C@H](C(=O)O)Cc3c2[nH]c2ccccc32)c(OC)c1OC 4012432 NEEYWOPERFZLCV-RDJZCZTQSA-N 382.416 2.882 0 50 GFAA biogenic O=C1N[C@@H]2CN(CCc3ccc4ccccc4c3)CC[C@@H]2N1C1CCNCC1 420396367 DCDCNHCVWJUADE-YADHBBJMSA-N 378.520 2.602 0 50 GFAA COc1cccc(NC(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c1 64800364 ZWNSNFFVOHJIGT-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3N=C(C(F)F)C[C@@]3(O)C(F)F)o2)n1 654143 HAWNSNAZLNDWFS-MRXNPFEDSA-N 388.321 2.562 0 50 GFAA CC1=NN(C(=O)c2ccn(COc3cccc(Cl)c3)n2)[C@@](O)(C(F)F)C1 6395366 DITVXOMFGKTSNJ-INIZCTEOSA-N 384.770 2.749 0 50 GFAA Nc1ccnc(N2CCC(Cc3ccccc3C(F)(F)F)(C(=O)O)CC2)n1 71749453 NRCYHHUDOILBFS-UHFFFAOYSA-N 380.370 2.992 0 50 GFAA O=C(c1cccc2[nH]ccc12)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328616269 BNFGHRXDHAUKSR-LJQANCHMSA-N 377.448 2.772 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@H]1CCCCN1C(=O)c1ccccc1 363128465 QTHQYFHSRPYXFR-FOIQADDNSA-N 382.508 2.779 0 50 GFAA CCN(C(=O)c1cc2n(n1)CCO2)[C@@H](c1cccnc1)c1ccc2c(c1)CCO2 365953762 RQHUJCHVBMOFBM-OAQYLSRUSA-N 390.443 2.857 0 50 GFAA O=C(Nc1cncc(Br)c1)c1cc(N2CCNC2=O)c(F)cc1F 156181451 GOVNQZHUBUYZLU-UHFFFAOYSA-N 397.179 2.904 0 50 GFAA CO[C@H](CNC(=O)c1ccc(-n2nc(C)c(CCC(=O)O)c2C)cc1)C(C)C 262428068 RLROMJOGMQEIDO-LJQANCHMSA-N 387.480 2.907 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CCN2CCC(O)CC2)c2ccccc2)cc1 130689609 RJLRCOQKLMUPBN-NRFANRHFSA-N 388.533 2.861 0 50 GFAA COc1ccc(N2C[C@H](C)N(C(=O)c3csc(SC)n3)CC2=O)cc1 82166377 BMSAYBQLPYJEGJ-NSHDSACASA-N 377.491 2.751 0 50 GFAA O=C(NCCN1CCC[C@@H](c2ccccc2)C1)N1CCN(c2ccncc2)CC1 426530378 GEURJJPLQHNEHY-OAQYLSRUSA-N 393.535 2.793 0 50 GFAA CCCc1nc2ccccc2n1[C@@H](C)C(=O)NCc1cc2n(n1)CCCNC2 82120133 SPZLGXCRGDAOCO-HNNXBMFYSA-N 380.496 2.556 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Nc1cc(Cl)ccc1Cl 239248022 XWOIEBCMEHRJBZ-NRULLWLTSA-N 391.254 2.985 0 50 GFAA O=C(c1cc(-c2ccccc2O)n[nH]1)N1CCN(c2ncccc2Cl)CC1 95357020 ZFGLHESPYHMONG-UHFFFAOYSA-N 383.839 2.793 0 50 GFAA CN(C)C(=O)CCc1cccc(NC(=O)N2CCC[C@@H](Cn3ccnc3)C2)c1 96131756 DJUGMMQJGFUIEH-SFHVURJKSA-N 383.496 2.848 0 50 GFAA O=S(=O)(c1cccs1)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95512759 BOKHDQMSJMCAHL-OAHLLOKOSA-N 388.518 2.956 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)[C@@H]1CCCN1C(=O)c1ccccc1 177432843 UQTGPTRQBDUFFV-WMZOPIPTSA-N 398.894 2.735 0 50 GFAA CCc1noc(-c2ccccc2NC(=O)N2CCC[C@@]3(CN(C)C(=O)O3)C2)n1 96164787 MPBJGZNQEZADMX-LJQANCHMSA-N 385.424 2.748 0 50 GFAA CN(C)Cc1cccc(CN2C[C@H]3CN(C4CCCCC4)C[C@@]3(C(=O)O)C2)c1 96180752 PLBUPMZKNZEGLO-REWPJTCUSA-N 385.552 2.899 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)NCc1nc(C)cc(C(F)(F)F)n1)CC(=O)N2 91677808 KVCXVWDWVGCOBN-LBPRGKRZSA-N 394.353 2.555 0 50 GFAA Cc1ccc(-c2nc(C(=O)N3CCN(c4cnn(C)c4)C(=O)C3)cs2)c(C)c1 177843838 ALWRGMAJERYVNJ-UHFFFAOYSA-N 395.488 2.649 0 50 GFAA COc1cccc(-n2cc([C@@H](C)NC(=O)N3CCc4nc(C)[nH]c4C3)cn2)c1 534672553 MTFRGCIVTOUKSC-CYBMUJFWSA-N 380.452 2.741 0 50 GFAA O=C(NC[C@H](Cc1ccccc1)C(=O)O)c1cc(N2CCCC2=O)ccc1F 299750549 NUTOOCRXPFQZPG-HNNXBMFYSA-N 384.407 2.626 0 50 GFAA Cn1cccc1-c1nnc2ccc(C(=O)N3CCC(N4CCCCC4)CC3)cn12 1940194997 HNPMKBBFIDDULB-UHFFFAOYSA-N 392.507 2.825 0 50 GFAA COCCn1c(C(=O)OC)c(NC(=O)CCc2ccccc2)c2cc(N)cnc21 299784673 KISXGRUZADCJIJ-UHFFFAOYSA-N 396.447 2.623 0 50 GFAA Cc1nc[nH]c1C(=O)NC[C@H]1CCCN(Cc2ccc3c(c2)OC(F)(F)O3)C1 828132196 SZSWPULWTNGSHE-CQSZACIVSA-N 392.406 2.682 0 50 GFAA Cc1sc2nc(CCNC(=O)[C@@H]3COc4ccccc4O3)nc(O)c2c1C 670460161 FHVJUSBOTVORPK-AWEZNQCLSA-N 385.445 2.512 0 50 GFAA O=C(NCc1ccc2nsnc2c1)C12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 670460444 PTWPPTBCTWPENT-JNKARSBBSA-N 394.504 2.895 0 50 GFAA Cc1cnc(-c2cccc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)c2)nc1N(C)C 1076075025 AXPINUPBENUIBG-MOPGFXCFSA-N 379.508 2.827 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)c1cnn(-c2ccccc2OC)c1 952978000 WTPHBDDIOPBEFX-UHFFFAOYSA-N 378.432 2.812 0 50 GFAA COCC(=O)Nc1cc(NC(=O)[C@@H](c2ccc(C)cc2)N(C)C)ccc1OC 952964343 LKRXHFAJQCCAPN-HXUWFJFHSA-N 385.464 2.830 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)cc1 268937426 HPSFBVMQKSECPG-GOSISDBHSA-N 387.457 2.520 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CCCN(c3ccc4nnc(C5CC5)n4n3)C2)n1 301151475 KKHKOMVYSAZXKC-OAHLLOKOSA-N 377.452 2.560 0 50 GFAA C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(I)cc2)C1 16192491 SLWTVRZAOGZOSR-PHIMTYICSA-N 379.263 2.958 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2ccc(F)c(F)c2)cc1OC 1529110868 TYEUSASVINVXBP-WOJBJXKFSA-N 379.403 2.916 0 50 GFAA COc1ccc(NC(C)(C)C(=O)N2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)cc1 1704312354 JEQVCWCGRLAQPY-BEFAXECRSA-N 387.480 2.898 0 50 GFAA Cn1ccnc1CN1C[C@H]2CN(c3cnccn3)C[C@]2(CCc2ccccc2)C1 1772815478 SEZGBKLJEOQZEA-REWPJTCUSA-N 388.519 2.781 0 50 GFAA CC1(C)Cc2c(sc(NC(=S)NC(=O)c3ccccc3)c2C(N)=O)CO1 5063736 UUXKKENMVVMVLU-UHFFFAOYSA-N 389.502 2.825 0 50 GFAA O=C(CCCn1cncn1)N1CC[C@]2(CCCN(CCc3ccccc3)C2)C1 12023280 WMVIYFIJEOCHOG-QFIPXVFZSA-N 381.524 2.616 0 50 GFAA CO[C@H](C(=O)NC[C@@H]1Cc2cccc(-c3cncnc3)c2O1)c1ccccc1 12122836 GAIMSRDWOMKUTL-RXVVDRJESA-N 375.428 2.951 0 50 GFAA COc1ccc(CN(C)Cc2ccccn2)cc1OC[C@@H](O)CN1CCCCC1 12318800 QFPZOOJIYGOKMB-NRFANRHFSA-N 399.535 2.948 0 50 GFAA Cc1ccc(-n2ncc3c2CCC[C@H]3NC(=O)CCN2CCCC2=O)cc1C 12443042 YGTHGHLICVIMQI-LJQANCHMSA-N 380.492 2.995 0 50 GFAA O=S(=O)(c1ccc(F)cc1F)N1CCC[C@@](CO)(Cc2ccccc2)C1 12458494 YQIZXDHTFIZYLH-LJQANCHMSA-N 381.444 2.971 0 50 GFAA COc1ccc2cc(C(=O)[C@@H]3CCCN(C(=O)CCn4cncn4)C3)ccc2c1 14981027 HAELNPJSSDYPGK-LJQANCHMSA-N 392.459 2.952 0 50 GFAA Cc1ccc(C(=O)N2CCCC[C@H]2CCn2cc(C(=O)NC3CC3)nn2)cc1 14997349 QQTRMIYIOVNAKN-SFHVURJKSA-N 381.480 2.564 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cn(C)c4ccccc34)C[C@@H]2CCO)CC1 19731242 OVRIJMIJXVOYRH-QFIPXVFZSA-N 398.595 2.920 0 50 GFAA COc1cccc(CN2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1 19789380 RIVNFBYLBZVFNS-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)Cc4ccc(C)cc4)nnc3c2)n1 169780332 XZDVLKGOMONXHO-UHFFFAOYSA-N 376.420 2.509 0 50 GFAA Cc1noc(C)c1C(=O)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)N(C)C)C2 1857673760 WWXHNRSOCLYTSK-NJNPRVFISA-N 381.476 2.986 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ccc4sc(=N)[nH]c4c3)C1)CC2 1857698024 FAJLQZAOELOMMT-FQEVSTJZSA-N 395.488 2.633 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(Cc3ccc(S(C)(=O)=O)cc3)CC2)O1 1857700227 DUWMURDCLDQVNT-IEBWSBKVSA-N 381.538 2.621 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)N3CCN(c4ccc(F)cn4)[C@H](C)C3)c2n1 1857708771 MQFMSPGXTJSGQO-CQSZACIVSA-N 382.443 2.540 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)cnc1C 1857722475 WGLBJMWQWXUYGZ-SFTDATJTSA-N 397.523 2.500 0 50 GFAA CCCC(=O)N1CC(=O)N2[C@@H](C[C@H](C(=O)N3CCCCC3)[C@@H]2c2ccccc2)C1 1857723012 SSNYSLWHLCSPRN-IPJJNNNSSA-N 397.519 2.600 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)c2cccc(Cn3nc(C)cc3C)c2)C[C@H]1O 1857734139 LHMAUXAABNNXIZ-IFMALSPDSA-N 385.508 2.534 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4cc[nH]n4)C3)nc2c1 1857739892 XMTDHJKCWSWJAD-CQSZACIVSA-N 383.452 2.525 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)CCC(F)(F)F)[C@H]4CC[C@]3(C2)O4)ccn1 1875243735 UXDOHGWJKSXIMY-BVIKNXMNSA-N 383.414 2.833 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N[C@H](CN)CC(C)C)cc1Cl 237076807 LVLMGDMUDUBHMA-VIFPVBQESA-N 399.738 2.763 0 50 GFAA Cc1nn(-c2ccccc2F)c(C)c1[C@@H]1COCCN1C(=O)c1n[nH]c(C)c1O 952887017 HBLJUSHBMOQNHA-INIZCTEOSA-N 399.426 2.579 0 50 GFAA CC(C)(C)c1ccc([C@H]2CN(C(=O)c3nn[nH]c3C(F)(F)F)CCN2)cc1 1875321331 DTBKETYAZQADMQ-CYBMUJFWSA-N 381.402 2.908 0 50 GFAA CC[C@@H](CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(C)s2)C1)c1ccccc1 1875305443 RETCQSVGQWQGGC-CGTJXYLNSA-N 386.517 2.942 0 50 GFAA CN(C(=O)c1ccccc1OC[C@H]1C[N@@]1Cc1cnn(C)c1)c1ccccc1 1875385100 MRAGOCZAWOMNAB-NIYFSFCBSA-N 376.460 2.960 0 50 GFAA CONC(=O)C1CCN(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)CC1 878443867 UIRPHFBWXDODBP-MRXNPFEDSA-N 391.468 2.556 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)C2Cc3ccccc3C2)CCCCN1 2100533002 UETCHDFPOVJESC-JOCHJYFZSA-N 397.563 2.775 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1SCC(=O)Nc1nn(C)c2c1CNCC2 2325769130 JSGLCYMWCNFFMQ-UHFFFAOYSA-N 396.520 2.599 0 50 GFAA O=C(OCc1ccc(-n2ccnc2)cc1)c1cnc(OC2CCOCC2)cn1 2325816245 LTNDGNNAOBRSCC-UHFFFAOYSA-N 380.404 2.577 0 50 GFAA N[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2n[nH]c3c2COCC3)cc1 2325857996 XDUVYQQJKHOEGH-GOSISDBHSA-N 380.423 2.797 0 50 GFAA CCOC(=O)C1CCN(C(=O)COc2ccc(C)cc2Br)CC1 1120514 KXBVWWULIVWPHG-UHFFFAOYSA-N 384.270 2.938 0 50 GFAA COc1ccc(C)cc1NC(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C 1141821 LARITTCWUVENQM-UHFFFAOYSA-N 376.478 2.846 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccn2c(=O)c3c4c(sc3nc12)CCCC4 4971746 URKDAHHOKUMXCD-GFCCVEGCSA-N 383.473 2.697 0 50 GFAA O=C(NCc1ccccn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 6709917 UWVBDUGQDGXMSW-UHFFFAOYSA-N 393.896 2.840 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccccc3C)CC2)c1 6714740 LYAMMNGHGVKHDM-UHFFFAOYSA-N 376.478 2.523 0 50 GFAA CCCCn1c(CN2CCC[C@@H](OC)C2)cnc1S(=O)(=O)CC1CCC1 59311981 HLBBYXVQDLHJNY-GOSISDBHSA-N 383.558 2.868 0 50 GFAA Cc1cccn2cc(Cn3c(=O)n(CC4CC4)c4ccc(C(=O)O)cc43)nc12 55099713 FXZODZKYSUHFGA-UHFFFAOYSA-N 376.416 2.916 0 50 GFAA Cc1n[nH]c(C)c1[C@@H](NC(=O)c1ccccc1OC(F)(F)C(F)F)C(=O)O 67934635 BXAWGFWVQGABAI-GFCCVEGCSA-N 389.305 2.819 0 50 GFAA CN(C)c1ccnc(NC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)n1 432372577 IGUOJMPKRVBUNW-UHFFFAOYSA-N 394.401 2.916 0 50 GFAA Oc1cc(-c2cccc(Cl)c2)cc2c1OCCN(CCCn1cnnn1)C2 67841377 DTPSDONVFLWZGD-UHFFFAOYSA-N 385.855 2.984 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@H](N2CCN(c3ccccc3)CC2)C1 67803390 RLTYYQWBPGZELX-QFIPXVFZSA-N 378.520 2.827 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(c3ncnc4ccsc34)CC2)C1 71615081 LAXQJAAQGLMYGH-CQSZACIVSA-N 385.537 2.651 0 50 GFAA CCCn1nccc1C(=O)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72163596 HXEZPZZFUPNIJV-SFHVURJKSA-N 376.460 2.977 0 50 GFAA CC[C@@H]1CCCCN1C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 16211362 SNGMROJSXOCMPC-MRXNPFEDSA-N 397.566 2.669 0 50 GFAA Cc1nc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)sc1C 71614468 RLKGGBMYFICRAE-MRXNPFEDSA-N 376.570 2.715 0 50 GFAA O=C(c1nn(-c2ccccc2F)cc1O)N1CCC(OC[C@H]2CCCO2)CC1 176398497 JDOUOLHDPCIDCQ-OAHLLOKOSA-N 389.427 2.517 0 50 GFAA Cc1nn(C)cc1-c1ccnc(N2CCC[C@H]2c2nc(-c3cccnc3)no2)n1 48221841 ZNQVGMRCTXBVDE-KRWDZBQOSA-N 388.435 2.972 0 50 GFAA CC(C)c1nc([C@H]2CCCN2C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)no1 177531393 VEJRYRTVSOSXML-SOUVJXGZSA-N 377.489 2.829 0 50 GFAA O=C(CN1CCCS1(=O)=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 194104092 IPAXJXMEMWLJPO-CQSZACIVSA-N 377.293 2.692 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccc(CSC)o3)C2)CCC1=O 91951879 NNLRUPYFICXLPG-IBGZPJMESA-N 380.510 2.634 0 50 GFAA Cc1nn(CCNC(=O)[C@@]2(C)CC[C@@H](C(=O)N(C)C)C2(C)C)c(C)c1Cl 91973775 ZVPZPKYYDIFFND-IFXJQAMLSA-N 382.936 2.800 0 50 GFAA CN(C)C[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn(C)n2)c1 97675300 FZJVUJAEFHJCCU-SFHVURJKSA-N 379.468 2.644 0 50 GFAA Cn1ccnc1[C@@H](O)C1CCN(c2nncc(-c3ccc(Cl)cc3)n2)CC1 23398941 DBCCQLQQYUMPTK-KRWDZBQOSA-N 384.871 2.876 0 50 GFAA COc1ccccc1CN(C)C(=O)[C@H]1CCC(=O)N(CCc2ccccn2)C1 91858995 ZBXOXCUYKCYZKK-SFHVURJKSA-N 381.476 2.530 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)c3cncnc3C)C2)cc1 95504477 ONYJVPIPAFHVFP-LJQANCHMSA-N 382.508 2.820 0 50 GFAA CC(C)SCC(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91943463 AVGXSEAZBNZETM-UHFFFAOYSA-N 375.538 2.954 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](NC(=O)c2cc(C)oc2C)CN1C1CCCC1 96136593 FWKSBHPDKPHGOG-LPHOPBHVSA-N 375.513 2.880 0 50 GFAA C[C@@H](N)C(=O)N1CCC(Oc2cc(Cl)ccc2C(=O)N2CCCCC2)CC1 95519302 VGPCKMAKBYGJOI-CQSZACIVSA-N 393.915 2.683 0 50 GFAA Cc1nn(C)c2nc(N(Cc3ccccc3)[C@@H]3CCS(=O)(=O)C3)sc12 95497974 UTGVVMINVYJJSN-CQSZACIVSA-N 376.507 2.532 0 50 GFAA O=C(NCc1noc(Cc2cccs2)n1)[C@@H]1CCCN(Cc2ccco2)C1 95510081 KHDDICDBQGUFBK-CQSZACIVSA-N 386.477 2.843 0 50 GFAA CNS(=O)(=O)c1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)nc1 296555866 CDVPWMXTMHCJJR-KRWDZBQOSA-N 386.477 2.749 0 50 GFAA C[C@H](NC(=O)N1CCNC(=O)C[C@@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1 182934152 AZRWXOCRMPWFDK-FBBABVLZSA-N 398.551 2.912 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N(C)Cc2nncn2C(C)C)cc1 534642955 XBZDQRVDSJDTBB-UHFFFAOYSA-N 383.456 2.599 0 50 GFAA CCn1cnnc1CCNC(=O)N1CCC[C@H](c2nc3ccc(C)cc3[nH]2)C1 534645434 SRZIXOAVHYCDNS-HNNXBMFYSA-N 381.484 2.614 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)NCCCN1CCCC[C@H]1CO 670471632 MMCRMRUERNMVTO-HNNXBMFYSA-N 381.904 2.655 0 50 GFAA Cc1ncnc2c1C[C@H](C(=O)N1CCC[C@H](CN(C)Cc3cccnc3)C1)CC2 1875290673 WMKDDTKNWPFEHD-WOJBJXKFSA-N 393.535 2.656 0 50 GFAA Cc1nn(C)c(C)c1C(=O)Nc1ccc(NC(=O)c2c(C)nn(C)c2C)cc1 1875278499 FRFNQLAEKIMMAE-UHFFFAOYSA-N 380.452 2.892 0 50 GFAA CC(=O)N1CCC[C@H](CNC(=O)N[C@@H](Cc2ccccc2)Cc2cccnc2)C1 1875288945 MECMNZBJYDYRCL-YADHBBJMSA-N 394.519 2.793 0 50 GFAA C[C@@H]1CCCc2cc(C(=O)Nc3ccc(N4CCC(N(C)C)CC4)cn3)nn21 1875306614 MFBVAXFKSUCWFJ-OAHLLOKOSA-N 382.512 2.958 0 50 GFAA Cc1cc(C)nc(N2CCC[C@@H](C(=O)NC[C@H]3CCCN4CCCC[C@@H]34)C2)n1 888103788 ZALXBUPLKWCELC-AQNXPRMDSA-N 385.556 2.691 0 50 GFAA O=C(N[C@@H]1CCN(c2cnnc(O)c2Cl)C1)c1cc(C(F)F)ccc1F 890992798 CRTDBBAOTMFLSQ-SECBINFHSA-N 386.761 2.921 0 50 GFAA Cc1cc(C2(C(=O)Nc3ccc(F)c(N4CCOCC4)c3)CCOCC2)on1 888100605 REZCXOBXTAAMSB-UHFFFAOYSA-N 389.427 2.646 0 50 GFAA C[C@@H](O)[C@](C)(CNC(=O)CCN1C(=O)COc2ccccc21)Cc1ccccc1 170611685 IXROESUSKBHBAA-HXOBKFHXSA-N 396.487 2.548 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)C(C)(C)C)C(C)C)[C@@H]1Oc1ccccc1 409948576 BSSGKOHVPZVPCR-MANSERQUSA-N 390.524 2.915 0 50 GFAA CCOC(=O)N[C@H](C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)C(C)C 225446731 CGRIRXFRWAPVDJ-WFXMLNOXSA-N 394.487 2.786 0 50 GFAA CN1CCC(N(c2ccccc2)S(=O)(=O)c2cccc3c2OCCO3)CC1 191948876 PYRFMEUGGCQFGH-UHFFFAOYSA-N 388.489 2.747 0 50 GFAA Cc1cc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)ccc1-n1cncn1 192355793 KSNYNCOEZVTFJS-QFIPXVFZSA-N 391.519 2.956 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCC2(c3ccccc3F)CCCC2)C1 1506413149 HHDQOOJUPVOQOG-INIZCTEOSA-N 384.517 2.830 0 50 GFAA Cc1nc(N2CCC[C@H](CNC(=O)Cc3cccnc3)C2)nc2c1CCCC2 1506424182 ZEEKQIDFIMUKRC-GOSISDBHSA-N 379.508 2.634 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)CCC(=O)Nc2cccc(O)c2)C[C@@H]1O 212035071 WAUCDJDPNUBYEK-IRXDYDNUSA-N 388.489 2.858 0 50 GFAA COc1cc(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)ccc1C 1704338439 AJIRBENJLAMNDC-DENIHFKCSA-N 383.444 2.524 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)[C@@H](C)Oc1ccc(F)cc1Cl 1704315878 PZRSOJMZGGZSGQ-CYBMUJFWSA-N 382.867 2.868 0 50 GFAA O=S1(=O)CC[C@H](OCCOc2cccc(-c3cnc4ccccc4n3)c2)C1 1775979478 IPPZCIIOFPIQNL-KRWDZBQOSA-N 384.457 2.879 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CN(c2ccc(CN3CCCC3)cn2)CC[C@@H]1O 1772700966 HMJWYPXFKJATBN-REWPJTCUSA-N 395.503 2.562 0 50 GFAA CCN1C[C@H](CN(C)Cc2nc(-c3ccc(C(=O)OC)cc3)oc2C)CC1=O 11662494 SLBLQSJIEAFSTI-HNNXBMFYSA-N 385.464 2.737 0 50 GFAA O=C(c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)N1CCC(O)CC1 11753463 XQJMNDMCNGIQQT-UHFFFAOYSA-N 395.503 2.722 0 50 GFAA C[C@@H](O)CNC(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 11878711 SSJZYMHEBWYYEC-GOSISDBHSA-N 382.504 2.883 0 50 GFAA C[C@]1(C2CCN(C(=O)C3CCC3)CC2)NC(=O)N(C2Cc3ccccc3C2)C1=O 12183870 VMFPVMZBMBNETQ-HSZRJFAPSA-N 395.503 2.503 0 50 GFAA CCN(CC)C[C@H](O)COc1cc(CN(C)Cc2cccnc2)ccc1OC 12307632 IEYHGOOZOVBFHN-FQEVSTJZSA-N 387.524 2.804 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4ccc(C)cc4)nnc23)n1 169776057 QWWDZLCVMLACBV-UHFFFAOYSA-N 376.420 2.970 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1c[nH]nc1-c1ccccc1)C2)c1cnccn1 1857670731 YCHBTLQCTKRGIU-YRWFTTLQSA-N 388.475 2.507 0 50 GFAA N[C@@H]1C[C@@H](C(=O)N2CCC(Oc3cccc(C(F)(F)F)c3)CC2)CC[C@H]1O 1857720665 DUQCVPFVTWLHHJ-JCURWCKSSA-N 386.414 2.564 0 50 GFAA CN(C)C(=O)CCNC(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857734975 ATQJTAGFMDPOJP-CYBMUJFWSA-N 392.887 2.682 0 50 GFAA CCc1cnc(N2C[C@@H]3[C@H](CNC(=O)c4cccs4)[C@H]4CC[C@]3(C2)O4)nc1 1857738419 HHCNMVWLIBOONB-QCBUCWTNSA-N 384.505 2.514 0 50 GFAA CCOC(=O)CC[C@@H](C)Sc1nc2cc(S(N)(=O)=O)ccc2n1CC 225794330 IFXLIMBGTUUBKE-LLVKDONJSA-N 385.511 2.528 0 50 GFAA COc1ccc([C@H](NC(=O)Cn2nnc(Cc3ccc(C)cc3)n2)C2CC2)cc1 241942319 ULORQQNXUXIPGP-JOCHJYFZSA-N 391.475 2.848 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccc(F)cc2OCC2CC2)co1 153105533 QCAWFESTKWVYCY-UHFFFAOYSA-N 382.413 2.710 0 50 GFAA COc1ccnc(CN2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)c1 2100555381 SYLOCKKKVZSVNS-RBBKRZOGSA-N 384.476 2.751 0 50 GFAA Cc1nc(C)c(CCNC(=O)N2CCN(c3ccc(F)cc3F)C(=O)C2)s1 2325827086 UURWEZVBBAFMSE-UHFFFAOYSA-N 394.447 2.639 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCC(c3nccc(C(F)(F)F)n3)CC2)C1 2325889198 DZDKETBTKXYFJV-CQSZACIVSA-N 396.413 2.626 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OC(C)C)[C@@H]1c1ccc(F)cc1 856669 XJTOZJAEUQGOBW-IKVWTGGYSA-N 394.439 2.769 0 50 GFAA O=C(c1cccn2cnnc12)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356146391 DELAHHWBKSLLLR-QFIPXVFZSA-N 389.459 2.527 0 50 GFAA CN(CC(=O)NCCc1ccccc1)S(=O)(=O)c1ccc2ccccc2c1 2863112 ORICAOKHEFBLQD-UHFFFAOYSA-N 382.485 2.819 0 50 GFAA CCOC(=O)c1cn2c(n1)N(S(=O)(=O)c1ccc(CC)c(CC)c1)CCC2 328593974 FKWXZUCYMMVBGF-UHFFFAOYSA-N 391.493 2.784 0 50 GFAA CCOc1cccc(NC(=O)CN(c2cccc(C(C)=O)c2)S(C)(=O)=O)c1 10294686 IVHCAIUZDBDHDM-UHFFFAOYSA-N 390.461 2.693 0 50 GFAA Cc1cc([C@H](C)NC(=O)NCCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc(C)c1F 121182634 WCNQIDZVEFKFLJ-OIDVLUPKSA-N 399.466 2.610 0 50 GFAA Cc1ccccc1OCCCN(Cc1cn2c(n1)CCCC2)S(C)(=O)=O 328618275 DNIKEVYWWYDROE-UHFFFAOYSA-N 377.510 2.759 0 50 GFAA Cc1ncccc1OC1(C(=O)N2CCc3c([nH]c4ccccc34)C2)CCNCC1 67588832 CUUHPKQIAAHMMY-UHFFFAOYSA-N 390.487 2.957 0 50 GFAA COc1ccc(C(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)cc1F 12716739 DGSIQUQSMOZDJK-UHFFFAOYSA-N 386.427 2.857 0 50 GFAA O=C(CCNC(=O)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21)N1CCCCCC1 333891900 YZRJWUFCODMCQI-MSOLQXFVSA-N 377.529 2.770 0 50 GFAA CN1C[C@@H]2C[C@H]1CN2c1nccc(C2(c3ccccc3Cl)CCNCC2)n1 72425177 XLDNUETXCXEEFZ-HOTGVXAUSA-N 383.927 2.692 0 50 GFAA COC(=O)c1nnn(Cc2ccccc2)c1NC(=O)Cc1c[nH]c2ccccc12 241965565 UTWTYPGSEGODRK-UHFFFAOYSA-N 389.415 2.776 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(CCCn2ccnc2)CCO3)n1 71278941 GEAIQCAPLLDYDP-UHFFFAOYSA-N 379.464 2.947 0 50 GFAA O=C(O)c1cc(-c2cccc(O)c2)cc(S(=O)(=O)NCc2ccccn2)c1 72141898 CMMZDGPXJVBAKA-UHFFFAOYSA-N 384.413 2.631 0 50 GFAA COC(=O)c1cccc(OCCN2CCC3(CC2)C[C@@H]3C(=O)N2CCCC2)c1 374479858 HUWBVKKZEDJBAJ-LJQANCHMSA-N 386.492 2.577 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)n[nH]1 71759579 YIWWMSBSLPSDMD-FQEVSTJZSA-N 395.551 2.711 0 50 GFAA CC(C)=C[C@@H]1[C@@H](C(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)C1(C)C 159041827 TYZXZUYETJRMTI-CABCVRRESA-N 375.450 2.780 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC(OC[C@H]2CCCO2)CC1 175373978 DBLZAZYZEUAYQP-OAQYLSRUSA-N 398.507 2.801 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)N[C@@H]1CCN(c2ncccc2F)C1 176211859 FLFLQADZKAWKOL-OAHLLOKOSA-N 381.411 2.954 0 50 GFAA CC(C)c1nc(C(=O)N2CCC[C@H](CCC(=O)N3CCOCC3)C2)cs1 14969733 SABOZNKDIVTGIT-OAHLLOKOSA-N 379.526 2.758 0 50 GFAA Cc1ccn(CCNC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)n1 426494383 LHYHERSNVCSJIY-UHFFFAOYSA-N 399.520 2.846 0 50 GFAA C[C@@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)Cc1cnc2ccccn12 82120293 HKDOIIHDUXXFFL-CQSZACIVSA-N 382.851 2.794 0 50 GFAA CC(=O)N1CCCn2nc(CNC(=O)Nc3c(C)cccc3Cl)cc2C1 82146669 WLHYDCQBJRVCQT-UHFFFAOYSA-N 375.860 2.919 0 50 GFAA NC(=O)c1ccccc1NCC(=O)N1CCC(c2noc3cc(F)ccc23)CC1 290920699 MNAGYZJQDLFINB-UHFFFAOYSA-N 396.422 2.884 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)nc(C)n3)CC2)cc1 82230461 GKPNGUDNDDIAJS-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Cc1cc2nc(CCC(=O)N[C@H]3CCCN(c4cnccn4)C3)[nH]c2cc1C 426723855 JASCKJHKGAHPBA-INIZCTEOSA-N 378.480 2.688 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N[C@H](CC(N)=O)c1ccc(Cl)cc1 1445245409 WTZRLRDZLBLLCQ-CYBMUJFWSA-N 390.871 2.788 0 50 GFAA Cc1nc(CC2CCN(C(=O)N[C@@H](CN3CCCC3)C(C)(C)C)CC2)no1 426489872 FWJUWQNCZTXGDT-KRWDZBQOSA-N 377.533 2.853 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)c2cncnc2C)CC1 95520304 UJPYJKPCDMUGKM-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA Cc1onc(-c2ccccn2)c1C(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 180888452 QUSZXBVUZZHWRC-LBPRGKRZSA-N 398.369 2.859 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)NC(C)C)C2)c(OC)c1 95530577 ANIMWOHPWOQXHA-INIZCTEOSA-N 391.512 2.930 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1)c1cccs1 181324120 DCLQQEYHSREZBO-OAHLLOKOSA-N 395.488 2.669 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(N2CCCC2=O)ccc1F 299752415 UBIHYSRASHEMKK-SFHVURJKSA-N 382.391 2.604 0 50 GFAA Cc1cccc(-c2nc(-c3cccc(C(=O)NCCN4CCCC4=O)c3)n[nH]2)c1 534656689 KODNTEPGJJOPFC-UHFFFAOYSA-N 389.459 2.799 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC2(CC1)C[C@H]2C(=O)Nc1cc(C)cc(C)c1 299800974 XKJWVLCLLOIMIM-PMACEKPBSA-N 397.519 2.882 0 50 GFAA Cn1ccnc1-c1ccccc1C(=O)N[C@H]1CCCN(C(=O)c2ccco2)C1 828184270 UPXONBOFYCTDQI-HNNXBMFYSA-N 378.432 2.715 0 50 GFAA CC(=O)N1CCN(c2ccccc2CN2CCC(c3c[nH]nc3C)CC2)CC1 952845309 XTGUKHLNAHPTEB-UHFFFAOYSA-N 381.524 2.766 0 50 GFAA O=C(c1ccn2nncc2c1)N1[C@H]2CC[C@H]1CC(O)(Cc1ccc(F)cc1F)C2 1875295453 YMRWRPQWBGFLDE-IRXDYDNUSA-N 398.413 2.748 0 50 GFAA Cc1cc(C(=O)N2CC(=C3CC(=O)NC3=O)C2)c(C)n1[C@H](C)c1ccccc1 1875302040 XTGAHGGCQSLCMB-CQSZACIVSA-N 377.444 2.513 0 50 GFAA O=C(NS(=O)(=O)N1CCc2ccccc2C1)OCCc1ccc(Cl)cc1 1875322768 GYRZEZPEWCEWQH-UHFFFAOYSA-N 394.880 2.912 0 50 GFAA Cc1ccnc(NC(=O)CCC(=O)N(C)Cc2cc(-c3ccncc3)no2)c1 952871731 CSWWSFAAEDIZGI-UHFFFAOYSA-N 379.420 2.817 0 50 GFAA COc1cccc(-n2cc(CNCc3cnc(N4CCCCC4)nc3)cn2)c1 952966438 IXENYJYXYBRSIR-UHFFFAOYSA-N 378.480 2.951 0 50 GFAA Cc1cnc(N2CCN(C(=O)Cc3ccccn3)CC2)nc1-c1ccccc1F 885828893 QTFCLKOUERCDCY-UHFFFAOYSA-N 391.450 2.877 0 50 GFAA O=C(N[C@H]1CCN(Cc2cscn2)C[C@@H]1O)c1ccc(-c2ccco2)cc1 1565508250 IDUOQRYINIYEHA-ROUUACIJSA-N 383.473 2.768 0 50 GFAA C[C@@H]1CCCCCN1C(=O)NCc1ccc(CN2C(=O)NC(C)(C)C2=O)cc1 170626947 XYEJLTUTSUPUDB-OAHLLOKOSA-N 386.496 2.991 0 50 GFAA CCN(C(=O)c1cc(N2CCNC(=O)C2)ccn1)[C@H](C)c1cc2ccccc2o1 190278369 CUIDTJNRHHCYHX-OAHLLOKOSA-N 392.459 2.987 0 50 GFAA O=C(c1ccn(CC(F)F)n1)N1CCN(c2ncc(Cl)cc2Cl)CC1 193847243 DHNSTBGBAJFGRW-UHFFFAOYSA-N 390.221 2.812 0 50 GFAA COc1ccnc(N2CCC[C@H](CNC(=O)Cc3cn(C)c4ccccc34)C2)n1 1506423869 GPRZTSMAXDWBSX-MRXNPFEDSA-N 393.491 2.552 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529189333 MILHXUBEJUZUKO-YLJYHZDGSA-N 390.439 2.880 0 50 GFAA C[C@H](O)c1nc2cc(-n3ccnc3-c3ccccc3OCC(=O)O)ccc2n1C 1775982732 DFDGRUDLHBFRBV-ZDUSSCGKSA-N 392.415 2.943 0 50 GFAA CC(C)(C(=O)N[C@H](CO)Cc1ccccc1)C1=N[C@@H](Cc2ccccc2)CO1 5497018 VXRLQNQIIORYIL-PMACEKPBSA-N 380.488 2.772 0 50 GFAA CN(CC1CCN(CCc2cccc(F)c2)CC1)C(=O)CN1CCCCC1=O 11817536 YRERTWUVDQFNBX-UHFFFAOYSA-N 389.515 2.551 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2ncc[nH]2)C1)N1CCN(Cc2ccccc2)CC1 11818941 OQPIKYOKTMWHRQ-NRFANRHFSA-N 395.551 2.746 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN(C)Cc2ccccn2)cc1OC 11820899 LZJLWZPTOGUBLL-HXUWFJFHSA-N 387.524 2.804 0 50 GFAA NC(=O)[C@H]1CCCN(CCNC(=O)c2ccc3nc(C4CCCCC4)oc3c2)C1 11838252 VKWSOCCGAWDKRF-KRWDZBQOSA-N 398.507 2.803 0 50 GFAA CC(C)CN1C[C@@H](OCc2cccnc2)CN(C(=O)c2cccs2)CC1=O 14538239 VWQAEDLEOARWEG-QGZVFWFLSA-N 387.505 2.669 0 50 GFAA O=C(NCC[C@@H]1COc2ccccc2O1)c1ccc(NCC2CCOCC2)nc1 14959514 NRWAQPIVTXSYHW-GOSISDBHSA-N 397.475 2.880 0 50 GFAA COc1cccc(OCC(=O)N[C@H]2CCC[C@H]3CN(C(=O)C(C)(C)C)C[C@@H]23)c1 1857667040 ZSBSNJPUXJVLKX-IPELMVKDSA-N 388.508 2.863 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)NCc3ccc(Cl)c(Cl)c3)CC2=O)s1 1857735343 DLDKLYDQQXNOQL-JTQLQIEISA-N 385.276 2.823 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H]3[C@H](CNC(=O)C4(C)CC4)[C@H]4CC[C@]3(C2)O4)cc1C 1857738784 YGLMRNAFYCAVIZ-RTXPOLOASA-N 382.504 2.839 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(C)nc4C)[C@H]4CC[C@]3(C2)O4)c1 1875250473 CICZOPBLZDLFHI-DZCCDHAISA-N 392.503 2.816 0 50 GFAA O=C(O)CN(C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)C1CCOCC1 238104939 YNSBYDVUYWOBQL-CABCVRRESA-N 382.254 2.645 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2cccc(NC(=O)C(F)(F)F)c2)CC2(CCC2)O1 859204065 PQIXPGDEGRGXRZ-LLVKDONJSA-N 392.399 2.520 0 50 GFAA Cn1ncc2c1CCC[C@@H]2N=c1[nH]c2ccccc2n1CCCn1ccnc1 2325773960 IQTSKPVXHMYROF-KRWDZBQOSA-N 375.480 2.968 0 50 GFAA Cc1cc(C(=O)N2C[C@H](N)CC(F)(F)C2)c2cnn(Cc3cccs3)c2n1 2325799813 ZGYPEJKLKHBUTJ-GFCCVEGCSA-N 391.447 2.658 0 50 GFAA Cc1ccc(C(=O)c2ccccc2C(=O)N2C[C@H]3CN(C)CC[C@@]3(CO)C2)cc1 2325803696 WEMLTDLZWXZLQB-DVECYGJZSA-N 392.499 2.612 0 50 GFAA CC(C)(N)c1nocc1C(=O)N=c1cc(-c2ccccc2C(F)(F)F)[nH][nH]1 2325859068 MSJSAVLDOJRVHO-UHFFFAOYSA-N 379.342 2.952 0 50 GFAA COC(=O)c1sc(NC(=O)COc2ccc(Cl)cc2C)c(C(N)=O)c1C 2749027 QANZKYHTZORBFV-UHFFFAOYSA-N 396.852 2.921 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)n1 2356147737 MIFAEQWOLPHIIK-HXUWFJFHSA-N 386.883 2.871 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CC[C@@]4(CN(C)C(=O)O4)C3)ncnc21 2356168767 MRSCPPFZGWQCGN-HXUWFJFHSA-N 386.500 2.856 0 50 GFAA CCn1ncc(NC(=O)Cn2ncc3cc(-c4cccc(OC)c4)ccc32)n1 55242388 FQDOUEULPUBWHC-UHFFFAOYSA-N 376.420 2.962 0 50 GFAA CCCn1nccc1C(=O)Nc1ccccc1-c1nnc(SCC)[nH]c1=O 55342030 DLCKIUQWNOCVMP-UHFFFAOYSA-N 384.465 2.803 0 50 GFAA Cn1cc(C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)cn1 67727120 VAAOJACWZRJYIL-UHFFFAOYSA-N 376.395 2.941 0 50 GFAA OCC[C@H]1CN(Cc2ccc3nonc3c2)CCN1Cc1ccc(F)c(F)c1 23375530 KAXLXYYBTMJHSM-INIZCTEOSA-N 388.418 2.570 0 50 GFAA COC(=O)N[C@@H](C)C(=O)N1CCOc2c(O)cc(-c3ccc(C)s3)cc2C1 67514107 NLLXLCRAMMAQTM-LBPRGKRZSA-N 390.461 2.895 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CCn4nc(CCC(=O)O)cc4C3)oc2c1 72421955 LKWWLMRYOQNVFK-UHFFFAOYSA-N 383.404 2.620 0 50 GFAA Cc1ccc(-n2ncc(C(=O)N3CCO[C@@H](CC(=O)O)C3)c2C(F)(F)F)cc1 237842791 NPDKGKLSGWEJFU-ZDUSSCGKSA-N 397.353 2.515 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3ccc(-n4ncc5ccccc54)cc3)C[C@@H]21 284779372 LJSDEPXZPZUMTR-SFTDATJTSA-N 391.475 2.962 0 50 GFAA O=C(NC[C@@H]1CCCN(c2ccccc2S(=O)(=O)C(F)F)C1)c1ccco1 367164265 HCWULJWUCDJOPH-ZDUSSCGKSA-N 398.431 2.922 0 50 GFAA CCNC(=O)C[C@@H]1COCCN1C(=O)CSc1cn(CC)c2ccccc12 72428880 JAAYXQJUEOIVMO-OAHLLOKOSA-N 389.521 2.507 0 50 GFAA CCc1nsc(N2CCCN(C(=O)N[C@@H]3CCOc4ccccc43)CC2)n1 175323887 JHQWETSKDPRELI-OAHLLOKOSA-N 387.509 2.846 0 50 GFAA CCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)N(CC)CC)CC1 47989212 AHKYCCKRTOQZHV-UHFFFAOYSA-N 388.512 2.939 0 50 GFAA Cc1ccc(NC(=O)N2CCN(C[C@H]3CCOC3)CC2)cc1OCC(F)F 176955596 KAOVBXVSTCZRGE-OAHLLOKOSA-N 383.439 2.825 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccc(F)cc2)CC1 225270261 CPXYBHKBWSXUDM-IEZWGBDMSA-N 394.512 2.672 0 50 GFAA Cc1cccc(-c2ncc(C(=O)N3CCO[C@H](c4ccccc4)C3)c(=O)[nH]2)c1 82166275 USKKABGYMVUNIC-IBGZPJMESA-N 375.428 2.959 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(C(=O)NCCSc2nc[nH]n2)C1 426489938 APRDDTZLQPJXNQ-HNNXBMFYSA-N 375.498 2.706 0 50 GFAA Cc1nc(C)c(CC(=O)N[C@@H]2CCCc3nc(-c4ccccc4)ncc32)c(=O)[nH]1 91526355 XBSBAIHBRRKMKY-GOSISDBHSA-N 389.459 2.580 0 50 GFAA COCC(=O)N1CCCN(C(=O)Nc2ccccc2OCc2ccco2)CC1 95511440 IGCJTVDAHINUMY-UHFFFAOYSA-N 387.436 2.571 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)c1cc[nH]n1)CC2 95507096 QZVXRAKBGQMLTL-UHFFFAOYSA-N 378.407 2.929 0 50 GFAA COc1ccc(-n2ncc([C@H](C)NC(=O)CCc3nc(Cl)n[nH]3)c2C)cc1 91690524 UVYAJCSXNOYGAQ-NSHDSACASA-N 388.859 2.771 0 50 GFAA COCc1nc(NCCCc2nc3cc(F)ccc3[nH]2)cc([C@H]2C[C@@H](N)C2)n1 243902032 BFFZPQSATCXXDT-XBXGTLAGSA-N 384.459 2.888 0 50 GFAA COc1cccc2[nH]cc(CCNC(=O)N3CCC(Nc4cccnn4)CC3)c12 183859755 VSWIRHLBPXLITQ-UHFFFAOYSA-N 394.479 2.795 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N(C)Cc1cc(C(=O)O)c(C)o1 299749037 IXYXWUXZLZNXFP-LJQANCHMSA-N 384.432 2.781 0 50 GFAA CCOC(=O)C1=C(CN2CCC(C)CC2)NC(=O)N[C@H]1c1ccc(OC)cc1 55227600 WJYXEYXITCUWEX-IBGZPJMESA-N 387.480 2.598 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2OC)CN1Cc1cc(C)ccc1C 64031767 SFOOFRVMEQCLPA-ICSRJNTNSA-N 396.487 2.858 0 50 GFAA CC[C@@H]1CN(CC(=O)NCC[C@@H]2CCCN2C)Cc2ccc(Cl)cc2O1 299771517 PXHRDUSIZPMQND-ZWKOTPCHSA-N 379.932 2.914 0 50 GFAA Cc1cc(N2CCCN(C(=O)c3ccccc3N3CCOCC3)CC2)ccn1 825281217 PLSBLUMUWLGWPA-UHFFFAOYSA-N 380.492 2.579 0 50 GFAA COc1ccc2c(c1)[C@H](C)N(C(=O)NCCCc1nnc3ccccn13)CC2 584903646 IUVRCUCJSDTMQI-HNNXBMFYSA-N 379.464 2.999 0 50 GFAA Cc1ccc(C)c(-c2c(C)sc3ncn(CCc4nc(N)n[nH]4)c(=O)c23)c1 584895138 SFVCETSBJQLEQF-UHFFFAOYSA-N 380.477 2.993 0 50 GFAA COCc1ccccc1S(=O)(=O)Nc1cnc(Br)c(OC)c1 1875316936 JGLMROOGLXJFLL-UHFFFAOYSA-N 387.255 2.800 0 50 GFAA CCCS(=O)(=O)Nc1cccc(C(=O)Nc2ccc3c(=O)[nH]ccc3c2)c1 1300543008 HPCJLCDJWKWOBK-UHFFFAOYSA-N 385.445 2.932 0 50 GFAA CN(Cc1nc(-c2ccccn2)no1)C1CCN(C(=O)c2cccs2)CC1 952977485 CJXVRBNRLSPLAS-UHFFFAOYSA-N 383.477 2.930 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)NCCC(=O)Nc3ccccc3)CC2)cc1 952977222 PJVJYWDBPDGWLL-UHFFFAOYSA-N 393.487 2.992 0 50 GFAA C[C@@H](NC(=O)CN1CCSC[C@@H]1C(=O)OC(C)(C)C)c1ccc(F)cc1 170598100 RKEFOGGRFSFQAZ-CZUORRHYSA-N 382.501 2.762 0 50 GFAA COCN1C(=O)CCc2cc(NS(=O)(=O)Cc3cccc(F)c3)ccc21 170603678 OEBUYFOIHKBFRT-UHFFFAOYSA-N 378.425 2.651 0 50 GFAA O=C(Nc1ncc(Cc2cccc(F)c2)s1)N1CCC[C@@H](OCCO)C1 172047964 MDKLULIUKMOMQG-OAHLLOKOSA-N 379.457 2.878 0 50 GFAA O=C(Cc1noc2ccccc12)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O 191166955 BKPHMCGRZVPEJP-QGZVFWFLSA-N 399.397 2.956 0 50 GFAA CN1C[C@H](C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)Oc2ccccc21 1506425299 FFSNNPYWZKUPPE-LJQANCHMSA-N 393.447 2.705 0 50 GFAA Cc1cc(S(=O)(=O)NCCc2noc([C@H]3CCCO3)n2)c(Cl)cc1F 1506407393 RNYBCYFQEDGXQC-GFCCVEGCSA-N 389.836 2.543 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cc[nH]n4)C[C@@H]2CN(C2CCOCC2)C3)cc1 1772811804 ZPKYABWOCNYDPH-OFNKIYASSA-N 380.536 2.955 0 50 GFAA COc1ccc(C(=O)N2CCN(c3ccc(Nc4ccccn4)nn3)CC2)cc1 11697489 RSYLKFHLXUBFOD-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA CCOC(=O)c1cnn(-c2nc3ccccc3s2)c1CN1CCC[C@@H](O)C1 11980135 TZGKHCSOQRHYEA-CYBMUJFWSA-N 386.477 2.615 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2CCC[C@@H](N(C)Cc3ccccc3)C2)CC1 12590696 MJBAYEHJFWXWDN-HXUWFJFHSA-N 386.540 2.503 0 50 GFAA COC[C@H](C)Nc1ncnc2sc(C(=O)N(C)Cc3ccon3)c(C)c12 15003622 PPIHKVNXBUISED-JTQLQIEISA-N 375.454 2.707 0 50 GFAA COc1ccc(Br)cc1CN1CCN(C(=O)c2cccnc2)CC1 19773426 BLVSNGBZBMAAJV-UHFFFAOYSA-N 390.281 2.811 0 50 GFAA COc1ccc(CN2CCN(Cc3ccccc3F)[C@@H](CCO)C2)cc1OC 19839846 VAVWJRHRWPVVEP-IBGZPJMESA-N 388.483 2.912 0 50 GFAA O=C(Nc1nc2c(s1)CCCC2)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 169772724 XYEVGSVENLYAPU-LLVKDONJSA-N 381.461 2.890 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1cccs1 1857666383 VVCCNYGMTKPRFF-HDMKZQKVSA-N 377.487 2.987 0 50 GFAA COc1ccc(CN2CCN(c3ccc(F)cn3)[C@@H](C)C2)cc1Cn1cncn1 1857674323 DEZLVJWVGQPWRW-INIZCTEOSA-N 396.470 2.580 0 50 GFAA O=C(Cn1ccc2ccccc21)N1CC[C@]2(C1)Cn1c(nnc1C1CCC1)CO2 1857694165 CUAOQYRQYBXCJQ-QFIPXVFZSA-N 391.475 2.702 0 50 GFAA c1nscc1CN1CCO[C@@]2(C[C@@H]3CC[C@H](C2)N3C[C@H]2C[C@@H]3CC[C@H]2O3)C1 1857701538 NCULJGOHABWXLC-OUCVULTDSA-N 389.565 2.908 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@@H](C)[C@@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237481657 ACVVRMGSLVHFKT-LIRRHRJNSA-N 385.464 2.804 0 50 GFAA CC(=O)N1N=C(c2ccc(Br)cc2)O[C@@]12C(=O)Nc1ccccc12 4753751 CCHYJISTWQGVBU-KRWDZBQOSA-N 386.205 2.795 0 50 GFAA Cc1cc(CN2CC[C@@]3(C2)c2ncn(C)c2CCN3C(=O)C[C@@H](C)C(C)C)on1 2325776914 NKFJDVIFVBKHLD-OPAMFIHVSA-N 399.539 2.885 0 50 GFAA Cc1ccc(OCc2ccc(C(=O)N[C@@H]3C[C@H](Cn4cccn4)C[C@H]3O)o2)cc1 2325785868 RDEWGAFDVICFJV-PWIZWCRZSA-N 395.459 2.933 0 50 GFAA CC(C)C(C)(C)C(=O)N[C@@H]1CC12CCN(C(=O)[C@H]1CN3CCC1CC3)CC2 2325794136 RMXAVGCUBLUECW-ZWKOTPCHSA-N 375.557 2.508 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCC(O)(c3ccccc3Cl)CC2)C1 2325889365 MGIDNXNCEUNZRG-OAHLLOKOSA-N 376.884 2.575 0 50 GFAA COc1ccc(C[C@@]2(O)C(=O)Nc3ccc(Br)cc32)cc1OC 780323 DEWLINGAFLJUOP-KRWDZBQOSA-N 378.222 2.849 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccc(C)c2C)S(C)(=O)=O)cc1OC 1135335 QBCSIOQYLHATGO-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COc1ccc(CCNC(=O)C[C@H]2Nc3cc(C)c(C)cc3NC2=O)cc1OC 4058432 GITHRRWGRSZHGK-GOSISDBHSA-N 397.475 2.802 0 50 GFAA Cc1nnc(SCC(=O)Nc2ccc(I)cc2)o1 4834907 JQDLHAJVHXGASK-UHFFFAOYSA-N 375.191 2.713 0 50 GFAA Cc1cccc(NC(=O)N[C@@H]2CCN(c3ccccc3F)C2)c1S(C)(=O)=O 417312107 RFNLTEKAKCMGOT-CQSZACIVSA-N 391.468 2.938 0 50 GFAA COc1cccc2c1C[C@H](N[C@H](C(N)=O)c1ccc(Br)cc1)C2 419333627 SPUBQMVLHASNBW-PBHICJAKSA-N 375.266 2.741 0 50 GFAA CN(C[C@@H]1CCCO1)c1ccc(C(=O)N2CCC(CCn3cccn3)CC2)cn1 20601681 IIQQNNBDXUNABG-FQEVSTJZSA-N 397.523 2.836 0 50 GFAA O=C(C1CCCC1)N1CCC[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 23375094 MKEBPABEVLJLKF-HXUWFJFHSA-N 399.535 2.714 0 50 GFAA C[C@@H](Cn1cccn1)C(=O)N1CCOc2c(O)cc(-c3cccnc3)cc2C1 67920724 NIHIYPWLHODFLB-HNNXBMFYSA-N 378.432 2.708 0 50 GFAA Cc1cc(-c2nnc(CCC(=O)NCCN3CCCc4ccccc43)o2)no1 11821628 FJCVBMLARLQRAO-UHFFFAOYSA-N 381.436 2.535 0 50 GFAA Cc1ccc2nc(N3CCC[C@@H](O)C3)c(CN(C)Cc3nnc(C)o3)cc2c1 72418114 MTFQBXGZVRYOHG-GOSISDBHSA-N 381.480 2.828 0 50 GFAA O=C(O)[C@H]1CC2(CCN(c3ccnc4ccccc34)CC2)CN1C(=O)C1CC1 72432479 HUSILKQVOOJPLN-LJQANCHMSA-N 379.460 2.917 0 50 GFAA COc1ncc(C(=O)N[C@@H](CO)Cc2ccc(C)c(C)c2)cc1Br 424886399 DRZXOZKSUKVQFO-OAHLLOKOSA-N 393.281 2.803 0 50 GFAA Cc1cc([C@@H](C)NC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc(C)c1F 121182185 WCNQIDZVEFKFLJ-WBOSRHFRSA-N 399.466 2.610 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3C)cc2CN(CCO)CCO)cc1F 12429232 UDQSEIAMZJPMCC-UHFFFAOYSA-N 399.466 2.782 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N3CCO[C@@H](C(C)(C)C)C3)CC2)oc1C 363948453 RGSPPAOGBUECOE-GOSISDBHSA-N 392.544 2.960 0 50 GFAA O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N[C@@H]1CCOC2(CCCCC2)C1 130255023 CDAYHJCTYZXWSM-KGLIPLIRSA-N 391.434 2.721 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H]3CC(=O)N(C4Cc5ccccc5C4)C3)CC2)cc1 72142167 GXBTVVZQZNKAKI-LJQANCHMSA-N 390.483 2.611 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(C(=O)CCC3CC3)CC2)C1 71388774 JHDVAMKMGWTHOR-LJQANCHMSA-N 398.551 2.591 0 50 GFAA C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 375603752 BRJWGNWZQOLIGO-QFOSIAFASA-N 381.476 2.664 0 50 GFAA COc1cc(CNC(=O)C2CCN(Cc3csc(C)n3)CC2)ccc1O 127651318 IPOQZVKHCCULOE-UHFFFAOYSA-N 375.494 2.694 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCC2)cc1)N[C@@]1(CO)CCc2ccccc21 128714114 KWMDBVAGAQRXHR-JOCHJYFZSA-N 379.460 2.878 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](N2CCCC2)C1)c1cccs1 171450601 AUIVMRFYOLSMDF-RBUKOAKNSA-N 397.544 2.786 0 50 GFAA C[C@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)CC[S@]1=O 242178813 XBBHPADSAISGIQ-ODCWNRFASA-N 381.567 2.610 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1cccnc1N1CCOCC1 242339313 ZGTNXCJIYHQIBD-UHFFFAOYSA-N 399.401 2.943 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 225331491 IXOUFVABXAMEQN-UHFFFAOYSA-N 391.475 2.579 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC[C@@H](c3nccn3Cc3ccccc3)C2)c[nH]1 82098128 LNCVKRRFUKTXST-GOSISDBHSA-N 376.460 2.948 0 50 GFAA CNc1nc(C)cc(-c2ccc(C(=O)N3CCN(c4ccccc4)CC3)cc2)n1 426399096 WHMLTCMQZKSTLS-UHFFFAOYSA-N 387.487 3.456 0 50 GFAA COc1ccc(CCN(Cc2ccncc2)C(=O)NC[C@H]2CCN(C)C2)cc1 426546304 YVFYGZAXVWXVKZ-HXUWFJFHSA-N 382.508 2.796 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)N1CCCCC1 197186466 JDDRWAWQYISXHT-VYJAJWGXSA-N 380.488 2.641 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(Cc1cnc(-c3ccco3)nc1)CC2 95502467 ZPJINWSAXOXOPR-UHFFFAOYSA-N 397.523 2.503 0 50 GFAA OC[C@@H]1C[C@H](CN2CCOCC2)CN(Cc2ccc(-c3ccccc3F)o2)C1 92098235 WTJNPRGURYCFOF-QZTJIDSGSA-N 388.483 2.848 0 50 GFAA COc1cc(CN2CCOCC2)ccc1OC[C@H](O)CN(C)C1CCCCC1 95521518 KGOIUADLXFACFX-HXUWFJFHSA-N 392.540 2.532 0 50 GFAA COc1cc(CN2CCOCC2)ccc1OC[C@@H](O)CN(C)C1CCCCC1 95521517 KGOIUADLXFACFX-FQEVSTJZSA-N 392.540 2.532 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N(C/C=C/c1ccccc1)C[C@@H]1CCCO1 91848719 GDBICLBUBCZDNB-PYJQOMOHSA-N 379.460 2.982 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)Cc2ccccc2)CC3)cn1 91713749 PGIYSXRMMVPIPJ-UHFFFAOYSA-N 392.503 2.759 0 50 GFAA O=C(c1ccon1)N1CCC2(CCN(Cc3ccc(F)cc3)CC2)[C@@H](CO)C1 97307513 TVFSVRFIFJVIMR-QGZVFWFLSA-N 387.455 2.551 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)N2CCN(c3ccccc3)C[C@@H]2C)c1 96160000 YPPWMKAWQMATTC-HNNXBMFYSA-N 377.452 2.713 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O)CC[C@@]43COS(=O)(=O)O)[C@H]1CCC2=O 247653842 OFAHVPXLWWIVAF-CWTKERLFSA-N 384.494 2.679 0 50 GFAA NC(=O)[C@H]1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)O1 294662677 DYRAGIIOKAVTKA-SJORKVTESA-N 398.850 2.709 0 50 GFAA O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1coc(-c2ccccc2)n1 183714796 PBCOPKUEERASFA-UHFFFAOYSA-N 382.395 2.642 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)N(C)Cc4ccccc4)c3CO2)cc1 263616520 JDYPXJBJVSQZIU-LJQANCHMSA-N 378.432 2.830 0 50 GFAA CCCc1sc(NC(=O)c2nc(=O)n(C)[nH]2)nc1-c1ccc(OCC)cc1 1940198415 PTIHKFNXFHCKFI-UHFFFAOYSA-N 387.465 2.835 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)NCc1noc(-c2cccs2)n1 828032033 JIZHISIQNVKQBS-UHFFFAOYSA-N 396.432 2.882 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2C(=O)CCS(=O)(=O)c2ccccc2)n1 952971500 DQLUMFLCULHNMO-HNNXBMFYSA-N 377.466 2.721 0 50 GFAA Cc1cc(CNCc2ccc3nc(O)[nH]c3c2)c(C)c(CN2CCN(C)CC2)c1 952871941 HMTWIAJANLUFHI-UHFFFAOYSA-N 393.535 2.923 0 50 GFAA CC(C)(C)n1ncc2c(O)nc(N3CCC(CN4CCCCC4=O)CC3)nc21 278804840 ROCXACLEXNQVLN-UHFFFAOYSA-N 386.500 2.516 0 50 GFAA CCCCN1C(=O)CC[C@@H](C(=O)NCC(F)(F)CO)[C@@H]1c1ccccc1OC 170597369 IWOFWSFAIXMDDZ-QAPCUYQASA-N 398.450 2.519 0 50 GFAA CCCOc1cc(C)ccc1NC(=O)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 170591916 QAZWQYCCXWQXAW-BEFAXECRSA-N 396.509 2.642 0 50 GFAA CCCN1CCCN(C(=O)c2nn(-c3ccccc3C)c3c2CCC3)CC1=O 189025441 FGVNJOXUFWBUHZ-UHFFFAOYSA-N 380.492 2.754 0 50 GFAA CO[C@@H](C)[C@H](C)N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 191722040 OSOMUIGGRXSHOB-IHRRRGAJSA-N 380.444 2.802 0 50 GFAA C[C@H]1CN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CCS(=O)(=O)C1 191880123 WZMWBUQRERWSGL-HNNXBMFYSA-N 395.484 2.804 0 50 GFAA FC(F)(F)c1nnc(N2CCN(Cc3cc(-c4ccncc4)no3)CC2)s1 1506421296 GOIWQFOPOQKNSR-UHFFFAOYSA-N 396.398 2.929 0 50 GFAA Fc1cnc(N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)nc1N1CCOCC1 1506406887 RXTCKSAPRKFCJC-CQSZACIVSA-N 382.443 2.713 0 50 GFAA CCN(Cc1ccc(C)o1)C(=O)[C@H]1OCC(=O)N[C@@H]1c1ccccc1Cl 1529104858 VITOHDLLOCVURM-MSOLQXFVSA-N 376.840 2.846 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2ccc(C)c(C)c2)cc1OC 1529090956 LGYMQNDEMXIPLS-NHCUHLMSSA-N 385.460 2.895 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)C3Cc4ccccc4C3)C1)CC2 1704340872 WEPSWGGPXOIVRZ-HSZRJFAPSA-N 376.504 2.764 0 50 GFAA Cc1csc2c(N3C[C@H]4COC[C@@H]3CN(C(=O)c3ccco3)C4)ncnc12 1772700678 GDSFMENCQDAHQW-KBPBESRZSA-N 384.461 2.570 0 50 GFAA O=C(NC[C@H]1Cc2cc(F)cc(-c3cncnc3)c2O1)c1cc(C2CC2)n[nH]1 11789633 XSFOCXYHOJCEBO-OAHLLOKOSA-N 379.395 2.617 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C(=O)[C@@H]1CCCO1 11949811 WNSFVDYKMLPCMF-NRFANRHFSA-N 390.524 2.561 0 50 GFAA COCCNC(=O)CCC1CCN(Cc2ccc(OC)c(COC)c2)CC1 12207756 LWANUPTTWORTJI-UHFFFAOYSA-N 378.513 2.596 0 50 GFAA CN(CC(=O)N[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1)Cc1cccnc1 12306236 DFMKFZOQWOUJNK-HXUWFJFHSA-N 386.927 2.948 0 50 GFAA COc1cccc(CNc2ncnc3sc(C(=O)N[C@@H](C)CO)c(C)c23)c1 12571808 UTZMCKFNBJGUAG-NSHDSACASA-N 386.477 2.731 0 50 GFAA COc1ccc(Cc2noc(CN(C)C[C@@H](O)c3ccccc3)n2)cc1OC 13594734 VCYWGUOXJOFIOH-QGZVFWFLSA-N 383.448 2.843 0 50 GFAA Cc1ccc(-n2c(C3CCN(C(=O)Cc4ccccc4F)CC3)n[nH]c2=O)cc1 169779854 KGYHPKMALIDAAQ-UHFFFAOYSA-N 394.450 2.957 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)/C=C/c2ccccc2Cl)cc1 1182552 PIWSGATWUVNMPY-IZZDOVSWSA-N 378.837 2.817 0 50 GFAA COC(=O)C[C@@H](c1cnn(C(C)C)c1)c1c(O)n2cc(Cl)ccc2nc1=O 205970626 PXEWGBFNHSNNJC-ZDUSSCGKSA-N 390.827 2.526 0 50 GFAA O=C(Cc1cccc2ccccc12)N1C[C@@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857716520 CAALZTCPCWZIIE-WMMXXEOUSA-N 387.479 2.978 0 50 GFAA COc1ccc(CN2CCC[C@H](n3cc(C(=O)N4CCCC4)nn3)C2)c(C)c1C 14984733 SEVCFGRXGCHITB-IBGZPJMESA-N 397.523 2.977 0 50 GFAA COC(=O)[C@H]1CC[C@@H]2C(=O)N(c3ccc4cc(OC)c(OC)cc4c3)C(=O)N2C1 864565932 OPIZESBZVRJASQ-XJKSGUPXSA-N 398.415 2.577 0 50 GFAA O=C(c1ccc2c(c1)CCS2(=O)=O)N1CCC[C@@H](c2cccc(O)c2F)C1 1875299319 HNETXYCSJMQDBM-OAHLLOKOSA-N 389.448 2.881 0 50 GFAA COC(=O)c1ccc2nc(N3CCc4c(CC(N)=O)cccc4C3)sc2c1 1875287063 TYSUDSWBROARII-UHFFFAOYSA-N 381.457 2.673 0 50 GFAA Cc1cccc(OCCC(=O)N[C@@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@H]2O)c1C 1875403604 WMGPTJRYQLFWJY-KBAYOESNSA-N 391.899 2.878 0 50 GFAA CCc1sc([C@H](C)NC(=O)N2CCC(N3CCCS3(=O)=O)CC2)cc1C 886093426 MMNDIPHIDCNFSV-AWEZNQCLSA-N 399.582 2.889 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3oc(-c4ccc(Cl)cc4)nc3c2)C(=O)N1 1857798143 RGLDXHWIMBFLBT-ZDUSSCGKSA-N 383.791 2.683 0 50 GFAA CCCc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H]3CCCC(=O)N3)[C@H](C)C2)cc1 2325826437 BDOAHIBLSKJEDV-NSISKUIASA-N 399.535 2.522 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)c3ccc4c(c3)OCO4)sc2c1 892800 VTIYQGPRZKMHAB-UHFFFAOYSA-N 376.415 2.681 0 50 GFAA Cc1ccc2nc(CNC(=O)c3cc4c(s3)C3(CCNCC3)OCC4)cn2c1 2356150869 CWZGTWSKUXYJPA-UHFFFAOYSA-N 396.516 2.786 0 50 GFAA CC[C@@H](C)NC(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccccc1 2961262 AYMLKKNPRIXCAU-OAHLLOKOSA-N 376.478 2.805 0 50 GFAA CC[C@@H](C)NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 4289722 CPDQGPLRAMPDEC-CYBMUJFWSA-N 390.461 2.787 0 50 GFAA COc1cccc(N(CC(=O)Nc2cccc(SC)c2)S(C)(=O)=O)c1 4671776 KAYKUMZNGGNXHA-UHFFFAOYSA-N 380.491 2.822 0 50 GFAA Cc1cccc(OCC(=O)N(Cc2sccc2C)[C@H]2CCS(=O)(=O)C2)c1 6810227 IDDKQDMMOOFHRE-INIZCTEOSA-N 393.530 2.960 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)[nH]n1 114705726 RPGQHBNXRZCOHE-INIZCTEOSA-N 391.475 2.999 0 50 GFAA COCC(=O)N1CCCc2ccc([C@H]3CCN(C(=O)OC(C)(C)C)C3)nc21 864096698 BKKSZSGAESICLC-HNNXBMFYSA-N 375.469 2.732 0 50 GFAA Cc1ccc(CCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 10338161 HRVFRTRDTSZFFM-UHFFFAOYSA-N 388.489 2.587 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2C(=O)c2ccno2)s1)N1CCCOCC1 20167872 ZENHWLMDBSNACI-ZDUSSCGKSA-N 375.450 2.576 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)N1CCCC2(CCNCC2)CC1 67834011 IAXOMSSWVKHJSM-UHFFFAOYSA-N 383.496 2.837 0 50 GFAA CCN(CC1CCN(CCc2ccccc2C)CC1)C(=O)c1ccc(O)nn1 20775550 AVFDJIURRIQLNH-UHFFFAOYSA-N 382.508 2.907 0 50 GFAA CCc1n[nH]c(=O)c(CNC(=O)CCc2ncc(-c3ccccc3)o2)c1CC 121052002 KUQSLXSAOIRBSD-UHFFFAOYSA-N 380.448 2.799 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc4ccccc4n3C)C[C@@H]2CCO)cc1 23373521 CKRCUWVJZAFVHC-FQEVSTJZSA-N 378.520 2.951 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3n[nH]c4c3CCCC4)CC2)cn1 328620719 AALZFQBDHPZBBK-OAHLLOKOSA-N 382.512 2.856 0 50 GFAA Cc1c([C@H]2[C@H](CNc3cnc4cc(F)c(F)cc4n3)CC(=O)N2C)cnn1C 328611818 MSUJYRDIAATXQF-JEOXALJRSA-N 386.406 2.581 0 50 GFAA Cc1sc(Br)cc1S(=O)(=O)NC[C@@H]1CCc2nccn2C1 328633385 SOXLCJIISQJVQH-JTQLQIEISA-N 390.328 2.556 0 50 GFAA COCCNC(=O)CC[C@H]1CN(Cc2cccc(Cl)c2)CC[C@H]1N(C)C 12055611 JFNLUFZZNGEVRH-PKOBYXMFSA-N 381.948 2.635 0 50 GFAA CN1CCC2(CCC1=O)CCN(S(=O)(=O)c1ccc(F)cc1Cl)CC2 67540891 QBAMEXKPZPYKCG-UHFFFAOYSA-N 388.892 2.892 0 50 GFAA COc1ccc(-c2ccc(C(=O)NCCCc3ccccn3)cn2)c(OC)n1 67643217 HMWWNQAMDMAGTI-UHFFFAOYSA-N 378.432 2.918 0 50 GFAA O=C1N[C@@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cccnc1 67883945 XLTRVZMPTREUHI-QFIPXVFZSA-N 378.476 2.505 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cnn(Cc3cccc(C(F)(F)F)c3)c2)cn1 2804561 YABMYNFDNCXFTK-UHFFFAOYSA-N 399.398 2.967 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1 237734340 MMTHMLLIMQQASP-PMACEKPBSA-N 394.471 2.546 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(N4CCCCC4)ncn3)CC2)cc1 38528642 KYSQBAAIBMAZCD-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA O=C(Nc1ccccc1)C(=O)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 71576027 QPTLUIBMMKOIFM-PWRODBHTSA-N 375.472 2.714 0 50 GFAA NC(=O)[C@@H](NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1 363663835 GSLYTCAFJGNPHA-KXBFYZLASA-N 384.455 2.568 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1[C@@H]1CCCCC1=O)c1ccccc1OC(F)F 155240595 TXJHSLAVDNPKGA-DZGCQCFKSA-N 394.418 2.768 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@H]1OC 460119139 XUZPLEIBQNYDIX-NUEKZKHPSA-N 394.269 2.761 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)COc3ccc4c(c3)OCO4)C2)cc1 72157245 BTIPCHAWNPOVOK-INIZCTEOSA-N 384.432 2.906 0 50 GFAA CN(C(=O)c1cnc2nc(O)nc(O)c2c1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C 288040309 DNTHMIKWNQZMQJ-CVEARBPZSA-N 394.431 2.754 0 50 GFAA C[C@@H](C(=O)NCCc1noc(-c2ccccc2)n1)n1c(=O)oc2ccccc21 221431080 RFNGUSGSKLUCKW-ZDUSSCGKSA-N 378.388 2.564 0 50 GFAA COC(=O)c1ccccc1-c1ccc(C(=O)NCCC(=O)N2CCCC2)cc1 426740339 DHCFFTXUAVQFKE-UHFFFAOYSA-N 380.444 2.883 0 50 GFAA CC(C)c1noc(CCNC(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)n1 162240052 ZOWNBGMHTCRHOC-UHFFFAOYSA-N 385.428 2.673 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)/C(=C(/O)N[C@@H]1CCS(=O)(=O)C1)S2 334158927 BKOZBLITUOKODU-LWQZHMPJSA-N 393.534 2.500 0 50 GFAA CC(=O)N1C[C@H](C2CC2)[C@@H](NC(=O)c2ccc(Cn3nc(C)cc3C)cc2)C1 95372369 PWWNGQLHGKXWQW-RTWAWAEBSA-N 380.492 2.535 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3ccccn3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95373123 YXFLWLBFAFNKTR-MDNUFGMLSA-N 377.488 2.722 0 50 GFAA O=C(O)[C@@H](c1ccc(NC(=O)N2CCOCC2)cc1)N1CCCCCCC1 95361907 DZPRWEOOONJLEG-GOSISDBHSA-N 375.469 2.943 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4ccoc4C)C3)CCC2=O)cn1 92004608 SFARSJVDJRELRP-OAQYLSRUSA-N 382.464 2.731 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(c3ncccn3)CC2)c1 95522942 KYIQKEFGWGXMBH-UHFFFAOYSA-N 382.464 2.769 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1ccc(Cl)c(Cl)c1 239433037 XDBLINCRGNVXGY-ARIMKUTISA-N 384.215 2.673 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)[C@H]1CC(=O)Nc3ccc(OC)cc31)CC2 95358448 XMVHOIVTAXDSIB-IBGZPJMESA-N 380.444 2.757 0 50 GFAA CCCN1C[C@@H](NC(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)CC1=O 97076313 HKSZIQZTPXMHAV-ZDUSSCGKSA-N 380.876 2.611 0 50 GFAA COCC(=O)NCc1cc2n(n1)CCCN(Cc1cc3ccccc3s1)C2 91617112 TXIUUNFPDVQRIR-UHFFFAOYSA-N 384.505 2.766 0 50 GFAA CCC[C@H](NC(=O)c1cc(C(=O)O)co1)C(=O)N1CCc2sccc2C1 183780498 KJAPIQIAYZVRGE-ZDUSSCGKSA-N 376.434 2.523 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2ccc(OCc3csc(C)n3)c(OC)c2)C1 299739447 ONJLQWNNGAPROC-AWEZNQCLSA-N 375.494 2.721 0 50 GFAA Cc1nn(CC(=O)N[C@H]2C[C@H](c3cc(O)nc(C4CC4)n3)C2)c(C)c1Cl 253535437 YLQCOAJTMKBQER-JOCQHMNTSA-N 375.860 2.589 0 50 GFAA CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@H]1c1ccc(Cl)cc1 55220591 CKMUZWWNPBVCHN-KRWDZBQOSA-N 377.872 2.997 0 50 GFAA CCO[C@H]1CN(C)C[C@@H]1NC(=O)N(Cc1ccccc1)Cc1scnc1C 584890408 GGUBKGYBEPTDJD-ROUUACIJSA-N 388.537 2.882 0 50 GFAA COc1cc(OC)cc([C@@]2(F)CCN(C(=O)[C@@H]3CCc4n[nH]c(C)c4C3)C2)c1 1875293717 AFGPFZNMLIXDII-SPLOXXLWSA-N 387.455 2.938 0 50 GFAA CS(=O)(=O)Nc1cccc(NC(=O)c2cc(Br)n3c2CCC3)c1 1875271335 MTYOWYBHGQJEMF-UHFFFAOYSA-N 398.282 2.821 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2C[C@H](C[C@@H]2O)C1 1875307937 WWIMTCAOIXJQHJ-WWGRRREGSA-N 398.463 2.978 0 50 GFAA CCOC(=O)[C@@H]1CCN(C(=O)c2cc3ccc(C(C)=O)cc3[nH]2)C12CCOCC2 1875300442 CJLGVGMIFHAQET-KRWDZBQOSA-N 398.459 2.945 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N[C@@H]2CCN(c3cccc(C)c3)C2=O)cc1 1875373551 FOLRMNQBHVWBMS-LJQANCHMSA-N 377.444 2.679 0 50 GFAA Cc1noc(C)c1CO[C@H]1CCOC[C@@H]1NC(=O)c1ccc2c(c1)CCCO2 1565508199 VTAQHAKAOUQONB-ICSRJNTNSA-N 386.448 2.721 0 50 GFAA Cn1c(=O)cc(-n2nc(C3CC3)nc2CCCN2CCCC2=O)c2ccccc21 885939042 OHHZWFWRLZLSGG-UHFFFAOYSA-N 391.475 2.552 0 50 GFAA CCN(CC)C(=O)c1ccc(OC(=O)[C@H]2CCO[C@@H]2c2cnn(C)c2C)cc1 275384730 PRHOCEBNMMBCNW-HKUYNNGSSA-N 385.464 2.894 0 50 GFAA C[C@@H](CNC(=O)[C@@H](C)N1CCn2c(Br)cnc2C1)c1ccccc1 225670570 HZFAVYYJFAYRIW-UONOGXRCSA-N 391.313 2.770 0 50 GFAA Cc1cc(NC(=O)N2CCN(c3nc4ccccc4o3)CC2)ccc1C(N)=O 172489516 DFKBZNFVBDOLDE-UHFFFAOYSA-N 379.420 2.589 0 50 GFAA Cc1ccc(N[C@@](C)(C(=O)N2CCN(CC(=O)O)CC2)c2ccccc2)cc1 1506406814 JOTRRRFJJHZOHH-JOCHJYFZSA-N 381.476 2.551 0 50 GFAA Cc1ccc(NC2(C(=O)N[C@@H](C)c3n[nH]c(CC(=O)O)n3)CCCCC2)cc1 1506399309 LWNWPXXGMXZKNF-AWEZNQCLSA-N 385.468 2.732 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)CCn3nc(C)cc3C)CC1)OCC2 1704335641 CTJACBYOXVGKQT-UHFFFAOYSA-N 383.492 2.989 0 50 GFAA CN1C[C@@H]2C[C@H](N(C)Cc3cnc(NCc4ccccc4)nc3)C[C@@H]2CC1=O 1704297196 MRKGDCAYRHKKPD-HSALFYBXSA-N 379.508 2.777 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1cc(C(F)(F)F)n[nH]1 1704340298 ZEYYTKMBLAVDDA-MLGOLLRUSA-N 390.365 2.964 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1)[C@@H]1CCCO1 11966094 VLRDVESDIFMCFM-MJGOQNOKSA-N 376.472 2.635 0 50 GFAA CSc1nnc(CNC(=O)c2ccc3c(c2)OCO3)n1-c1ccc(F)cc1 12027305 IKUIZRDEDRKOKG-UHFFFAOYSA-N 386.408 2.787 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C2CSCCSC2)CC1 12372825 CMLVPYQADPGLOC-GOSISDBHSA-N 399.670 2.928 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)[C@H]1CCCCN1Cc1ccc(F)cc1 12750957 NPRJAKKWZCGWKB-LJQANCHMSA-N 380.427 2.795 0 50 GFAA Cc1ccc(C(=O)NCCCn2ccnc2)cc1NS(=O)(=O)c1ccccc1 13679505 BOIQEYNDTRNZSB-UHFFFAOYSA-N 398.488 2.812 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1ccccc1Cl 15062495 YVSCCTYDXPVNFG-SFHVURJKSA-N 382.855 2.919 0 50 GFAA NC(=O)CCN1CCN(C(=O)C[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 15064574 HJAPTTONOJPHOD-FQEVSTJZSA-N 399.922 2.882 0 50 GFAA COc1ccc(CCN2C(=O)O[C@@H]3CN(C4Cc5ccccc5C4)C[C@@H]32)cc1 19838572 IIONFXJPLUNHSM-FCHUYYIVSA-N 378.472 2.910 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)Cc4ccc(C)cc4)nnc23)n1 169780168 SLMXCTZSNWUTKS-UHFFFAOYSA-N 376.420 2.509 0 50 GFAA Cc1c(NC(=O)/C=C/c2ccc3c(c2)OCO3)c(=O)n(-c2ccccc2)n1C 1470135 WCEHPQFGQMUFFT-PKNBQFBNSA-N 377.400 2.865 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2nn(C)c3c2C[C@@H](C)O[C@H]3C)CC1 1857529346 VKRJKRHGZUTCFR-CABCVRRESA-N 398.507 2.850 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(Cc3ccccc3)CC3(CO)CC3)nn(C)c21 1857529741 PBLHFGYOJJGINP-CVEARBPZSA-N 383.492 2.857 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857709489 AINCYBNGOVPHOT-XQBPLPMBSA-N 394.471 2.679 0 50 GFAA Cc1sc2ccccc2c1C(=O)NCCN1CCN(c2ncccn2)CC1 1857725164 LCSCCMNZAFBJFK-UHFFFAOYSA-N 381.505 2.552 0 50 GFAA Cc1cccc(CCN2C[C@@H]3[C@H](CNC(=O)c4cccs4)[C@H]4CC[C@]3(C2)O4)n1 1857728151 PQKWQVVATMOAIP-JZJXAQOMSA-N 397.544 2.903 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)N1CCNC(=O)[C@@H]1c1cccc(F)c1 1857728810 NCGBROBDEXURAR-IBGZPJMESA-N 378.407 2.838 0 50 GFAA O=C(c1ccon1)N1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NC2CCC2)C1 1875250153 BOKVLEAVSXKZBL-JOCHJYFZSA-N 393.491 2.849 0 50 GFAA CC[C@H]1CN(S(=O)(=O)c2cc(Cl)c(OC)cc2C)C[C@]2(CCOC2)O1 408339778 MEDSJHMJGWRZHS-GUYCJALGSA-N 389.901 2.616 0 50 GFAA O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1cnc2n1CCCC2 252487653 HYYSOUVHLDNHCI-LBPRGKRZSA-N 380.217 2.985 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 262505159 ZGRIUKUQQXXNQF-ZDUSSCGKSA-N 399.896 2.750 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)Nc2cnn(-c3ccccc3Br)c2)C1 263094161 SZGILBBFOWULMO-SNVBAGLBSA-N 379.214 2.573 0 50 GFAA CN(C)[C@@H]1CCN(Cc2cn(C)nc2C(=O)Nc2cccc3ccc(O)cc23)C1 2325759956 YVXDSJIBKHXORM-QGZVFWFLSA-N 393.491 2.667 0 50 GFAA CN1C(=O)c2ccc(NC(=S)NC(=O)Cc3ccc(Cl)cc3)cc2C1=O 1123096 FTISAVKAJDRKLF-UHFFFAOYSA-N 387.848 2.622 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3ccncc3)n2C)cc1 897200 XXGVEGOHLBTMHG-UHFFFAOYSA-N 397.460 2.785 0 50 GFAA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)C1 1120018 RTPPZZQALHSCMZ-SNVBAGLBSA-N 396.292 2.966 0 50 GFAA CCn1cc(C2=NO[C@H](C(=O)Nc3cc(C)nn3-c3ccccc3)C2)c(C)n1 4101812 UYIDJKQTKALBFC-SFHVURJKSA-N 378.436 2.837 0 50 GFAA C[C@@]12C=C[C@@](CO)(O1)[C@H]1C(=O)N(c3cc(C(F)(F)F)ccc3Cl)C(=O)[C@@H]12 4818704 PPIVCBCOLCHEFG-MPTQWLOMSA-N 387.741 2.554 0 50 GFAA CC(=O)Oc1ccccc1C(=O)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1 4867544 CDZMFMBKCOUJIT-CQSZACIVSA-N 393.486 2.503 0 50 GFAA O=C(c1cnc2sc3c(n2c1=O)CCCC3)N1CCN(c2ccccc2)CC1 10327462 NUOCVSWFNZMXTI-UHFFFAOYSA-N 394.500 2.597 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)[C@@H]1CCCO1 11814307 PEJRHUJEIUVODX-SFTDATJTSA-N 386.536 2.928 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)c2cn(C3CCCCCC3)nn2)C1 11936482 SOGNPPNEMRTWMM-HNNXBMFYSA-N 384.484 2.642 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(Cc2ccncc2)CC1 11937172 WGXWHUAJZGGYBQ-UHFFFAOYSA-N 399.491 2.510 0 50 GFAA Cn1cccc1-c1cc(C(=O)N[C@H]2CCCN(CCc3ccccc3)C2)[nH]n1 12445838 PFPWVCBYCUAACJ-SFHVURJKSA-N 377.492 2.852 0 50 GFAA O[C@@H]1CCCN(C2CCN(Cc3nc(-c4ccc(Cl)cc4)no3)CC2)C1 12587996 HAQCMVVWWNMKRA-QGZVFWFLSA-N 376.888 2.811 0 50 GFAA CCCN1CCCN(c2ccc(C(=O)NCCCc3c(C)noc3C)cn2)CC1 12713575 XMFHOYWCXZYLJI-UHFFFAOYSA-N 399.539 2.971 0 50 GFAA O=C1OCCCN1CCNc1ccc(-c2nc(Cc3ccccc3)no2)cn1 19148447 HZRAARDJRZYOFP-UHFFFAOYSA-N 379.420 2.977 0 50 GFAA O=C(CN1CCOC1=O)N1CCc2onc(-c3cccc4ccccc34)c2C1 20452792 AMNAJPSNXZGSOO-UHFFFAOYSA-N 377.400 2.832 0 50 GFAA CC[C@@H](C)N1CCc2c(c(C(=O)N3CCOCC3)nn2Cc2ccccc2)C1 20908562 JABCPQCYCNPBFT-QGZVFWFLSA-N 382.508 2.560 0 50 GFAA OCC[C@@H]1CN(Cc2cccc(-n3cccn3)c2)CCN1CCc1ccccc1 23129290 PXWSWXBLUDILNX-XMMPIXPASA-N 390.531 2.984 0 50 GFAA O=C(O)c1cn(C[C@H]2CCCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)nn1 67473285 BZTYSGGGTUZUMS-AWEZNQCLSA-N 379.420 2.524 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3cc(-n4nc(C)cc4C)ncn3)CC2)cc1 67630081 AEQZMSOFGWVUMU-UHFFFAOYSA-N 390.491 2.804 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCc3n[nH]cc3C2)nc1 67833676 YJPCGWWDLUZLFO-UHFFFAOYSA-N 393.495 2.507 0 50 GFAA NC(=O)c1nc(CN2CCO[C@H](CC(c3ccccc3)c3ccccc3)C2)no1 71662607 SNBWUIKQLFIUFF-GOSISDBHSA-N 392.459 2.592 0 50 GFAA Cc1nc(Cn2nc(C3CCNCC3)n(Cc3ccccc3)c2=O)sc1C 71755245 RBUUKTXGMYNOJT-UHFFFAOYSA-N 383.521 2.682 0 50 GFAA CC(=O)c1ccc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)cc1 92028229 LFVKLOHIVKPGPF-UHFFFAOYSA-N 380.492 2.908 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cncc(Cl)c3)CC2)CN1C[C@H]1CCCO1 95380736 BMBCDSKRLWPGSK-QGZVFWFLSA-N 391.899 2.759 0 50 GFAA CNC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3cccnc3)C2)c(C)c1 97679704 MSYCSPLFIBVCLP-SFHVURJKSA-N 381.480 2.536 0 50 GFAA O=C(NCCc1c[nH]c2ccccc12)c1nccnc1C(=O)N1CCCCC1 97759429 JKGMNTGVORHVGI-UHFFFAOYSA-N 377.448 2.557 0 50 GFAA COCC1CCN(C(=O)NCc2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)CC1 112437458 LUFRJTPTFPSQDM-HDICACEKSA-N 389.540 2.864 0 50 GFAA CCO[C@H](C)c1nc(C(=O)NS(=O)(=O)c2ccc3c(c2)CCC3)cs1 123830053 ARMYHWWHJZLUOQ-LLVKDONJSA-N 380.491 2.848 0 50 GFAA CCOc1ccccc1[C@H](CC)NC(=O)CN1CCOC2(CCOCC2)C1 135600596 FXLFZYVNIKZDIH-SFHVURJKSA-N 376.497 2.534 0 50 GFAA Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1cnc(C(F)(F)F)nc1 157326772 XIXJVFRFPXQODU-UHFFFAOYSA-N 394.353 2.529 0 50 GFAA COc1ccc2cc(NC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)ccc2n1 170620601 DJWCGRJYRXZVDS-HOTGVXAUSA-N 381.432 2.747 0 50 GFAA CCOc1cc2c(cc1CN1C(=O)c3ccccc3CS1(=O)=O)O[C@@H](C)C2 170629464 POBDBXOJMXZSEH-ZDUSSCGKSA-N 387.457 2.895 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N(C)C[C@@H]3CCCC[C@@H]3O)CC2)oc1C 182850282 OIDDBNFOPXESRK-OALUTQOASA-N 392.544 2.696 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@H]2[C@H](CCC(=O)N2CCC2=CCCCC2)C1 216883318 CWYULABIYSWHRC-MJGOQNOKSA-N 386.496 2.651 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)c2ccccc2CS(=O)(=O)c2ccccc2)C1 237496572 KJUUJYQYCMBTSP-DLBZAZTESA-N 386.517 2.860 0 50 GFAA NCc1ccc(-c2noc([C@@H]3CCCN3S(=O)(=O)c3cccs3)n2)cc1 261999374 LEGBGGMJOCOLBF-AWEZNQCLSA-N 390.490 2.783 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2c(F)cccc2Cl)[C@@H]1c1cnn(C)c1 275371206 XGKOKEGOBDEBJI-ORAYPTAESA-N 394.878 2.538 0 50 GFAA CN1CCN(C(=O)Nc2ccc3c(c2)CCCO3)C[C@@H]1c1nc(C2CC2)no1 284686408 SESLYGGVFQAJIH-MRXNPFEDSA-N 383.452 2.793 0 50 GFAA Cc1cc(CN2C(=O)[C@@H](Cc3cn(C(C)C)nn3)N=C2O)c2ccccc2n1 328612463 OSFBLQQQIWLFMG-GOSISDBHSA-N 378.436 2.583 0 50 GFAA Cc1ccncc1N1CCN(C(=O)c2cc(N3CCCC3=O)ccc2F)CC1 328784619 KGMQRHLXHOMWOZ-UHFFFAOYSA-N 382.439 2.618 0 50 GFAA CCc1ccccc1OC1CN(C(=O)NCCCc2nnc3ccccn23)C1 584892044 YIIRKRFMTPXDDZ-UHFFFAOYSA-N 379.464 2.697 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)[C@@H]3CN(C)c4ccccc4O3)cc2)CC1 823764834 JZMWZBPMTLZJNT-NRFANRHFSA-N 381.476 2.996 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N(C)C[C@@H]2CCCN(C)[C@H]2c2ccnn2C)c1 868230015 XOGWNPHWUBUGFF-LAUBAEHRSA-N 395.507 2.700 0 50 GFAA CC(=O)NCc1cc(O[C@H]2CCN(c3ncnc4sc(C)cc34)C2)ccn1 886043305 SNSCHAPEUILCDT-INIZCTEOSA-N 383.477 2.689 0 50 GFAA CC(C)c1nc(-c2noc(-c3cc4c(=O)n(C)c(=O)n(C)c4s3)n2)cs1 888101974 SXGNYOFCKSEBMQ-UHFFFAOYSA-N 389.462 2.596 0 50 GFAA COc1cc(S(=O)(=O)N(C)CC[C@H]2CCCCO2)c(OC)cc1Cl 952984093 NWELZSKXYYYXOG-GFCCVEGCSA-N 377.890 2.937 0 50 GFAA CN1CC[C@H](C(=O)N[C@@H]2C[C@]3(CCNC3)Oc3ccccc32)c2ccccc21 1342237957 YIQGYEHNMMSYKY-GWJPWWOOSA-N 377.488 2.982 0 50 GFAA CCC[C@]1(CO)CN(c2cc(Sc3ccc(F)cc3)nc(N)n2)CC[C@@H]1O 1529167598 KJKPTHMJWXKIQG-HNAYVOBHSA-N 392.500 2.699 0 50 GFAA COc1ccc(Cl)cc1-c1ccc(C(=O)N2C[C@H](CO)[C@@H](CO)C2)cc1 1565516823 PLNQUJIPHFCRCE-HZPDHXFCSA-N 375.852 2.688 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN2[C@H](COC[C@H]2C2CC2)C1 1616078335 DEIXTNZWXOJGPI-ICSRJNTNSA-N 381.476 2.514 0 50 GFAA CC[C@@H](C)S(=O)(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704338302 QNMXZKBZZPRDBO-CQSZACIVSA-N 383.510 2.696 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc4c(c3)ncn4C)C1)CC2 1704339446 HBOVQBWTXKXIRA-QFIPXVFZSA-N 390.491 2.550 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3COC[C@@H]2CN(Cc2scnc2C)C3)c(C)o1 1772706637 KCFUPGYYOYQQTB-HOTGVXAUSA-N 375.494 2.634 0 50 GFAA Cc1cnc2c(C(=O)N3CCCN(c4nc5ccccc5o4)CC3)cnn2c1 1772809543 XRNNLYPFQSOKCZ-UHFFFAOYSA-N 376.420 2.531 0 50 GFAA O=C(CCc1ccccc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@]2(CO)C1 1772819849 VOVMVOMAPFIBDV-NZQKXSOJSA-N 382.479 2.711 0 50 GFAA Cc1nnc([C@H]2C[C@@H](O)CN2C(=O)CCCOc2ccc3c(c2)CCCC3)o1 1775959072 DOSYWJILXSJWIW-IEBWSBKVSA-N 385.464 2.750 0 50 GFAA Cn1cc(CCn2ccnc2-c2ccc(OCC(=O)NC(C)(C)C)cc2)cn1 1857695408 IPVUWDOXWJPTMM-UHFFFAOYSA-N 381.480 2.820 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)N1C[C@@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857720440 USBQTOKZFGFBRC-SOAMZJECSA-N 391.389 2.914 0 50 GFAA O=C([C@@H]1CC[C@](O)(c2ccccc2)C1)N1CCN(c2cc(C3CC3)[nH]n2)CC1 1875271633 KZWIZOLCKRSNMR-VGOFRKELSA-N 380.492 2.624 0 50 GFAA COc1ccc2c(c1)OC[C@H](N=c1nc(-c3ccc(OC)c(OC)c3)[nH]o1)C2 2325718212 SQHNDCRNJDIMPF-CQSZACIVSA-N 383.404 2.600 0 50 GFAA COC(=O)c1cn(CC(=O)N2CCC(n3cc(C)cn3)CC2)c2ccccc12 2325727885 REGGBNJEKKXBLA-UHFFFAOYSA-N 380.448 2.797 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)cc1-c1ccccn1 2325786211 SWOGYUOQSUCGCU-CDHQVMDDSA-N 392.459 2.523 0 50 GFAA CC(=O)Nc1ccc(F)c(C(=O)N2CC[C@H](Oc3cccc(C(=O)O)c3)C2)c1 2325792549 QMKWZGZKBHYEOQ-INIZCTEOSA-N 386.379 2.776 0 50 GFAA Cc1ccc([C@H](C)C(=O)NC[C@@](C)(NC(=O)C2(CN(C)C)CC2)C2CC2)cc1 2325793790 HZUSYWIXRRDCEJ-HTAPYJJXSA-N 385.552 2.841 0 50 GFAA O=C1CCCN1c1ccc(CC(=O)N2CC[C@@H](O)[C@H]2c2cccc(F)c2)cc1 2325798756 XRGFXGMHYREHOT-DENIHFKCSA-N 382.435 2.830 0 50 GFAA C[C@]1(CNC(=O)c2ccc3ncnc(O)c3c2)CCN(Cc2ccccc2)C1 2325804812 SPQADYFLRLEYRU-JOCHJYFZSA-N 376.460 2.977 0 50 GFAA COC(=O)[C@@]12COC[C@@H]1CN(C(=O)c1ccccc1OCc1ccccc1)C2 2356136878 AAZKNOXPZWJWMR-JTSKRJEESA-N 381.428 2.527 0 50 GFAA COc1nc2ccccc2cc1-c1cnc2c(N3CCC(O)CC3)nccn12 2356142509 VMMRLDYKCJSZCG-UHFFFAOYSA-N 375.432 2.914 0 50 GFAA COc1ccc(N(CC(=O)NC2CCCC2)S(=O)(=O)c2ccccc2)cc1 654112 FUIYZZLWVCLGLG-UHFFFAOYSA-N 388.489 2.949 0 50 GFAA Cc1ncsc1C(=O)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 2356134811 DAQOOXPTHNJKJS-OXQOHEQNSA-N 388.489 2.752 0 50 GFAA O=C(c1cc(-c2ccccc2)on1)N1CCc2nc(-c3cccnc3)nn2CC1 2356166526 BLNIJAHOMPZFKG-UHFFFAOYSA-N 386.415 2.694 0 50 GFAA O=C(Oc1ccc(Cl)cc1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 3550285 HAVLNNMKYRJBIQ-UHFFFAOYSA-N 399.827 2.719 0 50 GFAA CC[C@H](Sc1nnc(-c2ccncc2)n1C)C(=O)Nc1nnc(C)s1 4736181 NSEJONQCCYWOIA-NSHDSACASA-N 375.483 2.546 0 50 GFAA COC(=O)c1c(SCc2nn(-c3ccccc3)c3c2CCC3)nc(=O)[nH]c1C 112522982 KZOUDOWDPHHSRE-UHFFFAOYSA-N 396.472 2.832 0 50 GFAA CN(C(=O)c1cc2c([nH]c1=O)CCCC2)C1CCN(Cc2ccccc2)CC1 113092433 IAOVQESIWBVFOU-UHFFFAOYSA-N 379.504 2.990 0 50 GFAA CC(CO)(CO)NC(=O)c1csc2nc(-c3ccc(C(F)(F)F)cc3)cn12 67954244 BUKAOYXDUJEGEB-UHFFFAOYSA-N 399.394 2.555 0 50 GFAA CN(C)C(=O)N1CCC(n2nccc2NC(=O)CCOc2ccccc2)CC1 67872479 UHDHKIBEBYDLJL-UHFFFAOYSA-N 385.468 2.609 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@@H]2CCO)cc1 20998899 MKPZJBWHZWTWFE-SFHVURJKSA-N 375.538 2.919 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)c(Cl)c1=O)Nc1ccc(F)cc1F 72119217 BLSIXNQVVKZZKK-UHFFFAOYSA-N 382.798 2.804 0 50 GFAA COCCN1CC(=O)N(C[C@H]2CCCN(C)[C@H]2c2cccc(Cl)c2)C1=O 252535706 GQRLDGJQMFOVPI-QAPCUYQASA-N 379.888 2.634 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@H](C(=O)NCc4cccnc4)C3)CC2)o1 71774729 AMUAAZWBVJMCQM-FQEVSTJZSA-N 396.535 2.976 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NCC[C@H]1CCCNC1)c1ccccc1 238151081 IGCFUOWWCOPLJM-TZIWHRDSSA-N 379.504 2.534 0 50 GFAA O=S(=O)(N[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc2c(c1)CCO2 431879930 FTWZBVMGROIDOG-HNNXBMFYSA-N 378.881 2.832 0 50 GFAA CN(C)c1nc(-c2cccnc2)nc2c1CCN(C(=O)c1cccc(O)c1)C2 71750717 UBCLYAPKUNCYGM-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA Cc1ccn(-c2ccc(NCCNC(=O)c3ccc(C(F)(F)F)cc3)nn2)n1 72446695 RQBUQQCFORTJTG-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA O=S(=O)(Nc1cncc(Br)c1)c1cnn(-c2ccccc2F)c1 158228142 FCNFCTCLCXVTJB-UHFFFAOYSA-N 397.229 2.970 0 50 GFAA CCOc1ccc2nc(CN3CCc4[nH]nc(C(=O)N(C)C)c4C3)ccc2c1 216212377 KDOANHHRNZEDOT-UHFFFAOYSA-N 379.464 2.617 0 50 GFAA C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)Nc1cnn(-c2ncccn2)c1 376817562 CEGXXDYRPNAVEY-CYBMUJFWSA-N 393.455 2.520 0 50 GFAA CNS(=O)(=O)c1cccc([C@H](C)NC(=O)c2cnn(C3CCCC3)c2C)c1 131677750 YGXQEFAWFWQJEN-ZDUSSCGKSA-N 390.509 2.706 0 50 GFAA COc1ccc2c(CC(=O)N3CCC(n4cc(C(=O)O)cn4)CC3)coc2c1 263234058 SJBMZWGHRPPOOR-UHFFFAOYSA-N 383.404 2.742 0 50 GFAA CNc1cc(N2CCC[C@@H]2CNc2cc(C)nc(-c3cccnc3)n2)ncn1 171986543 XBRHTDRYFKVAQI-MRXNPFEDSA-N 376.468 2.760 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1CCN(c2cccc(Cl)c2)C(=O)C1 82083888 NJRMTTNGPFEXKJ-UHFFFAOYSA-N 381.823 2.614 0 50 GFAA Cc1ccc(N2C(=O)[C@H]3[C@@H](c4ccc(F)cc4)N4CCCN4[C@H]3C2=O)cc1C 135645274 UREZEQAUZAHWSP-XUVXKRRUSA-N 379.435 2.978 0 50 GFAA O=C(C1CCN(c2cnccn2)CC1)N1CC[C@H](COCc2ccccc2)C1 172813051 YRGOYVFPYBBRIV-IBGZPJMESA-N 380.492 2.758 0 50 GFAA O=C(CN1CC[C@H](CN2CCCCC2)C1)Nc1ccccc1N1CCCC1=O 173882216 VFMSVKTVPZHUCD-GOSISDBHSA-N 384.524 2.560 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)N2CC=C(c3ccc(F)cc3)CC2)CCC(=O)N1 220533936 NGRDABNBRVSJPL-OAQYLSRUSA-N 388.439 2.735 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)c2onc4c2CCCC4)C3)no1 426526544 YCGASSGFQBUOEL-UHFFFAOYSA-N 379.420 2.814 0 50 GFAA COc1ccccc1CN1CCC(CN(CC(C)C)C(=O)[C@@H]2C=CCN2)CC1 95509764 TYBAOUYLMRPGKZ-NRFANRHFSA-N 385.552 2.920 0 50 GFAA Cc1cc(N2CCC3(CCC(=O)N(Cc4cccnc4)C3)CC2)nc(N(C)C)n1 91289291 ABPGDDVHNNQZFA-UHFFFAOYSA-N 394.523 2.655 0 50 GFAA CC[C@@H](OC)C(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91636821 FXMIBPQHIUHWJM-QGZVFWFLSA-N 380.435 2.731 0 50 GFAA CC(C)c1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)on1 95508562 MIHFWJHLFYWVEY-UHFFFAOYSA-N 383.496 2.807 0 50 GFAA CC(C)N1CCN(c2ccc(C(=O)Nc3cncnc3N3CCCC3)cc2)CC1 177565269 OGLBISAMIZKISR-UHFFFAOYSA-N 394.523 2.860 0 50 GFAA CCc1cc(N2CCC(NC(=O)CCn3cnc4ccccc43)CC2)ncn1 178204847 DTHBEZJARPCDMI-UHFFFAOYSA-N 378.480 2.564 0 50 GFAA COC(=O)c1cn(CCn2c(C(C)C)nc3ccccc32)cc2c(=O)[nH]nc1-2 263587995 NUVLZLNQYOJBQQ-UHFFFAOYSA-N 379.420 2.636 0 50 GFAA NCCCOc1ccc(C(=O)N[C@H]2CCCN(C(=O)c3cccs3)C2)cc1 299799538 HCBJBIPTLMWDMZ-INIZCTEOSA-N 387.505 2.510 0 50 GFAA Cc1cccnc1C[C@H](C)NC(=O)c1cccc(-c2nc(N(C)C)n(C)n2)c1 299776803 LZPJDKNEENKMFB-HNNXBMFYSA-N 378.480 2.613 0 50 GFAA CCc1csc(CNS(=O)(=O)c2ccc(-c3nnc(C4CC4)o3)o2)n1 823542117 CBPBMECBMCTALO-UHFFFAOYSA-N 380.451 2.704 0 50 GFAA Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)C2CCN(Cc3ccccc3)CC2)cn1 269460918 RYSCYIMBKZREMS-NRFANRHFSA-N 394.519 2.896 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccnc(O[C@@H]2CCOC2)c1 273330223 RAIWVJQXUFNTKS-QGZVFWFLSA-N 381.432 2.702 0 50 GFAA CCCC(=O)Nc1ccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1 1529104672 SCPVGIHOMMPLMC-TZIWHRDSSA-N 382.460 3.000 0 50 GFAA O=C(c1c(F)cccc1F)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697502 RKXIPYBQKXUGAN-UHFFFAOYSA-N 396.401 2.856 0 50 GFAA CCN(CC)CCN1C(=O)CC[C@@H]2CN(C(=O)c3sccc3C)CC[C@@H]21 12000127 DSVUMYSJQJORKV-SJORKVTESA-N 377.554 2.851 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)N[C@H]4CCCCNC4=O)cc3o2)c1 12752751 PWHGZXLSRVQQDE-KRWDZBQOSA-N 379.416 2.902 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 14974184 YOQCKKPSSCCPBS-OAQYLSRUSA-N 387.430 2.727 0 50 GFAA Cc1ccccc1Nc1nc(N)nc(CN2CCN(Cc3ccccc3)CC2)n1 19899169 KEVQTWVMMHSWOS-UHFFFAOYSA-N 389.507 2.824 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCC4(CC3)C[C@H](O)C[C@H](C(C)C)O4)cc2n1 1857700432 HRWDPKNGHNSMOI-SJLPKXTDSA-N 386.496 2.517 0 50 GFAA O=C(CC1=CCCC1)N1CC[C@@]2(C1)Cn1c(nnc1-c1ccc(O)cc1)CO2 1857707305 MTFCBYMAJVCZQL-OAQYLSRUSA-N 380.448 2.652 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2cc(-n3cccn3)ccc2Cl)CC[C@H]1O 1857720731 HIYFCOUZNLQCBQ-MJGOQNOKSA-N 377.872 2.511 0 50 GFAA Cc1cc(C)nc(CN(C)C(=O)[C@@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)c1 1857721334 KLHUBZJAEVVHNZ-CQSZACIVSA-N 387.509 2.685 0 50 GFAA COc1c(O)nc(O)nc1C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 416243279 OMNWTVUJTAUZPS-NSHDSACASA-N 397.353 2.935 0 50 GFAA O=C1NCC[C@@H]1N1CCN(c2cccc(OCc3ccccc3Cl)c2)CC1 253415621 GCNOYWMCWALGQN-FQEVSTJZSA-N 385.895 2.930 0 50 GFAA O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H](c2c[nH]c3ncccc23)C1 825118477 KNTBQSYUVOPANS-QGZVFWFLSA-N 391.475 2.814 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)[C@H](CCS(C)(=O)=O)c3ccccc3)c2c1C 1875265417 JAXSRJZIONAWLC-OAHLLOKOSA-N 386.477 2.732 0 50 GFAA CC(C)NC(=O)NCCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1 1875327220 PKVYGIQNHFCAKI-HNNXBMFYSA-N 387.311 2.505 0 50 GFAA C[C@H](OC1CCCC1)C(=O)NCCCN(C(=O)C1SCCS1)C1CC1 1875347834 TZXPRVMXOUZGJG-ZDUSSCGKSA-N 386.583 2.638 0 50 GFAA CCN1CCN(C(=O)c2cc(Cl)ccc2OC[C@H]2C[N@@]2CC2CC2)CC1 1875383828 BJUHJPFUZVQMCY-MZNJEOGPSA-N 377.916 2.591 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)C(=C(O)N[C@H]1CCS(=O)(=O)C1)S2 2083176133 BKOZBLITUOKODU-JTQLQIEISA-N 393.534 2.500 0 50 GFAA O=C([C@@H]1CCc2nncn2CC1)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1 2325791026 KFGMJXKMZUPNCL-CQSZACIVSA-N 396.882 2.859 0 50 GFAA CC(C)c1c(NC(=O)c2cnc3c(c2)CCNC3)c(=O)n(-c2ccccc2)n1C 2325857292 WIAHJUHVSBIYMD-UHFFFAOYSA-N 391.475 2.592 0 50 GFAA Cc1ccc(-c2nn(C)c(=O)c3ccccc23)cc1S(=O)(=O)N1CCCC1 1117199 NUJJHPHCCIDJIE-UHFFFAOYSA-N 383.473 2.693 0 50 GFAA O=C(NCc1ccco1)c1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1 1129252 YBVSKAXIDLPZGL-IBGZPJMESA-N 378.384 2.988 0 50 GFAA Cc1nonc1[C@@H]1CCCN1C(=O)c1cc2c(s1)CCOC21CCNCC1 2356158232 FYOZJUWUZBLCGN-AWEZNQCLSA-N 388.493 2.568 0 50 GFAA COc1cc(COC[C@@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC 2686946 HBVSYOPPYRXUFP-IBGZPJMESA-N 387.476 2.648 0 50 GFAA CN(C)CC(=O)N[C@@H]1CCC[C@@H](CN2CCC(Oc3ccccc3F)CC2)C1 2356162609 GSNHRURPXWHLNO-QZTJIDSGSA-N 391.531 2.906 0 50 GFAA COc1ccc(CCNC(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)cc1OC 2863181 SOMAKHCRJXPSOJ-AWEZNQCLSA-N 386.448 2.788 0 50 GFAA CCNC(=O)C[C@H]1C(=O)N(c2ccc(F)cc2)C(=O)N1Cc1ccc(F)cc1 2884256 NUXYKGUPCQEZTC-KRWDZBQOSA-N 387.386 2.828 0 50 GFAA CC(C)(C)NC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1 2993746 HYAYCRISCLVZNZ-UHFFFAOYSA-N 378.469 2.931 0 50 GFAA C[C@H](NC(=O)CCNC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763903 DLQJHZNPQZUTHH-INIZCTEOSA-N 384.432 2.551 0 50 GFAA CCc1nnc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)s1 4841653 LSKBBFMERYEMJS-UHFFFAOYSA-N 398.485 2.667 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c(OC)cc1C 6698176 SDXJFVAXNLFRJR-UHFFFAOYSA-N 394.468 2.662 0 50 GFAA Cc1cccc(CN2CCN(Cc3cnn(-c4ccccc4)c3)C[C@H]2CCO)n1 104400712 RLYFFBXUGMCBMZ-HSZRJFAPSA-N 391.519 2.645 0 50 GFAA C[C@@H](Sc1nnc(N2CCOCC2)n1C1CC1)C(=O)c1ccc(F)cc1 115454237 RKHXOIZTVGVZGQ-GFCCVEGCSA-N 376.457 2.952 0 50 GFAA Cc1c(C)n(CCN2CCOCC2)c2ncn3nc(-c4ccc(F)cc4)nc3c12 20589357 CWOLYUYVQIYAGP-UHFFFAOYSA-N 394.454 2.834 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4c(F)cccc4F)CC3)ncn2)n1 67601811 DTTASQXYBVEAEV-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA C[C@@H]1CCCN(c2ccc(C(=O)N3CCC(CN4CCCC4=O)CC3)cn2)C1 20908748 RYEXPSVDUAEUOR-QGZVFWFLSA-N 384.524 2.793 0 50 GFAA O=S(=O)(c1c(F)cccc1F)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 119888212 HNPMYCXYRKMFJB-CYBMUJFWSA-N 396.463 2.851 0 50 GFAA O=C(Nc1ccc(Sc2ccncc2)cc1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252532857 FINDNAJGWYPGRY-HNNXBMFYSA-N 393.472 2.568 0 50 GFAA O=C(c1ccc2c(c1)n(CC1CC1)c(=O)n2C1CCCCC1)N1CCNCC1 77486137 KDAOWLVRVPJKQY-UHFFFAOYSA-N 382.508 2.764 0 50 GFAA CC(=O)N(CC(=O)O)[C@H]1CCCN(CCCOc2c(C)cccc2C)CC1 328604225 JBEVAHAOFOHGFF-IBGZPJMESA-N 376.497 2.860 0 50 GFAA Cc1cc(N2CCO[C@@H](C(=O)NCCc3ccncc3)C2)c2ccccc2n1 72411274 JPTDFGFUEXLSCP-OAQYLSRUSA-N 376.460 2.502 0 50 GFAA O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCN(c2nc3ccccc3o2)CC1 363323034 PNZVSDNJDBRSQL-INIZCTEOSA-N 396.451 2.557 0 50 GFAA CS(=O)(=O)c1ccc([C@@H](O)CN2CCC([C@H](O)c3ccccc3)CC2)cc1 154791080 YPMXQDDNHLQSDB-LEWJYISDSA-N 389.517 2.569 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](C(=O)O)C[C@@H](C(=O)Nc3ccc(C)nc3)C2)c1 72141701 YMYLSYUDZYLQCX-SJORKVTESA-N 381.432 2.500 0 50 GFAA Cc1ccc(C)c(-n2ncc(C(=O)N(CCC(=O)O)C3CCOCC3)c2C)c1 237688267 UYSJGELVGXXEEC-UHFFFAOYSA-N 385.464 2.893 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)NCCc2nc(-c3cccnc3)n[nH]2)c1 72411210 NRHNECSEQJHWKX-UHFFFAOYSA-N 379.464 2.543 0 50 GFAA O=S(=O)(c1cccc2c1OC(F)(F)O2)N1CC2(CCOCC2)[C@H]1C1CC1 333219961 WHZSELGBQKFBOQ-OAHLLOKOSA-N 387.404 2.588 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCCOCC1 71404250 IVYWPQVLHIHMAQ-OAQYLSRUSA-N 385.552 2.612 0 50 GFAA COc1ncc(Cl)c(NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)n1 282191859 HIQHWXPJLIXSMA-XHDPSFHLSA-N 392.891 2.672 0 50 GFAA Cc1n[nH]c(C)c1CC(=O)N1CC[C@]2(CCCN(CC3CCCCC3)C2=O)C1 426388229 XGXOIDZJTXTGFG-JOCHJYFZSA-N 386.540 2.990 0 50 GFAA Cc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2cnccn2)C3)cc1Cl 95360596 QJSVRWOOOXMLNV-GOEBONIOSA-N 384.867 2.815 0 50 GFAA Cn1c(CCNC(=O)N2CCC[C@@H](OCc3ccccn3)C2)nc2ccccc21 426519262 OKHAMVGGPCZODL-GOSISDBHSA-N 393.491 2.902 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)N1CCC(CCn2cccn2)CC1 97099289 WQUNFKKGTRHADE-UHFFFAOYSA-N 383.496 2.896 0 50 GFAA O=C(NCc1cccc(-c2ccccc2)c1)[C@H]1CNC[C@H](C(=O)N2CCCC2)C1 95374057 KHFNJJWHOZMFSX-FGZHOGPDSA-N 391.515 2.818 0 50 GFAA COc1cccc([C@@H]2CN(Cc3nc(C(C)C)no3)C[C@H]2C(=O)O)c1OC 92078166 JCFDDRQQCJKVJW-UONOGXRCSA-N 375.425 2.510 0 50 GFAA CCC(=O)Nc1ccc(F)c(NC(=O)N[C@H]2CCCN(c3ncccn3)C2)c1 96141456 OKBIHLNQCAXAAZ-AWEZNQCLSA-N 386.431 2.755 0 50 GFAA C[C@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1)[C@]1(C)CCCO1 239636961 BHUSKJQLELFQKN-ZNUVSDCZSA-N 396.535 2.998 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 183532267 FIGBXIKEXWSCLG-UHFFFAOYSA-N 377.444 2.791 0 50 GFAA CN(Cc1n[nH]c2c1CCC2)C(=O)NCCc1csc(-c2cccnc2)n1 534669036 IAPOJSCURYJMDN-UHFFFAOYSA-N 382.493 2.801 0 50 GFAA CC[C@H](Cc1cccc(Br)c1)C(=O)N1CCO[C@@H](CC(=O)O)C1 299753724 ZDMILKFNYBDYTC-HIFRSBDPSA-N 384.270 2.720 0 50 GFAA COC(=O)COc1ccc(NC(=O)N(C)Cc2noc(C3CCCC3)n2)cc1 299771979 YSZDNZVQMJFXRA-UHFFFAOYSA-N 388.424 2.943 0 50 GFAA O=C(c1ccccc1[C@@H]1CCNC1)N1CCc2nnc(-c3ccccc3)n2CC1 72161326 WLCRTODGLCPVPN-GOSISDBHSA-N 387.487 2.721 0 50 GFAA Cc1c(C(=O)N[C@H](C)CN2CCc3ccccc3C2)cnn1-c1ccccn1 670458651 GGJBCRIDDJAPBC-MRXNPFEDSA-N 375.476 2.752 0 50 GFAA Cc1ccc2nc(SCC(=O)N3CCN(CC(C)C)[C@@H](CCO)C3)[nH]c2c1 952991805 SSBKAXIKTUNJGB-INIZCTEOSA-N 390.553 2.515 0 50 GFAA CCN(C(=O)c1ccc(CNC(N)=O)cc1)[C@@H]1CCN(Cc2ccccc2)C1 186342332 LSZKEISTHGEYJB-HXUWFJFHSA-N 380.492 2.592 0 50 GFAA Cc1cnn(C[C@@H]2CN(Cc3nnc(-c4ccc(Cl)cc4)n3C)CCO2)c1 186329579 HIERVBQYCIUGEK-KRWDZBQOSA-N 386.887 2.541 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2ccc(-c3ccccc3F)o2)C1 275558516 FOLHBXZLNZQWBA-CQSZACIVSA-N 395.438 2.804 0 50 GFAA O=C(NC1CCN(c2cccnn2)CC1)N[C@H]1CCCN(c2ccccc2F)C1 277512015 QRBKGKCSNHAUCS-KRWDZBQOSA-N 398.486 2.553 0 50 GFAA Cc1nc(CNC(=O)[C@@H]2CC[C@H](NS(=O)(=O)c3ccccc3C)C2)cs1 212720606 DYMKMZPWSZRLJA-CABCVRRESA-N 393.534 2.523 0 50 GFAA C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1cc(=O)n(-c2ccccc2)[nH]1 1529174791 XZIJJTDIVKWWSU-AWEZNQCLSA-N 379.416 2.770 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H]2CCCCO2)ccc1F 1704313383 PCEAXFPSAMFYPF-CYBMUJFWSA-N 377.416 2.854 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)Cc3coc4c(C)c(C)cc(C)c34)C[C@H]2O)n[nH]1 1704280463 UXVVHVZWAIQFIA-VQIMIIECSA-N 381.476 2.994 0 50 GFAA Cc1c(CC(=O)NC(C)(C)CO)c2c(n1Cc1ccc(F)cc1)CCCC2=O 12593223 DXQIPVUUNBVNHP-UHFFFAOYSA-N 386.467 2.933 0 50 GFAA CC[C@@]1(C(=O)OC)C[C@H](C(=O)N2CCCCO2)[C@H](c2ccc(OC)cc2)N1C 14956708 GROXWNHXNOMTGV-WFXMLNOXSA-N 390.480 2.564 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)/C=C/c2ccncc2)CC1 15066927 GCTWSSZXZLRQNU-HSTAZWAASA-N 398.551 2.714 0 50 GFAA O=C(NN1C(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C1=O)c1cccnc1 18102772 BLZFNNJHAMBXRO-ZAYGCWILSA-N 395.418 2.619 0 50 GFAA CNC(=O)CC[C@H]1CN(Cc2cccc3ccccc23)CC[C@H]1N1CCOCC1 19743760 GJCCJXUKJQQMOU-JTHBVZDNSA-N 395.547 2.889 0 50 GFAA COc1cc(C(=O)N[C@H]2C[C@@H](Cn3cccn3)C[C@@H]2O)ccc1OC1CCCC1 1857532584 VENXKERMXMUPCA-MNEFBYGVSA-N 399.491 2.783 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCN(c3ccc(F)cn3)[C@H](C)C2)cn1 1857670673 XCFWQYYMPMZFPM-OAHLLOKOSA-N 395.438 2.766 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(c3cc(C(F)(F)F)ncn3)CCN12 1857675301 RUYRRVLGNAXHIF-QGZVFWFLSA-N 378.354 2.749 0 50 GFAA CC[C@@]1(C(=O)NCCc2nccs2)C[C@@H]2CC[C@H]1N2CCCn1cccn1 1857698059 UUPHJSWHYAFAPR-SQGPQFPESA-N 387.553 2.722 0 50 GFAA COc1ccc(-c2nccn2[C@@H]2C[C@H]3CO[C@@H](CCO)CN3C2)cc1Cl 1857719232 HQBSOZFLQQEYRX-PMPSAXMXSA-N 377.872 2.609 0 50 GFAA CCCS(=O)(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3CC)C[C@]23CC[C@H]1O3 1875246853 CGWMMTOUPSHELC-DOIPELPJSA-N 392.565 2.558 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(F)cc4)[C@H]4CC[C@]3(C2)O4)c1 1875248794 OZXYVVIPHDZUSX-JZJXAQOMSA-N 381.451 2.943 0 50 GFAA CC(C)c1cccc(S(=O)(=O)N2CCC[C@@H](c3nn(C)cc3C(=N)O)C2)c1 328602500 BSQQMENACBFBTQ-OAHLLOKOSA-N 390.509 2.995 0 50 GFAA Cc1ccccc1OCC(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 1704328169 YFUNCHPUYKNRSN-QFIPXVFZSA-N 380.492 2.736 0 50 GFAA CN(C)CC(C)(C)CNC(=S)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 853047584 BIIVWMMMTNOHBC-QZTJIDSGSA-N 390.597 2.780 0 50 GFAA c1cncc(-c2nc3c(c(=NCCN=c4ccc5ccccc5[nH]4)[nH]2)CCC3)c1 1875253978 PCKIHWKAFCHUFX-UHFFFAOYSA-N 382.471 2.943 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CC(N(CC)C(=O)OC(C)(C)C)C2)cc1 1875370308 JTTOKASPHUDAEK-UHFFFAOYSA-N 387.480 2.570 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CC[C@@H](CCC(=O)O)C1 1875300593 JTXFODDENAIWMU-GXFFZTMASA-N 375.391 2.879 0 50 GFAA O[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1NCc1ccccc1-n1nnc2ccccc21 1875399773 IWFCIFUPIOIZFV-DKZVUGQWSA-N 388.475 2.546 0 50 GFAA COc1ccc(CCNC(=O)CSCC(=O)Nc2ccccc2)cc1OC 2311794 IQURCZBNHSHROO-UHFFFAOYSA-N 388.489 2.734 0 50 GFAA biogenic CN1C(=O)[C@@H]2[C@H]3c4ccccc4C=CN3[C@H](C(=O)c3ccc(F)cc3)[C@@H]2C1=O 20598106 PALMNRKJZYOPEU-MANSERQUSA-N 376.387 2.649 0 50 GFAA CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2c(C(F)F)nc3cnccn23)C1 897406808 FKCRUQFISMWHOD-LLVKDONJSA-N 380.395 2.861 0 50 GFAA COC(=O)c1c(NC(=O)CSc2nnc3ccccn23)sc(C)c1C 723987 OVGMRCZRVDWSEP-UHFFFAOYSA-N 376.463 2.925 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccc2c(c1)OCO2)c1cccc2ccccc12 882406 SDUMJVUHRNOMPS-UHFFFAOYSA-N 398.440 2.973 0 50 GFAA CCOc1cc(S(=O)(=O)n2nnc3ccccc32)ccc1Br 1079140 JNJJLKHCOIXTTQ-UHFFFAOYSA-N 382.239 2.830 0 50 GFAA COc1cccc(C(=O)C[C@]2(O)C(=O)Nc3ccc(Br)cc32)c1 1135199 IKFMJNOEASPXEJ-QGZVFWFLSA-N 376.206 2.870 0 50 GFAA biogenic O=C(O)CCC(=O)O[C@@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O 1481892 UCUOKZUJHTYPJT-IBGZPJMESA-N 386.791 2.864 0 50 GFAA O=C1CCc2c1cccc2C(=O)N1CCc2nc(Cc3ccccc3)nn2CC1 2356139235 USHAPPVMZRJUJN-UHFFFAOYSA-N 386.455 2.696 0 50 GFAA COc1ccc(C(=O)Nc2ccc(F)cc2)cc1S(=O)(=O)N1CCCC1 2833979 LVDRVCCQQVQBMU-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA COc1ccccc1CNC(=O)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356157466 MHHBCEWWGODTIB-UQNRQAKVSA-N 391.471 2.643 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)CCc2ccccc2Cl)C1=O 2356164692 CRZVJNFPJYKRKA-HXUWFJFHSA-N 378.900 2.903 0 50 GFAA CCN(CC)C(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1 3463496 PXSMOKXQFZEDHT-UHFFFAOYSA-N 378.469 2.885 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccncc2)cc1NC(=O)c1ccccc1 4935305 CDGCMLUYVBNELK-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA Cc1ccc(C(=O)N/C(=C\c2cccs2)C(=O)N2CCN(C)CC2)cc1C 20149046 UFXVSRTUKSXPMP-RGEXLXHISA-N 383.517 2.910 0 50 GFAA Cc1nc(CN2C(=O)N[C@@](CCCc3ccccc3)(C3CCNCC3)C2=O)co1 67677628 MDDQCYFORJBGNN-QFIPXVFZSA-N 396.491 2.796 0 50 GFAA CCC(C)(C)[C@H]1CCCN1C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 133719293 VTMQZLWLZJFHQJ-GOSISDBHSA-N 393.553 2.910 0 50 GFAA CCN1C[C@@H](NC(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)CC1=O 67588592 SIIHIHOIEDGTNZ-LBPRGKRZSA-N 397.353 2.623 0 50 GFAA CN(C(=O)NCc1cccc(OCCN2CCOCC2)c1)c1ccc(F)cc1 252549216 QVWDNCMZBKSRLY-UHFFFAOYSA-N 387.455 2.883 0 50 GFAA Cc1nn(CCO)cc1CN1CCC[C@@H](c2[nH]ncc2Cc2ccccc2)C1 77489664 BCSHOURDMTWBHR-LJQANCHMSA-N 379.508 2.877 0 50 GFAA COc1cc(F)ccc1NNC(=O)[C@@H]1CCCN1c1ncnc2sccc12 253433322 VPQZMKHHNDFMEN-AWEZNQCLSA-N 387.440 2.951 0 50 GFAA CN1CCC(N(Cc2ccco2)C(=O)NCc2ccc(-n3ccnc3)nc2)CC1 363100051 UBJWOSKNPVQEIG-UHFFFAOYSA-N 394.479 2.666 0 50 GFAA CCOCC(C)(C)CNC(=O)N1CCC(O)(Cc2ccccc2OC)CC1 365704774 QSZHNLRRFRQJKX-UHFFFAOYSA-N 378.513 2.837 0 50 GFAA Cc1cc(=O)c(O)c([C@@H](CC(N)=O)c2ccc(-c3ccccc3C(=O)O)o2)o1 217704264 JXYNTACEWSZZET-ZDUSSCGKSA-N 383.356 2.619 0 50 GFAA biogenic O=C(c1ccnc(-n2cnnc2)c1)N1CCO[C@@H](CCCc2ccccc2)C1 71748860 WSKINRLAZQXRNF-IBGZPJMESA-N 377.448 2.526 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CC4(CCNCC4)C[C@@H]3C(=O)O)coc2c1C 72133810 GNZBNDDHZZXEKK-QGZVFWFLSA-N 384.476 2.956 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@@H](CCc3c(F)cccc3F)C2)n1 71639698 FGODZPKEARXCEF-HNNXBMFYSA-N 375.419 2.701 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)NCc3nccn3C(F)F)CC2)cc1 171326431 LUXKJAXFZKWEDY-UHFFFAOYSA-N 391.422 2.691 0 50 GFAA CC(C)c1nnc([C@@H]2CN(C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CCO2)o1 284886502 NKCCEKGLQAHQCW-INIZCTEOSA-N 397.435 2.650 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCc1csc(-c3ncccn3)n1)C2 95367382 DVNINKLJUFHUKR-AWEZNQCLSA-N 396.472 2.519 0 50 GFAA CCN(C(=O)c1ccc(-c2cccc(C(F)(F)F)n2)cc1)[C@H]1COC[C@@H]1O 426359427 DIIZJWRGBBOKOF-HOTGVXAUSA-N 380.366 2.989 0 50 GFAA CCOC(=O)N1CCC(NC(=O)Nc2snnc2-c2ccccc2)CC1 95498451 NCSXRJAJMJQSAY-UHFFFAOYSA-N 375.454 2.948 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CCNC(=O)[C@H]3Cc3ccccc3)oc2c1 97532613 VGHWXFHRGKCUAK-GOSISDBHSA-N 378.428 2.933 0 50 GFAA CCN1CCN([C@H]2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)C2)CC1 182063073 XKAQYKMDDXLLIX-JCYILVPMSA-N 375.479 2.984 0 50 GFAA CC1(C)CN(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)C[C@H](C(F)(F)F)O1 293312749 LOXLJHVSTMFPMU-GFCCVEGCSA-N 395.403 2.632 0 50 GFAA CO[C@H]1COC[C@@H]1NC(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1 824506442 FDJRMPOWLFUQEJ-VXKWHMMOSA-N 394.515 2.750 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)c1cccc(NC(=O)[C@@H]2CCCO2)c1 670467392 PQFSRKXTBSDMNE-IBGZPJMESA-N 382.464 2.726 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@@H](C)N3CCc4ccccc43)CC2)ncn1 186209418 ZLHJBSIRZHZMRQ-MRXNPFEDSA-N 395.507 2.729 0 50 GFAA O=C(Cc1n[nH]c2c1CCCC2)NCc1cccc(COC2CCOCC2)c1 188914106 RJSLWBNJMQCUDF-UHFFFAOYSA-N 383.492 2.843 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)CCCc1nc(-c2cccnc2)no1)C1CC1 1506401169 MLJIGUXQAXKEJS-UHFFFAOYSA-N 394.479 2.996 0 50 GFAA Cc1cccc(SC2CCN(C(=O)COc3ccc4nncn4n3)CC2)c1 1506395892 AVIQTSOBWMNCIE-UHFFFAOYSA-N 383.477 2.595 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cnc(C(C)C)nc2)cc1OC 1529158589 GXUHCKQUGCRSFZ-WOJBJXKFSA-N 387.480 2.552 0 50 GFAA COc1ccc2cc([C@H](C(=O)O)N3CCC(N4CCC(O)CC4)CC3)ccc2c1 1529138960 KTGPNDMGZPZIFP-JOCHJYFZSA-N 398.503 2.895 0 50 GFAA COc1cc(C(=O)N2CCCN(C(=O)[C@H](C)c3ccccc3)CC2)ccc1O 1529191943 KEECPKOIOKHQFW-MRXNPFEDSA-N 382.460 2.879 0 50 GFAA CC(C)[C@H](NC(=O)/C(=C\c1ccc(F)cc1)NC(=O)c1ccccc1)C(=O)O 5102879 QKGRIBSRJBJWAO-WQJNHMDYSA-N 384.407 2.822 0 50 GFAA CCc1nccn1CCC(=O)N1CCCN([C@H]2CCN(c3ccccc3)C2)CC1 1775979481 IQJJLGPUAZVJIE-NRFANRHFSA-N 395.551 2.649 0 50 GFAA Cc1ccccc1N1CCN([C@@H]2CCCN(C(=O)CCN3CCCCC3)C2)CC1 11667931 IYKHNULCHRBCBY-JOCHJYFZSA-N 398.595 2.984 0 50 GFAA COc1ccccc1O[C@@H](C)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 12380856 WITKSDGUSUVLFN-HNNXBMFYSA-N 384.432 2.574 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cc[n+]([O-])cc1 12454080 LEPCWRSWRXJMTJ-FQEVSTJZSA-N 397.519 2.745 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1ccccc1)C2 14533567 BYUABPJYFBKVMB-QGZVFWFLSA-N 384.549 2.739 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3cc(OC)ccc3F)CC2)CC1 14966390 YVYIHLAPWXFBJI-UHFFFAOYSA-N 391.531 2.991 0 50 GFAA CO[C@H](C(=O)N1CCOc2ccc(CN3CCOCC3)cc2C1)c1ccccc1 14993671 WGCLDNRWNSOFTO-QFIPXVFZSA-N 396.487 2.628 0 50 GFAA Cc1nccnc1N1C[C@@H]2[C@H](CNC(=O)C3CCCCCC3)[C@H]3CC[C@]2(C1)O3 1857717417 OOFOZUKGKYGRAZ-JZJXAQOMSA-N 384.524 2.855 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCc4c(NC5CC5)nc(C)nc43)C2)cn1 1875244511 MTIYPZSTIDVZMU-JOCHJYFZSA-N 393.491 2.883 0 50 GFAA CCCn1cc(CN2C[C@@H]3OC(=O)N(CCc4ccc(F)cc4)[C@@H]3C2)c(C)n1 247992494 BINVZAJPPFFAHR-UXHICEINSA-N 386.471 2.988 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2n[nH]c3c2CCC3)cc1 247918040 WOZGRZJWBNVDCC-SJORKVTESA-N 380.492 2.644 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)Cc2c(C)noc2Cl)CC1 363193107 GKLJOCZSWYVHNC-UHFFFAOYSA-N 375.856 2.908 0 50 GFAA O=C(CNc1ccccc1Sc1ccccc1)NC[C@H]1CCS(=O)(=O)C1 1875262151 VZCFKTLZPLIBCD-OAHLLOKOSA-N 390.530 2.801 0 50 GFAA Cc1ccc(NC(=O)CN2CCN(C(=O)c3n[nH]c4ccccc34)CC2)c(C)c1 1875253924 JKNJTLNXRKJHBP-UHFFFAOYSA-N 391.475 2.576 0 50 GFAA COC(=O)[C@H]1CN(C(=O)N2CCc3[nH]nc(C(F)(F)F)c3C2)c2ccccc21 1875264212 GDVIMLUHRCHHGT-NSHDSACASA-N 394.353 2.683 0 50 GFAA CN1CCc2nc(C(=O)N(C)[C@@H](c3ccc(F)cc3)c3ncc[nH]3)sc2C1 2325822309 PYQBDKBOZLVJMM-INIZCTEOSA-N 385.468 2.855 0 50 GFAA CC[C@H]1SC2=NC(C)=C(C(=O)OC)[C@@H](c3ccc(OC)c(OC)c3)N2C1=O 2251778 FOSGWPWSCKRQPY-GDBMZVCRSA-N 390.461 2.916 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CCC[C@@H](c2cc[nH]n2)C1 2356167867 GKJOSPIOKDWAQV-QGZVFWFLSA-N 392.459 2.707 0 50 GFAA C[C@@H]1CN(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)CC[S@@](=O)C1 458368146 QODLDHXCCBYVTO-LOKFHWFJSA-N 391.468 2.923 0 50 GFAA CCC(=O)N[C@@H](NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl 3147867 UDNQRDMPKDAWOE-NSHDSACASA-N 398.699 2.894 0 50 GFAA CS(=O)(=O)Nc1ccccc1C(=O)Nc1ccccc1C(=O)N1CCCC1 4756714 JWWOBJKPMLFLDL-UHFFFAOYSA-N 387.461 2.546 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nnnn2[C@@H]2C[C@H]3CC[C@H]2C3)cc1 101549720 ZXNNAMQLLOBIED-CORIIIEPSA-N 387.465 2.552 0 50 GFAA O=c1c2c3c(sc2ncn1CCc1ccccc1)C[C@H](N1CCOCC1)CC3 20541288 IHAKGUHNACZNDK-QGZVFWFLSA-N 395.528 2.890 0 50 GFAA COc1ccc(CN2CCN(C3CSCCSC3)C[C@@H]2CCO)cc1C 20451945 NMXSDKVVMSBXQS-SFHVURJKSA-N 396.622 2.721 0 50 GFAA OCC1CCN(c2ncc3c(n2)CCC[C@H]3NC2Cc3ccccc3C2)CC1 23338611 JVQUFTZZTJLFAC-OAQYLSRUSA-N 378.520 2.820 0 50 GFAA COCc1ccc(C(=O)N2CCn3nc(-c4nc5ccccc5[nH]4)cc3C2)o1 67673915 ZBJUNJSFCGNICO-UHFFFAOYSA-N 377.404 2.822 0 50 GFAA COc1ccc(N([C@@H](C)C2CC2)S(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1 122048908 OBYLQYIALJCOPY-LBPRGKRZSA-N 387.461 2.859 0 50 GFAA CCn1ccnc1CN1CCC(Oc2cc(C(=O)NC3CC3)ccc2OC)CC1 12210754 VHMMJCGFQRNDEU-UHFFFAOYSA-N 398.507 2.847 0 50 GFAA CCn1c(SC)nnc1C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1 6176621 OOGBBCJVHVBVMU-UHFFFAOYSA-N 396.538 2.597 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CC(c3ccccn3)C2)nc2cccnc21 77538269 ZZIAQUGIJLYCHV-INIZCTEOSA-N 393.491 2.982 0 50 GFAA COC[C@@H](Cc1ccccc1)N(C)C(=O)c1sc2ncn(C)c(=O)c2c1C 170608888 BHEMBUUXGZQHMP-OAHLLOKOSA-N 385.489 2.633 0 50 GFAA COc1ccc(C(C)(C)CNC(=O)[C@H](CNC(=O)OC(C)(C)C)OC)cc1 253420561 YJFATNGLJRJHTM-INIZCTEOSA-N 380.485 2.629 0 50 GFAA CNC(=O)C[C@H](Nc1nc(O)c2cnn(-c3ccccc3)c2n1)c1ccccc1 481099046 BKTFVRRBPQJFAG-KRWDZBQOSA-N 388.431 2.810 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)c(F)c1 279190277 WHZXGKUJHNJXSR-CQSZACIVSA-N 399.488 2.645 0 50 GFAA CCCCN1CCN([C@@H](C(=O)NC2CCCCC2)c2ccccc2)C(=O)C1=O 77339776 IGOIZPIZLMGNJY-LJQANCHMSA-N 385.508 2.648 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3[C@@H](C)CC[C@H]3C)[C@@H]4C2=O)cc1C 77519696 GRFRXBMIOQVCBE-UDONMYLASA-N 394.515 2.985 0 50 GFAA Cc1c(-c2ccccc2F)[nH]c2ccc(CNC(=O)c3cc(=O)[nH]c(=O)[nH]3)cc12 71765456 VSDDDTKPGAGCSW-UHFFFAOYSA-N 392.390 2.589 0 50 GFAA CN(CC1(CO)CC1)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71638764 XLUGYQJIBDYPIU-DEOSSOPVSA-N 392.499 2.765 0 50 GFAA COc1ncc(CN2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 71747753 LZSWUSJOMWFIJN-LJQANCHMSA-N 386.471 2.883 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)C(=O)[C@@H]1CCCN1C(=O)c1ccccn1 173740066 MFZYODMVQNJDQM-LBPRGKRZSA-N 398.410 2.820 0 50 GFAA CCc1ncnc(N2CCC[C@@H](CNC(=O)Cc3ccc(OC)cc3)C2)c1F 95525322 GUVZFCSJXSNOIN-INIZCTEOSA-N 386.471 2.762 0 50 GFAA CCn1nc(C)cc1C(=O)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95363908 KNORIJIZOZIUGS-CEWLAPEOSA-N 380.492 2.619 0 50 GFAA O=C(NC[C@@H]1CCCS(=O)(=O)C1)c1cc(Oc2ccccc2)ccc1O 288381804 XRFWRHGCQLQLTD-AWEZNQCLSA-N 375.446 2.739 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccc4ncccc4c3)CC2)CN1C[C@@H]1CCCO1 95360662 FPQSFHQGIFZRFG-IBGZPJMESA-N 393.487 2.869 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2cn3ccccc3n2)C1 95497441 QNHIUNLPXZCKBZ-KRWDZBQOSA-N 380.496 2.502 0 50 GFAA COc1cc(CN2CC(c3cccnc3)C2)ccc1OC[C@H](O)CN(C)C(C)C 95499280 FFNYQXLUQNSGMA-OAQYLSRUSA-N 399.535 2.770 0 50 GFAA O=C(NCCc1noc([C@H]2CCCO2)n1)Nc1snnc1-c1ccccc1 95504360 WNDNTJUXYBVKTG-GFCCVEGCSA-N 386.437 2.804 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 181107385 JKWUCAPZOTUHJS-NSHDSACASA-N 391.382 2.895 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCCCc4ccccc4)c3CO2)cc1 263618308 SELKNAKJNUTZDC-HXUWFJFHSA-N 392.459 2.921 0 50 GFAA CCS(=O)(=O)CCNC(=O)N(Cc1ccccn1)Cc1sccc1C 584896759 UEPWWTDIBNTRBY-UHFFFAOYSA-N 381.523 2.598 0 50 GFAA CC(=O)c1ccc(N2CCN(C(=O)NCCCn3nc(C)c(C)c3C)CC2)cc1 584896321 VCHWJDBURQRPGC-UHFFFAOYSA-N 397.523 2.933 0 50 GFAA CCN1CCC[C@@]2(CCCN(S(=O)(=O)CCOc3ccc(F)cc3)C2)C1 952967412 JPQRXZPIWWGBAP-LJQANCHMSA-N 384.517 2.732 0 50 GFAA O=C(c1cccc(Nc2ncccn2)c1)N1C[C@@H]2C[C@@H](C1)[C@H]1CCCC(=O)N1C2 888088532 DYEOVCDKPUXQEM-VDZJLULYSA-N 391.475 2.693 0 50 GFAA CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 189059832 SLUKPRKCAOHYLX-LPHOPBHVSA-N 379.520 2.879 0 50 GFAA O=C(CCc1cc(Cl)no1)N1CCN2[C@H](COC[C@H]2c2ccccc2)C1 1616076171 FGLGTKXGIOZJFI-RDJZCZTQSA-N 375.856 2.545 0 50 GFAA CCOc1ccc(CN2CCCN(C(=O)COCc3ccccc3)CC2)cn1 1529100432 SEFZGSQUHSDQCD-UHFFFAOYSA-N 383.492 2.731 0 50 GFAA Cc1noc(CN2C[C@H]3CN(Cc4cc[nH]n4)C[C@]3(CCc3ccccc3)C2)n1 1772813994 DRMBNYRLKVYTEO-DENIHFKCSA-N 392.507 2.668 0 50 GFAA COc1ccc(CN(C)Cc2ccccn2)cc1OC[C@H](O)CN1CCCCC1 12318803 QFPZOOJIYGOKMB-OAQYLSRUSA-N 399.535 2.948 0 50 GFAA O=C(N[C@@H]1CCOC1)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 12386197 GFTSHFYREGBLLX-GOSISDBHSA-N 392.503 2.754 0 50 GFAA COC[C@H](C)NC(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 12443448 BWLPJUVMKXRUMZ-KRWDZBQOSA-N 383.492 2.890 0 50 GFAA O=C1O[C@@H]2CN(c3ccc(C(F)(F)F)cn3)C[C@@H]2N1CCN1CCCCC1 12755807 GHCIVNMTTRFVGM-LSDHHAIUSA-N 384.402 2.596 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)CC3CCCCC3)CC2)C1 14950121 AYQLAOWBYJBDCY-GOSISDBHSA-N 375.557 2.938 0 50 GFAA Cc1nc(N2CCN(C(=O)Cc3cccc(F)c3)CC2)cc(C(F)(F)F)n1 169780546 RFTWEJFSVITVHC-UHFFFAOYSA-N 382.361 2.834 0 50 GFAA O=C(O)c1cc2c(s1)C1(CCN(C(=O)c3c(O)cccc3O)CC1)OCC2 1857690278 ZQKKROTWTLQWLO-UHFFFAOYSA-N 389.429 2.562 0 50 GFAA CNC(=O)c1cccnc1N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857716607 DPLNHLKWGPJBIE-SOLBZPMBSA-N 386.883 2.721 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)N3CCC4(CCc5ccccc54)CC3)CC2=O)s1 1857727549 SVCVFJCAZSRCDR-MRXNPFEDSA-N 396.516 2.706 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)cn1 125123111 LEMUJKJFMHMPGZ-GFCCVEGCSA-N 380.231 2.781 0 50 GFAA Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N(C)C1CCNCC1 125354622 CJAXWXRSAGLUBA-UHFFFAOYSA-N 395.429 2.656 0 50 GFAA C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCCN1C(=O)CSC1=O 263874106 NHALXKZIZIFPKI-QMMMGPOBSA-N 377.249 2.572 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2CCOc3ccccc32)cc1N1CCNC1=O 266071436 FESLGKWAHJJBDF-HNNXBMFYSA-N 381.432 2.521 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CCCN(Cc3nc(N)c4ccccc4n3)C2)nc1 267128048 CKNSQBCZPCLHDO-HNNXBMFYSA-N 376.464 2.766 0 50 GFAA C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 854666812 GXKKHBXJEPAKSW-IIPCHUTBSA-N 386.492 2.703 0 50 GFAA CC(C)[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H]1c2ccccc2C[C@@H]1O 1875254431 JUHPQLPRUQEULB-ILWGZMRPSA-N 380.488 2.535 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCCOc3ncc(Cl)cc3Cl)n[nH]c21 1875393467 GFOIJRBPDMNBJC-BDAKNGLRSA-N 385.251 2.943 0 50 GFAA Cc1nc(C[C@H]2CCNC2)sc1C(=O)N1CCCCC[C@@H]1c1ncon1 1875315305 ORHFPFMQBZYVQE-ZIAGYGMSSA-N 375.498 2.744 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H](C(=O)OCc2ccccc2)[C@@H](C)CC)CC1 1875370337 KVXHZUSROFEHIS-JXFKEZNVSA-N 386.492 2.685 0 50 GFAA Cc1ccc(C(=O)N2C[C@H](CNc3ncccn3)C3(CCOCC3)C2)cc1F 888103542 LOJXGFCVLFKVRM-KRWDZBQOSA-N 384.455 2.905 0 50 GFAA CCc1ccc(CCC(=O)NC[C@@H]2COCCN2C(=O)/C=C(\C)C2CC2)cc1 1775992524 QWEUWAVBELAJAZ-PVGBUVFQSA-N 384.520 2.882 0 50 GFAA COCCN(C(=O)N=c1cc(Br)n(C)[nH]1)[C@H](C)c1ccccc1 2325731986 LDPLXRMPLNKDTI-GFCCVEGCSA-N 381.274 2.846 0 50 GFAA C[C@@H](c1ccc(S(C)(=O)=O)cc1)c1nc(-c2ccc3ncnc(O)c3c2)no1 2325736414 HEKGQJZZYNIATJ-NSHDSACASA-N 396.428 2.941 0 50 GFAA CCCN1C(=O)[C@@H]2[C@@H](ON(c3ccccc3)[C@H]2c2ccc(O)c(OC)c2)C1=O 135690236 NYPLHDDUBFFRLX-GBESFXJTSA-N 382.416 2.657 0 50 GFAA N=c1nc(O)cc(N2C[C@@H]3C[C@H](C2)[C@@H]2CCCCN2[C@H]3Cc2ccccc2)[nH]1 2356146123 STTKXQFVEDPVSO-XWSJACJDSA-N 379.508 2.517 0 50 GFAA COC(=O)c1ccccc1NC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 2858300 ONSZEQNAKWZASA-UHFFFAOYSA-N 380.404 2.915 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@@]12CCCN2Cc1ccncc1Cl 2356168904 HCXWTZVNDUOYLK-ZWOKBUDYSA-N 377.916 2.996 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987177 KGFLYLCKHGUYDY-HOCLYGCPSA-N 376.363 2.567 0 50 GFAA Cc1ccccc1CNC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 7965973 DXOJBEDVDGQRSN-INIZCTEOSA-N 378.519 2.774 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)CSc2nc3c(c(=O)[nH]2)CCC3)cc1 8844147 JMVRIMJUCMYSNK-UHFFFAOYSA-N 387.461 2.555 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@@H](C)CN(C)C[C@H]1C)c1ccc2c(c1)OCCCO2 221982511 SEVCPFYAKYBLMP-JKSBSHDWSA-N 389.540 2.686 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCN(Cc4ccccc4CO)CC3)c(C)c2c1 55271305 XSGRHTDKBRDCHZ-UHFFFAOYSA-N 393.487 2.935 0 50 GFAA Cc1cc(NC(=O)N2CCN(C[C@@H]3CCCO3)CC2)n(Cc2ccccc2)n1 65751905 LKVWMTQLKFJAHC-IBGZPJMESA-N 383.496 2.568 0 50 GFAA CN1CCN(C(=O)c2cnn(-c3nccc(-c4cccs4)n3)c2C2CC2)CC1 20780125 CZZAGMJNBUSOCG-UHFFFAOYSA-N 394.504 2.656 0 50 GFAA O=C1N[C@@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccncc1 67817795 RCEAZYIRWBQRRO-QHCPKHFHSA-N 392.503 2.895 0 50 GFAA O[C@@H]1CN(Cc2cnc(-c3ccccn3)nc2)CC[C@H]1c1ccc2c(c1)OCO2 65436268 XPTLPLPEPHIBED-PKOBYXMFSA-N 390.443 2.618 0 50 GFAA O=C(Cc1c[nH]c2cc(Cl)ccc12)NC1CCN(C[C@H]2CCOC2)CC1 136833715 VIIZMKBEDFLZSY-CQSZACIVSA-N 375.900 2.981 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 67603892 HLAVGYXCJSVTLC-UHFFFAOYSA-N 396.401 2.856 0 50 GFAA CC(C)(C)C(=O)N1CCC(O)(CS(=O)(=O)Cc2ccccc2Cl)CC1 1386602 YJBPBQKKFDFBDV-UHFFFAOYSA-N 387.929 2.654 0 50 GFAA COc1ccc([C@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C(F)F)cc1F 170605717 VKANFAAWWXUFMP-CJNGLKHVSA-N 384.398 2.905 0 50 GFAA CC[C@H](NC(=O)N1CCc2ccc(S(C)(=O)=O)cc2CC1)c1nccs1 374832911 MUTWIQHZBGZIQO-INIZCTEOSA-N 393.534 2.808 0 50 GFAA CC1=CCN(C(=O)[C@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@H]24)O3)CC1 77427790 BGQBHWDLPNFANQ-CIEVZJJWSA-N 392.499 2.764 0 50 GFAA C[C@H](NC(=O)c1cnn(C)c1Cc1ccccc1)c1ccc(NC(N)=O)cc1 445215047 ZEZVIFCOWZHQPA-AWEZNQCLSA-N 377.448 2.993 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)CC1 375965959 UQPKXWSCSASTNV-CQSZACIVSA-N 388.418 2.755 0 50 GFAA Cc1cc(C(=O)N(C)C2CCNCC2)nn1-c1ccc(Br)cc1 237101772 QDUWSIOEKHLYSW-UHFFFAOYSA-N 377.286 2.767 0 50 GFAA Cc1noc2nc(C3CC3)cc(C(=O)NCc3nc(-c4ccncc4)n[nH]3)c12 412789889 XNRKQKWTLISHRA-UHFFFAOYSA-N 375.392 2.519 0 50 GFAA CC(C)[C@]1(CO)CCN(C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)C1 378049863 PUHVUNYGXRUBGO-HXUWFJFHSA-N 379.522 2.884 0 50 GFAA O=C(Nc1ccc(OCc2ccccn2)c(F)c1)c1cn(C2CCNCC2)nn1 237705095 KYFSLLIGARKFEU-UHFFFAOYSA-N 396.426 2.568 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CN[C@@H]1CCc2cc(F)c(F)c(F)c21 449322254 OPWZFLBCMQXKBL-MRVWCRGKSA-N 376.444 2.789 0 50 GFAA COc1cccc(N2CCN(C(=O)NC3Cc4ccccc4C3)[C@H](C)C2=O)c1 426537722 OZMXTSUDZKKIML-OAHLLOKOSA-N 379.460 2.609 0 50 GFAA COC(=O)Cc1cccc(CCN2CCN(c3noc4ccccc34)CC2)c1 44127012 CTDPRWVNVKMWKV-UHFFFAOYSA-N 379.460 2.908 0 50 GFAA O=C(NC1CC1)c1ccnc(N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3=O)c1 91595878 IBQBSVYBTCGFTR-AZUAARDMSA-N 390.487 2.601 0 50 GFAA CC(=O)c1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(CCCc2ccccc2)C3)n[nH]1 91288770 MKVQRRMDVBWHPU-RBUKOAKNSA-N 380.492 2.782 0 50 GFAA COc1ccc(-n2ccnc2-c2cn(C[C@@H](O)c3ccc(O)cc3)nn2)cc1 91494667 DEUTZLPFHUDZQX-LJQANCHMSA-N 377.404 2.579 0 50 GFAA CC(C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCC(=O)O 141883836 RWMPPRIMKZLKTB-FQEVSTJZSA-N 396.443 2.751 0 50 GFAA CCOc1ccccc1CC(=O)N1C[C@@H](C(=O)O)[C@H](c2cccc(OC)c2)C1 91486096 VWKKYJHEWDCQSC-RBUKOAKNSA-N 383.444 2.963 0 50 GFAA COc1ccc(N2CCN(Cc3cc(=O)c4cc(F)ccc4[nH]3)[C@@H](C)C2=O)cc1 91846933 CPWLJGGGIMHGNN-AWEZNQCLSA-N 395.434 2.913 0 50 GFAA O=C(c1cnc(-c2cccnc2)nc1O)N(CCO)Cc1ccccc1Cl 91594023 KACKSKCNEBWTGE-UHFFFAOYSA-N 384.823 2.532 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2ccc(C)s2)CC1 96165804 XSQBUTMXNVZRPK-UHFFFAOYSA-N 384.509 2.933 0 50 GFAA COc1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cn4ccsc4n2)C3)cc1 96150764 ZPSYUIGOILNFNN-UHFFFAOYSA-N 379.445 2.993 0 50 GFAA Cc1cnn([C@@H]2CCN(C(=O)NC3CCN(CCc4ccccc4)CC3)C2)c1 290619333 GFFOCOYAMHBRFW-OAQYLSRUSA-N 381.524 2.855 0 50 GFAA COc1ccc([C@H](NC(=O)CCC(=O)c2ccc(F)cc2)[C@H]2C[C@@H](O)C2)cn1 243932542 BXGARTUEOSEXHN-XPIZARPCSA-N 386.423 2.821 0 50 GFAA O=C(N[C@@H](c1cccs1)[C@H]1C[C@@H](O)C1)C1(N2CCOCC2)CCCCC1 244748817 OOVYNHOQWKGEAN-SOLBZPMBSA-N 378.538 2.711 0 50 GFAA Cn1c(=O)oc2c(C(=O)NCC3CCN(Cc4ccccc4)CC3)cccc21 179263161 SPUCFOZWZWGJFI-UHFFFAOYSA-N 379.460 2.774 0 50 GFAA Cc1ccc([C@H](CNC(=O)N2CCOc3ccccc3C2)N2CCOCC2)o1 534665471 QTOBWKCYHGBZPW-SFHVURJKSA-N 385.464 2.566 0 50 GFAA CCc1nccn1CCNC(=O)N1CCC[C@@H](Cc2nc3ccccc3[nH]2)C1 534584210 BBNDNHZRRSWKEM-INIZCTEOSA-N 380.496 2.986 0 50 GFAA CC(C)CCN1CCC(N2C[C@@H](COc3ccc(F)cc3)OCC2=O)CC1 299771028 YLMWADRMNLMDBC-FQEVSTJZSA-N 378.488 2.942 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@@H](C)CNC(=O)CCc2c(C)nn(C)c2C)n1 952962472 BSPMPXFJXRNWJP-NSHDSACASA-N 385.434 2.946 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)N1CCC(CNC(=O)C2CC2)CC1 952974524 BSBURCUKOSXDSY-UHFFFAOYSA-N 391.899 2.742 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)CCC(F)(F)F)C[C@H]2C(=O)O)c1OC 91754613 OTJLCAWZKXHDLU-NWDGAFQWSA-N 375.343 2.673 0 50 GFAA Cc1c(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)sc2nccn12 270865303 IRXXMFUKRALGMM-GOSISDBHSA-N 398.532 2.880 0 50 GFAA O=C1NCc2ccc(NC(=O)[C@@H]3CCN(C(=O)OCc4ccccc4)C3)cc21 277744755 PMHHHFIWZWBWSR-MRXNPFEDSA-N 379.416 2.527 0 50 GFAA C/C=C/C[C@@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)C(=O)OCC 170596384 YOVGRRHCAJOPPN-MASHWEEQSA-N 381.372 2.761 0 50 GFAA CC[C@H]1CN(C(=O)C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C[C@H]1O 774489945 HWDICYJTWIHTSD-IFXJQAMLSA-N 391.487 2.762 0 50 GFAA CCN1CCC(N(CCc2ccccn2)C(=O)c2cnc(C3CC3)nc2)CC1 1506429676 WNPIQMIQAAAMLU-UHFFFAOYSA-N 379.508 2.918 0 50 GFAA Cc1cnc(C(=O)N2CCCN(Cc3ccc([C@@H]4CCCCO4)o3)CC2)cn1 1529168804 MIHJPRZMRWCVFN-IBGZPJMESA-N 384.480 2.968 0 50 GFAA Cc1cccc(Cn2ncc(C)c2NC(=O)CC[C@H](C)N2CCN(C)CC2)c1 1529151140 FVUJTJFAUXYVTO-IBGZPJMESA-N 383.540 2.903 0 50 GFAA O=C(c1cc[nH]n1)N1C[C@H]2CN(C(=O)C3CCC3)C[C@@]2(CCc2ccccc2)C1 1772707072 QVTYWQQWZLVGFH-XXBNENTESA-N 392.503 2.743 0 50 GFAA CCOC(=O)N1CCN(C(=O)C2CCN(C[C@H](C)c3ccccc3)CC2)CC1 5672626 SUCJWCZZDVTGRN-SFHVURJKSA-N 387.524 2.803 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(Cc3cn(C)c4ccccc34)C2)CC1 11938550 FNGAQVHDYCUWIB-IBGZPJMESA-N 382.552 2.945 0 50 GFAA COCCN1CCC(CN(Cc2c(C)nn(C)c2Cl)C[C@H]2CCCO2)CC1 12835833 WNCZOGKJCJNWEQ-GOSISDBHSA-N 398.979 2.721 0 50 GFAA COC[C@@H](C)N1CCC2(CC1)C(=O)N(C(C)C)C(=O)N2CCc1ccccc1 14540894 NDQBCAVORFCXHD-GOSISDBHSA-N 387.524 2.771 0 50 GFAA COc1ccc(CN2CCC3(CC2)C(=O)N(Cc2cccnc2)C(=O)N3C)cc1 14753843 UGBAKQWDPXZMBM-UHFFFAOYSA-N 394.475 2.519 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N[C@H]1CCCN(C2CCCCCC2)C1 15061965 RSRUNYLURWKAPH-SFHVURJKSA-N 398.555 2.977 0 50 GFAA COc1cccc(CN2CCN(C(=O)COc3cccc(C)c3)CC2)c1OC 19235145 OZZWIZVFUKIKEN-UHFFFAOYSA-N 384.476 2.735 0 50 GFAA O=C(Cc1cccc(F)c1)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772337 BBFVHXKMKBHIBB-UHFFFAOYSA-N 382.361 2.962 0 50 GFAA O=C(NCc1nnc2c(-c3nc(C4CC4)no3)cccn12)c1ccc(F)c(F)c1 169776330 ZMEUDGCKCVLLOZ-UHFFFAOYSA-N 396.357 2.865 0 50 GFAA COc1ccc(CC(=O)N2CCC[C@@]3(CCc4c(O)nc(C)nc43)C2)cc1F 1857698185 GYKSTTKBYDEBCA-OAQYLSRUSA-N 385.439 2.687 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)COc2ccc(C)c(C)c2)CC1 1857710298 PROXRRCSCZETGE-UHFFFAOYSA-N 381.476 2.993 0 50 GFAA COc1cnc(C)cc1C(=O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857731324 DVYNIYPIFCFVGK-QFIPXVFZSA-N 394.475 2.892 0 50 GFAA COc1cc(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2cscn2)ccc1F 247910294 UKOVLRSJDWNRSN-ZBFHGGJFSA-N 375.469 2.914 0 50 GFAA Cc1ccc(C(=O)NCCC(=O)N2C[C@H]3CC[C@@H](C2)N(CC2CCC2)C3)cc1 248136322 ZTVJKXRTHNSWJU-FPOVZHCZSA-N 383.536 2.838 0 50 GFAA CN1C(=O)COc2ccc(NC(=O)C3CCN(Cc4ccccc4)CC3)cc21 266538360 OLAVFKGUAQMTIY-UHFFFAOYSA-N 379.460 2.893 0 50 GFAA CC(=O)NCC(=O)O[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 835542268 GYCLGOJUIVWEKF-DLBZAZTESA-N 376.453 2.807 0 50 GFAA COc1cccc(N2C[C@@H](NC(=O)N3Cc4ccc(OC)cc4C3)CC2=O)c1 952993350 XZOMQASIJQLKOG-INIZCTEOSA-N 381.432 2.535 0 50 GFAA C[C@H](N=c1nc2sccc2c(N)[nH]1)c1cc(F)ccc1N1CCC(O)CC1 1875286578 YXNXBBLYALKLRT-NSHDSACASA-N 387.484 2.969 0 50 GFAA O=C(NC[C@]1(O)CCc2ccccc21)N[C@@H]1Cc2n[nH]cc2[C@H](C(F)(F)F)C1 1875278177 GEKMZXZQANEZAC-WBHUJUFNSA-N 394.397 2.504 0 50 GFAA O=C(N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1)[C@]1(F)CNCC12CCC2 1875292797 SVIHXEZFPTZIAQ-SUMWQHHRSA-N 397.376 2.511 0 50 GFAA CCC[C@@H](Oc1ccc(Cl)cc1C)C(=O)N1Cc2nc(O)nc(O)c2C1 1875302172 CKTIRUPZXRVXIJ-OAHLLOKOSA-N 377.828 2.940 0 50 GFAA CN(C)C(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)CCCc1ccc(F)cc1)C2 1875394457 JKMZTHZTGQCJFM-YXJHDRRASA-N 385.439 2.853 0 50 GFAA Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NC1CC[C@@H]2C[C@H]2CC1 1875328383 PAMAOZBFSXBYBM-HUUCEWRRSA-N 379.526 2.508 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccccc1-n1ccc(C2CC2)n1 1875400719 JLHDQETUMHYIGG-NYSBEXSLSA-N 391.475 2.516 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1ncncc1Cl 1875402790 LPPJCLHAGLOMAD-IAOVAPTHSA-N 397.866 2.563 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@H](NCCc3ccc(OC)cc3)C2=O)cc1 1902313 VCNNFWMSDYLBFS-FQEVSTJZSA-N 382.460 2.948 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)cc(O)n1 2100557457 SZWLTQMQCFFRST-QFIPXVFZSA-N 379.460 2.893 0 50 GFAA Cc1cnc(NC(=O)c2ccc(S(=O)(=O)NCCc3ccccc3)o2)s1 1857800107 VSKZQATZYZSAND-UHFFFAOYSA-N 391.474 2.818 0 50 GFAA C[C@@H](C(=O)Nc1cccc(NC(=O)c2cnc(-c3ccccn3)nc2)c1)N(C)C 2325872127 JOWYXAPAPHIVSF-AWEZNQCLSA-N 390.447 2.680 0 50 GFAA CC[C@H](Sc1nc(=O)cc(N)n1-c1cccc(C)c1)C(=O)Nc1cc(C)on1 1143036 WLPRYRZXSWHYCR-AWEZNQCLSA-N 399.476 2.929 0 50 GFAA O=S(=O)(Nc1cccc(NS(=O)(=O)c2ccccc2)n1)c1ccccc1 4877444 PZROTDZDODEKEX-UHFFFAOYSA-N 389.458 2.683 0 50 GFAA CCCN(Cc1ccccc1OC)C(=O)c1cc(S(N)(=O)=O)ccc1C 55310685 URKABDYVPGNMSB-UHFFFAOYSA-N 376.478 2.703 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3ccc(F)c(OC)c3)C2)CC1 23359952 KWZDLRXIDLBZMH-QGZVFWFLSA-N 379.476 2.573 0 50 GFAA CC(C)CCN1CCN(Cc2ccc(OCCN(C)C)cc2)C[C@@H]1CCO 20537434 PLSRKBGRMUBIBU-NRFANRHFSA-N 377.573 2.542 0 50 GFAA Cc1nc(C2CCN(S(=O)(=O)c3c(C)cccc3Cl)CC2)cc(=O)[nH]1 23368300 NYCYRTOWXXGKQC-UHFFFAOYSA-N 381.885 2.608 0 50 GFAA O=C1CN(C(=O)c2ccc(Cn3cccn3)cc2)CCN1Cc1cccc(F)c1 150834167 WXMJYQMHIWVDLS-UHFFFAOYSA-N 392.434 2.555 0 50 GFAA O=C(c1cnn2cc(CCO)cnc12)N1CCC[C@H](CCc2ccc(F)cc2)C1 71747661 ZBMIABKEIZGMPQ-QGZVFWFLSA-N 396.466 2.888 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)c(C)c1 77135981 GBQRFDJPWQWOLR-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Cc1cccc(NC(=O)c2cc(N3CCOCC3)ccn2)c1C(=O)N1CCCC1 129474552 XAMXKUQGWRFCQY-UHFFFAOYSA-N 394.475 2.715 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2CC[C@@H](O)[C@H]2C1 329765454 XAFAXMGTGXKZKV-VBNZEHGJSA-N 398.463 2.978 0 50 GFAA O=C(N[C@H]1CCN(C2CCOCC2)C1=O)c1cc(Cl)cc(C(F)(F)F)c1 363765904 GNAWDYUHIVRTNL-AWEZNQCLSA-N 390.789 2.869 0 50 GFAA Cc1c(NC(=O)c2csc(-c3ccc(C)n3C)n2)cccc1S(N)(=O)=O 156854832 LXVQBTWHQJBBCD-UHFFFAOYSA-N 390.490 2.665 0 50 GFAA O=C(C1CCN(CC(F)F)CC1)N1CCOC[C@@H]1Cc1c[nH]c2ccccc12 377153538 VVJQNMZVZDZDKN-KRWDZBQOSA-N 391.462 2.915 0 50 GFAA CCN1C[C@]2(CCCN(C(=O)c3cc(-c4ccccc4O)n[nH]3)C2)CCC1=O 72418064 FMFGGDCSUWEWHJ-NRFANRHFSA-N 382.464 2.647 0 50 GFAA N[C@@H](C(=O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2)c1ccccc1 82161034 YKYBDVRKNIIJLX-OAQYLSRUSA-N 381.524 2.738 0 50 GFAA CN(C[C@H]1COc2ccccc2O1)C(=O)CCCc1nc(-c2cccnc2)no1 426505600 BSKXGVWIYUUQMF-INIZCTEOSA-N 394.431 2.753 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1NC(=O)NCc1ccc2c(c1)CC(C)(C)O2 96132333 INRXCXUQOYNUSX-UHFFFAOYSA-N 389.477 2.678 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)NC2CCN(c3ccccc3OC)CC2)C1 291439627 ZSXFEHXHWYXDPD-NRFANRHFSA-N 375.513 2.858 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 92061953 WUXNCFFQIMVBCB-UHFFFAOYSA-N 395.507 2.802 0 50 GFAA CCNc1ncc(CN2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95378993 QYVVBNYIRAIZMV-PWRODBHTSA-N 379.508 2.676 0 50 GFAA CC(C)c1nc(CN2C[C@@H](c3ccccc3)CC2=O)n(CCc2cnc[nH]2)n1 92099615 RXHDMGNJNAPQEF-KRWDZBQOSA-N 378.480 2.883 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CCC(CO)(c3ccccc3)CC2)cc1 293738300 AXLZPUKHAVZNKV-UHFFFAOYSA-N 378.472 2.655 0 50 GFAA CN(C(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)[C@H]1CCNC1 299738659 DVLOZGITXQEKMR-AWEZNQCLSA-N 379.386 2.597 0 50 GFAA CNC[C@H]1CCN(C(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)C1 299740447 ZYDYUYZSGJYJBA-CQSZACIVSA-N 395.429 2.513 0 50 GFAA Cc1nc(C)c(CNC(=O)c2c(OCc3ccccc3)c(=O)ccn2C)s1 1940195478 GGNOLUMPIGLQBJ-UHFFFAOYSA-N 383.473 2.968 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H]2CC[C@@H](N(C)C)C[C@H]2C1 1356153591 KNZSJCRBUNJOOO-VNTMZGSJSA-N 387.524 2.533 0 50 GFAA Cc1c(CNCc2csc(-c3cnccn3)n2)c(=O)n(-c2ccccc2)n1C 952873325 VHCIDPLZVZOXKO-UHFFFAOYSA-N 392.488 2.688 0 50 GFAA Cc1cc(C(=O)N(C)[C@H]2CCSC2)ccc1NS(=O)(=O)C(F)(F)F 163335248 YEFPVKFHRWZJJT-NSHDSACASA-N 382.429 2.834 0 50 GFAA CN(Cc1ccc(CN(C)S(C)(=O)=O)o1)C[C@H]1CCN(c2ccccc2)C1 952977228 XLWUSXXICCLBQI-QGZVFWFLSA-N 391.537 2.629 0 50 GFAA CCNc1nc(C)c(C(=O)NC23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)s1 952976678 XPLBHACZXVABKB-BAUKFBFWSA-N 386.525 2.953 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N[C@H]3CCOC[C@@H]3Oc3ccccn3)c2)n1 1565510540 HZXXQQUEXHOEPU-PMACEKPBSA-N 392.459 2.850 0 50 GFAA O=C(c1ccccc1N1CCCC1)N1C[C@@H]2CC[C@H]1CN(c1ncccn1)C2 1565512596 VOQUEFOMXMXWAX-MSOLQXFVSA-N 377.492 2.818 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN([C@H]3CCN(c4ccccc4)C3)CC2)cc1 1506425920 SNORDOZAOJPEGJ-FQEVSTJZSA-N 385.533 2.580 0 50 GFAA CCc1cc(C(=O)N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)n(C)n1 1704344367 MDJKVZOFUGQBJT-UHFFFAOYSA-N 399.491 2.704 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(Cc3cc4ccccc4[nH]3)CC2)O1)[C@@H]1CCCO1 11995845 WAPJOWWYILVEMS-CTNGQTDRSA-N 397.519 2.977 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCSCC1 12580979 ZLPHDISBEZUEON-FQEVSTJZSA-N 387.593 2.938 0 50 GFAA Cc1cn2cc(CNC(=O)c3ccc(CN4CCC[C@@H](C)C4)[nH]c3=O)nc2s1 14985162 GYLMGSPBZMBKRD-CYBMUJFWSA-N 399.520 2.554 0 50 GFAA COCC(=O)N1CCC2(CCc3c2nc(-c2ccccc2)[nH]c3=NC2CC2)CC1 1857692035 LKPKPJAVVZIOGN-UHFFFAOYSA-N 392.503 2.593 0 50 GFAA O=C1NCCC[C@]12CN(Cc1ccc(OCc3ccccc3)cc1)CC[C@@H]2O 1857704695 BVSBFGUKSRZSHM-JTHBVZDNSA-N 380.488 2.729 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NCc1ccc2nc(O)[nH]c2c1 1857714079 KXMACJHPIHGIER-UHFFFAOYSA-N 380.433 2.674 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2N[C@@H](C)CC(=O)N2CCCCCC2)cn1 328654729 XSQWVMQBRWRBRC-VPWXQRGCSA-N 375.517 2.834 0 50 GFAA O=C(NCc1ccnc(-n2cccn2)c1)N1CCOC[C@@H]1c1ccc(F)cc1 457660773 HAFKVBVBDAVAIR-GOSISDBHSA-N 381.411 2.690 0 50 GFAA C[C@H]1Oc2c(cccc2C(=O)NC2(c3ccc(F)cc3)CCOCC2)NC1=O 264359787 FJLMCYNDIYZZIB-CYBMUJFWSA-N 384.407 2.981 0 50 GFAA C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)NC(=O)c1cc(O)nc2c1CCCC2 821863329 KXUCMTDSEKLPST-UONOGXRCSA-N 379.460 2.762 0 50 GFAA CC(=O)N[C@@H](Cc1ccc2c(c1)OCO2)C(=O)N1CC=C(c2cccs2)CC1 1875259125 HWCQLWWNVHZYJP-KRWDZBQOSA-N 398.484 2.840 0 50 GFAA O=C1CN(C(=O)NCc2cccc(CN3CCCC3)c2)CCN1CC1CCCC1 1875252660 OACQIEPHCQBYEB-UHFFFAOYSA-N 398.551 2.826 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)c1c[nH]nc1[C@@H]1CCCNC1)CC3 1875315215 LMWXWLVQQGWFBP-CABCVRRESA-N 377.492 2.954 0 50 GFAA O=C1C[C@H](c2ccccc2)S(=O)(=O)N1C[C@@H]1OC(=O)C2(CCC2)C12CCC2 1875392092 RVUBXBIFMGFOAJ-CVEARBPZSA-N 389.473 2.556 0 50 GFAA CC(C)C[C@H](CNC(=O)C[C@H]1CCOC1)NC(=O)Cc1ccc2cnccc2c1 1875331577 ODEJZAUKTBMBBE-WIYYLYMNSA-N 397.519 2.851 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)cc1-c1ccccc1 1318167796 ZPLBTTVBMZNOLO-SFHVURJKSA-N 379.460 2.992 0 50 GFAA Cc1cc(C)cc(-n2c(-c3ccccc3)cn3c4c(=O)n(C)c(=O)n(C)c4nc23)c1 2372642 UCPXOBKRJSGSQP-UHFFFAOYSA-N 399.454 2.959 0 50 GFAA Cc1nc(C)c(C(=O)N2CCc3nc(CCc4ccccc4)nn3CC2)s1 2100483571 FNZMXNUGHXOBDW-UHFFFAOYSA-N 381.505 2.835 0 50 GFAA Cc1cn(Cc2ccccc2)[nH]c1=NC(=O)N1CC[C@](N)(c2ccccc2)C1 2325773132 WDAKGICTPSVBRS-JOCHJYFZSA-N 375.476 2.754 0 50 GFAA Cc1nccn1-c1cc(C(=O)N[C@H](C)Cc2ccc3c(c2)OCCO3)ccn1 2325786804 FCJQFINEDOQEEM-CQSZACIVSA-N 378.432 2.708 0 50 GFAA CN1CCCc2ccc(NC(=O)CCNC(=O)c3ccc4n[nH]cc4c3)cc2C1 2325799299 IGOKTCIUEQZPDY-UHFFFAOYSA-N 391.475 2.700 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(CN(CC)CC)c1 625086 YPFYLJNBJDDUFN-GOSISDBHSA-N 375.469 2.728 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](SCC(=O)Nc3ccc(F)cc3)C2=O)cc1 805927 GBQSSLKTVJVMOL-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)cc1 915026 JINXIVDKQJHFGO-INIZCTEOSA-N 399.424 2.986 0 50 GFAA COc1ccccc1NC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 1072785 LTXBLATTZJOSKI-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA Fc1ccc(NC(=S)NNC(=S)Nc2ccc3c(c2)OCO3)c(F)c1 1119091 GIFRKDACOJYCGH-UHFFFAOYSA-N 382.417 2.882 0 50 GFAA COc1cc(C(=S)N2CCOCC2)ccc1OC(=O)Cc1ccc(F)cc1 1131998 YWVSBNBMQHNLTL-UHFFFAOYSA-N 389.448 2.990 0 50 GFAA CCOc1ccc(N2C[C@H](C(=O)Nc3ccccc3C(=O)OC)CC2=O)cc1 1165314 JUZIQFTXDGPRHX-CQSZACIVSA-N 382.416 2.864 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCc2nc(C3CC3)nn2CC1 2356149066 IRVHVAIRNKTIOU-UHFFFAOYSA-N 380.427 2.692 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(Br)s1 4008689 MMMXLRYUOJZYHG-GFCCVEGCSA-N 389.271 2.718 0 50 GFAA C[C@@H](CNC(=O)c1ccc2nn[nH]c2c1)Oc1cccc(Br)c1 464666826 TWXBFFNGOOSYFO-JTQLQIEISA-N 375.226 2.918 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)NCCc3nc4c(s3)CCC4)CC2=O)cc1 55071273 KZYYEASFCZICPL-INIZCTEOSA-N 383.517 2.648 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@H](C)c2ccon2)n1Cc1ccccc1 12314949 MHFWKAGQIBMQMX-OAHLLOKOSA-N 388.493 2.906 0 50 GFAA NC(=O)[C@@H]1CCCN(C(=O)CN2CCCCC[C@H]2/C=C/c2cccs2)C1 248389274 SDXPDFGJQKJKQL-ZUQFGZKASA-N 375.538 2.730 0 50 GFAA CN(C)C(=O)Cc1ccc(NS(=O)(=O)CCCOCc2ccccc2)cc1 328596202 WQQGBVSKZGOXMB-UHFFFAOYSA-N 390.505 2.666 0 50 GFAA Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1CCOC2(CCOCC2)C1 135639654 QNNDLTOEVCYDDI-LJQANCHMSA-N 377.525 2.914 0 50 GFAA Cc1cnn(Cc2cccc(F)c2)c1NC(=O)Cc1ccc2c(c1)NC(=O)CO2 65417520 JKKPVUTZBUZDKA-UHFFFAOYSA-N 394.406 2.891 0 50 GFAA CCN1CCN(Cc2cccc(OC[C@H](O)CN(C)C3CCCCC3)c2)CC1 22920192 WSQGDUKZGMPSPP-JOCHJYFZSA-N 389.584 2.828 0 50 GFAA O=C(NCCc1nnc2n1CCCCC2)N1CC[C@@H](Cc2ccc(F)cc2)C1 125101680 SMPFYMZDQDEKIA-KRWDZBQOSA-N 385.487 2.960 0 50 GFAA CCOC(=O)c1c(OCCOC(=O)c2cccc(C(F)(F)F)c2)noc1N 2555685 JVGGSEXVCQDAEA-UHFFFAOYSA-N 388.298 2.688 0 50 GFAA O=C(Nc1n[nH]c(-c2ccccc2)n1)N1CCN(C(=O)c2cccs2)CC1 32590210 MKGPLIXPUJSKCF-UHFFFAOYSA-N 382.449 2.523 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4cccn4C)CC3)CC2=O)c1 77455142 HUVDBOCFVNFHFU-UHFFFAOYSA-N 381.476 2.689 0 50 GFAA CC(C)N(C)Cc1ccc(CNC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 241316722 LUIYIUHNIKGPGR-FXAWDEMLSA-N 375.538 2.597 0 50 GFAA Cn1cc(N2CCC[C@H](NC(=O)c3csc(Cc4ccccc4)n3)C2)cn1 154016836 RUGUBWHTVMBREP-INIZCTEOSA-N 381.505 2.866 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)C[C@H]1C 245436937 VZRYUPXQOTXEER-FGTMMUONSA-N 391.512 2.553 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1ccc(Cl)cc1)CC(=O)N2 35476278 VZEXKIIVFGYQGS-ZDUSSCGKSA-N 379.811 2.746 0 50 GFAA Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)NC2CCN(c3cccnn3)CC2)cc1 373787328 NRDPHQPHZIGLJI-CTNGQTDRSA-N 395.507 2.973 0 50 GFAA O=C([C@H]1CCCN(C2CCN(c3ncnc4sccc34)CC2)C1)N1CCCC1 71764105 XJIXCPSCHWHJTG-INIZCTEOSA-N 399.564 2.995 0 50 GFAA Cc1cc(C)cc(-c2nnc(NC(=O)N3CC[C@@H]4OCCN(C)[C@H]4C3)s2)c1 285168693 MBBLOIASXWALJZ-HOTGVXAUSA-N 387.509 2.759 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3nc(-c4ccco4)no3)C2=O)c1 176304651 LTSCHEUNVIVWHW-MRXNPFEDSA-N 398.419 2.584 0 50 GFAA O=C(NCCc1nnc(-c2ccccc2)o1)[C@@H]1CCCCN1C(=O)c1ccco1 177664487 CLJYSMNJNSHPTK-INIZCTEOSA-N 394.431 2.683 0 50 GFAA C[C@H](NC(=O)N1CCC(N2CCCCC2)CC1)c1nc(-c2ccccn2)no1 426494505 PLHKMUZYKIZWAL-HNNXBMFYSA-N 384.484 2.853 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)Cc2cc(C)no2)C1 95519945 UPSYHXQJJKKCLT-GOSISDBHSA-N 385.508 2.947 0 50 GFAA O=C(NCc1nnc2n1CCCC2)Nc1ccc(OCc2ccccn2)cc1 96138873 LWPRSCCWDMQSTQ-UHFFFAOYSA-N 378.436 2.910 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CCN3CCC(C)CC3)[nH]c2C1 95518517 YHRUICXZKSKQQD-INIZCTEOSA-N 382.508 2.762 0 50 GFAA Nc1ccnc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)c1 92036937 UVLJZBPQCRXGSS-UHFFFAOYSA-N 378.476 2.709 0 50 GFAA CCN1CC2(CCN(C(=O)c3cccnn3)CC2)C[C@H](c2ccccc2)C1=O 91645647 JRDABVGDSVFSLQ-GOSISDBHSA-N 378.476 2.735 0 50 GFAA COc1ccc(OCc2cc(C(=O)N[C@H]3CC[C@H](O)CC3)n[nH]2)c(Cl)c1 247910447 UMMNYMMUTAYEIA-AULYBMBSSA-N 379.844 2.684 0 50 GFAA COc1cccc(C(=O)NCC(=O)N2CCn3cccc3[C@@H]2c2ccccc2)c1 183213812 PBRQHSFUZLMVKB-QFIPXVFZSA-N 389.455 2.858 0 50 GFAA CN(CCC(=O)O)C(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 299753897 ZSCZOOIQWQMNAP-CZUORRHYSA-N 386.370 2.548 0 50 GFAA COCC[C@@H]1CCCCN1C(=O)c1cccc(-c2cnn(C)c2C(=O)OC)c1 534585044 XMPVOSVVTBZVRN-KRWDZBQOSA-N 385.464 2.905 0 50 GFAA O=C1C[C@H](C(=O)NCC2(c3cccc(F)c3)CCOCC2)C2(CCCC2)O1 299759155 ABSIRKLBHIWTJA-QGZVFWFLSA-N 375.440 2.866 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)Nc3cccc(NS(C)(=O)=O)c3)o2)n1 1875252532 YJNVKRBSQFAZCZ-UHFFFAOYSA-N 388.449 2.765 0 50 GFAA NCC[C@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCO1 1875319088 PXDVWXMOBXHHDS-HNNXBMFYSA-N 399.438 2.948 0 50 GFAA Cc1cc(C)cc([C@@H](N)C(=O)N2CCC[C@H](n3c(O)nc4cccnc43)C2)c1 1875327200 ORFQDEWLHZDFPO-FUHWJXTLSA-N 379.464 2.617 0 50 GFAA O=C(NC[C@@H]1CCCN(CCS(=O)(=O)c2ccccc2)C1)c1cccs1 952969157 REFYTUNRKBOOJL-INIZCTEOSA-N 392.546 2.664 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCC[C@H](CNC(=O)c3ccc4c(c3)CCO4)C2)n1 952990798 IOWPACSRFPHXEL-OAHLLOKOSA-N 395.459 2.670 0 50 GFAA Cc1cnc(C)c(-c2cc(F)c3c(c2)C[C@H](CNC(=O)[C@H]2CCCCN2C)O3)n1 39551959 SGVSYOXJNKMLAO-IEBWSBKVSA-N 398.482 2.804 0 50 GFAA CN(Cc1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1 170645302 XYBPJXRIOFLGRD-KRWDZBQOSA-N 387.505 2.879 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)NC[C@H]2CCCC2(F)F)cc1Br 414334865 NVCMNCPYDJQRPR-MRVPVSSYSA-N 398.225 2.861 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCO[C@H](c2cccc(O)c2)C1 188716521 WGNIBWDEELLAKB-SFHVURJKSA-N 384.823 2.840 0 50 GFAA CCN(Cc1cccnc1)C(=O)[C@H]1OCC(=O)N(C(C)C)[C@@H]1c1ccccc1 1529089703 ZBBYKONZLWPGHH-RTWAWAEBSA-N 381.476 2.807 0 50 GFAA CCn1ncc(C)c1NC(=O)c1cc2c(nc1OC)CN(C1CCCC1)C2=O 1529189638 SJBBGDRHZTXOTH-UHFFFAOYSA-N 383.452 2.766 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)c(N2CCCC2)nn1C 1615696863 CQMCKNUDFKJQPB-SJORKVTESA-N 387.528 2.696 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cc[nH]n4)C[C@H]2CN(C2CCOCC2)C3)cc1 1772811803 ZPKYABWOCNYDPH-NZQKXSOJSA-N 380.536 2.955 0 50 GFAA O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)c1ccco1 5074143 UCRLHEGXDVZBKA-KRWDZBQOSA-N 378.384 2.958 0 50 GFAA COCCC(=O)N1CCCC[C@@H]1C(=O)Nc1cccc(-c2nnc(C)s2)c1 12193243 YRDOFCNGLXSTEG-MRXNPFEDSA-N 388.493 2.870 0 50 GFAA CCCS(=O)(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12200465 NXNIXOXQZZLBQJ-SFHVURJKSA-N 386.464 2.519 0 50 GFAA CN(C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1)C1CCCCC1 12835411 GSIVNAHWQJQXPA-SFHVURJKSA-N 375.557 2.891 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)N(CC)Cc2ccccc2)c1=O 14883149 XQOSPDAXQNPRDU-UHFFFAOYSA-N 383.492 2.916 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)c1ccc(C(F)(F)F)cc1 19924278 VHAGKODRVFWEHT-UHFFFAOYSA-N 376.342 2.523 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ccccc2)CC[C@@H]1NS(=O)(=O)C(C)C 1857703371 JQOIVIQAYJMCSC-FHWLQOOXSA-N 396.553 2.595 0 50 GFAA Cc1[nH]nc(CCC(=O)N2CCC(C3CCN(C(=O)C4CC4)CC3)CC2)c1C 1857712761 GXAVNICQSCOJFO-UHFFFAOYSA-N 386.540 2.846 0 50 GFAA O=C(c1ccn(C(F)F)n1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857723610 NNCQWUBHJDEAPF-ROUUACIJSA-N 390.434 2.956 0 50 GFAA COc1ccnc(CN2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)c1 1857728271 USMNZNGJXBSGPU-GPQLQYNLSA-N 387.524 2.622 0 50 GFAA O=C(c1cc(-c2ccccn2)[nH]n1)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875248441 QMNTXLARHDPBNW-OALUTQOASA-N 398.850 2.700 0 50 GFAA Cn1cncc1C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1875250500 GFNFCXOZCJSSIT-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA O=C(c1ccccc1O)N1C[C@@H]2OC(=O)N(CCc3cccc(Cl)c3)[C@@H]2C1 213005688 ASRLWHKQWHHUSQ-AEFFLSMTSA-N 386.835 2.934 0 50 GFAA O=C(N[C@H]1CC[C@@H](n2cc(C(=O)NC3CC3)nn2)CC1)c1cccc(Cl)c1 244873544 WRXWXWBVBQNJJX-IYBDPMFKSA-N 387.871 2.737 0 50 GFAA COc1cccc([C@H]2CN(C(=O)Cn3nc(C(F)F)cc3C3CC3)CCN2)c1 825207362 GCNKBRHYDWRMMW-QGZVFWFLSA-N 390.434 2.880 0 50 GFAA CN(CC1CN(C(=O)OC(C)(C)C)C1)C(=O)c1ccc(Br)nc1 1857779020 CXLDUYHXMUYXRH-UHFFFAOYSA-N 384.274 2.783 0 50 GFAA O=C(O)[C@H]1CCCN(S(=O)(=O)c2c(Cl)cccc2Br)C1 261691842 HRUOVIDDMSOTCC-QMMMGPOBSA-N 382.663 2.588 0 50 GFAA O=C(NC[C@@H](F)CO)c1cccc(-n2cc(-c3ccc4cnccc4c3)nn2)c1 2325869498 QKKYGDCZJOIAFV-GOSISDBHSA-N 391.406 2.543 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1CCc2nc(C3CC3)nn2CC1 2356135350 AGQDAUQTGWLETQ-UHFFFAOYSA-N 377.448 2.746 0 50 GFAA CC(C)(C)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)N(CC(=O)O)C3=O)cc1 4808848 RCDUDFNDSSEATL-UHFFFAOYSA-N 380.400 2.917 0 50 GFAA Cc1noc(Cl)c1CCC(=O)N1CCN(Cc2cnn(C(C)(C)C)c2)CC1 113922070 WYVHWWIJHZVAAH-UHFFFAOYSA-N 393.919 2.865 0 50 GFAA CCCC(=O)Nc1ccc(CC(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1 55413490 FQRBULFZSMAZFO-IBGZPJMESA-N 375.513 2.537 0 50 GFAA Cc1ccccc1CN1CCc2nnc(CNC(=O)c3ccccc3)n2CC1 20906143 QQYXGAUIHRFEME-UHFFFAOYSA-N 375.476 2.575 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cc(COc2ccc3ncccc3c2)on1)C(C)C 20598759 ZSSGEMFQCXDLFM-SFHVURJKSA-N 383.404 2.729 0 50 GFAA Cc1sc(Br)cc1S(=O)(=O)NC[C@H]1CCn2ccnc2C1 328636901 VTZGYQQXSWNWEP-JTQLQIEISA-N 390.328 2.556 0 50 GFAA CCc1cn[nH]c1[C@H]1CCCN(C(=O)CCn2c(=O)oc3ccc(C)cc32)C1 67884592 CJRUKKLDXVGDBB-INIZCTEOSA-N 382.464 2.985 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 7054797 ZEDGEIDAOXBRCR-UHFFFAOYSA-N 388.898 2.828 0 50 GFAA CC[C@H](CO)N1CCN([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 174132494 RWXHQIPMJGODST-NHCUHLMSSA-N 385.483 2.894 0 50 GFAA C[C@H](NC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1)c1nnnn1C 252489810 KBDWOGOJLILRIB-NSHDSACASA-N 382.390 2.879 0 50 GFAA COc1ccc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)[C@H]2C(=O)c2ccccc2)cc1 2502104 RUVFDGOFCYCCJZ-RVKKMQEKSA-N 394.349 2.799 0 50 GFAA COc1ccccc1N1CC[C@H](NS(=O)(=O)c2cnc3ccccc3c2)C1 242038536 VLWGRILEWXKSQP-INIZCTEOSA-N 383.473 2.801 0 50 GFAA O=C(CSc1ncnc2[nH]cnc12)N1CCC(OCc2ccccc2)CC1 361187747 KMAKKNLUUXQYNV-UHFFFAOYSA-N 383.477 2.653 0 50 GFAA CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc(OCC(F)F)nc3)cc21 153271259 VOKAPOAGESXYAN-UHFFFAOYSA-N 388.374 2.679 0 50 GFAA Cc1ccc(OC2CN(C(=O)C[C@@H]3CN(Cc4ccccc4)CCO3)C2)cc1 219383746 NGFNZXUSXMHWCL-OAQYLSRUSA-N 380.488 2.876 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N[C@H](C)c2ccc(OCC(=O)O)cc2)c1 263006635 LGHNDFLDOSDNKJ-CQSZACIVSA-N 384.432 2.733 0 50 GFAA O=C(NCCc1nc2cc(F)ccc2[nH]1)[C@@H]1CCCN1C(=O)Cc1ccccc1 176713402 BJJJOLUTMRGXEZ-IBGZPJMESA-N 394.450 2.594 0 50 GFAA Cc1cc(S(=O)(=O)NCc2ccncc2OC[C@H]2CCOC2)c(F)cc1F 288708389 XKVIJTRVAJPZED-ZDUSSCGKSA-N 398.431 2.562 0 50 GFAA COC[C@H](NC(=O)N1CCN(c2cccc(O)c2)CC1)c1ccc(F)c(F)c1 179954014 ATNOMSBTVAQYGX-IBGZPJMESA-N 391.418 2.890 0 50 GFAA Cc1cccc(CN2CCN(c3nccc(-c4c(C)nn(C)c4C)n3)CC2=O)c1 48112417 VQUCCAKSRVQHFB-UHFFFAOYSA-N 390.491 2.651 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)C2CCN(C3CCOCC3)CC2)cc1 426489318 FBHAKQSFYBCEBG-UHFFFAOYSA-N 382.508 2.688 0 50 GFAA COc1ccc(NC(=O)NCc2snnc2C(C)C)cc1C(=O)N(C)C 426699883 HGORMXSXFWUEHI-UHFFFAOYSA-N 377.470 2.694 0 50 GFAA Cn1c(CNC(=O)N2CCc3nc[nH]c3C2)nc2cc(C(F)(F)F)ccc21 426548388 BUXHZOYDTDLEAQ-UHFFFAOYSA-N 378.358 2.583 0 50 GFAA Cc1ccc(CNC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)s1 96164175 BRTLUNCTGMISKU-UHFFFAOYSA-N 389.477 2.616 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)o1 95526934 JWRJXRDVGQZHGC-UHFFFAOYSA-N 397.475 2.771 0 50 GFAA Cn1c(CCCNC(=O)CCc2nc(O)c3ccccc3n2)nc2ccccc21 252510144 ZCGPHQNHSPOQCV-UHFFFAOYSA-N 389.459 2.904 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NCc2cccc(C)n2)CN1Cc1ccc(Cl)cc1 299766102 AABBQYPYYOVXDI-UXHICEINSA-N 386.927 2.912 0 50 GFAA C[C@H](NC(=O)c1ccccc1N1CCOCC1)c1ccc(-n2cncn2)cc1 488887215 AWBSDTFJESTZIX-INIZCTEOSA-N 377.448 2.595 0 50 GFAA C[C@@H]1Sc2ccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)O)cc2NC1=O 268941792 KGZUSBNZMWLPRH-ZBEGNZNMSA-N 382.441 2.771 0 50 GFAA O=C(CCc1cnccn1)N1C[C@H]2C[C@H](c3ccccc3)CC[C@@]2(C(=O)O)C1 1565530982 ZVXSGPSDWRSIJT-JBYIUTFZSA-N 379.460 2.906 0 50 GFAA COc1cc(C(=O)N2C[C@H](C(C)C)[C@@H](NC(=O)N(C)C)C2)nc2ccccc12 1565516536 SJOLYASFBTWSJD-QAPCUYQASA-N 384.480 2.611 0 50 GFAA Cc1nc(C(=O)N(Cc2ccccc2F)C(C)C)nc(N2CC[C@@H](N)C2)c1C 1875401255 GZNADBMGKOULQG-QGZVFWFLSA-N 385.487 2.821 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCN(c2nc3ccccc3o2)CC1 952972668 QAORLPZCVMFLFF-UHFFFAOYSA-N 379.464 2.711 0 50 GFAA C[C@@H](C(=O)Nc1ccc(NC(=O)CCc2ccccc2)cc1)N1CCN(C)CC1 952873655 YEIWDHPZSUUWMQ-SFHVURJKSA-N 394.519 2.832 0 50 GFAA O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@@H]3C2)C1 886091322 POZZXGOCULESEG-VHDGCEQUSA-N 394.878 2.828 0 50 GFAA Cc1cccc(-c2n[nH]cc2C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)N(C)C)C3)c1 1073291293 RXPWTAOWACUWRX-WBVHZDCISA-N 381.480 2.603 0 50 GFAA COC(=O)c1ccc(NC(=O)N2CCC[C@@H](c3nc(C)no3)C2)c(N(C)C)c1 170612031 CGTVGEGQFDPEMJ-CQSZACIVSA-N 387.440 2.642 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(C(=O)c3c(C)n(C)c4ccc(OC)cc34)CCN21 1616078523 PZEYFJCIKJJVHC-SJORKVTESA-N 385.508 2.821 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCN1CCCCO1 12597670 ZGSKJBZSUAMUEP-HXUWFJFHSA-N 391.531 2.956 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2F)CN(C2CCN(C)CC2)CC1=O 14744589 UEJAEABRGAHIIF-FQEVSTJZSA-N 391.531 2.605 0 50 GFAA O=C(CCC1CCN(Cc2cccn2-c2nccs2)CC1)N1CCOCC1 14978993 IIICGKLHCGUALM-UHFFFAOYSA-N 388.537 2.785 0 50 GFAA CS(=O)(=O)c1ccc(-c2cccc3c2O[C@H](CNC(=O)CC2CC2)C3)cc1 15068711 AMDMMEGIUJSVMA-KRWDZBQOSA-N 385.485 2.977 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(=O)NC1CCCC1 16624294 XOWPNDXPIYGBLV-UHFFFAOYSA-N 375.450 2.563 0 50 GFAA CN(C)Cc1nc(C(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)cs1 1857681573 GLCSBTDSFLCFLA-CDXJDZJCSA-N 385.533 2.803 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c(OC)c1 1857708348 PGZPFQGUSOLSHO-LLGFUMIMSA-N 382.460 2.648 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4cnc[nH]4)C3)nc2c1 1857711878 OTKWJXFDOTUVLV-CQSZACIVSA-N 383.452 2.525 0 50 GFAA COCCC[C@@]1(CO)CN(Cc2ccccc2OC(F)(F)F)CC[C@H]1O 1857722599 ZUTGNNKKFJJIDS-SJORKVTESA-N 377.403 2.557 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCC(C)(C)CO)C3)nc2c1 1857726641 ASWDFTCMOLUJKM-AWEZNQCLSA-N 375.469 2.578 0 50 GFAA CN(C(=O)c1ccc2nc(O)c(O)nc2c1)C1CCN(Cc2ccccc2)CC1 264944272 IKQBLPGMXAZJBW-UHFFFAOYSA-N 392.459 2.778 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C1 266299303 IPMUVSZWDKPTJM-QGZVFWFLSA-N 382.508 2.679 0 50 GFAA CCn1cc(CN2C[C@@H]3COC[C@H](C2)N(C(=O)c2cc4ccccc4o2)C3)cn1 1704326078 VVKAAUNMNRNEMC-HKUYNNGSSA-N 394.475 2.622 0 50 GFAA Cc1ccccc1C[C@H](CNC(=O)C1(C(=O)Nc2ccc(F)cc2)CC1)C(=O)O 2325743675 JGTFQLBVUDSGGQ-MRXNPFEDSA-N 398.434 2.913 0 50 GFAA CN(C)C(=O)COc1ccc(-c2noc(CCc3n[nH]c4c3CCCC4)n2)cc1 2325774168 JQQXZFLJDUMEBG-UHFFFAOYSA-N 395.463 2.591 0 50 GFAA COC(=O)c1nc(N2CCN(c3cc(Cl)ccn3)CC2)c2sccc2n1 2325802546 NKZMTTDRZPOBGS-UHFFFAOYSA-N 389.868 2.853 0 50 GFAA CC(C)c1cc(C(=O)N2C[C@@H]3CCOC[C@]3(C(=O)O)C2)nn1-c1ccccc1 2325805517 NZPJWSXZGGMEAW-YCRPNKLZSA-N 383.448 2.559 0 50 GFAA COc1ccc(C(=O)Nc2sc(C(=O)OC(C)C)c(C)c2C(N)=O)cc1 995763 VQEIMEDNIQQFLY-UHFFFAOYSA-N 376.434 2.982 0 50 GFAA COc1cccc(-c2noc(CCCC(=O)Nc3ccc(C(N)=O)cc3)n2)c1 2232927 QJFLIHBMNBQCJV-UHFFFAOYSA-N 380.404 2.806 0 50 GFAA CCCCOc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCC(=O)O)cc1 2905745 CMTMOWQTXWEXFT-XMHGGMMESA-N 396.443 2.837 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CCS(=O)(=O)Cc2ccccc2)cc1 4740542 ABOPGLAGNZQFLB-UHFFFAOYSA-N 375.446 2.807 0 50 GFAA Cc1ccc(OCC(=O)N2CCN(c3ccccn3)CC2)c(Br)c1 4898824 PSBCVOZWEAXICA-UHFFFAOYSA-N 390.281 2.880 0 50 GFAA COCCN(Cc1ccc(C)cc1)C(=O)c1ccc(Cn2nnnc2C)cc1 55282200 JWCIMJGKOXXXLX-UHFFFAOYSA-N 379.464 2.627 0 50 GFAA C[C@H](NC(=O)C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc2c(c1)OCO2 225742547 SMRREDUFGGKAKX-ZETCQYMHSA-N 387.339 2.707 0 50 GFAA Cc1ccc(C(=O)N[C@H](CO)COCc2ccccc2)cc1NC(=O)C1CC1 55254201 JRUAMWVXERXPSX-LJQANCHMSA-N 382.460 2.651 0 50 GFAA c1cn(C2CCN(C3CCSCC3)CC2)c(-c2cc3n(n2)CCCNC3)n1 72477855 GQAOGHJHXCQYKG-UHFFFAOYSA-N 386.569 2.772 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 170620885 FSXSADROSLCJJA-GNRIBBGQSA-N 384.464 2.722 0 50 GFAA C[C@H](CC(C)(C)c1ccccc1)NC(=O)N1CCCN(CC(=O)N(C)C)CC1 69243621 QRBUYQVICUGQFF-GOSISDBHSA-N 388.556 2.548 0 50 GFAA COc1ccc(OC)c(NC(=O)c2cc3nccc(-c4cnn(C)c4C)n3n2)c1 2788299 NJIATWVZVDNAIW-UHFFFAOYSA-N 392.419 2.708 0 50 GFAA CCOC(=O)Cn1nc(C)cc1NC(=O)COc1cccc(C(F)(F)F)c1 4770267 GYWRLDYLDVKMKS-UHFFFAOYSA-N 385.342 2.791 0 50 GFAA CN1C(=O)Cc2cc(S(=O)(=O)N3CC[C@](F)(c4ccccc4F)C3)ccc21 451519961 YLCLCNUGTYFNTI-LJQANCHMSA-N 392.427 2.604 0 50 GFAA O=S1(=O)CC[C@H]2CN(Cc3c[nH]nc3-c3ccc(C(F)(F)F)cc3)C[C@H]21 377695191 JICBPZZBYJPFME-SWLSCSKDSA-N 385.411 2.714 0 50 GFAA CN(C)[C@@H]1C[C@@H](CO)N(C(=O)c2cccnc2SCCc2ccccc2)C1 223008879 GJQIJVKLGSNYDQ-MSOLQXFVSA-N 385.533 2.553 0 50 GFAA NC(=O)c1cc(NC[C@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)ccn1 132008665 YNEWEZUJKKYECL-QGZVFWFLSA-N 394.397 2.685 0 50 GFAA CO[C@H]1CCN(C(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)C1 426517979 TWTMSYZKPHZJEF-AWEZNQCLSA-N 375.494 2.772 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@H]4CCN(C)C4)csc3C2)nc1 426604236 FSKAGZQSZONABH-QGZVFWFLSA-N 398.576 2.945 0 50 GFAA Cc1ccsc1CCNC(=O)c1ccc([C@@H]2CCCN2C(=O)CN)s1 20868644 YHHNEZWRGGJBDE-ZDUSSCGKSA-N 377.535 2.713 0 50 GFAA CCOc1ccccc1CN1CCC(c2nnc(Cn3cccn3)n2C)CC1 96138152 LFJCBBRAKJQCAD-UHFFFAOYSA-N 380.496 2.838 0 50 GFAA CCc1cnc(C)nc1N1CCC(N2CCN(c3ccccc3O)CC2)CC1 95501336 CFMAWLUEOABBRN-UHFFFAOYSA-N 381.524 2.844 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ncnc4[nH]ccc34)C2)CN1CCc1ccccn1 91468895 CUOGUNKJQCDDOW-QFIPXVFZSA-N 390.491 2.805 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)N(S(=O)(=O)c1cccc(F)c1)C2 91351020 AKSFYWHSIVKBKC-DOTOQJQBSA-N 393.484 2.716 0 50 GFAA CCOc1ccc(-c2ccc(C(=O)NCCc3nc(C)cc(C)n3)cc2)nn1 534643512 GXMUHSPCCIFUGL-UHFFFAOYSA-N 377.448 2.922 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)N[C@H]1CCC(=O)N(C)C1 299784791 ZYPZRNAUKUGZLE-AWEZNQCLSA-N 375.860 2.636 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCO2)cccc1C(=O)NCCCc1csc(N)n1 827753272 ZCMDITCKJMYOSF-INIZCTEOSA-N 388.493 2.514 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(CNC(=O)c3ccoc3)CC2)C2(CCCCC2)O1 952968379 MSGYIOJIAOAEQQ-QGZVFWFLSA-N 388.464 2.514 0 50 GFAA COc1ccccc1/C=C(/C(=O)N1CCO[C@H](CC(=O)O)C1)c1ccccc1 268937739 CRPAFDIJMDTHGO-UIMCMNAESA-N 381.428 2.938 0 50 GFAA Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@@H](CO)c1cnn(C)c1 276927445 ZUOODBYMBWZXJO-AWEZNQCLSA-N 394.353 2.866 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N(C)Cc2ccc(C(F)(F)F)cc2)C1 1506396642 LMCXSDZTFFUESN-AWEZNQCLSA-N 380.432 2.740 0 50 GFAA CCOCCOc1cccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)c1 1529182760 ZMYZDXHGURCTTF-NHCUHLMSSA-N 385.460 2.677 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCCN(C(=O)NCc2cccs2)CC1 1775984283 MUOJLQZYKLJERK-UHFFFAOYSA-N 390.509 2.730 0 50 GFAA NC(=O)c1ccc(-c2cccc3c2O[C@@H](CNC(=O)/C=C/c2ccccn2)C3)cc1 11790153 NDDQFMYGHCFRJR-YVNCXZRQSA-N 399.450 2.981 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CC(=O)N(c3cccc(Cl)c3)C2=O)CC1 17729387 IVJGVNZZTSPELE-GOSISDBHSA-N 399.878 2.803 0 50 GFAA COc1ccccc1N1CCC(N2CCC[C@H](N3CCC(CO)CC3)C2)CC1 19228130 VJZRYHPDHTWKLA-NRFANRHFSA-N 387.568 2.833 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@@H](CCC(=O)N3CCN(C)CC3)C2)o1 19742302 XNTVTYXQGNIOPZ-INIZCTEOSA-N 393.553 2.549 0 50 GFAA O=C(Cn1nc(C(F)(F)F)c2c1CCC2)N1CCN(Cc2ccccc2)CC1 19893148 XNSTXXKEBGIYPA-UHFFFAOYSA-N 392.425 2.735 0 50 GFAA COC(=O)[C@@H]1CC[C@H](C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)C1 1857670383 LHUOVAODWNJUKK-DLBZAZTESA-N 381.476 2.604 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N3CCC[C@H]3COC)cc12 1857691472 MRXKNJSCIBQOHW-HNNXBMFYSA-N 378.538 2.883 0 50 GFAA Cc1ccnc([C@@H](C)NC(=O)c2cn3c(n2)CCN(C2CCSCC2)CC3)c1 1875251200 QZRCJXBZCNNOHC-MRXNPFEDSA-N 399.564 2.831 0 50 GFAA O=C(NC1CCCC1)c1cnc(N2CCC[C@@H](Cn3ccnn3)C2)c(Cl)c1 1875264987 ZRFNMWYWHMBQIU-CQSZACIVSA-N 388.903 2.916 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(C4CCCCC4)CC3)nn(C)c21 1875300148 NHOHXVGHVXVUHV-CABCVRRESA-N 375.513 2.990 0 50 GFAA CCc1nc(C)cc(N2CC[C@@H]([C@H](C)NC(=O)c3cccc4[nH]ncc34)C2)n1 1875358290 QGJFZSVOIJSPNZ-LSDHHAIUSA-N 378.480 2.869 0 50 GFAA COC(=O)[C@@H]1CCN(C(=O)NCc2cc(-c3ccc(F)cc3F)on2)C[C@H]1F 1875301948 YQYKJUJKPNKQMT-UKRRQHHQSA-N 397.353 2.662 0 50 GFAA CC1(CS(C)(=O)=O)CCN([C@H](C(=O)O)c2ccc(F)cc2Cl)CC1 1776578185 ZNQGVSUISOTKPY-AWEZNQCLSA-N 377.865 2.752 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(Br)s1 4008690 MMMXLRYUOJZYHG-LBPRGKRZSA-N 389.271 2.718 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)N2CCC(n3cc(C)cn3)CC2)CC1 2325727870 KMCBPOUNYDVBTE-UHFFFAOYSA-N 375.517 2.529 0 50 GFAA NC[C@@H](CC(=O)N=c1ccc2cc[nH]c2[nH]1)c1ccc(Br)s1 2325860246 AESIHBYNCOJGSC-SNVBAGLBSA-N 379.283 2.880 0 50 GFAA C[C@H](NC(=O)[C@@H]1Cc2ccc(Cl)cc2C(=O)O1)[C@H](O)c1c(F)cccc1F 2325860442 IPCZQTSLBGQUJS-KMNYPPFZSA-N 395.789 2.938 0 50 GFAA CCC(CC)CN[C@@H]1CCS(=O)(=O)C2(CC(CNC(=O)C3CC=CC3)C2)C1 2332237812 MQJXRDWEVHDUBO-MOMVYJMYSA-N 396.597 2.821 0 50 GFAA COc1ccc(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(OC)c1 633630 TUPHJGKOISEODD-SFHVURJKSA-N 382.416 2.963 0 50 GFAA Cn1c(Cc2ccccc2)nnc1SCC(=O)Nc1ccc2c(c1)OCO2 779189 QPXJXDKXQXQOFU-UHFFFAOYSA-N 382.445 2.865 0 50 GFAA CCOC(=O)c1c(C)n(C)c2ccc(OC[C@@H](O)Cn3nc(C)cc3C)cc12 811144 JQVVYVAFXFRXTE-INIZCTEOSA-N 385.464 2.917 0 50 GFAA CCN(CC)C(=O)c1ccc(NC(=O)Cn2nc(C)c3ccccc3c2=O)cc1 1131574 CVVVAXXFINRDLE-UHFFFAOYSA-N 392.459 2.826 0 50 GFAA O=C(CN1CCC[C@@]12CCCN(C1CC1)C2=O)NCCc1cccc(Cl)c1 2356135884 XGVPYEQTDGZPCI-NRFANRHFSA-N 389.927 2.618 0 50 GFAA Cc1nonc1[C@@H]1CCCN1C(=O)c1c(OCc2ccccc2)c(=O)ccn1C 2356152000 LNRGEGMLWAKUMW-INIZCTEOSA-N 394.431 2.633 0 50 GFAA O=C([C@H](O)c1cccc(Cl)c1)N1CCc2nc(-c3ccccc3)nn2CC1 2356159358 XHCYKAGXFQTLSU-GOSISDBHSA-N 382.851 2.717 0 50 GFAA O=C(N[C@@H]1CCC[C@@H](CN2CCCCC2)C1)c1cc(=O)n(-c2ccccc2)[nH]1 2356163317 XYXAFVINUTVWNX-QZTJIDSGSA-N 382.508 2.940 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCc3cc(O)no3)C2=O)cc1 2356167260 LGZSPDOFFHLNIU-OAQYLSRUSA-N 383.448 2.809 0 50 GFAA CCN1C(=O)[C@](O)(CC(=O)c2cccnc2)c2cc(Br)ccc21 4555023 OFHSWUFAUSPNAW-KRWDZBQOSA-N 375.222 2.671 0 50 GFAA COc1cc(S(=O)(=O)Nc2cccc(C)n2)c(OC)cc1Br 6706980 XGHUIDLZPRRPQE-UHFFFAOYSA-N 387.255 2.971 0 50 GFAA C[C@H]1Cc2cc(S(=O)(=O)NCCc3ccccc3)ccc2N1C(=O)C1CC1 6866593 SPWLTHVZGPRTNG-HNNXBMFYSA-N 384.501 2.895 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)[C@H](CC(=O)O)C1 306213538 LOZVGXQVQVQQAX-OAHLLOKOSA-N 378.425 2.719 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)N2CCCc3ccccc32)S(C)(=O)=O)cc1 10449550 VCIYRRWXRIHNFH-HNNXBMFYSA-N 388.489 2.829 0 50 GFAA CC(C)Cc1c[nH]c(C(=O)N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)c1 411313016 PFFATVGXUFFGCL-UHFFFAOYSA-N 383.448 2.540 0 50 GFAA O=C(CN1CCCCCC1)N1CCC[C@H](N2CCN(c3ccccc3)CC2)C1 55060647 WEGJEFVOMZCWRZ-QFIPXVFZSA-N 384.568 2.676 0 50 GFAA O=C(CCCN1CCOCC1)N1CCC(c2[nH]ncc2-c2ccccc2)CC1 67726942 WMNFJGLSYYCYJT-UHFFFAOYSA-N 382.508 2.895 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(CC45CCCN4CCC5)[nH]c3C2)c1 65383601 FONNHERJAOPVJT-MRXNPFEDSA-N 380.492 2.659 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccc4ccccc4c3)C[C@@H]2N1CCCN1CCOCC1 67841560 RUCXKEVZLNYBIT-FCHUYYIVSA-N 395.503 2.567 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)N1CCN(Cc2cccnc2)CC1 66344474 WINHKSBYGIPHIN-IBGZPJMESA-N 397.498 2.574 0 50 GFAA Cn1cc(C(=O)N2CCCC[C@H]2c2nnc(-c3ccccc3F)o2)ccc1=O 328603102 DSLJUTUMBSBCDB-INIZCTEOSA-N 382.395 2.942 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C[C@H](O)c2ccccc2F)CC1 328650602 VOMKZWFEKCKWBA-NQIIRXRSSA-N 386.471 2.552 0 50 GFAA CCC[C@H]1CN(Cc2nc3ccc(Cl)cc3c(=O)[nH]2)CCN1CCOC 121768089 QJUWNKKPRMRBNM-HNNXBMFYSA-N 378.904 2.509 0 50 GFAA Cc1nc(CN2C[C@@H](F)C[C@H]2CN(C)S(=O)(=O)CC2CCCC2)cs1 328859876 YTMIFZZBJWUVMO-RDJZCZTQSA-N 389.562 2.816 0 50 GFAA CS(=O)(=O)c1ccccc1NC(=O)NCc1ccnc(N2CCCCC2)c1 122312357 WHBSWVUIRAXRGY-UHFFFAOYSA-N 388.493 2.797 0 50 GFAA CC(=O)N(C)c1ccc(C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)cc1 487102218 IORSBFNKLPEZKL-UHFFFAOYSA-N 395.459 2.702 0 50 GFAA O=C(/C=C/c1cccc(OC2CCCC2)c1)N[C@@H]1CCC(=O)N[C@@H]1[C@@H]1CCCO1 365993397 LTEXQBKNKPQPAZ-QRFLAZBDSA-N 398.503 2.964 0 50 GFAA CN(CCOc1ccccc1)C(=O)NCC1(N2CCOCC2)CCCCC1 73044321 SXFGFLBAUDKYCX-UHFFFAOYSA-N 375.513 2.742 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2cc(C)ccc2C)CN1C1Cc2ccccc2C1 32576600 WVMDFBQFHOXWCP-GGAORHGYSA-N 377.532 2.749 0 50 GFAA O=C1CCCC(=O)N1C1CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1 372310684 VNXPCPIUAHZWSK-HXUWFJFHSA-N 386.492 2.748 0 50 GFAA CCCN(C)C(=O)Cn1c(-c2ccccc2)nn(-c2ccc(OC)cc2)c1=O 77470420 GRWGOLPEBREZAX-UHFFFAOYSA-N 380.448 2.578 0 50 GFAA CC(C)c1ccc(-n2cc(O)c(C(=O)N3CCC(N4CCCC4=O)CC3)n2)cc1 173151219 WCDFLAVRKHPBPI-UHFFFAOYSA-N 396.491 2.928 0 50 GFAA COc1ccccc1[C@@H]1[C@@H]2C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]2N2CCCN12 138538502 UYAIITJPYFAEPS-IPMKNSEASA-N 397.862 2.884 0 50 GFAA CN(Cc1cc2ccccc2nc1N1CCOCC1)Cc1n[nH]c2c1CCC2 215870729 AKCUWPISGUJWNP-UHFFFAOYSA-N 377.492 2.915 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@H]2CCCN(C(=O)CCc3nncn3C)C2)cc1 77489438 BLFDTGXHBIDLRR-KRWDZBQOSA-N 378.480 2.852 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1Cn1cncn1 173687953 CADIWPAYHBRRLJ-SFHVURJKSA-N 395.850 2.515 0 50 GFAA C[C@H]1Oc2ccc(C(=O)C3CCN(c4cccc(C(=O)O)n4)CC3)cc2NC1=O 263407805 LFEJBSSWDQDDQT-GFCCVEGCSA-N 395.415 2.599 0 50 GFAA C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCC2CCN(S(C)(=O)=O)CC2)C1 287636876 UGOFMLIWBJOXIS-QFBILLFUSA-N 393.553 2.841 0 50 GFAA CC(C)N1CC[C@@H](CNC(=O)N2CCN(Cc3ccc(F)c(F)c3)CC2)C1 426571663 SBJYFVLDJPAXEZ-KRWDZBQOSA-N 380.483 2.522 0 50 GFAA O=C(c1cnc(-c2ccccc2)[nH]c1=O)N(CCO)Cc1ccccc1Cl 91677767 KSTKLLWKBNKOAU-UHFFFAOYSA-N 383.835 2.725 0 50 GFAA O=C(Cn1ccnc1-c1ccccc1)NCc1csc(-c2cnccn2)n1 95518383 KNSFEQMAUDWLQQ-UHFFFAOYSA-N 376.445 2.780 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC(=O)c2csc(C)c2CC)CN1C1CCCC1 95515149 HRONCMXNVAJFHK-KDOFPFPSSA-N 377.554 2.870 0 50 GFAA O=C(NCCCN1CCC[C@H](O)C1)Nc1ccccc1OCc1ccccn1 96150349 VIKYFSLWEZOLIK-SFHVURJKSA-N 384.480 2.629 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2n[nH]c3ccccc23)CC1 95519994 KOMOYXQAVSSREC-UHFFFAOYSA-N 380.496 2.731 0 50 GFAA O=C(O)[C@@H]1C[C@H]1C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 299752934 WAUGDAWTEPVNME-VXGBXAGGSA-N 381.215 2.863 0 50 GFAA COc1ccc(Cn2nccc2NC(=O)COc2ccccc2)c(OC)c1OC 61227066 JRRLAYTUAZMNFF-UHFFFAOYSA-N 397.431 2.975 0 50 GFAA Cc1nnc(CCNC(=O)Nc2cccc(C(=O)NCC(C)C)c2C)s1 299780310 JHVHDXGJEHOXAE-UHFFFAOYSA-N 375.498 2.905 0 50 GFAA O=C(NCc1cncn1C1CC1)N1CCN(c2nsc3ccccc23)CC1 584884897 GBUOCOYQIGWWAN-UHFFFAOYSA-N 382.493 2.860 0 50 GFAA CC[C@H](C(=O)NCCn1c(C)cc(C)nc1=O)n1cc(C(C)=O)c2ccccc21 822668414 SYQFDKYTIWIKSG-LJQANCHMSA-N 394.475 2.785 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)C1CCN(Cc2ccco2)CC1 952969517 BMJYFVZEEDPQKN-UHFFFAOYSA-N 383.492 2.963 0 50 GFAA COc1ccc(/C=C/CN[C@@H]2C3CN4CCN(C3)CC2(c2ccccc2)C4)cc1 952984317 KBEYMKBKIFLJKL-NRDRTZDZSA-N 389.543 2.866 0 50 GFAA CC(=O)c1cc(CC(=O)N2C[C@@H]3CC[C@H]2CN(C2CCOCC2)C3)cs1 1565531344 MUJQJWHPFXCCBF-QAPCUYQASA-N 376.522 2.595 0 50 GFAA C[C@H]1CN(C[C@@H]2CCCN2C(=O)Nc2ccc([S@](C)=O)cc2)C[C@@H](C)O1 170014482 RPIAJMJOPXQZEP-DPPCBQIVSA-N 379.526 2.530 0 50 GFAA CN1CCN(CC2CCN(C(=O)Nc3nc4c(s3)CCCC4)CC2)CC1 194540228 OEMPFLKTDLKHNX-UHFFFAOYSA-N 377.558 2.513 0 50 GFAA CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1 195460269 FHCCNHRAVVSLSR-HKUYNNGSSA-N 399.535 2.692 0 50 GFAA CCOc1cc(CN2C[C@H](Cc3cnccn3)[C@@H](O)C2)cc(Cl)c1OCC 1615736126 UUWXWYJYLHXIKW-YJBOKZPZSA-N 391.899 2.963 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3cccnc3SC)C[C@@H]2NC(C)=O)cc1 222417253 JMORIRIFGKFIHF-MSOLQXFVSA-N 385.489 2.556 0 50 GFAA CC1=C(CN2C[C@@H]3CN(c4cc(C)nc(N)n4)C[C@@]3(CO)C2)C(C)(C)CCC1 1772810259 FKAVZCJLALYXRT-VGOFRKELSA-N 385.556 2.624 0 50 GFAA Cn1nccc1-n1nc(C2CCOCC2)nc1[C@@H]1CCCN(c2ccccn2)C1 1772819783 SZKVWWUDHNQJSK-QGZVFWFLSA-N 393.495 2.674 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)N[C@H]1CC[C@H](O)CC1)C2 1772807088 IUQNWTSKWLGDEU-MGPQQGTHSA-N 375.494 2.940 0 50 GFAA COc1ccc(-n2c(CCNC(=O)c3csc(C)n3)nnc2SC)cc1 11791386 YSFSDEDKKDNNLG-UHFFFAOYSA-N 389.506 2.735 0 50 GFAA CCCCNC(=O)c1cc(NC(=O)COC)cc2nc(-c3ccncc3)n(C)c12 12097172 JCEZJJJXGSRJBO-UHFFFAOYSA-N 395.463 2.750 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2nc3ccccc3[nH]2)C1)c1ccc2c(c1)OCO2 12300650 YVJNFEKIKVYGBJ-HNNXBMFYSA-N 392.459 2.934 0 50 GFAA COC[C@H](C)N1CCC(Oc2cc(OC)ccc2C(=O)N2CCCC2)CC1 15079871 ZVTMZYPEQBUSJA-INIZCTEOSA-N 376.497 2.809 0 50 GFAA COCCNC(=O)CCC1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1 19740061 ILUONVNBKMQVBP-UHFFFAOYSA-N 388.487 2.971 0 50 GFAA Cc1ccccc1C(=O)N[C@@H]1C[C@@H](C(=O)NCCc2cccc(F)c2)CC[C@H]1O 1875246725 LHKVGHCQEJWQNW-IOMROCGXSA-N 398.478 2.752 0 50 GFAA COCCN1CCC[C@H]1CNC(=O)N1CCC(c2nc3ccccc3o2)CC1 111867210 GMFBHYYPZJFRBG-KRWDZBQOSA-N 386.496 2.828 0 50 GFAA C[C@H](C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1)n1cncn1 837230730 FSYVIOKXSHLGTM-WBVHZDCISA-N 385.468 2.660 0 50 GFAA O=C(O)[C@H]1CCCN(S(=O)(=O)c2ccc(-c3ccn4nccc4c3)s2)C1 1875309525 AREVOOXMUXIARI-ZDUSSCGKSA-N 391.474 2.548 0 50 GFAA Cc1cc(F)c(CNC(=O)N2CCc3nc[nH]c3[C@@H]2c2ccnn2C)c(F)c1 1875301580 NWCFIGBDLJTHBG-SFHVURJKSA-N 386.406 2.587 0 50 GFAA CCN(C(=O)c1cnn(C)c1C)[C@H]1CCN(c2ccc(C(F)(F)F)cn2)C1 1875312963 VCLVCZGQBOHHIF-AWEZNQCLSA-N 381.402 2.883 0 50 GFAA N=c1cc(CN2CCC3(CC2)C[C@H](O)c2nn(C4CCCC4)cc2O3)cc[nH]1 1875395892 OUVJOZZXESCGBH-KRWDZBQOSA-N 383.496 2.656 0 50 GFAA CCN(Cc1c(F)cccc1F)C(=O)c1nc(C)c(C)c(N2CC[C@@H](N)C2)n1 1875401746 QNXXOPLZFVLMQL-CQSZACIVSA-N 389.450 2.571 0 50 GFAA Cn1nc(C(F)(F)F)c2c(c1=O)CCN(c1cc(Cl)nc(C3(C)CC3)n1)C2 1875404550 MKFDBUNSQOVWKV-UHFFFAOYSA-N 399.804 2.857 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cnn2c(C(F)(F)F)cc(-c3ccco3)nc12 1517169 REEHXWOUYZLEPT-JTQLQIEISA-N 380.326 2.917 0 50 GFAA O=C(N[C@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O)c1ccc(F)cc1 2863548 PNUJUPQISZAOIL-INIZCTEOSA-N 387.333 2.699 0 50 GFAA COC(=O)c1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)NCc2ccccc2)cc1 4825762 ZBDUZVGNANVGHY-SFHVURJKSA-N 395.484 2.582 0 50 GFAA CN1C(=O)CCN(C(=O)c2csc(-c3cnccn3)n2)c2ccc(F)cc21 225405321 YPROGPMYDFAYJQ-UHFFFAOYSA-N 383.408 2.753 0 50 GFAA Cc1ccc(CS(=O)(=O)NC[C@@H](c2cccs2)N2CCOCC2)cc1C 225832917 KOEGQJQCXABQQS-SFHVURJKSA-N 394.562 2.858 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc4nonc4c3)C[C@H]2CCO)cc1C 106697548 RMEGKWZPDHWEEL-LJQANCHMSA-N 396.491 2.609 0 50 GFAA CCc1ccc(OCCN(C)C(=O)Cc2ccc(N3CCNC3=O)cc2)cc1 55342211 PMGJAODLRIMSNY-UHFFFAOYSA-N 381.476 2.859 0 50 GFAA Oc1cc(-c2nc3ccccc3s2)cc2c1OCCN(CCc1nnn[nH]1)C2 67818957 ANVFLMZCYMRFBV-UHFFFAOYSA-N 394.460 2.619 0 50 GFAA Cc1oc2ncn(C)c(=O)c2c1C(=O)NC[C@H](O)c1cc(Cl)cc(Cl)c1 118521976 XXOQBBBKSVRQIN-LBPRGKRZSA-N 396.230 2.605 0 50 GFAA Cc1cc(Cl)c(OCCOCCNCCN(C)C)c(Br)c1 20418798 ZEWSAWFOCQCNBJ-UHFFFAOYSA-N 379.726 2.958 0 50 GFAA COc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H](NC(=O)c3cccc(C)c3)CN2C)cc1 67739629 TVKGWBAZLPNHGT-PBEJRMEISA-N 395.503 2.684 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@@H](O)c3ccc(Cl)cc3)c2c1 252478522 AOVYXXOQIYAASE-MRXNPFEDSA-N 377.853 2.832 0 50 GFAA Cc1cnn(C2(C(=O)O)CCN(Cc3cc4c(cc3Cl)OCO4)CC2)c1 77287394 UYYRRFJNPJIODI-UHFFFAOYSA-N 377.828 2.650 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2cccnc2OC(C)C)N2CCOCC2)o1 121659558 BDCIFMYFTMZSIQ-QGZVFWFLSA-N 388.468 2.965 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CN(C/C=C/c3ccccc3)S(C)(=O)=O)O2)n1 431264285 RIXURIUIXQHNFC-BRBWODKKSA-N 377.466 2.573 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCc1nnc(-c2ccsc2)o1 238028334 MTFGNFOWZDAMCY-OAHLLOKOSA-N 383.429 2.769 0 50 GFAA CN(CCCO)C(=O)CC[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71754099 NAPVODLICHXUKW-HSZRJFAPSA-N 380.488 2.765 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cccc(C)c3F)CC2)C1 71776502 YTGHKLBAUNWEMI-IBGZPJMESA-N 391.531 2.573 0 50 GFAA C[C@H](NC(=O)CSc1nnc([C@H](O)c2ccccc2)n1C)c1ccccc1 30953056 IRVFNKDIZOHQER-KBXCAEBGSA-N 382.489 2.866 0 50 GFAA COC(=O)c1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)cc1 13138708 XZKVHGVWRXUNMN-XFKLWTPLSA-N 380.448 2.999 0 50 GFAA C[C@@H](C(=O)N1CCNC[C@@H]1c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1 262101031 VBKZKBNQHAPKHS-KBXCAEBGSA-N 396.882 2.728 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@H]2CN2CCCC2)CC1 171670145 CIZNSSNLORTNKP-IBGZPJMESA-N 386.540 2.934 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N3CCC(Nc4ncccn4)CC3)cc2)n1 77537173 LCSZDGGXANWSBI-UHFFFAOYSA-N 376.464 2.996 0 50 GFAA C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171954886 BXOVFAUDVZAPOV-GOSISDBHSA-N 394.519 2.841 0 50 GFAA CN(C)[C@H]1CCCN(C(=O)NCc2nc3cc(C(F)(F)F)ccc3n2C)C1 426541204 DTTWDPRAUPTVQC-ZDUSSCGKSA-N 383.418 2.828 0 50 GFAA O=C(c1ccc(CSc2ncccn2)o1)N1CCN(c2ccccc2)C(=O)C1 82137703 RNZAWAHLIKAQHM-UHFFFAOYSA-N 394.456 2.851 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CCC[C@H](CS(C)(=O)=O)C3)o2)c1 426597309 XPYWQDUAQALCSE-AWEZNQCLSA-N 377.462 2.852 0 50 GFAA CCN1CCN(C[C@H](O)CN2CCn3c4c(c5cc(C)ccc53)CCC[C@@H]42)CC1 19706627 HFDBNPIDCZKBSN-CVDCTZTESA-N 396.579 2.641 0 50 GFAA NC(=O)c1cccnc1N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95365597 KRNMFNBIHPCOEO-KFKAGJAMSA-N 384.430 2.525 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)[C@@H]1CCCN(CC(F)(F)F)C1 177433068 MQSQVDCJPFAJJB-OLZOCXBDSA-N 390.837 2.704 0 50 GFAA O=C(Cn1nccc1[C@@H]1CCCNC1)N1CCC(OCc2ccccc2)CC1 426504146 XYDWVDUNWZEABD-LJQANCHMSA-N 382.508 2.558 0 50 GFAA O=C(Cc1cccc(F)c1)N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1 91493582 PAPBAPLDASJDTB-UHFFFAOYSA-N 398.482 2.565 0 50 GFAA CN1CCCCC[C@H]1C(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 91326804 PWALWENDJASCBW-FQEVSTJZSA-N 398.551 2.687 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1ccc2ncccc2c1 266310381 GJMDJAKENYQVGX-MRXNPFEDSA-N 384.461 2.660 0 50 GFAA O=C(N1CCCCC1)N1CCC(NC(=O)C2(N3CCCC3)CCCC2)CC1 952970880 WGUJTKWVARFCLT-UHFFFAOYSA-N 376.545 2.582 0 50 GFAA Oc1nc2ccccc2cc1CNC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 952970446 SYQLAHVGDDQTDO-XFKLWTPLSA-N 376.464 2.765 0 50 GFAA COc1cccc(SCC(=O)N2CCCO[C@H](CN3CCCCC3)C2)c1 952971538 HMPVHVVAHQFRIU-GOSISDBHSA-N 378.538 2.891 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccn2)C3)cc1F 1565531406 CDJPBMJSZCGOOA-ZBFHGGJFSA-N 383.423 2.606 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N[C@H](C)c3nc(C(F)(F)F)n[nH]3)c2)n[nH]1 1465558865 USTCIYKCJKSYIQ-SSDOTTSWSA-N 380.334 2.800 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1cnns1)CC2 275634055 JRPTWVQTBHLLAS-HNNXBMFYSA-N 376.507 2.643 0 50 GFAA NC(=O)[C@@H]1CCCN1Cc1cccc(NS(=O)(=O)c2cccc(Cl)c2)c1 170609144 IUFMMTXTYBRQHO-KRWDZBQOSA-N 393.896 2.591 0 50 GFAA CN(C)Cc1ccc([C@@H]2CCCN2C2CCN(C(=O)c3cnccn3)CC2)cc1 1506419332 ZEUMMBTYTHNDLI-QFIPXVFZSA-N 393.535 2.980 0 50 GFAA Cn1nc(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)c2c1CCC(=O)C2 1506419581 SNOIYVLCKITBRB-ZDUSSCGKSA-N 378.432 2.639 0 50 GFAA COc1cc2nc(N3CCC[C@@H](OCc4ccccn4)C3)nc(N)c2cc1OC 1529161388 HCTBMXFYYNKFGT-OAHLLOKOSA-N 395.463 2.810 0 50 GFAA O=C(c1cc2c(Cl)cccc2[nH]1)N1CC[C@@H](O)[C@@](CC2CC2)(C(=O)O)C1 1704340318 GBRMNINGRSFRLX-APWZRJJASA-N 376.840 2.899 0 50 GFAA Cn1ccc(C2CCN(C(=O)C3CCN(C(=O)C4CCCC4)CC3)CC2)cc1=O 1772809628 BKIFHKVDURBRJL-UHFFFAOYSA-N 399.535 2.520 0 50 GFAA COCC(=O)N1C[C@H]2CN(C3CCSCC3)C[C@]2(CCc2ccccc2)C1 1772704609 CXBLEBKHWDVUEL-DENIHFKCSA-N 388.577 2.922 0 50 GFAA O=S(=O)(c1cccc2cccc(Cl)c12)N1C[C@@H]2COCC[C@]2(CO)C1 1772701578 FRXOVXVKDSPRDA-RDTXWAMCSA-N 381.881 2.513 0 50 GFAA Cn1cc(CNCCCOc2cccnc2)c(-c2ccc3c(c2)OCCO3)n1 11665071 VNIIGFFZIBUEQQ-UHFFFAOYSA-N 380.448 2.812 0 50 GFAA CCn1ccnc1CN1CCC[C@H](C(=O)Nc2cccc(-n3cccn3)c2)C1 12300395 AFIMKGXKAFKLDQ-KRWDZBQOSA-N 378.480 2.939 0 50 GFAA CC(C)C(=O)NCCc1nnc(SC[C@H]2CCCO2)n1-c1ccccc1F 14999981 CDVOYHVUDYJYQJ-CQSZACIVSA-N 392.500 2.992 0 50 GFAA O=C(CCc1ccncc1)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 15070214 JLVXVJLWWDBDHD-MRXNPFEDSA-N 391.393 2.950 0 50 GFAA COc1ccc([C@H](CNC(=O)COc2cc(C)cc(C)c2)N2CCOCC2)cc1 19897846 HUFWMUBTSALPBD-QFIPXVFZSA-N 398.503 2.881 0 50 GFAA O=C(NCC1CC1)c1cc2c(s1)C1(CCN(c3cnccn3)CC1)OCC2 1857693121 IUNBFQMWHPIZJG-UHFFFAOYSA-N 384.505 2.746 0 50 GFAA CN(C)c1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cn1 1857703116 UHUMOSWWDHHJNP-UNMCSNQZSA-N 394.519 2.826 0 50 GFAA CCC(=O)N1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NCc2cc(C)no2)C1 1875246370 OKHDULRHPGRWFI-JOCHJYFZSA-N 395.507 2.901 0 50 GFAA Cc1ccc([C@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCOCC2)cc1 252537325 KYLVLBVSTYGNNU-KRWDZBQOSA-N 396.413 2.557 0 50 GFAA CC(C)(CNC(=O)c1cnc2ccncc2c1O)N1CCc2ccccc2C1 253630222 GJXVFPUQLLKJBE-UHFFFAOYSA-N 376.460 2.902 0 50 GFAA NCc1ccc(CNC(=O)c2cc3c(N4CCNCC4)cccc3s2)c(F)c1 1875276667 NQCFEYZXXYDJBW-UHFFFAOYSA-N 398.507 2.839 0 50 GFAA COCC[C@H](CO)NC(=O)COc1cc2sc(C)nc2c2sccc12 1875261267 DWQCGEFDKFRNFC-LLVKDONJSA-N 380.491 2.712 0 50 GFAA Cc1nccn1-c1cncc(N2CCC[C@H](C3(C(=O)O)CC(F)(F)C3)C2)n1 1875283508 UZNLLIOTHVUUFT-ZDUSSCGKSA-N 377.395 2.687 0 50 GFAA Cc1cccc(N2CCC[C@@H](NC(=O)c3ccnc(N4CCCCC4)n3)C2=O)c1 1875319089 YSRKYBPDOBFUKK-LJQANCHMSA-N 393.491 2.701 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2ccc(Cl)c(F)c2N2CCOCC2)C1 1875371846 NCVJSOQYPUOKNM-ZDUSSCGKSA-N 395.862 2.679 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N1CC[C@H](C2CC2)[C@H]1c1nnc(O)n1C 1875401943 WZQNAHCWTHVJPD-PXAZEXFGSA-N 381.436 2.624 0 50 GFAA CC(C)[C@@H](F)C(=O)NCC1(O)CCN(C(=O)c2ccc3c(c2)CCC=C3)CC1 1775991170 JBPAHXFZTGUEMN-LJQANCHMSA-N 388.483 2.723 0 50 GFAA Cc1cc(Sc2nccn2C)ccc1NC(=O)c1c(CN)nn2c1CCC2 2325789184 BMWHWBQVWMMPFB-UHFFFAOYSA-N 382.493 2.733 0 50 GFAA O=C(O)[C@@H](CCc1ccc(C(F)(F)F)cc1)NCC1CCS(=O)(=O)CC1 2325789774 LXFBSPLKODEGSD-OAHLLOKOSA-N 393.427 2.506 0 50 GFAA CCn1cc(C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)c2ccc(C(C)C)nc2)c(C)n1 2325824852 SXTFIKVAHXVAMP-MSOLQXFVSA-N 395.507 2.859 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2cc(OC)c(OC)cc2OC)C1=O 2356138026 FNPVZSJZMCQWLV-NRFANRHFSA-N 390.480 2.720 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)C4(C)COC4)C3)[C@@H]3CCCCN23)c1 2356161936 QLOUSJVFBSCZLA-WAGURGNTSA-N 398.547 2.976 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)c2cnc3cnn(C)c3c2)CC1 2356168033 MYRKVAOTCIWDIQ-UHFFFAOYSA-N 392.459 2.681 0 50 GFAA CCc1c(C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)[nH]c(C)c1C(C)=O 110364386 WXFAYVDOTJVIQK-UHFFFAOYSA-N 382.424 2.633 0 50 GFAA COc1cccc(NC(=O)c2cccc(NC(=O)Cn3nc(C)cc3N)c2)c1 55358325 XDZAGRZHYFWUAM-UHFFFAOYSA-N 379.420 2.673 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@@H]2CCCN(Cc3ccco3)C2)s1 55393435 UDFQWVJOJRHZBS-CQSZACIVSA-N 380.539 2.950 0 50 GFAA CCOc1ccc(N([C@H](C)C(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 101685510 UXVVONRGSKLJCN-LDDOYCOJSA-N 380.510 2.545 0 50 GFAA Fc1ccc(-c2n[nH]cc2CNC[C@@H](c2cccnc2)N2CCOCC2)cc1 55575364 LYTRJZXENHYYBZ-FQEVSTJZSA-N 381.455 2.774 0 50 GFAA CNCC(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 67784463 UKIRVIZJOZDUGJ-UHFFFAOYSA-N 390.875 2.563 0 50 GFAA CCCCN(C)C(=O)c1nc2ccccn2c1CNCCc1nc(C)cc(C)n1 20209622 RJDYVCRSDHWAQW-UHFFFAOYSA-N 394.523 2.946 0 50 GFAA O=C(c1ncn[nH]1)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67689139 ICRBVHKQAMJAKQ-UHFFFAOYSA-N 393.428 2.822 0 50 GFAA Cc1nn(Cc2nc3c4cnn(-c5ccccc5)c4ncn3n2)c(C)c1Cl 2800600 DELDVIAXPQAVIC-UHFFFAOYSA-N 378.827 2.978 0 50 GFAA Cc1ncccc1OC1(C(=O)N2CCC[C@@H]2c2nc(C(C)C)no2)CCNCC1 77540555 GPFRKVHIXFYHRA-MRXNPFEDSA-N 399.495 2.761 0 50 GFAA CS(=O)(=O)CCc1ccc(NC(=O)c2cnc([C@H]3CCCO3)s2)cc1 121264754 HPQWMCHZTQKEJZ-CQSZACIVSA-N 380.491 2.834 0 50 GFAA C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1 363328802 QYCLUJJPWSZKLI-KCXAZCMYSA-N 398.488 2.981 0 50 GFAA COc1cccc(C(=O)NCC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 363664879 KZOYEIJNXMRGOT-LJQANCHMSA-N 396.491 2.930 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CCC[C@](C)(O)C1 71757124 SRXTVALAGWMVAX-QHCPKHFHSA-N 392.503 2.953 0 50 GFAA O=C(CCc1cc2n(n1)CCNC2)Nc1ccccc1OCc1ccccn1 72412091 KIDVWKNWBKXBGP-UHFFFAOYSA-N 377.448 2.532 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3CCCCC3)[C@@H]4C2=O)cc1C 77486268 BHSJYKBURHIKJS-GJPOJAMWSA-N 380.488 2.598 0 50 GFAA Cc1cccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)nc(C)n3)CC2)c1 77136069 FDGQKYRHRMXLCF-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Cc1c(Cl)cccc1NC(=O)NCCNc1cc(N2CCOCC2)ncn1 72437649 OWARTBLCHIUDSR-UHFFFAOYSA-N 390.875 2.509 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCc2c[nH]cn2)(Cc2ccccc2)c2ccccc21 71748207 VRWOMEYGZFAMTB-QHCPKHFHSA-N 388.471 2.616 0 50 GFAA Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N[C@@]3(C(=O)O)CCSC3)c12 263013816 XDBLSOVQSRXIOT-FQEVSTJZSA-N 396.472 2.634 0 50 GFAA CC(C)[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)c1nc2ccccc2n1C 223218670 ISHVCENJDGFYOW-LJQANCHMSA-N 390.443 2.683 0 50 GFAA CCc1cc(Br)cc2sc(NC(=O)[C@@H]3CC[C@H](C(N)=O)O3)nc12 288136789 LFAOHWSSBBTTAW-ZJUUUORDSA-N 398.282 2.593 0 50 GFAA CC(=O)N1CCC(NC(=O)N(CCCO)Cc2cccc3ccccc23)CC1 426434394 AQUMQTANYKUMMM-UHFFFAOYSA-N 383.492 2.745 0 50 GFAA CNc1nc(C)cc(N2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)n1 82135194 ZSDSDLPYVLRJQT-NRFANRHFSA-N 380.496 2.631 0 50 GFAA CCCn1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c(C)n1 95499123 IXGIWPRJCARQFR-UHFFFAOYSA-N 396.539 2.611 0 50 GFAA Cc1ccc(-c2cc(C(=O)N(Cc3ccccn3)C[C@@H]3CCC(=O)N3)[nH]n2)s1 91594770 AYXYNYQOHULHGK-HNNXBMFYSA-N 395.488 2.763 0 50 GFAA NC(=O)c1nc(CNC(=O)C[C@H](c2ccccc2)c2cccc(Cl)c2)no1 95498066 LLCVFAMNKRQLRD-OAHLLOKOSA-N 384.823 2.660 0 50 GFAA Cc1ccnn1CC(=O)N1CCC[C@@H](CCC(=O)NCc2ccccc2F)C1 95528194 XLWLECLHIRNYEW-KRWDZBQOSA-N 386.471 2.666 0 50 GFAA CCCn1cnnc1CNC(=O)Nc1c(-c2ccccc2OC)c(C)nn1C 96149687 KGZVVXZRKFPVLF-UHFFFAOYSA-N 383.456 2.727 0 50 GFAA CC[C@@H](C)[C@@H](CO)NC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1 253401376 FOFNAKDSIJPAQC-WOCWXWTJSA-N 385.508 2.726 0 50 GFAA COC[C@H](NC(=O)N(C)Cc1ccc(OC)c2ncccc12)c1ccnn1C 534648589 ZHJXCANLZCMQNZ-INIZCTEOSA-N 383.452 2.506 0 50 GFAA CCc1ccc(-n2cnnc2)cc1NC(=O)N1CCN(c2ccccn2)CC1 299792157 DJPILJHEQQBJOO-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA O=C(NCCCN1CCCc2ccccc21)Nc1ccc(-n2cnnn2)cc1 299767975 DDRDMQHGYUWBCR-UHFFFAOYSA-N 377.452 2.627 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cnc(-c3ccccn3)nc2)C1)c1ccccn1 828184268 UEUVJGVZQOHIIG-QGZVFWFLSA-N 388.475 2.576 0 50 GFAA CN(C)c1ccc(Cl)cc1NC(=O)c1cn(CC[C@@H]2CCCCN2)nn1 952982397 WXIFCEGGCMJPAH-AWEZNQCLSA-N 376.892 2.782 0 50 GFAA Cc1cc(OC[C@@H](O)CNC(=O)CCc2n[nH]c3c2CCCC3)ccc1Cl 952965156 QMQQXWZCMHGHME-AWEZNQCLSA-N 391.899 2.739 0 50 GFAA Cc1ncc(CN(CCN(C)C)Cc2cccc(OCCCn3ccnc3)c2)[nH]1 1704313932 SOOIGFVHMMNHCE-UHFFFAOYSA-N 396.539 2.948 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N(C)[C@@H]1C[C@@H]2CC(=O)N(C)C[C@@H]2C1 1704340855 VMNHWMDRKNZFNP-QLFBSQMISA-N 391.899 2.692 0 50 GFAA O=C1NCCN1c1ccc(CN[C@@H]2CCCc3c2cnn3-c2ccccn2)cc1 11661015 KRHDRQVHVSLDIN-LJQANCHMSA-N 388.475 2.964 0 50 GFAA O=C(CSc1ccncc1)NC[C@@H]1Cc2cccc(-c3cnccn3)c2O1 12080292 VJXSLJMDACWXQF-HNNXBMFYSA-N 378.457 2.751 0 50 GFAA CCOC(=O)[C@@]1(Cc2cccc(OC)c2)CCCN(C(=O)C2CCOCC2)C1 12209365 IJHVXJJBMDVHJQ-JOCHJYFZSA-N 389.492 2.836 0 50 GFAA CCCNC(=O)c1cc(=O)n(CC(=O)Nc2ccccc2F)c2ccccc12 12411182 ZAPFVRABLRKGNJ-UHFFFAOYSA-N 381.407 2.919 0 50 GFAA biogenic,in-vitro O=C(NCCCn1ccnc1)/C(=C\c1ccccc1F)NC(=O)c1ccccc1 13426672 XBLOPDIFPBOZSL-HMMYKYKNSA-N 392.434 3.000 0 50 GFAA CCCN1CCC2(CC1)OCCc1sc(C(=O)NC[C@@H]3CCCO3)cc12 1857682714 MAYOIOANJPFJLI-HNNXBMFYSA-N 378.538 2.931 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CCN1Cc1ccccc1 225402191 PZYWCRGXMSPFJE-HYVNUMGLSA-N 397.441 2.709 0 50 GFAA Cc1c(NC(=O)c2cccc(-n3cccn3)c2)cccc1C(=O)N1CCOCC1 116633141 YBPZKBRAMPCROP-UHFFFAOYSA-N 390.443 2.905 0 50 GFAA CC(C)(C(N)=O)c1ccc(NC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)cc1 155350972 HYEJAMHAUGXAIK-QGZVFWFLSA-N 387.386 2.859 0 50 GFAA CNC(=O)COc1ccc(NC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2)cc1 265302272 POFHNBYWRJBGAM-LJQANCHMSA-N 396.491 2.944 0 50 GFAA Cc1nnc([C@H]2CCCN2C(=O)NCC2(N3CCSCC3)CCCC2)o1 1875256186 SKVXQMFLNZRBJY-OAHLLOKOSA-N 379.530 2.586 0 50 GFAA COCCn1nc2c(c1C(=O)N(C)CC1(O)CCCCCC1)C[C@H](C)O[C@@H]2C 1875315810 IRRKURPRROFOKY-JKSUJKDBSA-N 393.528 2.709 0 50 GFAA Cc1c(NC(=O)c2ccc(C3CCNCC3)cc2)nnn1Cc1ccncc1 2325821274 AVTICXCLZBTDHK-UHFFFAOYSA-N 376.464 2.749 0 50 GFAA COCc1noc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2[C@H]3CCC(C)C)n1 2356134276 HFUFWYDMWUBKAO-RYRKJORJSA-N 386.496 2.974 0 50 GFAA COc1ccc(-c2onc(NCCCN3CCCC[C@@H]3CO)c2C(=O)O)cc1 2356140588 NAOKYVNQWORLKB-OAHLLOKOSA-N 389.452 2.697 0 50 GFAA Cc1nc(N2CCc3nc(CCc4ccccc4)nn3CC2)c2c(C)noc2n1 2356168086 OSBBXRABEWLXAZ-UHFFFAOYSA-N 389.463 2.674 0 50 GFAA CCOc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(OC)c(C)c1 4867370 VDTWGIGJJFEFCI-AWEZNQCLSA-N 392.477 2.708 0 50 GFAA COc1cc(CNCc2ccccc2)c(Br)cc1OCC(N)=O 6703802 PRZMPINMSGRNCQ-UHFFFAOYSA-N 379.254 2.612 0 50 GFAA CCCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2nnc(-c3ccccc3)s2)C1 6746081 ITZMRJQPCXMHMU-CQSZACIVSA-N 394.522 2.595 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N(C)[C@@H]1CCc2ccccc2C1 114417540 YPGVQFUPSKCPIQ-LJQANCHMSA-N 388.471 2.699 0 50 GFAA C[C@H](c1cccs1)N(C)CC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 247985478 YZOLQFXLZPFNOJ-CABCVRRESA-N 396.534 2.550 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)NCc1csc(-c2cnccn2)n1 65432512 WMYOJSDJYPFFNC-UHFFFAOYSA-N 396.432 2.882 0 50 GFAA CCS[C@H]1CCCCN(C(=O)c2cc(Cl)sc2S(N)(=O)=O)C1 253404740 QLNZAPLQKPAHSL-VIFPVBQESA-N 382.960 2.797 0 50 GFAA Cc1nc(C(=O)NC[C@H]2CN3CCCC[C@@H]3CO2)nn1-c1ccccc1C(C)C 129030472 IYLYWIFMMZCDBN-MSOLQXFVSA-N 397.523 2.682 0 50 GFAA CN(C[C@H]1CCOC1)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 176220655 GFMSVQOPWLSXEH-NVXWUHKLSA-N 385.430 2.958 0 50 GFAA COc1ccc(CCNC(=O)N2CCCN(Cc3cccnc3)CC2)c(OC)c1 426411492 PGDDJAXBTNUNPR-UHFFFAOYSA-N 398.507 2.559 0 50 GFAA COc1ccc(NC(=O)N(C)C[C@H]2CCN(c3ccccc3)C2)cc1C(N)=O 97546465 MCIUUNJQJAWFLD-OAHLLOKOSA-N 382.464 2.784 0 50 GFAA CC(=O)N1CCCN(C(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2)CC1 96164381 DGKSCWUHTRPRQW-MRXNPFEDSA-N 386.496 2.645 0 50 GFAA CN(Cc1cc(-c2cccnc2)no1)C(=O)[C@H]1CCN(c2ccccc2)C1=O 95498374 FITVPUFNAMQPMO-GOSISDBHSA-N 376.416 2.748 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@@H](C)NC(=O)c1cnc(NC(C)C)nc1 91626144 KVUNITNZOKBHCX-CQSZACIVSA-N 377.452 2.948 0 50 GFAA Nc1cccc(C(=O)N2CCC[C@H](CCC(=O)NCc3ccccc3F)C2)n1 95510272 GNUVNWIMERJCEE-OAHLLOKOSA-N 384.455 2.752 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC(c3nccn3Cc3ccncc3)CC2)n1 95523182 HEELBIGXZIYZGK-UHFFFAOYSA-N 384.871 2.733 0 50 GFAA C[C@H](NC(=O)N1CCNC(=O)C[C@@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1 182934191 AZRWXOCRMPWFDK-HFSMHLIXSA-N 398.551 2.912 0 50 GFAA CN(C)[C@H]1CCN(C(=O)c2ccc(-c3ccc(Cn4ccnc4)cn3)cc2)C1 534578887 IIUWBIQTFBVUIJ-FQEVSTJZSA-N 375.476 2.770 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNCc2nnc(-c3ccc(C)n3C)o2)n1 65453076 KQOZDRWJDCSYKX-UHFFFAOYSA-N 380.374 2.833 0 50 GFAA O=C(N[C@H]1C[C@H](C(=O)N2C[C@H]3CCC[C@H]3C2)C[C@@H]1O)c1ccc(F)cc1Cl 1940194820 UWEBJSPWORTMEP-DNJOTXNNSA-N 394.874 2.607 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)[C@@H]3COc4ccccc4C3)s2)n1 1940196573 TTYROLDGDKNUAA-HNNXBMFYSA-N 383.477 2.784 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3cccc(-n4cccn4)c3)cc2C1 299760610 VMIIGGCEABOMAK-UHFFFAOYSA-N 378.480 2.615 0 50 GFAA Cn1ccnc1CN1CCN(C(=O)Nc2ccc(-c3cscn3)cc2)CC1 299763148 HAFUNVNEJNQYNQ-UHFFFAOYSA-N 382.493 2.893 0 50 GFAA C[C@@H](C(=O)N1CCN(C(=O)c2cccnc2)CC1)c1cn(C)c2ccccc12 185052922 ZSMBCBXQUMUOTG-MRXNPFEDSA-N 376.460 2.661 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2ccc(Br)cc2Cl)cn1 275702720 XSTPRWMANWNIJL-ZBFHGGJFSA-N 397.704 2.946 0 50 GFAA CCOC(=O)c1nc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)c[nH]1 170617388 WPHYCEZJLGMWBE-UHFFFAOYSA-N 377.344 2.547 0 50 GFAA COc1ccc(CN2C[C@@H]3OC(=O)N(Cc4ccc(OC)c(OC)c4)[C@@H]3C2)cc1 1615636281 NDMAXYSMTSSVIV-NQIIRXRSSA-N 398.459 2.918 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCC([C@@H](O)c3cccs3)CC2)c1 1506426565 PQVYQHVNMIVNMR-QGZVFWFLSA-N 379.503 2.737 0 50 GFAA CN(C[C@H]1Cc2ccccc2CN1C)C(=O)C(C)(C)NC(=O)c1cccs1 1506419881 ZMRFBRSZEWHXJO-QGZVFWFLSA-N 385.533 2.772 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2CC2CCN(C(C)C)CC2)cc1OC 1529099981 KLYPHEVJYVLZDW-FGZHOGPDSA-N 392.540 2.558 0 50 GFAA O=C(CCc1cccnc1)N1CCCN(C(=O)Nc2ccc3c(c2)OCO3)CC1 1772813246 VWYPHQWJBIEVBU-UHFFFAOYSA-N 396.447 2.509 0 50 GFAA O=C(NCc1ccco1)c1ccc2c(c1)N(Cc1ccccc1)C(=O)C[S@@]2=O 5058600 PHVAJIVVGPFZCI-MUUNZHRXSA-N 394.452 2.864 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(c3cc(C)nc(N)n3)C2)c1 12201315 QBGUHTSOTPWOBR-MRXNPFEDSA-N 383.496 2.689 0 50 GFAA O=C(N[C@H](Cn1ccnc1)c1ccccc1)c1cn(Cc2ccccc2F)nn1 12434278 GYZMUBATQSVJNQ-LJQANCHMSA-N 390.422 2.833 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)NCc1cccnc1N1CCC[C@@H](O)C1 12754586 JADUOIRFPUSENS-GOSISDBHSA-N 378.476 2.773 0 50 GFAA CN1C(=O)N(CCCc2ccncc2)C(=O)C12CCN(Cc1ccccc1)CC2 14541137 YCVHDNHJRIVZDE-UHFFFAOYSA-N 392.503 2.943 0 50 GFAA CCc1cccc2c(C(C)=O)cn(CC(=O)N3CCN(c4ncccn4)CC3)c12 19148317 CWOHAXUEXGLORG-UHFFFAOYSA-N 391.475 2.545 0 50 GFAA c1csc(CN2CCN(Cc3nc(-c4ccc5c(c4)OCO5)no3)CC2)c1 19741455 GCZFSOPYVWEPBW-UHFFFAOYSA-N 384.461 2.845 0 50 GFAA O=C1N[C@H](CC(=O)N2CCC(c3ccccc3)CC2)C(=O)Nc2ccccc21 206256671 ZPBXRDZWGUVPLH-LJQANCHMSA-N 377.444 2.533 0 50 GFAA COc1ccc(-c2ccc(C(=O)NCc3nc4ncccc4o3)c(O)n2)cc1 1857669923 CZGQOFNXUWJAAX-UHFFFAOYSA-N 376.372 2.929 0 50 GFAA COc1ccccc1-c1noc(CCC(=O)NCc2nc3ncccc3o2)n1 1857680607 PYRKAQYJVXLMEE-UHFFFAOYSA-N 379.376 2.530 0 50 GFAA CCCc1nnc(N2C[C@@H](C(=O)NCc3ccc(Cl)cc3)CC2=O)s1 1857697231 LCUIQALZDGKAKH-LBPRGKRZSA-N 378.885 2.813 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)NCc1cn2c(C)c(C)sc2n1 1857698225 YEUMCOBRUMDNPH-UHFFFAOYSA-N 391.522 2.544 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1ccccc1-c1nn[nH]n1)CC2 1857706664 ZBRANBKEEVRZMC-UHFFFAOYSA-N 399.458 2.508 0 50 GFAA C=Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)c4ccccn4)[C@H]4CC[C@]3(C2)O4)nc1 1857713024 SJSMUKHAMBQPRJ-ODULNIPZSA-N 376.460 2.533 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(OC)c(Cl)c3)C[C@]23CC[C@H]1O3 1857718774 SFIHAJUXLCHJQQ-DKYLXPRQSA-N 378.900 2.854 0 50 GFAA CCCNC(=O)[C@@]12CCCCN1C[C@@H](NC(=O)Cc1cc(F)cc(Cl)c1)C2 1875245574 GISBWFZZNKMPGA-PXNSSMCTSA-N 395.906 2.661 0 50 GFAA CN(C(=O)c1cccnc1-n1cccn1)[C@@H]1CCN(c2ccccc2Cl)C1=O 110998541 HGOSAQONOYFCBL-QGZVFWFLSA-N 395.850 2.798 0 50 GFAA CSc1ccc2cc(CN3C(=O)N[C@@]4(CCCNC4)C3=O)c(Cl)nc2c1 830545436 HDEOFZORSRSVLC-GOSISDBHSA-N 390.896 2.784 0 50 GFAA CCCCc1ccc(CCNCc2cnn([C@@H]3CCS(=O)(=O)C3)c2)cc1 1875290751 BYXOMMRCMZQHPR-HXUWFJFHSA-N 375.538 2.918 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c1nn(C)c2C(=O)N1CCC(CO)(Cc2ccccc2)CC1 1875314583 HBUPWJHMZLFDJT-SJORKVTESA-N 397.519 2.900 0 50 GFAA CO[C@H](C(=O)N=[S@@](C)(=O)c1ccnn1C)c1ccccc1C(F)(F)F 1875312200 WUAVLWIJCGKGSF-CANCMXDXSA-N 375.372 2.810 0 50 GFAA C[C@@H](NC(=O)N1CCC2(CC1)C[C@H](C(N)=O)CO2)c1ccc(C(F)(F)F)cc1 1875300388 BDTCVSXISSMIJG-OCCSQVGLSA-N 399.413 2.832 0 50 GFAA COc1ccc(C(=O)N2CCC(NC(=O)N[C@@]34CCC[C@@H]3C4)CC2)c(OC)c1 888101722 NBHXQDXNLGMFLY-SPLOXXLWSA-N 387.480 2.550 0 50 GFAA CCOC(=O)c1[nH]c(C)c(S(=O)(=O)Nc2ccc3c(c2)CCCN3)c1C 2325748767 HAONFLSRPACXHK-UHFFFAOYSA-N 377.466 2.967 0 50 GFAA Cc1c(N2CCC(c3nccn3C)CC2)nn2c(C(F)(F)F)nnc2c1C 2325780717 KDTRSYGELYVFIA-UHFFFAOYSA-N 379.390 2.877 0 50 GFAA COc1ccc(C)cc1NC(=O)CSc1nnc(-c2ccccc2OC)n1N 2438396 SYVGDKTZUVMNNJ-UHFFFAOYSA-N 399.476 2.715 0 50 GFAA CCN(CC(=O)Nc1ccc(OC)c(OC)c1)S(=O)(=O)c1ccc(C)cc1 2886550 OLMNDABJDQSAJG-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA CCc1nnc(SCC(=O)Nc2ccc(Cl)cn2)n1C[C@H]1CCCO1 6700051 XCDFZXILBJCFDC-GFCCVEGCSA-N 381.889 2.799 0 50 GFAA Cc1nc(CNC(=O)[C@@H]2CCC(=O)N(CCc3cccc(F)c3)C2)sc1C 67643541 KGSPXPVKQPDTGI-MRXNPFEDSA-N 389.496 2.997 0 50 GFAA COc1ccc2c(c1)C[C@H](c1nc(-c3c(C)ncc4c3CCNC4)no1)CO2 20256435 WCRZTAMKQFBCNZ-AWEZNQCLSA-N 378.432 2.813 0 50 GFAA COc1ccc(CC(=O)N2CCN(C(=O)c3cc4ccccc4n3C)CC2)cc1 20722326 OKBVMZXCLUSMRA-UHFFFAOYSA-N 391.471 2.714 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN(C)Cc3cnn(C)c3)C2=O)cc1 67434842 AANPDYXJWZKGCS-QFIPXVFZSA-N 384.524 2.529 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 120932995 JPAAYWNQQPKMPV-UONOGXRCSA-N 386.351 2.589 0 50 GFAA Cc1cccn2cc(C(=O)N3CC[C@]4(CCCN(CC5CCC5)C4=O)C3)nc12 72165592 YSJWUBANBAGLQN-JOCHJYFZSA-N 380.492 2.898 0 50 GFAA Cc1ccc(-n2cc(C(=O)N3CCC(O)(Cc4ccc(F)cc4)CC3)nn2)cc1 479234321 LJCCBYYLYMSDPM-UHFFFAOYSA-N 394.450 2.925 0 50 GFAA Cc1sc(=O)n(CC(=O)N2CCOC[C@@H]2c2nc3ccccc3s2)c1C 374319674 AODCUWITIJMKPK-CQSZACIVSA-N 389.502 2.736 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@H](C)N2CC[C@H](c3nc(C4CC4)no3)C2)c1 375466289 SURHEKQGXXTDHH-WFASDCNBSA-N 383.452 2.722 0 50 GFAA N[C@@H]1c2ccccc2C2(CCN(C(=O)COc3ccccc3Cl)CC2)[C@H]1O 72174098 MNQDJVPPDGKNHC-UXHICEINSA-N 386.879 2.654 0 50 GFAA O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 332793292 BRZQQLPVXLDEGU-HYEGPXJVSA-N 375.513 2.567 0 50 GFAA Cn1nccc1[C@@H](O)c1cc2n(n1)CCCN(Cc1cccc3cc[nH]c13)C2 219842332 OOBIJKLBUFCIBZ-NRFANRHFSA-N 376.464 2.586 0 50 GFAA CC[C@H]1CN(CC(=O)NC2CCN(C(=O)c3ccco3)CC2)c2ccccc2O1 173611901 BPUKNKQFUJRZMF-KRWDZBQOSA-N 397.475 2.678 0 50 GFAA COc1ccc(N2C[C@H](CN3CCN(C(=O)OC(C)(C)C)CC3)OC2=O)cc1 221540037 UTXVGVTZQUIFHB-KRWDZBQOSA-N 391.468 2.573 0 50 GFAA Cc1ccc(N2CCN(C(=O)CCC(=O)N(C)C3CCCCC3)CC2=O)cc1 82135026 SIGKBEIDXZKJKJ-UHFFFAOYSA-N 385.508 2.742 0 50 GFAA COc1ccccc1CNC(=O)N1CCN(Cc2ccc(C)cc2)C(=O)[C@H]1C 426512293 PQLOPOGPHDZTBK-QGZVFWFLSA-N 381.476 2.946 0 50 GFAA Cc1ccc(CN(C)C(=O)Nc2cccc(NS(=O)(=O)N(C)C)c2)s1 96139792 GLQOHTNAMVQIOG-UHFFFAOYSA-N 382.511 2.939 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)c1ccc(SC)cc1)CC2 91616484 CRZLXDVGNOWROS-UHFFFAOYSA-N 376.522 2.900 0 50 GFAA Cn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 96141645 AYPWAZGCLHDLPG-UHFFFAOYSA-N 389.463 2.561 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNC(=O)c2cc(-c3cccn3C)[nH]n2)C1 91644720 GBAJAMKIQWFXBE-KRWDZBQOSA-N 377.492 2.943 0 50 GFAA O=C(c1cnc(N2CCOCC2)nc1)N1CCC(CCc2ccccc2)CC1 95353827 VPIFPXGKBQPAHV-UHFFFAOYSA-N 380.492 2.798 0 50 GFAA CCc1cccc(OCCN(C)C(=O)c2cnc(-c3cccnc3)nc2O)c1 91808924 QBANACVHZVDBJI-UHFFFAOYSA-N 378.432 2.958 0 50 GFAA COc1cncc([C@H](NC(=O)c2ccc(N3CCCC3)cc2)[C@H]2C[C@@H](O)C2)c1 244852918 VBRZXTQYBCPBQA-LKUPVBHCSA-N 381.476 2.932 0 50 GFAA CC(=O)[C@@H]1[C@@H]2C(=O)N(C(C)(C)C)C(=O)[C@H]2[C@@H]2C=Cc3ccc4cccnc4c3N21 245310320 IDRVIQXMNRIGPG-IMBTUZDBSA-N 389.455 2.808 0 50 GFAA O=C(Nc1cc(C(F)(F)F)cnc1O)[C@H]1CCCN1C(=O)Cc1ccccc1 299201710 OCZPAVWCZGBAPT-OAHLLOKOSA-N 393.365 2.978 0 50 GFAA CN1C(=O)COc2ccc(NC(=O)NCCN3CCCc4ccccc43)cc21 534575271 HVQUDBBJVRKHQL-UHFFFAOYSA-N 380.448 2.616 0 50 GFAA CC(=O)Nc1cc(NC(=O)N2CCC[C@H](CN3CCCC3=O)C2)ccc1F 299770827 RVDBAROIYFWORM-CQSZACIVSA-N 376.432 2.650 0 50 GFAA Cc1nc(C)c(C(=O)NCC2CCN(c3nc(C)c4c(n3)CCCC4)CC2)o1 825302623 QFXMWDGGRKLLDW-UHFFFAOYSA-N 383.496 2.915 0 50 GFAA O=C1CNC(=O)c2ccc(C(=O)N3C[C@@H]4CCCC[C@]43c3ccccc3)cc2N1 1347679931 JVUYHPINHXZXCD-SBUREZEXSA-N 389.455 2.910 0 50 GFAA COc1ccc([C@H]2CN(C(=O)NCCc3ccccc3)C[C@@H]2NC(C)=O)cc1 1565528273 YQYBMEQSGBLKBK-RTWAWAEBSA-N 381.476 2.551 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 170638299 SNQODTZDJFBIFN-OLZOCXBDSA-N 386.351 2.589 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)[C@@H]1CCCCN1C(=O)c1cccs1 194989721 DZLYYKXJKMTSLA-INIZCTEOSA-N 395.488 2.640 0 50 GFAA CN(C)C1(CNC(=O)c2cc(=O)c3ccc(F)cc3o2)Cc2ccccc2C1 796621668 MNFHZHODQWKGRP-UHFFFAOYSA-N 380.419 2.761 0 50 GFAA O=S(=O)(Cc1ccc(Cl)cc1F)NC1CCN(C[C@@H]2CCCO2)CC1 1506417946 UIMUISKKYWEXBW-INIZCTEOSA-N 390.908 2.542 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 1506403530 PZVXULOMXHXTLT-KRWDZBQOSA-N 389.459 2.778 0 50 GFAA O=C(c1cc(C(F)F)[nH]n1)N1CCCN(CCCOc2ccccc2)CC1 1529144317 XLHYLNMAOCGKQU-UHFFFAOYSA-N 378.423 2.964 0 50 GFAA COc1ccc(CN(C)C(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2C)cc1 1529167662 PMLBYNZEXWJCRK-RTWAWAEBSA-N 382.460 2.561 0 50 GFAA COCCn1cnnc1[C@@H](C)Nc1cc(Sc2cccs2)nc(N)n1 1529184535 ADFMLXSOEUUERL-SNVBAGLBSA-N 377.499 2.683 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CC(=O)N[C@@H](Cc3ccccc3)C2)cc1 1772712256 MBYYEHZVTLAGSW-IBGZPJMESA-N 376.460 2.628 0 50 GFAA CC(C)C1=NO[C@H](C(=O)N2CCCN(Cc3cnn(-c4ccccc4)c3)CC2)C1 1772809112 MOHCQDZSWGRIEE-NRFANRHFSA-N 395.507 2.708 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)N2CCCC[C@@H]2c2cccc(OC)c2)nn1 11772160 KBVVBQOTRGQFEP-LJQANCHMSA-N 399.495 2.523 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCc1nnc(-c2ccc(C(C)=O)s2)o1 11873912 NVOZGORXYMVRBL-CYBMUJFWSA-N 376.482 2.534 0 50 GFAA Cc1ccc(OCCN(C)C(=O)[C@H]2CCC(=O)N(Cc3ccccn3)C2)cc1 12447857 RPRMJGWQJFRMAQ-SFHVURJKSA-N 381.476 2.666 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1cccc(F)c1F 12597135 HCAFLFBAZHSLIX-KRWDZBQOSA-N 384.390 2.544 0 50 GFAA O=S(=O)(NC[C@@H](c1ccccc1)N1CCOCC1)c1ccc(Cl)cc1 19537344 SUYNYRMPDZCVQW-SFHVURJKSA-N 380.897 2.692 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccc(C)cc4C)c2=O)CCCC3)no1 169763922 JMXCFGIJBLJNMH-UHFFFAOYSA-N 380.448 2.624 0 50 GFAA CNC(=O)c1cc(-n2ccnc2-c2cc3c(cc2OC)OCCO3)ccc1OC 1857675344 UNHCLYRZIDNENS-UHFFFAOYSA-N 395.415 2.687 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cc(=O)c3ccccc3o2)[C@H]1c1ccccc1 1857712199 MPAZRDNKYZVWIL-VXKWHMMOSA-N 392.455 2.937 0 50 GFAA O=C(COc1ccc(-c2nccn2CC[C@@H]2CCCOC2)cc1)N1CCOCC1 1857714366 ZTUFXILXSYKKRB-SFHVURJKSA-N 399.491 2.604 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccccc2-c2nc[nH]n2)[C@H]1c1ccccc1 1857726226 XPWULLJITPGSTQ-PMACEKPBSA-N 391.475 2.616 0 50 GFAA CCCCOc1ncccc1CNC(=O)Cc1ccnc(O)c1Br 225560734 LIFIGHXSFHSZSD-UHFFFAOYSA-N 394.269 2.983 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N[C@H](C(=O)O)c3ccccc3)cc2)C[C@@H](C)O1 237416527 HGGONKLSTKVCMH-QINHECLXSA-N 382.460 2.852 0 50 GFAA Cc1ccc(-c2nnc(CCC(=O)N3CCN(c4ccccc4)C(=O)C3)o2)s1 23251291 WLHWXAHGSQIEMW-UHFFFAOYSA-N 396.472 2.915 0 50 GFAA O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 1875256132 XKLKHEZZSAHLGF-RHSMWYFYSA-N 385.399 2.923 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C4CCCC4)cc2O3)nn1C 1875394633 PXLSFUCHSMQGEY-KRWDZBQOSA-N 399.495 2.531 0 50 GFAA CNc1nc(C)ccc1C(=O)N1CC[C@@H](C2CC2)[C@@H]1c1nnc(O)n1C(C)C 1875401950 XDHBXYFFGIVOFH-GOEBONIOSA-N 384.484 2.923 0 50 GFAA CC(=O)N1CCC2(CC1)C[C@H]2N(Cc1nccn1C)C(=O)c1cccc(C)c1F 1775989532 ORKRPGQWEQNVGT-GOSISDBHSA-N 398.482 2.911 0 50 GFAA C[C@@H](c1ccc(Cl)cc1)N1C[C@H](C(=O)NCc2nc3cccnc3[nH]2)CC1=O 2325780792 PNSOCUJAFPHGRA-GXTWGEPZSA-N 397.866 2.837 0 50 GFAA O=C(C1CC2(CC(OCc3ccccc3)C2)C1)N1CCCC[C@H]1Cc1nn[nH]n1 2325781122 MVSADSXKDWIPGS-ZEVNHLFTSA-N 395.507 2.899 0 50 GFAA CC(C)Cc1n[nH]c2ccc(C(=O)NC3CC(n4cc([C@H](C)O)nn4)C3)cc12 2325869732 ZAHAHWUSSLGVHH-GRTSSRMGSA-N 382.468 2.540 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)c3cnc(Nc4ccccc4)nc3)CC2)C1 2356147079 GXHTUJLAWLZTBC-HXUWFJFHSA-N 382.464 2.756 0 50 GFAA COC(=O)c1ccc2c(C(=O)C(F)(F)F)cn(CC(=O)N3CCCC3)c2c1 2503290 LOLRJFPLBJLPBN-UHFFFAOYSA-N 382.338 2.795 0 50 GFAA O=C1N(Cc2ccccn2)CCC[C@@]12CCCN2Cc1nc(C(F)(F)F)no1 2356170928 DUJMCQYAKJJDEC-QGZVFWFLSA-N 395.385 2.641 0 50 GFAA O=C(Nc1cccnc1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 6710289 UUTSGVHFCASIPH-UHFFFAOYSA-N 379.869 2.774 0 50 GFAA COc1ccc(Cl)c(S(=O)(=O)N2CCCC[C@H]2[C@@H](O)C(F)(F)F)c1 221987447 JURLXIYGSCLMMP-WCQYABFASA-N 387.807 2.815 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@H](CCO)C2)o1 104551082 MTFDQHPUCPAWHG-LJQANCHMSA-N 388.508 2.812 0 50 GFAA CCCn1nc(C)cc1NC(=O)c1cccc(CN2CCC(=O)NC[C@H]2C)c1 65526468 NWXKQGKXXVDZKK-MRXNPFEDSA-N 383.496 2.564 0 50 GFAA Nc1nnc([C@@H](NC(=O)c2cccc(-n3cccn3)c2)c2ccccc2)s1 65488578 UMRGCGLGWYKZRK-INIZCTEOSA-N 376.445 2.825 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)c3cccc(N4CCNC4=O)c3)C2)cc1 12432191 SYGIHNIMFNSOOL-GOSISDBHSA-N 394.475 2.942 0 50 GFAA O=C1OC2(CCN(C(=O)c3ccncc3)CC2)CN1CCOc1ccccc1 77459110 SKVPMMFUSGJGIC-UHFFFAOYSA-N 381.432 2.588 0 50 GFAA O=C1CCCN1CCCN1C(=O)CC[C@@H]2CN(C/C=C/c3ccco3)CC[C@@H]21 12036410 DEDBROSGPPLDOG-PDNSKEJHSA-N 385.508 2.618 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328615957 BFTGYMPEVZNTRN-HNNXBMFYSA-N 377.448 2.852 0 50 GFAA O=C(CN1CCCCC1=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 363097192 OLXVJPUUWWYLPR-UHFFFAOYSA-N 397.441 2.799 0 50 GFAA CS(=O)(=O)c1ccc([C@@H](O)CN2CCC([C@@H](O)c3ccccc3)CC2)cc1 154791287 YPMXQDDNHLQSDB-SFTDATJTSA-N 389.517 2.569 0 50 GFAA O=C(C[C@@H]1CCCO1)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 237953276 GAAUVGANZHICQS-WFASDCNBSA-N 395.253 2.611 0 50 GFAA O=S(=O)(Nc1ncc(-c2cncc(F)c2)cn1)c1ccc(C(F)(F)F)nc1 366207566 RSQBZHBAEDUVHA-UHFFFAOYSA-N 399.329 2.892 0 50 GFAA Cc1ccc(C)n1-c1nc(CC(=O)N2CCN[C@H](c3ccncc3)C2)cs1 367087177 WXHULWARFZEBKK-SFHVURJKSA-N 381.505 2.661 0 50 GFAA Cc1cnc(N2CCC[C@]3(CN=C(O)C3)C2)nc1N1CCC[C@@]2(CN=C(O)C2)C1 329805986 NOBGXZWHFGNRGZ-RTWAWAEBSA-N 398.511 2.679 0 50 GFAA Cc1nc(N2CCCC2)ncc1-c1cc(=O)[nH]c(N2CCc3ccccc3C2)n1 39383753 SZXLOWYARYSQBP-UHFFFAOYSA-N 388.475 2.698 0 50 GFAA CN(CC(=O)N1CCC[C@H](C(=O)O)C1)C(=O)c1ccc(Oc2ccccc2)cc1 262209144 POIJUVTVWFNUEK-KRWDZBQOSA-N 396.443 2.874 0 50 GFAA O=S(=O)(c1cc(Cl)cc(Cl)c1)N1CCCN(C[C@H]2CCCO2)CC1 239591310 BASUOFSVTSGSLE-OAHLLOKOSA-N 393.336 2.869 0 50 GFAA Cc1cc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c2cnn(C)c2n1 175135987 OABIRTYYQFTUGF-UHFFFAOYSA-N 391.475 2.833 0 50 GFAA O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)N1CCN(c2ccccc2)C(=O)C1 426613037 ZKMISTDRZYMJFU-FQEVSTJZSA-N 392.503 2.567 0 50 GFAA COc1cccc(N2CCN(C(=O)Cc3c(C)[nH]c4ccccc34)CC2=O)c1 82137435 QSDSJFFPXNIKSK-UHFFFAOYSA-N 377.444 2.903 0 50 GFAA O=C(N[C@@H]1CCCNC1)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 95509709 WXSLIMCYWJGGJI-LJQANCHMSA-N 394.519 2.607 0 50 GFAA O=C(COC[C@H]1CCCCO1)N1CCC(c2nccn2CC2CCC2)CC1 95530866 OAUYWLYDEKIQKO-LJQANCHMSA-N 375.513 2.975 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2cccnc2OC)C3)cc1 95358964 CPIXDRGFDVGEJR-ZWKOTPCHSA-N 381.476 2.835 0 50 GFAA O=C(O)c1c(I)cc(F)cc1I 95910968 FSKNMKMFAGISIJ-UHFFFAOYSA-N 391.905 2.733 0 50 GFAA Cn1cc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCCC3)c(C2CC2)n1 291189935 TZIGRGYKPYFSLR-UHFFFAOYSA-N 375.450 2.675 0 50 GFAA CN(CC1CCN(CCc2cccc(C(F)(F)F)c2)CC1)C(=O)c1nc[nH]n1 95524462 LQTXHVMXZPGEPH-UHFFFAOYSA-N 395.429 2.850 0 50 GFAA CNc1nc(C)cc(N[C@@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)n1 92038572 QOANZSYSETYFBH-MRXNPFEDSA-N 397.527 2.703 0 50 GFAA COc1cn(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)c(C)cc1=O 253405298 IFGIBLYPDSUQFQ-UHFFFAOYSA-N 377.444 2.963 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)[C@H](c3cccc(F)c3)N3CCOCC3)c2c1C 182643224 PPGNZNXMTJKQHU-KRWDZBQOSA-N 383.427 2.726 0 50 GFAA CNc1ccc(-c2cccc(C(=O)NC[C@@H](CO)Cc3ccsc3)c2)nn1 534673090 JCDJMVNXIDVKJD-HNNXBMFYSA-N 382.489 2.828 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)Cc1c[nH]c2ccccc12 266370210 RHRXETRAYWTBBT-HNNXBMFYSA-N 386.477 2.522 0 50 GFAA Cn1cccc1-c1cc(C(=O)NC[C@@H]2CCN(Cc3ccccc3F)C2)n[nH]1 952868671 CMIYYWNNERJOIP-HNNXBMFYSA-N 381.455 2.806 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)N(C)CCN(C)C1CCCC1 952981521 XRYFLLAMOYVTNU-UHFFFAOYSA-N 376.526 2.676 0 50 GFAA CS[C@H]1CCC[C@H]1N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 170690273 LQRLJCKJYVPJTI-UXHICEINSA-N 390.597 2.860 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(C(=O)c2ccc4c[nH]nc4n2)C3)cc1 1775978869 QEGBSTABDQABIU-UHFFFAOYSA-N 386.415 2.503 0 50 GFAA CCCCc1nn2c(=O)c(NC(=O)c3ccc(OC)c(OC)c3)cnc2s1 14291566 VVBZINFUNWIEAV-UHFFFAOYSA-N 388.449 2.763 0 50 GFAA Cc1ccc(-n2ncc3c2CCC[C@H]3NC(=O)CSc2nncn2C)cc1C 14973318 AERZTMHEYOHEOL-QGZVFWFLSA-N 396.520 2.904 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(COc3cccc(F)c3F)n2)C1 15072555 HMMSFTQYWZRSRV-GFCCVEGCSA-N 394.374 2.947 0 50 GFAA O=C(c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)N1CCC[C@H]1CO 15073257 CGJMXVRPHNFNDX-FQEVSTJZSA-N 395.503 2.722 0 50 GFAA Cc1nn(C)c2c1[C@H](NC(=O)CCCc1nc(-c3cccnc3)no1)CCC2 1857680218 IIWVOPLUIDFXOY-OAHLLOKOSA-N 380.452 2.690 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)CC3CC3)C[C@]23CC[C@H]1O3)c1cc(F)cc(F)c1 1857716824 GBDZTJPDZDJXEG-XKGFGPFHSA-N 390.430 2.501 0 50 GFAA CC(C)COc1cccc(-c2nccn2[C@H]2C[C@H]3CO[C@@H](CCO)CN3C2)c1 1857730936 DCGVIZWTGBSJCY-ZJOUEHCJSA-N 385.508 2.982 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)CCN2Cc3ccccc3C2=O)C[C@@H]1O 209900329 CMUMQEDKPANUPN-ROUUACIJSA-N 384.501 2.779 0 50 GFAA CCc1nc(CN2CCOC[C@@H]2c2c(C)nn(-c3cccc(OC)c3)c2C)n[nH]1 364280835 SBEZQKVMAOKLOR-GOSISDBHSA-N 396.495 2.752 0 50 GFAA COC[C@]1(C(=O)O)CCN(C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1 262880143 CCPFLEKYZRERFC-KRWDZBQOSA-N 384.354 2.760 0 50 GFAA O=C(COC(=O)c1ccc2c(c1)NC(=O)C2)NCCc1cccc2ccccc12 1875265015 UZUSOMRUGRRECU-UHFFFAOYSA-N 388.423 2.850 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCN(c2c(C)cccc2Cl)CC1)C1CCCC1 1875259496 JWTRAFJTAWRLEB-GOSISDBHSA-N 377.916 2.992 0 50 GFAA Cc1ccc(C)c(NC(=O)NC(=O)CN2CC[C@@](O)(Cc3ccccc3)C2)c1 1875309126 SKXZJYIRHDGIBW-JOCHJYFZSA-N 381.476 2.631 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOC[C@@H]2c2nc3ccccc3s2)CC1 1875362997 UNLCPYSVIBCTSC-MRXNPFEDSA-N 385.489 2.621 0 50 GFAA CC(C)C(=O)N[C@@H]1CCOC2(CCN(C(=O)c3cc4c([nH]3)CCCC4)CC2)C1 1775997485 KWDMLEAQSYBNIX-QGZVFWFLSA-N 387.524 2.820 0 50 GFAA Cc1cc(C(=O)O)ccc1S(=O)(=O)N1CCN(Cc2ccccc2)[C@H](C)C1 396357623 HWTLPGNLPIPISO-MRXNPFEDSA-N 388.489 2.588 0 50 GFAA CNc1ncccc1C(=O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100483034 NMMAYBQATCTTPT-HSZRJFAPSA-N 392.503 2.963 0 50 GFAA O=C(NC[C@@H]1CCCCN1C(=O)c1cc2cccn2c(O)n1)Nc1ccccc1 2325805604 VSILGDWFTOYILI-KRWDZBQOSA-N 393.447 2.856 0 50 GFAA Cc1cccc(CN2CCC[C@H]2CNC(=O)c2ccc3ncn(C)c(=O)c3c2)c1 2325858442 NGCSAYNXARCUEQ-IBGZPJMESA-N 390.487 2.636 0 50 GFAA C[C@@H]1CN(C(=O)[C@H](Cc2cc(F)cc(Br)c2)C(=O)O)C[C@@H]1F 2325869971 DSBRKSONGPADNT-JCOFBHIZSA-N 376.197 2.648 0 50 GFAA CCOc1ccc([C@H]2C(C(=O)OC)=C(C)N=C3SCCC(=O)N32)cc1OC 799366 BEKXNWLDZJFGMA-KRWDZBQOSA-N 390.461 2.917 0 50 GFAA O=C(C[C@]1(O)C(=O)Nc2ccc(I)cc21)c1ccccc1 1140856 ROHVCHJIMUFWTF-MRXNPFEDSA-N 393.180 2.704 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCN(C)C4(CCNCC4)C3)ncnc21 2356147708 KZNUQTQPZPUWLQ-UHFFFAOYSA-N 399.587 2.699 0 50 GFAA COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2ccc3c(c2)OCCO3)CC1=O 7598935 WZUZNNBMJDMSFX-AWEZNQCLSA-N 382.416 2.766 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCC(C(=O)N2CCCCCC2)CC1 10323822 DJRCFWMYOYCGPR-UHFFFAOYSA-N 398.500 2.638 0 50 GFAA CC(C)c1nnc(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1 8117205 GBROXNNSPGDCAN-UHFFFAOYSA-N 380.495 2.698 0 50 GFAA CCOc1ccc2nc(NC(=O)[C@H]3CC(=O)N([C@H](C)COC)C3)sc2c1 8245125 OWCJMHWYAIKMJO-NEPJUHHUSA-N 377.466 2.517 0 50 GFAA Cc1cnn([C@H]2CCCN(C(=O)CCC(=O)N3CCC(c4ccccc4)=N3)C2)c1 109683384 TYNUSSPOISXUCO-IBGZPJMESA-N 393.491 2.772 0 50 GFAA Cc1cc(NC(=O)c2cnn(-c3ccccn3)c2C)ccc1N1C(=O)CCC1=O 112589901 ZUJLGALFFOOHIP-UHFFFAOYSA-N 389.415 2.790 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCC[C@H]1Cc1cccc(OC)c1 248184069 GICSRADQSXQCFK-ICSRJNTNSA-N 388.508 2.646 0 50 GFAA O=C1N[C@@H](C(=O)N2CCOc3c(O)cc(-c4cccc(Cl)c4)cc3C2)CO1 67541183 JKRWOEOLFWBTAV-OAHLLOKOSA-N 388.807 2.542 0 50 GFAA CN1[C@H]2CC[C@H]1CN(C(=O)c1ccc(CNC(=O)c3cccs3)cc1)CC2 245434326 CHCGUHABIIOQCU-ROUUACIJSA-N 383.517 2.987 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 246257406 GYGHBWABXYSNGH-MRVWCRGKSA-N 385.386 2.880 0 50 GFAA Cc1nn2c(NCCN3CCOCC3)c3c(nc2c1-c1ccccc1)CCC3 20533177 MNOLPUPVOQAFIN-UHFFFAOYSA-N 377.492 2.938 0 50 GFAA CC[C@H](OC)C(=O)NCc1cccnc1N1CCN(c2ccccc2C)CC1 67908877 AIZGWRBTWLCZEE-FQEVSTJZSA-N 382.508 2.758 0 50 GFAA C[C@@H](O)c1ccc(CNC(=O)NCC2(N3CCOCC3)CCCCC2)cc1 170748565 DJUBRVPYBYAMMJ-QGZVFWFLSA-N 375.513 2.574 0 50 GFAA C[C@H](OC(=O)CCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 229443625 NEJXFSGIOQYHAZ-FXUDXRNXSA-N 388.464 2.857 0 50 GFAA O=S(=O)(CCCOCc1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1 253426735 AQPQRDSCPFOFFW-OAQYLSRUSA-N 388.533 2.787 0 50 GFAA Cn1nccc1[C@@H](O)c1cc2n(n1)CCCN(C/C=C/c1ccc(F)cc1)C2 218829267 XCZPLKLSPFTTJK-XAFBZQIESA-N 381.455 2.757 0 50 GFAA CC1(C)C[C@@]2(C[C@@H]2C(=O)N2CCC(N3CCN=C3O)CC2)c2ccccc2O1 328608306 YQJKMKSPUIPZDV-VGSWGCGISA-N 383.492 2.726 0 50 GFAA Cn1c(O)nc2ccc(C(=O)N3CCC4(CC3)C[C@@H]4C(=O)N3CCCCC3)cc21 329126758 ULQKGWDGUBMSQL-MRXNPFEDSA-N 396.491 2.534 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1 125944172 IWGVSNNVVHOBSF-ICSRJNTNSA-N 396.487 2.930 0 50 GFAA CCc1ccc(Nc2nc(-c3cnc(N4CCOCC4)nc3C)cc(=O)[nH]2)cc1 39383606 UAUNHOMCGWIDSJ-UHFFFAOYSA-N 392.463 2.678 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)ncn1 72434085 YVKURCNLOBFKBU-UHFFFAOYSA-N 390.491 2.642 0 50 GFAA COc1ccc(NC(=O)N[C@H]2COc3c(C)cccc3C2)c(S(C)(=O)=O)c1 455955300 WKKTVCDKJAGJEZ-CQSZACIVSA-N 390.461 2.532 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2ccsc2)[C@@H](CCO)C1 19811652 HIZIQDPSOFEZIV-INIZCTEOSA-N 376.551 2.835 0 50 GFAA O=C([C@@H]1CCCCN1Cc1ccccc1)N1CCC(O)(c2cccnc2)CC1 223296411 WFZOCKVSUWHQDT-NRFANRHFSA-N 379.504 2.946 0 50 GFAA Cc1cc(CN(C)C(=O)c2cccc(-n3nc(C)c4ccccc4c3=O)c2)n[nH]1 426649620 KVNDYSKONOGLST-UHFFFAOYSA-N 387.443 2.998 0 50 GFAA Cc1ccc(OCCN)c(C(=O)N[C@H]2CCCN(Cc3ccc(F)cc3)C2)c1 426379584 ALOMMTYDTYRBNW-IBGZPJMESA-N 385.483 2.866 0 50 GFAA CCOc1ccc(Cl)cc1CN(C)C(=O)[C@@H]1CCCN(C(=O)COC)C1 97156152 CZKYQKXYSCAFNT-CQSZACIVSA-N 382.888 2.582 0 50 GFAA NC(=O)N1CCC[C@@H](C(=O)NCC2CCC(c3nc4ccccc4[nH]3)CC2)C1 97088361 SXFXARWDLGXQBZ-UYSNPLJNSA-N 383.496 2.744 0 50 GFAA Cc1cc(C2CCC2)nc(N2C[C@H]3CN(C(=O)C4CCCC4)C[C@@]3(C(=O)O)C2)n1 96151109 VQJHVVXCTCCVNH-VGOFRKELSA-N 398.507 2.592 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCCO[C@H](CN2CCCC2)C1 91693889 RGSOBFZWMYJOKV-LJQANCHMSA-N 381.480 2.547 0 50 GFAA Cc1cc(C)cc(NC(=O)[C@@H]2O[C@@H]3OC(C)(C)O[C@@H]3[C@H]3OC(C)(C)O[C@H]32)c1 241439834 NMPFJWNIAMWBKN-ORDFZIBCSA-N 377.437 2.638 0 50 GFAA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)[C@H]1COc2ccc(Cl)cc2C1 299035644 PSAQSPRDBPHUCD-WCQYABFASA-N 376.806 2.892 0 50 GFAA O=C(c1ccc(-c2ccc(F)cc2)o1)N1CCC(c2nnc3n2CCNC3)CC1 261849111 XBNJMBVKDKSUAK-UHFFFAOYSA-N 395.438 2.800 0 50 GFAA Cc1nccc(N2CCN(C(=O)NCc3ccccc3OCC(C)C)CC2)n1 184962502 OUPZZXPCKMYVSQ-UHFFFAOYSA-N 383.496 2.852 0 50 GFAA COc1ccc(CN2CCC(N3CCSCC3)CC2)cc1Cn1cccn1 670440134 GLJGXEZHYXQHSA-UHFFFAOYSA-N 386.565 2.953 0 50 GFAA CN(Cc1sc2ccccc2c1Cl)C(=O)[C@H]1CCCN(CC(N)=O)C1 952869300 GYIYLQQWZTZLRK-LBPRGKRZSA-N 379.913 2.710 0 50 GFAA CC1(C)CC(CC(=O)N2CCC(N3CCC(C(=O)O)CC3)CC2)CC(C)(C)N1 952989209 HZZRVSUAIHQBJB-UHFFFAOYSA-N 393.572 2.721 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC([C@@H](O)c4cccs4)CC3)ccc2c1=O 1506426657 ITFFWJQBFNVYNN-GOSISDBHSA-N 383.473 2.581 0 50 GFAA Cc1oc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)N(C)C[C@@H]1CCOC1 1506396099 HQQZYXJVBHMYLQ-JTQLQIEISA-N 394.371 2.919 0 50 GFAA C[C@H](C(=O)N(Cc1cocn1)Cc1cocn1)c1nnc(O)c2ccccc12 1506419413 BQPSMIRSKHXJDE-LBPRGKRZSA-N 379.376 2.644 0 50 GFAA COC(=O)CCC(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 12030979 ZCZSTQJHMBGWSB-HXUWFJFHSA-N 380.435 2.733 0 50 GFAA COCCNC(=O)CCC1CCN(C(=O)Nc2ccc(OC)cc2C)CC1 12193813 FDBGKOUSGVQYAK-UHFFFAOYSA-N 377.485 2.790 0 50 GFAA CN(C[C@H](O)c1ccccc1)C(=O)c1cn(Cc2ccc(F)cc2Cl)nn1 12466177 GLGHXLZNBBZLJV-SFHVURJKSA-N 388.830 2.925 0 50 GFAA COCCCNC(=O)c1cc(-c2cccc3cccnc23)cc(-n2cnnn2)c1 12471287 VRZTUFKEAPCYAQ-UHFFFAOYSA-N 388.431 2.644 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc(-n3cccn3)c2)n1 14957782 ITIABPXFKKFYDC-IBGZPJMESA-N 375.432 2.819 0 50 GFAA CCOC(=O)CNC(=O)NCc1cccnc1Oc1ccc(C)c(F)c1F 15073846 OAHZIXOEWGYQML-UHFFFAOYSA-N 379.363 2.823 0 50 GFAA Cc1cnccc1CNC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 15078368 RPEKZPMZFKCWCP-UHFFFAOYSA-N 375.354 2.979 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)c4ccc(F)cc4)nnc23)n1 169776114 ONUCSOQIMPMNHV-UHFFFAOYSA-N 380.383 2.972 0 50 GFAA Cn1nc(C(=O)N2CCC(O)(c3cccc(C(F)(F)F)c3)CC2)nc1Cl 1857707234 JOVVPAMJOGIACY-UHFFFAOYSA-N 388.777 2.611 0 50 GFAA CCSCC(=O)NC[C@H]1[C@H]2CN(c3nc(C)c(C)s3)C[C@]23CC[C@H]1O3 1857734130 KXOMVBJZLYEURL-LUXYFRNMSA-N 381.567 2.613 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)Cc3ccc(O)cc3)C[C@@H]2NC(=O)C2CC2)cc1 213431133 UJXVIEDNCKJDOH-RTWAWAEBSA-N 378.472 2.764 0 50 GFAA COc1ccc(CN2CCC(n3cc(C(=O)N4CCCC4)nn3)CC2)c(C)c1C 14967446 CGXPLFWVGWSFBG-UHFFFAOYSA-N 397.523 2.977 0 50 GFAA CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NC1CCC2(CC1)OCCO2 266682262 REQCULDXUWDRDW-IBGZPJMESA-N 387.524 2.836 0 50 GFAA COc1ccccc1CC(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 1704299092 NOZUGKYBICTTBW-JOCHJYFZSA-N 380.492 2.600 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3cncc(Br)c3C)CCN2)c1 870154282 IPRDOSHARHVFHZ-KRWDZBQOSA-N 390.281 2.948 0 50 GFAA CNc1cnc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cn1 952893033 GXOBFGADMSUROI-MRXNPFEDSA-N 391.357 2.674 0 50 GFAA O=C1N[C@H]2c3ccccc3O[C@@]3(CCCS(=O)(=O)[C@@H]23)N1Cc1cccs1 1776006680 YXAPTTDYGNOZDA-XYJFISCASA-N 390.486 2.681 0 50 GFAA Cc1ncc(CCNc2cc(-n3nc(C)c(Br)c3C)ncn2)[nH]1 2325802668 SLFBFLBRXSWNKO-UHFFFAOYSA-N 376.262 2.728 0 50 GFAA Cc1cc(S(=O)(=O)Nc2c(C)nn(CCO)c2C)c(Cl)cc1Cl 2325821102 CPVVRKWUZWMFTJ-UHFFFAOYSA-N 378.281 2.908 0 50 GFAA CCc1ccc(F)cc1C(=O)N1CC(NC(=O)[C@@H](c2ccccc2)N(C)C)C1 2325827519 INPHDBPXEWZPCE-HXUWFJFHSA-N 383.467 2.632 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)N3CCC[C@H](c4ccccc4)C3)ccc2N1 880982572 MHXIKDFZAHFNMF-HNNXBMFYSA-N 399.472 2.824 0 50 GFAA CCOc1ccc(N(CC(=O)NC)S(=O)(=O)c2ccc(Cl)cc2)cc1 857992 GLBFXTUSMKFRDW-UHFFFAOYSA-N 382.869 2.680 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2ccc(OC)c(OC)c2OC)C1=O 2356149987 HCWRVJQHLABALO-NRFANRHFSA-N 390.480 2.720 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)o1 2356162965 NHCZPDPPLYTGQJ-JOCHJYFZSA-N 380.444 2.746 0 50 GFAA CCCc1nnc(NC(=O)Cn2c(=O)oc3cc(Br)ccc32)s1 2867160 HCNVTLIFMKBDRN-UHFFFAOYSA-N 397.254 2.800 0 50 GFAA CN1CCN(C(=O)c2ccccc2NC(=O)COc2ccc(Cl)cc2)CC1 4195836 CYRGINWVXSPJKH-UHFFFAOYSA-N 387.867 2.745 0 50 GFAA COc1cc(Cl)c(CN2CCc3nnc([C@H]4CCCO4)n3CC2)cc1OC 20601302 RXGMFMBWVMEYES-OAHLLOKOSA-N 392.887 2.859 0 50 GFAA Cc1nonc1N1CCN(Cc2nc(-c3cc(F)ccc3F)oc2C)CC1 67850791 KJFJOHUVRBNISR-UHFFFAOYSA-N 375.379 2.942 0 50 GFAA O=C(Nc1ccc(Cl)nc1)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65406820 MLVDETXXFXHDRS-UONOGXRCSA-N 375.812 2.846 0 50 GFAA CCc1nnc(NC(=O)CN2CCN(c3cccc(C(F)(F)F)c3)CC2)s1 20213873 HNZVGGPJGYOSIT-UHFFFAOYSA-N 399.442 2.880 0 50 GFAA Cc1nc(C(F)(F)F)nc(N2CCc3nnc([C@H]4CCCO4)n3CC2)c1C 67757271 IBSQITKKWCYASX-GFCCVEGCSA-N 382.390 2.618 0 50 GFAA Cc1cccn2cc(CNC(=O)[C@H]3CCCN(C(=O)Cc4ccccc4)C3)nc12 363396826 YTIBZILXAOPBCJ-IBGZPJMESA-N 390.487 2.740 0 50 GFAA CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(C(=O)O)n1 485648331 QGBGVRBHPFGIOJ-LJQANCHMSA-N 381.476 2.983 0 50 GFAA O=C(c1ccnc(N2CCO[C@@H](c3ccc(Cl)cc3)C2)c1)N1CCOCC1 71749608 IGPKFPNJGGYFBT-GOSISDBHSA-N 387.867 2.785 0 50 GFAA CN[C@@H](C)CNC(=O)c1ccc(C)c(S(=O)(=O)Nc2cccc(Cl)c2)c1 261794290 RCXOZBJAQSNFJB-ZDUSSCGKSA-N 395.912 2.787 0 50 GFAA Cc1cccc(C)c1OC1CCN(C(=O)[C@@H]2CC23CCS(=O)(=O)CC3)CC1 375127114 BDKQOKUFXWOVCT-SFHVURJKSA-N 391.533 2.888 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3cccc4c3ccn4C)CC2=O)c1 82100078 CSMXJIRQTIKMGX-UHFFFAOYSA-N 377.444 2.672 0 50 GFAA C[C@@H](NC(=O)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc(C(F)(F)F)c1 241869068 SUEPTQLNXRRMPH-WQVCFCJDSA-N 383.414 2.578 0 50 GFAA COC(=O)[C@@H]1Cc2ccc(OC3CCN(C(=O)OC(C)(C)C)CC3)cc2N1 44138696 UBUUNNDBFFEDOE-KRWDZBQOSA-N 376.453 2.975 0 50 GFAA C[C@@H](NC(=O)NCC1CCN(C2CCCC2)CC1)[C@@H](O)c1ccc(O)cc1 426531880 XPCPVBRPYRBYAB-FOIQADDNSA-N 375.513 2.768 0 50 GFAA Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)N2CCC[C@@H]2C(N)=O)cc1 426436580 PMYWMTOMTVHVQP-GFCCVEGCSA-N 381.358 2.588 0 50 GFAA CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccccc2Oc2cccnc2)C1 95504626 TXFKOHRHNJMCAJ-HNNXBMFYSA-N 389.477 2.874 0 50 GFAA CN(Cc1ccc(Cl)cc1Cl)C(=O)CN1C(=O)COc2cccnc21 95513117 WAIFUJLFHDUBLI-UHFFFAOYSA-N 380.231 2.772 0 50 GFAA O=C(NC1CC1)c1ccc([C@H]2CCCN2C(=O)c2nnc3n2CCCC3)s1 23542743 GSWJHNHACDITDE-CYBMUJFWSA-N 385.493 2.545 0 50 GFAA COc1ccc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)cc1-n1nnnc1C 179783082 KRIYWZVQGOAZAZ-MRXNPFEDSA-N 387.827 2.695 0 50 GFAA CCC(CC)N[C@H]1C[C@@H](C(=O)NCCOC)N(Cc2ccccc2Cl)C1 299784345 XKFVIIYXRXHJEP-HKUYNNGSSA-N 381.948 2.824 0 50 GFAA O=C(c1ccncc1)N1CCOC2(CCN(c3cnc4ccccc4n3)CC2)C1 952980857 RTXJPAIWYMJJIN-UHFFFAOYSA-N 389.459 2.536 0 50 GFAA CCNC(=O)c1cc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)ccc1Cl 952989878 SUDOZSJTORCXBC-LBPRGKRZSA-N 377.872 2.819 0 50 GFAA O=C1O[C@H]2CN(Cc3ccccc3OC(F)F)C[C@H]2N1CCN1CCCCC1 1565529929 HMCWOIDHCAQAJM-AEFFLSMTSA-N 395.450 2.779 0 50 GFAA Cc1c(-c2cc(CN[C@@H](CO)c3ccc(Br)cc3)on2)cnn1C 274424258 FNMDLSHXMVVENT-KRWDZBQOSA-N 391.269 2.969 0 50 GFAA O=C(c1ccccc1-n1cnnn1)N1CCN(C2CC2)c2ccc(Cl)cc21 187353479 NMOBPGWJSOECSO-UHFFFAOYSA-N 380.839 2.945 0 50 GFAA CCCC[C@H](COC)NC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1 170609853 PQMBCJQLVWPZNK-OAHLLOKOSA-N 375.494 2.994 0 50 GFAA CN(C)C(=O)Cc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)cc1 193336528 CUXOPTFCPWKMAS-IBGZPJMESA-N 379.460 2.561 0 50 GFAA CCCC[C@H]1CN(S(=O)(=O)c2ccc3nc(O)oc3c2)C[C@@H](C2CC2)O1 1616080821 BBJZZVCPZKPOLP-GUYCJALGSA-N 380.466 2.892 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cc(CC(C)C)[nH]n2)cc1OC 1529174493 WOPOFWNTWKBUCG-NHCUHLMSSA-N 389.496 2.560 0 50 GFAA COc1ccc(CCC(=O)NC23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)cc1O 1772705331 RWDJRQAMKDSJNW-RGMRCXJASA-N 396.491 2.789 0 50 GFAA COC(=O)CCCC(=O)N(CC1CCN(C2CCCC2)CC1)C[C@H]1CCCO1 12020984 MGUPTVRBVXSOBH-HXUWFJFHSA-N 394.556 2.992 0 50 GFAA O=C(NCc1nc2ccccc2s1)c1ccc(CN2CCCCC2)[nH]c1=O 12159358 JBHJJDJCMJXMPP-UHFFFAOYSA-N 382.489 2.901 0 50 GFAA CN(Cc1ccccc1)Cc1cc(C(=O)NCc2cn3ccsc3n2)no1 12445233 QFZXRQUCNSHIFS-UHFFFAOYSA-N 381.461 2.946 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@@H]1CCCN(C2Cc3ccccc3C2)C1 12573928 BFDCBEPYPHGTBF-HXUWFJFHSA-N 380.536 2.718 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2cnsn2)C1)NCc1ccc(F)c(F)c1 12593181 AUBRUWCKICQHIP-LBPRGKRZSA-N 394.447 2.765 0 50 GFAA CN(CCCC1CCCC1)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1 12715981 JXINYCRLZNXPDT-FQEVSTJZSA-N 389.515 2.945 0 50 GFAA Cc1cc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2)no1 14356865 YVJVCUVQNMPSQB-UHFFFAOYSA-N 378.237 2.549 0 50 GFAA O=C1CCN(C(=O)c2ccc(-n3cccn3)cc2)CCN1Cc1ccccc1F 14955897 ZGNGEIYZEOJZTH-UHFFFAOYSA-N 392.434 2.886 0 50 GFAA C[C@H](Cn1cccn1)C(=O)NCc1cccnc1N1CCc2ccccc2C1 14956180 IPYQYGWGKNTBCJ-QGZVFWFLSA-N 375.476 2.793 0 50 GFAA O=C(NCC[C@H]1COc2ccccc2O1)c1ccc(NCC2CCOCC2)nc1 14959518 NRWAQPIVTXSYHW-SFHVURJKSA-N 397.475 2.880 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(CC2CCC2)CCO3)cc(C)n1 1857702401 LYLSXVUKEBOOGS-UHFFFAOYSA-N 385.508 2.722 0 50 GFAA Cc1nsnc1C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1857738168 URKJGEWNCQAAIS-UHFFFAOYSA-N 387.509 2.760 0 50 GFAA Cc1cc(C)c(CNC[C@@H]2CCn3ncc(C(=O)N4CCOCC4)c3C2)c(C)c1 328608591 ZXELVNSGJKBJQZ-LJQANCHMSA-N 396.535 2.633 0 50 GFAA O=S(=O)(c1ccccc1)n1c(I)cc2cccnc21 16678147 RWGDHZXCZZVWDC-UHFFFAOYSA-N 384.198 2.878 0 50 GFAA in-vitro O=C(c1cn(Cc2cccs2)nn1)N1CCNC[C@@H]1c1cccc(Cl)c1 262073994 SQUGJEKYDHABLB-QGZVFWFLSA-N 387.896 2.828 0 50 GFAA O=C1CCNc2ccc(C(=O)N3CC[C@@H](n4cc5ccccc5n4)C3)cc2N1 1875329416 VBWGHONDNMQBMW-MRXNPFEDSA-N 375.432 2.878 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccccc1-n1ccc(C2CC2)n1 1875403556 YMBIVCFVYCGXEK-NYSBEXSLSA-N 391.475 2.516 0 50 GFAA Cc1cccc(Br)c1C(=O)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875402266 DFTDAEASZHXYHG-NWANDNLSSA-N 378.270 2.524 0 50 GFAA Cc1nc(CN2CCC3(CCc4c(O)nc(-c5cccnc5)nc43)CC2)cn1C 2100482271 NGPXSVNHYKAJIX-UHFFFAOYSA-N 390.491 2.766 0 50 GFAA COc1ccc(C(=O)NC[C@H]2NCCc3sccc32)cc1-c1ccnn1C 2325810459 LRFTYSWKGXJWIT-MRXNPFEDSA-N 382.489 2.774 0 50 GFAA CCc1ccccc1NC(=O)CN(c1cc(OC)ccc1OC)S(C)(=O)=O 824542 XYESBSFVHOJUEB-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3ccc(=N)[nH]c3)C2)c2cccc(=O)n21 2356154911 PISGVVQQKPEUHU-AOIWGVFYSA-N 380.492 2.893 0 50 GFAA COc1ccc(OCC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 2859105 WSDCDSMXINNOKT-UHFFFAOYSA-N 392.477 2.790 0 50 GFAA Cc1cccc(CSCCNS(=O)(=O)c2ccc3c(c2)OCCO3)c1 4163116 JSYCEXVTPJVIQX-UHFFFAOYSA-N 379.503 2.978 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)ccc1NCc1cccnc1 103970433 ZNFUSHNZKCNOBJ-YXUGBTPSSA-N 389.411 2.703 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)N1CCO[C@H]([C@H]2CCCO2)C1 247279955 KGMBCNYVGZRICZ-NXHRZFHOSA-N 379.888 2.508 0 50 GFAA CC[C@]1(C2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)CC2)NC(=O)NC1=O 67856379 IBSILFYEJPHPSO-OAQYLSRUSA-N 380.448 2.522 0 50 GFAA COCc1ccc(NC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cc1 252495649 OUZHHTSTSAVJBY-UHFFFAOYSA-N 382.508 2.902 0 50 GFAA CCN(Cc1ccc2c(c1)OCO2)C(=O)CCc1nc(-c2ccccn2)no1 120806821 UTVMWQCDQOWAKC-UHFFFAOYSA-N 380.404 2.842 0 50 GFAA CCN(CCN1CCCCCC1)C(=O)C[C@@H](NC(C)=O)c1ccc(OC)cc1 253420060 KNPXUEXYCCVCOO-OAQYLSRUSA-N 389.540 2.987 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(NCc2ccc([S@](C)=O)cc2)n1 328621673 AQIRTEWAHVOWSL-GYERCMHNSA-N 388.537 3.442 0 50 GFAA CCn1c(C)cc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCCOC)C2)c1C 72463558 LOUAXBZTVLDCER-PKOBYXMFSA-N 375.513 2.614 0 50 GFAA CC1(C)CN(C(=O)NCc2ccnc(-n3cccn3)c2)C[C@@H](C(F)(F)F)O1 487813888 BWZKASIYYCRASH-ZDUSSCGKSA-N 383.374 2.519 0 50 GFAA Cn1c(=O)ccc2ccc(NC(=O)c3ccc(Cl)c(N4CCNC4=O)c3)cc21 488407440 FBLMOPBWKJMJCW-UHFFFAOYSA-N 396.834 2.974 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)c1cccc(N2CCOCC2)c1 219711464 DEFIYZPKVBGROS-UHFFFAOYSA-N 376.460 2.681 0 50 GFAA Cc1noc(C)c1C(C)(C)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnoc1C 333312412 VNPBFUNVPGJHKO-HOTGVXAUSA-N 378.448 2.594 0 50 GFAA Cc1c(C(=O)NC[C@H]2CCCNC2)nnn1-c1ccc(-c2ccccc2)cc1 237810972 WWBDRHBNZYIYMB-KRWDZBQOSA-N 375.476 2.972 0 50 GFAA COc1ccc(C(=O)Cn2nc(-c3ccccc3OC)ccc2=O)cc1OC 40285553 SZNXPJKBQYWTKP-UHFFFAOYSA-N 380.400 2.819 0 50 GFAA Cc1ccnn1CCCNC(=O)[C@]1(C)CC1(Br)Br 17077518 VOGJBXDDGOUASL-NSHDSACASA-N 379.096 2.594 0 50 GFAA CS(=O)(=O)c1cc2cc(Br)cc(Br)c2nc1N 20386741 ZCBCXJLWSFDGRZ-UHFFFAOYSA-N 380.061 2.746 0 50 GFAA O=C(NC[C@@H]1CC(=O)N(C2CCCC2)C1)c1cccc(-c2ncccc2O)c1 426491523 LGBSUAXLLFZDSG-HNNXBMFYSA-N 379.460 2.975 0 50 GFAA Nc1cccc(C(=O)N2CCC[C@@H](CCC(=O)NCc3ccccc3F)C2)n1 95510271 GNUVNWIMERJCEE-HNNXBMFYSA-N 384.455 2.752 0 50 GFAA COc1ccc(C)cc1NC(=O)N1CCN(c2ccnc(N3CCCC3)n2)CC1 91402283 MQSQIHKYWHMQSX-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(c2noc(-c3ccccc3)n2)CC1 96179639 OEFHEZWBVHAIKY-UHFFFAOYSA-N 381.484 2.794 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)Nc2cccn3nc(C)nc23)s1 97569042 DUIAFBPZCVQUHJ-CYBMUJFWSA-N 384.465 2.828 0 50 GFAA CC1(C)CCCC[C@H]1CC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1 178595848 QKXSCGWCRMVBEC-AWEZNQCLSA-N 380.501 2.974 0 50 GFAA CCNc1ccnc(N[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)n1 92045435 SJGIJCANEQKUFV-HNNXBMFYSA-N 383.500 2.661 0 50 GFAA O=C(NCCc1noc([C@@H]2CCCO2)n1)Nc1ccnn1Cc1ccccc1 95502809 IBRINRAGSZZBIJ-HNNXBMFYSA-N 382.424 2.530 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)NCCCSCc2ccc(F)cc2)CC1 97347078 WFOGYEPZVXPIOV-UHFFFAOYSA-N 381.517 2.959 0 50 GFAA O=C(Nc1cnn(CC(F)(F)F)c1)[C@@H](c1ccccc1)N1CCC(O)CC1 179506912 QAYHOBROUGVUSW-MRXNPFEDSA-N 382.386 2.582 0 50 GFAA CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@@H]1O[C@@H](n2cc(F)c(N)nc2=O)CS1 256168592 AUTCQXVTOIJYOT-RSUGUSAISA-N 399.488 2.557 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCc1nnc(C)n1C1CC1 184204590 VEQSUEUTRLRBOA-VIFPVBQESA-N 384.406 2.717 0 50 GFAA CC(=O)Nc1ccc(NC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)cc1 263618433 SYSMVXFBMWZRHD-SFHVURJKSA-N 395.394 2.899 0 50 GFAA O=C(Nc1ncn(C2CCCCC2)n1)N[C@H]1CCN(c2ccccc2F)C1=O 184603506 NFQYZRSGGWKDGP-HNNXBMFYSA-N 386.431 2.849 0 50 GFAA COc1cc(C)ccc1S(=O)(=O)N(Cc1ccccn1)C[C@@H]1CCCO1 952984298 ZORYAKJJHSNZMK-KRWDZBQOSA-N 376.478 2.769 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)N[C@@H](C)c1nncn1C 277013253 VWSPOAQXICTFOK-FNHZYXHNSA-N 394.479 2.573 0 50 GFAA Cc1cccnc1NC(=O)[C@@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 170597487 LZPJLKCYEQJYAO-OAHLLOKOSA-N 380.452 2.629 0 50 GFAA CC(C)(C)n1cc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)nn1 191472510 PFVUZMVHOXLJSC-HNNXBMFYSA-N 381.402 2.725 0 50 GFAA CC[C@H]1CN(C(=O)C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C[C@@H]1O 774489950 HWDICYJTWIHTSD-LIRRHRJNSA-N 391.487 2.762 0 50 GFAA Cc1nnc(CN2CCC[C@H](CNC(=O)Cc3c[nH]c4ccccc34)C2)s1 1506398121 VWYLPZZFPGGNNG-OAHLLOKOSA-N 383.521 2.899 0 50 GFAA Cc1[nH]ncc1CNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 139234304 NOXDTPMLPHYNQU-HNNXBMFYSA-N 381.263 2.946 0 50 GFAA Cc1[nH]nc(CCC(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)c1C 1704301291 TYJMCTDRRKSXBG-DYESRHJHSA-N 378.476 2.569 0 50 GFAA CCCO[C@H]1CCCN(c2ccc(C(=O)N(CC)Cc3nccn3C)cn2)C1 11664493 OAJSTALJQYMTLV-SFHVURJKSA-N 385.512 2.873 0 50 GFAA Cc1c[nH]c(C(=O)N2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)n1 12203409 PCNDRNMCWBAFQG-FQEVSTJZSA-N 388.418 2.651 0 50 GFAA COc1ccc(S(=O)(=O)Cc2nnnn2-c2ccc(Cl)c(Cl)c2)cc1 13625192 ZJDPWMRQBSJIHA-UHFFFAOYSA-N 399.259 2.952 0 50 GFAA CC[C@H](C(=O)NCc1ccncc1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712282 LPGKFPKPMNWGTA-MRXNPFEDSA-N 381.885 2.596 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C(=O)CSC)CC2)c1 15077363 NXRNBFCKVSYYLU-UHFFFAOYSA-N 392.521 2.664 0 50 GFAA COc1ccc(NC(=O)C2=C(C)Nc3nnnn3[C@@H]2c2ccccc2F)cc1 16577372 CIDZTJQBUXJMGX-QGZVFWFLSA-N 380.383 2.748 0 50 GFAA CCOc1ccccc1NC(=O)CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19928560 HDQPZUGMRQVJHP-UHFFFAOYSA-N 397.475 2.570 0 50 GFAA O=C(NCCSc1ccccn1)c1cc2c(s1)C1(CCNCC1)OCC2 1857685180 PRJIWWDTTYNOOM-UHFFFAOYSA-N 389.546 2.817 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857697641 GASKUZVOERUWOK-JOCHJYFZSA-N 393.491 2.782 0 50 GFAA CC(C)COc1cc(O)cc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](C(C)C)CN3C2)c1 1857724331 VSSCNHWZWSAWPK-FUHIMQAGSA-N 376.497 2.655 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CCN1Cc1ccccc1 225402151 PZYWCRGXMSPFJE-DJIMGWMZSA-N 397.441 2.709 0 50 GFAA Cc1nc([C@H](C)NC(=O)[C@@H](Cc2ccccc2)N2Cc3ccccc3C2=O)n[nH]1 908175525 MGEMSFDQMLYVMC-IFXJQAMLSA-N 389.459 2.558 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H]2CC[C@@H]([C@H]3CCCO3)O2)cc1Br 1875296717 LEDSGVAUCZSXLK-ILXRZTDVSA-N 398.253 2.901 0 50 GFAA CC1(CN)CCN(C(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)CC1 1875292739 RHUKRGFTEFVMMN-FQEVSTJZSA-N 379.504 2.615 0 50 GFAA COc1ccc(C2=NO[C@@H](CNC(=O)Cc3cnc4c(C)cccn34)C2)cc1F 1875272150 NSRHVPORKZYHJG-MRXNPFEDSA-N 396.422 2.642 0 50 GFAA O=C(N[C@@H]1c2ccccc2CC[C@@H]1N1CCCC1)c1cnc2sccn2c1=O 892266243 DSJJDRZGPKNLTB-ZWKOTPCHSA-N 394.500 2.638 0 50 GFAA CCc1c(-c2ccccc2)n(-c2ccccc2)c2nc3c(c(=O)n(C)c(=O)n3C)n12 719307 MOHQCMZLQCXHKD-UHFFFAOYSA-N 399.454 2.905 0 50 GFAA CCCc1ccc(OCCNC(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)cc1 2996909 YKFLROHZLVVTOV-OAHLLOKOSA-N 380.444 2.819 0 50 GFAA CCCc1ccc(OCCNC(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)cc1 2996910 YKFLROHZLVVTOV-HNNXBMFYSA-N 380.444 2.819 0 50 GFAA Nc1cncc(-c2ccc(C(=O)NCc3ccc(N4CCCC4=O)cc3)cc2)n1 2100545077 PDFWTBCVYYFQSU-UHFFFAOYSA-N 387.443 2.783 0 50 GFAA Cc1c(F)ccc2[nH]c(C(=O)NCC[C@@](O)(c3nccn3C)C(F)(F)F)cc12 2325769789 NUPZYYKCORONPG-QGZVFWFLSA-N 398.360 2.919 0 50 GFAA O=C(CCn1ccc2cc(Cl)ccc21)N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O 2325785740 LPGLSAPGZPLMHQ-POZUXBRTSA-N 386.883 2.837 0 50 GFAA CCn1cc(C(=O)N[C@]2(CNC(=O)CCC(C)(F)F)CCCC[C@@H]2C)nn1 2325794281 WTJYTLJWMSUZBJ-UGSOOPFHSA-N 385.459 2.528 0 50 GFAA O=C(C[C@@]1(O)C(=O)Nc2ccc(I)cc21)c1ccccc1 1140857 ROHVCHJIMUFWTF-INIZCTEOSA-N 393.180 2.704 0 50 GFAA O=C(COc1ccc(CN2CCc3ccccc3CC2)cc1)NC[C@H]1CCCO1 2356142236 JTTUYZRQEMBWPA-HSZRJFAPSA-N 394.515 2.961 0 50 GFAA O=C(c1ccc(F)cc1O)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356151018 MTKDDIHQHAMVLN-NRFANRHFSA-N 383.423 2.724 0 50 GFAA O=C(CCc1ccccc1)N[C@]1(C(F)(F)F)NC(c2ccccc2)=NC1=O 2872235 KVKRMMVFHDMNCU-SFHVURJKSA-N 375.350 2.571 0 50 GFAA CN1CCC[C@]2(CCCN2Cc2ccc(OCC(=O)NC(C)(C)C)cc2)C1=O 2356164649 BEIRDTNNSBYFNK-QFIPXVFZSA-N 387.524 2.567 0 50 GFAA COc1ccc(NC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1OC 6741946 IUEGGXRUIAFQGB-UHFFFAOYSA-N 385.420 2.820 0 50 GFAA Cc1noc(CCNC(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)n1 112449941 PLWAXFFRBFWILW-HNNXBMFYSA-N 382.424 2.907 0 50 GFAA C[C@H](c1nc(-c2ccccc2)no1)N1CCC(CC(=O)N2CCN(C)CC2)CC1 114721728 RSQIEEWYISDVAA-QGZVFWFLSA-N 397.523 2.674 0 50 GFAA CN(C[C@@H]1COCCO1)C(=O)c1coc(COc2ccc(F)cc2Cl)n1 67724995 JCJMARHLINCJJA-GFCCVEGCSA-N 384.791 2.534 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCC[C@@H](c3cc(=O)[nH]cn3)C2)cc1)C1CCC1 65376340 SYDBXDZDLIHRDY-MRXNPFEDSA-N 380.448 2.528 0 50 GFAA CC(C)S(=O)(=O)N1CCN(C(=O)CC2(Cn3cccc3)CCCCC2)CC1 409413545 ITVFVFMKENWNMJ-UHFFFAOYSA-N 395.569 2.711 0 50 GFAA CC[C@@H]1C[C@@H](C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)CCO1 328616398 BPBDHUYLOZFACW-RAUXBKROSA-N 376.545 2.857 0 50 GFAA O=C(N[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1cc(-c2ccccc2)no1 72145005 VMVZHUCKXLZOBE-GOSISDBHSA-N 375.428 2.915 0 50 GFAA CCOc1ccc(CN2CCNC(=O)[C@H]2CC(=O)NC2CCCCCC2)cc1 12717197 LUJYZPMMUPIBNN-HXUWFJFHSA-N 387.524 2.615 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71776832 OUULMRKIDNZXMR-IBGZPJMESA-N 382.508 2.667 0 50 GFAA C[C@H](C(=O)N1CCNC[C@H]1c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1 262101043 VBKZKBNQHAPKHS-KDOFPFPSSA-N 396.882 2.728 0 50 GFAA Cn1ncc2c(NCCc3nc(-c4cccnc4)n[nH]3)nc(C3CCCC3)nc21 72153163 URQIMZYJXZXQPX-UHFFFAOYSA-N 389.467 2.856 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CC[C@@H]4[C@@H](CCC(=O)N4C4CC4)C3)cc2)o1 129710421 SAKOBCFYXBWQKF-FUHWJXTLSA-N 380.448 2.661 0 50 GFAA C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2ccc(C(N)=O)cc2)CC1 171722713 NXYCPEYKFBMZBJ-ZDUSSCGKSA-N 388.418 2.974 0 50 GFAA CCCC(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)c1nc(-c2cccc(OC)c2)no1 174656537 AJVBFVUFRKQBTH-XJKSGUPXSA-N 386.452 2.714 0 50 GFAA CN(C)[C@@H]1CCCN(C(=O)NCc2nc3cc(C(F)(F)F)ccc3n2C)C1 426541203 DTTWDPRAUPTVQC-CYBMUJFWSA-N 383.418 2.828 0 50 GFAA C[C@@H](NC(=O)Nc1cnc2sccn2c1=O)c1nc2c(s1)CCCC2 426374421 SPOQUPYPLMZKSW-SECBINFHSA-N 375.479 2.974 0 50 GFAA O=C1CC[C@]2(CCCN(c3cnc4ccccc4n3)C2)CN1CCc1c[nH]cn1 91745745 WZHHREAUHKRMPC-QFIPXVFZSA-N 390.491 2.805 0 50 GFAA O=C(c1ccnc2ccccc12)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccn1)C2=O 91713642 QTHYHFFZTPNACQ-FUHWJXTLSA-N 386.455 2.893 0 50 GFAA CSc1ncc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2ccccc2)C3)cn1 95517668 ZICFXAVMPBAARJ-UHFFFAOYSA-N 396.516 2.853 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 290717318 RQFIHZZRQQFXPX-GFCCVEGCSA-N 380.330 2.813 0 50 GFAA O=C(/C=C/c1cccs1)N[C@H]1CC[C@@H](n2cc(C(=O)NC3CC3)nn2)CC1 252448866 FPAMHXQLJIVAGM-XDKHPFTOSA-N 385.493 2.545 0 50 GFAA CC(C)(Oc1ccc(F)cc1)C(=O)N1CCC(c2ccnn2CCO)CC1 181914698 HRKSNAFAPHRAAE-UHFFFAOYSA-N 375.444 2.578 0 50 GFAA O=C(NCCN1CCOCC1)Nc1ccc(SCCc2ccccn2)cc1 299801148 VAQVTRRCGKIUBV-UHFFFAOYSA-N 386.521 2.870 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccccc1OC[C@H]1CCCO1 827861558 RCKGMRWGLJMOKP-OAHLLOKOSA-N 379.416 2.593 0 50 GFAA Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)N1CCC[C@H](Cc2nccn2C)C1 1340542095 VJQVFPCDUAPJGF-QGZVFWFLSA-N 394.523 2.651 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)Cc3cc(Cl)ccc3F)CCO2)cn1 189231192 PVOCZBKROHYVPF-INIZCTEOSA-N 387.864 2.599 0 50 GFAA Cc1ccn(CC(=O)Nc2ccc(NC(=O)CN3CCCCCC3)cc2)c(=O)c1 194453977 RYOBVFHCDQPWGX-UHFFFAOYSA-N 396.491 2.610 0 50 GFAA COc1cc(C(=O)N(Cc2ccncc2)C[C@@H]2CCC(=O)N2)nc2ccccc12 1506402672 ZWGQBEOTRKRWSK-INIZCTEOSA-N 390.443 2.559 0 50 GFAA COCc1cc(C)nc2sc(C(=O)NC(=N)c3ccc4c(c3)OCO4)c(N)c12 1848444089 JIMLJUFKCIIAET-UHFFFAOYSA-N 398.444 2.817 0 50 GFAA Cc1cccc(CN2C[C@H]3CN(C/C=C/c4ccc(F)cc4)C[C@]3(CO)C2)n1 1772815913 COVCMUDJCZLBFC-MIXLYOPUSA-N 381.495 2.969 0 50 GFAA COC(=O)c1ccc(-c2nc(CN(C[C@H]3CCC(=O)N3)C(C)C)c(C)o2)cc1 12439925 SEDLFLZTZAXWDH-QGZVFWFLSA-N 385.464 2.926 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)c1 13009122 LKXUZGTWCFQJOG-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA COc1ccc(-c2nc3c4c(C)c(C)n(CCN(C)C)c4ncn3n2)cc1OC 13629498 ZHZWNDDUTCPNJU-UHFFFAOYSA-N 394.479 2.942 0 50 GFAA O=C(NC1(c2ccccc2)CC1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 14978309 JHLYKAQJAFCLFS-LJQANCHMSA-N 395.547 2.905 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC(n2cc(-c3ccsc3)nn2)CC1 19794487 NPIDHAXBPCZASK-UHFFFAOYSA-N 379.449 2.755 0 50 GFAA Cc1ccc(Cn2c(C3CCN(C(=O)Cc4cccs4)CC3)n[nH]c2=O)cc1 169770157 PPFVFVOERSSRNZ-UHFFFAOYSA-N 396.516 2.938 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3c[nH]nc3-c3ccccc3)C[C@]23CC[C@H]1O3 1857717438 SEGNZYHTLUAOLT-JZJXAQOMSA-N 380.492 2.582 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)N1CCC(c2cc[nH]n2)CC1 1857729549 DOXGEZOKACNNMO-OAHLLOKOSA-N 394.479 2.959 0 50 GFAA O=C(c1cccn2cnnc12)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1875247994 SRBARESHSUZSPS-IEBWSBKVSA-N 392.459 2.617 0 50 GFAA O=S(=O)(N[C@@H]1CCCN(c2ccccc2F)C1)c1cccc2c1OCCO2 134947383 QJAVXASZCDRNLL-CQSZACIVSA-N 392.452 2.544 0 50 GFAA O=C(NCCc1sccc1Br)c1ncoc1[C@@H]1[C@H]2CN[C@H]1C2 1875393056 FBFDBHMAHRDJSP-UBHAPETDSA-N 382.283 2.546 0 50 GFAA CC12COC(C(=O)Nc3ccc4c(c3)CC[C@@H]4NC(=O)C34CC(C)(CO3)C4)(C1)C2 1875392673 NLEMOWXUJRTVCO-AOIXWNMRSA-N 396.487 2.867 0 50 GFAA Cc1cn(Cc2ccccc2)[nH]c1=NC(=O)N1CC[C@@](N)(c2ccccc2)C1 2325773133 WDAKGICTPSVBRS-QFIPXVFZSA-N 375.476 2.754 0 50 GFAA Cc1c(CN)c(=NC(=O)[C@H](C)Sc2ccnc3cc(Cl)ccc23)[nH]n1C 2325795153 KBFXBYIKZQDFGE-NSHDSACASA-N 389.912 2.930 0 50 GFAA Cn1nc(CN(c2ccccc2Br)S(C)(=O)=O)cc1Cl 863455765 VLOVVXFRALWMNJ-UHFFFAOYSA-N 378.679 2.802 0 50 GFAA O=C(Nc1sccc1C(=O)N1CCOCC1)c1cc2ccccc2oc1=O 1056282 OKGJAISTWMBFCQ-UHFFFAOYSA-N 384.413 2.579 0 50 GFAA O=C(O)c1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 1165214 VCRMJERRCBZZNP-UHFFFAOYSA-N 388.445 2.812 0 50 GFAA O=C(Nc1nccs1)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O 1774476 CTGMTADATDZJNG-MRXNPFEDSA-N 377.425 2.989 0 50 GFAA COc1ccc(OCc2nnc(SCC(=O)NCc3ccccc3)n2C)cc1 2859447 OHZYBIYWASUTER-UHFFFAOYSA-N 398.488 2.811 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccc(F)cc2)CC1 3330435 YVOPBDOVSMCRNR-UHFFFAOYSA-N 384.407 2.723 0 50 GFAA C[C@@H](NC(=O)CCNC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763910 DLQJHZNPQZUTHH-MRXNPFEDSA-N 384.432 2.551 0 50 GFAA O=C(c1cnc(N2CCCC2)nc1)N1CCN(C/C=C/c2ccccc2)CC1 102536770 YZLYWKWZSMKQHV-RMKNXTFCSA-N 377.492 2.548 0 50 GFAA Cc1cccc(-c2ccc(C(=O)N3CCC(Cn4cc(CN)nn4)CC3)o2)c1 23429862 ARKKNUSYPKFYHJ-UHFFFAOYSA-N 379.464 2.858 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)NC[C@H](c2cccnc2)N2CCCC2)cc1 55387334 YOMJFZYCAFJZPB-HXUWFJFHSA-N 396.491 2.762 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)CC1 245900177 DNZJZDTTXLMGHV-HKUYNNGSSA-N 386.540 2.790 0 50 GFAA COc1ccc(N2C[C@H](C(=O)Nc3ccc4[nH]cnc4c3)CC2=O)c(OC)c1 170625401 GUUOIHJUSNIHQE-GFCCVEGCSA-N 380.404 2.572 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccccc3Cl)CC2)C1 67541803 MKNPVZPAAGMLNE-GOSISDBHSA-N 393.959 2.779 0 50 GFAA CC[C@H]1CN(c2ccc(C(=O)NCCCc3ccc(OC)cc3)cn2)CCN1 67934212 LMTADYUARGIWPQ-IBGZPJMESA-N 382.508 2.641 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3nc4c(s3)CCC4)n2)cc1 61719598 MSNZARMRKAZRSC-UHFFFAOYSA-N 382.445 2.503 0 50 GFAA O=C1c2ccccc2N[C@H](c2ccccn2)N1NS(=O)(=O)c1ccccc1 1421361 NQMNTDNUBVEXTO-SFHVURJKSA-N 380.429 2.542 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@@H]1CCCN(C(=O)c2ccncc2)C1 12308342 SGBXCAXBQDSSML-SFHVURJKSA-N 380.492 2.810 0 50 GFAA Cc1cc(C)c(NC(=O)C[C@@H]2COc3ccc(C(=O)N(C)C)cc3N2C)c(C)n1 71746777 TYLSXZJGMPWVTI-QGZVFWFLSA-N 396.491 2.935 0 50 GFAA CCOCCCN1CC[C@H](N2C(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C2=O)[C@@H](C)C1 230237683 BLOVERYUVJTGPE-VMXHOPILSA-N 377.529 2.719 0 50 GFAA O=C(N1C[C@H]2CCC[C@@]2(c2nc(Cc3ccccc3)no2)C1)C1(O)CCCC1 328605926 PUNADIBBJKHVTB-DYESRHJHSA-N 381.476 2.846 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)[C@@H]3CSCCS3)CC2)cn1 328633734 MGBQDXDFERSSGN-HOCLYGCPSA-N 380.583 2.789 0 50 GFAA Cn1cc(C[C@H]2CCN(C(=O)NCc3cccc(CN4CCCC4)c3)C2)cn1 363585815 DZFGUBQTDIUPAP-HXUWFJFHSA-N 381.524 2.790 0 50 GFAA CCN(Cc1ccccn1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71763418 DAVXDOMVGCJVIJ-LJQANCHMSA-N 398.551 2.543 0 50 GFAA CC(C)c1ccc(CN2CCC[C@]3(CCN(S(=O)(=O)N(C)C)C3)C2)cc1 72157078 OEWSNLRMGPKEBR-FQEVSTJZSA-N 379.570 2.904 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)cc1 72115768 DZYYBIWPHVIGIR-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA Cc1cccc(OC[C@@H](O)CN2CCc3c(cccc3N3CCOC3=O)C2)c1 174057433 XMHZSCWUHLNECR-SFHVURJKSA-N 382.460 2.750 0 50 GFAA O=C(Cn1nccc1[C@H]1CCCNC1)NCc1nc(-c2ccccc2)cs1 426430569 BNDZKKUNPXEHPS-INIZCTEOSA-N 381.505 2.790 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)ccc1F 175559272 XTHMCNVTCNEHBR-IBGZPJMESA-N 397.450 2.700 0 50 GFAA Cc1ccccc1N(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)C(=O)c1ccco1 239159689 MPQSEDUZOHGAHD-ILRDRHFLSA-N 376.412 2.999 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCN(Cc3csc(C)n3)CC2)c(C)c1 95359698 HWDIUSBJIRWAAD-SFHVURJKSA-N 375.494 2.712 0 50 GFAA CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccccc2Oc2cccnc2)C1 95504627 TXFKOHRHNJMCAJ-OAHLLOKOSA-N 389.477 2.874 0 50 GFAA CCOc1nc(C)ccc1C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1 239761717 CKFPUAFAYDYENL-LBPRGKRZSA-N 380.441 2.822 0 50 GFAA O=C(c1cncs1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95499447 LUMCLISISFIHOP-GDIGMMSISA-N 383.473 2.574 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCN(Cc3csc(C)n3)CC2)cc1C 95369092 CNKPXACAUSPDOR-SFHVURJKSA-N 375.494 2.712 0 50 GFAA Nc1ncccc1CN1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91586398 BITRKLVPODWBHT-QFIPXVFZSA-N 379.508 2.506 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2Cc3cnc(CC(C)C)nc3C2)c1 97698665 LGLLUOBREBKVFI-UHFFFAOYSA-N 383.452 2.591 0 50 GFAA CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@H](OCCO)C1 178310180 JYRVDYRITNMWII-ZDUSSCGKSA-N 375.391 2.777 0 50 GFAA O=C1CC2(CCN(C(=O)C3(Cn4cccn4)CC3)CC2)CN1Cc1ccccc1 95523702 FYTZTWALIKWFTH-UHFFFAOYSA-N 392.503 2.705 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1CCC(c2ncc[nH]2)CC1 95502332 JTZPLWVQABFJIH-UHFFFAOYSA-N 384.465 2.743 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 92065801 DJNVNFAOUBBEEI-UHFFFAOYSA-N 382.464 2.731 0 50 GFAA CN(Cc1nc2ncccn2n1)C[C@@H]1CCCN(CCc2ccccc2F)C1 95523471 NCQNYNJNUWCELB-KRWDZBQOSA-N 382.487 2.650 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)Cc2cn(C)c3ccccc23)CC1 95531146 FEHUGPXIMHXBMS-UHFFFAOYSA-N 380.492 2.970 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)on1 91526883 PBTWFEDKXYUWGX-MAUKXSAKSA-N 382.464 2.645 0 50 GFAA CSCC[C@@H](O)C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1 294983006 NYXYBFPDKHAGJB-QGZVFWFLSA-N 395.502 2.935 0 50 GFAA COC(=O)c1ccc(Cl)c(NC(=O)Cn2cnc3ccccc3c2=O)c1C 184158223 WOUCMSSYIWKSOA-UHFFFAOYSA-N 385.807 2.784 0 50 GFAA COc1cc(C(=O)N2CCC[C@H](C(=O)O)C2)ccc1OCc1c(C)noc1C 299741587 GPQZYLKTWKHDIN-HNNXBMFYSA-N 388.420 2.816 0 50 GFAA COc1ccccc1N1CCN(CCN2C(=O)CC3(CCCC3)CC2=O)CC1 53064442 AYYCFGDXLUPJAQ-UHFFFAOYSA-N 385.508 2.527 0 50 GFAA biogenic,in-vivo Cc1nnc(SCC(=O)NCc2nc(-c3ccccc3Cl)no2)s1 827847620 AXJRWWPYNINDQC-UHFFFAOYSA-N 381.870 2.958 0 50 GFAA COc1cccc2c1OC[C@H](NCc1ccc(OCC(=O)N3CCCC3)cc1)C2 952969562 JCIOGWMCLMSTPB-LJQANCHMSA-N 396.487 2.790 0 50 GFAA C[C@H](C(=O)Nc1ccc(NC(=O)CCc2ccccc2)cc1)N1CCN(C)CC1 952873650 YEIWDHPZSUUWMQ-GOSISDBHSA-N 394.519 2.832 0 50 GFAA COc1cc2c(cc1CN[C@@H]1CCCN(C(=O)c3ccco3)C1)OCCCO2 952983817 RNNXPYPOVLKNRV-MRXNPFEDSA-N 386.448 2.844 0 50 GFAA CCS(=O)(=O)C1CCN([C@@H](C(=O)N2CCCCC2)c2ccccc2)CC1 193243857 ULNJSWFMQHSSKI-LJQANCHMSA-N 378.538 2.639 0 50 GFAA Cc1ccccc1OC[C@H](O)C(=O)N(C)CCc1nc2ccc(Cl)cc2[nH]1 1506397347 BROSDWKRDBWMQM-KRWDZBQOSA-N 387.867 2.966 0 50 GFAA O=C(c1cncc(N2CCC3(CC2)OCCc2ccsc23)n1)N1CCCC1 1704305718 NFINYBKTJHAMFG-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA CNC(=O)c1cccnc1N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704315350 AJCZOIATQHDWAZ-UHFFFAOYSA-N 376.460 2.991 0 50 GFAA COc1cc(OC)c(C(=O)N2CCC(Cc3ccc(O)nc3)CC2)cc1OC 1772817407 OBYIDVIXUGQYIS-UHFFFAOYSA-N 386.448 2.908 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cncnc4)C[C@H]2CN(Cc2ncc[nH]2)C3)cc1 1772809343 TYDRSXCGVHOULL-JTHBVZDNSA-N 388.519 2.767 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)NCCN4CCCC4=O)cc3o2)c1 11708209 HOTHIMFMZMFMTE-UHFFFAOYSA-N 379.416 2.856 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CCn1cncn1 11843568 OADUESSKJLBWDQ-GOSISDBHSA-N 389.931 2.735 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC(CCC(=O)N(C)Cc2ccccc2)CC1 12192493 KPBYMDFSEQBOSN-NRFANRHFSA-N 399.535 2.675 0 50 GFAA CCCn1cc(C(=O)N[C@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)c(C)n1 12438942 SPKBQYRUYAOFER-KRWDZBQOSA-N 388.899 2.828 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2cn(Cc3ccc(F)cc3Cl)nn2)C1 12575513 AOEGQEHEUBCBIC-ZDUSSCGKSA-N 394.834 2.534 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2F)CCCN(C(=O)c2cc(C)nn2C)C1 12755950 QLZNHJCMKVIBLQ-OAQYLSRUSA-N 387.455 2.896 0 50 GFAA COc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NC[C@H]2CCCO2)cc1 5483980 FHQITKDTJFHFCK-YFQSIASUSA-N 380.444 2.761 0 50 GFAA O=C1CCc2c1cccc2C(=O)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857674739 WLIOGFJMHRVHBC-HSZRJFAPSA-N 390.439 2.705 0 50 GFAA O=C(c1ccc[nH]1)N1CCOC[C@@H](CN2CCC3(CC2)CNc2ccccc23)C1 1857710909 ALKMVVWLBYDADU-SFHVURJKSA-N 394.519 2.563 0 50 GFAA CN(CC(=O)NC[C@H]1[C@H]2CN(CC(C)(C)C)C[C@]23CC[C@H]1O3)C1CCCC1 1857728326 WZWLQQUHXHEEDN-JZJXAQOMSA-N 377.573 2.503 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CC(N5CCCC[C@@H]5C)C4)CC3)nc2n1 1857729999 MDQGXTWTSPBACK-INIZCTEOSA-N 397.523 2.833 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCC(C)(C)O)C3)nc2c1 1857732638 YXNGOSQDJXBZJL-CQSZACIVSA-N 375.469 2.720 0 50 GFAA COc1cccc(CC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857741449 SZXOVLSFCAQNKZ-VIZSFHNOSA-N 392.455 2.539 0 50 GFAA CC(C)CCCC(=O)NC[C@H]1[C@H]2CN(c3cc(CO)ccn3)C[C@]23CC[C@H]1O3 1875250339 PXRVUMUEJJLBQG-JZJXAQOMSA-N 387.524 2.500 0 50 GFAA C[C@@H](CCC(=O)O)NC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 237519459 YOGPDOJTFVMEGR-IINYFYTJSA-N 387.263 2.968 0 50 GFAA CCc1ccc([C@H]2CNCCN2C(=O)c2nc(-c3cnn(C)c3)oc2C)cc1 261681336 IKLXASYZFHHUDM-GOSISDBHSA-N 379.464 2.733 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCO[C@@H](c2ccc(Br)cc2)C1 371467402 YVACOKMTMNVXSM-OAHLLOKOSA-N 387.237 2.934 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704297811 CSSOKLOKPQSJMU-JOCHJYFZSA-N 389.459 2.884 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(CCC(=O)NC3CCCCC3)C1)CC2 1704300918 ZKVSPKYHBXUYCP-QFIPXVFZSA-N 385.556 2.661 0 50 GFAA O=C(c1ccc(-c2ccc3c(c2)OCCO3)s1)N1CCC[C@H]1c1nn[nH]n1 816272746 SMVIBTNGXJBHFI-LBPRGKRZSA-N 383.433 2.677 0 50 GFAA O=C1C[C@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1c1ccc(F)cc1 712812 RHOMTYKCHCJYAE-SFHVURJKSA-N 387.842 2.933 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccc(Cl)cc4)CC3)C2=O)cc1 18116560 VRAPZTFJWHSKHS-LJQANCHMSA-N 399.878 2.803 0 50 GFAA O=C(C[C@H]1C(=O)Nc2ccc(Cl)cc21)NC1(C(=O)NCC2CC2)CCCC1 2325798294 HBXGGUPADDNPOM-OAHLLOKOSA-N 389.883 2.721 0 50 GFAA O=C([C@H]1CCC[C@H](CC(F)(F)F)C1)N(CCc1nn[nH]n1)Cc1cccnc1 2325808222 GKIDLLFPAPUTRI-ZFWWWQNUSA-N 396.417 2.925 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)Nc3ccccc3N=S(C)(C)=O)cn21 886406157 NVGWILPFFGYLHU-GFCCVEGCSA-N 382.511 2.940 0 50 GFAA O=C(Nc1nncs1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 806137 QGLCIVJOVPTWAL-UHFFFAOYSA-N 386.886 2.618 0 50 GFAA CNC(=O)CN(c1ccc(Br)cc1)S(=O)(=O)c1ccc(C)cc1 821403 XSCNGZZHQWXNKI-UHFFFAOYSA-N 397.294 2.699 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)NCc2ccccn2)cc1 839778 QTRRXQRLWMDTDC-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA COC(=O)c1ccc(NC(=S)NC(=O)c2cncc(Br)c2)cc1 977588 QEJQSAWAOLFIKM-UHFFFAOYSA-N 394.250 2.758 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(c1ccccc1OC)S(C)(=O)=O 1143374 HOGYCHNRDHLTBB-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CN(C)C[C@@]1(CO)CCCN(c2noc(-c3ccc(Cl)cc3)c2C(=O)O)C1 2356135845 VSWVAYAMJYPQPX-IBGZPJMESA-N 393.871 2.834 0 50 GFAA CCOC(=O)C1CCN(C(=S)Nc2cc(OC)c(OC)c(OC)c2)CC1 4852331 GGQBBFYQEUGAHS-UHFFFAOYSA-N 382.482 2.684 0 50 GFAA COC(=O)c1cccc(NC(=O)CSc2nc(Cc3ccccc3)n[nH]2)c1 6580186 RNRYZMQRNWHLFR-UHFFFAOYSA-N 382.445 2.913 0 50 GFAA O=C1NCCN1CCNCc1cn(CCOc2ccccc2F)c2ccccc12 55403541 PBOCRLCJAZNHOD-UHFFFAOYSA-N 396.466 2.974 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2C(=O)Cc2ccc(C(F)(F)F)cc2)O1 225761903 GPFKJJXEHUOTTM-MPESAESLSA-N 385.382 2.958 0 50 GFAA O=C(NCC1CC1)[C@@H]1CCCN([C@H]2CCN(c3cccc(Cl)c3)C2=O)C1 246098174 ANVMYRSXBRZAMK-QAPCUYQASA-N 375.900 2.684 0 50 GFAA C[C@H]1[C@H](C)CCC[C@H]1N(CC(=O)N1CCOCC1)Cc1ccc2c(c1)OCO2 248147890 IFFDLLDLBFSSBX-ZIFCJYIRSA-N 388.508 2.901 0 50 GFAA COc1ccc(CC2(CO)CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cc1 67723826 TVMZTOZXVKDUHS-UHFFFAOYSA-N 383.444 2.881 0 50 GFAA CCOc1ccc(N(CC(=O)NCc2ccc(Cl)cc2)S(C)(=O)=O)cc1 1206341 ZOLLCFKFUVGSGY-UHFFFAOYSA-N 396.896 2.821 0 50 GFAA COc1ccc([C@H](CO)N(C)C[C@@]23C[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1 253426021 XMBYMXNNXLCEBH-DJPFJPOOSA-N 376.497 2.917 0 50 GFAA CCCn1nc(C)c(CNC[C@@H]2CC(=O)N(C)[C@H]2c2c(C)nn(C)c2C)c1C 328635179 UQHALDKCZTXYEX-LAUBAEHRSA-N 386.544 2.569 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C(=O)N1CCCC[C@H]1C 363658533 CAONSSPEGISJCD-ZIFCJYIRSA-N 385.508 2.587 0 50 GFAA Cc1noc(C2CCN(C(=O)c3nnn(-c4ccccc4Cl)c3C)CC2)n1 363623361 KZBICXLPCPRGRN-UHFFFAOYSA-N 386.843 2.940 0 50 GFAA NC(=O)c1cc2c(nc1O)CCC[C@@H]2NC(=O)c1cc2ccc(Cl)cc2[nH]1 364046039 WOTXRPILCAAFLO-AWEZNQCLSA-N 384.823 2.828 0 50 GFAA C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H]1CCC(=O)N[C@@H]1C1CC1 367069260 UQGPCAXSPITCRU-YXKFXFPPSA-N 377.916 2.724 0 50 GFAA O=C(c1c[nH]nc1-c1cccs1)N1CCN(CCOc2ccccc2)CC1 77320819 ZXVJHIIPOCGUCF-UHFFFAOYSA-N 382.489 2.975 0 50 GFAA C[C@@H]1C[C@H]1c1nnc2ccc(N3CCC(NC(=O)NC4CCCCC4)CC3)nn12 333620537 YIHNCMIIWIYUTM-RHSMWYFYSA-N 397.527 2.848 0 50 GFAA Cn1ccnc1CCNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 128819063 YALGGCCJJZXSLM-UHFFFAOYSA-N 382.395 2.649 0 50 GFAA NC(=O)COc1cccc([C@H]2CC(=O)Nc3c2ncn3-c2ccc(Cl)cc2)c1 40283834 ITWVUGJNPOEXMG-MRXNPFEDSA-N 396.834 2.864 0 50 GFAA O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1nccc2ccccc12 132900214 KFPKCPHYSANNSX-UHFFFAOYSA-N 381.457 2.722 0 50 GFAA CSCC[C@H](C(=O)NCc1ccc(F)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 242106231 WIADFFISKPHHTK-BRWVUGGUSA-N 392.496 2.739 0 50 GFAA CCN(C[C@H]1COc2ccccc2O1)C(=O)c1cc(Cn2cc(C)cn2)on1 132485973 UAUYDZQVOPDVOR-INIZCTEOSA-N 382.420 2.530 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CCCn2nc([C@H](O)CO)cc2C1 220352277 NBQCKXWJRULJDR-OAQYLSRUSA-N 377.444 2.622 0 50 GFAA O=C(NC1CCN(c2ccccc2)CC1)N1CCC(N2CCSCC2)CC1 426360159 XHDCNQMYWIJCLJ-UHFFFAOYSA-N 388.581 2.878 0 50 GFAA COc1cccc(-c2noc(CCCC(=O)NCc3ncc(Cl)cn3)n2)c1 426552091 RVOKPMYGIHBVJI-UHFFFAOYSA-N 387.827 2.828 0 50 GFAA COc1ccccc1C(=O)N1CCN(Cc2cnc(-c3ccccn3)nc2)CC1 223304482 LHTFSCCLNXVQNQ-UHFFFAOYSA-N 389.459 2.505 0 50 GFAA CN(CC[C@@H](O)c1ccccc1)C(=O)NCC1(N2CCOCC2)CCCCC1 426359555 DBUNBLLRXXSXCG-HXUWFJFHSA-N 389.540 2.787 0 50 GFAA CCn1c(=O)n(CC)c2cc(NC(=O)N[C@H](C)CCn3cccn3)c(C)cc21 96138057 KTXOBGPLEXFWIQ-OAHLLOKOSA-N 384.484 2.948 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ncn(Cc2cccc(C)c2)n1 20606542 VOTDYYFAUFCALZ-SFHVURJKSA-N 380.404 2.933 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 95521519 JXEJZRSZVZLIEW-UHFFFAOYSA-N 384.871 2.733 0 50 GFAA CCOc1ccccc1CN1CCC[C@H](c2nnc(Cn3ccnc3)n2C)C1 95370440 DWZAYABGMAZJHT-SFHVURJKSA-N 380.496 2.838 0 50 GFAA COCc1nc(N(C)Cc2cc(-c3cccnc3)no2)cc([C@H]2C[C@H](N)C2)n1 244873605 WSVLRMMLYWJUPS-SHTZXODSSA-N 380.452 2.514 0 50 GFAA CCOc1cc(NC2CCN(C(=O)c3cccnc3N3CCCC3)CC2)ncn1 183965806 HYQKBEMGRPCUCF-UHFFFAOYSA-N 396.495 2.587 0 50 GFAA CN(Cc1ccc2nonc2c1)C(=O)CCSc1nnc(-c2ccncc2)o1 827884266 UEMORUHPMIKAAU-UHFFFAOYSA-N 396.432 2.809 0 50 GFAA O=C(NCCCc1nc2ccc(F)cc2[nH]1)c1ccccc1N1CCOCC1 826608018 CIILGTPAECSFOK-UHFFFAOYSA-N 382.439 2.901 0 50 GFAA O=C(O)C1CCN(C(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)CC1 269117830 GGLVIZVJKGWMAX-UHFFFAOYSA-N 387.457 2.597 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CCC(C(=O)C(F)(F)F)CC1 274709869 KWGYKOREKGCJFC-MRXNPFEDSA-N 396.409 2.590 0 50 GFAA O=C(CCn1[nH]c(=O)c2ccccc2c1=O)N(Cc1c(F)cccc1F)C1CC1 190017474 VVZPERHKJHMVPL-UHFFFAOYSA-N 399.397 2.549 0 50 GFAA Cc1nccn1CCCN(C)C(=O)[C@H]1Cc2cc(Br)ccc2O1 194506829 BQZPVLCJGNJVLX-MRXNPFEDSA-N 378.270 2.806 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)Nc2cc(C3CC3)nn2-c2ncccn2)cc1 731169705 HTVSEOKQQIZHJT-UHFFFAOYSA-N 388.431 2.594 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N2CCC[C@@](C)(O)C2)cc1 1704333704 FCTHQIBCQYIJKV-OAQYLSRUSA-N 385.464 2.937 0 50 GFAA COc1cc(CN2CCCN(C(=O)CCc3cccnc3)CC2)cc(OC)c1 1772709341 FVMQRCPJVRMPEV-UHFFFAOYSA-N 383.492 2.766 0 50 GFAA CN(c1ccc(C(=O)N[C@H]2CCCC[C@@H]2O)cc1)S(=O)(=O)c1ccccc1 5509937 BSXBHHRLIYNZHV-OALUTQOASA-N 388.489 2.545 0 50 GFAA CC(=O)NCCC(=O)N1CCC[C@@H](C(=O)c2ccc3c4c(cccc24)CC3)C1 12052891 IIYCRQACAWFTBP-GOSISDBHSA-N 378.472 2.886 0 50 GFAA CC[C@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCCOC(C)C)c1=O 12150041 ODOALPAQVKTXKG-HNNXBMFYSA-N 391.512 2.647 0 50 GFAA Cc1cc(=O)n2nc(N3CCC[C@@H](C(=O)N[C@H](C)c4ccccc4)C3)sc2n1 13110882 FJKVGYLFYFQGGM-GDBMZVCRSA-N 397.504 2.553 0 50 GFAA COc1ccc(CNCc2csc(C)n2)cc1OC[C@@H](O)CN(C)C(C)C 14952740 FLILZPFIFMLGAX-SFHVURJKSA-N 393.553 2.830 0 50 GFAA CC(C)N1CC[C@H](CN(C)C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)C1 15074193 QJSXWBPMMXCASH-MRXNPFEDSA-N 380.496 2.610 0 50 GFAA COc1cccc(C[C@]2(CO)CCCN(S(=O)(=O)Cc3ccccc3)C2)c1 19535861 UPPZKWAOFVAJPD-OAQYLSRUSA-N 389.517 2.842 0 50 GFAA COc1ccc(C2=NO[C@H](C(=O)N3CCN(Cc4ccccc4)CC3)C2)cc1 19894423 UVHMIXHJBBABEH-NRFANRHFSA-N 379.460 2.533 0 50 GFAA O=C([C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1)N1CCc2c([nH]c3ccccc23)C1 169772790 CVEFEZZPTOJTSQ-CQSZACIVSA-N 399.454 2.982 0 50 GFAA COc1cnc(N2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)nc1 1857682640 YCXJLXDVQZSIHK-NRFANRHFSA-N 390.447 2.527 0 50 GFAA CCCN1CCC2(CC1)OCCc1sc(C(=O)NCCc3ncc[nH]3)cc12 1857688208 XJBGHCVBLJSMMZ-UHFFFAOYSA-N 388.537 2.718 0 50 GFAA COc1cc(Oc2cc(C(=O)N3CC[C@H](N(C)C)C3)ccc2OC)ccc1CN 1857696363 XFKNKMRFRVCRDL-KRWDZBQOSA-N 399.491 2.731 0 50 GFAA Cc1cnc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc1N(C)C 1857699948 FULRTRLBZJNMJZ-NRFANRHFSA-N 380.496 2.708 0 50 GFAA O=C(c1cccnc1)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1857712664 KZSRHBBBLHLUMF-UHFFFAOYSA-N 387.443 2.759 0 50 GFAA O=C([C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1)N1CCCC2(CC2)C1 1857739961 AYXWIFDZDHSEFM-INIZCTEOSA-N 396.516 2.884 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC(c5cc[nH]n5)CC4)CC3)nc2n1 1857739974 BLVFHQPZCLGNHK-UHFFFAOYSA-N 394.479 2.877 0 50 GFAA C[C@H](CN(C)C(=O)C1(c2cccc(Br)c2)CCOCC1)C(=O)O 237541534 RPAGVJGAPXEVBT-GFCCVEGCSA-N 384.270 2.676 0 50 GFAA O=C(c1ccc(N2CCCC2=O)cc1)N1CC[C@H](c2ccc(F)cc2)[C@@H](O)C1 209939324 ITLCOFZYRIPTBP-UXHICEINSA-N 382.435 2.943 0 50 GFAA C[C@@H]1C[C@H](O)CN1C(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 408295635 VSFQCOJZEOQZDC-RISCZKNCSA-N 390.281 2.719 0 50 GFAA CC(C)n1cc(Br)cc1C(=O)N(CCC(=O)O)C1CCOCC1 236686490 SLUCVBGYCRWNRW-UHFFFAOYSA-N 387.274 2.927 0 50 GFAA Cc1cccc(C2=CCN(S(=O)(=O)C[C@H]3CCCS(=O)(=O)C3)CC2)c1C 908496765 IAYRFIYURVHIHA-KRWDZBQOSA-N 397.562 2.547 0 50 GFAA CC(C)c1ccccc1CNC(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1 1875264181 QKSOGYGGCSBGQT-QGZVFWFLSA-N 379.526 2.520 0 50 GFAA C[C@H](CC(=O)NCCc1c[nH]nc1C(F)(F)F)NC(=O)Nc1ccccc1 1875271015 NTYLFYRTHWFZSF-LLVKDONJSA-N 383.374 2.688 0 50 GFAA O=C(N=c1ccn(C[C@@H]2CCOC2)[nH]1)Nc1cc(F)c(OC(F)F)cc1F 1875260021 UINGRZOOFLRDPU-VIFPVBQESA-N 388.321 2.865 0 50 GFAA CCCC(C)(C)C(=O)N[C@H]1CCCN(C(=O)c2nnc(O)c3ccccc23)C1 1875310589 VJTBNGIWSJBUIW-AWEZNQCLSA-N 384.480 2.883 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)C3(Cc4ccc(F)cc4)CC3)Cc3c[nH]nc32)n[nH]1 1875393752 ROSOILLTBDYSJP-MRXNPFEDSA-N 394.454 2.726 0 50 GFAA Cc1nc(C(=O)NCC2CC(C(F)(F)F)C2)nc(N2CC[C@@H](N(C)C)C2)c1C 1875403852 HJAXBURQYDOCNE-YMAMQOFZSA-N 399.461 2.552 0 50 GFAA CCCSCC(=O)Nc1ccc(S(=O)(=O)Nc2nc(C)cc(C)n2)cc1 888093043 OUIATGVFLPVPRH-UHFFFAOYSA-N 394.522 2.976 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)[C@H]3CCCCc4ccccc43)ccc2N1 2325760682 FRPPHZLHCVHKJP-INIZCTEOSA-N 384.457 2.861 0 50 GFAA CC[C@@](C)(O)c1cn(-c2cccc(CNC(=O)c3ccc4c[nH]nc4c3)c2)nn1 2325869326 JITZQQHFZCIHPL-OAQYLSRUSA-N 390.447 2.691 0 50 GFAA CCOC(=O)c1c(NC(=O)c2nc3ncccn3n2)sc2c1CCCCC2 646531 AFKMXTRXRSXVDO-UHFFFAOYSA-N 385.449 2.884 0 50 GFAA CCc1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1C 3557691 IKNBHFGQGFZOTP-UHFFFAOYSA-N 388.489 2.831 0 50 GFAA O=C(CCNS(=O)(=O)c1ccccc1)N1CCC(Cc2ccccc2)CC1 6728173 LVRFUAPSRKZULH-UHFFFAOYSA-N 386.517 2.836 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2)cc1C(=O)NC(C)C 10008963 ZQRBLSLFGKPBLQ-CQSZACIVSA-N 376.478 2.873 0 50 GFAA COc1cc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)ccc1O 23373465 ZZCYBPJHHDEQSJ-NRFANRHFSA-N 384.520 2.902 0 50 GFAA C[C@H]1CN(C)C(C)(C)CN1C(=O)c1coc(COc2ccc3c(c2)OCO3)n1 67954989 BZBSTWDQELGAEX-ZDUSSCGKSA-N 387.436 2.537 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CC[C@H](c2ccnc(-c3ccccc3)c2)C1 65508916 ZCTOXKVNEVPFTR-IBGZPJMESA-N 384.501 2.889 0 50 GFAA O=C(c1cnc2ccccc2c1)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65470761 ISHHZRXRBYYGSU-PKOBYXMFSA-N 376.412 2.954 0 50 GFAA Cn1cc(-c2csc(CN3CCC(NC(=O)c4ccccc4)CC3)n2)cn1 252490251 KNBDKXFCFGZIHS-UHFFFAOYSA-N 381.505 2.938 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCC2CCNCC2)Cc2ccccc2C1 72162860 AGCRFJALXVFVRQ-UHFFFAOYSA-N 391.559 2.814 0 50 GFAA CCOC(=O)c1cc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc(C(=O)OCC)c1 4651242 MPIOXIQSKMNYNE-HZPDHXFCSA-N 389.404 2.646 0 50 GFAA COc1cccc(-c2cc(C(=O)N3N=C(C(F)F)C[C@]3(O)C(F)F)n[nH]2)c1 6420409 POXNCAGTLYKITG-INIZCTEOSA-N 386.305 2.506 0 50 GFAA CC(=O)[C@@]1(O)CC[C@@H]2[C@@H]3C[C@H](C)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]21C 36371047 FAOZLTXFLGPHNG-FHIRQYNOSA-N 376.468 2.923 0 50 GFAA COc1ccc(-c2nc(COc3ccc(F)cc3)no2)cc1N1CCNC1=O 121074488 JPTJTLLYBMNEMJ-UHFFFAOYSA-N 384.367 2.993 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)c2cccc(C(=O)NC[C@@H]3CCCO3)c2)cc1 71754829 CPKGZIOQBUNUHX-SFHVURJKSA-N 388.489 2.729 0 50 GFAA c1ccc2c(c1)nc1n2[C@]2(N3CCOCC3)CCCC[C@H]2[C@@H]1N1CCOCC1 36075326 NNKLHIKTXJPZQM-RBDMOPTHSA-N 382.508 2.598 0 50 GFAA O=C(c1ccc(NC2CCOCC2)nc1)N1CCC(Oc2cccnc2)CC1 71754375 WEAVORHROSUZQL-UHFFFAOYSA-N 382.464 2.751 0 50 GFAA COc1cc(Cn2nc([C@H]3CCCNC3)n(-c3ccccc3)c2=O)cc(OC)c1 71738672 FNVYAZXSTDDSOE-KRWDZBQOSA-N 394.475 2.567 0 50 GFAA O=C(Cn1nc(-c2ccccc2F)ccc1=O)NCCc1c[nH]c2ccccc12 40284161 VQQRQPZPLQAHFM-UHFFFAOYSA-N 390.418 2.890 0 50 GFAA COc1cccc(-c2noc(CCN3C(=O)c4ccccc4C3=O)n2)c1OC 225526383 OGHGDYRBBYDEMX-UHFFFAOYSA-N 379.372 2.593 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 175649967 JIBKLMHUPURSBD-OXJNMPFZSA-N 383.540 2.932 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCN(c4ccccc4)C(=O)C3)[nH]n2)cc1 82108578 IKHSSAJVMQRHSC-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA COc1cc(C(=O)N2CCNCC2)ccc1OC1CCN(C2CCCC2)CC1 95528601 IDWQIZNRTFBYQL-UHFFFAOYSA-N 387.524 2.526 0 50 GFAA CCn1cnnc1CN(C)C(=O)c1cccc(-c2cc(NC(C)C)ncn2)c1 426517801 GUORTQSARBAWNF-UHFFFAOYSA-N 379.468 2.848 0 50 GFAA CC(C)N(C(=O)c1ccccc1-c1cc(N2CCOCC2)nc(N)n1)C(C)C 97602136 YNHJLCBZBUVSNS-UHFFFAOYSA-N 383.496 2.821 0 50 GFAA CCCc1cnc(C)nc1N1CCC(N[C@@H](CO)Cc2ccc(O)cc2)CC1 96130744 FUWKMYFKFMSXHR-HXUWFJFHSA-N 384.524 2.605 0 50 GFAA O=C(C1CCCC1)N1C[C@@H]2CN(Cc3ccc(F)c(F)c3)C[C@]2(C(=O)O)C1 96138734 ARRCRPXDXJIEIQ-YWZLYKJASA-N 378.419 2.500 0 50 GFAA CN1CCN(c2cccc(NC(=O)NC[C@@H]3OCCc4ccccc43)c2)C1=O 95509767 NNZJAYLSGROXKK-IBGZPJMESA-N 380.448 2.994 0 50 GFAA O[C@H]1CN(Cc2cc3ccccc3s2)C[C@@H]1N1CCN(c2ccccn2)CC1 23358175 NTLZVBSHYXMVKI-PMACEKPBSA-N 394.544 2.664 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ncccc3F)CC2)CN1Cc1cccnc1 92045662 MRJTZZHJFBYUMP-UHFFFAOYSA-N 382.439 2.661 0 50 GFAA COc1ccccc1CN1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91656041 OUJDGPFTPUFDGD-JOCHJYFZSA-N 382.508 2.866 0 50 GFAA COCCn1nnc2c1CCN(C(=O)N[C@H](C)c1ccc3ccccc3c1)C2 292936754 DZZMPZUYBCHQSG-OAHLLOKOSA-N 379.464 2.907 0 50 GFAA CC(C)(C)[C@@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C[C@H]1O 298844686 IFDHTCWZFQDKJK-IAGOWNOFSA-N 381.480 2.750 0 50 GFAA CC(C)Oc1cccc(CNC(=O)N2CCC(CN3CCN(C)CC3)CC2)c1 534659632 FQKOQONQPSUZNG-UHFFFAOYSA-N 388.556 2.643 0 50 GFAA Cc1csc([C@](O)(CC(=O)N2CCC(c3ncc[nH]3)CC2)C(F)(F)F)n1 299574752 CFZHIPMOIRPHFW-OAHLLOKOSA-N 388.415 2.721 0 50 GFAA COCCN1C[C@@H](c2nc(-c3ccccc3)nn2-c2ccccc2OC)CC1=O 63845647 ZUDGDDAZYSFOPD-KRWDZBQOSA-N 392.459 2.905 0 50 GFAA CC(=O)N1CCC2(CC1)CN(Cc1c(C)nn(-c3ccccc3)c1C)CCO2 820569443 SUTZRQDKCDCMEP-UHFFFAOYSA-N 382.508 2.702 0 50 GFAA CN(C)CC(=O)Nc1ccc(NC(=O)C2(c3ccccc3)CCN(C)CC2)cc1 823676170 OGHSHQMCCAJBAY-UHFFFAOYSA-N 394.519 2.789 0 50 GFAA Cc1n[nH]c(C)c1CCCN(C)C(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 584896979 MPLLHFZHMQEDSG-CYBMUJFWSA-N 392.525 2.765 0 50 GFAA CC1(C)C[C@@H](O)CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1 584895087 OFRIPDCCIBGBPO-IBGZPJMESA-N 377.504 2.983 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCC(CNC(=O)c4cscn4)CC3)n[nH]2)o1 952990302 HXVZGSUPHTZJOU-UHFFFAOYSA-N 399.476 2.717 0 50 GFAA O=C(NC1CCN(Cc2cccc(O)c2)CC1)c1ccc(CN2CCCC2)o1 952976649 LVVVYWZAGPIEOH-UHFFFAOYSA-N 383.492 2.975 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2C[C@@H]3C[C@@H](C2)[C@H]2CCCC(=O)N2C3)n[nH]1 888088256 BFHJERZMRANSDM-YZVOILCLSA-N 394.475 2.558 0 50 GFAA Cc1ccc(-c2cc(CN3C[C@@H]4CC[C@H]3CN(S(C)(=O)=O)C4)on2)cc1 1565512999 PJAPKJNKPXAFOV-RDJZCZTQSA-N 375.494 2.506 0 50 GFAA CN(C)c1nc2sc(C(=O)N[C@H]3CCCO[C@@H]3c3cnn(C)c3)cc2s1 275489664 VDJQKSHTCAIESK-SMDDNHRTSA-N 391.522 2.807 0 50 GFAA CC(C)[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1 276532819 RBHMAZWUMZYAFU-RBUKOAKNSA-N 381.524 2.606 0 50 GFAA O=C1CN(C(=O)CN2CCC(Nc3ccc(F)cc3)CC2)c2ccccc2N1 170651266 FTQQXYTVVZDVSV-UHFFFAOYSA-N 382.439 2.687 0 50 GFAA CN(C)c1cccc(S(=O)(=O)Nc2ccc(OC(F)F)c(C(=O)O)c2)c1 170616530 RKKSLKBQRKRKNX-UHFFFAOYSA-N 386.376 2.853 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)N[C@@H](CC(N)=O)C3CCCCC3)c2O1 192639805 ITTFWGHMXQVCRT-HNNXBMFYSA-N 380.510 2.503 0 50 GFAA CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1 194074890 KJEGPLZHUMVMGG-UHFFFAOYSA-N 382.873 2.649 0 50 GFAA CCn1ccnc1[C@H]1CCCCN1C(=O)Cn1cccc(C(F)(F)F)c1=O 797777331 WCVQSEAVFOKDSM-CQSZACIVSA-N 382.386 2.837 0 50 GFAA O=C(/C=C/c1cccc(O)c1)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1 780545363 PXWFDPNTGQDUDG-QPJJXVBHSA-N 392.459 2.795 0 50 GFAA CC(C)c1nc2ccccc2n1CC(=O)N1C[C@H](O)[C@H](Cc2ccncc2)C1 1704354052 XRNBUKFOFKAYOO-XLIONFOSSA-N 378.476 2.617 0 50 GFAA O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1CCC[C@@]2(CCC[C@H]2O)C1 1704337467 SFOHYINXWMLHQO-CABCVRRESA-N 379.400 2.901 0 50 GFAA COc1ccccc1NC(=O)Cn1nc(-c2ccc(OC)c(OC)c2)ccc1=O 5388641 NOUCFSIKISJILG-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 11710946 NZHSBZHGLUSYEL-NRFANRHFSA-N 387.430 2.727 0 50 GFAA CN(C[C@H]1COc2ccccc2O1)C(=O)c1cn(Cc2ccccc2Cl)nn1 11716310 YCSZDERZGAEVMU-HNNXBMFYSA-N 398.850 2.892 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@H](C(=O)c2cc(F)ccc2F)C1 11936243 WEBHBCUPORSTJI-LBPRGKRZSA-N 377.391 2.960 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cccc(OC)c3)C2)cc1 12021143 QBAGPNAAABXOLF-IBGZPJMESA-N 382.460 2.876 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)nc1 12725747 UIMRCNPTVVMUNO-QGZVFWFLSA-N 387.867 2.916 0 50 GFAA CCOc1ccc(CCNC(=O)c2cccnc2N2CCOCC2)cc1OCC 14329538 LZFLUHFTCWUOKV-UHFFFAOYSA-N 399.491 2.688 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1C[C@@H](NCC(F)(F)F)CC2 14532848 LDEBMCYBMUBDMG-AWEZNQCLSA-N 380.414 2.642 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)CCC2CCOCC2)CCC1=O 14976868 JLVDEAFXMHYSPL-LJQANCHMSA-N 388.508 2.709 0 50 GFAA Cc1nn(CCO)c(C)c1CN1CCC[C@H]1c1ccc(C(=O)N(C)C)s1 19854044 RRYKRCQITDIUPC-INIZCTEOSA-N 376.526 2.593 0 50 GFAA CN(Cc1nccn1Cc1ccccc1)C[C@]1(O)CCCN(c2ccncc2)C1 1857715819 JUQNVOROIPVWQL-HSZRJFAPSA-N 391.519 2.790 0 50 GFAA Cc1ccc2c(C(=O)N3CCN4[C@@H](c5ccccc5)COC[C@H]4C3)cnn2c1 1857720479 WGGPSMWHUYJBEU-WIYYLYMNSA-N 376.460 2.541 0 50 GFAA O=C([C@@H]1CCCCN1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857721539 UQIBLSPZVGXVMQ-SFHVURJKSA-N 392.503 2.798 0 50 GFAA O=C(N1CCC(Cn2ccnc2)CC1)[C@@]1(Cc2ccccc2)C[C@H]2CC[C@@H]1N2 1857732098 BQJZEIVBFXVHRA-GIWBLDEGSA-N 378.520 2.875 0 50 GFAA COC(=O)c1cncnc1N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857734960 AHVBJMRWUGRQDM-SJLPKXTDSA-N 383.448 2.515 0 50 GFAA NCC[C@@H]1Cc2ccccc2N(S(=O)(=O)c2c[nH]c3nccc(Cl)c23)C1 923748312 LMPMAIRGVJXCFZ-GFCCVEGCSA-N 390.896 2.933 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1c(O)cc(Br)cc1Cl)C1CC1 864096661 ACQIKPXJBNWHCF-LLVKDONJSA-N 384.679 2.975 0 50 GFAA Cc1ccc(F)c(-n2nc(C(=O)N3CCC[C@@H]3c3nc[nH]n3)c3c2CCC3)c1 1875296035 WGAFAGXHFVHUMY-MRXNPFEDSA-N 380.427 2.904 0 50 GFAA O=C(N[C@H]1CC2(CCCC2)Oc2ccccc21)C(F)(F)c1cnc(O)nc1O 1875262829 NQJZUPGTCDTZRF-ZDUSSCGKSA-N 391.374 2.932 0 50 GFAA CCN(Cc1ccccc1Cl)C(=O)c1nc(C)c(C)c(N2CC[C@@H](N)C2)n1 1875401075 DZEAGMLMGPRHBX-MRXNPFEDSA-N 387.915 2.947 0 50 GFAA C[C@]1(c2cccc(C(F)(F)F)c2)CCN(CC2(O)CCS(=O)(=O)CC2)C1 886066130 IFGHYWYSNVHTAC-INIZCTEOSA-N 391.455 2.609 0 50 GFAA Oc1nncc(N2CC[C@H](NCc3ccc(Oc4cnccn4)cc3)C2)c1Cl 898364858 RAGOQJXPROIMOC-AWEZNQCLSA-N 398.854 2.786 0 50 GFAA Cn1cc(C(=O)N2CCN3C(=O)OC[C@@H]3C2)c2nc(-c3ccccc3)ccc21 2325779839 IYAPEBDBWUBWAL-HNNXBMFYSA-N 376.416 2.517 0 50 GFAA CC(C)c1nocc1C(=O)N1C[C@@H](C)[C@@H](NC(=O)COCC2CCCC2)C1 2325793687 DIEPXXJTIDXFTQ-PBHICJAKSA-N 377.485 2.582 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2cc(OC)ccc2OC)cc1 862813 PILONWHQAHVIST-LJQANCHMSA-N 397.431 2.979 0 50 GFAA O=C(COc1ccc(S(=O)(=O)Nc2ccccc2)cc1)NCc1cccnc1 1051104 JDYCFHXGNBZVTM-UHFFFAOYSA-N 397.456 2.578 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(Br)cc1 4550731 HDRSPQOGMCPABA-CYBMUJFWSA-N 385.283 2.983 0 50 GFAA Cc1cc2cc(CNC(=O)C[C@@H]3C(=O)NCCN3Cc3cccs3)ccc2[nH]1 55344206 VOFROPVCSLLSDW-LJQANCHMSA-N 396.516 2.545 0 50 GFAA CC[C@@H](CO)N(Cc1ccc(C)s1)C(=O)c1cccnc1N1CCOCC1 55242530 UITMULQDMJAHST-INIZCTEOSA-N 389.521 2.701 0 50 GFAA COc1ccc(CN2CCN(Cc3csc(C)n3)CC2)c(OC)c1OC 20782869 CAEKJLAXTYTALF-UHFFFAOYSA-N 377.510 2.795 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N3CCC[C@@H]3c3ccccn3)cnn2c1 67773214 UVCRQLUNYTWIBX-LJQANCHMSA-N 378.480 2.943 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)Nc4cccc(F)c4)CC3)nn2)n1 65362448 DMAOJAOCYXTXLD-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA COc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@@H]2CCO)c(F)c1 23359841 GASSWJVZHDIAPJ-IBGZPJMESA-N 390.503 2.681 0 50 GFAA Cc1cc(NC(=O)Nc2ccc3c(c2)CC(=O)N3)cc(N2CCN(C)CC2)c1 252484835 GJFXKXYDTNAVTL-UHFFFAOYSA-N 379.464 2.885 0 50 GFAA COc1ccc(F)c(-c2nc(CN3CCC4(CC3)CNC(=O)O4)c(C)o2)c1 71639477 CCWHSWVBSRESGP-UHFFFAOYSA-N 375.400 2.872 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3ccccc3OCC3CC3)CC(=O)N2C)cnn1C 328618162 DKZWKFASSVLCEU-PGRDOPGGSA-N 382.508 2.827 0 50 GFAA COC(=O)CC(C)(C)CC(=O)N1CC[C@@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 253418575 UKMVHONIOUSOTR-HUUCEWRRSA-N 382.501 2.824 0 50 GFAA Cc1c([C@H]2[C@H](CNC3CCN(C4CCCCC4)CC3)CC(=O)N2C)cnn1C 328630069 PMBQCQFTMAHGRK-HTAPYJJXSA-N 387.572 2.635 0 50 GFAA C[C@H](N[C@@H]1CCC[C@H]2OCC[C@H]12)C(=O)NC1CCN(Cc2ccccc2)CC1 151151818 XVMHIKIYAUYQJF-ZHNGQKSSSA-N 385.552 2.703 0 50 GFAA CC[C@H](C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2)n1cccn1 72454073 GCAQWKMSXMRHJW-LJQANCHMSA-N 380.492 2.876 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3ccccn3)C[C@H]21 329058098 TXWTWOPBOZIBOG-HZPDHXFCSA-N 398.511 2.502 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(C(=O)OCc2ccccc2)C1 72194253 BOZPQGHPJKFXML-HZPDHXFCSA-N 392.452 2.711 0 50 GFAA O=C1CC[C@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C(=O)N1 153355839 DZRXYXTZPPEUFG-LBPRGKRZSA-N 396.230 2.502 0 50 GFAA c1ccc(CN2CCC[C@@]3(CCCN(Cc4cc5n(n4)CCNC5)C3)C2)cc1 72162711 KEBGPFUBILNBDR-HSZRJFAPSA-N 379.552 2.865 0 50 GFAA O=C(N1CCc2c(ncnc2N2CCOCC2)C1)C1(c2ccccc2)CCCC1 77539039 UZVBEGFLWDANMP-UHFFFAOYSA-N 392.503 2.710 0 50 GFAA NCC[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 442620612 SVHCHAVKJSBRHB-JSGCOSHPSA-N 384.307 2.934 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1)N1CCC(F)CC1 71752674 PQFWWDWNZLMSDI-LJQANCHMSA-N 388.531 2.719 0 50 GFAA CCCc1nc(C(=O)N[C@@H]2COCC[C@H]2Oc2ccc(CO)cc2)cs1 219806525 JWEGERHBTJSVLI-NVXWUHKLSA-N 376.478 2.554 0 50 GFAA Cc1n[nH]c(CCC(=O)N2CC[C@]3(CCCN(CCCc4ccccc4)C3)C2)n1 14949396 FFSOSNGOYGXTNN-QHCPKHFHSA-N 395.551 2.993 0 50 GFAA Cc1ccc(NC(=O)N2CC[C@@H]3CNC[C@@H]3C2)cc1S(=O)(=O)C1CCCC1 333345678 QNJIZPRIXPUZPM-HZPDHXFCSA-N 391.537 2.785 0 50 GFAA CCN(CC)Cc1nc(C2(NC(=O)C(F)(F)C(=O)C(C)C)CCCC2)no1 240551537 GULOSDVAWJFERA-UHFFFAOYSA-N 386.443 2.657 0 50 GFAA CNC(=O)CC1CCN(C(=O)c2nn(-c3ccccc3)cc2OCC(C)C)CC1 173813205 FJQHTGBGHVMNFK-UHFFFAOYSA-N 398.507 2.895 0 50 GFAA Cc1cc2occ(CC(=O)Nc3ccnn3[C@H]3CCS(=O)(=O)C3)c2cc1C 174217600 KSOIIVOORVQOGM-HNNXBMFYSA-N 387.461 2.787 0 50 GFAA CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N1CCC[C@H](C2CC2)C1 288944461 WZSNADSFDQGLQO-HNNXBMFYSA-N 394.541 2.657 0 50 GFAA Cc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2ccccc2-c2nnn[nH]2)c1 97655371 OWKOQIZNBHZQMA-KRWDZBQOSA-N 377.448 2.997 0 50 GFAA O=C(N1CCC(c2nc3ccccc3[nH]2)CC1)C1(n2cnnn2)CCCCC1 334161237 XAIKZAOOKSUUIV-UHFFFAOYSA-N 379.468 2.615 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1ccnnc1 95504955 UTQIQSSIMUFYNE-UHFFFAOYSA-N 386.471 2.617 0 50 GFAA COCc1nc(NC2CCN(Cc3ccccc3)CC2)cc([C@H]2C[C@@H](N)C2)n1 244774095 PNUKMJYIBLULQP-HDICACEKSA-N 381.524 2.904 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@@H]1C=Cc3ccccc3N1[C@H]2C(=O)c1ccc(Cl)cc1 247798917 DVIXXRORQNKBTF-WNRNVDISSA-N 378.815 2.696 0 50 GFAA Cc1nccc(N2CCN(C[C@H](O)Cc3ccccc3C(F)(F)F)CC2)n1 183783590 MLUIZZYVFAFQNQ-MRXNPFEDSA-N 380.414 2.529 0 50 GFAA CCN(C[C@@H]1CCCCO1)S(=O)(=O)c1cc(-c2ccno2)ccc1OC 823086815 KZGSVUPSVNEAOB-HNNXBMFYSA-N 380.466 2.930 0 50 GFAA CC(=O)N1CCC2(CC1)CN(C1CCN(c3ccccc3F)CC1)CCO2 820569503 VSHULPYHQZFIOO-UHFFFAOYSA-N 375.488 2.508 0 50 GFAA CN1N=C(C(=O)Nc2ccc(NC(=O)CCc3ccccc3)cc2)CCC1=O 823807252 YGGDMKHMQDKNNM-UHFFFAOYSA-N 378.432 2.805 0 50 GFAA Cc1cc(N)n(CC(=O)N(CCc2c[nH]c3ccccc23)Cc2cccnc2)n1 952978719 LLNITLRSFUGRMO-UHFFFAOYSA-N 388.475 2.922 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)C3(N4CCCC4)CCCCC3)CC2=O)c1 952872088 JDZYPULIQAGGSJ-QGZVFWFLSA-N 385.508 2.715 0 50 GFAA O=C(NCC1(c2ccc(F)cc2Cl)CC1)N1CC[C@H](N2CCCC2=O)C1 276930486 RDTFMKWIBKRWJZ-AWEZNQCLSA-N 379.863 2.917 0 50 GFAA CC(C)c1nnc2ccc(NC(=O)Cc3csc(N4CCCC4=O)n3)cn12 189221319 VOBAHXVWETTXJZ-UHFFFAOYSA-N 384.465 2.617 0 50 GFAA CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1sc(CC2CC2)nc1C 190223758 CLNMUSFMFIUFQS-UHFFFAOYSA-N 391.518 2.515 0 50 GFAA O[C@H]1CN(Cc2cc3ccccc3o2)CC[C@@H]1N1CCN(c2ccccn2)CC1 1614374656 WIPNHQXZXLKPBQ-SFTDATJTSA-N 392.503 2.585 0 50 GFAA Cc1nc2cc(C(=O)N(Cc3cccnc3)C[C@@H]3CCC(=O)N3)ccc2s1 1506425446 CTQPWCCXYXPGFQ-INIZCTEOSA-N 380.473 2.921 0 50 GFAA Cc1csc(CN(C)S(=O)(=O)c2ccc(N3CCCCC3=O)cc2)n1 1506396065 BIFCNGMWSXKYIT-UHFFFAOYSA-N 379.507 2.789 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@H](CCn2cncn2)c2ccccc2)CC1 1506420167 WPILOJSOVUSTCM-OAQYLSRUSA-N 390.491 2.699 0 50 GFAA Nc1cc(C(=O)N2C[C@H](c3ccc4c(c3)OCO4)O[C@H](c3ccccc3)C2)[nH]n1 1529099587 BYUDSWOZTQBNHR-RBUKOAKNSA-N 392.415 2.676 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CCCN(C(=O)[C@H]2C[C@@H]3C=C[C@H]2C3)CC1 1772710685 ZKXFSABWBPOEMC-SQNIBIBYSA-N 392.503 2.769 0 50 GFAA O=C(c1csc2ccccc12)N1C[C@@H]2CN(Cc3ccns3)C[C@]2(CO)C1 1772813130 WWAXWHVJFFRERU-VBKZILBWSA-N 399.541 2.924 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSC2=N[C@H](c3ccccc3)CC(=O)N2)cc1 5495527 WNXCOMXENCYUNJ-KRWDZBQOSA-N 396.472 2.934 0 50 GFAA CCN(CCO)C(=O)CC[C@@]1(Cc2ccc(OC)c3ccccc23)CCC(=O)N1 11787241 DITNBIBRSACKSY-HSZRJFAPSA-N 398.503 2.661 0 50 GFAA CC[C@H](O)CNC(=O)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 11814199 TXGNJHHYZVNFCN-SFHVURJKSA-N 394.519 2.736 0 50 GFAA CN(Cc1nccn1C)C(=O)[C@@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 12316746 MJHDUQVDHXTCFD-MRXNPFEDSA-N 388.899 2.513 0 50 GFAA COc1ccc(CCN2C(=O)O[C@@H]3CN(C(=O)NC4CCCCC4)C[C@@H]32)cc1 12385142 SANIZIKASQIMDJ-RBUKOAKNSA-N 387.480 2.785 0 50 GFAA CC(C)[C@H]1NC(=O)[C@@H]2C[C@H](NCc3sc4ccccc4c3Cl)CN2C1=O 14744693 ZGTXIKLSKJBLHG-PLQHRBFRSA-N 391.924 2.768 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](NC3CCN(Cc4ccccc4)CC3)C2=O)cc1 19782439 URNKVWVDUBLFNJ-OAQYLSRUSA-N 393.487 2.581 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc(OC)c(F)c1 1857675762 DXCCNRUVSYECQR-BJOOFOGMSA-N 385.457 2.719 0 50 GFAA O=C(O)[C@H]1CN(Cc2cccnc2)CC12CCN(C(=O)CCC1CCC1)CC2 1857685204 QPFZEMOIXWATIX-LJQANCHMSA-N 385.508 2.787 0 50 GFAA O=C(CC1CCCC1)N1CCC[C@]2(C1)CN(c1ccc(F)cn1)CC[C@H]2O 1857696322 WASBCMQAQRXAHV-WIYYLYMNSA-N 375.488 2.981 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@H]1CC(=O)N(c2nccs2)C1 1857710831 ROBMEVNGTOLVLT-AWEZNQCLSA-N 382.445 2.810 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)N1CCO[C@H]2C[C@H](CO)C[C@@H]21 1857713031 AGJQPNVAVURKMT-CBQOVEMMSA-N 381.472 2.806 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccc(Cl)cn3)C[C@]23CC[C@H]1O3)c1ccccn1 1857715467 SRKYKUQCFFYAIK-DKYLXPRQSA-N 384.867 2.544 0 50 GFAA Cn1cc(-c2csc(CNc3ccc(N4CCC(CO)CC4)cn3)n2)cn1 240668117 HMLCXUGPMZFIJF-UHFFFAOYSA-N 384.509 2.759 0 50 GFAA CNC(=O)[C@H]1C[C@H](C)CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 1875288985 OJFKZAUDSLGGFZ-JQWIXIFHSA-N 375.366 2.758 0 50 GFAA C[C@@H]1OC2(CCN(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)CC2)NC1=O 1875274132 LJDFRCKWIALPAF-NSHDSACASA-N 396.369 2.582 0 50 GFAA O=C(NCc1nc(O)c2ccccc2n1)N[C@H](CN1CCCC1)c1ccccc1 1875276861 JNIXVRUCOZPHLG-LJQANCHMSA-N 391.475 2.972 0 50 GFAA C=CC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)C2=NO[C@@H](C(C)(C)C)C2)C1 1875383478 WKFDPPGQUQLFAF-CDMIOBSGSA-N 383.492 2.696 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CC[C@H](CCC(=O)O)C1 1875300592 JTXFODDENAIWMU-GWCFXTLKSA-N 375.391 2.879 0 50 GFAA COCCOc1cc(C)ccc1CNC(=O)c1c2c(nn1C)[C@H](C)O[C@H](C)C2 1875314627 JITGCNKRDCQZQH-CABCVRRESA-N 387.480 2.706 0 50 GFAA CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)c3ccc(Cl)c(N4CCCC4)n3)[C@H]2C1 1875404533 LTZFXQWBLBHCSG-YQQAZPJKSA-N 390.915 2.712 0 50 GFAA Cc1ccc([C@H](C)C(=O)N2CCC3(CCN(C(=O)Cc4cncn4C)CC3)C2)o1 2325793736 GIKGYUSKVZFNIZ-KRWDZBQOSA-N 398.507 2.509 0 50 GFAA C[C@@H]1CN(C(=O)NCc2nc3cc(F)c(F)cc3[nH]2)CCN1c1ccncc1 2325808029 WHAVIKRSFFRKQW-GFCCVEGCSA-N 386.406 2.656 0 50 GFAA O=C(NC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc2nc(O)nc(O)c2c1 2325850812 IKKDDGTZSOWROA-CQSZACIVSA-N 393.321 2.523 0 50 GFAA Nn1c(SCC(=O)Nc2cccc(C(F)(F)F)c2)nnc1C(F)(F)F 1280726 XWNCLFKJSZGDOC-UHFFFAOYSA-N 385.293 2.760 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(Cc2cccc(O)c2Cl)CC[C@H]1O 2356153737 SLFWBILMLMJTHJ-YLJYHZDGSA-N 375.852 2.926 0 50 GFAA CC[C@H]1SC2=NC(C)=C(C(=O)OC)[C@@H](c3ccc(OC(C)=O)cc3)N2C1=O 2695628 OJZBJKXWRMCKQR-GDBMZVCRSA-N 388.445 2.824 0 50 GFAA C[C@@H](CCc1ccccc1)NC(=O)c1ccccc1OCC(=O)N1CCOCC1 4842340 YDSXWMXQNUOZHJ-SFHVURJKSA-N 396.487 2.675 0 50 GFAA COc1ccc(S(=O)(=O)NC2CCCCC2)cc1C(=O)N1CCCCC1 6744005 SBCXZISVZRUNDX-UHFFFAOYSA-N 380.510 2.932 0 50 GFAA COc1ccc(CN2CCN(CC=C(C)C)[C@H](CCO)C2)cc1Cn1cccn1 104385520 GYORVKNPBVBPPT-JOCHJYFZSA-N 398.551 2.775 0 50 GFAA CN(C)C(=O)Cc1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 56554790 WOLCFWHSLHGMDX-IBGZPJMESA-N 380.492 2.713 0 50 GFAA COc1cc(N2CCN(C(=O)N[C@H](C)c3ccc(OC(C)C)cc3)CC2)ncn1 460907051 SSJALNUTDTZFEF-MRXNPFEDSA-N 399.495 2.865 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(-n4ccnc4C)ncn3)CC2)c1 67612663 VLSZVKFFJSPWOA-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CN(C)c1n[nH]c(C2CCN(C(=O)c3cc(O)ccc3C(F)(F)F)CC2)n1 328591521 SHKNQSINMIZRFV-UHFFFAOYSA-N 383.374 2.615 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)/C=C/c2ccccc2Cl)cn1 328626750 MATALEMHTGGVCE-PFSJMHODSA-N 381.885 2.977 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@@H]2CCn3ccnc3C2)sc1Br 328625913 LCZDHKDELMZCPT-SNVBAGLBSA-N 390.328 2.556 0 50 GFAA COc1ccc(Oc2cccc(CN3CCN[C@@H](C(=O)NC4CC4)C3)c2)cc1 72144250 RZGBILOLVDQQGY-OAQYLSRUSA-N 381.476 2.540 0 50 GFAA CCS[C@@H]1CCCCN(C(=O)c2cc(Cl)sc2S(N)(=O)=O)C1 253404737 QLNZAPLQKPAHSL-SECBINFHSA-N 382.960 2.797 0 50 GFAA O=C(Nc1ccccc1)c1cccc(CN2CCC[C@H](N3CCNC3=O)C2)c1 363638071 PTGJYLNXYFBJRU-FQEVSTJZSA-N 378.476 2.929 0 50 GFAA CN(Cc1nc2ccsc2c(=O)[nH]1)C[C@H](O)c1ccc(Br)cc1 131830834 ISVMPATWSVBSPA-ZDUSSCGKSA-N 394.294 2.913 0 50 GFAA CCN(Cc1cccnc1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71747886 SKHMZNLODQDLBK-FQEVSTJZSA-N 398.551 2.543 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)NCCc1nc(C)c(C)s1 72432361 YUXRIGRRKYZZDO-QGZVFWFLSA-N 378.586 2.615 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1csnc1C)CC2 262841630 SFQGMMAAEHOJKF-AWEZNQCLSA-N 376.434 2.683 0 50 GFAA C[C@H]1Oc2ccccc2[C@@H]1NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 377606525 NKENEEWLOHXORA-KZULUSFZSA-N 387.461 2.652 0 50 GFAA CCOC(=O)[C@H](Oc1ccccc1OC)[C@@H](O)c1ccc(OC)c(OC)c1 196166508 WXFAFGNQMYMUDX-RBUKOAKNSA-N 376.405 2.757 0 50 GFAA COc1cccc2c1ccn2CCC(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 225423179 WCXBDXFFSXWFMQ-SJORKVTESA-N 391.471 2.848 0 50 GFAA biogenic COCCN(Cc1ccc(C)s1)C(=O)Nc1cnc2sccn2c1=O 426494716 YOUPGFPGGXPQGU-UHFFFAOYSA-N 378.479 2.806 0 50 GFAA Cc1cccc(CN(C[C@H]2CCCO2)C(=O)c2ccccc2-c2nnn[nH]2)c1 97655372 OWKOQIZNBHZQMA-QGZVFWFLSA-N 377.448 2.997 0 50 GFAA O=C(CN1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2)NC1CC1 92001657 SOAZVBHERUCYKH-HXUWFJFHSA-N 381.520 2.526 0 50 GFAA O=C(Nc1ccc2c(c1)S(=O)(=O)CC2)N(Cc1ccco1)C[C@@H]1CCCO1 178374794 CIOKAVULUBUYNG-KRWDZBQOSA-N 390.461 2.823 0 50 GFAA COc1ccc(CN2CCN(C(=O)C[C@H]3CCc4ccccc43)CC2=O)cc1 91635422 KJPXQJQFALKEPX-LJQANCHMSA-N 378.472 2.986 0 50 GFAA CC(C)CN1CC2(CCN(c3cc(C(=O)N4CCCC4)ccn3)CC2)CC1=O 91587408 AKQSLEKDDYVMSP-UHFFFAOYSA-N 384.524 2.793 0 50 GFAA CC(C)OC(=O)[C@H]1[C@H]2C=C[C@@]3(CN(c4ccccc4Br)C(=O)[C@H]13)O2 239306230 GOUMLHLYFWBNID-LLDVTBCESA-N 392.249 2.687 0 50 GFAA CCc1cc(N2CCC3(CCC(=O)N(Cc4cnc(C)cn4)C3)CC2)nc(C)n1 92062429 HDBHFUHZMOUNRI-UHFFFAOYSA-N 394.523 2.855 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C1 91964928 YYHWZCWHUKMGIR-CQSZACIVSA-N 387.436 2.539 0 50 GFAA CCCCN(CC)C(=O)Cn1ccn2nc(-c3ccc(C)cc3)c(CO)c2c1=O 263619444 YRRNWGUOUNDZNA-UHFFFAOYSA-N 396.491 2.612 0 50 GFAA CCOc1cccc(CN[C@@H]2CNC(=O)c3cc(-c4cccc(OC)c4)nn32)c1 263617283 NBJAVYSHQPQUBL-NRFANRHFSA-N 392.459 2.989 0 50 GFAA CN(C)c1nc(-c2cccc(C(=O)N(CC3CCC3)C[C@@H]3CCCO3)c2)n[nH]1 299799747 RPHLKMLKBIDLBQ-SFHVURJKSA-N 383.496 2.959 0 50 GFAA CC(C)=CCN1CCC2(CC[C@H](CNC(=O)N(C)Cc3cc[nH]n3)O2)CC1 584886518 HPNWZDSVJAIBLB-GOSISDBHSA-N 375.517 2.531 0 50 GFAA CC(C)C(=O)N1CCC[C@H](NS(=O)(=O)c2ccccc2C(F)(F)F)C1 670452772 KNAZEMYTSZHQFE-LBPRGKRZSA-N 378.416 2.631 0 50 GFAA O=C(COc1ccc(CNCc2ccc3nc(O)[nH]c3c2)cc1)N1CCCC1 952974632 WVEIKVGWASZOTA-UHFFFAOYSA-N 380.448 2.560 0 50 GFAA CC[C@H](C(=O)N1CCC(NC(=O)Cc2c(C)n[nH]c2C)CC1)c1ccccc1 187053985 QEUQYETTWXHLIW-IBGZPJMESA-N 382.508 2.870 0 50 GFAA CC(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCCC[C@H]1NS(C)(=O)=O 170085062 XWFUAFXVIYPJLR-RTBURBONSA-N 390.553 2.946 0 50 GFAA Cn1cncc1CCC(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 170610272 PQINEOSJGHHYOS-INIZCTEOSA-N 378.270 2.715 0 50 GFAA Cc1oc(C(=O)N2CCC[C@H](c3cc(F)ccc3F)C2)cc1S(N)(=O)=O 190277719 AOFLBJZLJSMCOH-NSHDSACASA-N 384.404 2.533 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)C(=O)NCC1CC1)CC2 191695619 DQVYLQFVEMLCPR-NRFANRHFSA-N 394.471 2.704 0 50 GFAA CCCC(=O)N1CCCC[C@H]1C(=O)Nc1nnn(Cc2ccccc2F)c1C 192369868 VWAJPBBQRTUKRW-KRWDZBQOSA-N 387.459 2.894 0 50 GFAA COc1ccc(CN2C[C@@H]3CNC(=O)C[C@@H]3C2)cc1OCc1cccc(F)c1 1800410624 XWBMJHAYBLYUBD-MSOLQXFVSA-N 384.451 2.981 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)CCCn3cncn3)C[C@]2(CCc2ccccc2)C1 1772819167 GGPUAGZHXRXONI-GGAORHGYSA-N 395.551 2.862 0 50 GFAA O=C(NCc1n[nH]c2c1CCC2)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 1772815197 ZHMUYALYZXWCHB-CYBMUJFWSA-N 379.489 2.838 0 50 GFAA Cc1nc(C)n(CCCNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)n1 1772808692 YMWRKSPQQVEGST-MRXNPFEDSA-N 396.520 2.725 0 50 GFAA COc1ccc(CN2CC(=O)N[C@@H](Cc3ccccc3)C2)cc1CN1CCCC1 1772702184 FAWUDBJIQQNCFP-QFIPXVFZSA-N 393.531 2.834 0 50 GFAA CC(=O)N1CCC(C(=O)N(CCc2ccccc2)C[C@@H]2CCCN(C)C2)CC1 11932766 VAUBCYFCZHBHTF-OAQYLSRUSA-N 385.552 2.658 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2)C1 12058504 YUAMNLUDVQLANS-HSZRJFAPSA-N 385.552 2.961 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C2CCN(C(C)=O)CC2)C1 12093452 LZVKFWXRTAUGNX-FQEVSTJZSA-N 387.568 2.892 0 50 GFAA CCn1ccnc1CN(C)C(=O)c1cc(COc2cncc(Cl)c2)on1 12307191 QVLXWSDFTYDWKJ-UHFFFAOYSA-N 375.816 2.791 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NC1CCCCC1)C2 14532915 PHAXLGAFNSORFD-MRXNPFEDSA-N 376.570 2.872 0 50 GFAA COc1ccc(-c2noc([C@@H]3CCCN3C(=O)c3cnccn3)n2)cc1OC 169792135 JCMBUOFIWWFGHP-AWEZNQCLSA-N 381.392 2.521 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCC[C@]3(C2)CN(c2ncccn2)CC[C@H]3O)c1 1857685663 OOMLZACAALTIQG-KNQAVFIVSA-N 380.492 2.587 0 50 GFAA CS(=O)(=O)N1CCCC[C@H]1CCn1ccnc1-c1ccnn1-c1ccccc1 1857690106 AFLYTTXYWLKITG-KRWDZBQOSA-N 399.520 2.940 0 50 GFAA Cc1cnccc1N1C[C@@H]2[C@H](CNC(=O)Cc3ccccc3)[C@H]3CC[C@]2(C1)O3 1857717988 JNQHKRZOMJUSNC-KLJZETAQSA-N 377.488 2.733 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@]23CC[C@H]1O3)c1cccnc1 1857723078 WFTJPUYATBKSJU-GPQLQYNLSA-N 381.451 2.630 0 50 GFAA O=C(O)CN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)C1CCOCC1 238101168 DPVVSWAYPJEDSL-UHFFFAOYSA-N 378.812 2.630 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2c2ncc(C(F)(F)F)cc2Cl)C1 373031811 YNVHVWJXJCWVCM-SKDRFNHKSA-N 391.777 2.656 0 50 GFAA C[C@@H](C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1)n1cncn1 837230726 FSYVIOKXSHLGTM-DOTOQJQBSA-N 385.468 2.660 0 50 GFAA CN1C(=O)Cc2cc(NC(=O)[C@H]3C[C@@H](NC(=O)OCc4ccccc4)C3)ccc21 844501890 JRUMKGOLDRQLBL-MAEOIBBWSA-N 393.443 2.849 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccc(F)c(C)c3)C2)ncn1 1875280550 WISNMIXDPXFGRO-FXAWDEMLSA-N 396.466 2.999 0 50 GFAA C=CC(=O)N[C@H](C)[C@H]1CN(C(=O)c2cc(-c3ccc(Cl)cc3)on2)CCO1 1875386212 LCYALKHVWGSHHE-SJKOYZFVSA-N 389.839 2.527 0 50 GFAA CS(=O)(=O)NC(=O)Cn1c(Cc2cccc3ccccc23)nc2ccccc21 1875390839 UBDHCBNAJJGPER-UHFFFAOYSA-N 393.468 2.856 0 50 GFAA Cc1cc(C(=O)NCC2(NC(=O)c3ccnc4ccncc34)CCCCC2)no1 1775990002 BRZICQIPAVCZRK-UHFFFAOYSA-N 393.447 2.789 0 50 GFAA C[C@@H]1CO[C@H](C(=O)NC2(C3CCN(c4ccc(C(F)(F)F)nn4)CC3)CC2)C1 1775991175 JDGPVDLFSARXSO-JSGCOSHPSA-N 398.429 2.786 0 50 GFAA C[C@@H]1CN(C2CC2)CCN1C(=O)C1CCN(C(=O)c2cccc(Cl)c2)CC1 2100473720 WQBNOYNMTVGKRU-OAHLLOKOSA-N 389.927 2.887 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3[C@H]4CC[C@H]3C(=O)NC4)c3c(C)noc3n2)c(C)c1 2325790568 VSMMVDBYQMAKSM-KSSFIOAISA-N 390.443 2.918 0 50 GFAA C[C@H]1CN(C(=O)NCc2nc3cc(F)c(F)cc3[nH]2)CCN1c1ccncc1 2325808030 WHAVIKRSFFRKQW-LBPRGKRZSA-N 386.406 2.656 0 50 GFAA NC[C@@H](NC(=O)c1cnc2c(c1)NC(=O)CS2)c1ccc2ccccc2c1 2325857146 QSVHNNWFUAKZLV-QGZVFWFLSA-N 378.457 2.709 0 50 GFAA C[C@H](O)c1cn(-c2cccc(C(=O)NCc3cccc(-c4cc[nH]n4)c3)c2)nn1 2325869697 YFOLAFHKABURFS-AWEZNQCLSA-N 388.431 2.641 0 50 GFAA NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(Br)cc1 1132344 HETOTBVTPYFYIZ-UHFFFAOYSA-N 390.266 2.669 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(Cl)cc2)cc1OC 1145758 SVGIJQIJTURJBW-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(c1ccccc1F)S(C)(=O)=O 1171470 IUGWEAIBXXBMDG-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CCc2nc(-c3ccccc3)nn2CC1 2356150971 LAQZGYCTMLPVDR-UHFFFAOYSA-N 386.411 2.750 0 50 GFAA CCOc1ccccc1NC(=O)N1CCC[C@@]12CCCN(CCOC)C2=O 2356153363 CVLONDLQGGCALK-HXUWFJFHSA-N 375.469 2.721 0 50 GFAA O=C(NCCc1ccccc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1F 3020251 AQNCRMJQKSDQIP-UHFFFAOYSA-N 390.480 2.973 0 50 GFAA Cc1ccccc1-c1noc(CCC(=O)N2CCC[C@@]23CCCN(C)C3=O)n1 2356166797 ACGKRYJOGKPMEB-OAQYLSRUSA-N 382.464 2.591 0 50 GFAA O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 4029165 GMUYSWQSSRROPG-OALUTQOASA-N 396.443 2.600 0 50 GFAA biogenic,in-vitro CCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)OC 4764309 WGEUGAFHOWNSBM-SJORKVTESA-N 378.469 2.785 0 50 GFAA CSc1ccc(OC[C@H](O)CSc2nnc(-c3cnccn3)n2C)cc1 414122684 BHYSAASIWOPSSG-LBPRGKRZSA-N 389.506 2.526 0 50 GFAA CCCNC(=O)N1CCC(n2cc(CN3CCC[C@H]3c3ccccn3)nn2)CC1 23398829 GJPZHYYLHROGPN-FQEVSTJZSA-N 397.527 2.767 0 50 GFAA COc1ccc(-c2nc(CN3C[C@H](O)[C@@H](N(C)C)C3)c(C)o2)c2ccccc12 67712962 CJAXMXBOJOKJTJ-PMACEKPBSA-N 381.476 2.919 0 50 GFAA O=C(CCc1ccccc1)N1CCC[C@@H](CNS(=O)(=O)c2cccs2)C1 12229067 MNTGZCQFGFMYAQ-KRWDZBQOSA-N 392.546 2.898 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)CSc2nnc(C)s2)cc1 67820805 ZGAWKCJVMYOVST-UHFFFAOYSA-N 375.479 2.654 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@H](NS(C)(=O)=O)C2)cc(C(F)(F)F)c1 252489164 JIOOTWUAADUTHG-LBPRGKRZSA-N 379.404 2.559 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)c3cccc4cnccc34)CC[C@H]21 72410822 GNWLPFQUJGKJIM-FXAWDEMLSA-N 381.476 2.724 0 50 GFAA Cn1nccc1CCC(=O)N(Cc1ccncc1)Cc1ccc2c(c1)OCO2 215234149 DMMWVVSQWOGESW-UHFFFAOYSA-N 378.432 2.705 0 50 GFAA Cc1c(NC(=O)[C@@]2(O)CCc3ccccc3C2)nnn1Cc1ccccc1F 367635695 OQDRUBGUJNYHEL-OAQYLSRUSA-N 380.423 2.632 0 50 GFAA COc1ccccc1NC(=O)C1CCN(C(=O)c2ccc(C(=O)O)s2)CC1 262222589 LORLSPCDXWVIGL-UHFFFAOYSA-N 388.445 2.946 0 50 GFAA NC(=O)N[C@H](CC(=O)N1CCC[C@@H]1C(=O)O)c1cccc(Oc2ccccc2)c1 262718146 TVPOQCDASVAQIS-QZTJIDSGSA-N 397.431 2.654 0 50 GFAA Cc1ncn(-c2cc(NCCNC(=O)c3ccc(F)cc3Cl)ncn2)c1C 72436949 HKAHFPZZGMPVLX-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3c(C)[nH]c(C)cc3=O)CC2)OC1=O 72463551 MXCNGJRBCRBSDW-AWEZNQCLSA-N 375.469 2.607 0 50 GFAA Cc1cc(C(=O)NCC2(N3CCCCC3)CCN(C)CC2)nn1C(C)(C)C 172751551 KUDXUWOWYIAJAB-UHFFFAOYSA-N 375.561 2.627 0 50 GFAA Cc1nn2c(nnc3c(=O)n(CCCN(C)C)ccc32)c1-c1ccc(F)cc1 40391865 ZZSOLJAOMVLWCK-UHFFFAOYSA-N 380.427 2.505 0 50 GFAA O=C1CCCN1CC[C@H]1CCCCN1C(=O)c1ccccc1N1CCOCC1 82139204 XNDQWHDDHFIYED-GOSISDBHSA-N 385.508 2.530 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)n(C)n1 284001806 IJYNXPBNBBRSRR-MRXNPFEDSA-N 395.290 2.956 0 50 GFAA CCCCN1CCCC[C@@H]1C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1 241738555 QYLYYCSSKMMEFE-OAHLLOKOSA-N 375.498 2.830 0 50 GFAA CC(C)c1ncc(-c2nc3cc(S(=O)(=O)N4CCCC4)ccc3n2C)cn1 82127079 BDPCODQZFIDSSS-UHFFFAOYSA-N 385.493 2.938 0 50 GFAA Nc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)ccn1 91487020 RHDNCBHGRLHMSD-UHFFFAOYSA-N 378.476 2.709 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4ccc(O)cc4)C3)CCC2=O)cn1 92022843 WWKLHWAZCVNDKE-QFIPXVFZSA-N 394.475 2.536 0 50 GFAA Cc1ccccc1CN1CCC(CN(C[C@@H]2CCCO2)S(C)(=O)=O)CC1 95500033 XSHJCMOAYPOVMD-FQEVSTJZSA-N 380.554 2.648 0 50 GFAA O=C(COc1ccccc1O)N[C@H]1CCCc2nc(-c3cccnc3)ncc21 91381773 PBBCCFWQOMEVHH-INIZCTEOSA-N 376.416 2.817 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cccc(OC(F)F)c2)[C@H]2C[C@@H](O)C2)c1 243893457 ARLMXKXJNIFUJV-QEORTHHSSA-N 378.375 2.934 0 50 GFAA CNC(=O)C1(NC(=O)c2cccc(-c3cccc([C@@H](C)O)n3)c2)CCCCC1 534632951 MTLNHXJNXMEDPG-OAHLLOKOSA-N 381.476 2.981 0 50 GFAA COc1ccc(CN2CCC3(CC[C@@H](CNS(=O)(=O)C(C)C)O3)CC2)cc1 299757415 HDBDEWRMCWHVIR-IBGZPJMESA-N 396.553 2.537 0 50 GFAA CCn1nc(C)c([C@H](C)NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1C 670470035 JFXVNCUWTWBKOM-ZDUSSCGKSA-N 379.482 2.721 0 50 GFAA O=S(=O)(NCCCN1CCC[C@H](CO)C1)c1ccc(-c2ccccc2)cc1 670470267 YLFQEZDZZHNXEU-SFHVURJKSA-N 388.533 2.726 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCc1ccc(F)cc1)CCCCC3 169777282 WSEHMXIWCSREMS-UHFFFAOYSA-N 382.439 2.688 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)c3ccccc3-n3cncn3)C2)n1 952971135 DMEKSLLNPPOSEC-OAHLLOKOSA-N 380.452 2.869 0 50 GFAA CNS(=O)(=O)c1cccc(CN[C@@H](C)c2nnn(-c3ccc(C)cc3)c2C)c1 268838991 MTNMNOAPXZITKF-HNNXBMFYSA-N 399.520 2.643 0 50 GFAA Cc1nc(Cn2cc(C(=O)NC[C@@H](C)c3c(Cl)cccc3Cl)nn2)no1 278753309 QHAYCIHJAKRPID-SECBINFHSA-N 395.250 2.858 0 50 GFAA Cc1cccnc1C(F)(F)C(=O)N1CCCc2ccc(S(C)(=O)=O)cc21 783095863 WIQAOOTUPCZMGW-UHFFFAOYSA-N 380.416 2.865 0 50 GFAA CCCCn1nc(C)cc1NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O 1529119395 GRLUMDCZDNMCNE-HNNXBMFYSA-N 378.498 2.785 0 50 GFAA O=C(c1cc(-c2ccc(Cl)cc2)[nH]n1)N1C[C@H](O)[C@H](Cc2ccncc2)C1 1704280183 REECDTBYPCDXBE-BEFAXECRSA-N 382.851 2.801 0 50 GFAA CC(C)CN1C[C@H]2CN(CCS(C)(=O)=O)C[C@@]2(CCc2ccccc2)C1 1772806227 ABHJRBQEFJVQJU-RTWAWAEBSA-N 378.582 2.554 0 50 GFAA CC(C)N1CCNC(=O)[C@H]1CC(=O)N(CCc1ccccc1)Cc1ccccc1 12075645 BORJYPJJAFGWRY-JOCHJYFZSA-N 393.531 2.857 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cc[n+]([O-])cc1 12454077 LEPCWRSWRXJMTJ-HXUWFJFHSA-N 397.519 2.745 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@H]1CCCN(C(=O)CCn2cnnn2)C1 12474829 VWTBLOZVXUURBT-FQEVSTJZSA-N 389.459 2.852 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3cc(C)on3)C2)cc1OC 15073603 QDSDUGYAPQGSES-QGZVFWFLSA-N 387.480 2.779 0 50 GFAA CCCCc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccncc3)CC2)cc1 16603132 MNLYOHCBCNGMEC-UHFFFAOYSA-N 387.505 2.571 0 50 GFAA Cc1nn2c(ncc3c(=O)n(-c4nc[nH]n4)ccc32)c1-c1cccc(Cl)c1 19962586 YBTPRCWFFJVKGC-UHFFFAOYSA-N 377.795 2.780 0 50 GFAA Cn1nc2c(c1C(=O)N1[C@H]3CC[C@@H]1[C@@](CO)(Cc1ccccc1)C3)CCCC2 1857677147 QOMMZZBAXYFMPH-WGGBDISSSA-N 379.504 2.897 0 50 GFAA Cn1cc(CC(=O)N2CC[C@H]3[C@@H]2CC(=O)N3Cc2cccnc2)c2ccccc21 1857685055 BDLMGSDMMNHGRJ-SFTDATJTSA-N 388.471 2.518 0 50 GFAA CC[C@@]1(C(=O)NCc2cnc(C)cn2)C[C@@H]2CC[C@H]1N2Cc1nc(C)c(C)n1C 1857719326 ISEYDJZQCMCPOZ-NNMXDRDESA-N 396.539 2.585 0 50 GFAA O=C(c1cncc(-c2cc3c(s2)C2(CCNCC2)OCC3)n1)N1CCCC1 1857732984 PQAGMWIOFMMKQH-UHFFFAOYSA-N 384.505 2.593 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC2CC2)C[C@H]1NC(=O)c1ccncc1Cl 1875246985 OSWXYJDCHRFSMH-JCURWCKSSA-N 379.888 2.707 0 50 GFAA CN(C(=O)c1cccnc1-n1cccn1)[C@@H]1CCCN(c2ccccc2)C1=O 115501783 HDRAPAFZZAJMOM-GOSISDBHSA-N 375.432 2.535 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1cccs1)N1CCN(c2cccc(O)c2)CC1 123267072 HNDWOIHPOLYIIT-SFHVURJKSA-N 399.516 2.797 0 50 GFAA CN(Cc1cccc(-c2nc(O)cc(C(F)(F)F)n2)c1)C[C@H]1COCCO1 20820470 PTFCZNKANWNMSR-AWEZNQCLSA-N 383.370 2.715 0 50 GFAA CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)NC(=O)Cc2cccc(F)c2)cc1 821536592 GRKJVXLAFWPVEX-UHFFFAOYSA-N 392.452 2.858 0 50 GFAA CC(C)C1CCC(N(C)c2ncnc3c2ncn3C2CC(CO)(CO)C2)CC1 1875269068 CBKWKEHHAZUAAX-UHFFFAOYSA-N 387.528 2.783 0 50 GFAA COCCn1nc2c(c1C(=O)N(C)Cc1nccn1C(C)C)C[C@H](C)O[C@@H]2C 1875316072 STDCDVIVFNXMCG-LSDHHAIUSA-N 389.500 2.601 0 50 GFAA O=C1C[C@H](c2ccccc2)S(=O)(=O)N1C[C@H]1OC(=O)C2(CCC2)C12CCC2 1875392094 RVUBXBIFMGFOAJ-HZPDHXFCSA-N 389.473 2.556 0 50 GFAA O=C1COc2cccc(C(=O)N[C@@H]3CCN(C(=O)CCCC4CCCC4)C3)c2N1 1875330733 ARBXXTKXFVXWTL-MRXNPFEDSA-N 399.491 2.709 0 50 GFAA O=C(Cc1ccc2nc(O)[nH]c2c1)N1C[C@H](C2CCNCC2)c2ccccc21 1875318364 HJWPXRMABFRDPT-QGZVFWFLSA-N 376.460 2.941 0 50 GFAA O=C(c1cc2nc(-c3cccs3)cc(C(F)(F)F)n2n1)N1CCOCC1 756465 JFJFMNYEFJABEO-UHFFFAOYSA-N 382.367 2.949 0 50 GFAA CC(C)C[C@H](C(=O)N1CCOCC1)N1C(=O)c2cc(Cl)c(Cl)cc2C1=O 991266 WWPXRYYAMKUCBA-OAHLLOKOSA-N 399.274 2.863 0 50 GFAA CCOc1ccc(N([C@@H](C)C(=O)Nc2ccc(OC)cc2)S(C)(=O)=O)cc1 1157558 ZHCDOYASASOTNJ-AWEZNQCLSA-N 392.477 2.887 0 50 GFAA COc1ccc(NC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)cc1 1426258 LJZKAHCPUQMTGJ-UHFFFAOYSA-N 385.420 2.577 0 50 GFAA CN(C[C@H]1Cc2ccccc2O1)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356159814 RGPJHWOXHFMREA-MRXNPFEDSA-N 398.528 2.975 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)c2ccc(-c3ccccc3)nc2O)C[C@H]1O 2356166681 IXONVMPSDUTSAX-UTKZUKDTSA-N 384.432 2.532 0 50 GFAA CCc1ccccc1N1CCN(S(=O)(=O)c2cc(F)ccc2OC)CC1 2856058 ASISZVYTEFFBAX-UHFFFAOYSA-N 378.469 2.908 0 50 GFAA C[C@@H]1CCCC[C@@H]1OCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1 248113176 YVICTHXNCOAIDP-QRQLOZEOSA-N 394.537 2.551 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)Nc3nncn3Cc3ccccc3)CC2=O)cc1 117736940 UAUPPSREIKNYIH-KRWDZBQOSA-N 375.432 2.626 0 50 GFAA Cc1cccc(-c2ccc(C(=O)N3CCC[C@@H](Cn4cc(CN)nn4)C3)o2)c1 20599693 WZAPNLGZRVESFI-MRXNPFEDSA-N 379.464 2.858 0 50 GFAA CC[C@@H]1C[C@H](C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)CCO1 328616396 BPBDHUYLOZFACW-PIKOESSRSA-N 376.545 2.857 0 50 GFAA O=C(Cc1csc(-c2cccnc2)n1)NCc1ccc(-n2ccnc2)nc1 363095334 AEYVLJDJIIBQOS-UHFFFAOYSA-N 376.445 2.645 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(Cc3ccc(C(=O)O)cc3)CC2)c(C)s1 262495433 YCHPQJDVPUXVRR-UHFFFAOYSA-N 394.518 2.570 0 50 GFAA CCCCCNC(=O)C[C@H]1COCCN1C(=O)c1c[nH]nc1C1CCCCC1 72421189 IKYOIQUOGGHWPC-KRWDZBQOSA-N 390.528 2.995 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCN(c3ncnc4ccccc34)CC2)c1C 72478283 RYJNDQQXJRLELB-UHFFFAOYSA-N 377.448 2.740 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)N[C@H]1CCCn2ncnc21 175952574 JAPAZIGDMRJLFX-KRWDZBQOSA-N 382.468 2.951 0 50 GFAA O=C(CCc1cc(Cl)no1)N1CC[C@]2(CCCN(CC3CCC3)C2=O)C1 91793902 RECHFLIWLYLUST-LJQANCHMSA-N 379.888 2.902 0 50 GFAA Cc1ccc2nc(CNC(=O)CCc3nc4ccccc4[nH]c3=O)[nH]c2c1C 91440164 HKJDJVDBFYCUMR-UHFFFAOYSA-N 375.432 2.665 0 50 GFAA CCCc1cc(N2CCC(N3CCN(c4ccccn4)CC3)CC2)nc(C)n1 95523927 SZTLKHPZZIBRTM-UHFFFAOYSA-N 380.540 2.924 0 50 GFAA CCN(C(=O)Nc1ccc(Oc2ccccc2)nc1)[C@H]1CCS(=O)(=O)C1 96165459 HEXQEGIDDNDZDF-HNNXBMFYSA-N 375.450 2.915 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95377065 KPHNHMIHYZLEHP-LAUBAEHRSA-N 380.492 2.588 0 50 GFAA CC(=O)N1CCc2cc(C(=O)NC[C@H]3CCN(c4ccccc4F)C3)ccc21 293227492 JTLTUOIQPCYNIM-MRXNPFEDSA-N 381.451 2.991 0 50 GFAA O=C(Cc1ccccc1Cl)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 180290215 MUVDUQHHVXGYRH-MRXNPFEDSA-N 384.929 2.736 0 50 GFAA COc1ccc(NC(=O)CCc2c(C)nc3c4ccccc4nn3c2O)cn1 253537170 DUKPLMIXGSJTSI-UHFFFAOYSA-N 377.404 2.871 0 50 GFAA Cc1ccc(N2CCCC2=O)c(C(=O)NCCc2ccc(OCC(=O)O)cc2)c1 299752635 UUYPCIPZBGZWMM-UHFFFAOYSA-N 396.443 2.558 0 50 GFAA COc1cccc(CNC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)c1 263619196 XKXIFXUAHSTNBB-GOSISDBHSA-N 382.395 2.627 0 50 GFAA O=C(CCCc1ccc(Cl)cc1)N[C@@H]1C[C@H](C(=O)NC2CCC2)C[C@H]1O 1940197282 FLAVLTCWZIMBNB-BMGDILEWSA-N 378.900 2.587 0 50 GFAA COC(=O)c1ccc(-c2cccc(C(=O)N(C)[C@H]3CCN(C)C3)c2)cc1OC 584896108 RKNXMHWTZSTHRB-SFHVURJKSA-N 382.460 2.925 0 50 GFAA COc1cccc(OC[C@H](O)CNC2CCN(c3ccc(F)c(F)c3)CC2)c1 952981443 WRNHDHNKTXRDNH-QGZVFWFLSA-N 392.446 2.972 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCC[C@@H](N)C3)cc2)c(C)c1Br 191372124 HKBYNQRHAXUDKC-CQSZACIVSA-N 377.286 2.815 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2cccc3nsnc23)[C@H](c2ccccc2)CO1 194789676 APDTXAYTPTZMRU-WFASDCNBSA-N 375.475 2.842 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@@H]2CCCN(C(=O)c3cccs3)C2)s1 1506403526 PYDZTRBRZXUYPB-GFCCVEGCSA-N 378.523 2.979 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N[C@@H]3COC[C@H]3Cc3ccncc3)o2)CC1 1529167509 MNNGQQKRCINPSP-UYAOXDASSA-N 383.492 2.894 0 50 GFAA COc1ccc([C@]2(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)CC2(C)C)cc1 1704311835 DMKAMACYLLVVMA-QFIPXVFZSA-N 384.524 2.985 0 50 GFAA COC(=O)c1ccc(CNCC[C@H]2CCC(=O)N2CCCc2ccncc2)cc1 11787665 RLAUTVFSVAEBPP-OAQYLSRUSA-N 395.503 2.972 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)c3cccc(C)c3)C2)nn1 12245032 OCDJLJLYGWGQSW-KRWDZBQOSA-N 383.496 2.621 0 50 GFAA Cc1ccc(N2C[C@@H](c3nnc(NC(=O)[C@@H]4CCCO4)s3)CC2=O)cc1C 12862817 YHRQQZAGTRGURR-ZFWWWQNUSA-N 386.477 2.793 0 50 GFAA Cc1cccc(OCC(=O)Nc2ccc3c(c2)nc(CN2CCOCC2)n3C)c1 16651719 JSYWBIUWWMDIHY-UHFFFAOYSA-N 394.475 2.731 0 50 GFAA CSCC[C@@H](NC(=O)c1cc(-c2ccco2)[nH]n1)c1nnc2ccccn12 206251740 DMOZNCZURUXXQB-GFCCVEGCSA-N 382.449 2.937 0 50 GFAA CCc1cc(C(=O)N(CC(=O)NC)CC2CCC(C(C)C)CC2)cn(C)c1=O 1857527605 UFZRMCPHXYNAGU-UHFFFAOYSA-N 389.540 2.598 0 50 GFAA CCOc1ncccc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857697827 NZBGQNHBJGJKGX-JOCHJYFZSA-N 394.475 2.974 0 50 GFAA COc1ccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)cn1 1857736221 FQAJPDZKMMRCQG-OKZBNKHCSA-N 387.867 2.688 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCc4c(O)nc(C5CC5)nc43)CC2)cn1 1857738055 PPPSVUCBKIPWEP-UHFFFAOYSA-N 380.448 2.583 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)CC3CCCC3)C2)nn1 12201871 VLPYPIVICKYCNH-QGZVFWFLSA-N 375.517 2.579 0 50 GFAA Cc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2F)cnn1-c1cccc(Cl)c1 1875259217 DFRPTHABORKOJU-QGZVFWFLSA-N 386.814 2.930 0 50 GFAA CCn1nc(C)c(-c2cs/c(=N/c3ccccc3)n2C[C@@H]2CNC(=O)C2)n1 1875266212 ZVCCTKHXAKGSBR-WDWGUKLMSA-N 382.493 2.505 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)NCC1(c2ccccn2)CCC1 1875400651 HYBKEJPRBDPFBS-NVXWUHKLSA-N 396.495 2.520 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](N3CCN(c4cccc(Cl)c4)CC3)C2=O)cc1 100037205 JLTNYZGRBNLCAA-LJQANCHMSA-N 399.878 2.803 0 50 GFAA CCC[C@H](OC)C(=O)NC1(C)CCN(C(=O)CC[C@H]2CC(C)(C)CO2)CC1 2325793685 DHUKGPOINKRWCP-IRXDYDNUSA-N 382.545 2.894 0 50 GFAA Cc1cc(-c2cccc3c2OCC(=O)N3)ccc1C(=O)N1CCC[C@@H](C(=O)O)C1 2325806733 CYNUNNLEAOEIIB-OAHLLOKOSA-N 394.427 2.930 0 50 GFAA O=C(O)CC1[C@H]2CCC[C@H]1CN(C(=O)c1c(C(F)F)nc3cnccn13)C2 2325812828 LDTAPUKKFHOMNH-QWRGUYRKSA-N 378.379 2.630 0 50 GFAA O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 794195 WKLJTSBXAWSUKP-IRXDYDNUSA-N 394.493 2.691 0 50 GFAA COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC(=O)c2ccccc2)c(OC)c1 956315 IJVPRROYGNQAKN-SFHVURJKSA-N 396.399 2.715 0 50 GFAA COc1ccc(OC)c(NC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)c1 957801 NOHZTRSHTBKTRP-UHFFFAOYSA-N 399.472 2.993 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356157647 PJGBBJGSKMGDOC-DENIHFKCSA-N 378.428 2.688 0 50 GFAA CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cccnc3)CC2)cc1 8421690 CFLVUFKJZUZLJE-INIZCTEOSA-N 387.505 2.742 0 50 GFAA Cc1cc(-c2noc(CCC(=O)NC(C)(C)C(=O)N3CCCC3)n2)ccc1F 225448608 QRMMFJZKTHMMLF-UHFFFAOYSA-N 388.443 2.634 0 50 GFAA COc1cc(S(=O)(=O)NC[C@@H]2CCCCC2(F)F)cc(C(=O)O)c1OC 414332572 VKPRJYRNRBHNDO-JTQLQIEISA-N 393.408 2.506 0 50 GFAA Cc1ccccc1-n1c(Cn2ncc3c(N)ncnc32)nc2cccc(C)c2c1=O 51768817 KQDBVHKNIYROHU-UHFFFAOYSA-N 397.442 2.773 0 50 GFAA in-vitro CSCCCN1CCC(N2CCC[C@@H](C(=O)NCc3cccnc3)C2)CC1 71479397 UQYYUOIGFUSRLK-LJQANCHMSA-N 390.597 2.627 0 50 GFAA Cc1nc(CCC(=O)N2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n[nH]1 72141793 DJKZALDHJAEYDR-LJQANCHMSA-N 387.503 2.944 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)OC[C@@H]2Sc3ccccc3NC2=O)cc1 4107907 RBRROENIHDLYLJ-HNNXBMFYSA-N 392.458 2.523 0 50 GFAA CN1CCN(c2oc(-c3cccs3)nc2S(=O)(=O)c2ccccc2)CC1 4271790 WGXCCGRRPCONNE-UHFFFAOYSA-N 389.502 2.988 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)CC1 434169247 HMBWGMHPYMXJEB-CQSZACIVSA-N 397.479 2.884 0 50 GFAA CO[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc3ccccc3c2O)C1 363092950 RBGUDKRZGXJLJA-APWZRJJASA-N 382.460 2.787 0 50 GFAA CN(C)c1ccc(-c2cncc(C(=O)N[C@@H]3CC(=O)N(C(C)(C)C)C3)c2)cc1 151524977 UXCZIUVKVSALQL-GOSISDBHSA-N 380.492 2.944 0 50 GFAA CN(C)CCn1ccc2ccc(NS(=O)(=O)c3ccc4c(c3)CCO4)cc21 127385712 DGVHNMJRHISTFZ-UHFFFAOYSA-N 385.489 2.939 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CCCN(c3ncnc4[nH]ccc34)C2)CC1 72158266 PWSTZYVYRZZNET-QGZVFWFLSA-N 392.507 2.758 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](N3CCc4ccccc4C3)C2)cnc2ccnn12 72164076 IIZVDSLROZCITG-IBGZPJMESA-N 375.476 2.701 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCCNC1)c1ccccc1 238142161 IGCFUOWWCOPLJM-FPOVZHCZSA-N 379.504 2.534 0 50 GFAA O=C1C[C@H](NC(=O)CCCc2nc(-c3cccnc3)no2)c2ccccc2N1 222528484 OMWJIBLFDMXPKP-INIZCTEOSA-N 377.404 2.654 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 158916866 XWGIKTTWVRIYBZ-LJQANCHMSA-N 390.487 2.776 0 50 GFAA Cc1nc(CCNC(=O)N(C)Cc2cc(-c3cccnc3)no2)nc2c1CCC2 426413043 VPFIZEWICIXJRV-UHFFFAOYSA-N 392.463 2.708 0 50 GFAA O=C(NC[C@@H]1CCCN(CCc2ccccc2)C1)N1CCC(n2cnnc2)CC1 426399073 RVXKKOUJOFHOKT-FQEVSTJZSA-N 396.539 2.579 0 50 GFAA O=C(NCCc1nc2cc(Cl)ccc2[nH]1)c1coc(CN2CCOCC2)c1 95370641 PXMWNZLKDARKJO-UHFFFAOYSA-N 388.855 2.614 0 50 GFAA CCC(=O)Nc1ccc(F)c(NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)c1 96141455 OKBIHLNQCAXAAZ-CQSZACIVSA-N 386.431 2.755 0 50 GFAA Cc1cc(N2CCC(NCc3nnc(N)s3)CC2)nc(-c2ccccc2)n1 96137907 XTYYKNULWXFAOT-UHFFFAOYSA-N 381.509 2.644 0 50 GFAA C[C@@H]1[C@H](N2CCOCC2)CCN1C(=O)c1csc(Cc2ccc(F)cc2)n1 291454124 NKZUZDMMJXXTLH-RDTXWAMCSA-N 389.496 2.808 0 50 GFAA Cc1ccc(NS(C)(=O)=O)cc1NC(=O)N[C@H]1COC2(CCCCC2)C1 96180269 UFORAJKQNCAMGF-OAHLLOKOSA-N 381.498 2.980 0 50 GFAA Cc1cc(=N/C(O)=C2\C=C(c3ccccc3)N=N2)n([C@@H]2CCS(=O)(=O)C2)[nH]1 334159291 VGEYAFDIBLNVPJ-UZIMHIHGSA-N 385.449 2.619 0 50 GFAA COc1cccc(-c2ccc(NC(=O)[C@@H]3CCCN(S(C)(=O)=O)C3)cc2)c1 95526409 HYDRQWBSAMGYPD-QGZVFWFLSA-N 388.489 2.972 0 50 GFAA CCCCn1ccnc1C1CCN(c2cc(N3CCC(O)CC3)ncn2)CC1 95501461 NOJNTZVFZCTZCH-UHFFFAOYSA-N 384.528 2.818 0 50 GFAA CN(c1ccccc1)c1ccc(C(=O)NC2(c3ncon3)CCOCC2)cn1 184256959 JHDWFTBOLCGEEW-UHFFFAOYSA-N 379.420 2.668 0 50 GFAA CC(C)S(=O)(=O)N(Cc1cc(-c2cnn(C)c2)no1)c1ccccc1F 184440890 KVWYGLSGRGKZEP-UHFFFAOYSA-N 378.429 2.959 0 50 GFAA O=C(NCc1ccncc1)[C@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263616597 JQDRNEDIGPLIQX-KRWDZBQOSA-N 390.491 2.536 0 50 GFAA COc1ccc([C@H](NC(=O)/C=C/c2cnc(N(C)C)nc2)c2ccncc2)cc1 824654095 HQWUUKGSLBAAFC-ZSIUJALASA-N 389.459 2.865 0 50 GFAA CCc1cc(N2CCN(Cc3cnc(NCc4ccccc4)nc3)CC2)ncn1 823557562 UVVXPPGNAGDNTO-UHFFFAOYSA-N 389.507 2.763 0 50 GFAA O=C(NCCCn1ccccc1=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 584903848 UKYSKYPRRJSQAJ-MRXNPFEDSA-N 380.448 2.969 0 50 GFAA COCCN1C(=O)C[C@@H](CNC2CC(c3ccccc3C)C2)[C@@H]1c1cnn(C)c1 275420614 DOTPDIVKFYIDOD-IOORSOFGSA-N 396.535 2.800 0 50 GFAA Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)N2CCN(c3ncccn3)CC2)cc1 170645001 MEBINYKNDHTMPK-PMACEKPBSA-N 395.507 2.785 0 50 GFAA O=C(c1scc2c1OCCO2)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529172497 INHUDYYTQNBUHS-PBHICJAKSA-N 396.468 2.743 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)N1C[C@H]3[C@H]4CC[C@H](N4)[C@H]3C1)C2 1775981902 KDXIPUPOSFEAHU-LJIZCISZSA-N 398.532 2.729 0 50 GFAA CCCC[C@H]1CN(CC(=O)N(C)CCc2cnn(C)c2)Cc2ccccc2O1 12098995 GERRMMIIEJAIGW-FQEVSTJZSA-N 384.524 2.874 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)CCc3ccccc3)C2)nn1 12160060 ULBDJDAIPRJVLJ-LJQANCHMSA-N 397.523 2.632 0 50 GFAA O=C(NCCCOc1cccnc1)c1coc(Cn2cnc3ccccc32)n1 12445623 XFQBLEWFVMFMCO-UHFFFAOYSA-N 377.404 2.667 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCO[C@@H](Cc2ccccc2Cl)C1 12836182 VLNJURBCICEKES-KRWDZBQOSA-N 378.900 2.903 0 50 GFAA CN1CCN(C(=O)c2cnn3c2N[C@@H](c2ccccc2)C[C@@H]3C(F)(F)F)CC1 13124602 YHYMFGJYGJMYJJ-HZPDHXFCSA-N 393.413 2.931 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1ccc(C)o1)C2 14536919 HSXGRYDWRTXMSZ-OAHLLOKOSA-N 388.537 2.641 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@H](NCc1cccs1)C2 14741948 WVGBHVXGVPDULC-INIZCTEOSA-N 395.532 2.937 0 50 GFAA O=C(c1cccs1)N1CCC(c2n[nH]c(=O)n2Cc2ccc(F)cc2)CC1 169770457 ZQGRBBNTYWMZMA-UHFFFAOYSA-N 386.452 2.840 0 50 GFAA Cc1ccc(C(=O)N[C@H]2C[C@H](Cn3cccn3)C[C@@H]2O)cc1Oc1ccncc1 1857527119 CFVMNVORDXEARR-VDGAXYAQSA-N 392.459 2.948 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccsc3)C[C@]23CC[C@H]1O3)c1cscn1 1857724368 XIMONTORTSZIQI-GARXJVFOSA-N 375.519 2.614 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1C 1857731341 PVZRFISCRBHMJV-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA COCCn1cc2c(n1)[C@@H](NC(=O)N1Cc3ccccc3N(C)C[C@@H]1C)CCC2 332855145 CAXHAZMMSWVRIG-LPHOPBHVSA-N 397.523 2.957 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)[C@@](C)(O)C[C@@H](C(=O)OC(C)C)[C@@H]1c1ccc(F)cc1 245238273 IHNLSGUEYFDDLL-JJDSTIRJSA-N 394.439 2.769 0 50 GFAA Cc1csc([C@@](O)(CC(=O)Nc2ncc(Cl)cc2O)C(F)(F)F)n1 1875286552 VOOFQVZCPDXXGB-LBPRGKRZSA-N 381.763 2.984 0 50 GFAA C[C@@]1(F)CCCCN(C(=O)N[C@H](C(=O)N2CCOCC2)c2ccccc2)C1 1875265853 PSGOHWAZLQFIBU-FXAWDEMLSA-N 377.460 2.510 0 50 GFAA O=C(N[C@H](Cc1ccccc1)CC1CCCCC1)c1cc(=O)n2[nH]cnc2n1 1875260025 YWIJADPFEYRVEB-QGZVFWFLSA-N 379.464 2.729 0 50 GFAA CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCc2c(O)nc(O)nc2C1 1875304096 ZUYCCYNXXQTQHE-RDTXWAMCSA-N 382.464 2.915 0 50 GFAA O=C(O)Cc1ccc(C(=O)N2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1 2325759691 CFXJKLJCQJCKCU-UHFFFAOYSA-N 384.407 2.944 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1)c1ccncc1 1055971 FECIFCGQDSNJJD-UHFFFAOYSA-N 381.457 2.855 0 50 GFAA COC(=O)Cc1ccc(NC(=S)N2CCN(c3cccc(OC)c3)CC2)cc1 1111458 LSHFPDFDMCLPJV-UHFFFAOYSA-N 399.516 2.930 0 50 GFAA Cc1nn(C)c(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)c1C 2356145665 HIGAMCOJXNGTOZ-QHCPKHFHSA-N 394.519 2.877 0 50 GFAA CCc1nc(O)ccc1C(=O)N1Cc2cnc(Cc3ccc(OC)cc3)nc2C1 2356148712 OIBLAIZRRPQAMN-UHFFFAOYSA-N 390.443 2.895 0 50 GFAA COc1ccc(NC(=O)c2cnc3sc4c(n3c2=O)CCCC4)cc1OC 10327400 SAVWZNXIYAMAID-UHFFFAOYSA-N 385.445 2.904 0 50 GFAA CCn1cc([C@@H]2C[S@@](=O)CCN2C(=O)Cc2ccc(C(F)(F)F)cc2)cn1 225417434 ADPMENDGTIKJMW-OQRWROFFSA-N 399.438 2.797 0 50 GFAA COc1ccccc1/C=C(/C(=O)NC[C@@H](CO)[C@H]1CCOC1)c1ccccc1 225488549 URBRQVCTHMKOTI-LAAGDHCCSA-N 381.472 2.997 0 50 GFAA CC(C)Cc1ccc(CN2C[C@H](O)[C@@H](N3CCN(c4ccccn4)CC3)C2)cc1 23358854 DXVFWCPUZKZJSK-GOTSBHOMSA-N 394.563 2.647 0 50 GFAA COc1ccccc1CN(Cc1ccc(CN(C)S(C)(=O)=O)o1)C1CC1 55253794 JDFOVOKZESEHCM-UHFFFAOYSA-N 378.494 2.844 0 50 GFAA CC(C)c1noc(CCNC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)n1 115825608 NTOJBKDHIDTMJZ-MRXNPFEDSA-N 385.468 2.573 0 50 GFAA COCCN1CCC(CN(Cc2cnc(SC)nc2)C[C@H]2CCCO2)CC1 55270885 VNYOJZCAIRFJSV-LJQANCHMSA-N 394.585 2.538 0 50 GFAA COc1ccc([C@@H](CC(C)C)NC(=O)C2CCN(S(C)(=O)=O)CC2)cc1 65362169 FOYBHZISJAXETP-GOSISDBHSA-N 382.526 2.570 0 50 GFAA CC[C@@H](C(=O)N1CCCn2nc(C(=O)Nc3ccccc3)cc2C1)n1cccn1 65467472 OFNGFMVLCYVRTQ-IBGZPJMESA-N 392.463 2.716 0 50 GFAA CCc1nc(CN2CCOc3c(O)cc(-c4nc(C)cnc4C)cc3C2)no1 67908280 GJNZHLUTECAORT-UHFFFAOYSA-N 381.436 2.806 0 50 GFAA O=C(NC1CCCC1)c1cn(C2CCN(c3nc4ccccc4o3)CC2)nn1 67713261 RXAXTZITIGTOAB-UHFFFAOYSA-N 380.452 2.933 0 50 GFAA O=C(c1cc(=O)[nH]c2cc(F)ccc12)N1CCC(C(=O)O)(c2ccccc2)CC1 238068868 HLERAPVEAYKAIF-UHFFFAOYSA-N 394.402 2.926 0 50 GFAA Cc1nnc(NS(=O)(=O)c2ccc3c(c2)CN(C(=O)C(C)(C)C)CC3)s1 77555866 WHGWFZCOMSRLAL-UHFFFAOYSA-N 394.522 2.578 0 50 GFAA CCc1ccc(CN(Cc2ccccc2OC)C(=O)[C@@H]2C[C@H](N)CN2C)cc1 216231784 LZDOVGAAPCCFGW-SFTDATJTSA-N 381.520 2.818 0 50 GFAA O=C(O)c1cc(-c2ccc(F)cc2)cc(S(=O)(=O)N2CCSCC2)c1 72149121 KXVSDOJPDQSSFL-UHFFFAOYSA-N 381.450 2.928 0 50 GFAA CN1CCCN(C)C2(CCN(C(=O)CCSCc3ccccc3)CC2)C1 221360803 QOXXSRVDGJJQFI-UHFFFAOYSA-N 375.582 2.938 0 50 GFAA CC(C)c1csc(C(=O)N[C@@H]2COCC[C@H]2Oc2ccc(CO)cc2)n1 223088100 BSMUFPOGJJIKEF-NVXWUHKLSA-N 376.478 2.725 0 50 GFAA CC(C)(CN1CCCC1)CN1CCCn2nc(CNC(=O)C3CCC3)cc2C1 82160471 MFLXORUTNLEXEU-UHFFFAOYSA-N 387.572 2.627 0 50 GFAA Cc1cc(C(=O)Nn2c(=S)[nH]c3sc(C(=O)O)c(C)c3c2=O)cs1 17077978 XUOSSXWPBOLUSM-UHFFFAOYSA-N 381.460 2.881 0 50 GFAA C[C@@H](O)CNC(=O)NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1 426571630 PGJKMAJOOUUCRY-LJQANCHMSA-N 381.520 2.900 0 50 GFAA C[C@@H](Cc1ccccn1)NC(=O)N1CCC(C(=O)NCc2ccccc2)CC1 426634127 YLXSDAQOZVCCDH-KRWDZBQOSA-N 380.492 2.751 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 226124261 GDCZQRJGPIDFRI-LVQVYYBASA-N 399.274 2.520 0 50 GFAA CCCCN1CCn2nc(CNC(=O)Cc3ccc4nc(C)[nH]c4c3)cc2C1 426405149 NMFWLNRKTWBNJM-UHFFFAOYSA-N 380.496 2.542 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)N[C@H]1CCN(c2ncccc2Cl)C1 177440468 UUFYLISCJQNKAJ-INIZCTEOSA-N 381.867 2.858 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ncn(Cc2ccc(C)cc2)n1 20606625 DPIUJAAGBCAIIK-GOSISDBHSA-N 380.404 2.933 0 50 GFAA CC(=O)NC[C@H]1CCC2(CCN(C(=O)Nc3cccc4cccnc34)CC2)O1 97819594 IOTSYWQAFOGLFH-QGZVFWFLSA-N 382.464 2.916 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NCCCN3CCNC(=O)C3)cc2)cc1Cl 426537844 ZMYHMNBINIIHJH-UHFFFAOYSA-N 385.895 2.867 0 50 GFAA Cc1oc2c(c1C(=O)N1CCC[C@@H](CNC(=O)c3cccnc3)C1)C(=O)CCC2 95498243 JMBIKCAUFBFFDC-HNNXBMFYSA-N 395.459 2.784 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95507967 GHKSMHDQOGOOIM-HNNXBMFYSA-N 376.464 2.558 0 50 GFAA NC[C@@H]1CCCCN1C(=O)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91416686 UISJHLGYXQPSMM-NSHDSACASA-N 395.290 2.621 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(S(=O)(=O)c3ccccc3C(=O)O)C2)cc1 95367914 BEWCIEBKHJJJEC-HNNXBMFYSA-N 389.429 2.651 0 50 GFAA CC(C)(O)Cn1nc(Cc2cccs2)nc1CCN1CCCCCC1=O 828263775 NKPHWDBTNXJOKN-UHFFFAOYSA-N 376.526 2.646 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)NCc1ccc2c(c1)CCO2 828027320 VVURXKWKYHCOQO-UHFFFAOYSA-N 382.445 2.865 0 50 GFAA C[C@H]1Sc2ccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)O)cc2NC1=O 268941790 KGZUSBNZMWLPRH-BZNIZROVSA-N 382.441 2.771 0 50 GFAA O=C(NS(=O)(=O)c1ccc2c(c1)CCC2)c1csc([C@@H]2CCCO2)n1 165279852 DUQLKTNOPQWYJA-HNNXBMFYSA-N 378.475 2.602 0 50 GFAA CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)c1ccc(-c2cncnc2)cc1F 185828746 HAFQOLXDKGKVSU-LJQANCHMSA-N 399.514 2.771 0 50 GFAA C[C@H](CS(=O)(=O)NC(=O)c1csc([C@H]2CCCO2)n1)c1ccccc1 167004043 GVDJSUAJJODQQL-IUODEOHRSA-N 380.491 2.858 0 50 GFAA CN(C)CCOc1ccc(NC(=O)C(=O)N2CCc3ccccc32)cc1Cl 170603175 WFVSYLXMQUYBSI-UHFFFAOYSA-N 387.867 2.808 0 50 GFAA COc1ccc(-n2nc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)O)cc2C)cc1 190731417 IAAIYVXPBROLIQ-FQEVSTJZSA-N 391.427 2.841 0 50 GFAA CC(C)c1c(NC(=O)N2CCS(=O)(=O)CC2)cnn1-c1ccccc1Cl 191695753 QXACZQJRIPNEGF-UHFFFAOYSA-N 396.900 2.911 0 50 GFAA CS(=O)(=O)c1ccc(NC(=O)Nc2cc(CC3CCCCC3)n[nH]2)cn1 192221566 IMKNHZHXHVDHME-UHFFFAOYSA-N 377.470 2.975 0 50 GFAA COc1ccc(NC(C)(C)C(=O)NC2CCN(C(=O)N3CCCC3)CC2)cc1 1506418606 TWMFNUYTLKNVLP-UHFFFAOYSA-N 388.512 2.682 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N3CCC[C@@H](Cn4ccnc4)C3)o2)c1C 1506395901 JMTXOZFKPHDAML-HNNXBMFYSA-N 390.465 2.849 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC2(CC1)COC(=O)O2 1506414124 ONWPRAUVVDHGEF-UHFFFAOYSA-N 389.857 2.737 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)c3ccc(-c4noc(C5CC5)n4)cc3)C[C@@H]12 1704300113 VDMVHGPQMUOJMY-XMSQKQJNSA-N 396.491 2.533 0 50 GFAA Cc1ncc(CN(CCN(C)C)Cc2cnc(NCc3ccccc3)nc2)[nH]1 1772705026 VJTKWSFXFWVIHZ-UHFFFAOYSA-N 379.512 2.684 0 50 GFAA Cc1nn(C)cc1CN1CCC2(CC[C@@H](CNC(=O)c3ccccc3)O2)CC1 11815496 MYGIUHOJQFRKHH-FQEVSTJZSA-N 382.508 2.672 0 50 GFAA Cc1ccc2[nH]c(C3CCN(C(=O)c4cn(C[C@H]5CCCO5)nn4)CC3)nc2c1 11935417 SCDAZAIHFYUCNI-MRXNPFEDSA-N 394.479 2.662 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3ccc4c(c3)CCO4)CC2)C1 12442035 MFHNCPNXDCVDAP-LJQANCHMSA-N 383.536 2.577 0 50 GFAA COc1cc(Cl)ccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1 19863541 ITFSUVBKSDOFQA-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 169749848 LAHPGWQZRRLEHV-UHFFFAOYSA-N 391.475 2.646 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)Cc4ccccc4Cl)nnc3c2)n1 169776169 FRCUWMXELFCRDN-UHFFFAOYSA-N 396.838 2.854 0 50 GFAA NC(=O)[C@@H]1C[C@@H]2CN(C3CC4(CCCCC4)C3)CC(=O)N2[C@@H]1c1ccccc1 1857686225 MHKAPWOPYCXUSA-YFVAEKQCSA-N 381.520 2.859 0 50 GFAA CCOc1ccc2[nH]c(=O)c(-c3nccn3C[C@H]3Cc4nnc(C)n4C3)cc2c1 1857703322 YZIMTOGNFZINOX-CQSZACIVSA-N 390.447 2.563 0 50 GFAA Cn1nc(C(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)c2ccccc21 1857712091 KXSZWGQVJQVFPQ-IIBYNOLFSA-N 386.455 2.797 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H]3[C@H](CNC(=O)C4(C)CC4)[C@H]4CC[C@]3(C2)O4)c1C 1857712457 PDBPYCHZZJEQHB-RTXPOLOASA-N 382.504 2.839 0 50 GFAA COc1ccc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1O 1857713831 TXIFTUAEJQFMJM-SJBKTWHCSA-N 380.444 2.675 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1ccccc1Cn1cccn1)C[C@H]2O 1857722474 JLOGAFCRNIADJU-MOUTVQLLSA-N 389.499 2.500 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(Cc3cn4cc(C)ccc4n3)C[C@]23CC[C@H]1O3 1857732610 YCKNFVHTEQSQTH-JZJXAQOMSA-N 382.508 2.538 0 50 GFAA CCNC(=O)c1ccc(N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)nn1 413187707 VVEVJXNGJVGJHS-HNNXBMFYSA-N 380.370 2.823 0 50 GFAA O=C(CCCNC(=O)C1CC1)N[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)OCc1ccccc1 229897024 KSZKONQNRCZRGW-JYAXBFRTSA-N 398.503 2.567 0 50 GFAA O=C(Cc1cncn1Cc1ccccc1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 253433463 XKDZVAFMGQKPNS-JAXLGGSGSA-N 378.520 2.807 0 50 GFAA CN(C)CCn1nnc2c1C[C@H](c1nc(-c3cc4ccccc4o3)no1)CC2 952894593 ODUDRSVQLIBNJX-CQSZACIVSA-N 378.436 2.908 0 50 GFAA COC(=O)c1cc(C2CCN(C(=O)Nc3ccc(F)c(OC)c3F)CC2)[nH]n1 1875301997 WIACTEJWPVTNOG-UHFFFAOYSA-N 394.378 2.895 0 50 GFAA CC(C)Oc1ccccc1-c1cccc2c1CN([C@H]1CCC(=O)NC1=O)C2=O 1875328563 YQWQRSIDJVTWAK-SFHVURJKSA-N 378.428 2.902 0 50 GFAA COC(=O)[C@H](CNC(=O)[C@H](N)CC1CC(F)(F)C1)Cc1ccc(Cl)cc1 1875305069 FNCFQHKIXRVDCA-DZGCQCFKSA-N 388.842 2.551 0 50 GFAA CN(C(=O)c1[nH]cnc1C(=O)c1ccccc1)C1CCN(c2ccncc2)CC1 2325859954 RBUVQBKLEOOEKK-UHFFFAOYSA-N 389.459 2.777 0 50 GFAA C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)NCc1ccco1 894785 VJKPDVWFEWWILK-OAHLLOKOSA-N 391.427 2.967 0 50 GFAA COc1ccc(C)cc1NC(=O)CN(c1cccc(C(C)=O)c1)S(C)(=O)=O 4813684 FJTSHLWKUXXHNF-UHFFFAOYSA-N 390.461 2.611 0 50 GFAA CN(C)CCCNC(=O)C(=O)Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1 4813717 ZUYJYEAJOWLGLU-UHFFFAOYSA-N 390.553 2.617 0 50 GFAA CC(=O)N(CCC(=O)N1CCc2c(nc(C(C)C)n2C)C1)Cc1ccccc1 112670737 YPTDSPFDCSNNBC-UHFFFAOYSA-N 382.508 2.867 0 50 GFAA C[C@H]1CN([C@H](CNS(=O)(=O)CCCF)c2c(F)cccc2Cl)CCO1 245412504 ASGPQCMAPIWDAO-SWLSCSKDSA-N 396.887 2.520 0 50 GFAA Cc1ccc2c(c1)CCCN2C(=O)CN(C)Cc1nc(-c2cccnc2)no1 65410325 OLXHUMGUOAYIPV-UHFFFAOYSA-N 377.448 2.851 0 50 GFAA CCC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccccc3OC)CC2)cc1 20472129 ILFMELQOXITTOP-LJQANCHMSA-N 398.503 2.850 0 50 GFAA Cc1cc(C)c2nc(-c3cncnc3)cc(C(=O)N[C@H](C)Cn3cncn3)c2c1 63833860 OIGVKONKPKJRKY-OAHLLOKOSA-N 387.447 2.719 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(C)c(C)c3)CC2)cc(-n2cccn2)n1 65362857 YYXJENDVRHNZTC-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CC1=NN(C(=O)[C@@H](C)Cn2nc(C(F)(F)F)cc2C)[C@@](O)(C(F)(F)F)C1 6787452 LBJVAORUMNJEIL-MADCSZMMSA-N 386.296 2.706 0 50 GFAA COc1cccc(CS(=O)(=O)C[C@H](O)Cc2ccc(C(F)(F)F)cc2)n1 122589405 IJXISEOLQSBKTD-OAHLLOKOSA-N 389.395 2.627 0 50 GFAA CCO[C@H](C)c1noc(CN2CCCC[C@@H]2c2ccc(C(=O)NC)n2C)n1 328623675 CBKPTMCBBFHTDV-UKRRQHHQSA-N 375.473 2.592 0 50 GFAA CC(C)(C)NC(=O)CSC1=N[C@](C)(c2ccc(Br)cc2)C(=O)N1 253400393 BDKNGNYJSHGZOH-MRXNPFEDSA-N 398.326 2.798 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1CCCN(c2ccccc2)C1 363220368 ZGFNVTIIBXHTNH-GOSISDBHSA-N 376.464 2.736 0 50 GFAA C[C@@H]1CCCN(C(=O)C2CCN(C(=O)N[C@H]3CCN(c4ccccc4)C3)CC2)C1 363392381 HGLYOWFXRQGLAR-QUCCMNQESA-N 398.551 2.945 0 50 GFAA Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CCC(O)(CN)CC1 331885077 IGJLLUUARLSHFH-UHFFFAOYSA-N 384.263 2.883 0 50 GFAA CCc1c(C(=O)NCC[C@H]2CCNC2)cnn1-c1ccc(Br)cc1 262577162 JZBVXUVYPDXCCR-CYBMUJFWSA-N 391.313 2.927 0 50 GFAA CCN1C(=O)[C@@H]2CN(C(=O)c3sccc3-c3ccc(C)cc3)CCN2C1=O 369382792 FOQGYULRSYPVJP-INIZCTEOSA-N 383.473 2.832 0 50 GFAA CCOC(=O)c1cnn2cc(CN3CCc4[nH]c5ccccc5c4C3)cnc12 77458055 YNALOYPNTPSQDD-UHFFFAOYSA-N 375.432 2.946 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCCN(C3CCN(Cc4cccnc4)CC3)C2)o1 71754793 FPMVORUADNNPCV-HXUWFJFHSA-N 396.535 2.976 0 50 GFAA Cc1ccnc(-c2ccc(NC(=O)N3CCC(n4cnnc4O)CC3)cc2)n1 373842387 HCGQKJNRKNQIEA-UHFFFAOYSA-N 379.424 2.618 0 50 GFAA Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)[C@@H]1CC12CCS(=O)(=O)CC2 281867320 ZYXOJWVJROJIGR-HNNXBMFYSA-N 393.896 2.988 0 50 GFAA CCOc1cc(C(=O)NC[C@H](C)c2c(C)noc2C)ccc1OCC(=O)O 262873660 WVEPWPFUIGHPCT-NSHDSACASA-N 376.409 2.687 0 50 GFAA COc1ccccc1N1CCC(NC(=O)NC[C@@H]2CCCn3ccnc32)CC1 378226796 NWQZOVRSGMTSNP-INIZCTEOSA-N 383.496 2.737 0 50 GFAA CCNC(=O)c1ccc(NC(=O)c2ccc3c(c2)NC(=O)CCN3C)c(C)c1 174095102 GGFFHHNOPWZAQM-UHFFFAOYSA-N 380.448 2.775 0 50 GFAA COc1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cccnc2SC)C3)cn1 223452779 JIBWMFQEODVHEO-UHFFFAOYSA-N 381.461 2.796 0 50 GFAA O=C(NCCc1cnc[nH]1)N1CCC(c2cc(Cc3ccccc3)[nH]n2)CC1 426589923 DVWOIGDJXVTLJP-UHFFFAOYSA-N 378.480 2.855 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ccc(-c4ccccc4)nn3)C2)CN1CCCO 82099323 YZLRKDLSJCPLSV-JOCHJYFZSA-N 380.492 2.735 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3nc4ccccn4c3F)C2)CN1CC1CC1 92064805 ABTRGOIPOVAWSK-NRFANRHFSA-N 384.455 2.728 0 50 GFAA CCC[C@H]1C=CCN1S(=O)(=O)c1cccc(C(=O)N(C)CCCOC)c1 97675208 JPRFCKXALRPEEP-KRWDZBQOSA-N 380.510 2.524 0 50 GFAA CC1(C)CC(CC(=O)N2CCN(Cc3ccccc3)C[C@H](O)C2)CC(C)(C)N1 95517729 PSTLMFPFYDLVHN-FQEVSTJZSA-N 387.568 2.639 0 50 GFAA CN1CCN(Cc2cc(Cl)ccc2OC[C@@H](O)CN2CCCCCC2)CC1 95524540 TZYHKZUQMDNJAH-FQEVSTJZSA-N 395.975 2.703 0 50 GFAA Cc1ccnc(C[C@@H](C)N2CCC(N3CCC(C(=O)NC4CC4)CC3)CC2)c1 23311694 QLRVRAFLVDNXCD-GOSISDBHSA-N 384.568 2.776 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C)ccc1C)CC2 95529368 TWKQERJUDOLAHE-UHFFFAOYSA-N 380.492 2.953 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CC[C@@H]1CCCN(C(=O)c2ncn[nH]2)C1 95498697 CTQJLKORATXBDK-LBPRGKRZSA-N 391.859 2.738 0 50 GFAA C[C@H](CNC(=O)c1ccc(-c2ncn(C)n2)cc1)N1CCc2sccc2C1 183037731 QQUYYHFGECKTOT-CQSZACIVSA-N 381.505 2.720 0 50 GFAA CCN1C[C@@H](CN(C)C(=O)c2ccc(-c3cnn4ccccc34)cc2)CC1=O 534587172 GNPQGSDBQFTGOL-MRXNPFEDSA-N 376.460 2.942 0 50 GFAA O=C(c1ccco1)N1CCCN(C(=O)c2cc(O)nc3cc(F)ccc23)CC1 362918299 ZDBKCJSYKIDESR-UHFFFAOYSA-N 383.379 2.661 0 50 GFAA Oc1cccc(N2CCN(C[C@H]3CN(Cc4ccccc4)CCCO3)CC2)c1 551697105 YXMJZWABUBVPSH-QHCPKHFHSA-N 381.520 2.805 0 50 GFAA CN(C)c1ccc(C(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)cn1 1940194895 AQISZZUSUDJQRJ-YLJYHZDGSA-N 376.460 2.683 0 50 GFAA O=C(CCc1ccccc1)N[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 575442696 JESLSQXVSJEUFE-GOSISDBHSA-N 390.480 2.728 0 50 GFAA COc1ccc(Cl)cc1CN(C)C(=O)N[C@H]1CCCN(C(=O)C2CC2)C1 584897480 BIGALCOPVCONDI-INIZCTEOSA-N 379.888 2.891 0 50 GFAA CN1CC2(CCN(C(=O)C[C@H](c3ccccc3)c3ccco3)CC2)OCC1=O 670454114 FOQWHJFJHJOWHB-GOSISDBHSA-N 382.460 2.651 0 50 GFAA COc1ccc(Cl)cc1CN(C)c1cc(N2CCC[C@H](CO)C2)ncn1 301260739 SCRXLUBKYUWGGQ-AWEZNQCLSA-N 376.888 2.984 0 50 GFAA COc1ccc(CNC(=O)[C@H](C)OC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1 169309222 XNEURKZZRITXSU-KRJAUBJISA-N 387.476 2.574 0 50 GFAA CCC1(CC)CN(C(=O)c2cccc(NC(=O)NC3CC3)c2)CC[S@@]1=O 170597568 JIQPWLPRZSPWMD-SANMLTNESA-N 377.510 2.734 0 50 GFAA O=C(NCc1cc(F)cc2c1OCOC2)C(=O)Nc1cccc2c1CCCC2 170619137 GZZHTIIUYVAHAD-UHFFFAOYSA-N 384.407 2.826 0 50 GFAA O=C(N[C@H]1COC[C@H]1Cc1ccnc2ccccc12)c1cn(-c2ccccc2)nn1 1704354525 HUPPDKAGDRGBKU-VGSWGCGISA-N 399.454 2.803 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@H]2CN(C(=O)C3CCC3)C[C@]2(CO)C1 1772818595 VFMBLGHBHKQMBL-FOIQADDNSA-N 391.899 2.733 0 50 GFAA O=C([C@@H]1CCc2sc(-c3ccncc3)nc2C1)N1CCC(c2nc[nH]n2)CC1 1772806806 FNGCBNBRUAFPHV-OAHLLOKOSA-N 394.504 2.834 0 50 GFAA CCN(CC)C(=O)C[C@]1(c2ccccc2Cl)CC(=O)N(CCCOC)C1=O 11910032 NXGBNWAMZHSTNB-HXUWFJFHSA-N 394.899 2.632 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)N2CCC[C@H](c3ccccc3)CC2)nn1 12314423 MTPHUMVTKKFUMF-SFHVURJKSA-N 383.496 2.556 0 50 GFAA c1ccc2c(c1)nc1n2[C@]2(N3CCOCC3)CCCC[C@@H]2[C@H]1N1CCOCC1 12523765 NNKLHIKTXJPZQM-NQSCKRDGSA-N 382.508 2.598 0 50 GFAA O=C(c1cn(C[C@@H]2CCCO2)nn1)N1CCC(c2nc3ccccc3o2)CC1 12596907 SDMULEAQBAGYSI-HNNXBMFYSA-N 381.436 2.618 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@H](N1CCSCC1)CC2 14537320 NIYZFAONIDRVSA-QGZVFWFLSA-N 384.549 2.598 0 50 GFAA COc1cccc(-c2cc(C(=O)N3CCCC3)cc(-n3cnnn3)c2)c1OC 14990747 GWQBVGZOZJBNRY-UHFFFAOYSA-N 379.420 2.583 0 50 GFAA Cc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c(C)c1 19229342 XOLBQZSYCYVOQJ-HXUWFJFHSA-N 381.451 2.897 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2C2=Cc3cccc(OC)c3OC2)cn1 1857686280 OTMNORKPEUIJIH-UHFFFAOYSA-N 393.447 2.537 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccccc3F)C[C@]23CC[C@H]1O3)c1ccccn1 1857725299 OZEKUGXOMBJKKY-VTAPXXACSA-N 381.451 2.630 0 50 GFAA CCOc1cccc(C(=O)N2CC[C@H](O)[C@@](CO)(Cc3ccc(F)cc3)C2)c1 1857734237 GECYNKBRMDTQOF-UNMCSNQZSA-N 387.451 2.653 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccccc3F)C[C@]23CC[C@H]1O3)c1ccncc1 1857735109 ILJBMNKDKOUXPU-XHYAQGIWSA-N 381.451 2.630 0 50 GFAA COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(CCC(=O)O)C1CCOCC1 408513315 PWPHSPGTWBSSDQ-MRXNPFEDSA-N 375.465 2.988 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NC1CCN(c3cccc(C)n3)CC1)C2 116667431 IPFVGJSBXFIPSG-QGZVFWFLSA-N 381.476 2.735 0 50 GFAA CC(C)(C(=O)Nc1cnn(CCN2CCOCC2)c1)c1ccccc1Cl 264108950 VCLGBDZERJPOBH-UHFFFAOYSA-N 376.888 2.785 0 50 GFAA C[C@H](NCc1ncnn1C(C)(C)C)c1cc(F)ccc1N1CCC(O)CC1 801529196 LUOSYXQXALUNTO-AWEZNQCLSA-N 375.492 2.984 0 50 GFAA O=C([C@H](Sc1ccc(F)cc1)c1ccccc1)N1CCS(=O)(=O)CCO1 1289826951 CHMRQEPVQVBQNS-QGZVFWFLSA-N 395.477 2.848 0 50 GFAA Cc1cc(C)cc([C@H](N)C(=O)N2CCC[C@H](n3c(O)nc4cccnc43)C2)c1 1875327202 ORFQDEWLHZDFPO-WMZOPIPTSA-N 379.464 2.617 0 50 GFAA Cc1cc2ccc(C(=O)N[C@H]3C[C@@H](NC(=O)c4coc(CC5CC5)n4)C3)cn2c1 1875334124 ZFFMUSIKRPVUHO-CALCHBBNSA-N 392.459 2.879 0 50 GFAA CC(C)[C@H](C(=O)N1CC[C@H]1CN(C)C(=O)c1ccc(O)nc1)c1ccccc1 1875328762 LQJPDKZYMUOCDK-ICSRJNTNSA-N 381.476 2.900 0 50 GFAA COc1ccc(C)c(CN[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)c1Br 1875400216 UIIULKQKGRRRAD-NUEKZKHPSA-N 394.313 2.892 0 50 GFAA Cc1cc(CCC(=O)N[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)no1 1875402433 GMLYGIPANNBVPH-NSISKUIASA-N 394.475 2.735 0 50 GFAA CC1(C)CN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)C[C@H](C(=O)O)O1 1776562159 UBDQZBRQNGLTDZ-GFCCVEGCSA-N 385.342 2.819 0 50 GFAA Cc1cn([C@@H](C)c2ccccc2)[nH]c1=NC(=O)c1cnc(C2CCNCC2)[nH]1 2325759921 CVUVBAFNNCOVPU-HNNXBMFYSA-N 378.480 2.665 0 50 GFAA Cc1cn([C@H](C)c2ccccc2)[nH]c1=NC(=O)c1cnc(C2CCNCC2)[nH]1 2325759922 CVUVBAFNNCOVPU-OAHLLOKOSA-N 378.480 2.665 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)Nc2nc3c(o2)C[C@@H](C(C)C)CC3=O)cc1 2356152587 QLKNGHXCUDHBHJ-AWEZNQCLSA-N 394.435 2.541 0 50 GFAA CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(C(=O)O)c2)c1 4953894 UDSPVOFLAHLXIR-UHFFFAOYSA-N 382.825 2.541 0 50 GFAA COc1ccc(OC)c(N2C(=O)[C@@H]3C[C@H]2CN3Cc2ccc3nccnc3c2)c1 55307345 XNWOKEDHCDVYPB-YWZLYKJASA-N 390.443 2.637 0 50 GFAA O[C@H](COc1ccccc1)CN1CCN(Cc2cnc3ccccc3c2)CC1 225535136 UWZNUWIAWKYFHC-NRFANRHFSA-N 377.488 2.792 0 50 GFAA O=C(Nc1ncc(-c2ccccc2)s1)C(=O)N1CCC[C@@H]1Cn1ccnc1 225742894 NZQWVDQGNZCXCB-OAHLLOKOSA-N 381.461 2.636 0 50 GFAA CCn1c(CN2CCOCC2)nnc1SCC(=O)Nc1ccc(Cl)cc1 20018367 OGDDBHPZKKJTHM-UHFFFAOYSA-N 395.916 2.514 0 50 GFAA O=C(Nc1nc(CN2CCOCC2)cs1)c1cnc(-c2ccccn2)s1 170780088 INSXDBHNARIFLX-UHFFFAOYSA-N 387.490 2.746 0 50 GFAA CCc1ccc(-c2ccc(C(=O)NC[C@H]3CN(c4nncs4)CCO3)o2)cc1 328594561 UVMLPYIOYOWSMZ-INIZCTEOSA-N 398.488 2.996 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccccc3C)CC2)cc(-n2cccn2)n1 65364323 YFWSFXWBDBPRMV-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA COC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@H](C)Oc1ccccc1 427027373 BDSHTAXGUXSSEY-ORAYPTAESA-N 384.407 2.975 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2nccn2CC(F)(F)F)n1C 328654175 XHJGDFWLTUSUIX-CQSZACIVSA-N 383.418 2.871 0 50 GFAA CNC(=O)c1cc(C)ccc1NCc1noc([C@H]2COc3ccccc3O2)n1 153990220 GDCXXIZBAUDDRI-QGZVFWFLSA-N 380.404 2.862 0 50 GFAA Cc1cc(C)c2nc(C3CC3)cc(C(=O)N3CCN4C(=O)N=C(O)[C@H]4C3)c2c1 328964691 RWBHKSASVQSWKJ-QGZVFWFLSA-N 378.432 2.946 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@H](Cc2ccc(C(=O)O)cc2)C1 72174551 LABDIZDDTHITHM-MRXNPFEDSA-N 378.432 2.831 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N(Cc1ccccc1)C[C@@H]1CCCO1 72419394 USVXBKGCLYODHH-NRFANRHFSA-N 382.508 2.517 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)Nc4ccccc4)CC3)ncn2)c1C 72117823 XLWRXPPCZYRZOJ-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)NC2CCN(c3cccnn3)CC2)cc1 373787338 NRDPHQPHZIGLJI-PZJWPPBQSA-N 395.507 2.973 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)/C=C/c3cncc(F)c3)cc(Cl)c2O1 127371680 JSAZEJNANVNFNJ-VMZHVLLKSA-N 396.827 2.716 0 50 GFAA Cc1ccc(-c2ccno2)cc1S(=O)(=O)N1CCO[C@H](C(F)(F)F)C1 71639603 DUJLCWGHWOWWNK-AWEZNQCLSA-N 376.356 2.602 0 50 GFAA C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCC2CCN(S(C)(=O)=O)CC2)C1 287636881 UGOFMLIWBJOXIS-VQIMIIECSA-N 393.553 2.841 0 50 GFAA COc1ccc(CNC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)c(OC)c1 426477241 PZMVKYKLWJQRNW-LJQANCHMSA-N 385.464 2.990 0 50 GFAA CC(C)c1noc(CNC(=O)N2CCCN(Cc3ccc(F)cc3)CC2)n1 426640587 XPAOMTCCBRUITK-UHFFFAOYSA-N 375.448 2.750 0 50 GFAA COCCN1C(=O)c2ccccc2[C@@H](C(=O)N2CCSCC2)C12CCCC2 49550746 CMBAJZIUZVIBCT-SFHVURJKSA-N 388.533 2.761 0 50 GFAA COC(=O)c1n[nH]c(C)c1-c1cccc(C(=O)NCCc2scnc2C)c1 426727474 LSUPOZWFKZFTFG-UHFFFAOYSA-N 384.461 2.909 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)C(=O)c1cnc(CN2CCCC2)s1 97475461 FZOKJDNYEALDIA-MRXNPFEDSA-N 375.494 2.640 0 50 GFAA O=C(N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)n[nH]2)C1)OCc1ccccc1 97815395 RFJOCPGZQJHBOQ-LBPRGKRZSA-N 382.342 2.569 0 50 GFAA CNc1nc(C)cc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95387058 PPLQWVLNOKSRMC-ZLGUVYLKSA-N 393.491 2.622 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CCCCN3Cc3nncn3C)cc2)n1 95527451 CWHPZFVHZPBQPY-IBGZPJMESA-N 393.495 2.611 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)c1cccn1C1CC1)CC2 95375017 RMJLKVQAXGIKBE-UHFFFAOYSA-N 386.540 2.620 0 50 GFAA COc1ccc(Cn2nc(C3(c4ccccc4)CC3)nc2CNC(N)=O)cc1 97468597 VBDRMFHGZRNEPG-UHFFFAOYSA-N 377.448 2.583 0 50 GFAA O=C(N[C@H]1CC[C@@H](n2cc(C(=O)NC3CC3)nn2)CC1)c1ccc(Cl)cc1 244715737 LBFPZGFVQLNJMP-IYBDPMFKSA-N 387.871 2.737 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(C[C@@H](O)c4ccc5c(c4)OCO5)ccn3n2)cc1 263616660 JYKZZVHDHXVIMI-LJQANCHMSA-N 389.411 2.934 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 1940193387 JNVGEMDVSRHICC-UHFFFAOYSA-N 383.448 2.597 0 50 GFAA CCc1nc(CCNC(=O)N2CCC[C@@H](Cc3nc4ccccc4[nH]3)C2)no1 584892459 CUPCWGDUOGBLDJ-AWEZNQCLSA-N 382.468 2.715 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)c3ccc4c(=O)n(C)cnc4c3)C2)n1 952981447 IKAGVZUUTWFZEM-OAHLLOKOSA-N 395.463 2.535 0 50 GFAA O=C(CCNC(=O)N1CCc2ccccc2C1)Nc1ccc2c(=O)[nH]ccc2c1 1453073320 DVSSNCVWTKQFDM-UHFFFAOYSA-N 390.443 2.625 0 50 GFAA O=C(O)[C@H]1CN(Cc2cccc(N3CCOCC3)c2)C[C@@H]1c1ccc(F)cc1 1565516566 YYMDILBNLFZWGG-RTWAWAEBSA-N 384.451 2.963 0 50 GFAA CS(=O)(=O)Nc1cc(F)ccc1NC(=O)[C@@H]1C[C@]12CCOc1ccccc12 277056055 AECHHGSVJQJWNB-LIRRHRJNSA-N 390.436 2.876 0 50 GFAA CCS(=O)(=O)C1CCN(C(=O)Nc2cn(-c3ccccc3)nc2C)CC1 193752723 BRSWJGMRMXHBGT-UHFFFAOYSA-N 376.482 2.612 0 50 GFAA CCn1ccnc1[C@@H]1CCCCN1C(=O)Cn1cccc(C(F)(F)F)c1=O 797777330 WCVQSEAVFOKDSM-AWEZNQCLSA-N 382.386 2.837 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[C@@H]1O 1616082654 PVHBVLCOXPMFAJ-SJORKVTESA-N 383.473 2.868 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1CCCN(Cc2nc(C)c(C)n2C)CC1 1529174483 WGDXSIVXFNNSEY-UHFFFAOYSA-N 386.544 2.725 0 50 GFAA Cc1ncc(CN(CCN(C)C)C(=O)Cc2c(C)nn(-c3ccccc3)c2C)[nH]1 1704312865 AJMMQHIEKSNGDA-UHFFFAOYSA-N 394.523 2.654 0 50 GFAA Cc1nc(CCN(C)C(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)no1 1772806219 WMQLEMAAVGARPY-CQSZACIVSA-N 383.477 2.703 0 50 GFAA CCCCCc1nc(CCS(=O)(=O)c2ccccc2)n([C@H]2CCOC2)n1 1772812018 FPDUBDJLIKDEGX-INIZCTEOSA-N 377.510 2.989 0 50 GFAA O=C(c1cn(CCN2CCCCC2)nn1)N1CC=C(c2ccc(F)cc2)CC1 12057609 KRXKTIXBFFZZOT-UHFFFAOYSA-N 383.471 2.833 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)C3CCOCC3)C2)c1 13594300 CPERAQHCPWJDON-QGZVFWFLSA-N 388.508 2.757 0 50 GFAA CCOc1cc(CN2CCC3(CC2)C(=O)N(C)C(=O)N3CC(C)C)ccc1O 14537218 NAXQDDRMJKPVLU-UHFFFAOYSA-N 389.496 2.676 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCCCOC(C)C)C2 14732573 AJZBQXZUNCIAEG-KRWDZBQOSA-N 376.545 2.791 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)n1 15075445 LEHSSQFEOLPHGL-NRFANRHFSA-N 395.551 2.622 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(OC)cc3F)[C@@H](CCO)C2)cc1 19839788 XJGKCRZHAZPHOJ-IBGZPJMESA-N 388.483 2.912 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)n(C)n1 1857673764 XELXWGUOOIDMSK-QFIPXVFZSA-N 396.491 2.508 0 50 GFAA CN1CCN(C(=O)C[C@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)CC1 1857712816 IFROUEPWYREGJB-CQSZACIVSA-N 376.888 2.862 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(CCC(F)(F)F)C[C@]34CC[C@H]2O4)cn1 1857739984 BYZWHWCMPFLKPK-BVIKNXMNSA-N 383.414 2.552 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCCc4ncc[nH]4)C3)nc2c1 1857740043 FNTCACUUGRTGQK-HNNXBMFYSA-N 397.479 2.915 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3cccc4c3OC(C)(C)C4)CC(=O)N2C)cnn1C 328623506 JGCWHQKECCHKSR-FXAWDEMLSA-N 382.508 2.751 0 50 GFAA COc1ccccc1N1CC[C@@H](Nc2ccccc2CN2CCOCC2)C1=O 133111036 BBNHUNPMOQGGBN-LJQANCHMSA-N 381.476 2.745 0 50 GFAA Cc1ccc(-n2nnc(C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)c2C)cc1 151171649 RAUGJUWYTQFVEV-UHFFFAOYSA-N 375.432 2.765 0 50 GFAA O=C(CN1CCC[C@@H](c2nnc3ccccn23)C1)NCc1cccc(Cl)c1 155814354 MTVXQCZRBRZAHD-MRXNPFEDSA-N 383.883 2.879 0 50 GFAA COc1cccc(C)c1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 1704330795 KHJNULSHAKRRLZ-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA COC1(c2noc([C@H]3CCc4nnn(C5CCN(C)CC5)c4C3)n2)CCCC1 952894732 QAMCMLOTHFXURR-AWEZNQCLSA-N 386.500 2.616 0 50 GFAA CCc1nc(CN2CCC[C@@H](Nc3ncnc(-c4cccc(F)c4)n3)C2)no1 1875269990 PGPSPOSHQJKJRF-OAHLLOKOSA-N 383.431 2.700 0 50 GFAA COc1ccc(C(=O)Nc2cccc(N3CCCCS3(=O)=O)c2)c(Cl)n1 1875299845 YBIXYXUTTTWAMU-UHFFFAOYSA-N 395.868 2.926 0 50 GFAA O=C(c1ccco1)N1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1 643774 XHWDGOZTVWKXNM-UHFFFAOYSA-N 389.260 2.733 0 50 GFAA CCOc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(C)(=O)=O 670201 KXWGSHUPEXQGEQ-UHFFFAOYSA-N 396.896 2.821 0 50 GFAA CN(c1ccc(C(=O)N2CCOCC2)cc1)S(=O)(=O)c1ccc(Cl)cc1 1116600 ACBPUGGWEBDQNA-UHFFFAOYSA-N 394.880 2.638 0 50 GFAA O=C1CO[C@H](C(=O)N2CC=C(c3ccc(F)cc3)CC2)[C@@H](c2ccccc2)N1 2356135613 MCJOYQMLRUJWKA-RTWAWAEBSA-N 380.419 2.698 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2Cc2cnc(=NCc3ccccc3)[nH]c2)C1=O 2356167044 GMWYSTUOIMIBIX-HSZRJFAPSA-N 393.535 2.876 0 50 GFAA O=C(NCc1ccco1)c1ccccc1NC(=O)[C@@H]1COc2ccccc2O1 2838189 DPCOFDXRINTVHF-IBGZPJMESA-N 378.384 2.988 0 50 GFAA CCN(CC(=O)NCCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 2864469 KVSJBMVSFANDTK-UHFFFAOYSA-N 380.897 2.710 0 50 GFAA COc1ccc(Cc2nc3c4c(C)c(C)n(CCCO)c4ncn3n2)cc1OC 9306535 AYZKVYTYZYWUDK-UHFFFAOYSA-N 395.463 2.686 0 50 GFAA Nc1nc(CN2CCN(c3ccc(F)cc3)CC2)nc(Nc2ccccc2)n1 9397217 FYSWCQSONXXUKG-UHFFFAOYSA-N 379.443 2.659 0 50 GFAA COc1ccc2c(C)cc(NC[C@@H]3CCN(c4cnn(C)c(=O)c4)C3)nc2c1 77357771 LYAHJGCMZHSAHZ-HNNXBMFYSA-N 379.464 2.584 0 50 GFAA COc1ccc2c(CC(=O)NC[C@H]3CC[C@@H](C(=O)O)CC3)cc(=O)oc2c1C 217455441 QBTUAXVTKIGPIW-HDJSIYSDSA-N 387.432 2.660 0 50 GFAA O=C([C@@H]1CC12CCCC2)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc2C1 77393996 GZBQJVDAHIKGDC-IBGZPJMESA-N 388.533 2.936 0 50 GFAA COc1ccc(CN2C(=O)C(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1OC 5527325 XDZLALAGKVBTKL-UHFFFAOYSA-N 388.807 2.848 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N1CC[C@@H]2[C@H](CCCN2C)C1 152583734 UJCDIQWYDBVBOD-SJLPKXTDSA-N 388.512 2.735 0 50 GFAA O=C(c1cn(Cc2cccc(Cl)c2)nn1)N1CCN(c2ccccc2)CC1 72168332 OTJWZUSHYHUKMQ-UHFFFAOYSA-N 381.867 2.942 0 50 GFAA Cc1cccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)c1 71774435 NXBMAYALIWIOAA-HXUWFJFHSA-N 383.536 2.934 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)[C@@H]3CCS(=O)(=O)C3)CC2)c1 77454811 PNNJJKJPNUYUEU-QGZVFWFLSA-N 387.505 2.526 0 50 GFAA COc1cccc(N2CCN(C(=O)c3cc(C)nc4c3c(C)nn4C)CC2)c1 31386211 GNDKKMVPZKLODQ-UHFFFAOYSA-N 379.464 2.556 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CNCCc2cccnc2)cc1OC 15068103 UUHTVLVZRNSING-HXUWFJFHSA-N 387.524 2.504 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)N1CCN(Cc2ccc(C(C)(C)C)cc2)CC1 17079785 DJYUOYCEVUXZKY-UHFFFAOYSA-N 390.553 2.533 0 50 GFAA Cc1nc2ccc(C(=O)N[C@@H]3CCOC[C@H]3Oc3ccccn3)cc2nc1C 220693146 OSWSPRGXLVYKQO-IEBWSBKVSA-N 378.432 2.608 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1c1nc(-c2cc(C(N)=O)c[nH]2)no1 288975144 BPLBHRZJBDEZKN-OAHLLOKOSA-N 395.419 2.540 0 50 GFAA Cc1ccccc1-c1cccc(CN2CC[C@@H](N3CCN(C)CC3)[C@H](O)C2)c1 20271853 VDNGXTFACDOXSE-DNQXCXABSA-N 379.548 2.845 0 50 GFAA Cc1ccc(-c2cccc(CN3C[C@@H](CN4CCN(C)CC4)[C@@H](CO)C3)c2)o1 95380497 FORUNHNKGZLQFI-FGZHOGPDSA-N 383.536 2.543 0 50 GFAA Cc1ccc2cccc(NC(=O)N3CCC(C(=O)N4CCOCC4)CC3)c2n1 96164698 QWNJLHNFXBHQMY-UHFFFAOYSA-N 382.464 2.646 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cccc(-c3ncccc3O)c2)on1 426383877 QWQLMEHDAFUQIM-AEFFLSMTSA-N 379.416 2.738 0 50 GFAA COc1nc2c(cc1C(=O)N1CCC(c3nnc4ccccn34)CC1)CCC2 91998022 QMGXRSYNCGALNC-UHFFFAOYSA-N 377.448 2.641 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC1CCN(C(=O)c3ccncc3)CC1)C2 91547352 UGBXPHRWSHWKBS-INIZCTEOSA-N 381.476 2.536 0 50 GFAA CC1(C)CC(CC(=O)N2CCNC(=O)[C@H]2c2ccc(F)cc2)CC(C)(C)N1 97797580 BTEICSVJMPWXHZ-GOSISDBHSA-N 375.488 2.772 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCCN(C(=O)C2CCC2)CC1 92019990 LLJXBORBXXPWAF-UHFFFAOYSA-N 379.464 2.695 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)c(C)n1 95386476 TUMGDHIKAJLOMP-HNNXBMFYSA-N 382.493 2.815 0 50 GFAA O=C(N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1)c1cc2c(nc1O)CCCC2 253535581 GRWBXKDBRDJKRZ-LLGFUMIMSA-N 394.471 2.843 0 50 GFAA CC(C)c1ccc(N2C(=O)[C@H](CCC(=O)NCc3ccccn3)N=C2O)cc1 252489434 JRARQBRJZFEMES-SFHVURJKSA-N 380.448 2.931 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NCc1nnc(C)n1C1CC1 184204564 VEQSUEUTRLRBOA-SECBINFHSA-N 384.406 2.717 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 57992279 FRSPKGTUONAISJ-NRJQMVOHSA-N 379.435 2.774 0 50 GFAA CC(C)c1nccc(CN2CCC(CNC(=O)C[C@@H](C)n3cccn3)CC2)n1 827802441 MKNJTMZESCHZQI-QGZVFWFLSA-N 384.528 2.776 0 50 GFAA COCCN(Cc1ccsc1)C(=O)NC1CCN(C(=O)CC(C)C)CC1 584898666 DOJDPKKLSGFSBN-UHFFFAOYSA-N 381.542 2.943 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCCN(S(C)(=O)=O)C2)c2ccc(C)c(C)c2n1 952973441 XOYWOLMLTGDEQG-INIZCTEOSA-N 389.521 2.561 0 50 GFAA O=C(c1ccco1)N1CCC[C@@H](NCc2ccccc2OCCn2ccnc2)C1 952966235 URSWRXLXNFJHMD-LJQANCHMSA-N 394.475 2.950 0 50 GFAA C[C@H](O)c1ccc(CNC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 186707368 KUTYCBUVYIBGPK-MBSDFSHPSA-N 397.519 2.518 0 50 GFAA Cc1nc([C@@H]2CCCN2C(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cs1 187133097 QWVGYMPEPOFZRF-INIZCTEOSA-N 399.520 2.940 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)Cn2ncc3ccccc32)c1 170632931 WPCLIKHVKJRLIG-SFHVURJKSA-N 380.473 2.885 0 50 GFAA Cc1nc(-c2cccc(C(=O)NS(=O)(=O)C[C@H]3CCCCO3)c2)cs1 170645656 IFEOARJZOFOWDE-OAHLLOKOSA-N 380.491 2.747 0 50 GFAA CCCOc1nc(C)ccc1C(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 188752889 VKYWTISWGFLMBF-MRXNPFEDSA-N 384.480 2.729 0 50 GFAA CN(C(=O)COc1ccc2c(c1)CCC2)[C@H]1CCN(Cc2ccccc2)C1=O 189780276 QPQVAKILNVGQRO-NRFANRHFSA-N 378.472 2.814 0 50 GFAA COC(=O)[C@@H](CNC(=O)C(F)(F)c1ccc(F)cc1)Oc1ccc(F)cc1 759927637 OQMWSJFUQOCNIY-OAHLLOKOSA-N 385.313 2.793 0 50 GFAA CCOc1ccccc1CN1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1 19520188 RACQOGTYCOGULC-UHFFFAOYSA-N 390.505 2.600 0 50 GFAA CCc1ccccc1NC(=O)CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19523037 WKWNHQVICHIFET-UHFFFAOYSA-N 381.476 2.734 0 50 GFAA O=C(C[C@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1ccc2[nH]ccc2c1 206248170 LOZYABGJVRAUQQ-GOSISDBHSA-N 376.416 2.660 0 50 GFAA COc1ccccc1C=CCN1CC[C@H](Oc2ccnc(CNC(C)=O)c2)C1 1857527831 IDBXUXQMLBWOGK-NRFANRHFSA-N 381.476 2.893 0 50 GFAA O=C([C@H]1CCOC1)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1C(=O)c1cc2ccccc2s1 1857677251 SWSNFXKTUROVNF-IECFSIQFSA-N 396.512 2.999 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N(C)Cc4ncc(C)[nH]4)CC3=O)sc2c1 1857698643 BJSNKJKNHNKHMC-CYBMUJFWSA-N 383.477 2.648 0 50 GFAA O=C(O)[C@H]1CN(Cc2nccs2)CC12CCN(Cc1cccc(O)c1)CC2 1857702736 BBKMCFBRLLGLOS-QGZVFWFLSA-N 387.505 2.648 0 50 GFAA COCCNC(=O)c1cccc(-n2ccnc2-c2cccc3ccnn23)c1C 1857725685 IJDVJRKVCRZBKT-UHFFFAOYSA-N 375.432 2.872 0 50 GFAA CCOc1cccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857736935 XBZQMJGELGRLHU-VIZSFHNOSA-N 392.455 3.000 0 50 GFAA O=C(N[C@H]1CC[C@H](O)CC1)c1ccccc1NC(=O)[C@@H](C1CC1)N1CCCC1 911471569 QDHAFPJOQIVJEX-MBOZVWFJSA-N 385.508 2.533 0 50 GFAA COc1cccc(CCC(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c1 1875251016 QKTUDIZXHRRZJU-NFBKMPQASA-N 397.471 2.535 0 50 GFAA O=C(N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cnn2cccnc12 265134452 OCMMWLJNRXVYNH-LBPRGKRZSA-N 391.353 2.637 0 50 GFAA O=C(NC[C@H](O)c1ccc(O)cc1)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@@H]21 1875322971 QAJVJXMNHTZGRO-LEUOFYLZSA-N 388.261 2.890 0 50 GFAA CCOCCn1cc(C(=O)N2CCCCC[C@H](NC(=O)C[C@@H](C)CC)C2)cn1 1775990470 BFBVKKLSUCKOBZ-HKUYNNGSSA-N 392.544 2.857 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N1CCN(c2ccccc2F)CC1 1072239 XXZUYJAAWNHEIV-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA C[C@H](NC(=O)CCNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 514287101 OMHMKKLOQFHZAZ-ZDUSSCGKSA-N 382.416 2.505 0 50 GFAA CC(C)c1c(C(=O)N2CCOCC2)nnn1-c1ccc(Br)cc1 16650252 YUMUAAMXCACDKQ-UHFFFAOYSA-N 379.258 2.626 0 50 GFAA CC(C)(NC(=O)N=c1nc(-c2ccsc2)[nH]s1)C(=O)NCC1CCCC1 498955765 IYLDAGLGUKDEHS-UHFFFAOYSA-N 393.538 2.895 0 50 GFAA O[C@]1(c2nc(Cc3ccno3)no2)CCc2cc(Br)ccc2C1 2325758238 GTSIHBVXVHHHAH-MRXNPFEDSA-N 376.210 2.787 0 50 GFAA COC(=O)c1cc(=NC(=O)N[C@H]2CCC[C@H]2c2ccc(Cl)cc2)[nH]n1C 2325819151 WPVCAFHKHWTDGL-KBPBESRZSA-N 376.844 2.740 0 50 GFAA CN1CCC[C@@H]2CN(C(=O)NC3CCN(Cc4ccc(F)cc4)CC3)CC[C@H]21 246605328 DFUHJMZNFFDIBM-WIYYLYMNSA-N 388.531 2.916 0 50 GFAA COc1cc(C(=O)NCC(=O)OCc2ccccc2Cl)cc(OC)c1OC 959595 YWWHBZUJRPDRQY-UHFFFAOYSA-N 393.823 2.839 0 50 GFAA CCOc1ccc(NC(=O)CN(c2ccccc2OCC)S(C)(=O)=O)cc1 972408 HMTCFGAKRQJVGS-UHFFFAOYSA-N 392.477 2.889 0 50 GFAA COCCNC(=O)CN(c1cccc(Cl)c1C)S(=O)(=O)c1ccccc1 2959603 PHWVBYGXBCZJOQ-UHFFFAOYSA-N 396.896 2.606 0 50 GFAA CCOC(=O)[C@@H]1CCCN(Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)C1 9411484 MNWJZOZMMDIQRO-GFCCVEGCSA-N 390.875 2.626 0 50 GFAA O=C(NCCOC[C@@H]1CCCO1)c1cc(-c2ccc(Br)cc2)n[nH]1 115419459 RVSKWIYONUQSFF-AWEZNQCLSA-N 394.269 2.765 0 50 GFAA CCCCC[C@@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCC[C@@H](CC(=O)O)OC 43772103 UBKBNBIEPZZFBF-KZMRGGKVSA-N 386.529 2.892 0 50 GFAA in-vitro Nc1nccc(N2CCC(n3nccc3NC(=O)CCc3ccccc3)CC2)n1 67675913 DQMONLMZGIPNTO-UHFFFAOYSA-N 391.479 2.668 0 50 GFAA COc1cc(C(=O)c2coc3ccc(OCC(N)=O)cc23)cc(OC)c1OC 170622160 SFBAZCUFGMFZFY-UHFFFAOYSA-N 385.372 2.554 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCn3c(Br)cnc3C2)c(C)c1 252493932 NGQPCEPQVIMQMC-UHFFFAOYSA-N 384.299 2.775 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@@H](CCc3ccc(F)cc3F)C2)c(=O)[nH]1 71764526 FILSLEINAXSKMG-AWEZNQCLSA-N 375.419 2.770 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(CO)o2)CCC(=O)N1Cc1ccc(F)cc1 71730622 NBEWFNRLEYOGIN-SFHVURJKSA-N 388.439 2.810 0 50 GFAA CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cc(C2CC2)nc2onc(C)c12 125569316 QXOSPTKDXAFPDM-QGZVFWFLSA-N 399.539 2.897 0 50 GFAA Cc1cc(NC(=O)N2CCC(n3cnnc3O)CC2)cnc1N1CCCC[C@H]1C 375463518 CHSSICGHFYBXHV-OAHLLOKOSA-N 399.499 2.935 0 50 GFAA COc1ccccc1CN1CCN(C(=O)Cc2c(C)nc3ccccn23)CC1 214958993 AIDMJCVEGCZILT-UHFFFAOYSA-N 378.476 2.538 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)N3CCc4ccccc4C3)n2)c(F)c1 44890356 ZVBDCLGNLFOWBW-UHFFFAOYSA-N 393.418 2.643 0 50 GFAA COc1ccc(Cl)cc1-c1ccc(C(=O)N2C[C@@H](CO)[C@H](CO)C2)cc1 426552033 PLNQUJIPHFCRCE-HOTGVXAUSA-N 375.852 2.688 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@@H]2CCOC[C@H]2Oc2cccc(F)c2)n(C)n1 223360343 ZUCZYAKCAYKSTP-IEBWSBKVSA-N 375.444 2.724 0 50 GFAA O=C(N[C@@H](c1ccccc1)c1ccncc1)N1CCN(C2CCCC2)C(=O)C1 426411596 ZCQWUFLYMYSCKS-NRFANRHFSA-N 378.476 2.967 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC(c2nccn2Cc2ccncc2)CC1 95508209 KSXPXZJEUIVWRE-UHFFFAOYSA-N 387.447 2.618 0 50 GFAA COc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@@](C)(c2ccccc2)C1 95528564 KDWUCCONIFGKNH-HXUWFJFHSA-N 388.489 2.537 0 50 GFAA CCn1ncc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)c1C 95354810 PAJQCNRCKKTCTE-FXAWDEMLSA-N 378.520 2.915 0 50 GFAA O=C(c1cc(-c2ccccc2O)n[nH]1)N1CCC[C@@H](OCc2ccccn2)C1 95388022 JNIVJWQNHILVOM-MRXNPFEDSA-N 378.432 2.999 0 50 GFAA COCCN1C[C@H](NC(=O)Nc2ccccc2Oc2ccccc2F)CC1=O 97759225 DHMFBUAAKDVNJK-CQSZACIVSA-N 387.411 2.987 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1cccc(-c3ncc[nH]3)c1)CC2 95529374 GBSJNCWHHJNODB-UHFFFAOYSA-N 390.491 2.809 0 50 GFAA Cc1nc2ccc(C(=O)N3CCNC(=O)[C@H]3c3cccc(F)c3)cc2nc1C 97632117 VIKGJZDVCLFOQV-LJQANCHMSA-N 378.407 2.699 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95506788 OGJSZANRUAOBSM-KRWDZBQOSA-N 382.489 2.900 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)CCc2ccc(O)cc2)C1 95530018 XFLXKKINQLRGDJ-LJQANCHMSA-N 384.524 2.879 0 50 GFAA O=C(OCc1ccccc1)[C@H]1[C@H]2C=C[C@@]3(CN(Cc4ccc(F)cc4)C(=O)[C@H]13)O2 247749717 RSGURPYXAJJYPG-NVJIOZQYSA-N 393.414 2.851 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2cn(C)nc2C(F)(F)F)[C@H](c2ccccc2)CO1 293629797 WSVVQRJHNPLPOT-AAEUAGOBSA-N 389.399 2.590 0 50 GFAA O=C(c1ccnc(OC2CCCCC2)c1)N1CCC(N2CCCNC2=O)CC1 180029491 FWAULGOUFMOZPF-UHFFFAOYSA-N 386.496 2.813 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)NCc1ccccc1CN1CCC[C@@H]1CO 180471255 CESITSKFUAQQPP-JOCHJYFZSA-N 394.515 2.827 0 50 GFAA CCCCN1CCC(CNC(=O)N2CCOc3ccc(CO)cc3C2)CC1 534658061 JTTPFOUIPFVLGJ-UHFFFAOYSA-N 375.513 2.595 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)CC1 534651753 OFPUCVZPVGXOPR-LJQANCHMSA-N 383.496 2.758 0 50 GFAA CCCC(=O)N[C@@H]1CC[C@@]2(OC)CCN(C(=O)c3oc(CC)nc3C)[C@H]2C1 534675341 JCVFYNVBIPCAFU-QEEYODRMSA-N 377.485 2.614 0 50 GFAA COC(=O)c1ccc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)cc2)c(O)c1 534670883 UTVBNUWILRUZCY-SFHVURJKSA-N 380.444 2.766 0 50 GFAA Cc1ncnc(C)c1C(=O)NCC1CCN(C(=O)/C=C/c2ccccc2)CC1 827910243 JHPVHJJKKADGIW-CMDGGOBGSA-N 378.476 2.775 0 50 GFAA Cc1nc(-c2cccnc2)ncc1C(=O)Nc1ccc(CC(=O)NC2CC2)cc1 952965529 AHMJQKZDXUMXPZ-UHFFFAOYSA-N 387.443 2.920 0 50 GFAA Nc1cc(OC(=O)c2ccc(F)cc2)nn1S(=O)(=O)c1cccc(Cl)c1 170615634 CFTORCKPOPDSPQ-UHFFFAOYSA-N 395.799 2.714 0 50 GFAA CCOc1cnc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)cn1 190805374 OZJVTUBYWRVOLF-UHFFFAOYSA-N 383.496 2.966 0 50 GFAA COc1cc(CN2CC[C@H](O)[C@H](C(=O)O)C2)ccc1OCc1ccc(C)cc1 1616081192 QPTGOYKSZLSHBX-MOPGFXCFSA-N 385.460 2.850 0 50 GFAA COc1c(Cl)cc(C(=O)N2C[C@H](O)[C@H](Cc3cc(C)no3)C2)cc1Cl 1704356999 NSKSWHGKVOESOQ-ABAIWWIYSA-N 385.247 2.974 0 50 GFAA O=C(c1cn(Cc2cccc3ccccc23)nn1)N1CCN(c2ccccn2)CC1 11812724 ICMKVTYVLAPBDN-UHFFFAOYSA-N 398.470 2.837 0 50 GFAA CC(C)=CCC[C@@H](C)CN1CCC(n2cc(C(=O)N3CCOCC3)nn2)CC1 12338031 DHKDVQRPEUVICI-GOSISDBHSA-N 389.544 2.770 0 50 GFAA CCN(CC)CCNC(=O)c1sc2ncnc(NC[C@H]3CCCO3)c2c1C 15008376 GBYNFTRCFRVWOD-CQSZACIVSA-N 391.541 2.662 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(CCCn3cccn3)C2)cc1OC 19741070 YHGVFJXRBUYGJU-HXUWFJFHSA-N 386.540 2.929 0 50 GFAA O=C(c1ccsc1)N1CCC(c2n[nH]c(=O)n2Cc2ccc(F)cc2)CC1 169770347 YBSXDKMAWNLWCG-UHFFFAOYSA-N 386.452 2.840 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN(c3ccc(F)cn3)[C@@H](C)C2)n[nH]1 1857679631 OKYBCXQAGDYPNY-AWEZNQCLSA-N 395.438 2.970 0 50 GFAA CC(C)CCN1CCOC2(CCN(C(=O)CCc3cccnc3)CC2)CC1=O 1857683394 WOZQPBOCUVGDDB-UHFFFAOYSA-N 387.524 2.670 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)NCCCc3ccccc3F)CC2=O)s1 1857716671 OSAYAABUJBNQRX-AWEZNQCLSA-N 390.484 2.903 0 50 GFAA O=C(c1cn2c(n1)CCNCC2)N1CCC[C@@H](c2nc3ccccc3s2)C1 1857736745 UBLVULZJLLGMPB-CQSZACIVSA-N 381.505 2.658 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCN(Cc2cc(Cl)ccc2O)C[C@@H]1O 207880014 QKVDUQALPQSUHX-ICSRJNTNSA-N 375.900 2.550 0 50 GFAA Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 111347785 OUAWNRYXRGNSAD-CQSZACIVSA-N 382.844 2.871 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)CN2S(=O)(=O)c1cccc(F)c1 251920372 AKSFYWHSIVKBKC-WBVHZDCISA-N 393.484 2.716 0 50 GFAA O=C(N[C@@H](CO)C(=O)N1CCC=C(c2ccccc2)C1)OCc1ccccc1 908083425 KEVKDQUZMHQHKO-FQEVSTJZSA-N 380.444 2.590 0 50 GFAA CCc1ccc(OC[C@@H](O)CN(C)C(=O)NCc2cccc(CN(C)C)c2)cc1 1875261008 DYEKZEBIBDNRTK-NRFANRHFSA-N 399.535 2.892 0 50 GFAA O=C(CN1CCC[C@H](c2cc[nH]n2)C1)NCCc1ccccc1OC(F)F 1875253015 JDICBZLSJMYCOH-HNNXBMFYSA-N 378.423 2.549 0 50 GFAA Cn1c([C@@H](NC(=O)NC23CC(C(=O)O)(C2)C3)c2ccccc2)nc2ccccc21 1875276960 RHDBSXBAJCMDJT-YTXWROIDSA-N 390.443 2.969 0 50 GFAA Cc1ccc(CCC(=O)N2C[C@H]3C[C@H]2[C@H]3c2ocnc2C(=O)N(C)C)c(C)c1 1875394418 IGMBEYXASGJFEL-AOIWGVFYSA-N 381.476 2.940 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2cccc(-c3noc([C@@H]4CCCO4)n3)c2)cn1 1875385132 NFRDQIMCHPMDOA-JTWNBILESA-N 381.436 2.585 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)c2nc3ccccc3s2)CC[C@@H]1C(F)(F)F 1875385855 DDLLJEFXLLORAX-CMPLNLGQSA-N 383.395 2.992 0 50 GFAA COC[C@H](Cc1ccc(F)cc1F)NC(=O)[C@H]1CCCN1Cc1ccccn1 1875320011 CJTCZIYIMLQSPG-AZUAARDMSA-N 389.446 2.698 0 50 GFAA CCOC(=O)COc1cc(C)c(C)cc1S(=O)(=O)N1CCc2ccccc21 6668154 ZXMXMPQFVJJKTE-UHFFFAOYSA-N 389.473 2.997 0 50 GFAA COc1cc([C@@H]2CC(=O)Oc3c(O)cc4c(C)cc(=O)oc4c32)cc(OC)c1O 2049252059 IBWROUFDNDIFBH-LBPRGKRZSA-N 398.367 2.971 0 50 GFAA CCn1cc(C(=O)N[C@]2(CNC(=O)CCC(C)(F)F)CCCC[C@H]2C)nn1 2325794278 WTJYTLJWMSUZBJ-ACJLOTCBSA-N 385.459 2.528 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)c1cc2n(n1)CCC[C@@H]2N 2325795983 JPJDTXZCAJOZEU-NSHDSACASA-N 392.385 2.844 0 50 GFAA CN1CCN(C(=O)NCc2ccc3cn(C)nc3c2)C[C@H]1Cc1ccccc1 2325857285 WBGRHCWXMVOHPO-HXUWFJFHSA-N 377.492 2.642 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cc1 2325890039 UZCIHMBHVYDSDE-LJQANCHMSA-N 397.862 2.802 0 50 GFAA O=C(COc1ccccc1)N[C@@H]1CCCC[C@H]1NC(=O)COc1ccccc1 637773 YBRVMPVDCHTAQX-WOJBJXKFSA-N 382.460 2.688 0 50 GFAA Cc1ccccc1OCC(=O)Nc1nonc1NC(=O)COc1ccccc1C 677044 SBNCIEXVWMIIMK-UHFFFAOYSA-N 396.403 2.721 0 50 GFAA COc1ccc(CCNC(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)cc1OC 1125396 SOMAKHCRJXPSOJ-CQSZACIVSA-N 386.448 2.788 0 50 GFAA O=C(Nc1ccccc1C(=O)O)c1cc(S(=O)(=O)N2CCCCC2)cs1 4492430 RIJQWFXCWBENLP-UHFFFAOYSA-N 394.474 2.873 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)NCc3ccc(Cl)cc3)n2)c1 5400382 VNVYDBUARIUSGP-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA Cc1nnc(SCC(=O)N2CCN(c3nc4ccccc4s3)CC2)s1 5748788 YLKWRWZUOJQWSR-UHFFFAOYSA-N 391.547 2.897 0 50 GFAA CCOc1ccc2nc(N[C@@](NC(C)=O)(C(=O)OC)C(F)(F)F)sc2c1 9109419 KXWCCYHBXGCBIV-AWEZNQCLSA-N 391.371 2.675 0 50 GFAA CSCC(=O)N1CCC(n2nccc2NC(=O)CCc2ccccc2)CC1 12431454 HAIBXVZJNOLNJN-UHFFFAOYSA-N 386.521 2.981 0 50 GFAA COc1ccc(CN2CCc3nnc([C@@H](CC(C)C)NC(C)=O)n3CC2)cc1C 14967900 MYXSAGZPHSXMMF-LJQANCHMSA-N 399.539 2.877 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@H]2CC(=O)NC23CC4CC(CC(C4)C2)C3)cc1 15066813 IVXPELKOYYRRQW-PJVWNMJMSA-N 395.547 2.771 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4c[nH]nc4C)C3)C2)c1OC 15068981 HTSUAGZGTUSBCK-QFIPXVFZSA-N 398.507 2.864 0 50 GFAA COc1ccc(CNCCCOC(C)C)cc1OC[C@@H](O)CN(C)C(C)C 15074126 SHZVYJLUCJZHIV-IBGZPJMESA-N 382.545 2.680 0 50 GFAA CCCc1cn(C[C@H]2CCCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)nn1 19837876 MUXCNRBYXOTRDU-HNNXBMFYSA-N 379.464 2.625 0 50 GFAA O=C(NC1CCCC1)[C@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2)C1 19860666 MSSOWNXQYBUBDE-HNNXBMFYSA-N 384.929 2.941 0 50 GFAA O=C(c1nc2ncccn2n1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 19871444 LIIVIKDNJHSELY-UHFFFAOYSA-N 398.470 2.672 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCc3nnc([C@@H]4CCCO4)n3CC2)cc1 20909603 OXQSUGDBRMYGLV-SFHVURJKSA-N 394.479 2.587 0 50 GFAA O=C(CN1CCc2onc(-c3cccc4ccccc34)c2C1)N1CCOCC1 67605279 BLKYYMLUHJCFPG-UHFFFAOYSA-N 377.444 2.712 0 50 GFAA COc1cccc2c1OC[C@H](NC(=O)c1coc(COc3ccccc3)n1)C2 67921730 RVLRMYSACSBTPE-OAHLLOKOSA-N 380.400 2.996 0 50 GFAA O=C(c1cccs1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71752194 IRIXKBIKZUMGJJ-INIZCTEOSA-N 375.538 2.687 0 50 GFAA CCn1cc(-c2cn(CCc3nc4sc(C)c(C)c4c(=O)[nH]3)nn2)c(C)n1 91665582 VRJSWCNWWMQFOJ-UHFFFAOYSA-N 383.481 2.627 0 50 GFAA O=C(c1ccccc1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cn1cc3ccccc3n1)C2 91780836 ZYLRNDXXXYMWJR-FXAWDEMLSA-N 388.471 2.800 0 50 GFAA CC(C)c1cc(C(=O)N[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)[nH]n1 92038348 IWPHLCNTWIZDLJ-QGZVFWFLSA-N 398.511 2.603 0 50 GFAA CN(C)c1ccc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)O)C2)cc1 95352801 JCOFICDRXKTKSD-HTAPYJJXSA-N 380.444 2.531 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 95388892 WMVZIDFZBCYWJN-KRWDZBQOSA-N 379.508 2.875 0 50 GFAA CCc1c(O)nc(S[C@H]2CC(=O)N(c3ccc(F)c(Cl)c3)C2=O)nc1O 100120587 JRVKVJAFJRDCBQ-NSHDSACASA-N 397.815 2.667 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccnn1[C@@H]1CCCc2ccccc21 115954887 BEYMXOGRAZAYSK-HXUWFJFHSA-N 399.458 2.966 0 50 GFAA O=C(NC[C@@H](O)c1cccc(F)c1)C(=O)Nc1cc(Br)ccc1F 122757652 JPBJGVZJMXAVPJ-CQSZACIVSA-N 399.191 2.516 0 50 GFAA Cn1c(=O)[nH]c2ccc(C(=O)NCC3(c4ccccc4Cl)CCOCC3)cc21 126948750 DPHYFOSZUHUDEB-UHFFFAOYSA-N 399.878 2.998 0 50 GFAA Cc1cc(-c2cc(C(=O)N[C@H]3CCC(=O)N(C)C3)c3c(C)noc3n2)c(C)o1 134095462 NSJLAABPDKCQTJ-ZDUSSCGKSA-N 382.420 2.759 0 50 GFAA C[C@@H](C(=O)N(C)C1CCCCC1)[S@](=O)Cc1nc(O)cc(C(F)(F)F)n1 155291789 CBFQDWNDMKVRSA-ZHZWEUQESA-N 393.431 2.629 0 50 GFAA COc1ccc(-c2cc(N3CCC[C@H](NC(=O)c4cccn4C)C3)[nH]n2)cc1 169753646 FRCZBJCNXDPXBW-INIZCTEOSA-N 379.464 2.823 0 50 GFAA COc1cccc(CC(=O)NCc2nnc3ccc(-c4ccc(C)cc4)nn23)c1 169781159 SLHJRJXUEBQPQG-UHFFFAOYSA-N 387.443 2.967 0 50 GFAA Cn1nc(C(=O)N2CCC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)ccc1=O 177472548 MEZJJNQAJJKING-LBPRGKRZSA-N 382.247 2.771 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@H](NC(=O)Nc2nc3ccccn3n2)C1 184326329 YTMLNFOIHCAWLL-ZDUSSCGKSA-N 386.843 2.792 0 50 GFAA O=C(N[C@@H]1COCC[C@@H]1OCC1CC1)c1cc(-n2cccn2)ccc1Cl 219293361 OKUAMBDUIRHZLQ-MSOLQXFVSA-N 375.856 2.840 0 50 GFAA O=C1[C@H]2O[C@H]2C(=O)[C@@H]2[C@@H]1[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 238856705 WXYXLXQSWBFNEH-IIPSLTNZSA-N 396.868 2.984 0 50 GFAA O=C(NCc1ccccc1)c1ccc(NC(=O)[C@@H]2[C@H]3C[C@H]4OC(=O)[C@@H]2[C@H]4C3)cc1 239235490 WBHWYBPZICVMDL-HKUYMTLNSA-N 390.439 2.753 0 50 GFAA C[C@H](C(=O)N(C)Cc1ccccc1N1CCCC1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 248060201 PVCNRBFQNXVZPS-BHIYHBOVSA-N 395.503 2.585 0 50 GFAA C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NC(=O)c1ccc(NC(N)=O)cc1 253418143 GYQYLMMDOQOUOD-IOASZLSFSA-N 390.484 2.941 0 50 GFAA O[C@]12C[C@H](C(Cl)(Cl)Cl)O[C@@]1(O)C[C@H](C(Cl)(Cl)Cl)O2 257356498 ILZPXCIRVHHHJM-ZXXMMSQZSA-N 380.866 2.682 0 50 GFAA Cc1cc(Br)cc(C)c1S(=O)(=O)N1CCC[C@@H](n2cncn2)C1 266280739 JDJZYCOUOHVJEV-CQSZACIVSA-N 399.314 2.683 0 50 GFAA COc1ccc(CCC(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)cc1OC 269436209 MPATWCRCNKYBFQ-QGZVFWFLSA-N 385.464 2.634 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2C[C@@H](CO)c3ccccc32)c(C)c1CC(=O)O 294309285 VSVHTYMDQOORSD-HNNXBMFYSA-N 389.473 2.524 0 50 GFAA CN(C)[C@H]1CCCN(C(=O)c2ccc(-c3ccc(-c4nn[nH]n4)cc3)cc2)C1 426374208 MOIISTBYSDKSSB-IBGZPJMESA-N 376.464 2.700 0 50 GFAA O=C(O)Cn1nccc1[C@@H]1CCCN(C(=O)CCc2ccc(F)c(F)c2)C1 426514627 IFLNGUPZZNYPSV-CQSZACIVSA-N 377.391 2.585 0 50 GFAA COc1cccc(CNC(=O)N2CCC(OCc3ccccn3)CC2)c1OC 426544657 FRIQHWDBFHHMOO-UHFFFAOYSA-N 385.464 2.990 0 50 GFAA CCc1csc(CCNC(=O)NCCNC(=O)c2ccccc2Cl)n1 426563584 ZVUHGDQAMLSLGE-UHFFFAOYSA-N 380.901 2.631 0 50 GFAA O=C(NCCCN1CCC[C@H](O)C1)c1ccc(-c2ccc3c(c2)OCO3)cc1 426668357 NKMUBLJQJARHAT-IBGZPJMESA-N 382.460 2.659 0 50 GFAA O=C(NC[C@H](c1ccccn1)N1CCOCC1)c1ccc(Cn2cccc2)cc1 670473065 MOKHJNKVIJZWRL-JOCHJYFZSA-N 390.487 2.735 0 50 GFAA COc1ccc(NC(=O)CCc2nc3ccc(F)cc3[nH]2)cc1C(=O)N(C)C 824699817 LCTIEIMGGHBIOO-UHFFFAOYSA-N 384.411 2.984 0 50 GFAA O=C(c1ccon1)N1CCC2(CC1)CN(Cc1cccc3[nH]ccc13)CCO2 828228748 JQBKTWKMDOZTQM-UHFFFAOYSA-N 380.448 2.663 0 50 GFAA COC1(c2nc(C3CCOCC3)no2)CCN(c2ncc3c(n2)CCCC3)CC1 840300998 NALXWHRMADOBDP-UHFFFAOYSA-N 399.495 2.775 0 50 GFAA c1ccc(C23CN4CCN(CC(C4)[C@H]2Nc2ncnc4sccc24)C3)cc1 952964130 BJTXZUYOBHTFRZ-BPVAQJAMSA-N 377.517 2.671 0 50 GFAA Cc1nccn1CC(=O)N1CCC[C@H](CNC(=O)CCCc2cccs2)C1 952969544 DJHKRNJEZLMDBY-QGZVFWFLSA-N 388.537 2.631 0 50 GFAA CCOc1cccc(C(=O)NCC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)c1 952979695 FFLDATISHFMSED-OAQYLSRUSA-N 396.487 2.787 0 50 GFAA Cc1nncn1CCN1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 1506411304 IFSIAVIBHVUVMY-UHFFFAOYSA-N 388.825 2.866 0 50 GFAA COc1ccccc1CNC(=O)[C@H]1OCC(=O)N(C(C)C)[C@@H]1c1ccccc1 1529105515 DTPGLJAXDUSITQ-RTWAWAEBSA-N 382.460 2.689 0 50 GFAA Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@]2(CCc3cnc(N)nc32)C1 1704337595 AWWWFUASQYTVPC-QFIPXVFZSA-N 388.475 2.580 0 50 GFAA CCCCO[C@@H](C)C(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1C(F)F 1775991927 OZROYSVMLCTHCH-WBAHDQRJSA-N 386.483 2.979 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)COc2ccc(Cl)cc2Cl)CC12CCOCC2 1800410322 PJLIPYMORWODCS-LBPRGKRZSA-N 388.247 2.712 0 50 GFAA O=C(NCCCNc1cccnc1)[C@]12COC[C@H]1CN(CC1CCCCC1)C2 1857692860 XSODRBMOUWLMRZ-DENIHFKCSA-N 386.540 2.529 0 50 GFAA c1ccc(N2CC[C@@H](Nc3ncnc4nc(N5CCOCC5)sc34)C2)cc1 1875305236 NOVOFMGGLVSTQR-CQSZACIVSA-N 382.493 2.614 0 50 GFAA CC(C)(C)OC(=O)NC[C@@H]1COC[C@H]1NC(=O)c1cc(Cl)nc(Cl)c1 1875369912 PTLWQIRCKJBEBI-GHMZBOCLSA-N 390.267 2.658 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)CC1 1875370735 BHPSABXJGDVZOD-IBGZPJMESA-N 386.492 2.685 0 50 GFAA N=[S@]1(=O)CCC[C@@]2(CCCN2C(=O)c2ccnn2CCC(F)(F)F)C1 1875395615 GWHLALSZTAOAJX-SXBQZSJRSA-N 378.420 2.651 0 50 GFAA O=C(O)[C@@H](C[C@H]1CCSC1)NCc1nc(C(F)(F)F)n2c1CCCC2 2325789688 GBPRJVGUWJFHQO-GHMZBOCLSA-N 377.432 2.924 0 50 GFAA Cc1ccc([C@@H](C)C(=O)NC[C@](C)(NC(=O)C2(CN(C)C)CC2)C2CC2)cc1 2325793793 HZUSYWIXRRDCEJ-VGSWGCGISA-N 385.552 2.841 0 50 GFAA COc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1O 2325796792 MGRDMBPNKKVVMT-KRWDZBQOSA-N 397.427 2.822 0 50 GFAA C[C@H](c1ccccc1)N1C[C@H](C(=O)N2CCOC[C@H]2CC(F)(F)F)CC1=O 2325819565 JHFPMCBUZCEMKR-FVQBIDKESA-N 384.398 2.776 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356147249 NZOACEUMRHUSIJ-JOCHJYFZSA-N 378.476 2.696 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc(Cl)cc2)cc(C(=O)OC)c1 632234 IAISPOAFBFPDCN-UHFFFAOYSA-N 383.809 2.714 0 50 GFAA CN(CC(=O)Nc1cccc(Br)c1)S(=O)(=O)c1ccccc1 1130546 GVAVAKDWBPLDOK-UHFFFAOYSA-N 383.267 2.708 0 50 GFAA C[C@H]1CCc2nc(NC(=O)CSc3nnnn3-c3ccccc3)sc2C1 1262538 IOCYTRHTIGRUAY-NSHDSACASA-N 386.506 2.974 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@@]12CCCN2C(=O)[C@H]1CC[C@@H](O)CC1 2356142999 PZXQICNRCAELGZ-ZRCGQRJVSA-N 384.520 2.764 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2c[nH]c3ccc(F)cc3c2=O)C1=O 2356149544 HBBSKEDSPVHHNT-NRFANRHFSA-N 385.439 2.673 0 50 GFAA COc1ccc(NC(=O)CN(Cc2ccc(Cl)cc2)S(C)(=O)=O)cc1 2882909 BWMQUELAPBQKAZ-UHFFFAOYSA-N 382.869 2.749 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)NCc3ccccc3)cs2)no1 6681799 IXWSXSOHTHEZKU-UHFFFAOYSA-N 377.447 2.775 0 50 GFAA O=C(CCSc1ccc2c(c1)OCCO2)NCc1noc(C2CCC2)n1 55167856 BMOQMKOBSJOZMX-UHFFFAOYSA-N 375.450 2.907 0 50 GFAA Cc1ccccc1Nc1nc(N)nc(CN2CCN(c3ccccc3F)CC2)n1 54146998 JTBHNYKIHUAEKC-UHFFFAOYSA-N 393.470 2.967 0 50 GFAA COc1ccccc1NC(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 20898329 UWTVKBDVCZXBJG-UHFFFAOYSA-N 388.489 2.876 0 50 GFAA COCc1nc2n(n1)C[C@@H](NC(=O)COc1ccccc1-c1ccccc1)CC2 135119856 HHPHVBWIYQYHKH-KRWDZBQOSA-N 392.459 2.602 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)c3ccc(Br)o3)CC2)n1 67630268 YTFIDTHRAOWMGG-UHFFFAOYSA-N 394.273 2.535 0 50 GFAA c1ccc(CN2C[C@H]3[C@@H](NC4CCN(C[C@H]5CCOC5)CC4)CC[C@H]3C2)cc1 252512397 QDUABLWEOHMWCC-JSRBNTPPSA-N 383.580 2.988 0 50 GFAA CCc1nccn1CC(=O)N1CCC[C@@H](C(=O)c2ccc(OC)cc2OC)C1 72170466 JZGDBQCEJBENOE-OAHLLOKOSA-N 385.464 2.584 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2cnc(Cl)s2)CC1 328625388 DCUYCWVJYVVGLH-HNNXBMFYSA-N 379.917 2.990 0 50 GFAA O=C(C[C@@H]1COCCN1C(=O)CCc1cn2ccccc2n1)Nc1ccccc1 72408476 CPSISXFWAKQGCD-LJQANCHMSA-N 392.459 2.523 0 50 GFAA CC1CCC(N2C[C@@H](C(=O)N3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2=O)CC1 328727555 DHPOKSBIBNDCNU-QIURHJMISA-N 396.535 2.994 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)NCc1nnc(-c2ccccc2)s1 363902135 XFKAKLNDLXWFHM-UHFFFAOYSA-N 391.460 2.785 0 50 GFAA CCOc1ccc(C(=O)N2CCC(N[C@H](C(N)=O)c3ccc(F)cc3)CC2)cc1 171119508 FMBNPGYQVFXWMI-FQEVSTJZSA-N 399.466 2.645 0 50 GFAA O=C(Cn1ccc(O)nc1=O)N1CC[C@H](c2cccc(Oc3ccccc3)c2)C1 369888586 STFLSWYMSPBDAT-KRWDZBQOSA-N 391.427 2.757 0 50 GFAA Cn1cnc2c1CCN(C(=O)c1nc(-c3cccs3)n(-c3ccccc3)n1)C2 370802533 OFCAZISUDVYWIU-UHFFFAOYSA-N 390.472 2.928 0 50 GFAA Cc1cc(=O)c(C(=O)N2CC[C@@]3(CCCN(Cc4ccc(F)cc4)C3)C2)c[nH]1 72160933 QMBFLBYNKWGGCN-JOCHJYFZSA-N 383.467 2.951 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 376819363 NDTIEMIWGOWJPD-QYZOEREBSA-N 390.447 2.699 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2OC)CN1Cc1ccccc1C 15005943 OKZHZSYBODZNJY-HKUYNNGSSA-N 382.460 2.550 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)N[C@@H]1CCCn2ncnc21 175952561 JAPAZIGDMRJLFX-QGZVFWFLSA-N 382.468 2.951 0 50 GFAA O=C(NCc1nccn1CCc1ccccc1)N[C@H]1c2ccccc2C[C@H]1O 175921690 IFDVYNGPPJVYFI-CTNGQTDRSA-N 376.460 2.583 0 50 GFAA CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)Nc1ccc(NS(C)(=O)=O)c(Cl)c1)C[C@@H]3C2 287341377 YSHQKCDJKQVYID-SQNBZCGUSA-N 399.900 2.599 0 50 GFAA O=c1c2nnc3c(-c4ccc(Cl)cc4)cnn3c2ccn1C[C@H]1CCCO1 40395870 OPKDQFFRDUVZLT-CQSZACIVSA-N 381.823 2.939 0 50 GFAA CCC[C@H](O)c1ccc(-c2cccc(C(=O)NCCS(C)(=O)=O)c2)cc1 426510867 QJUBMBCBCZOPMK-IBGZPJMESA-N 375.490 2.962 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@H]4CO)csc3C2)nc1 426431096 QTNYCNDMAGFITP-KRWDZBQOSA-N 385.533 2.861 0 50 GFAA CC(C)c1cc(C(F)(F)F)nc(N2CCN(C(=O)c3ccccn3)CC2)n1 82097358 SBHHHBANAVAULA-UHFFFAOYSA-N 379.386 2.976 0 50 GFAA CC(C)n1cnnc1CN1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91746659 CLHLWVXUKQLMDP-UHFFFAOYSA-N 396.539 2.701 0 50 GFAA COc1ccnc(-c2ccc(C(=O)N3CCC[C@H](Cn4ccnc4)C3)cc2)n1 426683806 LPKROLCNKSCDIO-MRXNPFEDSA-N 377.448 2.901 0 50 GFAA FC(F)Cn1cc(CN2CCOC[C@H]2c2nc(-c3ccccc3)no2)cn1 294808080 WKZVJNBXSAVJIV-HNNXBMFYSA-N 375.379 2.772 0 50 GFAA CC[C@H](C)[C@@H](CO)NC(=O)C1CCC(Cn2cnc3ccccc3c2=O)CC1 252484088 FOFNAKDSIJPAQC-MVBPIPQGSA-N 385.508 2.726 0 50 GFAA COCc1noc([C@H](C)N2CCN(Cc3cc(Cl)ccc3OC)CC2)n1 181499322 OPHLTGHCLCONPA-ZDUSSCGKSA-N 380.876 2.757 0 50 GFAA CN(CC(C)(C)CN1CCOCC1)C(=O)c1cc(N(C)C)nc2ccccc12 182806605 ZCHJWQIWKKCTIM-UHFFFAOYSA-N 384.524 2.731 0 50 GFAA CCn1ncnc1[C@H](C)NC(=O)N(C)CC1CCN(Cc2ccccc2)CC1 534644799 KOLWRHSTKHTGGZ-KRWDZBQOSA-N 384.528 2.913 0 50 GFAA O=C(NC1(CN2CCOCC2)CCCC1)N1CCCN(c2ccccc2)CC1 534652997 KUBUEHAAJPEDCV-UHFFFAOYSA-N 386.540 2.553 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N[C@@H]1CCCN(Cc2ccccc2F)C1 827860873 NBZHVGCSSPXOGT-GOSISDBHSA-N 393.462 2.921 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)N(C)Cc2csc(C(C)C)n2)on1 584894539 FIQROFPCMZMICF-CJNGLKHVSA-N 378.498 2.962 0 50 GFAA O=C(O)[C@@]12COc3ccccc3[C@@H]1CN(Cc1cnc(N3CCCCC3)nc1)C2 1565509807 BNHJRMYFMOJWJC-AVRDEDQJSA-N 394.475 2.530 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2cc3ccccc3s2)[C@@H]1c1cnn(C)c1 275351105 UBPGVNKCPDFFEZ-HRAATJIYSA-N 398.532 2.961 0 50 GFAA C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccn(CC(=O)O)n1 190943850 GXEQXSBDMIJKPT-ZDUSSCGKSA-N 380.404 2.764 0 50 GFAA COc1cc(C(=O)N(Cc2cccnc2)C[C@@H]2CCC(=O)N2)c2ccccc2n1 1506424215 ZLCRURMRLPDKNS-INIZCTEOSA-N 390.443 2.559 0 50 GFAA O=C(c1cccc2c3c([nH]c12)CCCC3)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1529151166 GXPODLMOUGVIQI-IIBYNOLFSA-N 379.504 2.982 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)Nc1csc2nc(=O)c(C)nn12 1529153242 AHGHJUXFPDPQIX-UHFFFAOYSA-N 381.417 2.604 0 50 GFAA O=C(CN1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1)NC1CCCCCC1 1704339786 XWOYIHVMFZHFQG-XMSQKQJNSA-N 381.520 2.909 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)CC3CC3)CC2)C1 11661862 XMOMOBOWHMAHQU-NRFANRHFSA-N 397.563 2.848 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCCN(C(=O)Nc2ccc3c(c2)OCO3)C1 12308938 LVMUZPASNSLWFL-SFHVURJKSA-N 382.464 2.981 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@H]1CCCN(CCc2ccc(OC)cc2)C1 12709759 HOBXBGMXCJVZNX-LJQANCHMSA-N 390.524 2.751 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N[C@H]1CCCN(Cc2ccccc2F)C1 14974730 DMKMUSDTOOFBMR-INIZCTEOSA-N 383.423 2.514 0 50 GFAA O=C1CCN(C(=O)c2cnn(-c3ccccc3)c2)CCN1Cc1ccccc1F 15001547 CCNWIOCYFSBNLX-UHFFFAOYSA-N 392.434 2.886 0 50 GFAA CCOC(=O)[C@H]1CCCCN1C(=O)c1coc(COc2cccc(F)c2)n1 15078089 QCOBIEZDOLQTBQ-MRXNPFEDSA-N 376.384 2.951 0 50 GFAA COc1ccc(NC(=O)CSc2nc(O)cc(=O)n2-c2ccccc2)cc1 15987794 QQPQCAVPXKASKQ-UHFFFAOYSA-N 383.429 2.678 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3n[nH]c4c3CCC4)C1)CC2 1857671902 WBNXBOWMOSRYQJ-QFIPXVFZSA-N 395.507 2.812 0 50 GFAA Cc1n[nH]c(C)c1-n1ccnc1-c1ccccc1OCCCN1CCOCC1 1857690497 KZGASWBQJUGAEE-UHFFFAOYSA-N 381.480 2.980 0 50 GFAA O=C([C@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2[nH]nc(C3CC3)c2CC1 1857698054 UQUBWOGSLXJVMX-QGZVFWFLSA-N 379.382 2.967 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1cccc(OC(F)F)c1)C[C@H]2O 1857723365 CGEJJGRMISVIBP-ANTGDGSKSA-N 375.415 2.857 0 50 GFAA CCOCc1nnc(N2C[C@H](C(=O)NCC3(CC(C)C)CCC3)CC2=O)s1 1857738882 CISZWCVWXMZNJH-CQSZACIVSA-N 394.541 2.760 0 50 GFAA CCc1cccc(CN2CCC[C@@H](n3ncc(N4CCC(O)CC4)cc3=O)C2)c1 328607322 VMUVKBAYMQRDSP-HXUWFJFHSA-N 396.535 2.604 0 50 GFAA O=C(O)c1ccc(CNC(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)o1 238124587 UZYNNZNINRGNAV-LLVKDONJSA-N 397.214 2.954 0 50 GFAA C[C@H](CCCc1ccccc1)C(=O)NCc1ccc(S(=O)(=O)CCO)cc1 252496299 PGFDUFSURVYUTI-QGZVFWFLSA-N 389.517 2.728 0 50 GFAA C[C@H]1CC[C@H](C(=O)O)CN1C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 263243436 RWDVXSFOBHDKCI-BBRMVZONSA-N 388.851 2.875 0 50 GFAA N=c1[nH]c(C2CC2)cc(=NC[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)[nH]1 1875337880 IHJSDAONMREVAY-FQEVSTJZSA-N 385.471 2.998 0 50 GFAA CC(C)C[C@@H](CNC(=O)C[C@@H]1CCOC1)NC(=O)Cc1ccc2cnccc2c1 1875331576 ODEJZAUKTBMBBE-RXVVDRJESA-N 397.519 2.851 0 50 GFAA O=C(c1ccn2nnnc2c1)N(CC(F)(F)F)[C@H]1CCCc2cccnc21 888092875 MLKOTDWDFCXUST-ZDUSSCGKSA-N 376.342 2.601 0 50 GFAA CCc1nc2ccccc2n1CC(=O)N[C@@](C)(C(=O)O)c1cc(F)ccc1F 2325743367 FHTHOKFMRMEHSG-HXUWFJFHSA-N 387.386 2.993 0 50 GFAA CC1CCN(c2cc(N[C@@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)CC1 1857797772 OTBMMRFFKXLDJE-MRXNPFEDSA-N 379.464 2.597 0 50 GFAA COc1ccc(N[C@@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccc(Cl)cc2)cc1 1275997 LGRQAOZPZCZMGN-SJORKVTESA-N 395.864 2.783 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3cc(C)ccc3OC)n2N)cc1 2438421 NEOUAWBGNVSDQV-UHFFFAOYSA-N 399.476 2.715 0 50 GFAA COc1ccccc1C(=O)Nc1cccc(NC(=O)[C@@H]2C[C@@H](C)NC(=S)N2)c1 55132786 WVPWBAVLMUMWQG-WBMJQRKESA-N 398.488 2.511 0 50 GFAA C[C@@H](C(=O)NCc1cccs1)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 225388523 IFIPBOZDTYRYGE-ZDUSSCGKSA-N 398.454 2.989 0 50 GFAA O=C(c1ccc(NC(C2CC2)C2CC2)nc1)N1CCCN(c2ncccn2)CC1 20167129 DPARPEWIXIKSAP-UHFFFAOYSA-N 392.507 2.825 0 50 GFAA COCC[C@@H]1COCCN1C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 462778991 WDPPYTYSUOFVER-CYBMUJFWSA-N 385.342 2.633 0 50 GFAA Cc1nnc([C@@H](C)NC(=O)c2coc(COc3cccc4cccnc34)n2)o1 67965082 ICDFUWHMTXOAJY-LLVKDONJSA-N 379.376 2.984 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCN(C)[C@H](C)C3)nc2)cc1 39468153 WIZCHKGSKCVKOS-QGZVFWFLSA-N 382.508 2.593 0 50 GFAA N=C1Nc2nc3ccccc3n2[C@@H](c2ccc(I)o2)N1 1430185 BUBVGTWAZMDGTG-NSHDSACASA-N 379.161 2.731 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@H](NCc2cc(C)nc(N(C)C)n2)C1 252478670 ARVPFJDTDHEAKF-HNNXBMFYSA-N 375.904 2.882 0 50 GFAA CC(C)(C)C1CCN(c2nnc([C@H]3COCCO3)n2C[C@@H]2CCOC2)CC1 328805041 CVEDFVMOOADCKD-DOTOQJQBSA-N 378.517 2.665 0 50 GFAA O=C(NCc1cc(Cl)cc(I)c1)NC[C@H](O)C1CC1 425841628 XSKPAUGRJRDKJQ-LBPRGKRZSA-N 394.640 2.515 0 50 GFAA Cc1cc(=O)oc2cc(O[C@H](C)C(=O)N3CCn4cncc4C3)c(Cl)cc12 72158427 LRDROPIGRRXYEE-GFCCVEGCSA-N 387.823 2.761 0 50 GFAA O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N(CCc1ccccc1)C1CCCC1 476229334 AXXQHSCMMKUFCD-NRFANRHFSA-N 399.535 2.963 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)C1 328623609 BYQKKAFWPWVZJU-CQSZACIVSA-N 380.279 2.712 0 50 GFAA COc1cccc(OC[C@@H](O)CNC(=O)c2cc(CCc3ccccc3)no2)c1 12572367 ZDKSPTOKTHQCPA-SFHVURJKSA-N 396.443 2.638 0 50 GFAA CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)NCC1CCN(CC(F)(F)F)CC1 364009119 ZPTRZXSZYKCPRS-CVEARBPZSA-N 376.467 2.529 0 50 GFAA CN(C)c1noc([C@H]2CCCN2CC(=O)N(C)c2nc3ccccc3s2)n1 374533131 AJNQEXZDQTYPBP-CYBMUJFWSA-N 386.481 2.545 0 50 GFAA CCN(C)C(=O)CN1C[C@@H]2C[C@H]1C(=O)N2c1cc(-c2ccccc2)ccc1OC 77518200 CSPKCSUUTTYYKE-ICSRJNTNSA-N 393.487 2.630 0 50 GFAA Cc1ccc2oc(CN3C[C@H]4C(=O)N(CC5CC5)C[C@@]4(C(=O)O)C3)c(C)c2c1 77457820 JPXJFLOHJCEGFX-JTSKRJEESA-N 382.460 2.805 0 50 GFAA COc1ccccc1C(=O)N1CCN(C(=O)C2(c3ccccc3F)CC2)CC1 77436457 UEKKVLBJFGUPHD-UHFFFAOYSA-N 382.435 2.851 0 50 GFAA C[C@@H]1C[C@@H](N2CCOCC2)CN1C(=O)NCc1cccc(-c2cccnc2)c1 376492227 QXLJHQXHGUNHBR-DYESRHJHSA-N 380.492 2.753 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1=O)N1CCCCC1 136663348 JDDRWAWQYISXHT-HVTWWXFQSA-N 380.488 2.641 0 50 GFAA Cc1nccc(-c2cccc(NC(=O)c3cn(CC(=O)C(C)(C)C)nn3)c2)n1 173909027 ISOILCKQLHIHRF-UHFFFAOYSA-N 378.436 2.911 0 50 GFAA O=C(N[C@H]1CCCO[C@@H]1c1ccncc1)c1nn(-c2cccc(F)c2)cc1O 284780111 QJLZNQAVDVZCBE-QFBILLFUSA-N 382.395 2.762 0 50 GFAA CC(C)CN1CCCn2nc(CNC(=O)c3cc(=O)[nH]c4ccccc34)cc2C1 82126838 MNGDPFZMQWDSHU-UHFFFAOYSA-N 393.491 2.516 0 50 GFAA Cc1c(NC(=O)[C@H]2COc3ccccc3C2)cccc1C(=O)N1CCOCC1 193702346 BQWOTVCYLBVVJU-QGZVFWFLSA-N 380.444 2.657 0 50 GFAA N=c1cc[nH]cc1-c1ccc(C(=O)N2CCC(N3CCSCC3)CC2)cc1 426589907 CRFOSAFJEHLSSD-UHFFFAOYSA-N 382.533 2.815 0 50 GFAA COCCN1CCC(CN(C[C@H]2CCCO2)C(=O)c2cncc(Cl)c2)CC1 96132760 PXVGTKBNQGNVGO-LJQANCHMSA-N 395.931 2.715 0 50 GFAA Cc1c(C(=O)N2CC[C@H](C(=O)O)C2)nnn1-c1ccc(-c2ccccc2)cc1 237765993 DOFNWMMRFBYXGI-KRWDZBQOSA-N 376.416 2.789 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)N[C@@H](CC(C)C)c2cccnc2)c1 97785133 NLYGLEDYJMUMFI-KRWDZBQOSA-N 376.482 2.899 0 50 GFAA CCOc1ccc(NC(=O)N2CCC3(CC[C@@H](CNC(C)=O)O3)CC2)cc1 97088503 MVZQKLDUDNXFDQ-SFHVURJKSA-N 375.469 2.767 0 50 GFAA O=C(c1ccncc1F)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95370135 XNWPCCZIYYIDAQ-ZLGUVYLKSA-N 395.434 2.652 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 95378166 YXVUNGAQLHLFMO-IPMKNSEASA-N 387.505 2.542 0 50 GFAA CCCC(=O)c1cn(CC(=O)N[C@H]2COC[C@@H]2N2CCCC2)c2ccccc12 244875107 XMRQRSLUXLXHEV-ICSRJNTNSA-N 383.492 2.604 0 50 GFAA Cc1c(NC(=O)NCc2cnn3cccnc23)cccc1C(=O)NC(C)(C)C 299756732 FEJUMCWJXXTPFV-UHFFFAOYSA-N 380.452 2.888 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3ccccc3-n3cccn3)cc2C1 299761429 WMYDLGLJZFHRIN-UHFFFAOYSA-N 378.480 2.615 0 50 GFAA Cc1cc(NC(=O)[C@H]2CCCN(C3CCOCC3)C2)ccc1N1CCCC1=O 952978290 BPFFCOFSIGCBNN-KRWDZBQOSA-N 385.508 2.951 0 50 GFAA COc1ccccc1-c1nnc(NCc2ccccc2OCC(=O)N(C)C)o1 170616152 ZKYUKIFEDYTTMV-UHFFFAOYSA-N 382.420 2.824 0 50 GFAA O=C(NCC(=O)N1CC2(CCOCC2)c2ccccc21)c1ccc(F)cc1F 189802676 UWEPKYZBRAYXBN-UHFFFAOYSA-N 386.398 2.790 0 50 GFAA CC(=O)NC[C@@H]1CCCN(c2cc(Sc3ccc(F)cc3)nc(N)n2)C1 1704309986 VCEZDWGNKPAAAP-ZDUSSCGKSA-N 375.473 2.702 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)COc3ccc(Cl)c(Cl)c3)C[C@@H]2O)on1 1704349120 ZQZNGOZDUQHXIE-BZNIZROVSA-N 385.247 2.731 0 50 GFAA O=C(CCc1ccccc1)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697952 SHDBYESEGYTYDR-UHFFFAOYSA-N 388.475 2.897 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@@H](CNC(=O)[C@H]2CCCN(C)C2)O3)n1 12162099 BVPRELCESISOTN-HKUYNNGSSA-N 380.492 2.522 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-c2cccc(C)c2)c1 14963013 IQSZIDNKCAOXTG-HXUWFJFHSA-N 379.460 2.728 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(C[C@@H]2CCOC2)CC1)N1CCCC1 1857703204 XYQSKJVAUCPQOY-INIZCTEOSA-N 390.549 2.884 0 50 GFAA COc1ccccc1Cc1nc([C@H]2CC[C@@H](O)[C@H](N)C2)n(Cc2ccccc2)n1 1857735164 KTPFODBOOCVZKP-XUVXKRRUSA-N 392.503 2.882 0 50 GFAA COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NC[C@@H]3CCCO3)cc2)c1 1159755 RYRXJJBENAPIBN-KRWDZBQOSA-N 384.432 2.865 0 50 GFAA C[C@@]1(CNC(=O)N2CCC(c3nc(C(F)(F)F)cs3)CC2)CCC(=O)N1 333658299 LQIIDHIIRZVMTJ-HNNXBMFYSA-N 390.431 2.720 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1C[C@@H](CN)[C@H](c2ccccc2)C1 261810147 RMACVXZACDHPRR-WBVHZDCISA-N 381.505 2.667 0 50 GFAA NCC12CC(c3nc(-c4cccc(N5CCCC5=O)c4)no3)(C1)C1(CCC1)O2 1875283102 GFCVKTCGSMUVLN-UHFFFAOYSA-N 380.448 2.545 0 50 GFAA CC(C)c1ccc(-c2noc(CCC(=O)N3CC[C@@H](C)S3(=O)=O)n2)cc1 1875285478 OJNJSVYHLMMFOK-CYBMUJFWSA-N 377.466 2.743 0 50 GFAA CC(=O)Nc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C)ccn1 1875268569 HFOKSXNRUCMLOQ-STQMWFEESA-N 376.457 2.510 0 50 GFAA Cn1cc(-c2ccc(-c3nc(-c4cnn(CCO)c4)nn3C3CCC3)o2)cn1 1875348001 FHWOJFQCUIEXIO-UHFFFAOYSA-N 379.424 2.519 0 50 GFAA O=C(NS(=O)(=O)C1CCOCC1)c1ccc(Oc2ccc(F)c(F)c2)cc1 1318757130 MPBVVPAJSBQUIL-UHFFFAOYSA-N 397.399 2.996 0 50 GFAA CCc1ccccc1Oc1ccc(Cl)cc1CNC[C@H](O)CNC(N)=O 2325861092 FOZOUIQLFFHDTF-INIZCTEOSA-N 377.872 2.814 0 50 GFAA O=C1N[C@H](Cc2nc(-c3ccc(N4CCOCC4)cc3)no2)c2ccccc21 896037155 QNXOOEXJSCBQBE-GOSISDBHSA-N 376.416 2.600 0 50 GFAA O=C(C[C@]1(O)C(=O)Nc2ccc(I)cc21)c1cccs1 1159826 DIUYCMRYPRTQIP-CQSZACIVSA-N 399.209 2.765 0 50 GFAA C[C@@H](Sc1nnc(COc2ccccc2)n1C)C(=O)Nc1nccs1 4519803 AINDBBWTTBCDGJ-LLVKDONJSA-N 375.479 2.970 0 50 GFAA C[C@H](C[C@H]1COCCN1C(=O)OC(C)(C)C)N[C@H](C)c1nnc2n1CCCC2 248723723 MPJJUHGQDOUXGF-OAGGEKHMSA-N 393.532 2.680 0 50 GFAA CN(C)S(=O)(=O)c1ccsc1C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 110306997 GCCXEOUBRLIKKD-QWHCGFSZSA-N 384.910 2.938 0 50 GFAA C[C@H](NC(=O)c1ccc(Br)c(O)c1)c1nnnn1-c1ccccc1 133468747 UHJJIZCYTJXOGD-JTQLQIEISA-N 388.225 2.621 0 50 GFAA Cc1ncc(CN2CCC[C@H](C(=O)Nc3cccc(-n4cccn4)c3)C2)cn1 23192979 NXUXUOFSNBMWGR-SFHVURJKSA-N 376.464 2.821 0 50 GFAA COc1cc(CN2CCOCC2)ccc1OC[C@@H](O)CN1CCCCCCC1 23340463 HFWLSWVAEVWQPE-FQEVSTJZSA-N 392.540 2.533 0 50 GFAA O=c1[nH]c2cc3c(cc2cc1CN1CCC(O)(c2ccccc2)CC1)OCO3 67820076 YUJWAQGEZQPZBW-UHFFFAOYSA-N 378.428 2.740 0 50 GFAA CCCN1CCC(N2C[C@@H](NCc3cccc(C)c3)C[C@H]2C(=O)NCC)CC1 23338360 UEPKEHOEXNSEBG-UNMCSNQZSA-N 386.584 2.538 0 50 GFAA CCC[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)[C@H](C)CC)C(=O)OC 25664475 RWJCTEYKWWBVCL-HYVNUMGLSA-N 378.469 2.785 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(C[C@@H]2CCCO2)CC1 67805833 BWSSTPHOLLYDPM-KRWDZBQOSA-N 384.480 2.960 0 50 GFAA NC(=O)NCCN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67910243 YVXSQZJCVUSSRY-UHFFFAOYSA-N 384.461 2.532 0 50 GFAA CCOC(=O)c1cc(C)sc1NC(=O)CN1CCN(c2ccccc2)CC1 35800843 AODOFGPZKNWXMX-UHFFFAOYSA-N 387.505 2.994 0 50 GFAA CCN1CC2(CCN(C(=O)c3c[nH]nc3-c3cccc(OC)c3)CC2)OC1=O 72474868 ZESIWMNNOQJQCI-UHFFFAOYSA-N 384.436 2.532 0 50 GFAA COC[C@H](CO)NC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cccs1 252495227 OOASUWNZHQBKQT-SCOAYWHSSA-N 383.473 2.738 0 50 GFAA COC(=O)[C@@]1(N(Cc2ccccc2)C(=O)Cc2ccc(F)c(F)c2)CCOC1 328595515 XANZROOIFNLTFG-OAQYLSRUSA-N 389.398 2.868 0 50 GFAA CC1=CCN(C(=O)[C@@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@H]24)O3)CC1 77427793 BGQBHWDLPNFANQ-XARGGIHNSA-N 392.499 2.764 0 50 GFAA O=C(c1cn([C@H]2CCOC2)nn1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 330092724 QYMVOLZNLUJLEZ-WCQYABFASA-N 397.262 2.840 0 50 GFAA O=C(Nc1cccc(-c2nc[nH]n2)c1)[C@@H]1CCCN1C(=O)Cc1ccccc1 363539573 MIFQJUBDIRXZFR-SFHVURJKSA-N 375.432 2.644 0 50 GFAA COc1cccc2c1CC[C@H]2NC(=O)N1CCC(OCCN2CCCC2)CC1 154758268 WSNDGSFICHFRKH-HXUWFJFHSA-N 387.524 2.969 0 50 GFAA CN(C(=O)c1ccc2[nH]nnc2c1)[C@@H]1CCCN(C2Cc3ccccc3C2)C1 72166073 QXIPLFJGWQHGBG-GOSISDBHSA-N 375.476 2.662 0 50 GFAA CN(Cc1cnn(C)c1)C(=O)c1cn(C(c2ccccc2)c2ccccc2)nn1 72144405 RUHBXGGOHYFOQJ-UHFFFAOYSA-N 386.459 2.922 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)CSc3ccccc3)CC[C@H]21 72478007 FJXNDHVUXPRPOL-FUHWJXTLSA-N 376.522 2.655 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](N2CCCC2)C1)c1cccs1 171450611 AUIVMRFYOLSMDF-RTBURBONSA-N 397.544 2.786 0 50 GFAA O=S(=O)(CC1CC(F)(F)C1)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 333442804 PYZVWLAOHVXANK-SNVBAGLBSA-N 387.374 2.983 0 50 GFAA Cc1c(-c2ccccc2)n[nH]c1C(=O)N1CCC([C@H](C)N2CCOCC2)CC1 72420134 OWEOKIFIQCMQHH-KRWDZBQOSA-N 382.508 2.958 0 50 GFAA CCc1ocnc1C(=O)N1CCC[C@@]2(CCC(=O)N(Cc3cccnc3)C2)C1 82098881 LJFFOVVFMIMMIA-OAQYLSRUSA-N 382.464 2.677 0 50 GFAA O=C(Nc1nnc(-c2ccccn2)s1)[C@H]1CCCCN1C(=O)c1cccnc1 172833641 ZWSKEUQDQFRZKL-OAHLLOKOSA-N 394.460 2.629 0 50 GFAA Cc1ccc(NC(=O)C2CCCC2)cc1NC(=O)N(C)Cc1cnc(N)nc1 426504651 UVDFVADULWCPCT-UHFFFAOYSA-N 382.468 3.160 0 50 GFAA CCOc1ccc(CN2CCN(Cc3[nH]c(CC)nc3C)C[C@@H]2CCO)cc1 20992828 LZKIVVARCNDLHL-IBGZPJMESA-N 386.540 2.748 0 50 GFAA CC(=O)c1c(C)nn([C@H](C)CC(=O)N(C)Cc2nc(-c3ccccn3)no2)c1C 426387727 PNXAESALOKUOLL-GFCCVEGCSA-N 396.451 2.757 0 50 GFAA O=C(Nc1ccc(-c2cscn2)cc1)[C@@H]1CCCN(CCn2cnnc2)C1 95498510 RXXVEHVSDIVVII-MRXNPFEDSA-N 382.493 2.752 0 50 GFAA O=C1N(C2CCCC2)CCC[C@@]12CCN(S(=O)(=O)c1ccc(F)cc1)C2 91380878 NKSVDOOVFGHBGN-IBGZPJMESA-N 380.485 2.772 0 50 GFAA COc1ccc(Cn2nc(C)cc2NC(=O)NCc2cc(C)on2)cc1OC 96139829 JAPRBSSYWBGEFK-UHFFFAOYSA-N 385.424 2.875 0 50 GFAA C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1nc(-c2ncccn2)no1 91745347 NIGHCLBIFFTDJV-CYBMUJFWSA-N 375.388 2.764 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Nc1cc(Cl)ccc1Cl 239248023 XWOIEBCMEHRJBZ-YCBBYDHLSA-N 391.254 2.985 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1 95099740 AJEBIRRZGZEXDF-UHFFFAOYSA-N 390.871 2.943 0 50 GFAA CCS(=O)(=O)c1ccc(CCC(=O)N2CCCN(C3CCCC3)CC2)cc1 179344870 DAVLDUFJYAMGBT-UHFFFAOYSA-N 392.565 2.890 0 50 GFAA OCc1ccc(CN2CCN(Cc3nc(-c4ccc(Cl)cc4)no3)CC2)o1 179883362 RTUWEWCZOWBQOP-UHFFFAOYSA-N 388.855 2.793 0 50 GFAA Cc1nnn(-c2ccc(NC(=O)[C@@H](Sc3cnn[nH]3)c3ccccc3)cc2)n1 252494363 NTRRFRVXOYLISQ-KRWDZBQOSA-N 392.448 2.561 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1nc(N2CCCC2)ncc1Cl 299753946 ZYCIBRWLEDWYJE-YUTCNCBUSA-N 378.860 2.588 0 50 GFAA C[C@H](Cn1cncn1)C(=O)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1 299769549 XZBZMUBJLZICNA-MRXNPFEDSA-N 378.480 2.634 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@H]2CCCN(Cc3cccc4nonc34)C2)s1 825272189 DTLUVWCZVQKZQA-CQSZACIVSA-N 385.493 2.938 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cc2)nn1C 584888831 OFDUTBKZKODXEV-UHFFFAOYSA-N 378.480 2.930 0 50 GFAA Cc1nc([C@H](C)N(C)S(=O)(=O)c2ccc3oc(=O)n(C)c3c2)c(C)s1 952872190 JTBKDSQYBUAWMQ-VIFPVBQESA-N 381.479 2.587 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2csc(COc3ccccc3)n2)cn1 275475350 IAFLJWACPXWLKT-XLIONFOSSA-N 397.504 2.565 0 50 GFAA CS(=O)(=O)N[C@H]1CCCN(C(=O)c2cc(-c3ccccn3)ccc2Cl)C1 169006420 KUAQASCOIAQQJL-AWEZNQCLSA-N 393.896 2.556 0 50 GFAA COc1ccc2c(c1)N(C(=O)CCc1c(C)nc(SC)[nH]c1=O)C[C@@H](C)O2 170640676 YTUHQGIYDMWMRW-LLVKDONJSA-N 389.477 2.556 0 50 GFAA Cc1ccc(CN2CC[C@H](NC(=O)c3ccc(-c4nc(C)no4)cc3)C2=O)cc1 191607239 AQZZEROMAHNXNH-IBGZPJMESA-N 390.443 2.884 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1CCC([C@H](O)c2cccs2)CC1 1506427034 KRAUSTSJYVILCQ-SFHVURJKSA-N 375.494 2.765 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CC(N3CCCCC3)C2)s1 1506423368 VMGUOSXJXFHCLM-UHFFFAOYSA-N 381.523 2.879 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCc3cc(C(C)C)no3)CCC2=O)cc1 11772916 HIPKJYSZMFHKCR-KRWDZBQOSA-N 399.491 2.904 0 50 GFAA O=C(NCC1CCOCC1)[C@@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 12075656 PYMAXMYHUJWNIH-MRXNPFEDSA-N 398.425 2.987 0 50 GFAA Cc1nccn1[C@@H]1c2ccccc2C2(CCN(C(=O)c3ccco3)CC2)[C@H]1O 19953285 BMVYFHVKZYNBJH-UXHICEINSA-N 377.444 2.922 0 50 GFAA CN(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2[C@](Cc2ccccc2)(C(=O)O)C3)cn1 1857677164 QYLMKFBVUZMRRE-NJNPRVFISA-N 379.460 2.838 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccsc4)[C@H]4CC[C@]3(C2)O4)n1 1857706455 SUWGBPYULJEYQY-QEUVDIPISA-N 383.517 2.861 0 50 GFAA CN1CCC[C@@H](C(=O)N2CCC3(CCc4c(O)nc(C(C)(C)C)nc43)CC2)C1 1857717424 RJQBKDGEOKTKII-OAHLLOKOSA-N 386.540 2.628 0 50 GFAA Cn1nc(C2CC2)cc1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857721989 BHODAMAVNZZIPW-VXKWHMMOSA-N 394.519 2.976 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)NCc1ccccc1-n1ccnc1C 1857733501 MKJHJWOWAMGETD-UHFFFAOYSA-N 397.504 2.712 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)c2ccc3sc(=N)[nH]c3c2)n1 1857737397 KQAZRCDWZFLNQQ-UHFFFAOYSA-N 381.383 2.799 0 50 GFAA C[C@H](CC(=O)N1CC[C@@H](C(F)(F)F)[C@H](CO)C1)NC(=O)Nc1ccccc1 1875256685 RUJYQNFALJJLKP-VNHYZAJKSA-N 387.402 2.606 0 50 GFAA O=C(NC[C@H]1CNCc2ccccc21)[C@H]1CCCN1c1ncnc2sccc12 1875268126 FZCNLFUTZATVQT-CRAIPNDOSA-N 393.516 2.663 0 50 GFAA COc1cc(CC2CN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)C2)cc(OC)c1 1875293035 ACBCPIGLUWEBSI-QWHCGFSZSA-N 385.464 2.764 0 50 GFAA C[C@@H]([C@@H](C)NC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1)n1cncn1 1875264566 HPJJSHFGZGFWKC-OLZOCXBDSA-N 397.439 2.889 0 50 GFAA CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)[C@H]1CCOCC12CCC2 1875323049 UQWLQUXSXSASJA-MRXNPFEDSA-N 397.418 2.996 0 50 GFAA CN(C)C(=O)c1cnc(N[C@@H]2C[C@H](Cn3cc(Cl)cn3)C[C@H]2O)c(Cl)c1 1875399483 XQNZIMCGCSBHMR-COLVAYQJSA-N 398.294 2.538 0 50 GFAA Cc1ccc(C(=O)N[C@H]2[C@@H]3CN([C@H]4CCN(c5ccc(Cl)cc5)C4=O)C[C@@H]32)o1 1875325514 NXAFMENGIRAGCP-MJQMVNBJSA-N 399.878 2.707 0 50 GFAA C[C@@H](CC(=O)N1CC[C@](O)(CNC(=O)CC2(C)CC2)C1)c1cccc(F)c1 1875305021 CLURAUQKXHMIJU-BTYIYWSLSA-N 376.472 2.589 0 50 GFAA CCOc1ccccc1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397104 LLOWWOIHLOCNNU-GOSISDBHSA-N 397.523 2.562 0 50 GFAA O=C1Cc2cc(CCCC(=O)N3CC[C@](CO)(Cc4ccccc4)C3)ccc2N1 1875308316 ZSBUBFCHSNIMAF-DEOSSOPVSA-N 392.499 2.958 0 50 GFAA O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1cc2n(n1)CCC2)c1csc(C2CC2)n1 1875310661 XQPDYKUHKNHGGR-HUUCEWRRSA-N 399.520 2.634 0 50 GFAA C[C@H]1C[C@H](C(=O)N2CCOC3(CCS(=O)(=Nc4ccccc4)CC3)C2)CO1 1875395761 LIHJTGUKBHRYDC-KALSRWKASA-N 392.521 2.603 0 50 GFAA COc1cccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4Cl)CC3)C2=O)c1 96793221 BNQNHZYYGZUXNN-LJQANCHMSA-N 399.878 2.803 0 50 GFAA CCO[C@H](CC(=O)N1CC[C@@H](NC(=O)c2c(Cl)n[nH]c2C)[C@@H]1CC)C(C)C 2325793935 MBTOOXKHVPAKQV-QLFBSQMISA-N 398.935 2.932 0 50 GFAA O=C(NCC1(NC(=O)[C@H]2C[C@@H]2F)CC1)c1cccc(Cl)c1Br 2325829800 SMQHCWMXZLYUMA-ONGXEEELSA-N 389.652 2.839 0 50 GFAA c1ccc(Cc2nc3n(n2)CCN(Cc2ccc4c(c2)OCCO4)CC3)cc1 2356146465 HSBXMTRZHWBLGD-UHFFFAOYSA-N 376.460 2.698 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)c(O)n1 2356148609 INDNUYJRIAJGMU-JOCHJYFZSA-N 394.475 2.596 0 50 GFAA CCOc1ccc(CN(C(=O)CNS(=O)(=O)c2cccs2)C2CC2)cc1 55107519 TZKFDACCGKOYCS-UHFFFAOYSA-N 394.518 2.616 0 50 GFAA CC(C)OCCCN1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1 225843309 UMNQFRGQUVNXHU-UHFFFAOYSA-N 391.537 2.746 0 50 GFAA O=c1[nH]c2ccccc2cc1CS(=O)(=O)c1nc(CCC2CCCC2)n[nH]1 111902602 ZWQUTQVJMXZQTG-UHFFFAOYSA-N 386.477 2.743 0 50 GFAA CC(C)S(=O)(=O)Cc1cccc(NC(=O)N[C@H]2c3ccccc3C[C@H]2O)c1 112429151 CRUPXNKUZHIYHY-MOPGFXCFSA-N 388.489 2.790 0 50 GFAA CCC1(CC)CN(c2ccc(C(=O)N3CCC[C@H](COC)C3)cn2)CCO1 67884939 KDGMLZRLOCODRF-KRWDZBQOSA-N 375.513 2.976 0 50 GFAA COc1ccc(-c2nn3c(nc2=O)-c2ccc(F)cc2N2C(=O)CC[C@]23C)cc1 170620135 VFBVYHOTMNQBNW-OAQYLSRUSA-N 392.390 2.933 0 50 GFAA OCCOCCN1CCN(C2=Nc3ccc(O)cc3Sc3ccccc32)CC1 22061171 VEGVCHRFYPFJFO-UHFFFAOYSA-N 399.516 2.562 0 50 GFAA in-vitro CCOCCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccco3)nn2CC)C1 20201801 VLQQUJYIGWSYKR-INIZCTEOSA-N 388.512 2.642 0 50 GFAA COc1cc(C(=O)N[C@@H](c2nnc3ccccn23)C(C)C)cc(OC)c1OC 20721409 BCCOPHCNWCCPHD-QGZVFWFLSA-N 384.436 2.882 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCCN(c2nc3ccccc3s2)CC1 22261849 AHPDHLMGRVPQOX-UHFFFAOYSA-N 392.506 2.802 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN(C)Cc3cnccn3)C2=O)cc1 67921986 MJZRNQZAUMTODN-JOCHJYFZSA-N 382.508 2.586 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CC[C@]4(CCN(CC)C4)C3)nc2)on1 12205396 PNWQOTGNXADDPW-QFIPXVFZSA-N 397.523 2.874 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 12298356 KUOZUKOFJFFNHF-QFIPXVFZSA-N 381.451 2.805 0 50 GFAA CN(C)C[C@H]1CN(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCO1 118805223 WJBAAVYUAFZJRL-IBGZPJMESA-N 382.464 2.733 0 50 GFAA Cc1ccc(CCC(=O)NCc2ccccc2CS(=O)(=O)NC(C)C)o1 471367341 UAQSVULIJFSGCF-UHFFFAOYSA-N 378.494 2.665 0 50 GFAA Cc1ncccc1O[C@H]1CCN(S(=O)(=O)c2c(Cl)nc3ccccn23)C1 328614559 AIZDBCVYZOKFLO-ZDUSSCGKSA-N 392.868 2.533 0 50 GFAA CCN(c1ccc(C(=O)N2C[C@@H](OC)C[C@H]2C(=O)N2CCCC2)cc1)C(C)C 331416089 KIMQZMAGGNYJDX-PMACEKPBSA-N 387.524 2.773 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCOC[C@@H]3C[C@@H](O)c3ccco3)cc2)CC1 158903916 ZWYSFYMDMYMTQV-RBUKOAKNSA-N 383.448 2.830 0 50 GFAA Cc1ccn(-c2ccccc2NC(=O)N2C[C@@H](C(=O)O)[C@H](C(F)(F)F)C2)n1 263128213 XUKDVFFSESASOO-VXGBXAGGSA-N 382.342 2.908 0 50 GFAA CC(C)Cn1nc(C(=O)NCc2cccnc2)c2c1CCN([C@@H]1CCSC1)C2 19745977 UHQHRHRVPXHPMC-QGZVFWFLSA-N 399.564 2.728 0 50 GFAA Cc1c(C(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)sc2[nH]cnc(=O)c12 426475570 SALGGBDNCOHMGL-AWEZNQCLSA-N 384.461 2.509 0 50 GFAA O=C(NCc1nnc2n1CCC2)c1ccc2nc(-c3ccc(F)cc3)cn2c1 95382010 FJCRHPMROVXNJV-UHFFFAOYSA-N 376.395 2.608 0 50 GFAA Nc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)cn1 95353500 VXWPMMXHCZEJQE-UHFFFAOYSA-N 392.503 2.751 0 50 GFAA CCN1C[C@]2(CCCN(CCOc3c(OC)cccc3OC)C2)CCC1=O 91693726 SCLQPNWCRLXYNO-OAQYLSRUSA-N 376.497 2.807 0 50 GFAA Cc1cc(CS(=O)(=O)Cc2nn(-c3ccc(F)cc3)c3c2CCC3)no1 179803663 VEXOWXWACNGGCZ-UHFFFAOYSA-N 375.425 2.912 0 50 GFAA COc1c(S(=O)(=O)Nc2ccccc2C(N)=O)ccc(Cl)c1Cl 252506873 WCGRFTUXOLRHOL-UHFFFAOYSA-N 375.233 2.902 0 50 GFAA COCCn1c(C)cc(C)c(C(=O)Nc2nc(-c3ccccn3)cs2)c1=O 253408974 LGHMOLPQXHTHBE-UHFFFAOYSA-N 384.461 2.882 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C1 299740713 BHFQHIQIOFNRTO-NSHDSACASA-N 394.353 2.710 0 50 GFAA CC(C)C(=O)N1CCn2nc(CNC(=O)C[C@@H]3CCc4ccccc43)cc2C1 299769438 PNFXHLXXQIUEQO-KRWDZBQOSA-N 380.492 2.618 0 50 GFAA C[C@H](CCC(=O)Nc1ccc(OC2CCN(C)CC2)cc1)N1CCN(C)CC1 952973779 HSXWCJMEQIGGOG-GOSISDBHSA-N 388.556 2.514 0 50 GFAA COc1cc(Br)cc(NC(=O)N2CC[S@@](=O)CC[C@@H]2C)c1 408041985 JFKPSHIQEQFXBL-CWKPULSASA-N 375.288 2.833 0 50 GFAA O=S(=O)(NC[C@H]1CN(C2CC2)CCO1)c1cc(Cl)cc(C(F)(F)F)c1 187097458 SRBSGDOYWXABRI-ZDUSSCGKSA-N 398.834 2.500 0 50 GFAA COc1cc(S(=O)(=O)N2CCC[C@@]3(CCC[C@H]3O)C2)c(OC)cc1Cl 1704298168 GGKMUVCAKLUOFN-SJORKVTESA-N 389.901 2.673 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccc(I)cc1 229837249 BNGSBGUINYKDPI-DUBDDPSESA-N 379.197 2.993 0 50 GFAA O=C(CCc1ccccc1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@]2(CO)C1 1772819848 VOVMVOMAPFIBDV-NFBKMPQASA-N 382.479 2.711 0 50 GFAA CC(=O)N1C[C@H]2CN(c3ncnc4[nH]ccc34)C[C@]2(CCc2ccccc2)C1 1772813193 VEHVKKFFUKTZPW-AVRDEDQJSA-N 375.476 2.875 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)NCCN2CCCC2)no1 12054606 GSZPJJACLZTBPU-UHFFFAOYSA-N 379.844 2.741 0 50 GFAA CC(C)(C)C(=O)N1CCC(C(=O)N2CCN(c3ccc(F)cc3)CC2)CC1 12381232 YLHANTQNOFZPPJ-UHFFFAOYSA-N 375.488 2.759 0 50 GFAA COc1ccc(/C=C2\SC(=O)N(CC(=O)N3CCCCC3)C2=O)cc1OC 13027211 VEDRYXJODRJKKO-WJDWOHSUSA-N 390.461 2.753 0 50 GFAA CN(C)CCN(C)C(=O)c1cccc(OC2CCN([C@@H]3CCSC3)CC2)c1 14979265 XQPDMEBWCYCNIT-GOSISDBHSA-N 391.581 2.669 0 50 GFAA CSc1cccc(CN2CCC[C@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 15073280 BSONDTSBSVEYKE-IBGZPJMESA-N 394.504 2.987 0 50 GFAA CCOc1ccccc1CN1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 19520187 SIJPXTKQCYGEAK-UHFFFAOYSA-N 378.469 2.731 0 50 GFAA CC[C@]12COC(=O)N1CCN(c1nc(-c3ccc(OC)cc3)ccc1C(=O)O)C2 1857672925 JVMWLBVTIKUJJJ-NRFANRHFSA-N 397.431 2.876 0 50 GFAA Cc1c(-n2ccnc2-c2ccc(OCCCN3CCOCC3)cc2)cnn1C 1857704217 IVKQRVBUJHUQGJ-UHFFFAOYSA-N 381.480 2.682 0 50 GFAA COc1cnc(C)cc1C(=O)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1857722635 KXVBDQGZSULNHD-UHFFFAOYSA-N 394.475 2.892 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857732849 KEQBZEJODUOIDX-JOCHJYFZSA-N 395.507 2.770 0 50 GFAA COC(=O)c1cccc(C(=O)NC[C@@H]2Cc3cc(-c4cnccn4)ccc3O2)c1 12055483 NYUPOZZFAGMOOD-SFHVURJKSA-N 389.411 2.664 0 50 GFAA O=C(NC1CCCC1)c1cn([C@@H]2CCCN(Cc3ccc4c(c3)OCO4)C2)nn1 12028626 FTGZCLONHRAGAY-QGZVFWFLSA-N 397.479 2.516 0 50 GFAA COCc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1 239591421 BBHODDZKCOXUKG-IBGZPJMESA-N 388.489 2.933 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(N2CCNC2=O)cc1 264337057 UVFQOMUQSLDHAD-LJQANCHMSA-N 392.503 2.511 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1)c1c(Cl)n[nH]c1C1CC1 867242401 HXZQHNFPKUBYNH-CQSZACIVSA-N 388.855 2.790 0 50 GFAA O=S(=O)(Nc1cnc(C2CCOCC2)nc1)c1c[nH]c(C(F)(F)F)c1 1875281123 QAQYFGUGVADKQT-UHFFFAOYSA-N 376.360 2.518 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@H]2Cc3n[nH]cc3[C@H](C(F)(F)F)C2)cc1 1875368902 DOPNHNUHGZEMAM-TZMCWYRMSA-N 378.354 2.925 0 50 GFAA C=CC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)cc2Br)[C@@H](C)C1 1875371163 RFCVTGAGDNNTNT-NWDGAFQWSA-N 399.260 2.601 0 50 GFAA CC(C)(NC(=O)NCCC1CS(=O)(=O)C1)c1ccc(C(F)(F)F)cc1 883638305 IJHWNNIYZHTCCE-UHFFFAOYSA-N 378.416 2.674 0 50 GFAA C[C@H]1CCc2n[nH]cc2[C@H]1C(=O)NCc1ccccc1CN(C)C(=O)C1CC1 1775996894 MAHJRGYJZCFYNS-XOBRGWDASA-N 380.492 2.760 0 50 GFAA O=C(NCc1ccc(CN2CCCCC2)cc1)C(=O)Nc1ccc2c(c1)OCO2 4784070 VVQGQKAJYFPTEC-UHFFFAOYSA-N 395.459 2.656 0 50 GFAA Cc1cc(Cl)cn2cc(CNC(=O)c3cncc(N4CCCC4=O)c3)nc12 2325781638 QUIVNAGVNRAKMM-UHFFFAOYSA-N 383.839 2.748 0 50 GFAA CN(C)Cc1cc(Cl)ccc1NC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1 2325856814 DITBNPPZWLXKII-UHFFFAOYSA-N 385.855 2.538 0 50 GFAA Cn1c([C@H]2NC(=O)c3ccccc32)nnc1N1C[C@@H](F)[C@@H](Cc2ccccc2)C1 2325885891 DSMDVEKXMLBOKD-IPELMVKDSA-N 391.450 2.665 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CC[C@](O)(c3ccc(C(F)(F)F)cc3)C2)CC1 2325887864 GIKNRZBSWQLFJX-LJQANCHMSA-N 396.409 2.550 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1 806782 HRNDXHNVXXYGMD-CQSZACIVSA-N 382.416 2.864 0 50 GFAA COc1ccccc1[C@@H]1CC(c2cccc(NS(C)(=O)=O)c2)=NN1C(C)=O 1077208 BYUPBKBNHSREQZ-SFHVURJKSA-N 387.461 2.764 0 50 GFAA Cc1cc2occ(CC(=O)N3CCC4(CC3)CNC(=O)CO4)c2c(C)c1Cl 2356145518 DTJGKODRRSEYPS-UHFFFAOYSA-N 390.867 2.753 0 50 GFAA CC[C@@H](NC(=O)[C@@H](C)NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763988 ITQJMWBMKOWEGP-VQIMIIECSA-N 398.459 2.940 0 50 GFAA CN(C)C(=O)N1CCC[C@@H](C(=O)Nc2nnc(CCc3ccccc3)s2)C1 59745323 XFGIKAJGLKMQSU-OAHLLOKOSA-N 387.509 2.655 0 50 GFAA COc1ccc(OC)c(-c2nc(CN3CCN(c4ncccn4)CC3)c(C)o2)c1 55198474 USGREWJYNHGOIN-UHFFFAOYSA-N 395.463 2.779 0 50 GFAA CCN(C)C[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)C1 246900148 KEOPJKMORRQBPG-FNHZYXHNSA-N 377.916 2.660 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCn2nc(C)c(Br)c2C)cc1 2782339 JQMVPIUIMRSQPX-UHFFFAOYSA-N 386.315 2.939 0 50 GFAA COc1cc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)ccc1F 252499991 SLHMVDPCUJDFDT-UHFFFAOYSA-N 386.832 2.990 0 50 GFAA CC(C)[C@@H](CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccccc1 252498621 RGEXJFIEEYUOOO-HXUWFJFHSA-N 389.517 2.899 0 50 GFAA CN(C)[C@@H](CNc1ncnc2ccc(S(C)(=O)=O)cc12)c1ccc(F)cc1 252501551 UHFXSYJBPKXASK-SFHVURJKSA-N 388.468 2.887 0 50 GFAA Cc1cccn2c(CN3CC[C@@H](O)C3)c(C(=O)N(C)CCc3ccccc3)nc12 71422142 MNEVNLMDTYTCRQ-LJQANCHMSA-N 392.503 2.524 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCC2)NCCc1c[nH]c2ccc(Cl)cc12 71281283 LYOPUMMXJNPMBD-UHFFFAOYSA-N 384.867 2.616 0 50 GFAA CC(C)(C)c1ncc(C(=O)NS(=O)(=O)N2CCCc3ccccc32)s1 121447407 FRGSBTROGXFGHG-UHFFFAOYSA-N 379.507 2.868 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@H](O)c2ccc(F)cc2F)n1C 328625543 DFYRTJJSCBLKCD-MJGOQNOKSA-N 377.435 2.924 0 50 GFAA Cc1oc2nc(CN3CCC[C@@H](c4nnc5ccccn45)C3)nc(N)c2c1C 153984561 XJRAWOCMCGGZPH-CQSZACIVSA-N 377.452 2.844 0 50 GFAA Cc1cc(C)n(CCCN(C)c2nc(-c3cccnc3)nc3c2CCNC3)n1 71763676 WNAZBFDMMXVBOA-UHFFFAOYSA-N 377.496 2.524 0 50 GFAA O=C(c1ccc(NC(=O)N2CCC[C@@H]2Cn2cncn2)cc1)N1CCCCCC1 363527779 MPXGYUTVKQMBBJ-LJQANCHMSA-N 396.495 2.991 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cc4ccccc4[nH]3)C[C@H]2CCO)n1 72421793 DMKTVJGYQBVWQI-LJQANCHMSA-N 378.476 2.580 0 50 GFAA O=C1NCCN1c1cccc(NC(=O)N2CCOC[C@@H]2c2ccc(F)cc2)c1 454453217 KOKOXZCSBBXLGL-GOSISDBHSA-N 384.411 2.961 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@H](c2ccccc2F)C1 171155500 DWSAHPUUQKHTPN-SFHVURJKSA-N 381.411 2.690 0 50 GFAA O=C(N[C@H]1CCCN(CCc2ccccc2)C1)c1ccccc1-c1nc[nH]n1 72420328 PBSUNHYQXFHRTG-SFHVURJKSA-N 375.476 2.909 0 50 GFAA CC(C)Cc1cn(C[C@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)nn1 48436174 YLZUZCFVDUOGDF-INIZCTEOSA-N 378.480 2.972 0 50 GFAA CCCc1cc(C(=O)OCC)c(NC(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)O)s1 225627962 WZHXSPWZDFLGBW-SYQHCUMBSA-N 381.450 2.694 0 50 GFAA O=C(c1cccc(O)c1)N1CCN(Cc2ccn(-c3ccc(F)cc3)n2)CC1 174668864 GIHGWPKMTBBLJF-UHFFFAOYSA-N 380.423 2.675 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)Cc3nccn3C)csc2C1 426431667 AJYGJKVGWUGZLP-UHFFFAOYSA-N 399.520 2.917 0 50 GFAA O=C(N[C@H]1c2ccccc2C[C@@H]1O)C1CCN(C(=O)CCc2ccccc2)CC1 176609863 YQHJDMSHJBGVKW-GMAHTHKFSA-N 392.499 2.632 0 50 GFAA CNC(=O)c1ccc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)cc1 237221848 IEZQXHZATSCFFZ-CALCHBBNSA-N 395.503 2.585 0 50 GFAA CCCn1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2c(C)noc2C)C3)c(C)n1 95381260 PLIWDFOYXXLSJF-ZWKOTPCHSA-N 385.512 2.943 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](CO)C[C@H](CN(C)C)C2)c2cc(Cl)ccc2n1 91656809 MWQQOTPONJULKJ-CABCVRRESA-N 375.900 2.829 0 50 GFAA Cc1cc(N2CCC3(CC2)CC(=O)N(Cc2cc(F)cc(F)c2)C3)nc(N)n1 92022351 LVGUEFBWQDBHQW-UHFFFAOYSA-N 387.434 2.665 0 50 GFAA O=S(=O)(N1CCCC1)N1CCc2c([nH]c3ccccc23)[C@@H]1c1ccccn1 95505593 YCKVHOMFZUJILB-FQEVSTJZSA-N 382.489 2.851 0 50 GFAA O=C(Nc1cccc(-n2cnnc2)c1)N1CCC[C@@H](OCc2ccccn2)C1 97743044 YZOKZBDSGACDNK-LJQANCHMSA-N 378.436 2.875 0 50 GFAA Cc1nc2ccc(C(=O)Nc3ccc(NC(=O)CN(C)C)cc3)cc2nc1C 525293249 ILQPSLKLCGXTNX-UHFFFAOYSA-N 377.448 2.999 0 50 GFAA COc1cccc(F)c1[C@@H](C)NCc1nnc2n(C)c(=O)c3cc(C)ccc3n12 179941588 VKOMSVNYVDFASV-CYBMUJFWSA-N 395.438 2.888 0 50 GFAA Cc1onc(-c2ccccn2)c1C(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 180888435 QUSZXBVUZZHWRC-GFCCVEGCSA-N 398.369 2.859 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)NCc1cn2ccsc2n1 1940195487 GRLHJGRDDXEYCB-UHFFFAOYSA-N 394.456 2.604 0 50 GFAA CS(=O)(=O)CCC(=O)N(Cc1cccc(F)c1)Cc1ccc2c(c1)OCO2 826615411 NPVFBVCGKGOVBA-UHFFFAOYSA-N 393.436 2.518 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)C[C@H]1CC(=O)O 218672677 PNXCGQIZIZHADE-OAHLLOKOSA-N 378.425 2.719 0 50 GFAA O=C(CSCc1ccccc1Cl)N[C@@H]1[C@@H]2CCO[C@@H]2[C@H]1N1CCCC1 1565509736 MJEWKSQUFXDROY-VLQPXKRTSA-N 380.941 2.941 0 50 GFAA O=S(=O)(NCCc1coc(-c2ccccc2)n1)N1CCc2ccccc2C1 170615271 HFDSQTFWWUFTQP-UHFFFAOYSA-N 383.473 2.777 0 50 GFAA C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccn(CC(=O)O)n1 190943835 GXEQXSBDMIJKPT-CYBMUJFWSA-N 380.404 2.764 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O 191569951 XKQXOHRVOXKQJB-HXUWFJFHSA-N 382.435 2.611 0 50 GFAA CCc1nc(C2CCN(C(=O)c3cc(N4CCCC4=O)ccc3F)CC2)n[nH]1 191579866 JCLGLVRNTXWWEE-UHFFFAOYSA-N 385.443 2.653 0 50 GFAA CC(C)(C)OCc1cc(CNc2cc(N3CCCC[C@H]3CO)ncn2)no1 192359000 DTGSYTJTIGNAPG-HNNXBMFYSA-N 375.473 2.743 0 50 GFAA S=C(NCc1cccs1)N1CCOC[C@H]1c1ncn(Cc2ccccc2)n1 789395300 PHPFWTGXPBPRGM-KRWDZBQOSA-N 399.545 2.836 0 50 GFAA O=C(N[C@H]1CCNC[C@@H]1O)c1cccc(-c2ccc(OC(F)(F)F)cc2)c1 219719689 HUGODTKIHGCEKX-IRXDYDNUSA-N 380.366 2.705 0 50 GFAA Cc1cc(C)c(C(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)c(O)n1 1704298643 JQFQNHNWRLIEKC-VQIMIIECSA-N 377.444 2.628 0 50 GFAA O=C(Nc1cccc(F)c1)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12004162 XGLVUUVPUXUKQQ-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1cc(C)[nH]n1 12304930 BBABGUDGJGOCDE-UHFFFAOYSA-N 388.487 2.858 0 50 GFAA O=C(CCCN1CCOCC1)N1CC[C@@]2(CCCN(CC3CCCCC3)C2)C1 12596124 RREUKYXGTHYXSK-HSZRJFAPSA-N 391.600 2.994 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@H](CNC(=O)c2cccc3ccccc23)C1 12613018 QLTCVVFDELBDDM-MRXNPFEDSA-N 392.459 2.742 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1CCCc1ccccc1 12712898 NFBMNTOVKYCHAV-HXUWFJFHSA-N 376.464 2.698 0 50 GFAA CC(C)(C)[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)Cn1nc(O)ccc1=O 15062498 FQKFHEMPFQCSBL-FQEVSTJZSA-N 380.448 2.602 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)NC(C)C)C3)C2=O)c1 15080259 IFOQDNIYQVLUEQ-HXUWFJFHSA-N 377.460 2.767 0 50 GFAA Cc1ccc2nc(NC3=N[C@H](C(=O)Nc4ccccc4)CC(=O)N3)nc(C)c2c1 17043678 UFBKHNPTUMBVFO-KRWDZBQOSA-N 388.431 2.542 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772215 OQXNNLYFKHPTSJ-CYBMUJFWSA-N 380.370 2.612 0 50 GFAA O=C([C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1)N1CCc2c([nH]c3ccccc23)C1 169772791 CVEFEZZPTOJTSQ-AWEZNQCLSA-N 399.454 2.982 0 50 GFAA CCC(=O)N1CCC(C2CCN(C(=O)c3cc(C(C)C)[nH]c(=N)n3)CC2)CC1 1857734115 FDQFEMVUPPOGTM-UHFFFAOYSA-N 387.528 2.513 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1cc3c(cc1Cl)OCO3)C[C@@H]2O 1857736942 RQLBDIFDVKZDGV-CGRMTHRGSA-N 387.863 2.638 0 50 GFAA O=C([C@@H]1CC12CCNCC2)N1CCO[C@H](c2ccccc2Br)C1 236588121 HHAQPJDXAHZPIT-HOCLYGCPSA-N 379.298 2.739 0 50 GFAA Cc1cc(CNC(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)nc(N(C)C)n1 241590530 PFOFCTYMJNXDSE-LBPRGKRZSA-N 399.430 2.601 0 50 GFAA CO[C@@H](C)C(=O)Nc1c(C(O)(C(F)(F)F)C(F)(F)F)cnn1C(C)C 864096377 AEKYPTNNQCXXMU-ZETCQYMHSA-N 377.285 2.750 0 50 GFAA COCCc1nsc(N2Cc3cnn(-c4ccncc4)c3CC(C)(C)C2)n1 952891888 ABEZQODHFWMMLN-UHFFFAOYSA-N 384.509 2.897 0 50 GFAA COc1cccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1F 1875258688 WFXFCYVUWYZDFO-GFCCVEGCSA-N 398.481 2.935 0 50 GFAA O=C(NCc1cc(O)nc(O)n1)C1C[C@@H]2CCC[C@H](C1)C21SCCS1 1875269562 ZRDUTQQTEAZACM-YOGCLGLASA-N 381.523 2.507 0 50 GFAA O=C(NCc1ccccc1CN1CCC(O)CC1)c1ccc2c(c1)COCC2 1875280547 VQKUICYIXKHENC-UHFFFAOYSA-N 380.488 2.646 0 50 GFAA CC(C)[C@H](C(=O)NC[C@@H]1C[C@H](CC(N)=O)CO1)c1cccc(C(F)(F)F)c1 1875310626 WDVFTRMMUTZTQU-PVUWLOKVSA-N 386.414 2.842 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)C(C)(C)Oc2ccc(F)cc2)C[C@H]1C(F)(F)F 1875383207 LEVKTGSIUJJCNK-ZIAGYGMSSA-N 388.361 2.675 0 50 GFAA CN(C)C/C=C/C(=O)NC[C@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C 1875377377 ZADZLMZNCJOHTQ-BVBGJJFLSA-N 379.423 2.552 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(c3ncnc4sc(C)cc34)C2)ccn1 886043306 SNSCHAPEUILCDT-MRXNPFEDSA-N 383.477 2.689 0 50 GFAA C[C@H](NC(=O)C1=NO[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1cncs1 889505781 AUPGTZBHUDKJQS-KPZWWZAWSA-N 394.497 2.866 0 50 GFAA COC(=O)c1cc(=NC(=O)N[C@@H]2CCC[C@H]2c2ccc(Cl)cc2)[nH]n1C 2325819153 WPVCAFHKHWTDGL-UONOGXRCSA-N 376.844 2.740 0 50 GFAA CN(C(=O)[C@H]1CC2(CC2)CO1)[C@@H]1CCN(C(=O)c2ccc(C(C)(C)C)cn2)C1 2325827737 OUTGAHMVVKNZOA-SJLPKXTDSA-N 385.508 2.621 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2CCCN(C(=O)c3cccs3)CC2)c1 2325885106 URGFRYMTZVPPCF-UHFFFAOYSA-N 383.473 2.861 0 50 GFAA C[C@@H](NC(=O)CSc1nc(=O)cc(N)n1-c1ccccc1)c1ccccc1 657250 RCEGTTUIVPAPDG-CQSZACIVSA-N 380.473 2.784 0 50 GFAA COc1cccc([C@@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)c1OC 956268 HVBGHCIUWJHKJM-QGZVFWFLSA-N 392.419 2.618 0 50 GFAA O=C(NN1C(=O)c2ccccc2C1=O)c1cccc(NC(=O)c2cccs2)c1 1216834 FBBXFDXELDRGLQ-UHFFFAOYSA-N 391.408 2.941 0 50 GFAA CS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 2806930 DGIGUTGSEGPOJH-VIFPVBQESA-N 384.807 2.969 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)NC1CCCCCC1)S(C)(=O)=O 2816784 KTGIDLGVWOITMR-UHFFFAOYSA-N 388.917 2.954 0 50 GFAA CCOC(=O)CN(c1ccc(OCC)cc1)S(=O)(=O)c1ccc(F)cc1 2873150 LULSJUCIUVBWOD-UHFFFAOYSA-N 381.425 2.983 0 50 GFAA COc1ccc(N[C@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccc(Cl)cc2)cc1 4158930 LGRQAOZPZCZMGN-DLBZAZTESA-N 395.864 2.783 0 50 GFAA Cn1c(CCCOc2ccc(Cl)cc2Cl)nnc1SCC(N)=O 8784596 IVHGFIKDCSRWFK-UHFFFAOYSA-N 375.281 2.711 0 50 GFAA Cc1cccc(C)c1NC(=O)c1ccc(NC(=O)c2cc(=O)[nH]c(O)n2)cc1 55196618 DYPYPMJOZNMTRN-UHFFFAOYSA-N 378.388 2.597 0 50 GFAA CCSc1nc(CC(=O)N(C)Cc2nc(-c3ccncc3)no2)cs1 55053700 MXVFZHXCDVQFMA-UHFFFAOYSA-N 375.479 2.901 0 50 GFAA CCOC(=O)C1CCN(c2nc3cccnc3n(Cc3ccccc3)c2=O)CC1 21782481 GHHCCNXVUMSAHQ-UHFFFAOYSA-N 392.459 2.619 0 50 GFAA CN1C[C@H]2[C@@H](c3cn(-c4ccccc4)nc3-c3ccncc3)N[C@@](C)(CO)[C@H]2C1 65492366 DLCBZSQHHUTDPC-VLSUOOLDSA-N 389.503 2.507 0 50 GFAA CC(C)c1nsc(NC(=O)c2ccc(CN3CCC[C@@H](C(N)=O)C3)cc2)n1 65383587 WUJCIUCPLDOGBA-OAHLLOKOSA-N 387.509 2.611 0 50 GFAA Cc1ncsc1CNC(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252488666 IWMOIULTQOFIJQ-UHFFFAOYSA-N 394.522 2.994 0 50 GFAA CN(C(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 120046029 OPPOWJLRJMQNNP-LJQANCHMSA-N 376.460 2.770 0 50 GFAA O=C(NCC(F)F)[C@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 71758974 JXXIFXLNFZMQNQ-SFHVURJKSA-N 391.506 2.712 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N[C@@H]2CCN(c3ccccc3OC)C2)cc1 120429212 ZMHAWZLUXKSCBB-QGZVFWFLSA-N 382.464 2.845 0 50 GFAA CC(C)(O)CCc1ccc(C(=O)NCc2csc(N3CCOCC3)n2)cc1 72468032 NKHMIEXNNWIZCR-UHFFFAOYSA-N 389.521 2.613 0 50 GFAA CN(C)c1cccc(CNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)n1 152261031 PMEIBGCYKKALLX-UHFFFAOYSA-N 382.445 2.930 0 50 GFAA O=C(COC[C@@H]1CCOC1)Nc1ncccc1CN1CCc2ccccc2CC1 362176536 GMQMCZWIMMYBNB-GOSISDBHSA-N 395.503 2.674 0 50 GFAA Cc1nn(C)cc1[C@@H]1CCCN1C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 363923886 SZUQFCNVUCOKCR-SFHVURJKSA-N 385.468 2.565 0 50 GFAA Cc1nc(C(=O)N(CCN(C)C)Cc2cccc(C(F)(F)F)c2)c(=O)[nH]c1C 155133813 SPTBEHKMXGFIJW-UHFFFAOYSA-N 396.413 2.610 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)CC(F)(F)F)CC3)CC2=O)c1 77319203 ATSBCMUNLKCEJJ-UHFFFAOYSA-N 384.398 2.989 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1ccccc1)NC(=O)/C2=C\N1CCOCC1 32609447 GJFRUQPNPYEUJG-NUVSWBFWSA-N 380.444 2.596 0 50 GFAA Cc1cc(O)cc(=O)n1CCC(=O)NCCc1nc(-c2ccccc2)cs1 218294777 UCRLNVUNTSYBGV-UHFFFAOYSA-N 383.473 2.735 0 50 GFAA COc1ccc([C@H](OC)[C@@H](C)NC(=O)NCc2ccc(-n3ccnc3)nc2)cc1 378383348 PUAUXNQTJDLQNC-FOIQADDNSA-N 395.463 2.851 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@H](C(=O)N4CCOCC4)C3)CC2)s1 82120211 BPLZQLQZRKWEGL-SFHVURJKSA-N 391.581 2.592 0 50 GFAA Cc1ccc2nc(CCC(=O)N3CCN(c4ccccc4)C(=O)C3)[nH]c2c1C 82166547 NUWKNVDZSIFDEK-UHFFFAOYSA-N 376.460 2.988 0 50 GFAA CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1 284609428 RPIXNYCXTJBRCX-DNVCBOLYSA-N 398.463 2.755 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2C(=O)NCc2ccc(-n3cncn3)cc2)n1 426395914 GHPZUUIKGYXRKW-INIZCTEOSA-N 381.440 2.820 0 50 GFAA CCS(=O)(=O)CCNC(=O)Nc1cc(NC(=O)C2CCCC2)ccc1C 426372167 FVZRUESCTJFFKC-UHFFFAOYSA-N 381.498 2.680 0 50 GFAA CN(C(=O)c1cnc2nc(O)nc(O)c2c1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C 288040314 DNTHMIKWNQZMQJ-HZPDHXFCSA-N 394.431 2.754 0 50 GFAA CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cnc(C2CC2)nc1N 288128879 PYWVDBNQFPCWGD-UHFFFAOYSA-N 380.496 2.710 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cc3cc(F)ccc3n2C)C2CC(O)C2)cn1 222860181 XKTVNJJYZUVBIC-QJXPYNDKSA-N 383.423 2.963 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(OC)c(C)c2C)CN1Cc1ccccc1 23360599 UNBSRMHSIXGTDX-RTWAWAEBSA-N 381.520 2.791 0 50 GFAA O=C(CCc1ccc(O)cc1)NCc1cc2n(n1)CCN(C1CCCCC1)C2 92081096 NBPJRVKVUJXQRM-UHFFFAOYSA-N 382.508 2.986 0 50 GFAA COc1cc(CN2CCCC2(C)C)ccc1OC[C@H](O)CN1CCSCC1 95521739 IOQVFPVGDFBPQM-GOSISDBHSA-N 394.581 2.858 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)cc1 91644747 LTFDPYANKUKVKL-RBUKOAKNSA-N 381.428 2.985 0 50 GFAA Cc1oc2c(c1C(=O)N1CC[C@]3(CCCN(CC4CC4)C3=O)C1)C(=O)CCC2 91877257 PWCYNHFNDFHVNR-JOCHJYFZSA-N 384.476 2.972 0 50 GFAA O=C(c1cc(=O)n(-c2ccccc2)[nH]1)N1CCC[C@H](c2nccn2CC2CC2)C1 95526278 VBDFNDYGDORKQJ-KRWDZBQOSA-N 391.475 2.792 0 50 GFAA O=C(Nc1ccnn1C1CCCCC1)N1CCC[C@H](CN2CCOCC2)C1 96162355 JOYLVJWJXUYIKN-QGZVFWFLSA-N 375.517 2.964 0 50 GFAA C[C@]1(Cc2ccc3c(c2)OCO3)CCC(=O)N(Cc2nnc3n2CCCC3)C1 91593965 OFZBRZDMNGHKCX-OAQYLSRUSA-N 382.464 2.715 0 50 GFAA Cc1cccc(N2C[C@@H](NC(=O)C3CCN(Cc4ccco4)CC3)CC2=O)c1 95383045 ZZTGGATWYUVJCJ-SFHVURJKSA-N 381.476 2.722 0 50 GFAA CNc1cc([C@H]2C[C@@H](NC(=O)c3cccc(-n4nc(C)cc4C)c3)C2)ncn1 244817224 SWQXEIGZSCGUIQ-CALCHBBNSA-N 376.464 2.997 0 50 GFAA COc1ccccc1-c1noc(CCC(=O)NCc2cnc3ccccn23)n1 252492040 MBGJYDIYKGYIKE-UHFFFAOYSA-N 377.404 2.642 0 50 GFAA C[C@@H]1O[C@H](C)CN2c3cc(Cl)ccc3CC3(C(=O)OC(C)(C)OC3=O)[C@@H]12 251781038 MXUWHMHCDMMPKV-JRPNMDOOSA-N 379.840 2.701 0 50 GFAA COc1ccc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)cc1OCc1ccc(F)cc1 1529153066 PIUQFSWUULZLMH-ZWKOTPCHSA-N 389.423 2.681 0 50 GFAA CCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(-n2nnnc2C)c1 952984504 UZOKYZPJYKQOAL-MSOLQXFVSA-N 384.484 2.632 0 50 GFAA CN1[C@H]2CC[C@@H]1Cc1nc(N)c(C#N)c(-c3cnc(N4CCCCC4)nc3)c12 71294149 MMPIGNLNKUYJDM-PBHICJAKSA-N 375.480 2.674 0 50 GFAA COc1ccc(/C=C/CN2CC[C@]3(O)CCN(C(=O)C4CCC4)C[C@@H]3C2)cc1 1565529221 WAHIXZMBTDHGBH-OPHREGNQSA-N 384.520 2.794 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ccc1C 170598316 JAJCZQXZAYSHGL-MGPUTAFESA-N 389.521 2.923 0 50 GFAA O=C(CN[C@H]1CCCc2c(O)cccc21)NCc1ccccc1Cn1cccn1 192357468 ZCTRTCYIPFZZQD-NRFANRHFSA-N 390.487 2.920 0 50 GFAA COc1ccc(C)c2c1N(S(=O)(=O)c1ccc(C(=O)N(C)C)cc1)CCC2 194626768 NYZVXRAEVNFNFI-UHFFFAOYSA-N 388.489 2.847 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc3ccccc3c2)s1 745258986 QPQXATANHCOLSS-UHFFFAOYSA-N 375.427 2.588 0 50 GFAA COCc1cc(CN2CCCN(C(=O)c3cccc(C)n3)CC2)ccc1OC 1772813964 COCKRZXBSJLZRV-UHFFFAOYSA-N 383.492 2.893 0 50 GFAA O=C1CCCCN1c1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1 11907613 LTQCCNSCLFXXIN-UHFFFAOYSA-N 399.516 2.714 0 50 GFAA O=C(CCc1ccccc1)N[C@@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 11950850 OSDYZLPZYMFIDZ-HXUWFJFHSA-N 394.519 2.812 0 50 GFAA COc1ccc(CCN2C(=O)CC[C@@H]2CCNCc2cccnc2)cc1OC 12151906 IJDZWNYPYLARFI-LJQANCHMSA-N 383.492 2.812 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNC3(c4ccccc4)CC3)C2=O)c1 12198082 GSYGBRSITWAHDY-HSZRJFAPSA-N 380.488 2.828 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1ccccn1 12421785 GASMXXYTQZHAJG-UHFFFAOYSA-N 375.450 2.517 0 50 GFAA CN(CCCC1CCCC1)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1 12715985 JXINYCRLZNXPDT-HXUWFJFHSA-N 389.515 2.945 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@@]1(O)CNC1C2CC3CC(C2)CC1C3 12718696 YKFSPNUEYXFHRO-XDCCUOHYSA-N 382.548 2.997 0 50 GFAA O=C1CCN(Cc2ccc(OCCO)cc2)CCN1Cc1cccc(Cl)c1 14988745 VETYITLRNRBVNV-UHFFFAOYSA-N 388.895 2.946 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(NCCn3ccc(C)n3)nc2)CCN1C(C)C 19334364 NZAKJTVTPLWURN-IBGZPJMESA-N 384.528 2.643 0 50 GFAA COc1cc(Cl)cc(C(=O)NC[C@@H]2CCC[C@H](NC(=O)C3(C)COC3)C2)c1 1857682321 IXIMSMACRZIOIZ-CJNGLKHVSA-N 394.899 2.790 0 50 GFAA O=C(N[C@H]1CCC[C@@H](CNC(=O)c2c(F)cccc2Cl)C1)c1cnccn1 1857684616 VODKVDHZQDBMCL-OLZOCXBDSA-N 390.846 2.988 0 50 GFAA COc1cc2c(cc1CN1C[C@H](O)[C@]3(C1)[C@H](c1ccccc1)[C@H]3CO)CCC2 1857722871 QZKHSKVKXOILNB-GNLZIIPMSA-N 379.500 2.753 0 50 GFAA Cc1cccn2c(CC(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3ccccc3)cnc12 1857723364 CFUXNQDAHSRRCC-UNMCSNQZSA-N 392.503 2.716 0 50 GFAA COC(=O)C1=NO[C@@]2(CCCN(C(=O)N[C@H](C3CCCC3)C(F)(F)F)C2)C1 1875296461 YGJNGHIGGOVQSQ-CJNGLKHVSA-N 391.390 2.601 0 50 GFAA c1ccc(N2CC[C@H](Nc3ncnc4nc(N5CCOCC5)sc34)C2)cc1 1875305235 NOVOFMGGLVSTQR-AWEZNQCLSA-N 382.493 2.614 0 50 GFAA CN(CCc1ccccc1)S(=O)(=O)N1CCC(c2ccccc2CN)CC1 1875307135 UQDBHZWKQJUGEG-UHFFFAOYSA-N 387.549 2.744 0 50 GFAA O=C(N1CC(O)(c2cccnc2F)C1)C1(c2ccccc2Cl)CCOCC1 1875312887 JEFAKLQDKPCETA-UHFFFAOYSA-N 390.842 2.652 0 50 GFAA Cc1c(C(=O)N[C@H](C)[C@@H](N)c2ccco2)nnn1-c1ccc(Cl)cc1F 1875340725 OVTOXMQXOBFXNP-RFAUZJTJSA-N 377.807 2.780 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1N=c1[nH]nc(-c2ccco2)cc1C(F)(F)F 1875398366 MYNPSLJLXRTWRK-NJZAAPMLSA-N 393.369 2.625 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)c2sc(Cc3ccccc3)nc2C)o1 1775959388 YJYINXLGFGAUAA-HUUCEWRRSA-N 398.488 2.936 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccn(-c4ccccc4)n3)ccc21 1164117 LPTRRFNVJOZHMV-UHFFFAOYSA-N 382.445 2.582 0 50 GFAA CC[C@H]1CCCCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 13545233 ISCJFBDBTWHHTC-INIZCTEOSA-N 394.537 2.894 0 50 GFAA CCCCc1oc2ccccc2c1C(=O)N=c1ccn(CCN2CCNC2=O)[nH]1 2325765367 FNHKSXSABZPXQY-UHFFFAOYSA-N 395.463 2.671 0 50 GFAA Brc1ccc(-n2cc(CNCc3cc4n(n3)CCCO4)cn2)cc1 2325777534 JHSISBPGQCDNSE-UHFFFAOYSA-N 388.269 2.904 0 50 GFAA O=C(c1ccc(Cc2nc[nH]n2)cc1)N1CCNC[C@@H]1c1cccc(Cl)c1 2325795090 DLMLDISKBJMAKY-GOSISDBHSA-N 381.867 2.836 0 50 GFAA Cc1oc(C(=O)N[C@@H]2CCCN(C(=O)[C@H](O)C(C)C)C2)cc1-c1ccccc1 2325828380 FUJOJFULRRFAAT-YLJYHZDGSA-N 384.476 2.993 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2Cc3ccc(O)cc3[C@H](C(=O)O)C2)cc1 2325851662 FWFSICGUOCWTFY-LJQANCHMSA-N 379.416 2.975 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CCc2ccc(O)cc2C1 2356163545 IHNVQYDEPMQABA-UHFFFAOYSA-N 390.439 2.868 0 50 GFAA CCCCNc1sc(S(C)(=O)=O)nc1S(=O)(=O)c1ccc(C)cc1 2823612 XSHOUAONWUMJJU-UHFFFAOYSA-N 388.536 2.900 0 50 GFAA Cc1ccnc(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)n1 6728492 VYUZGFHUHBOZEJ-VIFPVBQESA-N 376.507 2.801 0 50 GFAA COc1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)ccc1F 23358597 QIWVUIGBYWIWAL-FQEVSTJZSA-N 393.547 2.576 0 50 GFAA COc1cc(CN2CCN(c3ccc(Cl)cn3)C[C@H]2CCO)cc(OC)c1 106997116 WWYCANNBWNTMFI-QGZVFWFLSA-N 391.899 2.825 0 50 GFAA Cc1ccc(NC(=O)CC(=O)N[C@H](C)c2cn3ncsc3n2)cc1Cl 55244688 QFOJZDOCRKRREY-SNVBAGLBSA-N 377.857 2.959 0 50 GFAA CCCCCCNc1nc(OC)nc(N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)n1 3627354 KPBXTYDTNKBTLS-CVEARBPZSA-N 398.511 2.658 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)c4c[nH]nc4C)C3)C2)c1 11664750 DATZDRHNMRVWJN-NRFANRHFSA-N 386.471 2.994 0 50 GFAA Cc1noc(C2CCN(c3nccc(N[C@@H]4CCCO[C@H]4C(C)C)n3)CC2)n1 328652964 WREQVOQFRDZSQC-AEFFLSMTSA-N 386.500 3.168 0 50 GFAA CC[C@@H]1CN(C(=O)c2cc(Cl)c[nH]c2=O)CCC(=O)N1Cc1ccccc1 71661581 QXKUQAZWPWQZLK-MRXNPFEDSA-N 387.867 2.682 0 50 GFAA COc1ccc(Cl)cc1CNC(=O)CN1C[C@@H](CN)[C@H](c2ccccc2)C1 261686153 IQCZZWCRHBOOMW-MJGOQNOKSA-N 387.911 2.639 0 50 GFAA CCCN(C(=O)c1cn2cc(-c3ccc(OC)cc3)n(C)c(=O)c2n1)C1CC1 72429595 DZFDGIGPJQDIQF-UHFFFAOYSA-N 380.448 2.723 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCC(O)CC4)nc3)n2)c1OC 39430153 NYTAFXBQVLWTBX-UHFFFAOYSA-N 382.420 2.777 0 50 GFAA COCc1ccccc1C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 371641621 HWCKBKHXSXCMBW-QGZVFWFLSA-N 380.423 2.975 0 50 GFAA COc1ccc2[nH]c(C(=O)N[C@H]3CC(=O)N(Cc4ccc(F)cc4)C3)cc2c1 72120791 PUAZIFOPKVYDKK-INIZCTEOSA-N 381.407 2.847 0 50 GFAA CN(CC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)c1ncnc2[nH]cnc12 376157696 MDQNEDKHBOVXOM-BBWFWOEESA-N 376.464 2.584 0 50 GFAA C[C@H](c1ccc(F)cc1)N1CC[C@H](N2CCC3(CCC3)S(=O)(=O)CC2)C1=O 334050563 ROIUMRRMSLCKSL-QAPCUYQASA-N 394.512 2.531 0 50 GFAA Cc1cc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)sc1C(=O)O 237871817 KODLRWPQZJRTEA-UHFFFAOYSA-N 394.518 2.698 0 50 GFAA C[C@@H]1CN(S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)[C@H]1c1ccccc1 451285368 QTRXTOLKRYRSAV-RDTXWAMCSA-N 379.503 2.613 0 50 GFAA O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cnn(Cc2cccc(C(F)(F)F)c2)c1 226567759 ZRRYLPVTISPRSX-FPCVCCKLSA-N 391.349 2.617 0 50 GFAA Cc1cc(C)c(C(=O)N[C@@H](c2cnc3ccccc3c2)C2CC(O)C2)c(=O)[nH]1 220134703 PWSYUPBFIGKUNI-MKJPBZQASA-N 377.444 2.782 0 50 GFAA COc1ccccc1C(=O)N1CCN(C(=O)NC[C@@H](C)c2ccccc2)CC1 43306065 YXXFDJILBWRIQL-QGZVFWFLSA-N 381.476 2.966 0 50 GFAA CN(C)C(=O)NCc1cc2n(n1)CCCN(Cc1ccc(Cl)c(F)c1)C2 82139955 TXEHMRXNQGKWGT-UHFFFAOYSA-N 379.867 2.853 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)N1CCC[C@@H](Cn2ccnc2)C1 426604650 VWRDAGWXKSTCGZ-IBGZPJMESA-N 378.480 2.733 0 50 GFAA Cc1nc(N2CCCCC2)ncc1C(=O)NCc1ccc(-c2ncon2)cc1 426473692 UVYHNBRFILLYEC-UHFFFAOYSA-N 378.436 2.755 0 50 GFAA CN1C[C@@H]2[C@@H](CCCN2C(=O)NCc2cccc(COCC(F)(F)F)c2)C1=O 284815442 BNVZXNGQMKJUFP-HZPDHXFCSA-N 399.413 2.528 0 50 GFAA CC(C)c1ccc(CN2CCC[C@]3(CCN(CCN4CCOCC4)C3)C2=O)cc1 426485749 MVHJMZUSWOLJIG-XMMPIXPASA-N 399.579 2.957 0 50 GFAA CCC[C@]1(CO)CCCN(Cc2ccc(-c3nc(COC)cc(=O)[nH]3)cc2)C1 82039443 UFQQSTYOCDPKOK-QFIPXVFZSA-N 385.508 2.958 0 50 GFAA Cc1cccc2nc(CN(C)C(=O)NC[C@@H]3CCCN(C(=O)C4CC4)C3)[nH]c12 426503317 OLXQKJNUZRTEMU-HNNXBMFYSA-N 383.496 2.661 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)NCC[C@@H]3C[C@@H]4C=C[C@H]3C4)CC2)c1 426641625 YCQFGFUWNAHCQH-FGTMMUONSA-N 383.492 2.765 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2ccc(-n3nnnc3C)cc2)N(C)C)cc1 95528337 ZYOFIAQEBZAJIG-LJQANCHMSA-N 379.468 2.704 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CN1CCCOCC1)C1CCCCC1 95499289 FJCILMUIPVPNIB-OAQYLSRUSA-N 376.541 2.913 0 50 GFAA NC(=O)CN1CCC(C(=O)Nc2cccc(-c3cc4ccccc4[nH]3)c2)CC1 95512063 MBJOCNCMSWGIAW-UHFFFAOYSA-N 376.460 2.971 0 50 GFAA NC(=O)c1ccc(OCC(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1 290833014 CUWMNYRBVXEPDB-IBGZPJMESA-N 395.503 2.583 0 50 GFAA O=C(CC[C@H]1CCCN(C2CCNCC2)C1)N1CCN(Cc2ccccc2)CC1 95505590 YBDSJGGBWKNYNH-JOCHJYFZSA-N 398.595 2.575 0 50 GFAA Cc1c(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)ccn1C 91255727 WJOCYZAQWNYADQ-UHFFFAOYSA-N 380.492 2.774 0 50 GFAA O=C(NCCc1nnc2n1CCCCC2)N1CCO[C@@H](CCc2ccccc2)C1 182899488 PSBOXQAELVXXKJ-IBGZPJMESA-N 397.523 2.590 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)N1CCC[C@H](c2ncc[nH]2)C1 534586961 BJUJBMPCHUQDKH-INIZCTEOSA-N 380.452 2.515 0 50 GFAA COc1ccc(C)cc1C1(CNC(=O)c2ccc(C(=O)O)nc2)CCOCC1 299741313 DQVDMALEJAYBSY-UHFFFAOYSA-N 384.432 2.575 0 50 GFAA COc1ccc([C@H](CC(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)NC(C)=O)cc1 299749874 LXWYRSMJLGIQBN-BVBHFADKSA-N 388.464 2.507 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cccc3nonc23)C1)c1ccc2c(c1)CCO2 828169465 UXNGNJSFAUDWLZ-HNNXBMFYSA-N 392.459 2.800 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1CCC[C@H]1c1nc(-c2ccncc2)no1 952980137 YBJIPUPRXNYLHY-INIZCTEOSA-N 387.403 2.894 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)N(C)C[C@H](C)CN3CCCC3)cc12 952980945 QYQKYPCHQVSUMH-AWEZNQCLSA-N 377.510 2.601 0 50 GFAA Cc1cccc(C)c1CCNC(=O)c1nnn(-c2ccc3c(c2)OCCO3)c1C 165014996 VATNRLXPWVVLEV-UHFFFAOYSA-N 392.459 2.936 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCC([C@H](O)c2cccs2)CC1 1506403374 YCIJPPRCUFOFLO-IBGZPJMESA-N 399.520 2.707 0 50 GFAA O=C(Nc1ccccc1)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697533 ZKRCDEIVIHIGIT-UHFFFAOYSA-N 375.436 2.969 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1)N1CCOCC1 12433428 ZMHFEWRDWBMADN-SFHVURJKSA-N 382.508 2.928 0 50 GFAA Cc1cc(C(=O)N2CC[C@]3(CCCN(CCCc4ccccc4)C3=O)C2)n[nH]1 12446524 LGCCKPCISKAGDX-JOCHJYFZSA-N 380.492 2.806 0 50 GFAA CCOC(=O)C1(Cc2cccc(F)c2)CCN(C(=O)c2cnc(C)cn2)CC1 12590053 JYNOMOBKXISTJJ-UHFFFAOYSA-N 385.439 2.952 0 50 GFAA O[C@@H]1CCN(Cc2cn(Cc3ccccc3)nc2-c2ccc3c(c2)OCO3)C1 12709630 RSSSXTPIMWJYEI-LJQANCHMSA-N 377.444 2.894 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@@H](NCc1ccsc1)C2 14745785 CDJLLIYKUMAVOO-QGZVFWFLSA-N 395.532 2.937 0 50 GFAA CSCC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cscn3)n2)C1 19939743 YTTNEIHSRVTKGX-UHFFFAOYSA-N 387.490 2.811 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)Cc2cccs2)CC12CCN(Cc1ccco1)CC2 1857689466 FGQXFMHRUJZOBJ-KRWDZBQOSA-N 388.489 2.709 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4occc4C)[C@H]4CC[C@]3(C2)O4)nc1 1857715333 MXSJBQYTUYLPCM-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)CC4CC4)C[C@]34CC[C@H]2O4)cc1C 1857716825 GBLICOMHMHRQRU-DZCCDHAISA-N 382.504 2.839 0 50 GFAA Cc1cccc(CC(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)c1 1857723535 KFLSDXDNBPAJCU-GMAHTHKFSA-N 396.535 2.726 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCOC[C@H]1C(=O)O 262553787 XSIRWKAUWATUSY-ZDUSSCGKSA-N 396.852 2.610 0 50 GFAA O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCC[C@H](c2ncc[nH]2)C1 263961625 XRFPLBGWAWMDOD-LBPRGKRZSA-N 387.383 2.723 0 50 GFAA Cc1noc(C)c1CCNC(=O)N1CC(O)(c2cccc(Br)c2)C1 856859347 NTXHFGXBXLYXGW-UHFFFAOYSA-N 394.269 2.509 0 50 GFAA O=C([C@@H](c1cccc(F)c1)N1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1 862803272 KOISSFMVYLPCNP-FYYLOGMGSA-N 398.478 2.709 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)N[C@@]3(C(N)=O)CCCOC3)cs2)cc1 1875254039 RUJAALIKTITLFH-FQEVSTJZSA-N 387.505 2.627 0 50 GFAA CC(C)n1ncc2cc(C(=O)N3Cc4cccc(F)c4C[C@@H]3C(=O)O)cnc21 1875320349 PRTKKBPGTMBICA-QGZVFWFLSA-N 382.395 2.803 0 50 GFAA CC[C@@H]1CN(C(=O)CC2(OC)CCC2)CC[C@@H]1NC(=O)c1cc(C(F)F)[nH]n1 1875333883 OUKHVZYRQYNBRW-OLZOCXBDSA-N 398.454 2.663 0 50 GFAA O[C@@H]1C[C@H](Cn2cccn2)C[C@H]1NCc1ccc(OCc2ccncc2)cc1 1875399809 JNKQBFLOVLLNHV-CEMLEFRQSA-N 378.476 2.786 0 50 GFAA COc1ccc(CCCNC(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)cc1OC 1875314518 CDJUWDDCGFKBHI-KGLIPLIRSA-N 387.480 2.822 0 50 GFAA CC(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@H](CNc1ccccc1)c1ccccc1 1875344457 LEKSXEWRYBLFFQ-RTBURBONSA-N 389.521 2.530 0 50 GFAA CC1(c2cc(=NC(=O)NC[C@@]3(CO)CC34CCOCC4)[nH]o2)CCCCC1 1875404342 FXANUXXXLADYKQ-HXUWFJFHSA-N 377.485 2.619 0 50 GFAA CO[C@@H](C)C(=O)N1CCC2(CC1)C[C@@H](NC(=O)c1ccc(C)cc1C)CCO2 1775997998 XXXRPOVYSWHINS-ROUUACIJSA-N 388.508 2.608 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1)[C@H]1CCCO1 1054572 MYGZRAACDCICHL-LJQANCHMSA-N 386.473 2.946 0 50 GFAA O=C(O)c1cccnc1S[C@@H]1CC(=O)N(c2ccc(OC(F)F)cc2)C1=O 1126711 NTXUOUQVJJRNGM-GFCCVEGCSA-N 394.355 2.805 0 50 GFAA Cc1ccc2c(-c3ccc(C(=O)NC[C@H]4CN(C)C(=O)CO4)cc3)cccc2n1 2356137935 AYOPWEBJFVHOBJ-SFHVURJKSA-N 389.455 2.797 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc(-c3noc(C4CC4)n3)cc2)CC[C@H]1O 2356146014 NSOQUOXOBDHTAQ-IIBYNOLFSA-N 399.447 2.692 0 50 GFAA O=C(NC(=S)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)C1CC1 2852973 YWFPDXYLTQTWFD-UHFFFAOYSA-N 375.475 2.710 0 50 GFAA Cc1ccc(CNC(=O)COc2ccc(S(=O)(=O)NC(C)C)cc2C)cc1 4868067 SNSVLMDZTTZKFA-UHFFFAOYSA-N 390.505 2.685 0 50 GFAA COc1cccc(CCNC(=O)C(C)(C)NC(=O)c2cccs2)c1OC 55036058 VXRZXAQMSBQVFI-UHFFFAOYSA-N 376.478 2.633 0 50 GFAA O=C(CN1C(=O)OC[C@@H]1c1ccccc1)N1CCC(CCn2cccn2)CC1 20868808 DERGIHZJGAZMPY-LJQANCHMSA-N 382.464 2.705 0 50 GFAA Cc1cc(C)cc(OC[C@@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)c1 225835883 PPDZXALOIAMBNK-JTSKRJEESA-N 381.428 2.864 0 50 GFAA Cc1cc(C)cc(OC[C@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)c1 225835899 PPDZXALOIAMBNK-VGSWGCGISA-N 381.428 2.864 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)C[C@H]1N 418930139 AZPGTSHFZARFLM-NIKGAXFTSA-N 385.895 2.546 0 50 GFAA Cc1cccc(-c2cccc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4CNC[C@H]4C3)c2)c1 419512777 KXQTWEYONSPJPQ-YPAWHYETSA-N 391.515 2.783 0 50 GFAA CN1CCc2n[nH]c(C(=O)N3CCC[C@@]4(C=Cc5ccccc5O4)CC3)c2C1 67804273 GRJSKOBGXLPRGH-JOCHJYFZSA-N 378.476 2.868 0 50 GFAA Cc1ccc([C@@H](CNC(=O)c2cc(=O)c3ccccc3o2)N2CCOCC2)cc1 28289569 ZXNOQAANHQJWAW-LJQANCHMSA-N 392.455 2.905 0 50 GFAA O=C1C[C@@H](NC(=O)c2cc(Cn3cnc4ccccc43)on2)c2ccccc2N1 67855691 WKJLDWBXDZZJGM-QGZVFWFLSA-N 387.399 2.886 0 50 GFAA O=C(COc1ccccc1CN1CCO[C@@H](C(F)(F)F)C1)N1CCCCC1 71774400 SVGVHOHMVNMUOQ-QGZVFWFLSA-N 386.414 2.841 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN(c2cccc(F)c2F)CC1 363541255 HODPODWMCLGNMM-UHFFFAOYSA-N 398.417 2.577 0 50 GFAA COCC1(C(=O)N2C[C@H](c3cccc(OC)c3)[C@@H]3[C@H]2C2CCN3CC2)CCC1 72128408 XDICEBCQCUOBOQ-NJDAHSKKSA-N 384.520 2.901 0 50 GFAA O=C(CN1CCOC[C@@H]1c1nc(-c2cccs2)no1)N1CCc2ccccc21 366901382 QVPRDQCQGCJACT-MRXNPFEDSA-N 396.472 2.761 0 50 GFAA O=C1COc2cc(NC(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C(F)(F)F)c(Cl)cc2N1 369036820 RCIIRGCZVXCFMY-MHWZDGSBSA-N 390.745 2.965 0 50 GFAA Cc1ccc(Cc2nnc(NC(=O)c3nnn(C4CCNCC4)c3C)s2)cc1 156688287 LJLFSQMABABWGT-UHFFFAOYSA-N 397.508 2.514 0 50 GFAA CCn1ccnc1CN(C(=O)c1n[nH]c2ccccc12)[C@H]1CC12CCNCC2 262094919 HRXXTICNHSDPRP-KRWDZBQOSA-N 378.480 2.564 0 50 GFAA COCc1nc2ncc3c(=O)n(-c4ccccc4C(F)(F)F)ccc3n2n1 71376280 DDYOORITOSMLQA-UHFFFAOYSA-N 375.310 2.594 0 50 GFAA CCCc1ncncc1C(=O)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 72152118 PPCUCXNDKZCQNE-MRXNPFEDSA-N 382.464 2.917 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CC(n4cc(C(C)(C)O)nn4)C3)c2)cs1 378537044 VNSRVSNNYAKOEW-UHFFFAOYSA-N 383.477 2.635 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCN(C4CCCC4)C(=O)C3)cc2)cn1 426635559 UROSPDRZJSRFOF-UHFFFAOYSA-N 379.460 2.984 0 50 GFAA Nc1cncc(-c2cccc(C(=O)N3CCC[C@@H](CN4CCOCC4)C3)c2)c1 426513727 QSPKHOUFKXELNX-KRWDZBQOSA-N 380.492 2.515 0 50 GFAA COc1cc(-c2cnn(CC(=O)Nc3cc(C)nn3C3CCCC3)c2)ncn1 48353720 JSUOTSLYZNRDND-UHFFFAOYSA-N 381.440 2.607 0 50 GFAA COc1cccc(N2CCN(Cc3cccc(Cn4cccn4)c3)CC2=O)c1 82096301 DNUVBMUKUVMTLK-UHFFFAOYSA-N 376.460 2.789 0 50 GFAA COCCn1nc(C)c(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1C 176563194 HYZJHIYWSCOGGX-GOSISDBHSA-N 384.480 2.637 0 50 GFAA CCC[C@@H](NC(=O)c1sc(COc2ccc(F)cc2)nc1C)c1nnn[nH]1 176741626 CTKFEXGYTYFJDR-CYBMUJFWSA-N 390.444 2.954 0 50 GFAA CN(C)C[C@@H]1CN(C(=O)c2ccc(Cn3ccc4ccccc43)o2)C[C@@H]1CO 91985402 GBRXUFZANSGWIJ-QZTJIDSGSA-N 381.476 2.525 0 50 GFAA Cc1n[nH]c(C)c1CCN1CCC[C@@]2(CCC(=O)N(Cc3ccccn3)C2)C1 91808368 VVFADFFVTTZMIN-JOCHJYFZSA-N 381.524 2.869 0 50 GFAA Cc1cnn(CCC(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)c1 95509943 JAQYUBMRFQROGN-INIZCTEOSA-N 384.509 2.689 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)c1csc3c1CCCC3)CCN2C 95503655 SGKGJDPHFAKQRN-NRFANRHFSA-N 389.565 2.786 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Nc1ccccc1C(F)(F)F 239038796 DYHZTLSTMQNXRE-GQYKBVJTSA-N 390.361 2.697 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1ccn(Cc3c(Cl)cccc3Cl)n1)[C@H]1CC[C@H]2O1 245239971 NOOZLSAWAGEZOY-RRCSTGOVSA-N 392.242 2.905 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccccc1 253413025 SUGLCWZRPYGOGR-HIUFNZKISA-N 383.536 2.929 0 50 GFAA biogenic CCCn1cnnc1CN(C)C(=O)NCc1nn(C)c2cccc(Cl)c12 534637768 GCPRMRVZCYGEGN-UHFFFAOYSA-N 375.864 2.570 0 50 GFAA CC(=O)CCC(=O)N1CCC[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C1 55100430 TWMMKFBCXOGANL-LJQANCHMSA-N 377.916 2.822 0 50 GFAA CN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)Nc1ccc(OCc3ccccn3)cc1)C2 299773845 GCRGQSZKOMKWLD-QAPCUYQASA-N 380.448 2.745 0 50 GFAA Cc1cc(C)nc(-c2cccc(C(=O)NCCn3c(C)cc(C)nc3=O)c2)c1 299755929 FFFFQCBJQIAQRT-UHFFFAOYSA-N 376.460 2.969 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(c3ccccn3)C2)cc1OC 824312832 AEKWIKZLSJOXLW-HNNXBMFYSA-N 398.463 2.530 0 50 GFAA O=C(CN1CCN(c2ncccn2)CC1)N1CCCC[C@H]1CCc1cccs1 952990697 SCTYZZIXPBCQAU-SFHVURJKSA-N 399.564 2.674 0 50 GFAA Cc1ccc(Oc2ccc(NC(=O)C(=O)N[C@H]3CCc4[nH]ncc4C3)cn2)cc1 167410686 YLZNTOFULSFNEY-HNNXBMFYSA-N 391.431 2.518 0 50 GFAA Cc1cc(S(=O)(=O)Nc2ccc(C(=O)N3CC[C@@](C)(O)C3)cc2)ccc1F 170018036 XIZRXIAQLGNAQF-LJQANCHMSA-N 392.452 2.532 0 50 GFAA CCc1ccc([C@H]2CN(C(=O)Nc3cnn(-c4ncccn4)c3)CCO2)cc1 192279469 UOSOTCMLLFPFPI-GOSISDBHSA-N 378.436 2.830 0 50 GFAA Cc1cc(N2CCCN(C3CCN(C(=O)c4cccnc4)CC3)CC2)ccn1 1506428190 NRBMXJDAELXGAE-UHFFFAOYSA-N 379.508 2.602 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cccc(OCCN4CCCCC4)c3)C[C@H]2O)on1 1529146516 ZYTQIKLTMBROKR-NFBKMPQASA-N 399.535 2.883 0 50 GFAA CCCCN(Cc1ccc(C)cc1)C(=O)[C@H]1OCC(=O)N[C@@H]1c1cccnc1 1529152054 OHIPAFKGVDUGIS-RTWAWAEBSA-N 381.476 2.775 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@H]2CC[C@@H](N)CC2)ccc1F 1704336034 SUWIYVTZVAEZKW-BETUJISGSA-N 376.432 2.555 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N[C@H]3CCCN4CCC[C@@H]34)c2)o1 1772808454 QXRAKOIUJVZLTN-IRXDYDNUSA-N 375.494 2.864 0 50 GFAA CCc1ncc(C(=O)N2CCCN([C@@H]3CCN(c4ccc(F)cc4)C3)CC2)cn1 1775979035 SEOXUXLFAAQKPM-HXUWFJFHSA-N 397.498 2.605 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccn(C)c2)cc1 12305101 OKHWYVOXECNJRG-HXUWFJFHSA-N 391.475 2.691 0 50 GFAA CN(CCc1ccccc1)[C@H]1CCc2c(c(C(=O)N3CCSCC3)nn2C)C1 14743779 VWKCPUJWWCHBRC-SFHVURJKSA-N 398.576 2.641 0 50 GFAA COc1ccc(CNC(=O)c2cn(CC(C)C)cc(C(=O)NC(C)C)c2=O)cc1 14958265 GGJPFJRJJZTFFY-UHFFFAOYSA-N 399.491 2.581 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@H](NCCc3ccc(Cl)cc3)C2=O)cc1 19972530 DOECSZDLQFTPSZ-SFHVURJKSA-N 385.851 2.763 0 50 GFAA C[C@@H]1CN2C[C@H](NC(=O)c3cc(-c4cccnc4)nc4ccccc34)C[C@H]2CO1 1857673159 NTZZZZWULQYEPF-NXHRZFHOSA-N 388.471 2.888 0 50 GFAA O=C1CO[C@@H](COc2ccc(F)cc2)CN1C1CCN(C2CCCC2)CC1 1857680029 FGLIXUHSXHJQEV-HXUWFJFHSA-N 376.472 2.839 0 50 GFAA O=C1CC2(CCN(C(=O)c3cscn3)CC2)OCCN1Cc1ccccc1 1857692901 ZFOVFDNBCMLBGP-UHFFFAOYSA-N 385.489 2.567 0 50 GFAA COc1ccccc1Cc1nc([C@@H]2CCn3nccc3C2)n(-c2ccnn2C)n1 1857697553 CREXNNRYPKTWNT-MRXNPFEDSA-N 389.463 2.527 0 50 GFAA O=C(Nc1ccccc1F)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857708208 KYRPHEGQNYIIIC-OALUTQOASA-N 383.423 2.860 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)c2cccn2C2CC2)cn1 1857734917 YVMYJQONIAXNLL-SFTDATJTSA-N 397.523 2.625 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCOCC2)CC[C@H]1NC(=O)c1ccc(C)cc1 1875246349 MYPBRDASCPJGSO-XUVXKRRUSA-N 388.508 2.548 0 50 GFAA COc1ccc(-c2ccnc3nc(=NC(=O)c4cc5ccccc5[nH]4)[nH]n23)cc1 1875248145 ZFFVNLHGRUQGEL-UHFFFAOYSA-N 384.399 2.955 0 50 GFAA CCOc1cccc(N2CCN(C(=O)C[C@H]3OCCc4ccccc43)CC2)n1 115066805 VXCDJEDPMHUINH-LJQANCHMSA-N 381.476 2.833 0 50 GFAA Cc1c(C(=O)N(CC(=O)O)C2CC2)cnn1-c1ccc(Br)cc1 237726513 KWVPMSCIRQAFRG-UHFFFAOYSA-N 378.226 2.632 0 50 GFAA O=C(NCCc1ccc(OC(F)(F)F)cc1)c1ncoc1[C@@H]1[C@H]2CN[C@H]1C2 1875392948 AOSATOXYRYMPSQ-KWCYVHTRSA-N 381.354 2.621 0 50 GFAA Cc1cc(NC(=O)C(=O)N[C@H](C)c2ccc(NC(N)=O)cc2)cnc1C(F)F 1875300104 LJVXSVZZTBZARU-SNVBAGLBSA-N 391.378 2.634 0 50 GFAA O=C(Cc1ccc(C(F)(F)F)nc1)N[C@H]1CCS(=O)(=O)c2ccccc21 888092832 UPLRSHOOCFGOHS-ZDUSSCGKSA-N 384.379 2.678 0 50 GFAA O=C([C@@H]1CCCCO1)N1CCC(n2ncc3c2CN(c2ccccn2)C3)CC1 888103619 QFCMXDCUDMZESX-IBGZPJMESA-N 381.480 2.531 0 50 GFAA Cc1nnsc1C(=O)Nc1ccc(Nc2ccc(-n3cccn3)nn2)cc1 48985178 LBIFUCDELYJKKA-UHFFFAOYSA-N 378.421 2.818 0 50 GFAA Cc1ccccc1C(C)(C)C(=O)N(C)C[C@H](C)NC(=O)[C@H](C(C)C)N(C)C 2325794338 YWLQXBDTSCXESM-HKUYNNGSSA-N 375.557 2.822 0 50 GFAA NC(=O)c1c(NC(=O)Cc2ccc(N3CCOCC3)cc2)sc2c1CCCC2 2325807242 KVIJFDDDUPPZPF-UHFFFAOYSA-N 399.516 2.744 0 50 GFAA COCC1(C(=O)Nc2nc3c(Cl)cccc3n2CC(F)(F)F)COC1 2325814044 KQLXYANRPPSAKS-UHFFFAOYSA-N 377.750 2.854 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@H](c3cccc(OC)c3OC)C2)cc1 1165361 CBPUZZOZWLJICV-KRWDZBQOSA-N 390.461 2.823 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)c(C)n1C 2356134694 YEKGEFICLORSSB-JBYIUTFZSA-N 387.524 2.543 0 50 GFAA O=C(O)Cc1ccc(CN2CCC[C@]23CCCN(Cc2ccccn2)C3=O)cc1 2356148970 CCJFRZYBZVEXGV-QHCPKHFHSA-N 393.487 2.866 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)CCc3cc(Cl)no3)s2)n1 2356150053 JKJZMWKSYNIRSG-UHFFFAOYSA-N 380.861 2.807 0 50 GFAA CCC[C@@]1(C(=O)O)CN(c2ccnc(-c3ccc4c(c3)OCO4)c2)CC[C@H]1O 2356157359 HJIZHUUNNMZGIH-TZIWHRDSSA-N 384.432 2.919 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C(=O)Cc2cccc(C(F)(F)F)c2)C1 2356157405 JBDXGWSEIPGLPP-LJQANCHMSA-N 390.409 2.957 0 50 GFAA NC(=O)C1(N2CCCCC2)CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 4574446 QPKBDTATQRSVQP-UHFFFAOYSA-N 384.307 2.939 0 50 GFAA CC[C@H](C)NC(=O)c1ccccc1NC(=O)c1ccccc1NS(C)(=O)=O 6267347 BDKDPMZRSIRTCL-ZDUSSCGKSA-N 389.477 2.839 0 50 GFAA O=C(CCNC(=O)c1ccccc1F)NCC1(c2ccccc2)CCOCC1 55369229 YXPOFICDJVPRHS-UHFFFAOYSA-N 384.451 2.810 0 50 GFAA COc1ccc(Cl)cc1N([C@H](C)C(=O)N1CCC[C@@H](C)C1)S(C)(=O)=O 10541640 PRYJNAMQTUHASP-CHWSQXEVSA-N 388.917 2.762 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccc(C)cc3)[C@H](C)C2)cc1OC 101777648 MJGCELOFYUWBNL-MRXNPFEDSA-N 390.505 2.912 0 50 GFAA O=C(Nc1ccccn1)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 107086864 YKGYWCBMHTVTLT-USJZOSNVSA-N 377.400 2.795 0 50 GFAA Cc1ccc(C(N)=O)c(N2CCC(n3cc(Cc4ccccc4)nn3)CC2)n1 55358065 LHPYLBYCPIQIRT-UHFFFAOYSA-N 376.464 2.513 0 50 GFAA CC(C)(C)c1cc(N2CCN(CCO)CC2)n2ncc(-c3ccccc3)c2n1 20533244 IGAAXNVBHPXIHO-UHFFFAOYSA-N 379.508 2.808 0 50 GFAA CCN1CCN(C2(C(=O)NCc3cccc(C)c3)Cc3ccccc3C2)CC1 20451612 IXGMNSBXTPUXOE-UHFFFAOYSA-N 377.532 2.786 0 50 GFAA O=C(Cn1c(O)nc2ccccc2c1=O)N[C@H]1CCCc2c1[nH]c1ccccc21 409414274 JYRNGHKMGSISJF-SFHVURJKSA-N 388.427 2.777 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cccc(-n4cccn4)n3)CC2)oc1C 135484734 HBFDQEMXQBVIBR-UHFFFAOYSA-N 394.479 2.514 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3ccc(F)c(F)c3)CC2)C1 67742257 TZPMNZTZVWLBMN-INIZCTEOSA-N 377.479 2.920 0 50 GFAA Cc1cccc(C)c1-c1cc(C(=O)O)cc(S(=O)(=O)N2CCN(C)CC2)c1 72143105 WDOVWRHTXADXCY-UHFFFAOYSA-N 388.489 2.605 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1O)N1CCC[C@@H](CCc2ccccc2)C1 71498041 JHJWCTJSFQEAEF-KRWDZBQOSA-N 377.448 2.853 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 376819361 NDTIEMIWGOWJPD-GUDVDZBRSA-N 390.447 2.699 0 50 GFAA CCOc1ccc(NC(=O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 20176797 ZXIGQMIZTFOFJF-UHFFFAOYSA-N 397.475 2.570 0 50 GFAA O=C(O)Cn1ccc([C@@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)n1 426580679 GMUMVJJSJADZHA-LJQANCHMSA-N 382.508 2.812 0 50 GFAA C[C@@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)c1cc(F)cc(F)c1 426612478 DDICVIRFVBZUJR-OAHLLOKOSA-N 380.483 2.695 0 50 GFAA CC(C)N(C)c1ccc(NC(=O)N2CCN(C[C@H]3CCOC3)CC2)cc1F 176880398 NEELRQJIFWHRFX-MRXNPFEDSA-N 378.492 2.856 0 50 GFAA CCCn1ncc(C(=O)N2CCC(C(=O)NCCc3ccccc3)CC2)c1C 91656474 LLNMERHBCLTTDI-UHFFFAOYSA-N 382.508 2.813 0 50 GFAA CN(C)Cc1nnc(C2CCN(C(=O)c3ccc4ncsc4c3)CC2)n1C 96148510 PMVOZDKHPWLVNZ-UHFFFAOYSA-N 384.509 2.506 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCC(c2cc(=O)[nH]cn2)CC1 97572285 LVETUVSGEDPDRC-UHFFFAOYSA-N 380.473 2.837 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1C[C@@H]2CN(C3CCCC3)C[C@]2(C(=O)O)C1 96140434 ACTCSQYYWSAYDM-BUXKBTBVSA-N 380.847 2.880 0 50 GFAA C[C@@]12C=C[C@@](CO)(O1)[C@@H]1C(=O)N(c3cc(C(F)(F)F)ccc3Cl)C(=O)[C@H]12 244774187 PPIVCBCOLCHEFG-APYUEPQZSA-N 387.741 2.554 0 50 GFAA O=C1CCCc2occ(C(=O)N3CCOC[C@H]3c3ncnn3-c3ccccc3)c21 295815700 BWUGAXDSNMCCRJ-INIZCTEOSA-N 392.415 2.593 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)COCc1ccccc1)CC2 299282680 WVYADIPNXKFDJZ-SFHVURJKSA-N 399.443 2.821 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)c1nnn2c1CO[C@H](c1ccc(F)cc1)C2 263615569 DBPVWPOZBDKVIC-KRWDZBQOSA-N 382.351 2.670 0 50 GFAA COc1cccc(CCN(Cc2cccc(C)c2)C(=O)N[C@H]2CCNC2=O)c1 534577320 YDBLGRUAKZILGJ-FQEVSTJZSA-N 381.476 2.646 0 50 GFAA CCCn1ncc(CN2CCn3nc(CNC(=O)C4CCCC4)cc3C2)c1C 299760642 WCFNIWVHPVLUSW-UHFFFAOYSA-N 384.528 2.620 0 50 GFAA CN(C)CC(=O)Nc1ccccc1NC(=O)c1cnn(Cc2ccccc2)c1 823678143 AAPATEXQOUYPIT-UHFFFAOYSA-N 377.448 2.684 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@H]2CCCN(C(=O)c3ccco3)C2)c1C 670439897 PDPQCJFHQLXJCB-INIZCTEOSA-N 383.448 2.646 0 50 GFAA Cn1c(CO)nc2cc(C(=O)N3CCC[C@H]3Cn3cnc4ccccc43)ccc21 1336418298 UJYKIWDRZFIRER-INIZCTEOSA-N 389.459 2.720 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@H](CNC(=O)c3ccc(F)cc3C)C2)cc1=O 952965081 BOHXYIZKQNYMIE-MRXNPFEDSA-N 399.466 2.598 0 50 GFAA Cc1ccc(CN2CC[C@]3(O)CCN(C(=O)C4CCC4)C[C@@H]3C2)c(F)c1F 1565526247 NRMQGAAHXICUAD-UWJYYQICSA-N 378.463 2.859 0 50 GFAA O=C(COc1ccc(F)cc1)N1CCN(c2ncnc3c(F)cccc23)CC1 302785353 MQIYPXPAZMHQCZ-UHFFFAOYSA-N 384.386 2.636 0 50 GFAA O=C(NCc1cccnc1N1CCOCC1)N1CCCc2ccc(F)c(F)c21 170614983 KIQJNMXBDBYTKT-UHFFFAOYSA-N 388.418 2.859 0 50 GFAA COc1ccc([C@H]2CC(c3cc(OC)cc(OC)c3)=NN2S(C)(=O)=O)cc1 170615377 UUSDPFNSYWKANR-LJQANCHMSA-N 390.461 2.823 0 50 GFAA O=C(O)c1c(NCCN2CCCC[C@H]2CO)noc1-c1ccc(Cl)cc1 1704324620 BLDZUGWLRBMNPP-AWEZNQCLSA-N 379.844 2.952 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CN(c3cnccn3)C[C@]2(CCc2ccccc2)C1 1772815476 SEZGBKLJEOQZEA-OFNKIYASSA-N 388.519 2.781 0 50 GFAA CCN(C[C@H]1CCCO1)C(=O)CCc1nnc(-c2ccc(C(C)=O)s2)o1 11771930 SYPKDJYTAYPBOK-CYBMUJFWSA-N 377.466 2.961 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)/C=C/c3c[nH]cn3)C2)cc1OC 11820275 KYMVZISEWJBRNJ-XSBJJCPUSA-N 398.507 2.606 0 50 GFAA COc1cccc(-c2cnnc(N3CCN(c4ccccc4OC)CC3)n2)c1 11936897 LXAUBVMOQRFUGF-UHFFFAOYSA-N 377.448 2.882 0 50 GFAA C[C@H](CCn1cccn1)N1CCC(n2nccc2NC(=O)c2cccnc2)CC1 12299061 ULJDDTOMFMCHGW-QGZVFWFLSA-N 393.495 2.843 0 50 GFAA COCC(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 12430436 NHJPENSPFOXNHM-UHFFFAOYSA-N 386.414 2.987 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@H]1c1cccc(Cl)c1 13590345 QRUWDFCYKJYGTR-RCJHGTSTSA-N 382.840 2.506 0 50 GFAA CC(C)CC(=O)Nc1ccnn1C1CCN(C(=O)CN2CCCCCC2)CC1 14981162 IXIZEIDTDJQASE-UHFFFAOYSA-N 389.544 2.907 0 50 GFAA COCCN[C@H]1CCc2c(sc3ncn(Cc4ccc(C)cc4)c(=O)c23)C1 15072352 CZAHFHXLJGLBAL-INIZCTEOSA-N 383.517 2.908 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)CC1 16579634 YFFZFVGZYNTGGT-UHFFFAOYSA-N 381.281 2.597 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1857530398 GGUSVZBUBAUHJL-UHFFFAOYSA-N 388.892 2.972 0 50 GFAA CCCC1(NC(=O)[C@@H]2CC(=O)N(c3nnc(Cc4ccccc4)s3)C2)CC1 1857716982 HPIVTZDALUKBRQ-OAHLLOKOSA-N 384.505 2.931 0 50 GFAA CC(C)c1nc(CCNC(=O)[C@H]2CC(=O)N(c3nc4ccccc4s3)C2)no1 1857736047 NNHHLSUSMRGRGU-LBPRGKRZSA-N 399.476 2.515 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC[C@H](N)C2)cc1OC 237396425 STXYKTQOQUDJAI-INIZCTEOSA-N 392.459 2.730 0 50 GFAA CCn1cnnc1C1CCN(CC(=O)N(C)Cc2c(F)cccc2Cl)CC1 155399754 RAYPOKHPLWFVQQ-UHFFFAOYSA-N 393.894 2.929 0 50 GFAA O=S1(=O)CCC(S(=O)(=O)N2CCC[C@@H]2c2cccc3ccccc23)CC1 263648951 CPKKLJOSFPIXKC-LJQANCHMSA-N 393.530 2.884 0 50 GFAA Cc1ccccc1[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1ccccc1NC(=O)C1CC1 851051918 UTURMFUBOMSDID-DLBZAZTESA-N 398.484 2.952 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2ccccn2)nc1 1875401125 GDMCERFSWFYGIQ-QAPCUYQASA-N 390.447 2.591 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)COc2cc(Cl)cc(Cl)c2)o1 1775957303 MSZNSQYPXPDXOP-DGCLKSJQSA-N 386.235 2.652 0 50 GFAA C[C@@H](COc1ccccc1F)NC(=O)c1ccc(N2CCOCC2)c(F)c1 1318315524 FCLDJQZTSBMSLP-AWEZNQCLSA-N 376.403 2.999 0 50 GFAA Cc1nc2cc(CNC(=O)c3ccc4nnc([C@@H](O)C(C)C)n4c3)ccc2n1C 2100541292 ZUQKPQLCGHRZLJ-IBGZPJMESA-N 392.463 2.544 0 50 GFAA CN1CCc2nc(C(=O)N(C)[C@H](c3ccc(F)cc3)c3ncc[nH]3)sc2C1 2325822310 PYQBDKBOZLVJMM-MRXNPFEDSA-N 385.468 2.855 0 50 GFAA C/C=C/C[C@@H](CC)C(=O)N1[C@H]2CC[C@@H]1CN(C(=O)c1cc(N(C)C)ccn1)C2 2325872865 PTXDHLFTAHFXKQ-FRAGRWOZSA-N 384.524 2.955 0 50 GFAA CC(C)CSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccccc1Cl 625822 RFURUUVONSTNCN-UHFFFAOYSA-N 392.912 2.884 0 50 GFAA COc1cccc(NC(=O)CN(c2cc(Cl)ccc2OC)S(C)(=O)=O)c1 652985 DGTZHPGMQNBDDM-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA NS(=O)(=O)c1cc(C(=O)OCC(=O)c2ccccc2)c(Cl)cc1Cl 1158964 OFYZLACAKPMKCY-UHFFFAOYSA-N 388.228 2.681 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356151896 FRUDRWBHNMYYHV-FQEVSTJZSA-N 386.883 2.871 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)NC1CCCCC1 2870423 UZEYSPQFZVAEPT-UHFFFAOYSA-N 380.510 2.689 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C(=O)COc3ccccc32)oc2ccccc12 10110150 CTTJVJLUWIEDRY-UHFFFAOYSA-N 394.383 2.974 0 50 GFAA CCOC(=O)c1ncn(C2CCN(c3ncnc4c(F)cccc34)CC2)c1N 225751579 CZNOJMUYDZGBOT-UHFFFAOYSA-N 384.415 2.566 0 50 GFAA Cc1cccc(Cn2nc(C)cc2NC(=O)CCn2c(C)cc(C)nc2=O)c1 55383869 CRBWFRJZNGQPPU-UHFFFAOYSA-N 379.464 2.751 0 50 GFAA Cc1nc2ncccn2c1C(=O)Nc1cc(C(N)=O)ccc1N1CCC[C@H](C)C1 55100210 FREWLTUNLLPVRH-ZDUSSCGKSA-N 392.463 2.625 0 50 GFAA COc1ccc(F)c(-c2nc(CN3CCN(c4cnccn4)CC3)c(C)o2)c1 55385850 FRLFGNDSURKGIO-UHFFFAOYSA-N 383.427 2.910 0 50 GFAA O=S(=O)(c1cnn(-c2ccccc2)c1)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 246338092 LMSBLZKNAGQMAE-JXFKEZNVSA-N 386.521 2.510 0 50 GFAA CCSc1nnc(-c2ccccc2NC(=O)c2cnc(C)nc2C)c(=O)[nH]1 55402071 QOEOIXSWKBXYMM-UHFFFAOYSA-N 382.449 2.603 0 50 GFAA CN(CCCCN1CCOCC1)C(=O)CCc1nnc(C2CCCCC2)o1 20906345 UXPKHHJFGQABIZ-UHFFFAOYSA-N 378.517 2.621 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CC1 65363478 VSIXNTZECIAHOR-UHFFFAOYSA-N 393.896 2.528 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccc(OC3CCN(C)CC3)cc2)cc1 67601824 KLXJQPKXQCAXNI-UHFFFAOYSA-N 376.478 2.969 0 50 GFAA O=C1NC2(Cc3ccccc3C2)C(=O)N1Cc1ccc(-n2ccnc2)c(F)c1 348924869 NPNXUCLPUXJMQH-UHFFFAOYSA-N 376.391 2.601 0 50 GFAA Cc1ccccc1-c1noc(-c2ccccc2OCC(=O)N2CCOCC2)n1 21524676 BJQSJRSWXGNTPZ-UHFFFAOYSA-N 379.416 2.950 0 50 GFAA COc1ccc(-n2cccn2)c([C@H]2CC(=O)NCc3nc4sccn4c32)c1 65406788 DCRYRUJLJFMVHA-CQSZACIVSA-N 379.445 2.742 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@@H](c4[nH]ncc4-c4ccccc4)C3)nnc2n1 67947770 SVJSBGTZCNIXEP-MRXNPFEDSA-N 387.447 2.843 0 50 GFAA c1ccc(N2CCc3nc(N4CCN(CCc5ccncc5)CC4)ncc32)cc1 65526275 XVGIMENCVPCYDO-UHFFFAOYSA-N 386.503 2.931 0 50 GFAA CN(CCC(N)=O)c1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cn1 67804651 SYIQQFIPLICYGN-UHFFFAOYSA-N 394.519 2.878 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccccc2C(=O)O)ccc1C 1230686 ZVRHZDYBPCRVMN-UHFFFAOYSA-N 390.461 2.976 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)[C@@H]3CSCCS3)CC2)cn1 328633735 MGBQDXDFERSSGN-ZBFHGGJFSA-N 380.583 2.789 0 50 GFAA COc1cccc(C(=O)N2CCN(c3cc(C)nc(N4CCCCC4)n3)CC2)c1 72446883 NIHUSIDKVOFXKA-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA COCCC(=O)N1CCN(C(=O)Nc2cc(-c3nc(C)co3)ccc2C)CC1 252508739 XSEWKCHNGAXGTA-UHFFFAOYSA-N 386.452 2.671 0 50 GFAA Cc1nn(C)cc1-c1cc(-c2cn(C)nc2C)n(CC(=O)NC2CCCCC2)n1 13960909 FWQYBYSIFNECMR-UHFFFAOYSA-N 395.511 2.750 0 50 GFAA C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1 450787905 IHSBTIJSOCECQZ-AWEZNQCLSA-N 399.520 2.999 0 50 GFAA O=C(N[C@@H]1CCc2[nH]ncc2C1)N(CCO)Cc1ccc(Cl)c(Cl)c1 153366758 QKBCOTNISOGMJW-CYBMUJFWSA-N 383.279 2.778 0 50 GFAA C1CC([C@@H]2COCCN(CC3(CN4CCOC[C@@H](C5CCC5)C4)COC3)C2)C1 366499940 ZKGKPNNAAPOANQ-VXKWHMMOSA-N 392.584 2.500 0 50 GFAA COc1cc(C)c([C@H](C)NC(=O)CN2CCOC3(CCCC3)C2)cc1OC 158226008 NSQRVTIOEZNADI-INIZCTEOSA-N 376.497 2.834 0 50 GFAA CNc1nc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)cs1 72166461 UQWJPEQSMDTPRB-CGTJXYLNSA-N 384.505 2.593 0 50 GFAA CC1(Cn2cc(C(=O)N3CCC(c4cccc5cnccc45)CC3)nn2)COC1 376457191 CGTXFINXTDTWKA-UHFFFAOYSA-N 391.475 2.883 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1cccc3cn[nH]c13)CC2 262771583 LLEODNVRFFIMDA-MRXNPFEDSA-N 395.415 2.794 0 50 GFAA C[C@@H](NC(=O)N1CCc2ccnc(O)c2C1)c1cnn(Cc2ccccc2)c1 494808771 DBBPUMDCDVVKKF-OAHLLOKOSA-N 377.448 2.861 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cccc(Cl)c1Cl 129473404 PRCFWKNLTYCDAA-SNVBAGLBSA-N 391.280 2.545 0 50 GFAA O=C(NS(=O)(=O)CC1CCCCC1)c1cccc(OCC(F)(F)F)n1 172546627 RDMQGTHOZPFLNX-UHFFFAOYSA-N 380.388 2.663 0 50 GFAA CC(C)(C)C1CCC(O)(CNC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)CC1 173593034 OVZGGWXVJDAIQE-OJCRERRGSA-N 387.524 2.770 0 50 GFAA CN(CCOc1cccc(Cl)c1)C(=O)Cn1nccc1[C@H]1CCCNC1 426388227 XDROAWBDMMGSEG-HNNXBMFYSA-N 376.888 2.541 0 50 GFAA CC(=O)c1c(C)nn([C@@H](C)CC(=O)N(C)Cc2nc(-c3ccccn3)no2)c1C 426387729 PNXAESALOKUOLL-LBPRGKRZSA-N 396.451 2.757 0 50 GFAA O=C(N[C@@H]1CCN(Cc2cscn2)C[C@H]1O)c1ccc(-c2ccco2)cc1 426405111 IDUOQRYINIYEHA-QZTJIDSGSA-N 383.473 2.768 0 50 GFAA COCCC[C@@H]1CCCCN1C(=O)c1ccc(OC)c(N2CCOCC2)c1 91321861 LCLFXGXGUANGED-SFHVURJKSA-N 376.497 2.953 0 50 GFAA O=c1c(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)coc2ccccc12 20777614 XXRYJRJXQPKROL-NRFANRHFSA-N 392.499 2.904 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4cccnc4C)C3)CCC2=O)cn1 95499188 DESUBDZCFNDLII-JOCHJYFZSA-N 393.491 2.533 0 50 GFAA CC(=O)c1cc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)cs1 91997459 VJBVVXWUYLRKJV-UHFFFAOYSA-N 386.521 2.969 0 50 GFAA CCCN1C[C@H](NC(=O)c2cccc(-c3ccc4[nH]nc(N)c4c3)c2)CC1=O 534646471 GSGPQKWHIYMHBS-MRXNPFEDSA-N 377.448 2.553 0 50 GFAA O=C(NCc1cccc(F)c1)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 57992283 FRSPKGTUONAISJ-CDMIOBSGSA-N 379.435 2.774 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)Nc1cccc(CN2CCCC2)c1 828065515 VAVYAWHVZCYTBM-UHFFFAOYSA-N 378.480 2.908 0 50 GFAA CCn1cc(S(=O)(=O)NC[C@H](c2ccccc2)N2CCCCCC2)cn1 670462519 XEKKHJRVEBOQNP-LJQANCHMSA-N 376.526 2.799 0 50 GFAA C[C@@H](NCc1ccc(Sc2nncn2C)o1)c1nc(-c2ccncc2)no1 952985823 ASCWTBDPBCPPFZ-LLVKDONJSA-N 383.437 2.855 0 50 GFAA C[C@H](OC(=O)c1cnn(-c2cccnc2)c1)C(=O)N(C)Cc1cccc(F)c1 170616619 NRTGTBXFSFYQOA-AWEZNQCLSA-N 382.395 2.610 0 50 GFAA O=C(O)c1ccc(CCC(=O)N2CCCN(C(=O)c3ccccc3)CC2)cc1 191571835 LGURGWZHGQIEOM-UHFFFAOYSA-N 380.444 2.692 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCc2nc(-c3ccccc3)cs2)C1 1506425635 FMCGHDBPQNKFCT-AWEZNQCLSA-N 381.523 2.503 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)N1CCC([C@H](O)c2cccs2)CC1 1506416469 BQJZIKCLOBFNAP-FQEVSTJZSA-N 397.500 2.820 0 50 GFAA COC(=O)c1cccc(C(=O)N2CCC[C@H](Nc3ccc4c(c3)OCCO4)C2)c1 11932951 LJOZKHONZCYMME-SFHVURJKSA-N 396.443 2.961 0 50 GFAA COCc1ccc(C(=O)NCc2nnc(SCc3ccc(F)cc3)n2C)o1 12454938 ZGBWIBRAHHFEEK-UHFFFAOYSA-N 390.440 2.916 0 50 GFAA Cn1nc(C(=O)NCCc2ccccc2)c2c1CC[C@@H](NCc1ccco1)C2 14532680 JQUSYUWOFHKWMI-QGZVFWFLSA-N 378.476 2.633 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@](CO)(Cc2ccc(F)cc2)C1 14976328 SNRGWONRTJOVRS-QFIPXVFZSA-N 387.499 2.952 0 50 GFAA NC(=O)c1ccc([C@@H]2CCCN2C(=O)Cc2nc(-c3ccccc3)n[nH]2)s1 19642417 YMLFRUYEWAHRRZ-ZDUSSCGKSA-N 381.461 2.538 0 50 GFAA COc1c(C)cnc(Cn2c(-c3ccccc3)nc(C)c(CCO)c2=O)c1C 169754339 ONCYJOMISICIHH-UHFFFAOYSA-N 379.460 2.822 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cc(F)cc(F)c4)nnc3c2)n1 169776162 FYJUMFRCTBUDFE-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA COc1ccc(F)c(CN2CC[C@]3(C2)Cn2c(nnc2-c2cccnc2)CO3)c1 1857684533 RTAKARUJDILUEA-NRFANRHFSA-N 395.438 2.663 0 50 GFAA O[C@H]1C[C@H](c2ccccc2)OC2(CCN(c3nnnn3-c3ccccc3)CC2)C1 1857695382 HOUCTPPUNBKUFU-VQTJNVASSA-N 391.475 2.914 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)[C@H]2CC[C@H](c3ccccc3)N2)n1 1857731267 NFRKSXGLGLNPKC-HUUCEWRRSA-N 378.398 2.956 0 50 GFAA CCCc1nnc(N2C[C@@H](C(=O)NCc3nc4c(C)cccc4o3)CC2=O)s1 1857732973 PHKPVPBGTAOGJK-LBPRGKRZSA-N 399.476 2.610 0 50 GFAA Cc1nc2c(c(=NCC3CC3)[nH]1)CC[C@]21CCCN(C(=O)c2c(C)noc2C)C1 1875249072 COOWDRZBHRZXLO-QFIPXVFZSA-N 395.507 2.754 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2)c1)c1ccco1 125145063 FZLJXMBBBXLCDB-IBGZPJMESA-N 389.411 2.845 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@@H]12 910239213 FMOPREHMNBKVJJ-ZJIFWQFVSA-N 385.382 2.711 0 50 GFAA COc1ccsc1S(=O)(=O)NC(=O)Cc1ccc(Br)cc1 1875261729 SDKSMRPDHLYRNQ-UHFFFAOYSA-N 390.280 2.567 0 50 GFAA CN(Cc1cccc(C(F)(F)F)c1)C(=O)CS[C@@H]1CCCS(=O)(=O)C1 1875282040 KLSYCSKTJMKUOZ-CQSZACIVSA-N 395.468 2.974 0 50 GFAA CCn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3c(C)cc(C)nc3C)CC1)O2 1875394487 KCABPVCOGNUPSR-INIZCTEOSA-N 384.480 2.714 0 50 GFAA COc1ccc(CN(C(=O)[C@@H]2C[C@H]2C(=O)O)c2ccc3c(c2)OCO3)c(OC)c1 1775965306 SQSIMGNPNDHDOI-HZPDHXFCSA-N 399.399 2.686 0 50 GFAA C[C@H]1CN(C(=O)c2cc3c(cnn3C)nc2C(F)(F)F)CCN(C2CCC2)C1 2325780138 JQJVCXJQHKYWGG-GFCCVEGCSA-N 395.429 2.934 0 50 GFAA Cc1ccc(S(=O)(=O)NCC(=O)Nc2ccccc2Br)cc1 1148064 FNUMYEKUTKDOBN-UHFFFAOYSA-N 383.267 2.675 0 50 GFAA COC(=O)c1cn(C(=O)CCN2C(=O)c3ccccc3C2=O)c2ccccc12 2863136 IRYCGLPBXYHQLW-UHFFFAOYSA-N 376.368 2.754 0 50 GFAA Cc1[nH]nc(CCC(=O)N2CCC[C@]23CCCN(Cc2ccccn2)C3=O)c1C 2356169361 ZEOUVKCHPIVVDW-QFIPXVFZSA-N 395.507 2.538 0 50 GFAA COc1ccc(CCNC(=O)C2CCN(C(=O)Cc3ccccc3)CC2)cc1 4539206 DSAHSCAYIGQRTA-UHFFFAOYSA-N 380.488 2.835 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)Nc1cccc(Cl)c1 4866510 UVEUJHOZFBCEPV-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)N1CCCCC1 6401055 DJKCBBKYJNEAGR-UHFFFAOYSA-N 380.510 2.886 0 50 GFAA O=S(=O)(NCc1noc(C(F)(F)F)n1)c1ccc(CC(F)(F)F)cc1 225546473 VKYBRYWEDHRLPH-UHFFFAOYSA-N 389.277 2.672 0 50 GFAA CS(=O)(=O)c1ccc(N2CCC[C@H]2Cc2ccccc2)c(S(C)(=O)=O)c1 117463471 NGSFPCMYAGETPE-INIZCTEOSA-N 393.530 2.705 0 50 GFAA CC1CCC(N2CCN(C(=O)Cn3nc(-c4ccccc4)ccc3=O)CC2)CC1 115255500 KFGBWTBMNSUJTL-UHFFFAOYSA-N 394.519 2.633 0 50 GFAA CNC(=O)CN(C)c1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cn1 67741908 LVUZGWGREPAZHG-UHFFFAOYSA-N 394.519 2.749 0 50 GFAA O=C(COc1ccc(Br)cc1C(=O)O)NCCc1ccccc1 4811013 ZHGPPJWOCCBCMH-UHFFFAOYSA-N 378.222 2.885 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc4ccccc4o3)CC2)C1 71315694 JSHKLMVZHCMRNV-LJQANCHMSA-N 399.535 2.872 0 50 GFAA CC(C)(C)n1cnc(C(=O)N2CCCC[C@H]2c2nnc(C3CCOCC3)o2)n1 329733629 JUFVSNYXYLAZQN-AWEZNQCLSA-N 388.472 2.678 0 50 GFAA O=C(CN1CCC[C@H]1c1nc(-c2ccccn2)no1)N1CCc2ccccc21 77388635 OHCUBJKGSCZJSN-SFHVURJKSA-N 375.432 2.858 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@](CO)(Cc2cccc(Cl)c2)C1 12717582 WDPKEJJCYDREKG-GOSISDBHSA-N 397.928 2.686 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)Cn4ccnc4)C3)C2)c1 39532661 KDCHDWSONZXDML-NRFANRHFSA-N 386.471 2.546 0 50 GFAA COc1ccc(-n2ccnc2[C@@H]2CCOC(C)(C)C2)cc1NS(C)(=O)=O 77302802 RLPADMNAPKFRJX-CYBMUJFWSA-N 379.482 2.925 0 50 GFAA NC(=O)c1ccc(CNC(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)cc1 171308321 IMHFNHUVBNOSOD-QGZVFWFLSA-N 391.830 2.861 0 50 GFAA COc1cc(C(=O)N[C@@H]2CC(C)(C)c3ccccc32)sc1S(N)(=O)=O 158219161 LDCVLQTVNJZQOY-GFCCVEGCSA-N 380.491 2.557 0 50 GFAA CCc1cc(C(=O)N[C@H](c2cnc3ccccc3c2)C2CC(O)C2)cc(=O)[nH]1 223924642 DOZJZGZZFQGSTC-LREWSXEPSA-N 377.444 2.728 0 50 GFAA CNC(=O)[C@@H]1CCCCN1CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 173207516 KNIAJKZOGTWLJS-KRWDZBQOSA-N 397.523 2.709 0 50 GFAA CCCc1ccc(CN2CCC[C@H](c3nnc(CN4CCOCC4)n3C)C2)o1 426484932 XNZGBKYETAOWHN-KRWDZBQOSA-N 387.528 2.572 0 50 GFAA CN(C[C@H](O)COc1ccccc1CN1CCc2n[nH]cc2C1)C1CCCCC1 95496744 ATQJSYOXFOBGRV-NRFANRHFSA-N 398.551 2.972 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)Nc1cc(Cl)c2c(c1)NC(=O)CO2 96136666 ICZMGRWWDRWDGA-UHFFFAOYSA-N 377.832 2.717 0 50 GFAA C[C@@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc2c(c1)OCC(=O)N2 97532334 TZSQDCRKWDUENV-AWEZNQCLSA-N 380.448 2.586 0 50 GFAA CCC[C@@H](O)c1ccc(-c2cccc(C(=O)NCCS(C)(=O)=O)c2)cc1 426510868 QJUBMBCBCZOPMK-LJQANCHMSA-N 375.490 2.962 0 50 GFAA O=S(=O)(Cc1ccnc(-c2ccc(Br)cc2)n1)C[C@H]1CCCO1 178588893 WOPJDLKWUMFJLU-OAHLLOKOSA-N 397.294 3.000 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@@H]1CCCN(C(=O)c2ccncc2O)C1 95511485 IGCPQLKKOMIIFK-KRWDZBQOSA-N 396.491 2.516 0 50 GFAA Cn1c(CN2CCCC2)nnc1C1CCN(Cc2cc(C(C)(C)C)[nH]n2)CC1 96163748 UFKIUFDFQJOAED-UHFFFAOYSA-N 385.560 2.811 0 50 GFAA C[C@@H]1C[C@@H](C)CN(CCCCNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1 237551418 XTMIQBIDGUOCJI-ZIAGYGMSSA-N 386.489 2.560 0 50 GFAA COc1cc(NC(=O)NCCc2nc(C(C)C)cs2)cc(-n2cnnn2)c1 96141445 QIFFVRJHSKUDNK-UHFFFAOYSA-N 387.469 2.615 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cc1ccc(O)c(Cl)c1)C2 95364588 ZYLAOJCFCKBFGZ-GOEBONIOSA-N 376.884 2.838 0 50 GFAA CCn1ncnc1[C@H](NC(=O)Nc1cccc(-c2nncn2C)c1C)C1CC1 95508257 WMQXHINNDHFVOV-MRXNPFEDSA-N 380.456 2.675 0 50 GFAA COCC[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NC2CCC2)c1 95355986 NVYMARALGFFYRT-QGZVFWFLSA-N 380.510 2.549 0 50 GFAA CCc1nc(C)cc(N2CCC(c3nnc(Cn4ccnc4)n3CC)CC2)n1 96136417 KAPQDKPWSKQEDF-UHFFFAOYSA-N 380.500 2.588 0 50 GFAA O=C(NCc1ccnc(N2CCCCC2)c1)[C@H]1CCCCN1C(=O)c1ccco1 298918367 BKQKNNKOJWMNAY-GOSISDBHSA-N 396.491 2.976 0 50 GFAA C[C@@]1(CNC(=O)C2(c3ccc(S(C)(=O)=O)cc3)CCCCC2)CCCO1 252500793 TVLIQDANKCHSCQ-IBGZPJMESA-N 379.522 2.977 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1cc(Cl)c[nH]1)CC2 299410585 QGKHETCTPGJIIC-AWEZNQCLSA-N 378.812 2.900 0 50 GFAA CCOC(=O)[C@@H]1C[C@]2(C(=O)Nc3ccc(Br)cc32)N2CCC[C@H]12 55243778 OROIOIPZEJZPSI-ZLENFMNRSA-N 379.254 2.644 0 50 GFAA O=C([C@H]1CCCCn2nnnc21)N1CCC(Oc2cccc(Cl)c2)CC1 299783824 VBXQSJBYXWTLJE-INIZCTEOSA-N 375.860 2.664 0 50 GFAA CN1CCC2(CC1)CN(Cc1cc(CN3CCCCC3)cs1)CCN2C 823769820 FQBAHYFMHJISTI-UHFFFAOYSA-N 376.614 2.946 0 50 GFAA Cc1cccc2nc(COCC(=O)NCCN3CC[C@@H](c4ccccc4)C3)[nH]c12 670467452 BJBBRYJWDRFUAO-LJQANCHMSA-N 392.503 2.994 0 50 GFAA O=C(c1csc(-c2ncccn2)n1)N(Cc1ccccn1)C[C@@H]1CCCO1 952990682 WCHFLZBQRREOSG-HNNXBMFYSA-N 381.461 2.817 0 50 GFAA CN(C)Cc1nc(N2CC[C@@H](CO)[C@H](O)C2)c2c(-c3ccccc3)csc2n1 170091019 MANSNGNSLWLXQE-DOTOQJQBSA-N 398.532 2.599 0 50 GFAA CC(C)C[C@H]1C(=O)NCCN1C(=O)c1cnc(-c2ccc3c(c2)CCO3)s1 189046794 UTYWRXKLNVZGDG-HNNXBMFYSA-N 385.489 2.732 0 50 GFAA C[C@H]1C[C@@H](O)CN1C(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 788345633 UDNNZEZCXQTVOS-GOEBONIOSA-N 377.460 2.516 0 50 GFAA O=C(C1CCN(Cc2cc3ccc(Cl)cc3nc2O)CC1)N1CCOCC1 1506411239 ZVNQRJORFMZTDO-UHFFFAOYSA-N 389.883 2.665 0 50 GFAA Cc1nc(CCNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)sc1C 11932811 DMCXLNKPSFYGRW-MRXNPFEDSA-N 389.496 2.997 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)c2cn(C3CCCCCC3)nn2)C1 11936481 SOGNPPNEMRTWMM-OAHLLOKOSA-N 384.484 2.642 0 50 GFAA O=C(c1cc(COc2cccc(C(F)(F)F)c2)[nH]n1)N1CCN2CCC[C@@H]2C1 12304944 ZTVNBNKTCLQYGV-OAHLLOKOSA-N 394.397 2.928 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)CCc3cccs3)CC2)C1 14973614 YQIHBOJAZHJEOI-INIZCTEOSA-N 389.565 2.662 0 50 GFAA O=C(Cc1ccccc1OC1CCCC1)N[C@H]1C[C@@H](Cn2cccn2)C[C@@H]1O 1857527014 IJGXRCBETDZYTH-UXPWSPDFSA-N 383.492 2.703 0 50 GFAA Cc1cc(C)nc(CCNC(=O)C[C@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857716924 JEJSSMRTVUTQJZ-MRXNPFEDSA-N 394.479 2.595 0 50 GFAA CC[C@@]1(C(=O)NCc2nc[nH]n2)C[C@@H]2CC[C@H]1N2Cc1cccc2[nH]ccc12 1857729475 NJUBETRSGRVCRG-RRMPHLOHSA-N 378.480 2.736 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)Nc3ccc(F)cc3)C1)CC2 1857729559 POBHIRZSXQCYTI-HXUWFJFHSA-N 385.443 2.899 0 50 GFAA CC1(C)CN(Cc2cnn([C@@]3(C)CCS(=O)(=O)C3)c2)CC[C@@H]1C(F)(F)F 408349896 VUTWXYKQKCVGMH-HOCLYGCPSA-N 393.475 2.827 0 50 GFAA C[C@@H](c1nnnn1C1CC1)N1CCO[C@@H](c2cccc(Br)c2)C1 248836938 KCTJIHDMCDYKOH-XHDPSFHLSA-N 378.274 2.905 0 50 GFAA COc1ccc(C)cc1CCNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O 363314949 PJKRBCJBTKHSHT-SFHVURJKSA-N 382.460 2.673 0 50 GFAA O=C1CCOC2(CCN(c3cnccn3)CC2)CN1CC1CCC(F)(F)CC1 1704336427 HWEXKQZIMMALST-UHFFFAOYSA-N 394.466 2.890 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NC34CC(CO)(C3)O[C@@H]4C)c12 1875299233 DVRDGORASHRVDL-ZJDGCUJOSA-N 379.416 2.610 0 50 GFAA CC1CC(C(=O)N2CC(N3CCN(C(=O)c4ccc(C5CC5)cc4)CC3)C2)C1 1875328353 NDIXWKXEKUMMBL-UHFFFAOYSA-N 381.520 2.579 0 50 GFAA O=C1C[C@H](CN2CCC(=O)N(Cc3ccc(-c4ccccc4)cc3)C2=O)CN1 1875347413 OJWBQUXSNQKSJN-KRWDZBQOSA-N 377.444 2.644 0 50 GFAA CCc1nc([C@H]2CN(C(=O)C3(Cc4ccc(F)cc4)CC3)Cc3c[nH]nc32)n[nH]1 1875393751 ROSOILLTBDYSJP-INIZCTEOSA-N 394.454 2.726 0 50 GFAA O=C1NC(=O)[C@@](CNC(=O)c2cc3cc(Cl)ccc3o2)(c2ccccc2)N1 1875330972 KDEHHSHGVKUYEZ-LJQANCHMSA-N 383.791 2.551 0 50 GFAA O=C(N[C@H]1c2ccccc2CC[C@@H]1N1CCCC1)c1cnc2sccn2c1=O 892266242 DSJJDRZGPKNLTB-ROUUACIJSA-N 394.500 2.638 0 50 GFAA CCOc1ccccc1C(=O)Nc1nc2ccc(S(N)(=O)=O)cc2s1 950358 JIURFAHANOPNNF-UHFFFAOYSA-N 377.447 2.595 0 50 GFAA O=C(CSc1ncn(-c2ccccc2)n1)N1CCN(c2ccccc2)CC1 1114533 YPVIWTBNFRRWLS-UHFFFAOYSA-N 379.489 2.708 0 50 GFAA COc1ccccc1[C@@H]1[C@H]2C(=O)N(c3ccc(Cl)cc3)C(=O)[C@H]2N2CCCN12 19166766 UYAIITJPYFAEPS-QRVBRYPASA-N 397.862 2.884 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=S)N[C@@H]2c2ccc(O)cc2)c(OC)c1 8769689 ZNSWBSHLMZUPJA-GOSISDBHSA-N 399.472 2.841 0 50 GFAA CO[C@H](Cc1ccc(F)cc1)Cn1cc(S(=O)(=O)N(C)C)nc1C(C)C 2325762795 DKEYAKDGCSEINM-MRXNPFEDSA-N 383.489 2.654 0 50 GFAA Cc1cnc(-c2ccccc2NC(=O)c2ccnc(N3CCC(N)CC3)c2)[nH]1 2325786554 XEHGRZWIARECME-UHFFFAOYSA-N 376.464 2.960 0 50 GFAA O=C(N[C@H]1CC12CCN(C(=O)[C@@H]1C[C@H]1C1CCC1)CC2)c1occ2c1CCOC2 2325793925 LQEDEYZKERZACH-OTWHNJEPSA-N 398.503 2.899 0 50 GFAA O=C(O)[C@@H]1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)O1 2325808349 SFZAXCPXSVQDTG-ZRQNBYAXSA-N 387.354 2.827 0 50 GFAA O=C(N[C@H]1CC2(CN(Cc3cccnc3)C2)n2ccnc21)[C@@H]1C[C@H]1c1ccccc1 2332237895 PYTMEJHMSVFAJD-HBMCJLEFSA-N 399.498 2.854 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(CN(CC)CC)c1 625079 YPFYLJNBJDDUFN-SFHVURJKSA-N 375.469 2.728 0 50 GFAA CCOC(=O)N1CCN(c2ncnc3c2cnn3-c2ccc(Cl)cc2)CC1 1143383 TYMCKRUXBLIHHR-UHFFFAOYSA-N 386.843 2.747 0 50 GFAA Cc1cccc(-n2c(CN3C(=O)c4ccccc4C3=O)nc3ccccc3c2=O)n1 1211617 QNEZEEYCXPFWCG-UHFFFAOYSA-N 396.406 2.885 0 50 GFAA Cc1nonc1[C@@H]1CCCN1C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356167175 JIIDIGLCDMKHCB-AWEZNQCLSA-N 388.493 2.568 0 50 GFAA CSCCONC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 225436270 NIPNZAAPSICTJD-UHFFFAOYSA-N 384.457 2.550 0 50 GFAA Cc1nc2cc(F)ccc2cc1C(=O)NC1CCN(C(=O)c2cnccn2)CC1 135578101 CJEGIZNHRGTCJH-UHFFFAOYSA-N 393.422 2.507 0 50 GFAA CCc1csc([C@@H]2CCCN(C(=O)c3c(C)oc4ncn(C)c(=O)c34)C2)n1 113202798 PIOPLSCLROCZBO-GFCCVEGCSA-N 386.477 2.874 0 50 GFAA CCC[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@H](C)CC)C(=O)OC 25664470 RWJCTEYKWWBVCL-PVAVHDDUSA-N 378.469 2.785 0 50 GFAA COCCN1C[C@@H](CNc2nncc(-c3ccc4ccccc4c3)n2)CC1=O 12590580 OCYDMTVINGLICA-OAHLLOKOSA-N 377.448 2.599 0 50 GFAA Cc1ccc2c(c1)CCCN2C(=O)CNCc1csc(-c2cnccn2)n1 65383389 CEXNCVNXICOSIC-UHFFFAOYSA-N 379.489 2.978 0 50 GFAA COc1ccc([C@H](CC(C)C)NC(=O)C2CCN(S(C)(=O)=O)CC2)cc1 65362168 FOYBHZISJAXETP-SFHVURJKSA-N 382.526 2.570 0 50 GFAA CC1(C)[C@@H]2C[C@@H]1CC(=O)[C@]2(C)OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12 252485008 GMFYNJHSTOUGIQ-COURCCKHSA-N 394.537 2.649 0 50 GFAA CCOc1cccc2[nH]cc(CCNC(=O)N3CCC[C@H](CNC(C)=O)C3)c12 252498168 QVSHAOITNMJANA-MRXNPFEDSA-N 386.496 2.667 0 50 GFAA CN(C)[C@H]1CCN(c2nccc(C3(c4ccccc4Cl)CCNCC3)n2)C1 72477793 RRFUATKFLRZBIO-INIZCTEOSA-N 385.943 2.940 0 50 GFAA COc1cc(F)c(NC(=O)N2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)cc1F 363951433 WXRIKLWNLQUCJS-MLGOLLRUSA-N 380.395 2.827 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1)C2 171799606 FYYNSRHSGICUAD-UXHICEINSA-N 397.519 2.959 0 50 GFAA O=C(NCc1ccncc1OC[C@@H]1CCOC1)c1cc(-c2ccccc2)[nH]n1 288453112 STMZKNVJBYZACL-OAHLLOKOSA-N 378.432 2.817 0 50 GFAA Cc1c(C(=O)N(C)C2CCNCC2)cnn1-c1cccc(Br)c1 237115872 NGQJMQSVVYOUJO-UHFFFAOYSA-N 377.286 2.767 0 50 GFAA CC(C)CCN1CCC2(CC1)CCN(C(=O)Cc1cncs1)C[C@H]2CO 97394053 VVDWUIWEGJROJX-KRWDZBQOSA-N 379.570 2.655 0 50 GFAA CCN(CC)C[C@@H](O)COc1cc(CN2CCC3(CCO3)CC2)ccc1OC 95509341 SQHILFGZBDHTPQ-LJQANCHMSA-N 392.540 2.532 0 50 GFAA CCc1ccc(CNC(=O)Nc2nnc(CCn3nc(C)cc3C)s2)nc1 23581209 WMMPEHFVCICMMZ-UHFFFAOYSA-N 385.497 2.873 0 50 GFAA CN(C)[C@H]1CCN(C(=O)c2cccc(CCC(C)(C)O)c2)C[C@H]1CCCO 91254455 HSLGGKNQKZXLBE-UXHICEINSA-N 376.541 2.555 0 50 GFAA COCCCN1CC2(CCN(C(=O)COc3ccc(C)c(C)c3)CC2)CC1=O 95367174 UTTMOLSXDKLZQK-UHFFFAOYSA-N 388.508 2.560 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)Cc3nc4ncccn4n3)C2)cc1 95531594 OTHWOBWSGWSQKV-IBGZPJMESA-N 394.523 2.519 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H]2Cc2cccc(F)c2)cc1-n1cnnn1 180731005 ZDDAMRWYFSHNNN-QGZVFWFLSA-N 381.411 2.657 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@@H](n3cc(CO)nn3)C2)nn1C1CCCCC1 296635863 AHDILDBXNQLGNJ-QGZVFWFLSA-N 387.488 2.650 0 50 GFAA CCc1cc(-c2cnn(Cc3ccc(OC)cc3)c2)nc(N2CCOCC2)n1 534653730 PCNMFTPZEYTBGX-UHFFFAOYSA-N 379.464 2.796 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263615347 BWXLBBHGQTUEJR-KRWDZBQOSA-N 390.491 2.536 0 50 GFAA CN(Cc1cc(-c2ccccc2)on1)C(=O)NCc1noc([C@@H]2CCCO2)n1 534674555 SEUMTSUQMLIEQR-HNNXBMFYSA-N 383.408 2.918 0 50 GFAA COc1ccc(-n2cc([C@@H](C)NC(=O)c3cnc4cnn(C)c4c3)cn2)cc1 1940197108 SGQDQZSSNKJTDL-CYBMUJFWSA-N 376.420 2.654 0 50 GFAA CC(C)CS(=O)(=O)CCNC(=O)N(C)Cc1ccccc1C(F)(F)F 584891696 NYENKMJCQVYDJH-UHFFFAOYSA-N 380.432 2.918 0 50 GFAA CC(=O)Nc1ccc(C)cc1NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O 952975444 ZINTVYUPMLMJBF-UHFFFAOYSA-N 389.477 2.667 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CC[C@](O)(C4CCC4)[C@@H](C)C3)n2)c1 1565512638 SOZZRBVBDPNZBA-YCRPNKLZSA-N 382.512 2.879 0 50 GFAA Cc1oc(CNC(=O)c2ncoc2-c2ccc3c(c2)OCCO3)cc1C(=O)O 408513376 LDDIYCXNKLMRSZ-UHFFFAOYSA-N 384.344 2.642 0 50 GFAA CN(c1ccccc1NC(=O)NCC1(CCO)CCCCC1)S(C)(=O)=O 268177402 KSZHBLLJXITEJH-UHFFFAOYSA-N 383.514 2.537 0 50 GFAA COCC(=O)N1CCc2c(N[C@H](C)C(=O)Nc3nc(C)c(C)s3)cccc21 184473163 ACDJNQXBLXCXAR-GFCCVEGCSA-N 388.493 2.735 0 50 GFAA Cc1nc(-c2ccccc2NC(=O)NCc2ccc3c(c2)C(=O)NCC3)no1 755958209 SHEYBEABYGDJMS-UHFFFAOYSA-N 377.404 2.653 0 50 GFAA O=C1CC[C@H](NCc2noc(-c3c(F)cccc3F)n2)CCN1CC1CC1 1506420219 YQFPSDPSHZTXHQ-ZDUSSCGKSA-N 376.407 2.896 0 50 GFAA O=C([C@H]1CCCO1)N1CCCN(Cc2ccc(OCc3ccccn3)cc2)CC1 1772805343 LHKCKODFKRRJHF-JOCHJYFZSA-N 395.503 2.874 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2)CN(C(=O)c2cncs2)CC1=O 14531321 PBAGAGFLRIIPJI-KRWDZBQOSA-N 387.505 2.669 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](N(C)CCc1ccccn1)C2 14534266 XFRVYGTUKCCKGA-IBGZPJMESA-N 395.551 2.956 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 14974187 YOQCKKPSSCCPBS-NRFANRHFSA-N 387.430 2.727 0 50 GFAA O=C1CCN(C(=O)c2cc3ccccc3oc2=O)CCN1Cc1cccc(F)c1 15070713 LTMGBNROXRXEAY-UHFFFAOYSA-N 394.402 2.807 0 50 GFAA O=C(Nc1ccc(Cl)cn1)C1CCN(S(=O)(=O)c2ccccc2)CC1 16606496 LPTFVGKTXBWJPV-UHFFFAOYSA-N 379.869 2.774 0 50 GFAA O=C(Cc1ccccc1OC1CCCC1)N[C@H]1C[C@H](Cn2cccn2)C[C@@H]1O 1857527015 IJGXRCBETDZYTH-VDGAXYAQSA-N 383.492 2.703 0 50 GFAA CCn1cc(-n2ccnc2-c2ccc(OCCCN3CCOCC3)cc2)cn1 1857689489 QXENXPSMMYLRNP-UHFFFAOYSA-N 381.480 2.857 0 50 GFAA COc1ccc(CN2CCc3[nH]nc(C4CC4)c3CC2)cc1Cn1cncn1 1857701772 OUYFJPYERWRQPV-UHFFFAOYSA-N 378.480 2.536 0 50 GFAA O=C(C1CCOCC1)N1CCC2(CC1)OCCc1cc(-c3cnc[nH]3)sc12 1857725401 UWLWFFBUNDYDBJ-UHFFFAOYSA-N 387.505 2.955 0 50 GFAA O=C(CC1CC1)NC[C@H]1[C@H]2CN(Cc3cc(F)cc(F)c3)C[C@]23CC[C@H]1O3 1857727126 LKHZDUYOVBPOPS-QEUVDIPISA-N 376.447 2.861 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1cc(-c2ccc(Cl)cc2)[nH]n1 1857739163 KWWXLOADIKGLDT-TXPKVOOTSA-N 386.883 2.712 0 50 GFAA O=C1O[C@H]2CN(Cc3ccc(-n4cccn4)cc3)C[C@H]2N1CCc1ccccn1 209631721 ZIFWSRNPSDPLSK-RTWAWAEBSA-N 389.459 2.515 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCC(Cc3ccccc3)CC2)[C@@H]1c1cnn(C)c1 115202143 RTYFSRMFCAAGJO-IRLDBZIGSA-N 394.519 2.811 0 50 GFAA CS(=O)(=O)c1ccc(CN2C[C@H](c3cccc(F)c3)[C@@H](C(=O)O)C2)cc1 247486536 ABDKLPKDCIVXKB-MSOLQXFVSA-N 377.437 2.529 0 50 GFAA Cc1csc(C[C@@H]2CCCN(C(=O)c3cc4c(N(C)C)ncnc4n3C)C2)n1 924347890 FBHRXNZOFJEFLQ-AWEZNQCLSA-N 398.536 2.894 0 50 GFAA Cc1cc(NC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc(C(=O)N(C)C)c1 1875264352 XOQZBAHMKABXFR-UHFFFAOYSA-N 381.436 2.531 0 50 GFAA Cc1cnc(C(=O)N2CCn3c(C(F)(F)F)nc(C4CCN(C)CC4)c3C2)o1 1875394158 ZNESPZXQGUFOPO-UHFFFAOYSA-N 397.401 2.664 0 50 GFAA CC(=O)Cc1ccc(OC[C@H]2C[N@]2Cc2cnn(C)c2)c(Br)c1 1875381691 DLHBVYGPIGPLAX-VFNWGFHPSA-N 378.270 2.577 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3nc(CCC(C)(C)C)ncc3C2)CC1 1875370617 VYUPEYOTJZBVRQ-UHFFFAOYSA-N 384.524 2.765 0 50 GFAA C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)NCc1ccccc1CN(C)C(=O)C1CC1 1775996891 MAHJRGYJZCFYNS-JLTOFOAXSA-N 380.492 2.760 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3c(C)cccc3C)CC2)cc1OC 1074475 KLVSKFLMGKPHDM-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1 1095633 LZKVAIYAZCHMDI-UHFFFAOYSA-N 378.881 2.988 0 50 GFAA CCc1ncnc(N[C@@]2(C)CCN(C(=O)c3cn(C)nc3-c3ccco3)C2)c1F 2325793613 ANGCZMCVOVNSOB-FQEVSTJZSA-N 398.442 2.888 0 50 GFAA C[C@H]1CC2(CCN([C@H](C)C(N)=O)CC2)CN1C(=O)CC(C)(C)CC(F)(F)F 2325794001 NUQYGEWUVMCNMQ-UONOGXRCSA-N 391.478 2.932 0 50 GFAA O=C(Cc1ccc(-n2cnnc2)cc1)N1C[C@H](C2CCNCC2)c2ccccc21 2325798789 ATTHSEBLFRQASX-OAQYLSRUSA-N 387.487 2.940 0 50 GFAA O=C(C[C@H]1CC1(Cl)Cl)NC[C@@H]1C[C@H](F)CN1C(=O)[C@@H]1CC=CCC1 2325823038 CKATZHZMZYLFBI-RFGFWPKPSA-N 377.287 2.982 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](N(C)CCc3ccc(OC)c(OC)c3)C2=O)cc1 708722 VGWPKJGHJBPYFU-GOSISDBHSA-N 398.459 2.519 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2c[nH]c(=N)nc2-c2ccccc2)C1=O 2356148600 IGQILLYNRPCACR-JOCHJYFZSA-N 393.491 2.562 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)N2CCN(C3CC3)C[C@@H]2C)cc1Cl 2356153093 RBCHUGBNSSYWHP-JTQLQIEISA-N 379.309 2.859 0 50 GFAA COc1ccc(NC(=O)[C@H]2CC(c3ccc(OC)c(OC)c3)=NO2)cc1OC 4078337 YZDJXSFRXSZRSK-LJQANCHMSA-N 386.404 2.853 0 50 GFAA COc1ccc([C@@H](NC(=O)Nc2ccc(OC)c(OC)c2)C(=O)O)c(OC)c1 225486894 RYKYNTYYLVZTMP-QGZVFWFLSA-N 390.392 2.668 0 50 GFAA Cn1c2ccccc2n2c(S(=O)(=O)Cc3cc(-c4ccccc4)on3)nnc12 225685117 RTDIXFRPPLJDJN-UHFFFAOYSA-N 393.428 2.850 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cn1)c1c(C(F)(F)F)nc2ccccn12 415141189 OTTMJWUPNKAMCS-UHFFFAOYSA-N 391.353 2.837 0 50 GFAA CC(=O)N(c1nc(CN2CCC(N(C)c3cccnn3)CC2)cs1)C1CC1 114719459 DEJRDWBKCQVLLG-UHFFFAOYSA-N 386.525 2.549 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3CC[C@H](N)[C@H]3C2)cc(C)c1OCC(=O)N1CCCCC1 248700769 ZNUWJMMLNNYPGR-IHPCNDPISA-N 399.535 2.504 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)N1CCC[C@H](c2ccn[nH]2)C1 114900049 SDPGAMCMUHVZEC-NSHDSACASA-N 384.408 2.818 0 50 GFAA C[C@@H](NC(=O)CCc1nc(C2CCCC2)no1)c1nnnn1-c1ccccc1 135500400 OSQUVOSNRSXDCN-CYBMUJFWSA-N 381.440 2.513 0 50 GFAA Cc1cc(CN2CCC(n3cc(CN4CCC5(CCCC5)C4)nn3)CC2)n[nH]1 20911993 WRKRMNBVJKZXNJ-UHFFFAOYSA-N 383.544 2.913 0 50 GFAA CN1C(=O)COc2cc3c(cc21)[C@H](c1coc2ccccc2c1=O)CC(=O)N3 65406056 JKBAYAFDHHOMND-GFCCVEGCSA-N 376.368 2.622 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1C 65365351 JJTSNUJETIZNKL-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA COc1ccc2c(c1)CCC[C@H]2CNS(=O)(=O)c1cccc2c1OCCO2 463863581 FJJUUECMYLVLMX-HNNXBMFYSA-N 389.473 2.865 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CCC[C@]2(C=Cc3ccccc3O2)CC1 65534042 NFUOKRSIQZRQSN-FQEVSTJZSA-N 375.490 2.668 0 50 GFAA CNc1ncc(C(=O)N2CCC(c3[nH]ncc3-c3cccc(OC)c3)CC2)cn1 67725042 XJFRFFPZSOYLSV-UHFFFAOYSA-N 392.463 2.937 0 50 GFAA Cc1cccc2[nH]c([C@@H]3CCCN(C(=O)c4cc5n(n4)CCN(C)C5)C3)nc12 67643163 JFGOTDZXCRVYCZ-OAHLLOKOSA-N 378.480 2.533 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CCC(C2CCOCC2)CC1 124447684 VGMQXVARUJPQIZ-OAQYLSRUSA-N 384.520 2.885 0 50 GFAA O=C(C1CCCCC1)N1CC[C@@H](Nc2nc(C(F)(F)F)nc3[nH]cnc23)C1 252481867 CUFHVRNVZPYIPM-LLVKDONJSA-N 382.390 2.965 0 50 GFAA COc1cccc(OC[C@H]2CCCN(C(=O)c3cnn4cc(C)cnc34)C2)c1 77471444 XOINHLZOHOOREH-INIZCTEOSA-N 380.448 2.978 0 50 GFAA COc1cccc(C2=NO[C@@H](C(=O)Nc3cc(OC)c(OC)c(OC)c3)C2)c1 4076337 NGCBEKFBQMYJMY-GOSISDBHSA-N 386.404 2.853 0 50 GFAA CN(C[C@@H]1CCc2nccn2C1)S(=O)(=O)c1ccccc1OC(F)(F)F 328629885 PGQDAVWPMWYKSD-LBPRGKRZSA-N 389.399 2.665 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccc(F)cc3)CC2)cc(-n2cnc(C)c2C)n1 72437766 LRNTYJDLBCPXBP-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NC34CCC(CC3)C4)c2)C1 363752856 MQQXXUBRZHCFQU-UEUGHCDMSA-N 384.524 2.516 0 50 GFAA COc1ccc(C(=O)NCC(=O)Nc2ccccc2-c2ncc(C)[nH]2)cc1OC 363718606 MMSHALYOJMLWFN-UHFFFAOYSA-N 394.431 2.771 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3cccc4cnccc34)CC2=O)cc1 77388643 WKNDRZYPUHJOHV-UHFFFAOYSA-N 375.428 2.728 0 50 GFAA Cn1ccc(NC(=O)N2CCN(Cc3csc(-c4ccccc4)n3)CC2)n1 171667132 PMCNDPOLEOIDBX-UHFFFAOYSA-N 382.493 2.893 0 50 GFAA CCC[C@@]1(CO)CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1 378101361 PWVKHKQSWICFSB-OAQYLSRUSA-N 377.504 2.984 0 50 GFAA CN(Cc1ccccc1)Cc1cccc(C(=O)N[C@H]2CCc3ncnn3C2)c1 172002390 SPALWSWBKCRXLC-FQEVSTJZSA-N 375.476 2.655 0 50 GFAA Cc1ccc2nc([C@@H](C)NC(=O)N3CCN(Cc4ccccn4)CC3)[nH]c2c1 426618037 AJMCPIIJKABGFG-MRXNPFEDSA-N 378.480 2.855 0 50 GFAA Cc1cc(N2CCC3(CC2)CC(=O)N(Cc2ccc(F)c(F)c2)C3)nc(N)n1 91745797 DNROMYNZWWTSAO-UHFFFAOYSA-N 387.434 2.665 0 50 GFAA COc1c[nH]c(CN(C)C[C@H]2CCCN(CCc3ccccc3F)C2)cc1=O 95509261 HWJRMWDPSXFKPL-QGZVFWFLSA-N 387.499 2.909 0 50 GFAA CCc1c(C)nc(C)nc1N1C[C@@H]2c3ccc(OC)cc3OC[C@]2(C(=O)O)C1 95358778 BBROCYUSWQHWND-DYESRHJHSA-N 383.448 2.732 0 50 GFAA Cc1cccnc1OC1CCN(c2cc(N3CCCC[C@H]3CO)ncn2)CC1 290919205 HYUXVEORFRRYAP-KRWDZBQOSA-N 383.496 2.579 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1C 95510441 WYSFNTPYAMBNMF-UHFFFAOYSA-N 392.503 2.953 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1C[C@H]2CC[C@@H]1CN(Cc1nc[nH]c1C)C2 95361708 LNXLXHGZJAAQCV-DLBZAZTESA-N 384.528 2.795 0 50 GFAA Cc1cc2cc(C(=O)N[C@H]3C[C@@H](c4cc(N5CC[C@@H](O)C5)ncn4)C3)ccc2o1 252553117 VFVDSCZCKZTBPH-BPQIPLTHSA-N 392.459 2.778 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2cc(C)[nH]n2)C[C@H]1NC(=O)c1ccccc1 1940196089 JRBFFKIWVGFLCZ-DFQSSKMNSA-N 398.507 2.728 0 50 GFAA COc1ccc(CN2CCC3(CC2)CN(C[C@H]2CCCCO2)CCO3)cc1O 824733234 WXMYTBZFYNROOV-LJQANCHMSA-N 390.524 2.637 0 50 GFAA COc1cc(SC)c(OC)cc1CN1CCC[C@H](CN2CCN(C)CC2)C1 952982256 PHCRVARWKAJUSN-QGZVFWFLSA-N 393.597 2.885 0 50 GFAA Cc1cc(C)c(N2C[C@@H](C(=O)Nc3cncnc3N3CCCC3)CC2=O)c(C)c1 186246654 NDCNNCBTLMPVJD-KRWDZBQOSA-N 393.491 2.994 0 50 GFAA Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)NCCc1nnc2n1CCC2 170620770 YSUFABXGTIVLQG-UHFFFAOYSA-N 376.526 2.660 0 50 GFAA Cc1ccc(CN2CC[C@@H](NC(=O)c3ccc(-c4nc(C)no4)cc3)C2=O)cc1 191607254 AQZZEROMAHNXNH-LJQANCHMSA-N 390.443 2.884 0 50 GFAA COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)C(=O)NCC1CC1)CC2 191695634 DQVYLQFVEMLCPR-OAQYLSRUSA-N 394.471 2.704 0 50 GFAA CCOC(=O)C1CCN(C(=O)c2ccccc2I)CC1 834194 KKORIBCMVRUOPU-UHFFFAOYSA-N 387.217 2.707 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)n1 1529179908 GORVVZSAUWONRJ-WIYYLYMNSA-N 378.476 2.500 0 50 GFAA CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)N3C[C@H]4C[C@H](O)[C@H]4C3)CC2)cc1 1772702696 VDIVHDIVXBDXCK-HOJAQTOUSA-N 384.520 2.676 0 50 GFAA O=C(NC/C=C/c1ccccc1)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772812711 PABURISDHQKJEG-PFWMLDTASA-N 383.517 2.914 0 50 GFAA CC(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3F)C2)CC1 11947675 XITJIKKQRRPYPQ-IBGZPJMESA-N 375.488 2.507 0 50 GFAA O=C(N[C@@H](Cn1ccnc1)c1ccccc1)c1cn(Cc2ccccc2F)nn1 12434277 GYZMUBATQSVJNQ-IBGZPJMESA-N 390.422 2.833 0 50 GFAA COc1cccc(CO[C@H]2CN(Cc3cccnc3)CC(=O)N(CC(C)C)C2)c1 14538127 HMJTVLIZMAIYNR-QFIPXVFZSA-N 397.519 2.976 0 50 GFAA Cn1cc(CNc2ccc(C(=O)N3CCCC[C@@H]3CCn3cccn3)cn2)cn1 15062527 WTBHFWFIDWVYJO-LJQANCHMSA-N 393.495 2.709 0 50 GFAA CCOc1ccc(Br)cc1S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 18046265 UGHMAMGUUPUDOA-PHIMTYICSA-N 378.288 2.646 0 50 GFAA Cc1nc2ccc(C(=O)N3CCCN(C(=O)c4ccco4)CC3)cc2nc1C 169845254 PKIHTRCAFREQFA-UHFFFAOYSA-N 378.432 2.828 0 50 GFAA NC(=O)[C@H]1CCCN(CCn2ccnc2-c2ccc(CC(F)(F)F)cc2)C1 1857694624 GMTUDKSBSVZMRG-INIZCTEOSA-N 380.414 2.852 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2cnn(C)c2)cc1Cl 1857738157 TXFNJELYIVZYRQ-ROUUACIJSA-N 376.888 2.526 0 50 GFAA Cn1cc(CNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c(C(F)(F)F)n1 156299101 ZIHHGNNSEVUJGF-AWEZNQCLSA-N 394.397 2.608 0 50 GFAA CC1CCN(C[C@@H]2CCCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)C2)CC1 263770235 SOAARLWWUISINT-INIZCTEOSA-N 393.478 2.665 0 50 GFAA CCS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOC[C@H]2CC(F)F)c1 804723246 UXNPGBGUZBLLKQ-SNVBAGLBSA-N 381.828 2.630 0 50 GFAA Cc1ccc(OCC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc1 1704304095 KOYNJWMVKSURDQ-JOCHJYFZSA-N 380.492 2.736 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCO[C@@H](C(F)(F)F)[C@@H]3C)ccc21 1875372059 VDEUGLZCLZHEII-YVEFUNNKSA-N 382.382 2.944 0 50 GFAA N=c1cc(CN2CCC3(CC2)C[C@@H](O)c2nn(C4CCCC4)cc2O3)cc[nH]1 1875395893 OUVJOZZXESCGBH-QGZVFWFLSA-N 383.496 2.656 0 50 GFAA O=C1NC(=O)[C@]2(CCCC[C@H]2NC(=O)c2ccc(OC3CCC3)cc2Cl)N1 1875328620 CCKWLHZWMKDTFP-DNVCBOLYSA-N 391.855 2.522 0 50 GFAA O=C(O)c1n[nH]cc1[C@H]1CCCN(Cc2cc(CO)cc(C(F)(F)F)c2)C1 1875310012 ZCXBGSOOZRDFDE-ZDUSSCGKSA-N 383.370 2.999 0 50 GFAA O=C1C[C@@H](CNC(=O)c2cnn3c(C(F)F)cc(-c4ccccc4)nc23)CCN1 1875312353 LPIFALWHEWUMJK-LBPRGKRZSA-N 399.401 2.590 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2ccccn2)nc1 1875401124 GDMCERFSWFYGIQ-MAUKXSAKSA-N 390.447 2.591 0 50 GFAA O=C(NCc1ccc(OC(F)F)cc1OC(F)F)c1cnn2ncccc12 888092628 FLNLMNCEBLNVDJ-UHFFFAOYSA-N 384.289 2.862 0 50 GFAA C[C@@H](NC(=O)N1CCC2(C1)Oc1ccccc1O2)c1ccc2c(c1)NC(=O)CO2 888102475 RVHVJVKNKSDBFZ-CYBMUJFWSA-N 395.415 2.662 0 50 GFAA CC(C)n1cc2c(n1)[C@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)CCC2 1319949833 NIFBLBVJWHPVNN-QGZVFWFLSA-N 390.509 2.572 0 50 GFAA c1ccc2c(c1)nc1n2[C@]2(N3CCOCC3)CCCC[C@@H]2[C@@H]1N1CCOCC1 36075324 NNKLHIKTXJPZQM-PIPMEXSNSA-N 382.508 2.598 0 50 GFAA Cn1cc(-c2cccc(C(=O)N[C@@H]3C[C@@H](Cn4cc(Cl)cn4)C[C@H]3O)c2)cn1 2325785776 MVEQXHBVHSXBIL-UPRAQXHNSA-N 399.882 2.507 0 50 GFAA C[C@H]1CCn2ncc(C(=O)N[C@H](C(=O)O)c3ccc(F)c(Cl)c3F)c2C1 2325805631 YEBVNSBAQIOCSG-AYVTZFPOSA-N 383.782 2.953 0 50 GFAA CCCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)N[C@H](C)CC(=O)N3)c1 906231229 QKPGNGVRNQSJMY-CQSZACIVSA-N 394.475 2.899 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(Cl)cc2C)cc1 627905 VVZPBOVWKCJMOP-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA CCC(=O)N1CCN(c2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2)CC1 809572 OHJWZEMHHPSNLZ-UHFFFAOYSA-N 381.432 2.726 0 50 GFAA O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)cc1)NC1CC1 1161999 UWTOZVYZFVDAMW-UHFFFAOYSA-N 396.871 2.949 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2cc(-c3ccc(O)cc3)[nH]n2)C1=O 2356149837 WRWGODZZTPGWJF-NRFANRHFSA-N 382.464 2.788 0 50 GFAA Cn1ccnc1-c1ccc(=N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)[nH]n1 2356169559 UMJATONBOFIPCD-OXQOHEQNSA-N 386.459 2.517 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3ccc(C(=O)O)cc3)n2C)cc1 4690480 SPLOXFMQZHSKBP-UHFFFAOYSA-N 398.444 2.920 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccc(OC)c(Cl)c2)cc1 4867663 QNJMFZIOCQWQCN-LLVKDONJSA-N 398.868 2.663 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(S(=O)(=O)Nc2ccccc2F)c1 6402322 HQUNLCNJSWAVMS-CQSZACIVSA-N 378.425 2.535 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)N1CCC[C@H](Oc2ncccc2F)C1 225607873 XUPYHMATMIXQDW-HNNXBMFYSA-N 381.407 2.717 0 50 GFAA O=C1CN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)CCN1C1CCCCC1 55134228 SQRGLLBMIJPINB-UHFFFAOYSA-N 382.464 2.782 0 50 GFAA COc1ccc([C@@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N(C)C(=S)N32)cc1O 22018291 KDBIECCTXGPLJB-HNAYVOBHSA-N 393.468 2.955 0 50 GFAA O=C(CCCn1cncn1)N1CC[C@]2(CCCN(Cc3ccccc3F)C2)C1 12055215 RLNOJQGGQHWGEF-NRFANRHFSA-N 385.487 2.712 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(Cc3noc(C(C)C)n3)[nH]c2C1 67675020 MNDKXTASQTUFLM-LBPRGKRZSA-N 381.436 2.585 0 50 GFAA O=C(N[C@@H](C(=O)Nc1cn[nH]c1)c1ccccc1)c1ccc(-c2cc[nH]n2)s1 431905617 VVJIFDDCCOGCLN-QGZVFWFLSA-N 392.444 2.971 0 50 GFAA CCOC(=O)c1cc(C(=O)OCC)c2nnc(-c3ccc(Cl)cc3)n2c1N 2558772 WWIZRGOGJMQBLY-UHFFFAOYSA-N 388.811 2.985 0 50 GFAA Cc1nc(CN2C[C@@H](F)C[C@H]2CN(C)C(=O)CCc2ccccn2)cs1 328603700 GXQIUKLPFMNYQH-YJBOKZPZSA-N 376.501 2.850 0 50 GFAA CCc1nnsc1C(=O)N1CCC[C@H](Nc2ccc(OC)c(OC)c2)C1 72153821 PLZOTRPYPNAWQF-ZDUSSCGKSA-N 376.482 2.834 0 50 GFAA CCOc1ccc(-c2ccnc(N3CCN(CC4CC4)CC3)n2)cc1C(=O)O 77406829 YWIHFJQJESBRAJ-UHFFFAOYSA-N 382.464 2.773 0 50 GFAA CCCCN1C[C@]2(CCCN(C(=O)c3cnc(SC)nc3)C2)CCC1=O 77391490 LVQJWACLKKBUIW-IBGZPJMESA-N 376.526 2.843 0 50 GFAA CN(CCO)c1ccc(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cc1 72479851 OMQCISJMNVTELK-UHFFFAOYSA-N 385.483 2.602 0 50 GFAA Cc1c(CN2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cnn1C 72156419 FUCVHXNZMPVBGX-VLCRHTCISA-N 380.492 2.519 0 50 GFAA CN(C)c1ncccc1CNC(=O)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 376581139 WNYAFTWGIZACMH-HSALFYBXSA-N 380.492 2.862 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCOC[C@H]3C[C@@H](O)c3ccco3)cc2)CC1 158904050 ZWYSFYMDMYMTQV-RTBURBONSA-N 383.448 2.830 0 50 GFAA CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)c3cc(C4CC4)on3)cc2)C1 172639066 KEXLGIVCBALWAR-KRWDZBQOSA-N 382.464 2.971 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1ccccn1)c1cc(-c2ccccc2)n[nH]1 220564586 CJPJBPQMHYLUJI-YLJYHZDGSA-N 378.432 2.576 0 50 GFAA CCOc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccc(C)cc2)cc1 136443856 PMGMAXXAGFTQNO-PCCBWWKXSA-N 391.471 2.929 0 50 GFAA CCc1nc(C2(NC(=O)CC3(N4CCOCC4)CCCC3)CCCC2)no1 175161611 WWKGRBXVUJQGFM-UHFFFAOYSA-N 376.501 2.553 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)Nc3cccc(-c4nncn4C)c3C)C2)n[nH]1 426423839 XVYZERMPPSVOIQ-CQSZACIVSA-N 380.456 2.629 0 50 GFAA CCn1ccnc1CN1CCC(c2nnc(CN3CCCCCC3)n2C)CC1 96130284 PIAHAAVOJKJVJI-UHFFFAOYSA-N 385.560 2.787 0 50 GFAA O=C(NCc1ccco1)c1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)c1 239165256 NTXAEMXTNHARBB-YDRVBMSGSA-N 388.423 2.767 0 50 GFAA CCN(CCS(=O)(=O)c1ccc(C)cc1)C(=O)c1cn2ccsc2n1 92001606 BLFZHMYMLSDZBJ-UHFFFAOYSA-N 377.491 2.640 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)[C@@H]2CCOC(C)(C)C2)CC1 95366297 XJNLJFWMWKHNCK-GOSISDBHSA-N 376.545 2.746 0 50 GFAA Cc1cc(C)cc(CN2CCN(c3cc(C(=O)NC(C)C)ccn3)CC2=O)c1 95498674 VHPDUYDRNVIEPC-UHFFFAOYSA-N 380.492 2.685 0 50 GFAA Cc1ccc(NS(C)(=O)=O)cc1NC(=O)N[C@H](C)Cc1ncccc1C 96179908 HBZGYYNRQNPQTF-CQSZACIVSA-N 376.482 2.823 0 50 GFAA O=C(CCc1ccccn1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91364789 AQQBRGXTNPMORA-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA COc1ccc(CN(CC(=O)N2CCOCC2)C2CCCCC2)c(OC)c1 252509058 YBTWUWPCXGMFPS-UHFFFAOYSA-N 376.497 2.697 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1 253413091 SZXNKSQSULNMRW-BHDDXSALSA-N 397.563 2.801 0 50 GFAA biogenic COC(=O)[C@@H]1C[C@H](C(=O)NCCc2ccccc2)[C@H](c2ccccc2F)N1C 55154656 FWCLTAVAPMSBMJ-IHPCNDPISA-N 384.451 2.719 0 50 GFAA C[C@@H](NC(=O)[C@@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 34363710 VXGGBPQPMISJCA-CHWSQXEVSA-N 382.416 2.503 0 50 GFAA O=C(NCc1csc(-c2cccs2)n1)[C@H]1CC(=O)N(Cc2ccccn2)C1 827696781 XXNRJKRLUZAOKJ-ZDUSSCGKSA-N 398.513 2.932 0 50 GFAA CCCCN1CCOC2(CCN(C(=O)c3scc4c3OCCO4)CC2)C1 822865672 LXUPHJLFKORILO-UHFFFAOYSA-N 380.510 2.626 0 50 GFAA O=C(CN1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2)N1CCc2ccccc21 1565512383 NJTJUDGJQHFSNG-APWZRJJASA-N 382.533 2.629 0 50 GFAA CCOC(=O)C[C@@](C)(NC(=O)CCNC(=O)c1ccc(F)cc1F)C(C)C 170599343 YFCALQPXKRRFLM-LJQANCHMSA-N 384.423 2.569 0 50 GFAA C[C@@H]1CN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CCN1CCO 187291218 XJELTTGGIOMVHS-GOSISDBHSA-N 377.488 2.828 0 50 GFAA COc1ccccc1-c1nc(C2CCN(C(=O)c3snnc3C)CC2)no1 191776710 LNNJKTPTCWOUMF-UHFFFAOYSA-N 385.449 2.925 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@@H](c1cccnc1)N1CCOCC1 1506404657 ZQWVOWQITAQIBU-OAQYLSRUSA-N 392.459 2.769 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCCN(C(=O)Cc3ccccc3O)CC2)c1 1529172923 KTVXGFVBEZHIIS-UHFFFAOYSA-N 380.488 2.855 0 50 GFAA COc1ccc(-c2ccc(C(=O)O)c(N3CCC[C@H](CCC(N)=O)C3)n2)cc1 1529169396 YGIVYTZCLMYLNH-CQSZACIVSA-N 383.448 2.937 0 50 GFAA O[C@@H]1CCCN(c2ccnc(NCC3CCN(CCc4ccccc4)CC3)n2)C1 1529092011 UEEWHCAEUCXXII-OAQYLSRUSA-N 395.551 2.804 0 50 GFAA CC1(C)[C@H](c2nc(-c3ccc(Cl)cc3)cs2)C(=O)NC(=N)[C@@H]1C(N)=O 5864840 SXZYKFGMBRQJHI-NEPJUHHUSA-N 376.869 2.782 0 50 GFAA CC(C)c1cc(CNC(=O)[C@H]2CCCN(C3CCN(C(C)C)CC3)C2)on1 12466030 QRGDZJUWGIPPBP-KRWDZBQOSA-N 376.545 2.999 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3ccccn3)C2)cc1OC 15072400 JUDJCIXPJJKCJD-SFHVURJKSA-N 383.492 2.878 0 50 GFAA Cc1ccc(C2=NOC3(CCN(C(=O)c4n[nH]c5c4CCCC5)CC3)N2)cc1 169760425 ASGVASYWUJWPLJ-UHFFFAOYSA-N 379.464 2.511 0 50 GFAA COc1ccc(Cn2c(C3CCN(C(=O)c4ccsc4)CC3)n[nH]c2=O)cc1 169770602 CTPOSDUWMJWVNW-UHFFFAOYSA-N 398.488 2.710 0 50 GFAA O=C(C1CC1)N1CCC[C@@]2(CN(Cc3cccc(O)c3Cl)CC[C@H]2O)C1 1857691710 AFIFQNVWERNUQJ-YLJYHZDGSA-N 378.900 2.631 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCCc3cccnc3)cc12 1857688488 MRGGQSBBNIJHBV-UHFFFAOYSA-N 385.533 2.999 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3)c1ccc(F)cc1 1857718588 LXEPNSIBIKKHQC-TVKQPGBESA-N 387.480 2.692 0 50 GFAA Cn1cc(C(=O)N2CCC3(CCc4c(O)nc(-c5ccccc5)nc43)CC2)cn1 1857724762 BQBHRVUPVAYFNA-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA COc1ccnc(C(=O)N2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)c1 1857733799 ZGWXKEBGJRUOMZ-FXAWDEMLSA-N 382.460 2.978 0 50 GFAA Cc1cncc(N2CCC[C@@](O)(CN(C)Cc3cc4cc(F)ccc4[nH]3)C2)n1 1857734267 GWTGSTGYZZMKEK-OAQYLSRUSA-N 383.471 2.869 0 50 GFAA CC1(C)C[C@@](CCN2CCn3nc(C(=O)O)cc3C2=O)(c2ccccc2)CCO1 1875244737 RSFUWWMBQQYWBS-QFIPXVFZSA-N 397.475 2.954 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N[C@H]1CC[C@@H](C(=O)NC2CCCCC2)C1 215255192 VYJIWRHLOJGXHT-WBVHZDCISA-N 386.540 2.955 0 50 GFAA CNC(=O)c1cc(NC(=O)c2ccc(N3CCC(O)CC3)cc2)ccc1Cl 114173227 NZPDQLYFGLZMIU-UHFFFAOYSA-N 387.867 2.913 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@H]1c1ccc(Cl)cc1 4016849 SNYBQIIVGREIAE-MKSNKDDYSA-N 382.840 2.506 0 50 GFAA in-vitro CNC[C@H]1CCCN(C(=O)C2(S(=O)(=O)c3cc(C)ccc3C)CCCC2)C1 237322565 XCXHYSAUZTUGLK-GOSISDBHSA-N 392.565 2.848 0 50 GFAA COC[C@]1(O)CCOC[C@@H]1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 1875278518 GPDZFWKPFGMBCV-JTHBVZDNSA-N 394.471 2.586 0 50 GFAA CC(C)n1ccc(C(=O)NCCC2CCN(c3ccc4nccnc4n3)CC2)n1 1875310033 ALHPAZQCIXMHDT-UHFFFAOYSA-N 393.495 2.839 0 50 GFAA NC(=O)[C@@H](CNC(=O)CC[C@H]1CCc2ccccc2C1=O)Cc1ccc(F)cc1 1875316132 WSPNROZVXJFASN-QZTJIDSGSA-N 396.462 2.811 0 50 GFAA C[C@H](N=c1[nH]ccn2nc(-c3ccccc3)cc12)c1cccc(S(N)(=O)=O)c1 1875324463 ZUXVLKSOHMTMTC-AWEZNQCLSA-N 393.472 2.639 0 50 GFAA CCn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3c(C)cc(C)nc3C)CC1)O2 1875394488 KCABPVCOGNUPSR-MRXNPFEDSA-N 384.480 2.714 0 50 GFAA CCc1nnc(N2CC[C@@](C)(C(N)=O)C2)n1Cc1oc2ccc(F)cc2c1C 1306124465 PEFRSAHTPVIJNP-HXUWFJFHSA-N 385.443 2.784 0 50 GFAA Cc1ccc(O[C@@H](C)C(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c(C)c1 2325772364 GUVRZMKLGLOKID-GJZGRUSLSA-N 376.478 2.596 0 50 GFAA C[C@H](C(N)=O)N1CCC2(CC1)C[C@@H](C)N(C(=O)CC(C)(C)CC(F)(F)F)C2 2325794002 NUQYGEWUVMCNMQ-ZIAGYGMSSA-N 391.478 2.932 0 50 GFAA COc1ccc2c(c1)[C@@H](C)CN(C(=O)c1ccc3c(c1)CC[C@@H](N)C(=O)N3)CC2 2325795565 NECJFKIMBDQQSO-VBKZILBWSA-N 393.487 2.709 0 50 GFAA COC(=O)[C@H](NC(=O)c1cnoc1Cc1ccccc1)c1ccc2c(c1)CCO2 2325825132 FYBNLVPRARBFFT-HXUWFJFHSA-N 392.411 2.844 0 50 GFAA Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)c1ccc2c(c1)CNCCO2 2325856475 QUYIUZRJXYQUTM-UHFFFAOYSA-N 380.423 2.732 0 50 GFAA COC(=O)c1ccc2[nH]c(=NCCN3CCc4c(Cl)cccc4C3)[nH]c2c1 2325858182 BXYFEQNPLZVIMH-UHFFFAOYSA-N 384.867 2.895 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 4135800 UCWFVPLGCOXIMK-HXUWFJFHSA-N 395.459 2.666 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSC1CCCCC1)c1cccc(F)c1 4703263 RKONPYXJQYAELT-UHFFFAOYSA-N 388.530 2.774 0 50 GFAA CCOC(=O)N1CCN(C(=O)C2CCN(Cc3ccc(CC)cc3)CC2)CC1 4725536 YKVKMIWKXZFKBD-UHFFFAOYSA-N 387.524 2.762 0 50 GFAA O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1cccc(Br)c1 100099553 JDMPTMXEWXNHEO-OKILXGFUSA-N 377.238 2.729 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)CN1CCN(c3ccc(F)cc3)CC1)OCO2 54254306 ZMVPNZXRHDGRRR-UHFFFAOYSA-N 399.422 2.518 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CC[C@@H](C3CCCCC3)C2)n1CCOC 23251095 FAKXYCZVBXYWAX-QGZVFWFLSA-N 383.558 2.725 0 50 GFAA COc1ccccc1C1=NN(C(C)=O)[C@H](c2ccccc2NS(C)(=O)=O)C1 252482406 DESKRKYADUYVCY-SFHVURJKSA-N 387.461 2.764 0 50 GFAA CCCCc1nc(C)cc(N2CCOC[C@H]2c2ncn(CC(F)(F)F)n2)n1 253418782 ZPQKRQFGYZDQSU-ZDUSSCGKSA-N 384.406 2.859 0 50 GFAA Cc1cc(CS(=O)(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)on1 330000094 VXJFEUNLTUYWOA-LBPRGKRZSA-N 390.292 2.988 0 50 GFAA C[C@H](C(=O)N1C[C@@H]2CCCN(C(=O)[C@@H](C)c3cccnc3)[C@@H]2C1)c1cccnc1 330066377 SUUVORBJYSYJRP-IDPBPBMLSA-N 392.503 2.833 0 50 GFAA C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)[C@H]1CN 156813658 HMBYRNYOSSYKBC-UZLBHIALSA-N 386.517 2.860 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1[C@H]2CCCO[C@H]2C1(C)C 332900593 UTKRUJSBTCAXFB-VBSBHUPXSA-N 383.492 2.535 0 50 GFAA COc1cc([C@H](C)N[C@H]2CCCN(c3cccnc3)C2=O)cc(OC)c1OC 240540891 GPYSUEWPJNFKMS-YOEHRIQHSA-N 385.464 2.954 0 50 GFAA CN(Cc1nccs1)[C@@H]1CC12CCN(S(=O)(=O)c1cccc(F)c1)CC2 283166208 KQDLWYCAPKHDPQ-MRXNPFEDSA-N 395.525 2.957 0 50 GFAA O=S(=O)(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 285180532 BQPLCJBDKCLNDM-KURKYZTESA-N 378.881 2.928 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)N(CC1CCC1)C3=O)OCCO2 95355321 LFWZOKBRVCMMRC-FUHWJXTLSA-N 386.492 2.689 0 50 GFAA COc1ccc([C@@H]2CN(c3cc(N(C)C)ncn3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95385396 NKDALHIPHGCUCB-VLCRHTCISA-N 379.508 2.618 0 50 GFAA O=C(CN1C(=O)NC2(CCCC2)C1=O)N1CCc2cc(Cl)cc(Cl)c2C1 177678606 VIPRWEVPPMRNOH-UHFFFAOYSA-N 396.274 2.743 0 50 GFAA CC(C)(N)c1cn(C2CCN(Cc3cccc(Cn4cccn4)c3)CC2)nn1 20858339 ZEQFEYQRIDDVIV-UHFFFAOYSA-N 379.512 2.554 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3ccc(OCCO)cc3)C2)N1Cc1ccccc1 95362985 IMRUWVUCGRIUCE-LEWJYISDSA-N 380.488 2.681 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CN2CCC(O)CC2)cc1 95503108 PTUSJGBWUORZDP-JOCHJYFZSA-N 384.520 2.515 0 50 GFAA Cc1cnn([C@@H](C)C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c1 91320429 SJOIQZOXPCHHEF-SFHVURJKSA-N 395.507 2.579 0 50 GFAA O=C(c1ncc[nH]1)N(CCN1CCCCC1)C[C@@H]1CCCN(C2CCCC2)C1 95506096 ZIHIFCACTNJNFN-LJQANCHMSA-N 387.572 2.992 0 50 GFAA Cc1cc2ncn(C[C@@H](O)CN3CCN(c4ccncc4Cl)CC3)c2cc1C 162479328 SKWGFJFFWUFMBE-KRWDZBQOSA-N 399.926 2.885 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(Cc1cc3ccccc3[nH]c1=O)CC2 91808349 QTBVAKFMGNYCDW-UHFFFAOYSA-N 377.492 2.621 0 50 GFAA Cc1nc2c(c(N3CCC[C@H](N4CCCC4=O)C3)n1)Cc1ccccc1OC2 95511533 QVVRFRATTFAOIW-KRWDZBQOSA-N 378.476 2.859 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)C2(c3ccc(OC)cc3)CC2)CC1 95499306 JRTCGUFLXVMXMJ-UHFFFAOYSA-N 383.492 2.976 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)CCC(F)(F)F)CC1 96150676 HTLDWQSJLOHBPP-UHFFFAOYSA-N 384.406 2.591 0 50 GFAA CCN1C(=O)COc2cc(NC(=O)NCCCn3nccc3C3CC3)ccc21 96152142 PSWJUSQDWMZKMT-UHFFFAOYSA-N 383.452 2.718 0 50 GFAA COCCn1c(CN2CC=C(c3ccc(F)cc3)CC2)nnc1[C@H]1C[C@@H](N)C1 244840201 UILFHKLJCPOVIQ-IZAXUBKRSA-N 385.487 2.558 0 50 GFAA CC1(C)O[C@@H]2[C@H](O1)[C@H]1OC(C)(C)O[C@@H]1O[C@@H]2COC(=O)c1ccccc1Cl 247953547 LBWVFYWBICENNB-HNLJFRNMSA-N 398.839 2.893 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2Cl)C1=O)N1CCc2ccccc2C1 252548798 QLTGDQXAXUXXQB-GOSISDBHSA-N 397.862 2.940 0 50 GFAA CNC(=O)[C@H]1CCCN1C(=O)c1ccc(-c2cccc3c(=O)cc(C)[nH]c23)cc1 534675003 BDPADWUNZTYENZ-LJQANCHMSA-N 389.455 2.854 0 50 GFAA COc1cccc2ccc(N3CCc4nc(C(=O)NC5CCC5)cn4CC3)nc12 1940194904 BHMXSLIDHODCAL-UHFFFAOYSA-N 391.475 2.785 0 50 GFAA CCn1ccc(C(=O)Nc2ccc(NC(=O)CN3CCCCC3)cc2)cc1=O 823588092 WYDZEOGPEIJJQL-UHFFFAOYSA-N 382.464 2.545 0 50 GFAA CC1CCC(NC(=O)CN2CCN(c3ncc(C(F)(F)F)s3)CC2)CC1 302787337 WZIBTYPTEOHKBP-UHFFFAOYSA-N 390.475 2.979 0 50 GFAA CN(C)C(=O)C[C@H]1CN(CC2CCS(=O)(=O)CC2)c2ccc(Cl)cc21 271188769 BVSLFUKPBOYKSU-AWEZNQCLSA-N 384.929 2.547 0 50 GFAA COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)NCc1ncc[nH]1)C(=O)OC2 277379826 WHXLZXLLIDBREW-UUILKARUSA-N 399.447 2.688 0 50 GFAA Cn1ccn2ncc(C(=O)N3CC[C@@](O)(c4ccccc4)[C@H]4CCCC[C@H]43)c12 1506398406 ZKSUIMKZAPEVDX-NNMXDRDESA-N 378.476 2.965 0 50 GFAA CCNC(=O)[C@H]1CCN(Cc2ccccc2CS(=O)(=O)c2ccccc2)C1 1506398476 CBXOKYCUBOCMKW-SFHVURJKSA-N 386.517 2.619 0 50 GFAA Cc1ccc2c(c1)C[C@@H](C(=O)N1CCCN(C(=O)c3ccc(F)cc3)CC1)N2 1529191845 GFXHACAZRSBDAW-FQEVSTJZSA-N 381.451 2.845 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)Sc2nnnn2-c2ccccc2OC)cc1 11692795 RKPHUFQRBZAYBH-GFCCVEGCSA-N 385.449 2.799 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@H]1CCCN(CCc2ccccc2OC)C1 11954888 JQUGQUAYCRSNOA-GOSISDBHSA-N 390.524 2.751 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2CCCN(c3ccccn3)C2)CC1)NC1CC1 12026085 HKQVFOZZKPXNMD-GOSISDBHSA-N 384.524 2.595 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1)NC1CCCCCCC1 12058733 VLKYZZXNZIYMOZ-LJQANCHMSA-N 375.488 2.745 0 50 GFAA Cn1nccc1C(=O)NC[C@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1 12078400 QVDHWDWYRISOSX-QGZVFWFLSA-N 386.471 2.503 0 50 GFAA CCn1cc(CNC(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)cn1 12459140 GUUAZOZILGOXAZ-UHFFFAOYSA-N 396.491 2.613 0 50 GFAA CCOc1ccc(NC(=O)CCn2ccn3nc4c(c3c2=O)CCCC4)cc1 169760171 CVVXSJJIGOXKBQ-UHFFFAOYSA-N 380.448 2.802 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c1 169772908 GZQMKGUMQHAVOB-GFCCVEGCSA-N 395.394 2.652 0 50 GFAA Cc1nc([C@@H](N)C(C)C)n(CC(=O)N2CCC3(C=Cc4ccccc43)CC2)n1 1857697651 GMWXUIMXPYENIP-FQEVSTJZSA-N 379.508 2.830 0 50 GFAA COC(=O)N1CCCC[C@@H]1C(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857698300 KNJCNJJQSCLLAF-LJQANCHMSA-N 396.491 2.635 0 50 GFAA Cc1c(F)cccc1CN1CCC2(CC1)CN(Cc1cc[nH]n1)C[C@@H]2C(=O)O 1857707393 QNXHGWLBUWMXBI-GOSISDBHSA-N 386.471 2.656 0 50 GFAA COc1ccccc1OCc1nc([C@H]2C[C@@H](N)[C@H](O)C2)n(-c2ccc(C)cc2)n1 1857717692 TZAJLDSFOXHSOK-CGTJXYLNSA-N 394.475 2.729 0 50 GFAA Cc1ccccc1-n1cc(CN2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)cn1 1857719136 DZPJUFWZLKCXKD-VWPQPMDRSA-N 380.492 2.738 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccncc4)[C@H]4CC[C@]3(C2)O4)s1 1857721878 KDVNUGODCXWEPV-QEUVDIPISA-N 383.517 2.861 0 50 GFAA C[C@H](Cn1cccn1)C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1857722557 YCAJDIPKCPRDHS-OAHLLOKOSA-N 397.523 2.819 0 50 GFAA Cc1cc(C(=O)N2CC[C@H](O)[C@](CC3CC3)(C(=O)O)C2)c2ccc(F)cc2n1 1875243322 BEFKFSDLWZODGH-GHTZIAJQSA-N 386.423 2.760 0 50 GFAA CC1=C[C@@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@@H]4[C@]2(O)[C@@H]1O)[C@@H]1[C@H](C[C@H]3C)C1(C)C 504185771 ONMDPPVVEFWDOD-OPYQOWIESA-N 388.504 2.614 0 50 GFAA biogenic CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)O 4535695 QJJULDSUCQXEDB-OTRWWLKZSA-N 378.469 2.943 0 50 GFAA in-vitro Cc1c(C(=O)N(CCC(=O)O)C2CCOCC2)cnn1-c1ccccc1Cl 237730213 CTVSAWXBUNONIQ-UHFFFAOYSA-N 391.855 2.930 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2C[C@H](C)OC[C@H]2c2ccccc2)c1 245445766 KPWQVMJOTSWKSS-JXFKEZNVSA-N 381.476 2.837 0 50 GFAA Cc1ccc(-n2nccc2NC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)nn1 155702153 HSEZNNDUBQVLNM-KRWDZBQOSA-N 379.420 2.781 0 50 GFAA CN(C[C@@H]1OCCN(C)[C@H]1c1ccccc1)C(=O)/C=C/c1ccc(C(=O)O)cc1 1875270137 YJYIQRLFBYJFDU-AJKUUOFVSA-N 394.471 2.928 0 50 GFAA COCCOc1cc(C)ccc1CNC(=O)c1nn(C)c2c1C[C@H](C)O[C@@H]2C 1875403381 VCRLRQUSEDQOMY-LSDHHAIUSA-N 387.480 2.706 0 50 GFAA COc1ccc([C@@H]2[C@@H](CNC(=O)NCc3ccnc(N(C)C)c3)CCN2C)cc1 1775996460 XYVTWCZVIZIVOT-WIYYLYMNSA-N 397.523 2.648 0 50 GFAA O=C(CSC1=NC(=O)[C@@H](c2ccccc2)C(=O)N1)Nc1cccc(Cl)c1 1194270 QSTKWULECDFAKK-UHFFFAOYSA-N 387.848 2.808 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)Cc2ccc(F)cc2)CCCCN1 2100534023 PWCFMALWPFSMJP-FQEVSTJZSA-N 389.515 2.742 0 50 GFAA CN(C)[C@H]1C[C@H]2C[C@@H](N(C)S(=O)(=O)c3cccnc3C(F)(F)F)C[C@H]2C1 2100543519 TUDZQFCZKCQEJD-KPWCQOOUSA-N 391.459 2.840 0 50 GFAA Cc1cc(NC(=O)C2CC2)sc1C(=O)N1CCC(CN2CCCC2=O)CC1 2325748149 HBJVPRNZVDFXGT-UHFFFAOYSA-N 389.521 2.880 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)N2[C@H]3CCC[C@H]2CC(O)C3)C1=O 2325776133 PVMLADIFMRWAKK-XYJFISCASA-N 389.471 2.717 0 50 GFAA COC(=O)c1cc(-c2nc(-c3cc4c(nc3O)CCNC4)no2)ccc1Cl 2325849909 FIQNEDOGTAELFI-UHFFFAOYSA-N 386.795 2.590 0 50 GFAA CN1CCC[C@@H](CNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1c1cccs1 246494795 ARMXHMAGTYBRNU-YJBOKZPZSA-N 382.493 2.537 0 50 GFAA COC(=O)c1cc(Cl)c(NC(=O)[C@@H]2COc3ccccc3O2)cc1OC 943590 QQSDBQLKFQKIKJ-INIZCTEOSA-N 377.780 2.914 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)COc2ccc(Cl)cc2)c1 1205168 LGJQSRPDQVMZHP-UHFFFAOYSA-N 377.780 2.931 0 50 GFAA COc1ccnc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)c1 2356139690 HOIHTIHIOJLOAI-QHCPKHFHSA-N 393.487 2.930 0 50 GFAA O=C1CCCCCN1CC(=O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356162574 FRMRKMWLMQDXIH-HSZRJFAPSA-N 397.519 2.573 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)NCC3=CCCCC3)OCC(=O)N2C2CC2)cc1 2356170303 FDFJJSLICIJUBB-RTWAWAEBSA-N 384.476 2.743 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(C(=O)Nc3ccccc3C)CC2)cc1 6699026 ONQQLKOUPKTZAO-UHFFFAOYSA-N 389.477 2.542 0 50 GFAA Cc1c(CN2CCc3[nH]c4ccccc4c3C2)cnn1CCN1CCOCC1 67674285 UAEIUPMKENTHJB-UHFFFAOYSA-N 379.508 2.563 0 50 GFAA CC(=O)NCCC(=O)N1CCC[C@H](c2nc(C)ncc2-c2cccc(C)c2)C1 12039362 IMZYNRZOVTWBRZ-IBGZPJMESA-N 380.492 2.993 0 50 GFAA Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)sc1C 2730867 CNURDBGHVPEGEW-UHFFFAOYSA-N 380.491 2.638 0 50 GFAA COc1ccc(NC(=O)Cn2ncc(N3CCCCC3)c(Cl)c2=O)cc1 72117860 LOTATMWOCBHJEE-UHFFFAOYSA-N 376.844 2.534 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCc2cn[nH]c2)(Cc2ccccc2)c2ccccc21 71775676 VMQPNKFJNQIZQL-HSZRJFAPSA-N 388.471 2.616 0 50 GFAA Cc1ccc(CN2CCN(Cc3cnc(N4CCCCC4)nc3)CC2=O)cc1 72156800 AYYVMYRVOLIGBT-UHFFFAOYSA-N 379.508 2.620 0 50 GFAA Cc1noc([C@H]2COCCN2C(=O)CCc2ccccc2OC(F)(F)F)n1 155467763 KYXAIAKOHCEPGY-CYBMUJFWSA-N 385.342 2.809 0 50 GFAA CC(C)[C@H](O)C(=O)N1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cc2)CC1 368299863 SRIZMZYSXOVOTM-INIZCTEOSA-N 386.414 2.785 0 50 GFAA COC(=O)CC[C@H]1CN(Cc2ccc(SC)cc2)CC[C@H]1N1CCOCC1 14988490 KEJIIVRISYNOHN-AZUAARDMSA-N 392.565 2.884 0 50 GFAA Cc1[nH]c2c(c1C(=O)N1CCC(=O)N(CC3CC3)[C@@H](C(C)C)C1)C(=O)CCC2 71523856 JJWPDBMNZWQVPR-QGZVFWFLSA-N 385.508 2.951 0 50 GFAA Cc1cc(C(=O)NC[C@]2(O)CCCN(C(=O)c3cccs3)CC2)c(C)o1 72162084 FTTHKPASIBYWMS-IBGZPJMESA-N 376.478 2.745 0 50 GFAA Cc1ccc([C@H](CNC(=O)N2CCC(NC(C)C)CC2)N2CCOCC2)s1 174988909 JPSOWPDOFXMRHF-SFHVURJKSA-N 394.585 2.602 0 50 GFAA O=C(c1ccc(F)cc1)[C@@H]1[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]2[C@@H]2CCCN21 226880499 DMCLCFCWODYPFH-MANSERQUSA-N 396.393 2.800 0 50 GFAA Cc1cc(C)n(-c2ccc(=O)n(CC(=O)Nc3cccc(C(F)(F)F)c3)n2)n1 40288535 HBPANZWUIHSGSS-UHFFFAOYSA-N 391.353 2.703 0 50 GFAA OCC1CCN([C@@H]2CCCN(C3CCN(c4ccccc4F)CC3)C2)CC1 20541539 ASFSLIQYOFTYDM-HXUWFJFHSA-N 375.532 2.963 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)N[C@@H]1COC2(CCCCC2)C1 426634192 MJTXCUKDITXXEA-AWEZNQCLSA-N 379.888 2.861 0 50 GFAA CCN(CC(=O)N1CCc2cc(OC)c(OC)cc2C1)[C@H]1CCOC(C)(C)C1 289711016 HYXSPZXGLABYOK-SFHVURJKSA-N 390.524 2.868 0 50 GFAA COCCN(Cc1cccc(OC)c1)C(=O)[C@H]1CCC(=O)N(C2CCCC2)C1 91793045 KVKGVMHVZNXIDB-SFHVURJKSA-N 388.508 2.851 0 50 GFAA Cc1ccc(NCc2cn(C(C)C)nn2)cc1S(=O)(=O)N1CCCCC1 290068409 HUZXBRGFOZGTEI-UHFFFAOYSA-N 377.514 2.954 0 50 GFAA O=C(NCc1nnc2n1CCC2)Nc1ccccc1OCCc1ccccn1 96137459 NYXLBJXJBYWAKE-UHFFFAOYSA-N 378.436 2.563 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 95520199 YWEFIXRXEUQUAE-INIZCTEOSA-N 380.496 2.731 0 50 GFAA CCN1CC2(CCN(S(=O)(=O)C3CC3)CC2)C[C@H](c2ccccc2)C1=O 91737512 BGETZBRMTSTSGW-GOSISDBHSA-N 376.522 2.597 0 50 GFAA CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1ccc(-c2ccccc2)[nH]c1=O 91563203 YZXQXVKXSBYDMG-UHFFFAOYSA-N 392.440 2.612 0 50 GFAA O=C(Nc1ccc2c3c(cccc13)CC2)N1CCC[C@@H](n2cc(CO)nn2)C1 296286833 IQYLLGJEGVDODU-QGZVFWFLSA-N 377.448 2.891 0 50 GFAA C[C@H]1Oc2ccccc2N(CCC(=O)N[C@@H](CC(=O)O)c2cccs2)C1=O 299744021 NIRFWNHIUQTLBB-OLZOCXBDSA-N 388.445 2.584 0 50 GFAA C[C@]1(CNC(=O)C2(c3ccc(S(C)(=O)=O)cc3)CCCCC2)CCCO1 252500794 TVLIQDANKCHSCQ-LJQANCHMSA-N 379.522 2.977 0 50 GFAA CCN(CC)CCN1C(=O)CC[C@H]1CCNCc1cc2c(cc1Cl)OCO2 299762712 XBNBRFRQOBYIMF-INIZCTEOSA-N 395.931 2.881 0 50 GFAA COc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)CCC(=O)Nc1nncs1 952969120 HQAHSOHISLNHRV-ZDUSSCGKSA-N 390.465 2.684 0 50 GFAA NC(=O)[C@H]1CC(C(=O)OC[C@@H]2CCCc3ccccc32)=NN1c1ccccc1 170621438 XZSRAIHDFOVYBK-OXJNMPFZSA-N 377.444 2.770 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H](C)N2CCCC2)ccc1F 1704308011 CFMIHABRECAXFP-CYBMUJFWSA-N 390.459 2.769 0 50 GFAA COC(=O)c1cccc(C(=O)NC[C@H]2Cc3cccc(-c4cncnc4)c3O2)c1 12079758 RCGDXSZSRNBVEA-GOSISDBHSA-N 389.411 2.664 0 50 GFAA COc1ccccc1CCC(=O)NCCc1nnc(SCC(C)C)n1C 12211961 NWDUZKFIMWULIP-UHFFFAOYSA-N 376.526 2.863 0 50 GFAA O=C(NCC[C@@H]1CCCCO1)c1cc(COc2ccc(-n3cncn3)cc2)on1 12314101 LOCRJXBPNAEPEH-INIZCTEOSA-N 397.435 2.523 0 50 GFAA O=C(c1cnc(O)cn1)N1CC[C@H](C2CCN(CCc3ccccc3)CC2)C1 12385728 BAEPFLLBDPLDRW-IBGZPJMESA-N 380.492 2.599 0 50 GFAA COCCN1CCC(CN(Cc2ccc(COC)o2)C[C@@H]2CCCO2)CC1 12386199 PHGXJXLXNWWIJV-IBGZPJMESA-N 380.529 2.765 0 50 GFAA O=C1C[C@@H](NC2CCN(Cc3ccccn3)CC2)CN1Cc1cccc(F)c1 12434619 QBLSXVATDRFKPR-OAQYLSRUSA-N 382.483 2.576 0 50 GFAA O=S(=O)(c1ccc(F)cc1F)N1CCC[C@](CO)(Cc2ccccc2)C1 12458495 YQIZXDHTFIZYLH-IBGZPJMESA-N 381.444 2.971 0 50 GFAA COCCc1nc2ccc(C(=O)N3CCN(C4CCCCC4)C(=O)C3)cc2o1 12590079 LYLSPHNMULSIGX-UHFFFAOYSA-N 385.464 2.634 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)N1CCC[C@H](Nc2ccc(F)cc2)C1 12594488 OQFQMCCPTNFYDS-KRWDZBQOSA-N 382.439 2.962 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@H](N(C)Cc1ccon1)CC2 14743614 PECVLXPISUUUHH-GOSISDBHSA-N 393.491 2.670 0 50 GFAA Cc1cc(OCC(=O)N2CCN(c3ccccn3)CC2)ccc1Br 18116736 VQBBCJPLABVQRG-UHFFFAOYSA-N 390.281 2.880 0 50 GFAA CCc1csc(CNC(=O)[C@H]2CCC(=O)N(Cc3ccccc3OC)C2)n1 19798959 IVWKZNFWTBCSPZ-HNNXBMFYSA-N 387.505 2.769 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)c4nccc5ccccc45)nnc3c2)n1 169776254 VPXFPJNUSMQQKS-UHFFFAOYSA-N 385.387 2.566 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CCC3CCC3)CC(=O)N2[C@H]1c1ccccc1 1857717481 VFUXNMDTDVAAEG-WFXMLNOXSA-N 384.476 2.540 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(c4ccncc4F)C[C@]34CC[C@H]2O4)cc1 1857738447 IDCYEHZNLGMZGY-VTAPXXACSA-N 381.451 2.943 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(NC2CCN(c3ncccn3)CC2)ncn1 328638586 PFFHHLWWUPKVHS-FXAWDEMLSA-N 397.527 2.963 0 50 GFAA COc1ccc([C@@H]2CCNC[C@H]2NC(=O)N2CCOC3(CCCCC3)C2)cc1 333730373 VZNSLLARKNZYHZ-VQTJNVASSA-N 387.524 2.885 0 50 GFAA O=C(O)C1CCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)CC1 238020805 DJVXSOAPBOCXTG-UHFFFAOYSA-N 396.281 2.821 0 50 GFAA O=C(OCCCn1nc2ccccn2c1=O)c1ccccc1Br 133799833 QPULEJCAEONQKL-UHFFFAOYSA-N 376.210 2.506 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3ccc(C(F)(F)F)c(O)n3)CCN2)c1 870154047 XQPZPPKSHPXKBF-OAHLLOKOSA-N 381.354 2.601 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCO[C@H](C(F)F)CC2)(c2ccccc2)CC1 870648427 LXVRYBZGWXNBCT-KRWDZBQOSA-N 392.446 2.615 0 50 GFAA NC(=O)C1CCN(Cc2cn(CCCc3ccc(C(F)(F)F)cc3)nn2)CC1 1875270194 MCMIIACANWRERZ-UHFFFAOYSA-N 395.429 2.627 0 50 GFAA N[C@@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)n(-c3ccccc3)n2)C12CCOCC2 1875277853 KASREXQFQYTVFE-HUUCEWRRSA-N 394.397 2.517 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CC[C@H](C)S(=O)(=O)C1 888101718 PUWPKNSJQAWATC-MJQMVNBJSA-N 394.537 2.950 0 50 GFAA COC(=O)c1cc(CSc2nnc(O)n2C[C@@H]2CCCO2)c(Cl)s1 2325772348 DUAIBPCAJGQUAI-VIFPVBQESA-N 389.886 2.957 0 50 GFAA O=C([C@@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC([C@H]2CCOC2)CC1 2325809779 KSFVXGUAOJORPG-PKOBYXMFSA-N 381.480 2.562 0 50 GFAA CN(CC1CCN(c2ccncc2)CC1)C(=O)c1cccc(-c2nc(O)n[nH]2)c1 2325815453 DTWASJVXMGPDGJ-UHFFFAOYSA-N 392.463 2.561 0 50 GFAA CC(C)OC1(CNC(=O)C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)CCC1 874313891 REYLSEHVLMJHML-GOSISDBHSA-N 390.480 2.647 0 50 GFAA CCOC(=O)C1=C(C)N2C(=O)CSC2=N[C@H]1c1cc(OC)ccc1OC 1198550 ONXHCBHTWMFZEY-INIZCTEOSA-N 376.434 2.527 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)c2cncc(Br)c2)cc1 1891235 FTDXAKPYXFKHAV-UHFFFAOYSA-N 398.282 2.785 0 50 GFAA CCC(=O)NC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1ccccc1OC)C[C@@H]2O 2356155264 DTMXQUPEKXNYMB-NZRJUOQRSA-N 394.515 2.798 0 50 GFAA Cc1nc(CNC(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)sc1C 2356159773 QAGZEUSRKLCDRA-NVAPDCRFSA-N 396.516 2.708 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N3CCc4nc(C5CC5)nn4CC3)c2)n1 2356168402 BVBXJOQTKQXVCF-UHFFFAOYSA-N 390.491 2.716 0 50 GFAA CONS(=O)(=O)c1ccc(C(=O)N(C)[C@H](C)Cc2ccccc2C)cc1 225567304 ZHOKBWWGPXEFAS-OAHLLOKOSA-N 376.478 2.538 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CCC[C@@]2(C=Cc3ccccc3O2)CC1 65534046 NFUOKRSIQZRQSN-HXUWFJFHSA-N 375.490 2.668 0 50 GFAA O=C(c1cc(COc2ccc(F)cc2F)on1)N1CC(N2CCCCC2)C1 67769942 XYLGUMJGZDUZQD-UHFFFAOYSA-N 377.391 2.842 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)CCc2nnc(-c3ccsc3)o2)C1 20907621 KDYIGFRZDCWMLO-CYBMUJFWSA-N 399.476 2.586 0 50 GFAA Cc1nc(C(F)(F)F)nc(N2CCC(Cn3cc(C(C)(C)N)nn3)CC2)c1C 20856683 HFYZZWUVFPRYOC-UHFFFAOYSA-N 397.449 2.814 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)N[C@@H]1CCCN(CCc2ccccc2)C1 67674929 VRNRBPUVRHNYNJ-OAQYLSRUSA-N 391.515 2.856 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](N)CN1C(=O)c1cc(C)nc2ccc(Cl)cc12 67742795 KMMIILAWHMDKQW-KSSFIOAISA-N 388.899 2.607 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)N2CCO[C@@H](C(=O)C3CC3)C2)C[C@@H](C)O1 252535895 HCMLEMXKQCYXDR-SPYBWZPUSA-N 387.480 2.512 0 50 GFAA Cn1c(-c2ccccc2Cl)nc2cc(C(=O)N3CCC(C(N)=O)CC3)cnc21 77471870 AMGLSDWEKURTEF-UHFFFAOYSA-N 397.866 2.626 0 50 GFAA O=C(c1cn([C@@H]2CCOC2)nn1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 330092725 QYMVOLZNLUJLEZ-YPMHNXCESA-N 397.262 2.840 0 50 GFAA COc1ccc(-n2ccnc2-c2nccn2[C@H]2COC[C@@H]2N2CCCC2)cc1 77339906 XDINKVCCFGKEDY-OALUTQOASA-N 379.464 2.780 0 50 GFAA C[C@H](N[C@@H](C)C1CCOCC1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 125412079 WEQLQLDUVNTJJT-WCJKSNMJSA-N 377.529 2.574 0 50 GFAA COc1ccc2cc([C@@H]3CN(C(=O)c4cc(C(C)=O)n[nH]4)CCO3)ccc2c1 71747073 SXEZDRUULURDHE-FQEVSTJZSA-N 379.416 2.988 0 50 GFAA CC[C@]1(C)Oc2ccc(NC(=O)C(=O)N[C@@H]3CCN(c4ccccc4)C3)cc2O1 443734627 RPTFSEHIJBPOAN-OPAMFIHVSA-N 395.459 2.918 0 50 GFAA O=C(N[C@H](C(=O)O)[C@H]1CCCOC1)c1ccc(COc2ccc(F)cc2)o1 262697263 ABYSFXPMDMJYBR-SJCJKPOMSA-N 377.368 2.607 0 50 GFAA CCc1nccn1CC(=O)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72170572 LXGZMMRTBIOGGM-SFHVURJKSA-N 376.460 2.516 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc2)C[C@@H](C)O1 131123250 HKFZYLMENPVBJR-ZPGKAZOCSA-N 380.488 2.684 0 50 GFAA COc1cccc(-c2noc([C@H](C)NC(=O)NC3(c4noc(C)n4)CCC3)n2)c1 173518795 JOXFFNAGZYVKJX-NSHDSACASA-N 398.423 2.876 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](N(C)Cc3nc(-c4ccco4)no3)C2=O)c1 176304668 LTSCHEUNVIVWHW-INIZCTEOSA-N 398.419 2.584 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 95525534 XEQTYNUCZMJNPW-JOCHJYFZSA-N 396.491 2.774 0 50 GFAA CC(C)c1n[nH]c2c1CN(C(=O)Nc1ccccc1CN1CCOCC1)CC2 95506248 HKJMURPIJDKJDX-UHFFFAOYSA-N 383.496 2.956 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3ccc(-n4ccnc4C)cc3)C2)n[nH]1 426627892 ZIIJNZZERKCPFE-QGZVFWFLSA-N 379.468 2.696 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3cn(C)c4ccccc34)C2)CCC1=O 91964536 SNBYAVCDQQNHMT-JOCHJYFZSA-N 383.492 2.670 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2ccccc2-c2ccccc2)C[C@@H]1CO 95371162 GOTKHLZGLXSCQC-WOJBJXKFSA-N 382.504 2.612 0 50 GFAA COc1ccc2c(c1)OC[C@]1(CO)CN(Cc3noc(C4CCCC4)n3)C[C@H]21 95501854 NIFJOBJBLYWKHA-DYESRHJHSA-N 385.464 2.706 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(-c3ccc4c(c3)OCO4)[nH]c2C1 95372836 CGHIBYVSRSUFPM-ZDUSSCGKSA-N 377.400 2.884 0 50 GFAA CC(C)[C@@H](C(=O)NC[C@H]1CC[C@H](C(=O)O)CC1)n1cnc2ccccc2c1=O 238937281 UXTAEYAURAEDPJ-MPGHIAIKSA-N 385.464 2.601 0 50 GFAA COc1cccc2c1O[C@@]1(C)[C@@H](C(=O)N(C)C)[C@H]2NC(=S)N1c1ccccc1 242495107 FUUSMPUTMAGTMS-WWMYMODYSA-N 397.500 2.944 0 50 GFAA CN(CCC(=O)Nc1ccc(C(N)=O)cc1)C[C@H]1CCN(c2ccccc2)C1 243893763 AUBQHSCJLKSRAL-QGZVFWFLSA-N 380.492 2.572 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CCN(c3cc(F)cc(F)c3)C2=O)cc1C(=O)O 299753058 WRLWAFDCPPFITE-OAHLLOKOSA-N 392.358 2.576 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)COC1CCCCC1)CC2 299739429 OGORTEYHPYSKJZ-QGZVFWFLSA-N 391.464 2.954 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N(C)Cc2cc(C(=O)O)c(C)o2)cc1 299751905 SGKOSTBOJBMJHW-GOSISDBHSA-N 384.432 2.744 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CCN(c3ccc4nccn4n3)CC2)c(C)c1 534588376 SJBYJTLMQLPGCS-UHFFFAOYSA-N 378.480 2.686 0 50 GFAA Cc1ccc2nc(C)c(C)c(C(=O)N3CC[C@@H]4OCc5cnnn5[C@H]4C3)c2c1 299800468 WBLLJUHEWMBQJI-OALUTQOASA-N 377.448 2.738 0 50 GFAA COc1ccc(/C=C/CN2CCn3nc(CNC(=O)C4CCC4)cc3C2)cc1 299785368 YXJRPUFKHKCHRN-ONEGZZNKSA-N 380.492 2.837 0 50 GFAA Cn1c(=O)c(C(=O)Nc2ccccc2CN2CCOCC2)cc2ccccc21 828147329 PWYBHDZDCCBVSX-UHFFFAOYSA-N 377.444 2.623 0 50 GFAA Cc1sc2nc(CCNC(=O)[C@@H]3CC(=O)OC34CCCC4)nc(O)c2c1C 670448436 ATQPHUFYNNKVRT-LBPRGKRZSA-N 389.477 2.548 0 50 GFAA Cn1cc(CC(=O)N2CCC(CNC(=O)c3ccco3)CC2)c2ccccc21 952975936 ZTECEERFUMUKNZ-UHFFFAOYSA-N 379.460 2.982 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)c2cccc(NC(=O)c3cccnc3)c2)[C@]12CCCO2 273716678 QRXGMQGOBJYQAM-WOIUINJBSA-N 395.459 2.790 0 50 GFAA Cc1cc2c(cc1C)O[C@@H](C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)O)C2 170044532 XBPXMDYPJVIXSF-AZUAARDMSA-N 378.428 2.900 0 50 GFAA COc1ccccc1[C@H](CNC(=O)Cn1cnc2ccccc2c1=O)OC(C)C 187399783 QUPAQTIZTWHEIB-FQEVSTJZSA-N 395.459 2.688 0 50 GFAA CN(C)c1cccnc1NC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O 170595598 KEUZTYBNQHAXAS-UHFFFAOYSA-N 393.230 2.689 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H]2CCCN(C)C2)ccc1F 1704309613 YVCUDKGSKVQWNA-CYBMUJFWSA-N 390.459 2.627 0 50 GFAA CCCNC(=O)N1C[C@H]2CN(Cc3ncc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772810639 NONSMIYTOLYTCV-KNQAVFIVSA-N 381.524 2.896 0 50 GFAA CO[C@@H](C(=O)NC[C@H]1Cc2cccc(-c3cncnc3)c2O1)c1ccccc1 12122843 GAIMSRDWOMKUTL-WIYYLYMNSA-N 375.428 2.951 0 50 GFAA O=C(Cc1ccccc1)NC(=S)Nc1cccc(C(=O)NC[C@H]2CCCO2)c1 12138734 VCLKLDRJQTWKSU-GOSISDBHSA-N 397.500 2.651 0 50 GFAA CC1(C)Cc2c(c(N3CCOCC3)nc3sc4c(=O)[nH]cnc4c23)CS1 13115826 ZWNCCUAYQRUTRQ-UHFFFAOYSA-N 388.518 2.937 0 50 GFAA CCOC(=O)COc1ccccc1/C=C1/NC(=O)N(Cc2ccccc2F)C1=O 14009803 QANFHVAMURTPLL-GZTJUZNOSA-N 398.390 2.861 0 50 GFAA CCOc1ccc(-c2nc3s/c(=C/c4cccc(OC)c4)c(=O)n3n2)cc1 6355382 RJYVCLJCIHPVFH-SFQUDFHCSA-N 379.441 2.773 0 50 GFAA COc1cc2c(cc1CN1CCN3C(=O)OC[C@]3(Cc3ccccc3)C1)OCO2 1857679095 WSHNXKJXWKVJST-QFIPXVFZSA-N 396.443 2.673 0 50 GFAA Cc1c(C(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)cnc2ccnn12 1857678929 MMNQQVQICHDARI-KPLVRAHFSA-N 376.460 2.636 0 50 GFAA CC[C@H](C(=O)N1CCC2(CC1)OCCc1cc(C(=O)O)sc12)n1cccn1 1857687204 QZBRQDTUJCUEFX-CQSZACIVSA-N 389.477 2.685 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(OC)c(F)c3)C[C@]23CC[C@H]1O3 1857716369 JCEJKCURFUTCNG-LTVCHDBBSA-N 376.472 2.730 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3ccc4c(c3)CC(C)(C)O4)CC(=O)N2C)cnn1C 328620943 HLLMOHFBAOEZTJ-LAUBAEHRSA-N 382.508 2.751 0 50 GFAA O=C1NCCN1C1CCN(Cc2cc(Cl)ccc2OC[C@H]2CCCO2)CC1 127564940 BPQKJYMSZAMHIB-GOSISDBHSA-N 393.915 2.887 0 50 GFAA C[C@@H](CCNS(=O)(=O)c1ccccc1)NC(=O)c1cccc2c1ccn2C 241316901 LVXAXWLCYZSSFR-HNNXBMFYSA-N 385.489 2.665 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1Nc1ncc(Br)c2cccnc12 1875399110 OZMAKZWUFINHBM-KCPJHIHWSA-N 388.269 2.840 0 50 GFAA C[C@@H](O)c1cn(CC(=O)N[C@@H](CCc2ccccc2)c2cccc(F)c2)nn1 1875312956 LCQGGFGBSVBXOX-BEFAXECRSA-N 382.439 2.961 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)Cc1ccc2c(c1)CCCO2 1875401739 QKGKNNSNAURJLD-YLJYHZDGSA-N 396.491 2.871 0 50 GFAA C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1cnc(C2CC2)s1 888101355 LLELYYZMYPESGT-GXFFZTMASA-N 377.491 2.577 0 50 GFAA CCn1ncc(Br)c1Cn1cc(COc2cccc(O)c2)nn1 2325772795 IUKCWBGUSPNFFV-UHFFFAOYSA-N 378.230 2.590 0 50 GFAA Cn1cc(-c2cccc(C(=O)N[C@@H]3C[C@H](Cn4cc(Cl)cn4)C[C@H]3O)c2)cn1 2325785775 MVEQXHBVHSXBIL-MJXNMMHHSA-N 399.882 2.507 0 50 GFAA O=C(CN1CC(F)(F)C[C@H]1CCO)N1CC=C(c2c[nH]c3ccccc23)CC1 2325808731 FETOLDPRQLAZAH-MRXNPFEDSA-N 389.446 2.876 0 50 GFAA Cn1c(Cc2ccccc2)cnc1CNC(=O)c1cc(F)cc2c1CNCC2 2325858275 GHJSEUDDSLSZSI-UHFFFAOYSA-N 378.451 2.726 0 50 GFAA COc1cc(Cl)ccc1C[C@@H](NC(=O)[C@@H](CC(C)C)n1ccnc1)C(=O)O 2325876112 KVTPOULOIRCMFR-HZPDHXFCSA-N 393.871 2.944 0 50 GFAA CCc1ccccc1NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 817049 XGMNSNBLFKWUGB-UHFFFAOYSA-N 376.478 2.971 0 50 GFAA COc1cc(CNn2nnnc2N)ccc1OCc1c(Cl)cccc1Cl 1108758 RDIQHWBHSUQDMP-UHFFFAOYSA-N 395.250 2.893 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)CC1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 2356152090 QHNURWHGMXIULK-WOVMCDHWSA-N 392.883 2.952 0 50 GFAA O=C(c1cnc(O)[nH]1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1[C@H]2Cc1ccccc1 2356155212 BWKKRDQIJOWBDA-UMGGQSCQSA-N 380.492 2.673 0 50 GFAA C[C@]1(O)CCOC2(CCN(C(=O)Cc3cc4c(cc3Cl)OCCO4)CC2)C1 2356158119 XIHWWOYGMAEJDF-IBGZPJMESA-N 395.883 2.576 0 50 GFAA C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(I)cc2)C1 2999267 SLWTVRZAOGZOSR-QWRGUYRKSA-N 379.263 2.958 0 50 GFAA Cc1n[nH]c(O)c1[C@@H](c1cc(Br)ccc1O)c1c(O)n[nH]c1C 4147363 LYCWVZWZPZVDGG-UHFFFAOYSA-N 379.214 2.809 0 50 GFAA CS(=O)(=O)N(Cc1ccc(C(=O)NCc2cccnc2)cc1)c1ccccc1 6076192 FJLZNKXVCCIXHH-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCN(c2cccc(Cl)c2)CC1 6697652 KFXWZKJPQLKMCO-OAHLLOKOSA-N 375.900 2.780 0 50 GFAA COc1cc(CO)ccc1OCc1nnnn1-c1ccc(Br)cc1 6760837 MXNRDQJVAWXFQS-UHFFFAOYSA-N 391.225 2.505 0 50 GFAA Cc1nc2ccc(Cl)cn2c1CN1CCC(n2cc(C[C@H](C)O)nn2)CC1 20821160 KCQRJDLWBHCAMF-ZDUSSCGKSA-N 388.903 2.648 0 50 GFAA Cn1cc([C@@H]2CCN(C(=O)Cc3csc(-c4ccc5c(c4)OCO5)n3)C2)cn1 116116884 GFKSKNGSUPBVJK-CQSZACIVSA-N 396.472 2.831 0 50 GFAA O=C(NCCCn1ccnc1)c1ccc([C@@H]2CCCN2Cc2ncc[nH]2)s1 20295247 HTUXHVDPZNNJPZ-HNNXBMFYSA-N 384.509 2.825 0 50 GFAA CN1C(=O)COc2cc3c(cc21)[C@@H](c1ccc2cccc(O)c2n1)CC(=O)N3 65527310 OOQKIOCPMCDDAH-ZDUSSCGKSA-N 375.384 2.770 0 50 GFAA Nc1cc(C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)n[nH]1 67871814 HXWLRHZHQYFYEI-UHFFFAOYSA-N 377.383 2.513 0 50 GFAA Cc1ccc2c(c1)c1c3n2CCN(C[C@H](O)CNCCCN(C)C)[C@H]3CCC1 1802064 MADDWMBZCFZGJC-GCJKJVERSA-N 384.568 2.545 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)[C@@]1(C)CC1(Br)Br 2091081 WNBCMJZLCKTCMS-GFCCVEGCSA-N 393.123 2.891 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccn(Cc2ccc(F)cc2Cl)n1 2804880 UTVWGDVSQKYFKQ-UHFFFAOYSA-N 383.836 2.865 0 50 GFAA CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1ccn(-c2ccccc2F)n1 151273832 CYYDXHFGDPEZPK-UHFFFAOYSA-N 391.399 2.947 0 50 GFAA Cc1c(C(=O)NCc2ccccc2OC2CCCC2)nnn1C1CCNCC1 151291526 ULKIYCQLMXKJMY-UHFFFAOYSA-N 383.496 2.762 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2C[C@H](F)CN2c2ccncn2)nn1[C@H](C)C1CC1 329953878 JRADHKHJKYBACQ-PVAVHDDUSA-N 386.475 2.642 0 50 GFAA COc1ccc(-c2nnsc2C(=O)N2CCN(c3ccccn3)CC2)cc1 36365597 DVZLRVTXOHFIKU-UHFFFAOYSA-N 381.461 2.571 0 50 GFAA CCOc1cccc2c1OCC(C(=O)N1c3ccccc3C[C@H]1C(=O)NC)=C2 485132657 IWBFOQFNQNXXFO-SFHVURJKSA-N 378.428 2.565 0 50 GFAA Cc1csc(SCC(=O)N2CC[C@@H](Cc3cccc(C(N)=O)c3)C2)n1 72153649 CSWWEANLRKDGMN-AWEZNQCLSA-N 375.519 2.734 0 50 GFAA Cn1nccc1[C@H]1[C@@H](C(=O)Nc2ccc3[nH]ccc3c2)CCC(=O)N1C1CC1 367932420 LDLWRHXCTWKLKW-OXJNMPFZSA-N 377.448 2.982 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCCN2C[C@H](C)C[C@@H](C)C2)cc1C(=O)O 237551278 HLVRRMDXYUQHCH-HUUCEWRRSA-N 382.526 2.730 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3cccc(-c4ncc[nH]4)c3)CC2)c1 77521055 GXLSVNXDOYLDLF-UHFFFAOYSA-N 390.443 2.684 0 50 GFAA COC(=O)c1ccc(NC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1 13746730 YDQMICONEKOLOP-UHFFFAOYSA-N 383.404 2.590 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1CCC[C@H](N(C)CCc2ccccc2)C1 72171303 OBXDAYGMLPIULG-FQEVSTJZSA-N 381.520 2.781 0 50 GFAA CN1CCC(N(Cc2ccncc2)C(=O)NCc2cnc3ccccn23)CC1 426511828 VUIJLRIDKDZXOB-UHFFFAOYSA-N 378.480 2.535 0 50 GFAA COc1cc(C)sc1C(=O)N[C@@H]1CCOC[C@H]1Oc1ccc(CO)cc1 220546747 AJKFQAHBEISVGG-NVXWUHKLSA-N 377.462 2.524 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)N2CCC[C@H](n3cncn3)C2)C[C@@H](C)O1 175287385 CITIFVOLDHOWJS-ZACQAIPSSA-N 384.484 2.761 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN3CCc4ccccc4C3)C2=O)c1 20455859 AWAQHQMJSDYDGH-HSZRJFAPSA-N 398.478 2.746 0 50 GFAA Cc1cccc(C)c1N1C(=O)C[C@@H](N2CCN(Cc3ccccc3)CC2)C1=O 20494458 AVGZRHVGYNGDNY-HXUWFJFHSA-N 377.488 2.753 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91756533 CTINLFWFVCREOU-UHFFFAOYSA-N 396.491 2.774 0 50 GFAA Cn1cc([C@@H]2CN(S(=O)(=O)Cc3c(Cl)cccc3Cl)CCO2)cn1 267531294 KXLKSKYJVOVYBD-HNNXBMFYSA-N 390.292 2.630 0 50 GFAA CCc1noc([C@@H]2CCCN2C(=O)CCN2CCN(c3cccc(C)c3)CC2)n1 95372421 SEZHWQWVOXBOPJ-IBGZPJMESA-N 397.523 2.816 0 50 GFAA CC1(C)CN(C(=O)NCc2ncc(C(F)(F)F)cn2)C[C@H](C(F)(F)F)O1 297579706 QYLWSYDQCCZDLC-SECBINFHSA-N 386.296 2.747 0 50 GFAA COc1cccc2c1OC[C@H](NC(=O)CCCc1nc(-c3ccco3)no1)C2 824804893 RJEPBFBAALMQQW-CQSZACIVSA-N 383.404 2.781 0 50 GFAA COCCN1CCC[C@@H](CNS(=O)(=O)c2cc(Cl)c(Cl)s2)C1 670473318 OSNSDYFREOMTSS-JTQLQIEISA-N 387.354 2.692 0 50 GFAA CC(C)N1C[C@@H](NC(=O)CCn2ccc3cc(Br)ccc32)CC1=O 952985952 DNDFRYOLTLDHKH-HNNXBMFYSA-N 392.297 2.919 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)S(=O)(=O)CCOc1ccc(F)cc1 952990417 UEEXRSJNRMNZHO-UHFFFAOYSA-N 381.404 2.682 0 50 GFAA CCS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](c3noc(C4CC4)n3)C2)c1 270739723 UMXFMOFBHAUGST-HNNXBMFYSA-N 389.477 2.760 0 50 GFAA Cc1c(F)cc(C(=O)NCC(F)(F)F)cc1NC(=O)CC(C)(C)C(=O)O 169987597 YQDRUVWESMQFIK-UHFFFAOYSA-N 378.322 2.866 0 50 GFAA O=C(NCCCc1nc2ccccc2[nH]1)N1CCN(c2cccc(O)c2)CC1 193025466 SEITXDOQTRJOTO-UHFFFAOYSA-N 379.464 2.733 0 50 GFAA CC[C@H](NC(=O)/C=C/c1cc(CO)cs1)c1ccc(S(C)(=O)=O)cc1 1506414221 DLUDMQHZNJWEHU-NADMHLTPSA-N 379.503 2.925 0 50 GFAA Cc1nn(CC(=O)N(Cc2ccncc2)C2CCN(C)CC2)c(C)c1Cl 1506416715 FUQWQGQUOPXSBB-UHFFFAOYSA-N 375.904 2.671 0 50 GFAA Cc1noc(C)c1CN1CCCN(C(=O)CCc2nc3ccccc3[nH]2)CC1 1529198887 OKIBMCGOSNKMQG-UHFFFAOYSA-N 381.480 2.835 0 50 GFAA CC(=O)c1cnc(N2CCC(C(=O)N3CCc4ccccc4C3)CC2)nc1C 1772706212 VSJVEHFXXCWCNK-UHFFFAOYSA-N 378.476 2.789 0 50 GFAA O=C(NCCN1CCCCC1)c1cn(Cc2ccccc2C(F)(F)F)nn1 11878576 UDIFSCHBCDMKDQ-UHFFFAOYSA-N 381.402 2.561 0 50 GFAA COC(=O)c1ccc(C(=O)Nc2ccc(C(=O)NC[C@H]3CCCO3)cc2)cc1 12406063 VPDOHVOQXXRMLK-GOSISDBHSA-N 382.416 2.634 0 50 GFAA COc1cc(CNC2CCCCC2)ccc1OC[C@@H](O)CN1CCSCC1 12458558 GRGSXZODDOLPME-IBGZPJMESA-N 394.581 2.906 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)c2cn(C(c3ccccc3)c3ccccc3)nn2)C1 12584063 QELJKFHMRYFTER-LJQANCHMSA-N 375.476 2.692 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCCCn3ccnc3)c2)cc1 13677032 FMPUPIJNVHVZLE-UHFFFAOYSA-N 398.488 2.812 0 50 GFAA CCCn1cc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c(C)n1 14980645 JGCRGMIRQXGZII-SFHVURJKSA-N 387.572 2.557 0 50 GFAA Cc1cccc(NC(=O)[C@H](C)N(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c1 16579370 GNIZYVPQUNVCQV-AWEZNQCLSA-N 390.461 2.559 0 50 GFAA CCn1ccc(C(=O)N[C@@H]2CCCN(c3cc(-c4ccc(OC)cc4)n[nH]3)C2)n1 169753937 FFSATHNZTCOSRY-MRXNPFEDSA-N 394.479 2.701 0 50 GFAA COc1ccccc1CC(=O)N1CCN(c2cc(C(F)(F)F)nc(C)n2)CC1 169772291 QCDVOVSBQDVCSL-UHFFFAOYSA-N 394.397 2.704 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N[C@@H]3CCCC[C@H]3O)cc12 1857692252 WCXWASHAIKRDOH-HZPDHXFCSA-N 378.538 2.665 0 50 GFAA O=C([C@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CCc2ncccc2C1 1857727852 CJGZSBXOSMHILM-AWEZNQCLSA-N 378.457 2.629 0 50 GFAA OCCOc1ccccc1CN1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875250410 WQNMQBIBJKTJLQ-PMACEKPBSA-N 377.868 2.646 0 50 GFAA O=C(c1cnc([C@H]2CCCO2)s1)N1CCc2c(nnn2-c2ccccc2)C1 329362890 JBIYHHLPMPXOQY-MRXNPFEDSA-N 381.461 2.774 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)N1CCN(c3ccncc3Cl)CC1)CO2 123297726 KMORVTDSNCBWPG-HNNXBMFYSA-N 387.867 2.644 0 50 GFAA COc1cccc(C(C)(C)CNC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)c1 127459680 OAVSRJBAHKCWEJ-QGZVFWFLSA-N 385.512 2.675 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)n(-c2ccccc2)n1 237981271 LUBGLDCZGHJEHK-IBGZPJMESA-N 395.390 2.923 0 50 GFAA O=C(O)C1CCN(C(=O)c2cn(-c3ccc(Br)cc3)cn2)CC1 238043544 JPBYWENTRFQDRV-UHFFFAOYSA-N 378.226 2.572 0 50 GFAA COc1ccccc1Nc1nnc(S[C@@H](C)C(=O)NC(=O)NC2CC2)s1 139202568 DYXAQQLHOPHIBT-VIFPVBQESA-N 393.494 2.759 0 50 GFAA COC(=O)c1ccc(-c2nc(CN3CCO[C@@H]([C@@H]4CCCO4)C3)cs2)cc1 152289906 UKHFRUPNCNPJJH-ZWKOTPCHSA-N 388.489 2.977 0 50 GFAA COc1cccc(C[C@@H](NC(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)C2CC2)c1 1875257247 KCHJIBBVMCJBEW-UYAOXDASSA-N 385.508 2.670 0 50 GFAA CN1C[C@@H]2CN(c3cc(-c4cccnc4)nc4ncnn34)C[C@H]2[C@H]1c1ccccc1 1875260719 WUEJVJZOQLWMIV-WOIUINJBSA-N 397.486 2.925 0 50 GFAA C[C@@H]1CCNC(=O)[C@H]1CN1CCC(=O)N(CCc2cc3ccccc3s2)C1=O 1875299042 WPYABGMXTGKGJQ-PBHICJAKSA-N 399.516 2.870 0 50 GFAA Cc1cc(=NC(=O)c2cnnn2C2CC2)[nH]n1-c1cccc(C(F)(F)F)c1 1875285761 YKKRJFIXJZDKCV-UHFFFAOYSA-N 376.342 2.800 0 50 GFAA O=C(c1ccc(F)c2ccncc12)N1CCC(c2ncc3c(n2)CCNC3)CC1 1875311996 FUQOWESRPWIQSL-UHFFFAOYSA-N 391.450 2.829 0 50 GFAA O=C(Cc1ccc(F)cn1)N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875402383 FAHZVBYESHCEPD-CWFSZBLJSA-N 394.450 2.583 0 50 GFAA COc1cc(OC)c([C@@H]2CC(=O)Oc3c2c(=O)[nH]c2ccccc32)cc1OC 4387088 BGLIMMMKADBZHG-ZDUSSCGKSA-N 381.384 2.995 0 50 GFAA O=C(NCc1ccc2c(n1)CCCC2=O)c1ccc(CSc2nc[nH]n2)cc1 2325728603 JEQWUACUNAJBHC-UHFFFAOYSA-N 393.472 2.941 0 50 GFAA COC(=O)[C@H](Cc1ccccc1)OC(=O)c1ccc([C@H]2CCCC(=O)N2)cc1 2325780610 AUNUMYCGFDWJLX-MOPGFXCFSA-N 381.428 2.969 0 50 GFAA O=C(COc1ccc(S(=O)(=O)NC2CCCC2)cc1)N1CCCCCC1 804913 JBAYDPMIUIZNKA-UHFFFAOYSA-N 380.510 2.689 0 50 GFAA Cc1ncc(CN2CCC3(CCc4c(O)nc(-c5cccnc5)nc43)CC2)n1C 2356149966 GEXKIWGDIHVLJI-UHFFFAOYSA-N 390.491 2.766 0 50 GFAA Cc1ccc(C(=O)NC[C@@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c(C)c1 225716629 APYOTJLBZPPOMQ-LJQANCHMSA-N 398.478 2.890 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N2CCC[C@H]2Cc2cc(F)ccc2F)cs1 416261084 UASREJPUHHBYLH-ZDUSSCGKSA-N 386.445 2.521 0 50 GFAA O=C(NC1CC1)c1cc2n(n1)CCCN(Cc1c(Cl)nc3sccn13)C2 65467546 IAZATAUGHVCIJJ-UHFFFAOYSA-N 390.900 2.544 0 50 GFAA CN(Cc1ccc2nonc2c1)C[C@]1(O)CCCN(CC2CCCCC2)C1=O 67947505 UNUBWVSBKYPYOU-OAQYLSRUSA-N 386.496 2.588 0 50 GFAA Cc1cccc(O[C@H](C)C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 20375063 VAQSBJOFSLANCM-QGZVFWFLSA-N 382.460 2.835 0 50 GFAA O=C(c1ccc(CSc2ncn[nH]2)o1)N(C/C=C/c1ccccc1)CCO 65396388 IJVNDWXVAYYPNS-QPJJXVBHSA-N 384.461 2.838 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccccc4C)CC3)ncn2)n1 72115397 KIBBNKMZQQYIJD-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CC[C@H]1CN(C(=O)c2cc(C)c(C)[nH]c2=O)CCC(=O)N1Cc1ccccc1 71760208 SNHRVWQEAWKMFU-SFHVURJKSA-N 381.476 2.645 0 50 GFAA COC(=O)c1cc(C)sc1NC(=S)N1CCN(C(=O)c2ccco2)CC1 6825579 SAUSVSCRQZGKLD-UHFFFAOYSA-N 393.490 2.591 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2c2ncc(Br)cn2)n1C 328631260 QSEOSGMPVSOPDJ-CYBMUJFWSA-N 378.274 2.669 0 50 GFAA Cc1cnc(C(=O)N2CC[C@]3(CCCN(CCCc4ccccc4)C3=O)C2)cn1 12577402 VWMMKODFKQFSGY-HSZRJFAPSA-N 392.503 2.873 0 50 GFAA Cn1ccnc(N2CCC[C@@H](NC(=O)Nc3ccc(F)c(C4CC4)c3)C2)c1=O 366944062 BBROABWVKQKACR-OAHLLOKOSA-N 385.443 2.587 0 50 GFAA C[C@H](c1nc(-c2ccccc2)no1)N1CCC(S(=O)(=O)N2CCCC2)CC1 367074080 WLWCYPFRURXUKS-OAHLLOKOSA-N 390.509 2.688 0 50 GFAA Cc1nccn1-c1ncccc1CNC(=O)N1CC[C@]2(C1)OCc1ccccc12 372216761 NRDOYTZYPQGYDQ-JOCHJYFZSA-N 389.459 2.917 0 50 GFAA Cc1cccc(=O)n1CCC(=O)N(C)CC1CCN(Cc2ccccc2)CC1 77423948 XIAMHHJJXIPVDA-UHFFFAOYSA-N 381.520 2.917 0 50 GFAA Cc1c(CN(C)C(=O)C[C@H]2C(=O)NCCN2CC(C)(C)C)[nH]c2ccccc12 72161170 GIJRPIRIWBJITE-IBGZPJMESA-N 384.524 2.671 0 50 GFAA O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1csc(Cc2ccccc2F)n1 238098464 VPJQXIWCMHAOQQ-AWEZNQCLSA-N 392.452 2.969 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N3CCC4(CC3)CN(C)C(=O)O4)o2)CC1 77440122 BBESYKFKHWLXMT-UHFFFAOYSA-N 375.469 2.568 0 50 GFAA CN1CCc2nc(NC(=O)C3CCN(C(=O)c4ccccc4)CC3)sc2C1 173172440 ZBOBQLWLIIYICU-UHFFFAOYSA-N 384.505 2.622 0 50 GFAA COC(=O)[C@@H](CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21 135726284 GVVDKFNHFXLOQY-GOSISDBHSA-N 383.400 2.932 0 50 GFAA CCCCOc1ccc(CN2CCn3nc(CNC(=O)N(C)C)cc3C2)cc1 82096949 TWSAJTJQAYSAOQ-UHFFFAOYSA-N 385.512 2.849 0 50 GFAA Cc1ccc2nc(CNC(=O)N3CCCC[C@H]3CCN3CCCC3=O)[nH]c2c1 426595129 ZDEMQWZQVAJHSN-INIZCTEOSA-N 383.496 2.948 0 50 GFAA Cc1cc(C)n(C[C@@H](C)CNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)n1 20607537 BZZPNKQXTOPWPM-NSHDSACASA-N 383.418 2.656 0 50 GFAA C[C@H](NC(=O)c1coc(CN2CCOCC2)c1)c1cnn(-c2ccccc2F)c1 95385472 CNQUKDQZHZFYJZ-HNNXBMFYSA-N 398.438 2.928 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCN(CC(C)C)[C@H](CCO)C3)cc2)nn1 426442826 COGSUOOEPZSTJE-HXUWFJFHSA-N 382.508 2.617 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N3CC[C@@]4(CC(=O)c5ccccc5O4)C3)c2n1 97655412 LXABVENBFHWPFL-OAQYLSRUSA-N 376.416 2.596 0 50 GFAA Cc1cccc2cc(C(=O)NCc3cc4n(n3)CCCN(C(=O)N(C)C)C4)oc12 91602426 YULSMSZONTYFGJ-UHFFFAOYSA-N 395.463 2.755 0 50 GFAA COc1ccc(CN2CCC(NC(=O)c3c(C)cc(C)nc3O)CC2)cc1OC 252494902 OHQFMWGYADGDNX-UHFFFAOYSA-N 399.491 2.816 0 50 GFAA O=C(Nc1cccc(OCCN2CCOCC2)c1)c1n[nH]c2c1CCCCC2 257263198 LOVLMLYPUAESBS-UHFFFAOYSA-N 384.480 2.642 0 50 GFAA CCn1cc(-c2ccc(C(=O)N3CCC[C@H](CN4CCOCC4)C3)cc2)cn1 534590839 JQBJQCUOMBTSPW-GOSISDBHSA-N 382.508 2.754 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc(C3CC3)nc3onc(-c4ccccc4)c23)CCO1 299751875 SBQXOCZJRKBQQJ-MRXNPFEDSA-N 393.399 2.693 0 50 GFAA COc1ccc(-c2nn3ccn(Cc4cc(F)cc(F)c4)c(=O)c3c2CO)cc1 263619636 ZSEWMDNMQVGZQA-UHFFFAOYSA-N 397.381 2.990 0 50 GFAA CC(C)CCOc1cccc(CCNC(=O)N2CCC[C@H]2C(=O)N(C)C)c1 584899270 SFOJOCAUCAIOSV-IBGZPJMESA-N 375.513 2.916 0 50 GFAA CN(C)c1ccc(C(=O)NCC2CCN(C(=O)/C=C/c3ccccc3)CC2)cn1 952987958 MKSZIDPZHCQWMB-DHZHZOJOSA-N 392.503 2.829 0 50 GFAA Nc1ncc(/C=C/C(=O)N(CCc2ccc(F)cc2)Cc2cccnc2)cn1 952962309 DCJFGXJXDABBSR-VMPITWQZSA-N 377.423 2.878 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 170591087 XUMYCLKADXYXHJ-UHFFFAOYSA-N 385.825 2.864 0 50 GFAA CCOc1cc2c(cc1CN1C(=O)c3ccccc3CS1(=O)=O)O[C@H](C)C2 170629461 POBDBXOJMXZSEH-CYBMUJFWSA-N 387.457 2.895 0 50 GFAA O=C(Cc1cnc2ccccc2c1)NCc1cccc(N2CCCS2(=O)=O)c1 190761473 PDLSLWJEECSAMA-UHFFFAOYSA-N 395.484 2.634 0 50 GFAA COc1ccccc1-n1cc(C(=O)Nc2ccnn2C2CCN(C)CC2)cn1 1506405959 CZQIPSNAECTGIK-UHFFFAOYSA-N 380.452 2.596 0 50 GFAA COc1ccc2c(c1)[C@@H](NC(=O)c1cc(N3CCOCC3)no1)CC(C)(C)O2 1772812291 KNIBXOBKVPAJIA-HNNXBMFYSA-N 387.436 2.552 0 50 GFAA O=C(NCCc1nc(-c2ccccc2)cs1)c1cc(N2CCOCC2)no1 1772818812 LPEKOCOLLKBPGS-UHFFFAOYSA-N 384.461 2.607 0 50 GFAA Cc1ccsc1C(=O)N1CC[C@H]2[C@H](CCC(=O)N2CCCn2ccnc2)C1 12124370 BZNLEADSPZXVKJ-SJORKVTESA-N 386.521 2.796 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1cccc3ncccc13)CC2 12149462 BANLHHIJZYMPLN-LJQANCHMSA-N 393.487 2.777 0 50 GFAA CCOC(=O)[C@]1(Cc2cccc(OC)c2)CCCN(C(=O)c2cc(C)[nH]n2)C1 12447293 WDRCNXDUFBMVMB-NRFANRHFSA-N 385.464 2.755 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN(C)Cc2cc(C)no2)cc1OC 12705637 WTSPMMMDWGJLDB-GOSISDBHSA-N 391.512 2.705 0 50 GFAA Cc1cccc(CN[C@@H]2CCc3c(c(C(=O)N4CCSCC4)nn3C)C2)c1 14754411 NUTJZNBHBUGYQV-QGZVFWFLSA-N 384.549 2.565 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CCN(CC4CCC4)CC3)nc2)on1 15065754 KVEJICXSNPGGDU-UHFFFAOYSA-N 397.523 2.874 0 50 GFAA CCOCCCN[C@H]1CCc2c(c(C(=O)N(C)C)nn2Cc2ccccc2)C1 19147838 MWKWZNOYRAHLMU-SFHVURJKSA-N 384.524 2.507 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CCC(Cn2cc(CO)nn2)CC1 19772174 LHNQVCYOFJDJDX-UHFFFAOYSA-N 376.460 2.990 0 50 GFAA O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(-n2ccnc2)cc1 158938959 MRINXTSRYLLKHJ-FQEVSTJZSA-N 388.471 2.836 0 50 GFAA COc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NC[C@@H]2CCCO2)cc1 5483977 FHQITKDTJFHFCK-XPFMCRKWSA-N 380.444 2.761 0 50 GFAA Cn1c(N2CCOCC2)nc2cc(C(=O)NC[C@H]3CC[C@@H]4CCC[C@@H]43)ccc21 1857667401 JBJQLQWJORRVDO-JQHSSLGASA-N 382.508 2.966 0 50 GFAA Cc1ccc(C(=O)N[C@H]2C[C@H](C(=O)NCc3ccc(Cl)cc3)C[C@@H]2O)cc1 1875243472 IHCGXGVTBLVPQI-WDSOQIARSA-N 386.879 2.834 0 50 GFAA CCn1nc(C)c(CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1C 237036211 JPQXQPPSYLEDRU-FQEVSTJZSA-N 383.540 2.507 0 50 GFAA CC(C)c1nc([C@@H]2CCCN2C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)no1 246726599 VEJRYRTVSOSXML-KKUMJFAQSA-N 377.489 2.829 0 50 GFAA Cc1ccc(S(=O)(=O)n2ccc(C(=O)N3CCC(n4ccnc4)CC3)c2)cc1 264777016 WAOGOUSGNZSGAY-UHFFFAOYSA-N 398.488 2.707 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)NC[C@@H](O)Cc2cccc(Cl)c2)ccn1 834810644 JSMKSVCURQVBCB-INIZCTEOSA-N 375.856 2.663 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)C(C)(C)c3ccc(F)cc3)CC1)O2 1875394666 RBTDEYGRGIIKJN-INIZCTEOSA-N 387.455 2.714 0 50 GFAA Cc1cc(-c2nnc(NC(=O)CCS(=O)(=O)c3ccccc3)o2)cs1 2100537227 JTBPNOQFJWGHFU-UHFFFAOYSA-N 377.447 2.909 0 50 GFAA CC(C)[C@@H]1CC(=O)c2nc(NC(=O)c3ccc(-c4nnn(C)n4)cc3)oc2C1 2100539424 IDZLJMWNZOMHJA-CYBMUJFWSA-N 380.408 2.519 0 50 GFAA C[C@H]1CN(C(=O)c2c(C(F)F)nc3cnccn23)CC[C@@H](C(F)(F)F)O1 893229452 GYEMBSABORCAEZ-IUCAKERBSA-N 378.301 2.849 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cccc(OC(C)=O)c1 957014 GEAPCOGOJCHKRT-QGZVFWFLSA-N 388.445 2.825 0 50 GFAA Cc1ccc(N(CC(=O)Nc2ccc(F)cc2)S(=O)(=O)N2CCCC2)cc1 1114326 QJUGDIJPXMZUJD-UHFFFAOYSA-N 391.468 2.920 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(NS(=O)(=O)Cc2ccccc2)cc1 1131846 SSTRNBCGQZSLER-UHFFFAOYSA-N 382.507 2.659 0 50 GFAA COC(=O)c1c(NC(=O)C(Cl)(Cl)Cl)sc(C(=O)N(C)C)c1C 1140250 XIHBFNSFWOGVHV-UHFFFAOYSA-N 387.672 2.854 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2cc(-c3ccccc3O)[nH]n2)C1=O 2356135788 SYGGFSGSIFIYGD-NRFANRHFSA-N 382.464 2.788 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)c(O)n1 2356145069 ZFNFAVMCVLEEQM-QFIPXVFZSA-N 379.460 2.893 0 50 GFAA Cc1cc(Cl)ccc1S(=O)(=O)N1CCC[C@]12CCCN(C1CC1)C2=O 2356146104 RPVIZCVHLIVUCN-SFHVURJKSA-N 382.913 2.957 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3ccccc3-n3ccnc3)cn12 2356163474 FKVPYCVIVZNKLK-IBGZPJMESA-N 390.447 2.534 0 50 GFAA CC(C)CNS(=O)(=O)c1ccc(OCC(=O)NC2CCCC2)c(Cl)c1 2855930 DPROSBWXADTVHE-UHFFFAOYSA-N 388.917 2.712 0 50 GFAA CCN1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(C)cc2)CC1 4756862 MPOPTDPQVQVLPP-UHFFFAOYSA-N 387.505 2.574 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1cccc(C(F)(F)F)c1)NC1CCCCC1 55099434 TUTHXHRVHXUVTB-KRWDZBQOSA-N 397.441 2.845 0 50 GFAA COc1ccccc1N1C(=O)C[C@@H](N2CCN(c3ccc(Cl)cc3)CC2)C1=O 100027518 NUSROMPSMCFUEJ-GOSISDBHSA-N 399.878 2.803 0 50 GFAA C[C@H](Cn1cncn1)NC(=O)c1ccc2nc(Cc3ccccc3F)oc2c1 11840591 FBUIWZOWNCQZGY-CYBMUJFWSA-N 379.395 2.968 0 50 GFAA O=C(c1csc2nc(-c3ccccc3)cn12)N1C[C@H](O)[C@@H](N2CCCCC2)C1 67946263 RQQDAIOCJNKKAM-HKUYNNGSSA-N 396.516 2.734 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(c3ccnc(N4CCCC4)n3)CC2)cc1 72117698 VUQPERZULUXGRE-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA O=c1oc2ccccc2n1CCN1CCN([C@@H]2CCc3ccccc3C2)CC1 216251141 NQTXXVLDRMVCRQ-HXUWFJFHSA-N 377.488 2.770 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)N[C@@H](C(=O)O)c1ccccc1 71283443 CVLOLYRNGSMQGV-LJQANCHMSA-N 397.818 2.506 0 50 GFAA CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)CCC(=O)N2CCN(c3ccccn3)CC2)C1 330050561 LXYLTHCBPZHAKQ-FDDCHVKYSA-N 398.551 2.938 0 50 GFAA O=C(NC1CCCCC1)N1CCC[C@H](CNS(=O)(=O)Cc2ccccc2)C1 12579569 RZCWMLNZLACXFX-GOSISDBHSA-N 393.553 2.860 0 50 GFAA COc1cccc([C@H]2C[C@H](C)CN2C(=O)NCCNC(=O)c2cccnc2)c1 363736343 GQHAQPLODRDBSK-HNAYVOBHSA-N 382.464 2.613 0 50 GFAA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)NCc1ccc(-n2ccnc2)nc1 374777976 NXABOFRYHGCNGO-MSOLQXFVSA-N 389.463 2.531 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCCOCC1 71404249 IVYWPQVLHIHMAQ-NRFANRHFSA-N 385.552 2.612 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CCCNCC2)[C@@H]1c1ccccc1OC 236771106 DLXWGVRQVUXGBE-RXVVDRJESA-N 387.524 2.597 0 50 GFAA Cc1cc(C)c2c(OCC(=O)NC[C@@H](N)c3ccc(C(C)C)cc3)nn(C)c2n1 236821191 HNIUPPHLJUQYJP-GOSISDBHSA-N 395.507 2.904 0 50 GFAA Cn1ncc(N2CCO[C@@H](CCNc3ccc4cccc(Cl)c4n3)C2)cc1=O 77303009 QMIDSYAIOBLMOJ-INIZCTEOSA-N 399.882 2.689 0 50 GFAA CCOc1ccc(NC(=O)c2nc(C)n(-c3ccccc3Cl)n2)c(C(N)=O)c1 129285812 UDCIRBBWQGYIQQ-UHFFFAOYSA-N 399.838 2.979 0 50 GFAA C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(-n4cncn4)c(F)c3)CC2)C1 173088597 SPCODQWBNCPKFF-HNNXBMFYSA-N 399.470 2.517 0 50 GFAA CCCN1CCCn2nc(CNC(=O)C3(c4ccc(OC)cc4)CC3)cc2C1 82138324 UIZSEEFDNOUBKS-UHFFFAOYSA-N 382.508 2.855 0 50 GFAA Cc1nc(O)cc(C2CCN(C(=O)CN3CC[C@H](c4ccccc4)C3)CC2)n1 220142108 UDBAIRDLLRUBPE-IBGZPJMESA-N 380.492 2.686 0 50 GFAA O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)NCc1cncn1C1CC1 426490094 CZJLYBHZJRZMSI-UHFFFAOYSA-N 399.454 2.911 0 50 GFAA Cc1nn2c(CNc3cccc(S(=O)(=O)NC4CC4)c3C)c(C)nc2s1 289523583 POQPPKFQFXMOQA-UHFFFAOYSA-N 391.522 2.769 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)NCCc3ccccc3)C[C@H]2NC(C)=O)cc1 95525788 YQYBMEQSGBLKBK-LEWJYISDSA-N 381.476 2.551 0 50 GFAA Cc1cc(C(=O)N2CCN(C)[C@]3(CCNC(=O)CC3)C2)c(-c2ccccc2)o1 95388758 KYCVUUGLOSWXNF-JOCHJYFZSA-N 381.476 2.682 0 50 GFAA CCCCN1C[C@]2(CCCN(CCS(=O)(=O)c3ccccc3)C2)CCC1=O 92003152 ATCCABBHDRJPDB-OAQYLSRUSA-N 392.565 2.965 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3c[nH]c4ccccc34)C[C@H]2NC(C)=O)cc1 91519420 BGOIVCQVSPGXOD-RBBKRZOGSA-N 391.471 2.850 0 50 GFAA CN(C)c1nc(Cl)c(CN2C[C@H]3CC[C@@H]2CN(C2CCOCC2)C3)s1 95371371 WCAOMPFSCBSLLF-DZGCQCFKSA-N 384.977 2.938 0 50 GFAA COc1cc2c(cc1CN1C[C@H]3CC[C@@H]1CN(C(=O)c1cnccn1)C3)CCC2 95353717 WURKBJXKGFCDIE-OXQOHEQNSA-N 392.503 2.711 0 50 GFAA CCN1CCC[C@H]1Cn1c(=O)n(C[C@H]2CCCCO2)c2cc(C(=O)O)ccc21 249701571 YOIJEDREJXBJAM-DLBZAZTESA-N 387.480 2.555 0 50 GFAA O=C(c1ccc(NS(=O)(=O)Cc2ccccc2Cl)cc1)N1CCOCC1 252480313 BZPMJWQXXWHENN-UHFFFAOYSA-N 394.880 2.754 0 50 GFAA C[C@](O)(CNC(=O)NC1CCN(CC(F)(F)F)CC1)c1ccccc1Cl 184054213 NUGVVVOCOYKMQO-INIZCTEOSA-N 393.837 2.873 0 50 GFAA O=C(O)COc1cccc(CNC(=O)c2ccccc2OC[C@H]2CCCO2)c1 299741731 AJJUADILXJDUGU-QGZVFWFLSA-N 385.416 2.638 0 50 GFAA O=C(O)[C@]1(CCCc2ccccc2)CN(CCn2cc(Cl)cn2)CC[C@@H]1O 1940195471 FWNDLLYLTREPSV-AZUAARDMSA-N 391.899 2.697 0 50 GFAA O=C(CCn1nnc2ccccc21)NCCN1CCC(c2ccccc2)CC1 299798465 RVRNDEKGLVHOSH-UHFFFAOYSA-N 377.492 2.817 0 50 GFAA CC[C@H](NS(=O)(=O)c1ccc(OC)c(C(=O)NC)c1)c1nc(C)c(C)s1 822668891 OJQBZBSDNIOCJL-AWEZNQCLSA-N 397.522 2.558 0 50 GFAA Cn1nnc(-c2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCO3)cc2)n1 952980714 KRLFIUKWUMFWDF-MRXNPFEDSA-N 379.420 2.687 0 50 GFAA CC(C)=CCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)CCC(=O)Nc1ccccc1)C2 1565514369 CFAULNZSWYIIHW-MJGOQNOKSA-N 383.492 2.821 0 50 GFAA O=C(c1cc[nH]c1)N1C[C@H]2CN(Cc3cnc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772814719 PKCHJJKTNCSCCR-OFNKIYASSA-N 389.503 2.945 0 50 GFAA CCC(CC)NC(=O)C1CCN(C(=O)[C@H]2CC(=O)N(c3ccccc3)C2)CC1 11093117 CZFDVRYXQXRUGQ-KRWDZBQOSA-N 385.508 2.583 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@@H](OCc3ccccn3)C2)nn1 11937943 NMWGSIPJMONZTP-HXUWFJFHSA-N 391.475 2.851 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCCc2ccccc2F)c1=O 12051529 WZKHUNYTVPUNGA-UHFFFAOYSA-N 399.466 2.825 0 50 GFAA Cc1c(C(=O)NCCCc2ccncc2)cnn1-c1nccc(-c2cccnc2)n1 12191448 NTROGUNHWOINFY-UHFFFAOYSA-N 399.458 2.790 0 50 GFAA O=C1C[C@H](NC(=O)c2nc(N3CCCC3)nc3c2CCCC3)c2ccccc2N1 12314672 WLUSJHDWDWHQKS-SFHVURJKSA-N 391.475 2.769 0 50 GFAA Fc1ccc(-n2ncc3c(N4CCN(c5ccccn5)CC4)ncnc32)cc1 13724077 KEMHRYJOYKUFHE-UHFFFAOYSA-N 375.411 2.676 0 50 GFAA CC(C)OCC(=O)N1CCC[C@H]1c1ccc(C(=O)N2CCCOCC2)s1 19113483 XMWHFBYZKMHYKY-HNNXBMFYSA-N 380.510 2.699 0 50 GFAA Cc1ccc(OCCN2CCN(C(=O)c3cc4ccccc4oc3=O)CC2)cc1 19619996 OYDJFIQHHHNLRN-UHFFFAOYSA-N 392.455 2.938 0 50 GFAA COc1ccc(-c2nc(-c3nnn4c3CO[C@@H](c3ccc(C)cc3)C4)no2)cn1 169769346 OKHMCBXTKZRPGX-MRXNPFEDSA-N 390.403 2.979 0 50 GFAA CCOCCNC(=O)C1(OC)CCN(C(=O)c2csc3ccccc23)CC1 1857695779 XHFLCIMLYVFHIT-UHFFFAOYSA-N 390.505 2.675 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCN(C)C(C)C)C3)nc2c1 1857728488 DDSNJUZJPANMRU-INIZCTEOSA-N 388.512 2.899 0 50 GFAA CCCOCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(C)cc3F)C[C@]23CC[C@H]1O3 1857729924 JDQQNSGTXACXBT-XHYAQGIWSA-N 390.499 2.656 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)nc1 125166516 NALWUFPWLFIQEP-GFCCVEGCSA-N 380.231 2.781 0 50 GFAA Oc1n[nH]c([C@@H]2CCCCN2Cc2cc(Br)c3c(c2)OCO3)n1 333631609 AKEDGSVATKSQSG-NSHDSACASA-N 381.230 2.729 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCC3(CC2)C[C@@H]3CN(C)C2CC2)c1C 367357526 BUKDVAFLUGKGRD-MRXNPFEDSA-N 377.554 2.640 0 50 GFAA NC(=O)c1ccc(N2CCN(C(=O)C[C@H]3CCc4ccccc4C3)CC2)cc1 265501550 XUVILHTWBWACLG-KRWDZBQOSA-N 377.488 2.629 0 50 GFAA Cc1cc(N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)nc(N2CCCC2)n1 1704311382 HFQJZDIHTVEGPD-JOCHJYFZSA-N 393.539 2.726 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1CCc2cccc(C(=O)O)c2C1 844157673 KEDFNLJLTISHRJ-NRFANRHFSA-N 392.455 2.806 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(c3nccc(-n4ccnc4)n3)C[C@H]21 1875273614 UFQPIGVJJRMTMR-NCOADZHNSA-N 396.495 2.744 0 50 GFAA CN1CCC(c2nc(C(F)(F)F)n3c2CN(C(=O)Cc2ccoc2)CC3)CC1 1875394652 QQSXBPADTZKEOS-UHFFFAOYSA-N 396.413 2.889 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)o1)N1C[C@@H]2COC[C@]2(c2ccccc2)C1 1875393188 AAKPLLYCMWOICO-CJNGLKHVSA-N 387.379 2.887 0 50 GFAA O=C(Cn1cc(I)cn1)NCCc1ccc(Cl)cc1 4745017 XKWCQQXWQNVLPM-UHFFFAOYSA-N 389.624 2.500 0 50 GFAA O=C(c1cccc(Cc2nn[nH]n2)c1)N1CCC[C@H](c2ccc(F)c(O)c2)C1 2325807971 PIFBODVUPCACER-INIZCTEOSA-N 381.411 2.655 0 50 GFAA N[C@@]1(c2ccccc2)CCN(C(=O)C(=O)NCCc2csc3ccccc23)C1 2325857533 FOPRKBIMULZVSY-QFIPXVFZSA-N 393.512 2.647 0 50 GFAA C[C@@H](CNC(=O)c1nccc2c1[nH]c1ccccc12)NC(=O)c1cnc(Cl)[nH]1 2325873052 XDTDUTUPOSMDHX-JTQLQIEISA-N 396.838 2.641 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)NCc1ccc(C)cc1)S(C)(=O)=O 669967 AKVCJDSQOOCTJO-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA COc1cccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc(OC)cc2OC)c1 909828 HTKCYWSABJWFHZ-LJQANCHMSA-N 397.431 2.979 0 50 GFAA O=C(NCc1cccnc1)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)cc1 1110180 UMIUPTYUPYTYTA-QZTJIDSGSA-N 381.432 2.841 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2ccc(C)cc2C)S(C)(=O)=O)c1 1219374 QLQYRPBINYTZCJ-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CC(C)[C@H]1CC(=O)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)oc2C1 2356134092 XPWDOBWTENCLCL-LBPRGKRZSA-N 376.434 2.732 0 50 GFAA COc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCC[C@]12CCCN(C)C2=O 2356134871 GLDHPIXENYOAQQ-FQEVSTJZSA-N 394.537 2.903 0 50 GFAA Cc1oc2nc[nH]c(=O)c2c1C(=O)NCc1cccc(COCC(F)(F)F)c1 121924820 PHWYUZSPJJDBOQ-UHFFFAOYSA-N 395.337 2.833 0 50 GFAA CC(C)C[C@H]1COCCN1C(=O)c1ccc(OCC(=O)N2CCCCC2)cc1 55343855 HJMPCYRHGNWDAQ-IBGZPJMESA-N 388.508 2.965 0 50 GFAA O=C(NCCn1ccc2ccccc21)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 170622169 BTJZYDCLFGAAME-MRXNPFEDSA-N 387.443 2.687 0 50 GFAA COc1ccccc1CN1CCN(Cc2nc(Cc3ccccc3)no2)CC1 20256655 IXGOOWDZKPQPTH-UHFFFAOYSA-N 378.476 2.987 0 50 GFAA CC(C)(CC1CCOCC1)C(=O)NS(=O)(=O)c1cccc2cnccc12 119670640 KHVNZNPGKLSKFA-UHFFFAOYSA-N 376.478 2.883 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNCc2cc3ccccc3nc2O)CC(=O)N1C 328628307 NNWRBSSXCJJJJG-HRAATJIYSA-N 393.491 2.600 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@@H](CCO)C2)o1 23375176 MTFDQHPUCPAWHG-IBGZPJMESA-N 388.508 2.812 0 50 GFAA CCOc1nc2ccc(C(=O)N[C@@H]3CCN(c4ccccc4F)C3=O)cc2[nH]1 469654988 XWSZUYZVJKEWFU-OAHLLOKOSA-N 382.395 2.636 0 50 GFAA C[C@]1(C2CCN(c3cc(-c4ccccc4)nc4ncnn34)CC2)N=C(O)N=C1O 330050825 MKDTWGSXYDZMES-HXUWFJFHSA-N 391.435 2.651 0 50 GFAA COc1cccc(CN2CCN(C)C3(CCN(C(=O)OC(C)C)CC3)C2)c1 67955121 GIXHSIDNBZVWGQ-UHFFFAOYSA-N 375.513 2.822 0 50 GFAA COc1ccc(C(=O)N[C@@H](NC[C@H]2CCCO2)C(Cl)(Cl)Cl)cc1 24302624 UTFWYWCXRCOFDK-TZMCWYRMSA-N 381.687 2.890 0 50 GFAA CCc1ccnc(CNC(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c1 438167971 JXQDWVHPSYADJU-UHFFFAOYSA-N 384.455 2.841 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)Cc1cn(C)nc1-c1ccc2c(c1)OCCO2 20775238 FZGICGVYIXVBBA-UHFFFAOYSA-N 381.480 2.873 0 50 GFAA O=C(CNC1CCN(C(=O)NC2CCCCC2)CC1)NCc1ccccc1F 65395723 OLOGEJOHKZNHJS-UHFFFAOYSA-N 390.503 2.538 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)[C@@H]1CCS(=O)(=O)c3ccccc31)CC2 367414547 FCHKYCDQSCKNCH-LJQANCHMSA-N 385.485 2.584 0 50 GFAA CCOc1ccc(C(C)(C)NC(=O)C[C@H]2C(=O)NCCN2C2CCCC2)cc1 72165377 BOHCXIGIXNMRQL-IBGZPJMESA-N 387.524 2.570 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2C[C@H](C)C[C@@H](C)C2)c1C(=O)OC(C)C 17080898 ZMZGZVCARHFOBZ-VXGBXAGGSA-N 395.525 2.637 0 50 GFAA CCc1ccc([C@@H]2CNCCN2C(=O)c2csc(-c3cnn(C)c3)n2)cc1 261707181 DIGINHDELVFNQY-SFHVURJKSA-N 381.505 2.893 0 50 GFAA Cc1nc2n(n1)C[C@H](NC(=O)NC[C@H]1CCCCN(Cc3ccccc3)C1)CC2 378110781 LRRLDWMFVZWBKR-WOJBJXKFSA-N 396.539 2.503 0 50 GFAA CCn1c(C)nnc1CN1CCC[C@@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 378541932 SUWQNIVNUZIRRK-QGZVFWFLSA-N 393.495 2.961 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCCS(=O)(=O)N2CCCC2)c2ccccc2N1 176093823 AYNBILVMWIMHNF-KRWDZBQOSA-N 379.526 2.676 0 50 GFAA Cc1ccccc1C(=O)Nn1ccc2c(nnc3c(-c4ccccc4)cnn32)c1=O 40388278 XTQNRWUDUGAXND-UHFFFAOYSA-N 396.410 2.799 0 50 GFAA CCN(C)C(=O)c1ccc([C@H]2CCCN2C(=O)c2cn3cccnc3n2)s1 20858367 LGNSEOGSWPUOEF-CQSZACIVSA-N 383.477 2.860 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](c3cccc(C(=O)O)c3)C2)cc1 95372188 HUBQQHLGSNOCKL-KRWDZBQOSA-N 387.457 2.808 0 50 GFAA Cc1cc(OC[C@@H](O)CNC(=O)c2cc(C(F)(F)F)n[nH]2)ccc1Cl 97637894 PAXDALGVHNPNQT-VIFPVBQESA-N 377.750 2.560 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)c2cnc(C)nc2)C1 95507993 ASPXURIXXPKZJK-SFHVURJKSA-N 382.508 2.820 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(C(=O)Cc3ccccc3)CC2)CC1=O 91873052 MGYQIMIQFSNGKL-UHFFFAOYSA-N 381.476 2.875 0 50 GFAA CCCO[C@H]1CCCN(C(=O)NC2CCN(Cc3cccc(O)c3)CC2)C1 534579763 DYIWZKDDZBRURT-FQEVSTJZSA-N 375.513 2.957 0 50 GFAA COc1ccc(-c2noc([C@H](C)NC(=O)N3CCSCC3)n2)cc1OC 534675013 TZCSHWLSMPCZKW-NSHDSACASA-N 378.454 2.573 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263614999 ACCMIFOYZBJTIO-UHFFFAOYSA-N 397.429 2.849 0 50 GFAA Cc1cc2nc(CCNC(=O)N3CCN(c4ccncc4)CC3)[nH]c2cc1C 534583268 RSFBUKDPGIIGLO-UHFFFAOYSA-N 378.480 2.649 0 50 GFAA CCCn1cc(CN2CCn3nc(CNC(=O)C4CCCC4)cc3C2)c(C)n1 299759652 NTRLHVJJEPZVTR-UHFFFAOYSA-N 384.528 2.620 0 50 GFAA Cc1ccc(C(=O)NCCN2CCC[C@@H](CO)C2)cc1NC(=O)C1CCCC1 828711253 VJTOSOCDMMLZOR-QGZVFWFLSA-N 387.524 2.558 0 50 GFAA CC(C)C(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(OC(F)(F)F)c2)C1 827927053 SPFZGQOPTSQDMV-LBPRGKRZSA-N 394.415 2.511 0 50 GFAA Cc1ccnc(C[C@@H](C)N(C)C(=O)NC2CCN(C(=O)N3CCCC3)CC2)c1 584888599 XUSBKXUNWVESSF-QGZVFWFLSA-N 387.528 2.643 0 50 GFAA COC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1NC(=O)c1nc(-c2cccc(C(F)(F)F)c2)no1 1875309801 OIFYFUNSDFBGAF-XQHKEYJVSA-N 395.337 2.683 0 50 GFAA Cc1ccnc(-n2nccc2NC(=O)c2nc3c(Br)cccn3n2)c1 1875344047 CLLHSJJHPVYZNB-UHFFFAOYSA-N 398.224 2.633 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1oc(C(C)C)nc1C)C[C@H](C)O[C@@H]2C 1875315797 HYUIHJUZFPQNHR-GXTWGEPZSA-N 390.484 2.902 0 50 GFAA O=C(c1cc(C2CC2)[nH]n1)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565513384 KIQHCVKKUNNLRI-BEFAXECRSA-N 376.504 2.991 0 50 GFAA Cn1cc([C@@H]2[C@@H](C(=O)N[C@@H]3CCCc4occc43)CC(=O)N2C(C)(C)C)cn1 225453498 YCFFBLJUZJIMJZ-FRQCXROJSA-N 384.480 2.895 0 50 GFAA C[C@@H](OC(=O)c1cnn(-c2cccnc2)c1)C(=O)N(C)Cc1cccc(F)c1 170616620 NRTGTBXFSFYQOA-CQSZACIVSA-N 382.395 2.610 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1OC(F)F)N1CCN(CC2CCOCC2)CC1 172425366 FDCDEHHEAGBPOS-HNNXBMFYSA-N 397.466 2.659 0 50 GFAA Cc1cc(-c2nc(C3CCOCC3)nn2[C@@H]2CCOC2)c2c(C)nn(C)c2n1 1772813698 PFZYQHDTFVCPRY-OAHLLOKOSA-N 382.468 2.699 0 50 GFAA Cn1cc(CNC(=O)c2cc(CN3CCC(Cc4ccccc4)CC3)on2)cn1 12208358 IBJKHCHCEQSIQU-UHFFFAOYSA-N 393.491 2.793 0 50 GFAA CCN(Cc1nccn1C)C(=O)c1ccc(N(C)Cc2ncccc2C)nc1 12434089 SDBRGLBNXROVDG-UHFFFAOYSA-N 378.480 2.817 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN(C)Cc2cc(C)no2)cc1OC 12705643 WTSPMMMDWGJLDB-SFHVURJKSA-N 391.512 2.705 0 50 GFAA CC1CCN(C(=O)C[C@H]2C(=O)NCCN2Cc2ccc3ccccc3c2)CC1 12707632 QTRPKFCFEYRFOE-NRFANRHFSA-N 379.504 2.789 0 50 GFAA O[C@H](COc1ccccc1CNCCc1ccccc1)CN1CCSCC1 12716054 CPKVGTVMGHZETQ-NRFANRHFSA-N 386.561 2.807 0 50 GFAA Cc1cc(O)nc(SCc2nnnn2-c2ccc(Br)cc2)n1 16701795 BXRJDDVYDSCCRL-UHFFFAOYSA-N 379.243 2.521 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4cc5ccccc5[nH]4)CC3)nn2)n1 169777307 LGMPPILGXOUVOL-UHFFFAOYSA-N 377.408 2.595 0 50 GFAA Cc1cccc(CN(C)C(=O)c2nc(C)c(C)c(N3CC[C@@H](N(C)C)C3)n2)c1 1857528659 HZDQFBKRXSHVLD-LJQANCHMSA-N 381.524 2.814 0 50 GFAA COc1cc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)ccn1 1857689294 MSSAYUFDLNITLG-FPOVZHCZSA-N 381.476 2.768 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCC(O)CC3)[C@@H]2c2ccccc2)c(C)o1 1857694714 UZYCCLNUWFRLIG-VXKWHMMOSA-N 398.503 2.935 0 50 GFAA C[C@H](NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1)c1nncn1C 1857714601 YEBLBFDNVLSLHD-NSHDSACASA-N 388.859 2.704 0 50 GFAA COc1ncccc1C(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857739569 VYUHCINIEPJQCG-SOLBZPMBSA-N 387.867 2.688 0 50 GFAA O=C(c1csc(-c2ccccc2)n1)N1CC[C@H](O)[C@](CC2CC2)(C(=O)O)C1 1875250622 RZCJEMXDOLTNJW-OXJNMPFZSA-N 386.473 2.888 0 50 GFAA Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(CC(=O)O)C1CCOCC1 237650869 JPQTYRAOLALIPA-UHFFFAOYSA-N 392.452 2.887 0 50 GFAA CN(Cc1ccc(Cl)s1)C(=O)CN1CCC[C@@H]1c1nc(N(C)C)no1 374538656 RNDYMIWLWLPKKR-GFCCVEGCSA-N 383.905 2.646 0 50 GFAA COc1ccc([C@@H]2CCCN2C(=O)Nc2cnn(CCN3CCOCC3)c2)cc1 266977364 RIXPFSVPRJQBGY-FQEVSTJZSA-N 399.495 2.593 0 50 GFAA COc1cc2c(cc1F)CC[C@H]2NC(=O)Cn1c(S)nc2ccccc2c1=O 801555028 XEPULKPEJCLEOV-MRXNPFEDSA-N 399.447 2.637 0 50 GFAA C[C@H](O)C[C@H](C)NC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)ccc1F 831995631 JANSWPOMHOALPJ-RYUDHWBXSA-N 398.431 2.655 0 50 GFAA Cc1cc(=O)c(O)c(C(C)(C)CC(=O)NCCc2c[nH]c3ccc(O)cc23)o1 2084394547 SVNHLWFAIHSCBU-UHFFFAOYSA-N 384.432 2.867 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@H]2CN(S(=O)(=O)c2cc(Cl)ccc2Cl)C1 100223776 ODEGXYDNMCOGBB-RYUDHWBXSA-N 399.299 2.963 0 50 GFAA CC[C@H](C)CC(=O)N1CCc2c(ncn2C)[C@@]12CCN(C(=O)Cc1ccco1)C2 2325776820 CKJRZMPXXSWKHW-AOMKIAJQSA-N 398.507 2.504 0 50 GFAA Cn1[nH]c(=NC(=O)c2ccc(C3(CN)CCC3)nc2)cc1-c1ccc(F)cc1 2325778706 KOANUCISZBWGHP-UHFFFAOYSA-N 379.439 2.676 0 50 GFAA Cc1c(CNS(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)noc1-c1ccccc1 2325818886 CQQKTYHDSGJBIX-UHFFFAOYSA-N 395.440 2.970 0 50 GFAA COc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(F)cc2)cc1Cl 1057425 DGHJAYZXFPRJJG-JTQLQIEISA-N 386.832 2.793 0 50 GFAA C=CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3ccccc32)C2=C1CC(C)(C)CC2=O 2871334 YFTXDLSSAGWOJZ-JOCHJYFZSA-N 375.428 2.682 0 50 GFAA O=C(NC1CCCCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 3434443 WRVMUJJDVSXELW-UHFFFAOYSA-N 385.917 2.689 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2O)cc1S(=O)(=O)N1CCCCC1 4841345 TZALTYCOLTTYOL-UHFFFAOYSA-N 390.461 2.828 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2nnc(C)n2C)sc2c1CCCC2 9048824 GSOCCOKUHRFQFD-UHFFFAOYSA-N 394.522 2.971 0 50 GFAA COc1ccc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccccc2)cc1 11859120 RUVFDGOFCYCCJZ-RLFYNMQTSA-N 394.349 2.799 0 50 GFAA CCOc1ccccc1CN1CCC[C@H](n2cc(C(=O)N(CC)CC)nn2)C1 12122945 KADHQBFSMASLBK-SFHVURJKSA-N 385.512 2.996 0 50 GFAA COc1ccccc1CN1C(=O)O[C@@H]2CN(C(=O)NCc3ccccc3)C[C@@H]21 12206517 ACRNHQYNJHJGJV-PKOBYXMFSA-N 381.432 2.610 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1cc(F)ccc1F)CC2 12281220 NSOMVXQEODWBMK-MRXNPFEDSA-N 378.419 2.507 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 13580585 NHGFUQAMOLYJAB-CQSZACIVSA-N 392.452 2.874 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@H](NCc1cccnc1)C2 14733306 CQSMCCOSSKZTQN-KRWDZBQOSA-N 393.491 2.810 0 50 GFAA Cc1c(C(=O)N(C)CCCN(C)C)cnn1-c1nccc(-c2ccccc2F)n1 14993492 SZISNQOXZSEKRB-UHFFFAOYSA-N 396.470 2.801 0 50 GFAA CO[C@@H](C(=O)Nc1ccnn1C1CCN(C(=O)C2CC2)CC1)c1ccccc1 15065147 SEKTXPRAMPFEEN-LJQANCHMSA-N 382.464 2.783 0 50 GFAA c1ccc(OCCN2CCN(Cc3nc(COc4ccccc4)no3)CC2)cc1 19229100 VCGXMRLWOHEFIB-UHFFFAOYSA-N 394.475 2.845 0 50 GFAA COC(=O)c1ccc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)cc1 19339717 HUTXIKDFPYKCCC-QFIPXVFZSA-N 382.504 2.585 0 50 GFAA COc1cc(CN2CCN(C(=O)c3ccccc3F)CC2)cc(OC)c1OC 19549830 JNBMHOWNFDFYAO-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA CCn1cc(CNC(=O)[C@@H]2CC(c3cccc(Br)c3)=NO2)c(C)n1 20602108 XIDNQBVXVKKFFC-INIZCTEOSA-N 391.269 2.783 0 50 GFAA COc1nc(N)nc(C/C(=N/Nc2ccc(Br)cc2)C2CC2)n1 22064712 JCFOGBCLUANKGT-UUYOSTAYSA-N 377.246 2.646 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)[C@H](C)C2=O)c1 55134147 SMTYMMYNYPNGGC-MRXNPFEDSA-N 389.455 2.710 0 50 GFAA COc1cc(C[C@@H](C)N2CCCn3nc(C(=O)N4CCCC4)cc3C2)ccc1O 65469784 SZFYILILUKAVRK-MRXNPFEDSA-N 398.507 2.670 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NC[C@@H]2CCCN2)Cc2ccccc2C1 72135240 CPLCJEGIBSCSLS-QFIPXVFZSA-N 377.532 2.567 0 50 GFAA Cc1ccc(S(=O)(=O)NCCNc2ccc(Nc3ccc(C)cn3)nn2)cc1 72139269 XGTIZCYCORIBIJ-UHFFFAOYSA-N 398.492 2.622 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)Cc3ccc(C)c(C)c3)C2)CC1 72143147 ILTPSIUVHKNSCX-FQEVSTJZSA-N 387.524 2.611 0 50 GFAA COC(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN(C(=O)OCc2ccccc2)C1 72194252 BOZPQGHPJKFXML-HOTGVXAUSA-N 392.452 2.711 0 50 GFAA CN(C)[C@H](C(=O)N1CCC(CCN2CCCC2=O)CC1)c1cccc(F)c1 95366127 BJBVEUJMKKXISW-FQEVSTJZSA-N 375.488 2.680 0 50 GFAA CCn1ccnc1C1CCN(C(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)CC1 95518425 NZIRAEYOOSWPOG-OAQYLSRUSA-N 396.535 2.900 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4ccccc4F)C3)CCC2=O)cn1 95531351 MRZZZODOHCGGST-QFIPXVFZSA-N 396.466 2.969 0 50 GFAA CCc1nnc(-c2ccc(OC)c(NC(=O)NCc3n[nH]c4c3CCC4)c2)o1 96133562 JWPWYEGHPOMWQG-UHFFFAOYSA-N 382.424 2.841 0 50 GFAA CCn1cc(CN(CCOC)C(=O)Nc2cc(-c3ccccc3)nn2C)cn1 96160166 RDRCRHBNDYJUMV-UHFFFAOYSA-N 382.468 2.984 0 50 GFAA CC[C@@H](O)CN1CCN(CC(=O)Nc2ccccc2Oc2ccccc2)CC1 118858522 WYDSILAZXVIVFH-GOSISDBHSA-N 383.492 2.806 0 50 GFAA CC(=O)N1CCC(N[C@H](C)c2cc3c(cc2Br)OCCO3)CC1 121488158 LGWHVXDSMWFJDE-LLVKDONJSA-N 383.286 2.882 0 50 GFAA CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@H](N3CCCC3)CC2)C1 127385364 RBGVSGVIZLAKOT-PMACEKPBSA-N 392.588 2.931 0 50 GFAA Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)c1ccc2c(c1)ncn2C 133135093 BODLCIDDBCZYAU-UHFFFAOYSA-N 378.432 2.606 0 50 GFAA Cc1ccnc(N2CCN(C(=O)c3nn(C(C)C)c(=O)c4ccccc34)CC2)c1 159069538 VXJBPRRYYVHFEH-UHFFFAOYSA-N 391.475 2.643 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ncccc2C(F)(F)F)C[C@H]1C(=O)O 169725697 QCHOOBAZXROOGS-NSHDSACASA-N 375.347 2.611 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccc(Cl)cc4)c2=O)CCCC3)no1 169763921 JKPOTGZWPPOVGU-UHFFFAOYSA-N 386.839 2.660 0 50 GFAA O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1ncc(Br)s1 170607906 XKJGMQJQIDFVHK-ZDUSSCGKSA-N 396.310 2.709 0 50 GFAA O=C(Nc1nc2c(s1)CCCC2)N1CCN(Cc2nccn2C(F)F)CC1 195219971 VLSJFANSYMXUML-UHFFFAOYSA-N 396.467 2.963 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)N[C@H](C)C(=O)Nc1ccccc1)CC2 208201851 SDEJGAYKTFEXHH-CQSZACIVSA-N 383.448 2.799 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)nc(C)n1 216822999 CIJMOAKYZSYRTC-XLIONFOSSA-N 376.504 2.797 0 50 GFAA COc1ccc(Nc2nc(N3CCO[C@@H](C)C3)cc(N3CCO[C@@H](C)C3)n2)cc1 241466018 NTYFMQFJNOWBIE-HOTGVXAUSA-N 399.495 2.679 0 50 GFAA CCn1cc(CC(=O)N[C@H]2CCN(C(=O)c3ccccn3)C2)c2ccccc21 242047958 VRNMLOGTVBHPLT-KRWDZBQOSA-N 376.460 2.630 0 50 GFAA CN(Cc1ccccc1)C[C@@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1 242324453 ZBLHEPLDAMITDE-SFHVURJKSA-N 375.513 2.882 0 50 GFAA CCCCOC[C@H](O)CN(C)C[C@@H](O)COc1ccccc1C(F)(F)F 252549313 RDTMYQSWXRHQEB-HUUCEWRRSA-N 379.419 2.555 0 50 GFAA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@H]2C=CC=NN2[C@H]3C(=O)C(C)(C)C)c(C)c1 253487326 IPZGPHQTJJWIDX-VSZNYVQBSA-N 379.460 2.633 0 50 GFAA Cc1c([C@H]2OCC[C@@H]2C(=O)N(C)CC(=O)Nc2cccc(Cl)c2)cnn1C 275402779 RJUWMMPRNYTNAL-YJBOKZPZSA-N 390.871 2.557 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@H](Cn3ccnn3)C2)ncn1 275707931 NYRQANWLMXJKPJ-QKLQHJQFSA-N 385.516 2.600 0 50 GFAA CN(C[C@H]1CCc2nccn2C1)S(=O)(=O)c1ccc(Br)s1 328644965 ZNRPEWJIBWZCHU-SNVBAGLBSA-N 390.328 2.590 0 50 GFAA COc1ccccc1CNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 363205195 OBFYLPHNGZYBJX-QGZVFWFLSA-N 392.459 2.740 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N1CC[C@]2(CCOC2)C1 408252545 SIZDUTNOSOOWSE-HNNXBMFYSA-N 390.299 2.567 0 50 GFAA C[C@H]1[C@@H](N)CCN1C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1 415198557 CLSBASNOTIYHTI-UGSOOPFHSA-N 389.477 2.836 0 50 GFAA COc1ccc(C2(C(=O)NCc3cnn4cccnc34)CCCC2)cc1OC 426477502 DLUGLYUQKSFIFG-UHFFFAOYSA-N 380.448 2.875 0 50 GFAA CCOc1ccc2c(C)c(C(=O)N3CCN4C(=O)OC[C@H]4C3)oc2c1OCC 426491375 GDZUVZZPUZASNU-CYBMUJFWSA-N 388.420 2.815 0 50 GFAA O=C(NCc1cccc(C(F)(F)F)c1F)[C@H]1CC(=O)N(Cc2ccncc2)C1 827696389 KSQCOIWDJIILNB-AWEZNQCLSA-N 395.356 2.904 0 50 GFAA O=C(/C=C/c1cc(CO)cs1)N1CCN([C@H]2CCc3ccccc3C2)CC1 828835558 DOHNOPCYQUTPGV-DUIUGDAFSA-N 382.529 2.955 0 50 GFAA CNC(=O)CCCCC(=O)N1CCOC[C@@H]1c1c(C)nn(-c2ccccc2)c1C 952887992 IXJOTJDURUFPKA-LJQANCHMSA-N 398.507 2.695 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H]2CC[C@H](N(C)C)C[C@H]2C1 1356153589 KNZSJCRBUNJOOO-LWYYNNOASA-N 387.524 2.533 0 50 GFAA Cn1nnc(-c2ccc(C(=O)N3CCC(Oc4ccccc4F)CC3)cc2)n1 1506405440 BQPJRHGTSUPJKS-UHFFFAOYSA-N 381.411 2.700 0 50 GFAA Cn1c([C@@H]2CCCN2C(=O)c2nc(N)nc3c2CCCC3)nc2ccccc21 1506410189 JRQCNCJODHCWIK-KRWDZBQOSA-N 376.464 2.802 0 50 GFAA CCc1[nH]nc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)c1C 1565513087 PJSPKHPIPQRJIM-APWZRJJASA-N 378.520 2.984 0 50 GFAA O=C(NC1(CO)CCCCC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704334261 HDTUYXHNPQAGOV-UHFFFAOYSA-N 385.464 2.603 0 50 GFAA FC(F)Oc1cc(Cn2c([C@@H]3CCCOC3)nnc2N2CCCC2)ccn1 1750371913 WHUOMEANFNBOCO-CQSZACIVSA-N 379.411 2.817 0 50 GFAA C[C@@H]1C(=O)N2CCC[C@H]2CN1S(=O)(=O)c1cccc2cccc(Cl)c12 1772708196 FMMWSAUBJIVNNM-OCCSQVGLSA-N 378.881 2.877 0 50 GFAA CS(=O)(=O)c1ccc(CN2CC[C@H]3[C@@H](C2)CN3CCc2ccccc2)cc1 1775976905 BSXOXADLQZGBDA-UNMCSNQZSA-N 384.545 2.839 0 50 GFAA Cc1cncc(C(=O)N2CCCN(Cc3coc4ccccc4c3=O)CC2)c1 1775982631 MOPJVCMTNPBFLY-UHFFFAOYSA-N 377.444 2.845 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)NCc3ccccc3C(F)(F)F)CC2=O)s1 1857677449 CEJMLBZEQSUJCI-NSHDSACASA-N 384.383 2.535 0 50 GFAA O=C(N[C@H]1CC[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)C1)c1cc(C2CC2)[nH]n1 1857694290 JOZDYOUVZPCAKN-CABCVRRESA-N 395.438 2.988 0 50 GFAA COc1ccnc(CN2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1OC 1857694834 JZOZEOQGWZVPJY-QFIPXVFZSA-N 396.491 2.952 0 50 GFAA Cn1ccnc1CCNC(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857725872 QOPIQRKBKSPYPX-CYBMUJFWSA-N 387.871 2.790 0 50 GFAA COc1cnc(C)cc1C(=O)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1857738029 OMHCUSNLDWUDRS-OXQOHEQNSA-N 377.444 2.622 0 50 GFAA COC12CCC(C(=O)N[C@H]3CCc4ncc(Br)n4C3)(CC1)CC2 1875272356 FFLAWOHDZJNHAV-CDEQTRAXSA-N 382.302 2.816 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1cccc(-c2cc[nH]n2)c1 1875401311 IJSSMHQJVZQSQA-NVXWUHKLSA-N 378.436 2.524 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccccc2F)o1 1875402548 JANRTGOBEKPIRG-BMGDILEWSA-N 399.422 2.764 0 50 GFAA C[C@H]1[C@@H](NC(=O)C23CCC(CC2)C3)CCN1C(=O)c1cc2ccccc2nn1 2325793482 WKWYLILVSHAPRI-WANZLAPOSA-N 378.476 2.929 0 50 GFAA Cc1ccc([C@@H](O)[C@@H](C)NC(=O)CCn2cc(Br)cn2)cc1F 2325800234 YZTUBTBCLWFHOU-BZNIZROVSA-N 384.249 2.722 0 50 GFAA CN(C)CCC1(C)CN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C1 2325802726 XYZVKSPJRZGJFB-SFHVURJKSA-N 379.495 2.944 0 50 GFAA Cc1cc(-c2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4C)n(CC(N)=O)n2)c(C)o1 2325872700 KCXVIVOKYUEFHO-UHFFFAOYSA-N 393.447 2.561 0 50 GFAA O=C(c1cccn2cnnc12)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356146390 DELAHHWBKSLLLR-JOCHJYFZSA-N 389.459 2.527 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)CCn3c(O)nc4ccccc43)C1)CC2 2356138686 FKIPMWDKHNSLJP-JOCHJYFZSA-N 391.475 2.737 0 50 GFAA CC(C)c1nc(O)ccc1-c1nc(CC(N)=O)nn1-c1ccc2c(c1)CCC2 2356167441 OTEOWEHGOIOGFA-UHFFFAOYSA-N 377.448 2.675 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCC(Cc2ccccc2)CC1)c1ccccc1 6672371 DKVXASUTGBYNQE-UHFFFAOYSA-N 386.517 2.934 0 50 GFAA Cc1ccccc1-c1nc(CNC(=O)Cc2csc(NC(=O)C(C)C)n2)no1 225491122 IKGAJHBSURWKQX-UHFFFAOYSA-N 399.476 2.955 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(C(=O)C2C(=O)CCCCC2=O)no1 225552271 UGSBYBFMIPYAAT-NSHDSACASA-N 391.424 2.653 0 50 GFAA COc1ccc([C@@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C)C(=S)N32)cc1O 22018298 KDBIECCTXGPLJB-DNVCBOLYSA-N 393.468 2.955 0 50 GFAA Nc1nnc([C@H](NC(=O)c2cccc(-n3cccn3)c2)c2ccccc2)s1 65488581 UMRGCGLGWYKZRK-MRXNPFEDSA-N 376.445 2.825 0 50 GFAA NC(=O)c1cc(-c2csc(NC(=O)c3cc(Br)c[nH]3)n2)c[nH]1 247755838 WGVGBBYEKMVHOI-UHFFFAOYSA-N 380.227 2.580 0 50 GFAA Cc1cc2occ(CC(=O)NC3CCN(C(=O)c4cnccn4)CC3)c2cc1C 135578251 ZVWINFLIUCRWEQ-UHFFFAOYSA-N 392.459 2.803 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3F)c2)c(N(C)C)n1 137204177 NRFBBDFWBJMWKQ-UHFFFAOYSA-N 375.429 2.582 0 50 GFAA O=C(CCc1nnc(-c2ccsc2)o1)NCc1ccc(-n2cncn2)cc1 20999297 AMYBBQBICVCRLH-UHFFFAOYSA-N 380.433 2.628 0 50 GFAA COc1ccc([C@@H](NC(=O)CCCN2CCCCCC2)C2CC(O)C2)cn1 219940403 NGJXNIABVLIJPJ-WIXQSORDSA-N 375.513 2.675 0 50 GFAA NC(=O)C1(NC(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)CCCC1 67975341 VMHGBCCATDZTQR-UHFFFAOYSA-N 397.353 2.800 0 50 GFAA CCN1CCC(NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)CC1 252484050 FMYWFMJEXGYGHO-UHFFFAOYSA-N 394.541 2.513 0 50 GFAA COc1cc(N2CC[C@@H](c3ccc(F)cc3)[C@@H](NC(=O)C(F)(F)F)C2)ncn1 252515609 MEHPVTAOIRMZBY-KBPBESRZSA-N 398.360 2.665 0 50 GFAA Cc1noc([C@@H]2COCCN2C(=O)[C@@H]2C[C@]23CCOc2ccc(Cl)cc23)n1 328607724 WUJRGGQQMZSTTE-DOXZYTNZSA-N 389.839 2.672 0 50 GFAA O=Cc1ccc(OCC(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1 123399963 RUQURBNUWJXNAL-KRWDZBQOSA-N 382.464 2.602 0 50 GFAA O=C(NCc1nnc(C2CC2)n1C1CC1)[C@@H]1CCCCN1C(=O)c1ccccc1 363835970 OQSPQFIEMYDZGR-SFHVURJKSA-N 393.491 2.802 0 50 GFAA COc1ccc(CN2CCN(c3ncnc4[nH]ccc34)C[C@@H]2CCO)c(C)c1C 72424189 PMBDOTLUMQPOBU-SFHVURJKSA-N 395.507 2.657 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1O)N1CCC[C@H](CCc2ccc(F)cc2)C1 71763283 WHNKHYLXEQKTOK-MRXNPFEDSA-N 395.438 2.992 0 50 GFAA CC(C)[C@@H](NC1CCOCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1 157339676 MKHLAIUUCFBGOZ-OAQYLSRUSA-N 391.531 2.700 0 50 GFAA c1ccc2nc(N3CCOCC3)c(NCc3ccnc(-n4ccnc4)c3)nc2c1 378039567 LAMHJRINYJMRPJ-UHFFFAOYSA-N 387.447 2.659 0 50 GFAA Cc1nc(N2CCN(C(=O)c3cccs3)CC2)cc(-n2cnc(C)c2C)n1 82230651 ISPCGPGQUNCOSS-UHFFFAOYSA-N 382.493 2.611 0 50 GFAA O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1c[nH]nc1-c1cccs1 426495613 MRUAIYMMPJETKC-UHFFFAOYSA-N 391.456 2.792 0 50 GFAA O=S(=O)(NCC1CC1)c1ccc(N2CCC(OCC3CCCC3)CC2)nc1 176779164 RKPXJJHMMVTUJM-UHFFFAOYSA-N 393.553 2.946 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NC(=O)C(=O)NC(C)C)cc1 91713057 IOAYCMAOYPVNLX-KRWDZBQOSA-N 384.480 2.535 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1CCC[C@@H](OCc2ccccn2)C1 95358324 PJQCJSYUSDMAFO-LJQANCHMSA-N 375.432 2.755 0 50 GFAA C=Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)CC)cc1 95522573 ISZGBFIWKYOIDE-UHFFFAOYSA-N 378.476 2.979 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC(c2nccn2Cc2ccccn2)CC1 95511240 AOLHLFRCDXEIGM-UHFFFAOYSA-N 387.447 2.618 0 50 GFAA Cn1nc(-c2ccccc2)cc1NC(=O)N[C@H]1CCCN(c2cnccn2)C1 95529649 HSVMQZOOCRYIIM-INIZCTEOSA-N 377.452 2.668 0 50 GFAA CCc1cc(C(=O)N2CCc3[nH]c(-c4cccc(OC)c4)nc3C2)cc(=O)[nH]1 96137398 CNXDNUMBPAGNLO-UHFFFAOYSA-N 378.432 2.535 0 50 GFAA Cn1cnc2ccc(NC(=O)N3CCN(CCOc4ccccc4)CC3)cc21 97642554 GSXLZNRTINMTSF-UHFFFAOYSA-N 379.464 2.802 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CC2 95352115 NJQDBHOKQOOYQD-LEWJYISDSA-N 397.563 2.973 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccccc2F)C1)N1CCN(c2ccncc2)CC1 643441457 CMBXRAZCSWTQRO-KRWDZBQOSA-N 383.471 2.579 0 50 GFAA O=C(N[C@@H]1CC2(CCCCC2)Oc2ccccc21)N1CCS(=O)(=O)CC1 584891755 IOEOFZVBARMQRQ-MRXNPFEDSA-N 378.494 2.653 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)NCc2ccc3c(c2)CCCO3)C1 584899088 XVOXHXVBZWDQFG-QGZVFWFLSA-N 382.464 2.550 0 50 GFAA O=C(NS(=O)(=O)C[C@@H]1CCCCO1)c1csc(Cc2ccc(F)cc2)n1 170620488 NGMOKHAFRRMIBA-AWEZNQCLSA-N 398.481 2.502 0 50 GFAA O=C(c1cncc(NC[C@H](c2cccnc2)N2CCCCC2)n1)N1CCCC1 1704337929 IJKUTMWGHHTDCZ-LJQANCHMSA-N 380.496 2.747 0 50 GFAA Cc1noc(CN2C[C@@H]3CN(Cc4cc[nH]n4)C[C@@]3(CCc3ccccc3)C2)n1 1772813997 DRMBNYRLKVYTEO-UGKGYDQZSA-N 392.507 2.668 0 50 GFAA CCOc1ccc(OCc2nc(-c3cn(C)nc3C)n(-c3ccnn3C)n2)cc1 1772810504 KLWSMVTWDNKIGM-UHFFFAOYSA-N 393.451 2.687 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)Cn4cccn4)C3)C2)c1 11999210 RPJNMHHBAQGUHZ-NRFANRHFSA-N 386.471 2.546 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]1(O)CNCc1ccc(F)cc1 12458951 FWSXONFXNUJWCE-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA Cc1nn(C)cc1CN(C)Cc1ccccc1OC[C@H](O)CN1CCCCC1 12745639 SXCACJOFOVOVNS-OAQYLSRUSA-N 386.540 2.586 0 50 GFAA O=C1N[C@@H](CC2CCCCC2)C(=O)N2CCN(Cc3ccc(Cl)cc3)C[C@H]12 14733533 CZYCWBQTTULCGN-RBUKOAKNSA-N 389.927 2.822 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cc5ccccc5[nH]4)nnc3c2)n1 169776171 SPQWPGCKINNYHH-UHFFFAOYSA-N 387.403 2.753 0 50 GFAA COC(=O)C[C@H](c1ccc(F)c(F)c1F)c1c(O)n2ccccc2nc1=O 205968322 BJCAWBHSHZSICA-SNVBAGLBSA-N 378.306 2.512 0 50 GFAA Cc1cccc(N2CCC(N[C@@H]3CN4CCCC[C@]4(C(=O)NC4CC4)C3)CC2)c1 1857685613 ZVPVOZKRUNYAJU-XUZZJYLKSA-N 396.579 2.829 0 50 GFAA O=C(NCCN1CCc2ccccc21)c1cc2c(s1)C1(CCNCC1)OCC2 1857702471 CGVMGFMGXSXFJU-UHFFFAOYSA-N 397.544 2.692 0 50 GFAA COc1ccc(-n2ccnc2-c2nccn2C[C@H]2CC(=O)N(C3CC3)C2)cc1 1857732437 QOXFCJFDQJLBKN-OAHLLOKOSA-N 377.448 2.755 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1cn([C@@H]2CCOC2)nn1 330047357 HPJZSQOSIXMMCF-QGZVFWFLSA-N 383.452 2.508 0 50 GFAA CNC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc3ccncc23)c1 1875359334 ASMNDHJSWSWSDZ-CYBMUJFWSA-N 377.400 2.778 0 50 GFAA O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCOC2(CCOCC2)C1 135596805 CGPQPFIQIJHLFL-CQSZACIVSA-N 376.280 2.615 0 50 GFAA FC(F)(F)[C@@]1(c2nc(-c3n[nH]c(C4CC4)n3)no2)CCN(c2ccccn2)C1 952893540 JDFNATRUADOLNB-INIZCTEOSA-N 391.357 2.838 0 50 GFAA c1cc2c(-c3noc([C@H]4CCc5nnn(C6CCOCC6)c5C4)n3)cc[nH]c-2n1 952893355 ISENHTRPNXOKHT-LBPRGKRZSA-N 391.435 2.780 0 50 GFAA O=C(c1ccccc1)N1CC[C@H](Cn2c(Cc3ccc(F)cc3)noc2=O)C1 1875315850 KBKXDZYQZNGSET-INIZCTEOSA-N 381.407 2.729 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)C(C)(C)c3ccc(F)cc3)CC1)O2 1875394667 RBTDEYGRGIIKJN-MRXNPFEDSA-N 387.455 2.714 0 50 GFAA Cc1cc(C)nc(N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)n1 704673 OQHHDYQKFCOFJI-UHFFFAOYSA-N 386.463 2.549 0 50 GFAA Oc1cc(N2CCC(c3cc(C4CCNCC4)[nH]n3)CC2)c2ncccc2n1 2325799599 KWDIVGYCXACIHI-UHFFFAOYSA-N 378.480 2.910 0 50 GFAA CC1(CCC(=O)N2CC3(C[C@H](NC(=O)Cc4ccccc4)c4nccn43)C2)CC1 2332237879 PSBGAQCMDUZTDY-SFHVURJKSA-N 392.503 2.805 0 50 GFAA CC(=O)Oc1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)cc1 635281 KJFKDKDBXYVKOY-INIZCTEOSA-N 385.397 2.734 0 50 GFAA O=C(CCc1ccccc1)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 888901 YIBFYULWIBTHKJ-UHFFFAOYSA-N 382.445 2.849 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)cc1 1050177 OTOVPVWUAPUWOK-UHFFFAOYSA-N 375.446 2.502 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2CCN(c3ccccc3F)CC2)cc1C 1116753 KIDNQGOLLQXCLE-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA COc1ccccc1NC(=O)CN(c1cc(Cl)ccc1OC)S(C)(=O)=O 1142846 UDSVCGONNUZVOG-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc1 2356141619 JGCQLKMYRGFXTC-QFIPXVFZSA-N 379.508 2.729 0 50 GFAA Cc1n[nH]c(C)c1Cc1nnc2n1[C@@H](C)C(=O)N(Cc1ccccc1Cl)C2 2356155192 BDIBEHPRVPYAAS-ZDUSSCGKSA-N 384.871 2.966 0 50 GFAA COc1ccc(-c2onc(N3CCC[C@@H](C(=O)N4CCCC4)C3)c2C(=O)O)cc1 2356159697 NDVCENSIIHAWJD-OAHLLOKOSA-N 399.447 2.887 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CC[C@]4(CN(C)C(=O)O4)C3)ncnc21 2356168766 MRSCPPFZGWQCGN-FQEVSTJZSA-N 386.500 2.856 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2C(F)(F)F)cc1 2853867 QCEAFTAAEFECGP-UHFFFAOYSA-N 389.424 2.839 0 50 GFAA COc1cc(CNc2nn[nH]n2)cc(Br)c1OCc1cccnc1 4943020 ANYSXBWWQBBRHO-UHFFFAOYSA-N 391.229 2.557 0 50 GFAA CC[C@@H](C)NC(=O)c1ccccc1NC(=O)c1ccccc1NS(C)(=O)=O 6267342 BDKDPMZRSIRTCL-CYBMUJFWSA-N 389.477 2.839 0 50 GFAA CC(C)CN1CCO[C@H](CNC(=O)N[C@H]2CCCOc3c(F)cccc32)C1 245526148 OUZSFSQCJJWNQX-QAPCUYQASA-N 379.476 2.695 0 50 GFAA COC(=O)c1c(NC(=O)CN2CCN(C)CC2)sc(C)c1-c1ccccc1 20661402 RRCLDUBIRJQSME-UHFFFAOYSA-N 387.505 2.696 0 50 GFAA O=C(c1ccc([C@H]2CCCN2C(=O)CCn2cccc2)s1)N1CCOCC1 20855457 PYMRJQJXFQISMS-MRXNPFEDSA-N 387.505 2.776 0 50 GFAA CCOC(=O)N1CCN(Cc2nc(Cc3cccc(C(F)(F)F)c3)no2)CC1 20453522 HOPHVLWZAHVYEO-UHFFFAOYSA-N 398.385 2.953 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1ccc2[nH]cnc2c1 67868039 XRHAHPQNXVSPHR-UHFFFAOYSA-N 386.459 2.962 0 50 GFAA COc1ccccc1-n1c(=O)n(Cc2ccc(F)cc2)c(=O)c2cccnc21 12371811 UFXZEZSRTUUWCH-UHFFFAOYSA-N 377.375 2.743 0 50 GFAA COc1ccccc1[C@H]1CCCN1C(=O)NC[C@H](C(C)C)N1CCN(C)CC1 170838728 VPAFFAOJOMWKDO-WOJBJXKFSA-N 388.556 2.814 0 50 GFAA COc1ccc2cc([C@H]3CN(C(=O)c4cccc(CO)n4)CCO3)ccc2c1 71759587 VLGVYTYEUIHGLQ-OAQYLSRUSA-N 378.428 2.949 0 50 GFAA Cc1cc(C)cc(-n2c(-c3ccco3)cn3c4c(=O)n(C)c(=O)n(C)c4nc23)c1 12445760 LYYBSNJUMUHVQM-UHFFFAOYSA-N 389.415 2.552 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)Cc3ccc(C)c(C)c3)C2)CC1 72143145 ILTPSIUVHKNSCX-HXUWFJFHSA-N 387.524 2.611 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)c(C)c1 72139230 MYWABSULPOBSAP-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cc2c(s1)CCOC2 155058168 WLHQWOJBQAZNKW-QGZVFWFLSA-N 384.501 2.784 0 50 GFAA Cn1c(-c2ccc(CN3CCc4nc[nH]c4[C@@H]3C(=O)O)o2)nc2ccccc21 72458304 UHTCBAGHIKXXCE-GOSISDBHSA-N 377.404 2.740 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N2CCc3ncsc3C2)cc1C(F)(F)F 445558294 PIWGGBDDQKSCAB-UHFFFAOYSA-N 392.380 2.607 0 50 GFAA CCc1nc(N2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)ncc1C 72409944 ACIBNJJDLNFCLY-MRXNPFEDSA-N 376.451 2.699 0 50 GFAA O=C([C@H](O)c1ccccc1Cl)N1CCN(c2ccccc2Cl)C(=O)C1 82116186 XRYFCMHLEPSHIH-QGZVFWFLSA-N 379.243 2.902 0 50 GFAA Cc1ccc(-c2csc(NC(=O)CSCC(=O)O)c2C(N)=O)cc1C 17077410 UXBSUUBEPBIWJB-UHFFFAOYSA-N 378.475 2.887 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(c4ncccc4C(N)=O)C3)C2=O)c1 20600218 GGTCVPAEKFXNRB-JOCHJYFZSA-N 378.476 2.508 0 50 GFAA CN(C)C[C@@H]1CN(C(=O)c2cccc(OCc3cccc(F)c3)c2)C[C@@H]1CO 91934826 ZYMKMXHTNMOGQI-RTBURBONSA-N 386.467 2.647 0 50 GFAA Cn1c(CCNC(=O)N2CCC[C@H](OCc3ccccn3)C2)nc2ccccc21 426519263 OKHAMVGGPCZODL-SFHVURJKSA-N 393.491 2.902 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@@H](c3ccc(C(=O)O)cc3)C2)c(=O)n1C 95380228 LKOSNCVIIKEFFI-QGZVFWFLSA-N 382.460 2.974 0 50 GFAA COCC(=O)N1CCCN(C(=O)Nc2cccc(Cc3ccccc3)c2)CC1 95499138 ZONJEMKPYMZIPQ-UHFFFAOYSA-N 381.476 2.990 0 50 GFAA CSc1ccc(NC(=O)N2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)cc1 91951784 GYMVQSUCACXSOQ-LJQANCHMSA-N 376.526 2.569 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)c2cnc(COc3ccccc3)[nH]c2=O)no1 91468945 IEVUKEYVRPBHCQ-KRWDZBQOSA-N 380.404 2.623 0 50 GFAA O=C(c1ccc(-n2cccn2)cc1)N1CCC2(CC1)Nc1ccccc1NC2=O 91625908 INBBPINWKMAMNQ-UHFFFAOYSA-N 387.443 2.911 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)N(C)Cc1cnc3ccccc3n1)CC(=O)N2 91621318 AGTVKUQBEMYWBP-MRXNPFEDSA-N 376.416 2.723 0 50 GFAA CCOC(=O)Cc1ccc(NC(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)cc1 95507918 QGRKTYFZBQLVJM-QGZVFWFLSA-N 387.480 2.659 0 50 GFAA O=C(N[C@@H]1CCNC[C@H]1O)c1cccc(-c2cc(F)ccc2C(F)(F)F)c1 584884207 LOXGPNWHQAFWHJ-IAGOWNOFSA-N 382.357 2.964 0 50 GFAA Cn1c(CO)nnc1C1CCN(C(=O)NC2(c3ccc(Cl)cc3)CC2)CC1 584888480 ORKOAPQVURDKSB-UHFFFAOYSA-N 389.887 2.539 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H]1CN(Cc1cccnc1)C3)OCO2 1565515787 KBBVNSMCJVBQIW-MJGOQNOKSA-N 381.476 2.915 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2cccc(Cl)c2Cl)C1 275805055 VAGLMDCNOCLSCY-NSHDSACASA-N 380.279 2.712 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N[C@@H](C)CCn2cccn2)n[nH]1 11663893 PZTOBUGCOFIGMQ-AWEZNQCLSA-N 377.452 2.521 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)[C@H]1CCC(=O)N(CCc2ccccn2)C1 12429887 ZOZDMNBIJMZFTJ-HNNXBMFYSA-N 398.532 2.514 0 50 GFAA CSc1cccc(CNC(=O)[C@@H]2CCC(=O)N(CCc3ccccn3)C2)c1 12448959 UGWYILKQROOGCF-QGZVFWFLSA-N 383.517 2.901 0 50 GFAA CCc1ncc(CN[C@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)cn1 12718577 REIOUHGJYQWMGJ-SFHVURJKSA-N 396.539 2.593 0 50 GFAA COc1cccc(C[C@@]2(CCC(=O)N[C@@H](C)Cc3cccnc3)CCC(=O)N2)c1 14885857 HPAUDVKXUTZQFE-GAJHUEQPSA-N 395.503 2.809 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)c2ccsc2)CC1 15068534 QSPGBWUCQXVOTL-GOSISDBHSA-N 377.554 2.981 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@@H](NCc1ccncc1)C2 19227514 UHJVNXBITAOPIO-GOSISDBHSA-N 393.491 2.810 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@H](c2ccccn2)C1 1857728058 LHYBABIYJBRYCM-HNNXBMFYSA-N 381.461 2.771 0 50 GFAA CC(C)NC(=O)N1C[C@@H]2[C@H](CNC(=O)CC3CCCCC3)[C@H]3CC[C@]2(C1)O3 1857734417 SAHYHTIQNNAVTA-XKGFGPFHSA-N 377.529 2.670 0 50 GFAA COc1ccc(CCN2C(=O)O[C@H]3CN(C(=O)NCc4ccccc4)C[C@H]32)cc1 208474884 MSYWUKOEOWKGOJ-UXHICEINSA-N 395.459 2.653 0 50 GFAA CC(=O)OC[C@@H]1O[C@@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@H]12 222223291 AVMIIKLVEDAPFQ-YYWYGQEZSA-N 382.453 2.795 0 50 GFAA biogenic CC[C@@]1(C2CCN(Cc3ccoc3)CC2)NC(=O)N(Cc2ccccn2)C1=O 11996055 GTYUUWWECOIHIL-NRFANRHFSA-N 382.464 2.787 0 50 GFAA COc1ccc(F)c(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2cscn2)c1 247892218 NEAVYGDGMQERJF-CJNGLKHVSA-N 375.469 2.914 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)[C@H](O)C[C@@]12O 139365304 PVAMXWLZJKTXFW-QNIOEUEBSA-N 390.520 2.575 0 50 GFAA biogenic COCc1c(C(=O)N2CCC3(CC2)CNC(=O)C3)sc2cccc(F)c12 377895331 GAPLAVBIRLACIY-UHFFFAOYSA-N 376.453 2.929 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CC[C@@]2(CO)CCCN(C)[C@@H]2C1 1704338161 NVRJDUUTTKHZBG-YLJYHZDGSA-N 393.915 2.607 0 50 GFAA O=C(NCc1cc(Br)cnc1O)N1CCOc2ccccc2C1 1875295565 JVDCAFRXAWLYND-UHFFFAOYSA-N 378.226 2.654 0 50 GFAA CC(=O)N1CCC(NC2CCN(C(=O)c3cccc(Cl)c3F)CC2)CC1 1875361091 PMXVLOOOXYVSAX-UHFFFAOYSA-N 381.879 2.684 0 50 GFAA COc1ccccc1-c1ccnc(N2CC[C@H](C3CC3)[C@@H]2c2nc(O)n[nH]2)n1 1875399568 CYWSQWOJTVDUEZ-CXAGYDPISA-N 378.436 2.954 0 50 GFAA O=C(N=[S@@]1(=O)CCC[C@]2(CCCN2)C1)c1cccc(CN2CCCC2)c1 1875393412 MYCSMQKRURUFAG-FQRUVTKNSA-N 375.538 2.807 0 50 GFAA CC1(C)C[C@H](S(C)(=O)=O)CN1C(=O)NCc1ccc(-c2ccsc2)nc1 1875405726 NDKCFQIJJAOTSI-HNNXBMFYSA-N 393.534 2.917 0 50 GFAA Cc1nc2c(NC(=O)CNC(=O)c3cc(Cl)ccc3Cl)cccn2n1 2100540800 QFASENQZTVYQTF-UHFFFAOYSA-N 378.219 2.713 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)[C@H]2CCN(C(=O)c3c(C4CC4)cnn3C)C2)nc1C 2325793273 NPDHOJBUPDBBSC-WBVHZDCISA-N 395.507 2.590 0 50 GFAA Cc1ccccc1C(C)(C)C(=O)N(C)C[C@@H](C)NC(=O)[C@H](C(C)C)N(C)C 2325794339 YWLQXBDTSCXESM-MJGOQNOKSA-N 375.557 2.822 0 50 GFAA Nc1cc(N)nc(SCC(=O)Nc2ccc(Br)cc2Cl)n1 1129307 SMENVBJRVLYOIH-UHFFFAOYSA-N 388.678 2.788 0 50 GFAA Cc1nnc(N2C(=O)c3ccc(C(=O)c4ccc(C(=O)O)cc4)cc3C2=O)s1 1176544 STVSPBQEXRXPKX-UHFFFAOYSA-N 393.380 2.576 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCCc3nc4ccccc4o3)cn12 2356165616 LGDSJJKTWWUIFA-SFHVURJKSA-N 379.420 2.532 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)cc1 2356170029 RHUXUJWJRNQYDW-HSZRJFAPSA-N 392.503 2.945 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)NCCNC(=O)[C@@H](CC)Oc1ccccc1 4646639 SVZQXGIJKCQXMN-WOJBJXKFSA-N 384.476 2.934 0 50 GFAA O=S1(=O)N=C(Nc2ccc(N3CCOCC3)c(Cl)c2)c2ccccc21 4739924 SSFYSXUBOLEKJB-UHFFFAOYSA-N 377.853 2.738 0 50 GFAA CCCCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCOC)cc1OC 4845076 GMHNEDGHGVBEHM-GOSISDBHSA-N 392.452 2.692 0 50 GFAA C[C@@H](c1ncnc(Cl)c1F)[C@](O)(Cn1cncn1)c1ccc(F)cc1F 21298440 BQDLXFABVRRDFU-XXFAHNHDSA-N 383.761 2.830 0 50 GFAA in-vitro Cc1ccc(CNC[C@@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)s1 55109177 WWBPXRHHBQEQDK-IBGZPJMESA-N 380.460 2.978 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1cccc(C(F)(F)F)c1 100971669 YGMQTFAWIBFVRZ-KUDNYVPYSA-N 378.350 2.841 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)c2cc(C)c(C)n(C)c2=O)cn1 67740350 GUDANQKUVDTQLI-UHFFFAOYSA-N 378.432 2.823 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCCCc2ccncc2)C1 77340569 XSLVNIUWOPWRIM-UHFFFAOYSA-N 388.475 2.883 0 50 GFAA CCc1ccc([C@@H]2CNCCN2C(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1 261627472 DNELHWPYPBWRNC-FQEVSTJZSA-N 380.492 2.600 0 50 GFAA CN(CCCN1c2ccccc2CCc2ccccc21)C(=O)[C@@H]1CNCCO1 72157811 UVPAFBKVFKJABH-QFIPXVFZSA-N 379.504 2.760 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)cc1 72442229 SGOJVDNZDRRWKT-UHFFFAOYSA-N 390.491 2.804 0 50 GFAA C[C@H](c1ccc(F)cc1)N1CC[C@@H](N2CCC3(CCC3)S(=O)(=O)CC2)C1=O 334050561 ROIUMRRMSLCKSL-CRAIPNDOSA-N 394.512 2.531 0 50 GFAA C[C@H]1NCCC[C@H]1C(=O)N1CCCN(c2ccc(-c3ccccc3)nn2)CC1 377524585 NWRRFFHZWKWFGQ-IEBWSBKVSA-N 379.508 2.570 0 50 GFAA Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N[C@]3(C(=O)O)CCSC3)c12 263013820 XDBLSOVQSRXIOT-HXUWFJFHSA-N 396.472 2.634 0 50 GFAA C[C@@](O)(CCc1ccccc1)C(=O)N1CCn2c(nnc2-c2ccccc2)C1 283193511 MBJSIYUKZGEKSU-JOCHJYFZSA-N 376.460 2.671 0 50 GFAA O=C(NCc1ccccc1N1CCOCC1)N1CCOC[C@H]1c1ccc(F)cc1 458100020 UTQINDVJPBCOCY-NRFANRHFSA-N 399.466 2.945 0 50 GFAA Cc1nc(C[C@H]2CCCN(C(=O)C(C)(C)NC(=O)Nc3ccccc3)C2)no1 174607060 OAULMCARYVIJQT-OAHLLOKOSA-N 385.468 2.759 0 50 GFAA O=C([C@@H](O)c1ccc(C(F)(F)F)cc1)N1CCN(c2ccccc2)C(=O)C1 82156395 PIVPBKVWCWTHDB-KRWDZBQOSA-N 378.350 2.614 0 50 GFAA COCCN1CCC(CN(Cc2ccncc2)C(=O)c2scnc2C)CC1 95526234 SRTUJKDVUXIQCR-UHFFFAOYSA-N 388.537 2.847 0 50 GFAA CCS[C@@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91563089 NLUNEWQTLVUIED-INIZCTEOSA-N 375.538 2.954 0 50 GFAA CCC[C@@H](NC(=O)c1cnc(COc2ccccc2)nc1O)c1nccn1C 91493547 BIPKTLVWALUNKY-MRXNPFEDSA-N 381.436 2.766 0 50 GFAA O=S(=O)(N1CCCC1)N1CCc2c([nH]c3ccccc23)[C@H]1c1ccccn1 95505594 YCKVHOMFZUJILB-HXUWFJFHSA-N 382.489 2.851 0 50 GFAA CC(C)c1noc(CN(C)C(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)n1 91725816 CZUKVPJZTLCXAP-MRXNPFEDSA-N 376.501 2.970 0 50 GFAA NC(=O)c1ccc([C@@H]2CCCN2C(=O)COc2ncnc3ccccc23)s1 23251526 NPPSVWSMMTUGLW-AWEZNQCLSA-N 382.445 2.533 0 50 GFAA Cc1nc2c(c(N(C)CCCCN3CCOCC3)n1)Cc1ccccc1OC2 95522600 CULQLNHSAOLVNE-UHFFFAOYSA-N 382.508 2.817 0 50 GFAA COc1cncc([C@@H](NC(=O)c2ccc(-c3cc[nH]n3)cc2)[C@H]2C[C@@H](O)C2)c1 244884448 YMTRTBNDCZYUPG-VPWXQRGCSA-N 378.432 2.722 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCCc1ccco1 252536456 IQFUTLKGTSXXRB-UHFFFAOYSA-N 382.395 2.920 0 50 GFAA COc1ccc(Cn2ccn3nc(-c4cccc(F)c4)c(CO)c3c2=O)cc1F 263618247 RYFJDYPRWPBNGR-UHFFFAOYSA-N 397.381 2.990 0 50 GFAA CSCc1noc(CNC(=O)Nc2ccc(N3C(=O)CC[C@H]3C)cc2)n1 299791887 DKTMDARCXXBNAX-LLVKDONJSA-N 375.454 2.770 0 50 GFAA O=C(NCCS(=O)(=O)c1ccc(F)cc1)Nc1ccnn1C1CCCC1 299768853 MRIGKFCNEGZYPZ-UHFFFAOYSA-N 380.445 2.733 0 50 GFAA COc1ccc(-c2nc(-c3ccc4c(c3)n(C)c(=O)n4C)n(O)c2C)cc1OC 824736802 YWQPGQHFSIRZSX-UHFFFAOYSA-N 394.431 2.970 0 50 GFAA COc1cccc([C@H](C)NC(=O)N2CCN(Cc3ccccc3CO)CC2)c1 670441121 JDKUBTQUQSWJFE-KRWDZBQOSA-N 383.492 2.776 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2C(=O)C2CCN(C(=O)c3ccccn3)CC2)n1 952985983 CIENKPSHQXEVQH-KRWDZBQOSA-N 397.479 2.804 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1C[C@@H]2CN(CC3CCC3)C[C@]2(C(=O)O)C1 1565516474 YXEUIIAGKWIZNP-DJJJIMSYSA-N 380.847 2.738 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)CC2CCC(C(F)(F)F)CC2)C1 275734161 PPVDXMFRSAACFX-YMAMQOFZSA-N 399.461 2.850 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2cccc(OC3CCCC3)c2)C1 276631910 XDTWGMIJOZCQCO-QGZVFWFLSA-N 395.507 2.727 0 50 GFAA Cn1cc([C@H]2C[S@@](=O)CCN2C(=O)c2ccc(CCC(F)(F)F)cc2)cn1 277839980 ZWWUHNXIHAFUHR-JWIGPWBQSA-N 399.438 2.861 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)NC[C@@H](c1cccnc1)N1CCCCC1 1506428186 YEVLXFWBQRRTOA-NRFANRHFSA-N 381.524 2.960 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@@]3(C2)C(=O)Nc2ccccc23)nc(O)n1 1506424250 KATQMROLKDUAII-NRFANRHFSA-N 380.448 2.507 0 50 GFAA CO[C@H]1CN(C(=O)c2ccc3nc(C)c(C)nc3c2)C[C@H]1Cc1cc(C)no1 1529187577 VFEKUQKUFLMTJL-UZLBHIALSA-N 380.448 2.873 0 50 GFAA COc1cccc(OCCN2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 1704343845 FXYUOAZLZBZZSF-JOCHJYFZSA-N 382.508 2.910 0 50 GFAA CNC(=O)CCC(C)(C)NC(=O)[C@H]1CCc2sc(-c3ccncc3)nc2C1 1772815182 YKFLQNGFUWDRNW-AWEZNQCLSA-N 386.521 2.731 0 50 GFAA CCc1ccc(CN2C[C@@H]3CN(Cc4ccc(C(=O)O)o4)C[C@]3(CO)C2)s1 1772805739 RLVXDZZBQRXJNK-VBKZILBWSA-N 390.505 2.528 0 50 GFAA CC(=O)Nc1cccc(NC(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)c1 5399327 JZEJZHHXGWKQQW-UHFFFAOYSA-N 380.379 2.647 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@@]1(O)CNCc1ccc(F)cc1 12458950 FWSXONFXNUJWCE-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCC(O)(c2ccccc2)CC1 12467711 GDEBPKZJEHOMAG-UHFFFAOYSA-N 376.460 2.645 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)Cc2cccs2)C1 12744391 VZCGWAGBRCJFHP-MRXNPFEDSA-N 386.521 2.747 0 50 GFAA Cc1ccc(OCc2cc(C(=O)N[C@@H](Cn3ccnc3)C(C)(C)C)no2)cn1 15063285 JERXULGJMKXAIG-SFHVURJKSA-N 383.452 2.998 0 50 GFAA Cc1nnc(SCC(=O)N2CCC[C@H]2c2ccc(C(=O)NC3CC3)s2)o1 19147628 KCJMZJZBZGVGSX-LBPRGKRZSA-N 392.506 2.788 0 50 GFAA COc1ccc(NC(=O)Cn2ccn3nc4c(c3c2=O)CCCC4)cc1Cl 169760042 HXNFGQUSOOZWGW-UHFFFAOYSA-N 386.839 2.676 0 50 GFAA Cc1ccc(-n2c(C3CCN(C(=O)Cc4cccc(F)c4)CC3)n[nH]c2=O)cc1 169779852 VSMBXKIXODENTQ-UHFFFAOYSA-N 394.450 2.957 0 50 GFAA Cc1cccc(CN[C@H]2CCc3c(sc4ncn(CCCO)c(=O)c34)C2)c1 200537353 ALFDSSKZNHKQKN-INIZCTEOSA-N 383.517 2.796 0 50 GFAA COc1cc(F)c(NC(=O)c2ccc(=O)n(-c3ccccc3F)n2)cc1OC 153105179 MHXOXJCQICOAHV-UHFFFAOYSA-N 387.342 2.780 0 50 GFAA CCOc1ccc(/C=c2/sc3nc(-c4ccccc4)nn3c2=O)cc1OC 2533825 GWAQZLIIFNAFIH-SFQUDFHCSA-N 379.441 2.773 0 50 GFAA CN(C)[C@H](C(=O)N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1cccnc1)C2)c1ccc(F)cc1 1857686613 DRIAMXZENADSKT-PSBKLILYSA-N 396.510 2.850 0 50 GFAA O=C(N[C@@H]1CC[C@H](NC(=O)c2c[nH]nc2-c2cccc(F)c2)C1)c1ccccn1 1857708138 HKPFPJCJTCHIKF-JKSUJKDBSA-N 393.422 2.692 0 50 GFAA CN(CC(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)C1CCCC1 1857728033 KLCAMWSXVLYSIQ-YZGWKJHDSA-N 391.943 2.845 0 50 GFAA Cc1nc(N2CCC3(CC2)CN(CCC2CCCCC2)C(=O)CCO3)no1 1857736558 MRFFVECTZVPGMH-UHFFFAOYSA-N 376.501 2.936 0 50 GFAA C[C@@H]1C[C@@H](O)CN1C(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 408295633 VSFQCOJZEOQZDC-BXUZGUMPSA-N 390.281 2.719 0 50 GFAA CCn1nccc1NC(=O)N1CCCCC[C@H]1c1noc(-c2cnn(C)c2)n1 329513450 NVKBGCPDXWJYSI-AWEZNQCLSA-N 384.444 2.836 0 50 GFAA CC[C@@H](NC(=O)c1nnn(C2CCNCC2)c1C)c1ccccc1OC(F)F 151553556 LGQKVUVNYWWQKL-OAHLLOKOSA-N 393.438 2.994 0 50 GFAA CCCC[C@@H](NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)C1CCC1 152787127 HQIURCXBPJOADN-LJQANCHMSA-N 394.537 2.796 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCO[C@H](C2CCN(C(=O)C[C@H]3CCCO3)CC2)C1 839830156 IWZJIQSYXBDOAU-KURKYZTESA-N 396.528 2.866 0 50 GFAA CCCC1(O)CCN(C(=O)c2cc(S(=O)(=O)N(CC)CC)ccc2C)CC1 952845888 GPIQVLAXGAKDON-UHFFFAOYSA-N 396.553 2.793 0 50 GFAA C=CC(=O)NC[C@@H](NC(=O)[C@@H]1CCCN(C(C)=O)C1)c1ccc2ccccc2c1 1875386348 NXNASBDSDIGUFA-NHCUHLMSSA-N 393.487 2.558 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cc(C)ccn1 1875313442 QPXQWIYLXFVYSC-GFCCVEGCSA-N 398.868 2.576 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cc(C2CC2)[nH]n1 1875403359 UNENDYFNWHFQTR-BOUXLOLZSA-N 391.475 2.720 0 50 GFAA N[C@@H]1CCc2cc(C(=O)N3CCC(F)(F)[C@H](C(F)(F)F)C3)ccc2NC1=O 2325774964 LOCBDMKQNCEPCE-DGCLKSJQSA-N 391.340 2.558 0 50 GFAA Cc1cc(C)c(C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)c2cn(-c3ccccc3)cn2)[nH]1 2325793276 NQSBFIMRNCLMFS-ROUUACIJSA-N 389.459 2.556 0 50 GFAA Cc1ccc(-c2ccnn2C)cc1NC(=O)c1ccnc(N2CCC(N)CC2)c1 2325795545 MAGVJSJSFILPAJ-UHFFFAOYSA-N 390.491 2.970 0 50 GFAA O=C(Cc1c[nH]c2ccccc12)N1CCN(c2nccnc2C(F)(F)F)CC1 2325805905 CFOAIUJZJKLHOA-UHFFFAOYSA-N 389.381 2.868 0 50 GFAA O=C(CNS(=O)(=O)c1ccc(Br)cc1)Nc1cccc(F)c1 665095 XOAGZDXPMQGWHB-UHFFFAOYSA-N 387.230 2.505 0 50 GFAA COc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1I 670810 VRYDXBOIZJSPFO-UHFFFAOYSA-N 396.184 2.651 0 50 GFAA Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)c(C)c1 673939 JYLMBKRKBXPJPY-UHFFFAOYSA-N 376.434 2.908 0 50 GFAA Cc1ccc(-n2c(SCC(=O)N3CCOCC3)nnc2-c2ccncc2)cc1 779240 IJRHCDAOUWLXQG-UHFFFAOYSA-N 395.488 2.589 0 50 GFAA CCC(=O)N(Cc1ccc(OC)cc1)[C@H]1CC(=O)N(c2ccc(OC)cc2)C1=O 842644 LRGOVSMXMNWQGQ-IBGZPJMESA-N 396.443 2.775 0 50 GFAA CC(=O)N[C@@H](O[C@@H](NC(C)=O)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 3123329 BWTSRGSOSAIODU-OLQVQODUSA-N 394.897 2.668 0 50 GFAA COc1ccc(-c2cc3nccn3c(Nc3ncccc3C(N)=O)n2)cc1OC 3817793 JWQOJVOKBAAAAR-UHFFFAOYSA-N 390.403 2.651 0 50 GFAA in-vitro COc1ccccc1C(=O)C[C@@]1(O)C(=O)N(C)c2ccc(Br)cc21 4554995 XQWDOZXIPBRSQK-SFHVURJKSA-N 390.233 2.895 0 50 GFAA COc1ccccc1NC(=O)Cn1nc(C)c(I)c1C 4726584 XPFQTAFXANPZGI-UHFFFAOYSA-N 385.205 2.752 0 50 GFAA O=C(N1CCCC1)C12C[C@@H]3C[C@H](C1)CC(n1cnc(Br)n1)(C3)C2 13882227 OEWZSXFKHBVSOT-ZPVISIIKSA-N 379.302 2.959 0 50 GFAA Cc1ccc(-c2ccnc(-n3ncc(C(=O)N(C)CCN(C)C)c3C3CC3)n2)o1 14954655 OIQYUAXIHHYVDS-UHFFFAOYSA-N 394.479 2.742 0 50 GFAA CC(=O)N1CCN(c2ccc(-c3nc(CCc4ccccc4)no3)cn2)CC1 19147701 VIRXHGKREPFAJG-UHFFFAOYSA-N 377.448 2.585 0 50 GFAA COc1cccc(N2C(=O)[C@@H]3[C@@H](C2=O)N2CCCN2[C@@H]3c2ccc(C)cc2)c1 19169255 XYGKUGZWLMVTJR-ZCNNSNEGSA-N 377.444 2.539 0 50 GFAA O=C(NCCN1CCCC1)[C@@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 20534976 QMNRCNFCHUPVFM-MRXNPFEDSA-N 397.441 2.656 0 50 GFAA CCCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(-c3cn(C)nc3C)nc21 20615739 QGAHCBRYSDFIHL-UHFFFAOYSA-N 387.465 2.750 0 50 GFAA CN(C)CC(=O)Nc1ccc2c(c1)N(C(=O)CN(C)C)c1ccccc1CC2 22341298 KOCLZUGYDUMRJZ-UHFFFAOYSA-N 380.492 2.512 0 50 GFAA O=C(CN1CCN(Cc2ccccc2F)CC1)Nc1ccc2nsnc2c1 22752275 PTEPPIDMPXQJAH-UHFFFAOYSA-N 385.468 2.587 0 50 GFAA Cc1nc(-c2cccc(CN(C)CCN3CCOCC3)c2)[nH]c(=O)c1C(C)C 23337789 IBGPWRALVLEOIN-UHFFFAOYSA-N 384.524 2.633 0 50 GFAA Cn1ncc(NC(=O)c2ccc([C@@H]3CCCN3CCCn3cccn3)s2)n1 23380012 RCXBSYGFBBVOJE-AWEZNQCLSA-N 385.497 2.553 0 50 GFAA O=C(c1cc(CN2CCOCC2)on1)N(Cc1ccccc1Cl)C1CC1 67840275 PKPJUPMDGPTWOJ-UHFFFAOYSA-N 375.856 2.965 0 50 GFAA Cc1cc2ccccc2n1CCC(=O)N1CCCn2nc(CCC(=O)O)cc2C1 72457702 LUNKJSQXKAZJIJ-UHFFFAOYSA-N 394.475 2.986 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1ccc3ccccc3n1)CC2 91441403 OAGDOLHRHSYBMO-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)Nc1ccc(F)cc1F)CCN2C 91860840 QMVRZBIBJQCPSA-LJQANCHMSA-N 380.439 2.515 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@](C)(Cc3ccc4c(c3)OCO4)C2)c(=O)n1C 92046044 MEEQJXVDFAABGP-QFIPXVFZSA-N 382.460 2.907 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(c1nc3ccccc3cc1CO)CC2 92078787 DUEPNWFJEPHICL-UHFFFAOYSA-N 377.492 2.824 0 50 GFAA COc1cccc(OC)c1[C@@H](C(=O)O)N1CCN(Cc2cccs2)CC1 95362653 BPKDMZUDXZMSDZ-SFHVURJKSA-N 376.478 2.709 0 50 GFAA CN(C)C(=O)N1CCC[C@@H](CCC(=O)N2CCN(Cc3ccccc3)CC2)C1 95528011 IMMXWGQHGJBFGL-FQEVSTJZSA-N 386.540 2.505 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)N1CCC[C@@H](Cn2ccnc2)C1 96153812 JDXSSUMAIHXWNH-SFHVURJKSA-N 383.496 2.659 0 50 GFAA C[C@@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2)n1)NC(=O)c1cc([C@H](C)O)n[nH]1 117196041 BLIJXOOIHRSQRB-RYUDHWBXSA-N 398.854 2.670 0 50 GFAA investigational COc1ccc(S(=O)(=O)N2CCNC(=O)[C@@H]2c2ccccc2)c2ccccc12 131183851 MHMUXHPQVNMJQJ-FQEVSTJZSA-N 396.468 2.710 0 50 GFAA Cc1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)n1 169780962 AUZVPINQCOEMRE-LLVKDONJSA-N 376.779 2.516 0 50 GFAA Cc1ccnc(NCCCN2C(=O)NC3(CCCC3)C2=O)c1Br 170616243 OQTUHCXPJDQPHE-UHFFFAOYSA-N 381.274 2.819 0 50 GFAA C[C@@]1(C2CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)NC(=O)NC1=O 170651694 DTQLYDULKGDIAU-QFIPXVFZSA-N 395.459 2.716 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N2CCC(c3nc(C)no3)CC2)cc1 173703208 XJTWDTHIQQHNBE-GOSISDBHSA-N 382.464 2.584 0 50 GFAA C[C@@H](NC(=O)Cn1ccc(=O)c2ccccc21)C1CCN(CC(F)(F)F)CC1 189645960 GEHVFLZLHZUXRT-CQSZACIVSA-N 395.425 2.781 0 50 GFAA C[C@@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCN(CC(=O)O)CC1 237474409 BMLRGWOTGQKEGK-NSHDSACASA-N 384.358 2.519 0 50 GFAA O=C(c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F)N1CCNCC1 237819843 OMHVBMQTPBSPFR-UHFFFAOYSA-N 394.184 2.638 0 50 GFAA CN(Cc1cccc(O)c1)C(=O)[C@@H]1C[C@H](C(=O)O)N(C)[C@@H]1c1ccccc1F 248100848 HMLZJMWIEMSNTH-BHIYHBOVSA-N 386.423 2.636 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC[C@H]1CCC(F)(F)C1 281966760 YCADYYXHLQUUCV-QWRGUYRKSA-N 380.844 2.558 0 50 GFAA O=C(NC[C@]1(O)CCNC1)c1cccc(-c2cccc(OC(F)(F)F)c2)c1 299770370 QMTHDPZPVRWEAY-SFHVURJKSA-N 380.366 2.706 0 50 GFAA Cc1ccc(-c2ccc(NC(=O)N3CCN(CCOCCO)CC3)cc2)cc1 299797254 QASMSDXQLMHFPU-UHFFFAOYSA-N 383.492 2.820 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNCc2ncccc2C(F)(F)F)CC(=O)N1C 328618725 DZJOTWMDCRSQIA-SCLBCKFNSA-N 395.429 2.760 0 50 GFAA COCCNC(=O)Cn1cc(NC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)cn1 363592428 JXSORQSUGOZZAE-IBGZPJMESA-N 399.495 2.632 0 50 GFAA COc1ccccc1-c1noc(CCCC(=O)N2C[C@@H]3CC[C@H](C2)[C@@H]3OC)n1 426471731 VSRGFNBZLJRBEI-QVDMIQRCSA-N 385.464 2.951 0 50 GFAA COC[C@@H](NC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CCCO1 469090632 QOOUXLNHRVRJFC-HZPDHXFCSA-N 394.269 2.763 0 50 GFAA O=C(c1cccc(-c2ccc(Cn3ccnc3)cn2)c1)N1CCCC[C@H]1CO 534646036 DSPKXNAGRJLRCS-FQEVSTJZSA-N 376.460 2.980 0 50 GFAA Cc1ccc(CN(CCCO)C(=O)N[C@H](C)c2cn3ncsc3n2)s1 534647335 PNKMMARLGQBZHR-GFCCVEGCSA-N 379.511 2.816 0 50 GFAA CCCc1nc(Cc2cccs2)nn1-c1cc(S(N)(=O)=O)ccc1F 670440476 IPQLFVXGLFQSFA-UHFFFAOYSA-N 380.470 2.659 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)[C@@H]1CC(=O)N(c2ccc(O)cc2)C1 827696421 KXEJMMKTDAOWDX-OAHLLOKOSA-N 377.400 2.717 0 50 GFAA O=C(NC1CC1)c1ccc(C(=O)N2CC3(CCN3Cc3ccccc3)C2)cc1 910780710 KRTPCXXHZWRZAL-UHFFFAOYSA-N 375.472 2.679 0 50 GFAA CN(C)C[C@@]1(CO)CCCN(S(=O)(=O)c2ccc(-c3ccccc3)cc2)C1 952986224 YXUVYWDAWCSXPD-NRFANRHFSA-N 388.533 2.678 0 50 GFAA CCc1cc(N2CCN([C@@H](C(=O)O)c3ccc(OC(C)C)cc3)CC2)ncn1 1506420578 JYSBXSMROUEHAQ-HXUWFJFHSA-N 384.480 2.774 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3cncc(F)c3)CC1)OCC2 1704298427 FMUDIVDTBKKAGY-UHFFFAOYSA-N 386.423 2.942 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@@H](CO)CC(C)C)ccc1F 1704313133 GHIIYTKOAHJWCP-CYBMUJFWSA-N 379.432 2.692 0 50 GFAA Cc1nc(C)c2c(n1)O[C@H](COc1ccc3c(c1)CCOC31CCNCC1)C2 1857689222 JQJNZBWIOSKZTE-SFHVURJKSA-N 381.476 2.627 0 50 GFAA COc1ccc(-c2nc(CNC(=O)c3c4c(nn3C)CCCC4)c(C)o2)cc1O 1857696191 QOFSVHXCWIJTLB-UHFFFAOYSA-N 396.447 2.907 0 50 GFAA CC(C)n1cc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)cn1 1857713997 HBKWDYKNAFEWPR-NRFANRHFSA-N 381.480 2.957 0 50 GFAA CCn1ccnc1CNC(=O)C[C@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857729312 DDGQHNTVSSEYOY-OAHLLOKOSA-N 397.479 2.976 0 50 GFAA CCCc1nnc(N2C[C@@H](C(=O)NCCCCc3ccccc3)CC2=O)s1 1857733666 UAHUBWOYEPIEFG-INIZCTEOSA-N 386.521 2.983 0 50 GFAA CCn1cc(S(=O)(=O)N2C[C@H](C(C)C)O[C@H](c3ccccc3)C2)c(C)n1 1875243445 HKZBNAITCLJUFM-MSOLQXFVSA-N 377.510 2.998 0 50 GFAA CCn1c(-c2cc3c(F)c(F)ccc3[nH]2)nnc1N1CC[C@@H]2OC(=O)O[C@H]2C1 1875279266 KOOJKLODQQJFKW-KBPBESRZSA-N 389.362 2.839 0 50 GFAA COc1ccc2c(c1OC)CC[C@H]2NC(=O)Cn1cnc2c(C)cccc2c1=O 1875308259 WPHFJFJQSBQSIM-QGZVFWFLSA-N 393.443 2.526 0 50 GFAA c1ccc(Sc2nc(=NC[C@H]3CCCO3)nc(Sc3ccccn3)[nH]2)nc1 1875391091 XZBUFCASFGHLNB-CYBMUJFWSA-N 398.517 2.977 0 50 GFAA CO[C@H]1C[C@@H](CN)N(c2cc(Nc3cccc(OCC(F)(F)F)c3)ncn2)C1 1875394843 YPKQVPBLGCKKDS-ZFWWWQNUSA-N 397.401 2.714 0 50 GFAA CCCN(Cc1nccn1C)C(=O)c1ccc2nnc(-c3cccn3C)n2c1 2100482404 XENDTYXVJRDROR-UHFFFAOYSA-N 377.452 2.521 0 50 GFAA C[C@H](CNC(=O)Cc1ccc2c(n1)NCCC2)Cn1cc(C(F)(F)F)cn1 2325801643 QMEHZKCBXCAOJV-GFCCVEGCSA-N 381.402 2.650 0 50 GFAA NCc1nc2ccc(NC(=O)c3c(C(F)(F)F)nc4n3CCCC4)cc2[nH]1 2325858408 LVDOZTKVDJISGK-UHFFFAOYSA-N 378.358 2.826 0 50 GFAA O=C(O)c1c(-c2ccccc2)o[nH]c1=NC1CCN(Cc2cccnc2)CC1 2356140414 HZRMDAXOTMABRS-UHFFFAOYSA-N 378.432 2.933 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2cccc(Cn3cccn3)c2)C1=O 2356165884 JIPHVZDUAKFIIB-QFIPXVFZSA-N 380.492 2.939 0 50 GFAA O=C(COc1ccc(Cl)cc1Cl)N1CCN(C(=O)c2ccco2)CC1 815617 YLXKAFKTAHSMND-UHFFFAOYSA-N 383.231 2.950 0 50 GFAA Cc1cc(C)cc(NC(=S)NC(=O)CCN2C(=O)c3ccccc3C2=O)c1 941018 GIQQGZKMYUVWJE-UHFFFAOYSA-N 381.457 2.803 0 50 GFAA CCN(CC)C(=O)c1ccc(-c2cnc3c(N4CCOCC4)nccn23)cc1 2356146353 CAJVSYDSAZQNMP-UHFFFAOYSA-N 379.464 2.715 0 50 GFAA CO[C@H](C)C(=O)Nc1c(C(O)(C(F)(F)F)C(F)(F)F)cnn1C(C)C 864096376 AEKYPTNNQCXXMU-SSDOTTSWSA-N 377.285 2.750 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(c3cc(N(C)C)nc(C)n3)CC2)cc1 21795033 TUAHJVUHOFGPAM-UHFFFAOYSA-N 384.484 2.604 0 50 GFAA C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)c1cccc(N2CCCS2(=O)=O)c1 120065876 KSVYBFUJKWJTQO-HNNXBMFYSA-N 388.489 2.635 0 50 GFAA CN(CCc1ccccc1)Cc1cc(C(=O)N2CCN3CCCC[C@@H]3C2)no1 67675803 IMIZNICXKZGDTL-LJQANCHMSA-N 382.508 2.659 0 50 GFAA Cc1cc(CS(=O)(=O)N2CCCN(c3cccc(Cl)c3C)CC2)no1 284552928 FFQZVVWDGXYSAM-UHFFFAOYSA-N 383.901 2.987 0 50 GFAA CCN(Cc1ccccn1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71763419 DAVXDOMVGCJVIJ-IBGZPJMESA-N 398.551 2.543 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(c3cc(C)nc(N)n3)C2)cc1OC 72145107 XZHRTXPNCSJEDG-KRWDZBQOSA-N 385.512 2.528 0 50 GFAA COc1ccc(C(=O)NCc2ccc(-c3nnn[nH]3)cc2)c(OCC2CC2)c1 252482293 DCMCKHWDLMCSCE-UHFFFAOYSA-N 379.420 2.594 0 50 GFAA C[C@H](NC(=O)CN1CCC[C@H]1CN1CCC[C@@H]1CO)c1ccc2c(c1)CCCC2 252674793 SNUYKGVHEPXUIG-OFAXGOBFSA-N 399.579 2.664 0 50 GFAA COC(=O)c1cc2c(=O)n(CCc3ccc(OC)c(OC)c3)ccc2nc1C 36369886 YHDOJWWGAXADII-UHFFFAOYSA-N 382.416 2.751 0 50 GFAA biogenic COc1ccccc1N1CC[C@H](NC(=O)c2c(-c3ccccn3)noc2C)C1=O 154706195 YARDTBBZWWYWCV-HNNXBMFYSA-N 392.415 2.589 0 50 GFAA O=S(=O)(c1c[nH]c2ncccc12)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 285286455 JWJXQKWUPUYDJI-NRFANRHFSA-N 396.516 2.850 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccs3)[C@H](CCO)C2)cc1CO 39500033 UOFPUVRPTJXAIM-LJQANCHMSA-N 390.549 2.708 0 50 GFAA COCC1(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCc3cccs3)C2)CCC1 72410790 GWXCAXHGKXJJGP-FUHWJXTLSA-N 390.549 2.947 0 50 GFAA COc1ccc(OC)c(-c2cc(C(=O)NC[C@@]3(O)CCc4ccccc43)no2)c1 158733582 ZCTSQZCNPNBHSQ-QFIPXVFZSA-N 394.427 2.923 0 50 GFAA CNS(=O)(=O)c1cccc2c1CCN(c1nc(C)nc3scc(C)c13)C2 286332248 GHYPTHXJNDPFRN-UHFFFAOYSA-N 388.518 2.779 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cccc(C(C)=O)c3)n2)c(F)c1 49551789 FAHZEKJKLWLMTE-UHFFFAOYSA-N 395.390 2.899 0 50 GFAA O=C(NCc1ccc(Oc2ccccc2)cc1)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 178180525 MZOFSFQUXGTQNT-MRXNPFEDSA-N 376.416 2.871 0 50 GFAA COCc1cc(N2CC[C@@]3(CCCN(Cc4ccccc4F)C3=O)C2)ncn1 426604248 GXRHUUDBIQTOHA-NRFANRHFSA-N 384.455 2.781 0 50 GFAA Cn1cc(-c2cccc(C(=O)N[C@@H]3CCCN(Cc4cccnc4)C3)c2)cn1 426667406 MQSXMRNYSDMTHF-OAQYLSRUSA-N 375.476 2.877 0 50 GFAA Cc1ncnc(N2CCN(C(=O)c3cccc(-c4cncc(N)c4)c3)CC2)c1C 426712606 JBRZQIJRMAPWHC-UHFFFAOYSA-N 388.475 2.700 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccccc2F)CC1 225249384 ADPSEXHWASRMNB-QOKNQOGYSA-N 394.512 2.672 0 50 GFAA Cn1cc(CN2CCC(CCCN3CCOCC3)CC2)c(-c2ccncc2)n1 180795792 RSCODHNKJRRRIK-UHFFFAOYSA-N 383.540 2.807 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)c1 95378638 RRLTZVAAZRBJJF-OAHLLOKOSA-N 384.459 2.587 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2cnc(C)nc2C)C3)cc1 95382547 RFVIVVKRWGKORK-RBUKOAKNSA-N 380.492 2.839 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2cc(C)oc2C)CC1 96148889 CQPNQOGHXLBGNX-UHFFFAOYSA-N 382.468 2.772 0 50 GFAA CCn1ccnc1[C@H]1CCCN(C(=O)c2sc3ncn(C)c(=O)c3c2C)C1 95502445 BXYHRUJFVWBGDA-ZDUSSCGKSA-N 385.493 2.540 0 50 GFAA COc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95523178 DRNJIUQXCPNCAT-CEWLAPEOSA-N 381.451 2.932 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(S(=O)(=O)C3CC3)CC2=O)cc1 91254430 ZFRDBEUUNPYHEY-LJQANCHMSA-N 384.501 2.747 0 50 GFAA C[C@H]1CCCN(C(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)[C@H]1CN 237656354 BOMCJDSDVWXLMH-JXFKEZNVSA-N 386.517 2.860 0 50 GFAA O=C(NCc1ccco1)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)cc1 239174190 PMCXEGKYIKKDNM-RPZLJYRGSA-N 388.423 2.767 0 50 GFAA CCc1nc2ccccc2n1[C@@H](CC)C(=O)N(C)C1CCS(=O)(=O)CC1 95366110 SBDOGJDGENHJQL-INIZCTEOSA-N 377.510 2.585 0 50 GFAA O=c1c2ccccc2nc(O)n1C[C@H]1CC[C@H](C(=O)NCc2cccnc2)CC1 245255830 LMSTVLKYILKCKK-JCNLHEQBSA-N 392.459 2.620 0 50 GFAA COc1ccc(Br)c(C(=O)N(CCC(=O)O)C[C@H]2CCCO2)c1 299742252 AWBLRNWIIOJYHV-GFCCVEGCSA-N 386.242 2.554 0 50 GFAA C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@H](O)CC[C@@]43COS(=O)(=O)O)[C@H]1CCC2=O 253614974 OFAHVPXLWWIVAF-FLDBGCDGSA-N 384.494 2.679 0 50 GFAA CCOC(=O)N1CCc2cc(NC(=O)CCOc3cccc(C(N)=O)c3)ccc21 1875264123 WMUYMDQYLCUBOV-UHFFFAOYSA-N 397.431 2.712 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCN(C(=O)NC3CCCCC3)CC2)cc1 1875373536 FAVPPPKWHIIINP-UHFFFAOYSA-N 398.507 2.636 0 50 GFAA O=C1C[C@@H](CN2CCC(=O)N(Cc3ccc(-c4ccccc4)cc3)C2=O)CN1 1875347414 OJWBQUXSNQKSJN-QGZVFWFLSA-N 377.444 2.644 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(c3cccnc3)C[C@@H]2C1 1875329249 MRXKTYIRPGBYMV-TXTKFYIRSA-N 393.487 2.929 0 50 GFAA CN(C)C1(C(=O)N[C@@H](CNc2ncnc3scnc23)C(C)(C)C)CCCC1 1875326675 RXPHTRYOTOULOY-ZDUSSCGKSA-N 390.557 2.904 0 50 GFAA CCc1ncnc(N2CCC3(CC2)CN(Cc2scnc2C)CCO3)c1F 952868419 OAHLWKIOQSVIHS-UHFFFAOYSA-N 391.516 2.814 0 50 GFAA C[C@@H](NC(=O)N1CCC[C@@](O)(CC(=O)N(C)C)C1)[C@H]1CCCc2ccccc21 888093862 ZYWSUPUYOJJZEF-RADWXHQJSA-N 387.524 2.510 0 50 GFAA CCc1ccc(S(=O)(=O)[C@@H]2CS(=O)(=O)C[C@@H]2NC2CCCCCC2)cc1 55408877 DJSLMQVHDYKZII-RBUKOAKNSA-N 399.578 2.501 0 50 GFAA CCC1(CC)CN(C(=O)c2cccc(NC(=O)NC3CC3)c2)CC[S@]1=O 170597569 JIQPWLPRZSPWMD-AREMUKBSSA-N 377.510 2.734 0 50 GFAA Cc1ccc(NS(C)(=O)=O)c(C(=O)Nc2ccc3nnc(C(C)C)n3c2)c1 189087862 YQJAOCQBABJCNC-UHFFFAOYSA-N 387.465 2.785 0 50 GFAA O=C(c1ccncc1)N1CCC(NC[C@@H]2CCN(c3ccc(F)cc3)C2)CC1 1506399026 WPHGWGYJEZIEFR-KRWDZBQOSA-N 382.483 2.941 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3C)CC[C@@H]21 216437077 VAUKKOMTVACBLI-MJGOQNOKSA-N 376.472 2.553 0 50 GFAA Cc1sc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)NCc1cc[nH]n1 1506425935 HKWYXHNKICMCKE-UHFFFAOYSA-N 392.384 2.932 0 50 GFAA Cc1nc(C(=O)N2CCC3(CC2)CN(Cc2ccccc2)C(=O)CCO3)cs1 1704308846 MKSUGEPGCLWNBP-UHFFFAOYSA-N 399.516 2.875 0 50 GFAA O=C(c1cccnc1NCCc1csc(-c2ncccn2)n1)N1CCCC1 1704298545 HQIDDRRWFSBCJR-UHFFFAOYSA-N 380.477 2.886 0 50 GFAA CCCN1C[C@H]2CN(C(=O)CCCn3cncn3)C[C@]2(CCc2ccccc2)C1 1772819168 GGPUAGZHXRXONI-GMAHTHKFSA-N 395.551 2.862 0 50 GFAA OCCOc1ccccc1OCCSCCOc1ccccc1OCCO 5717590 SMCMCXQNGGSUJT-UHFFFAOYSA-N 394.489 2.620 0 50 GFAA NC(=O)c1cncc(-c2cccc3c2O[C@@H](CNC(=O)[C@@H]2CC=CCC2)C3)c1 11975866 IADRQNVMYYYNGS-RDTXWAMCSA-N 377.444 2.624 0 50 GFAA C[C@H](NC(=O)c1ccco1)c1nnc2n1CCN(Cc1ccc(F)cc1)CC2 11977650 ISOPQPQXCOYADN-AWEZNQCLSA-N 383.427 2.560 0 50 GFAA CN(C[C@H](O)COc1cccc(CNCC2(C)COC2)c1)C1CCCCC1 12208955 DYYPRVYUOVCNRJ-FQEVSTJZSA-N 376.541 2.817 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)NCCc2nc(C)c[nH]2)no1 12301358 LJUVTCSYFSWAMW-UHFFFAOYSA-N 390.827 2.920 0 50 GFAA CCCN(CC1CC1)C(=O)c1cn(Cc2ccccc2)cc(C(=O)NCC)c1=O 12333044 RQOMVTNUNGEHLI-UHFFFAOYSA-N 395.503 2.909 0 50 GFAA CN1CCC[C@]2(CCCN(C(=O)c3cn(Cc4ccc(Cl)cc4)nn3)C2)C1 12429869 FGNXCMXCVOPSKI-FQEVSTJZSA-N 387.915 2.928 0 50 GFAA O=C(CN1CCCCC1=O)N[C@@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1 12581287 WZHYDEYPAQDOKO-QGZVFWFLSA-N 388.418 2.657 0 50 GFAA CSc1nnc(CCNC(=O)c2csc(C)n2)n1-c1ccc(F)cc1 14981957 LBDKPNCVZWZBQD-UHFFFAOYSA-N 377.470 2.866 0 50 GFAA O=C(Cc1cccnc1)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 15079882 OHCCSNNFPATTBX-OAHLLOKOSA-N 377.366 2.560 0 50 GFAA c1ccc(-c2noc(CN3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)cc1 19838205 CEJCMNNPZLFYNP-UHFFFAOYSA-N 378.432 2.783 0 50 GFAA COc1ccc(CNC(=O)C2CCN(Cc3cccc4ccnn34)CC2)cc1 1857676863 UQXKABBQXNUPBM-UHFFFAOYSA-N 378.476 2.871 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ncccn3)C[C@]23CC[C@H]1O3)c1cccc(Cl)c1 1857727787 ZSWLSKRSYZGXEZ-TVKQPGBESA-N 384.867 2.544 0 50 GFAA CN(C)C(=O)c1cccc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857732466 RJHXCKYDAMNECA-QFIPXVFZSA-N 393.491 2.641 0 50 GFAA Cc1cc(-c2noc(CCC(=O)N3CCC(C4OCCO4)CC3)n2)ccc1F 110413171 FWRLYYQHECRWEU-UHFFFAOYSA-N 389.427 2.728 0 50 GFAA Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 111347787 OUAWNRYXRGNSAD-AWEZNQCLSA-N 382.844 2.871 0 50 GFAA Cc1sc(O)nc1C(=O)N[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 1875269447 LXSOVMOFOFRWMC-LBPRGKRZSA-N 388.493 2.904 0 50 GFAA C[C@H](OC(=O)[C@H]1CNC(=O)c2ccccc21)C(=O)N1CCSc2ccccc21 860417123 CXSITQJPUPEWMQ-BBRMVZONSA-N 396.468 2.584 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)O)c2cc(C)cc(C)c2)cc1OC 840731 QGBAWDFTIWYFIP-UHFFFAOYSA-N 379.434 2.601 0 50 GFAA O=C(O)c1cccnc1S[C@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1=O 4856567 WVWJWOYKWNYLPT-LBPRGKRZSA-N 380.784 2.997 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@@H](C(=O)OCc2ncn(-c3ccccc3)n2)CC1=O 2325731313 DPYUHLOLZPWEDS-WMZOPIPTSA-N 390.443 2.920 0 50 GFAA Cc1nnc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)o1 2325779478 IFIHITVAJHJHKA-BPUTZDHNSA-N 388.855 2.757 0 50 GFAA Cc1cc(Cl)c(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1OCC(N)=O 645290 VPNXPPHRRKDZCL-UHFFFAOYSA-N 394.880 2.802 0 50 GFAA COc1ccc(N2C(=O)N(c3ccccc3Cl)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 1135430 GBNNYSMKJRWEBL-IRXDYDNUSA-N 392.864 2.961 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCN[C@@H](c2ccccc2)C1 2356152751 ZOQTVZUKORKJOT-GOSISDBHSA-N 397.544 2.686 0 50 GFAA O=C(c1c[nH]ccc1=NCCc1ccccc1)N1CCC[C@]2(CCC[C@H]2O)C1 2356157028 BAMCCSUAZMYSFX-FYYLOGMGSA-N 379.504 2.925 0 50 GFAA COC(=O)c1ccc(N2CCN(C(C)=O)CC2)c(NC(=O)c2cccc(F)c2)c1 4413690 UMUQOODUXAEBDV-UHFFFAOYSA-N 399.422 2.533 0 50 GFAA Cc1cccc(N2C[C@@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)CC2=O)c1 9096479 XYLLAICWNBZWEB-KRWDZBQOSA-N 381.451 2.836 0 50 GFAA CS(=O)(=O)c1ccc(CN2CCN(c3ccnc4ccccc34)CC2)cc1 65422985 ZLVFVNINBCWBQF-UHFFFAOYSA-N 381.501 2.961 0 50 GFAA COc1cc(C(=O)N[C@H](c2nnc3ccccn23)C(C)C)cc(OC)c1OC 20721407 BCCOPHCNWCCPHD-KRWDZBQOSA-N 384.436 2.882 0 50 GFAA Cc1cccc(OC2CCN(Cc3c(C)nn(C)c3N3CCOCC3)CC2)c1 67742021 LAMVMJAOMRZAQE-UHFFFAOYSA-N 384.524 2.917 0 50 GFAA CCNC(=O)[C@@H](C)N1CCC(n2nccc2NC(=O)c2ccccc2C)CC1 67770183 ANTNIORPDNASBI-MRXNPFEDSA-N 383.496 2.605 0 50 GFAA COc1ccc(NC(=O)c2n[nH]cc2I)cc1Cl 680022 LVMRHQMVQJRJGV-UHFFFAOYSA-N 377.569 2.929 0 50 GFAA Cn1c(C(=O)N2CCN(Cc3ccco3)[C@H](CCO)C2)cc2cc(F)ccc21 215060103 YMBRGVWJNVWGMB-QGZVFWFLSA-N 385.439 2.619 0 50 GFAA OC1(CN2CCCC2)CCN(c2cc(-c3ccccc3)nc3ccnn23)CC1 72140093 KQXGVLAEZNIQMI-UHFFFAOYSA-N 377.492 2.823 0 50 GFAA CCc1c(C(=O)NC2C[C@@H]3CC[C@H](C2)N3)nnn1-c1ccc(OC(C)C)cc1 237107721 NOUASRDMOXMLAC-XYPWUTKMSA-N 383.496 2.630 0 50 GFAA Cc1nc(CN2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cs1 71575659 AFMWDYDVDSUBBE-QGZVFWFLSA-N 376.570 2.750 0 50 GFAA CN(C(=O)[C@@H]1CC12CCN(CC(=O)NCCC1CCCCC1)CC2)C1CC1 371553940 NXEIRBHZBYDUGH-IBGZPJMESA-N 375.557 2.796 0 50 GFAA O=C(NCCN1CCCc2ccccc21)N1CCOc2ccc(CO)cc2C1 426493930 DRTKGVLLSJOAGP-UHFFFAOYSA-N 381.476 2.536 0 50 GFAA COc1ccc(C2=NO[C@@H](C(=O)N3CCN(Cc4ccc(F)cc4)CC3)C2)cc1 20602470 YAYQBZGHELIVGH-OAQYLSRUSA-N 397.450 2.672 0 50 GFAA COCc1ncc(CN2CC[C@]3(OC)CC[C@H](Oc4ccccn4)C[C@H]23)cn1 426526329 YEJCOGPMSPNCFP-BBTUJRGHSA-N 384.480 2.609 0 50 GFAA Cc1ccccc1CCC(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 180295433 MWOPWBYPFFABQX-IBGZPJMESA-N 378.538 2.781 0 50 GFAA COc1cccc(CNC(=O)N2CCN(Cc3cccc(C)c3)C(=O)[C@@H]2C)c1 426707149 GEBFMIOOIKWGEV-KRWDZBQOSA-N 381.476 2.946 0 50 GFAA CCn1c(CN2CCC(c3nnc(CN(C)C)n3C)CC2)nc2ccccc21 96152103 UOHNXUFZRNILCZ-UHFFFAOYSA-N 381.528 2.626 0 50 GFAA Cc1cc(N2CCN(C(=O)Nc3ccc(-n4cncn4)cc3)CC2)cc(C)n1 95496783 XXWZQRGFXAWZIK-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cc1cccnc1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95503663 CNYWMRLWYJSYBO-MTNREXPMSA-N 391.471 2.821 0 50 GFAA Cn1c(CN2CCOCC2)nnc1C1CCN(CCCC2CCCC2)CC1 96153596 RPMGFWCMJCNTJH-UHFFFAOYSA-N 375.561 2.797 0 50 GFAA COC(=O)[C@@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@]12C 253604835 RKZIYOHKBLFLTH-ORJOZELTSA-N 394.552 2.757 0 50 GFAA CCNc1nc(C)c(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)s1 823193757 AQXNJCQCUUWOCK-UHFFFAOYSA-N 388.493 2.570 0 50 GFAA O=C(CCC(=O)N1CCC[C@H](COc2ccccc2F)C1)Nc1nncs1 828084887 VOYNKGNEVRPLKV-ZDUSSCGKSA-N 392.456 2.714 0 50 GFAA Cc1sc2nc(CCNC(=O)CCc3n[nH]c4c3CCCC4)nc(O)c2c1C 827822465 QTZLYIUCGNDHHA-UHFFFAOYSA-N 399.520 2.907 0 50 GFAA CCn1cc(CN2CCC3(CC2)CN(Cc2csc(C)n2)CCO3)cn1 823603705 KZAGQYWLAMOMDK-UHFFFAOYSA-N 375.542 2.535 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)c(C)n1 1565517057 CTQHAPICVQAOIF-XLIONFOSSA-N 376.504 2.797 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 268890025 JHZAPNACRUYFMX-WOJBJXKFSA-N 378.428 2.984 0 50 GFAA Cc1c(C(=O)N(CCC(N)=O)Cc2ccccc2)cnn1Cc1ccccc1 195081604 KADMWOMZBXYMLB-UHFFFAOYSA-N 376.460 2.758 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCN(Cc2ccc3ccccc3n2)C[C@@H]1O 1614378146 IOVJSJFVJVFMPA-GOTSBHOMSA-N 376.504 2.740 0 50 GFAA CN(Cc1cc(=O)n2nc(C3CC3)sc2n1)C[C@@H]1Cc2ccccc2CN1C 1506421996 YBHXHYXSOOSARX-SFHVURJKSA-N 395.532 2.517 0 50 GFAA CCOc1ccc(CN(C2CC2)S(=O)(=O)N2CCC[C@@H](COC)C2)cc1 1506420965 FDFLIKGLERTPAV-QGZVFWFLSA-N 382.526 2.653 0 50 GFAA CC[C@@]1(O)CCCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704303733 BAEJFMQLRWCVOM-OAQYLSRUSA-N 385.464 2.555 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3cccc(NC(C)=O)c3)n2)c1 5400111 WORLFQMQQBDVHS-UHFFFAOYSA-N 392.415 2.516 0 50 GFAA CN(CC[C@@H]1CCCCO1)C(=O)CCc1nnc(-c2ccc3c(c2)OCO3)o1 12385913 QBOVSYUMIFOAOK-HNNXBMFYSA-N 387.436 2.816 0 50 GFAA O=C1CCCN1CC(=O)N1CCc2[nH]nc(-c3ccc(C(F)(F)F)cc3)c2C1 12445719 NELFNFVBAUBWJX-UHFFFAOYSA-N 392.381 2.603 0 50 GFAA C/C=C/CSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(Cl)cc1 13470515 BYXWORKOAMYVID-SNAWJCMRSA-N 390.896 2.804 0 50 GFAA COc1cccc(N2C[C@@H](C(=O)Nc3nnc(C(F)(F)F)s3)CC2=O)c1 13944099 KCOFOPZNOGWHGI-QMMMGPOBSA-N 386.355 2.557 0 50 GFAA Cc1c(CN2CCC[C@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)cnn1C 15074018 IUSYOHQYLXQLJB-KRWDZBQOSA-N 378.480 2.969 0 50 GFAA COCCN(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)COc1ccccc1 16488116 VOCCTZQTQNCFFP-UHFFFAOYSA-N 380.444 2.891 0 50 GFAA COc1ccccc1N1C(=O)C[C@H](N2CCN(c3ccc(Cl)cc3)CC2)C1=O 17730026 NUSROMPSMCFUEJ-SFHVURJKSA-N 399.878 2.803 0 50 GFAA COc1ccccc1C(=O)NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12 169776314 CUYCQBVYUGBTJU-UHFFFAOYSA-N 390.403 2.595 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857684960 LMIZVGLQHSIJMW-NRFANRHFSA-N 381.480 2.612 0 50 GFAA O=C(Cc1ccc(O)c(F)c1)N1CC[C@]2(CN(CC3CCCCC3)CCO2)C1 1857691463 MJVNIHXSKURUSR-QFIPXVFZSA-N 390.499 2.957 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(Cc3cc(=O)n4ccsc4n3)CC2)O1 1857714239 WVMZTHKPVCNTFH-HZPDHXFCSA-N 391.537 2.677 0 50 GFAA COC(=O)c1ccc(OC)c(CN2CCC(C3CCN(C(C)=O)CC3)CC2)c1 1857734045 BJVPXNVCPBGAAE-UHFFFAOYSA-N 388.508 2.952 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)NCc3ccc(Cl)c(Cl)c3)CC2=O)s1 1857735344 DLDKLYDQQXNOQL-SNVBAGLBSA-N 385.276 2.823 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCCc2nc(C)cs2)C[C@H]1NC(=O)C1CC1 1875250920 BTCUFHGJZTZTTH-GVDBMIGSSA-N 393.553 2.600 0 50 GFAA CCOc1cc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)ccc1OC 114293160 JALHAPQNKIQWJH-MRXNPFEDSA-N 386.448 2.998 0 50 GFAA O=C(O)c1csc(CNC(=O)C2(c3cccc(Cl)c3)CCOCC2)n1 124384477 KKUUUJWRHTWQLG-UHFFFAOYSA-N 380.853 2.859 0 50 GFAA O=C1CN(c2nncc(-c3cccc(F)c3)n2)CCN1Cc1cccc(F)c1 12574006 ICKBQHBYNNRCOJ-UHFFFAOYSA-N 381.386 2.666 0 50 GFAA CCOc1ccc(CN2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc1CO 1704326158 YXGANDKZXKDONN-QHCPKHFHSA-N 396.535 2.914 0 50 GFAA CN1CCN(C(=O)Cc2ccc(NC(=O)C3(C(F)F)CCCC3)cc2)CC1 808291266 ILLFQEHPANFZQN-UHFFFAOYSA-N 379.451 2.767 0 50 GFAA CCc1[nH]c(-c2ccc(Cl)cc2)nc1C(=O)N1CCOC[C@@H]1c1nc[nH]n1 952961814 JLRHNANINNJAJL-CQSZACIVSA-N 386.843 2.624 0 50 GFAA CC1(C)[C@H](CN)CC[S@]1(=O)=NC(=O)c1csc(Nc2ccccn2)n1 1875358852 LRUBWIHNUYHBJF-JPQMIFPKSA-N 379.511 2.647 0 50 GFAA C[C@H](c1ccc(S(C)(=O)=O)cc1)c1nc(-c2ccc3ncnc(O)c3c2)no1 2325736413 HEKGQJZZYNIATJ-LLVKDONJSA-N 396.428 2.941 0 50 GFAA O=C1CC[C@H](CNCc2cc(C(F)(F)F)ccc2Br)C(=O)N1 2325802179 NNNUDEPOYVVTEU-MRVPVSSYSA-N 379.176 2.610 0 50 GFAA CN(C(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[C@@H]1CCS(=O)(=O)C1 125004032 UIIUNVAIXUMHGR-QLFBSQMISA-N 390.530 2.992 0 50 GFAA CCC1(CC)[C@H](NC(=O)C2CCN(C(=O)N3CCCC3)CC2)[C@@H](C)[C@H]1OC 245619706 QWHIXXWYIZYUPE-KBAYOESNSA-N 379.545 2.870 0 50 GFAA O=C(O)CN(Cc1ccc(Br)cc1)S(=O)(=O)c1ccccc1 1016060 YEYXWXSNROROJY-UHFFFAOYSA-N 384.251 2.725 0 50 GFAA O=C1C[C@@H](c2ccccc2)NCCCCN(C(=O)c2ccncc2)CCCN1 2356161030 CRVHEBNPTWDZDS-FQEVSTJZSA-N 380.492 2.545 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1Cl)N1CCCC1 4502420 PDCFNZWAOQODBV-UHFFFAOYSA-N 386.901 2.516 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1c(F)cccc1Cl 4805225 FJVNYFBHPRFFOJ-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA CCOC(=O)CN1C(=O)[C@@](O)(CC(=O)c2ccccc2Cl)c2ccccc21 4841294 GLNDCUROYUQKGP-HXUWFJFHSA-N 387.819 2.710 0 50 GFAA O=C(c1ccccc1F)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 6335580 SKEXEVVEIZSZTQ-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA OCC[C@H]1CN(Cc2cnn(-c3ccccc3)c2)CCN1Cc1ccccc1 22851306 WEEDDXMMGASAPE-QHCPKHFHSA-N 376.504 2.941 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)CCc1cccc(F)c1F)CC2 115291621 HRYFHBRKRPIUIB-UHFFFAOYSA-N 394.443 2.737 0 50 GFAA COC(=O)c1ccc(NC(=O)c2c(O)c3cccc4c3n(c2=O)[C@@H](C)C4)cc1 170624662 QUAGWHBFFZETHE-NSHDSACASA-N 378.384 2.863 0 50 GFAA CCn1c(C)ccc(C(=O)N2CCc3[nH]nc(-c4ccccc4F)c3C2)c1=O 67947603 FJFNMIAWBHPOPR-UHFFFAOYSA-N 380.423 2.904 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)c2cc(CN3CCc4ccccc4C3)on2)C1 67695112 ICHPXAIXIACACH-LJQANCHMSA-N 382.508 2.789 0 50 GFAA Cc1c(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)nnn1-c1ccccc1 474832775 KVIIAAVMPQNSEF-UHFFFAOYSA-N 394.450 2.925 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)co1 153013253 QTSJUVDOZFMIAM-GWCFXTLKSA-N 386.832 2.608 0 50 GFAA O=C(Nc1ccc(CNC(=O)N2CCOC[C@@H]2C2CC2)cc1)c1cccnc1 153529427 BBNOKOMHRRLTTD-LJQANCHMSA-N 380.448 2.654 0 50 GFAA CCOc1ccccc1CN1CCN(C2CCN(C(C)C)CC2)[C@H](CCO)C1 39438570 AKWJMNOUFSXYOQ-JOCHJYFZSA-N 389.584 2.827 0 50 GFAA O=S1(=O)CCCN1C1CCC(N[C@H](c2ccc(F)cc2)c2ncc[nH]2)CC1 370476828 KMKDBXPSEZSUPV-DAWZGUTISA-N 392.500 2.575 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCc2ncc[nH]2)(Cc2ccccc2)c2ccccc21 71614509 MGEVIHBQJBEQKB-HSZRJFAPSA-N 388.471 2.616 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc(CCC(=O)O)cc2)c1 71750250 RMADDITYLPSOCA-UHFFFAOYSA-N 391.445 2.756 0 50 GFAA COc1cc2c(cc1CN1CCC3(CC1)Nc1ccccc1NC3=O)OCO2 82137660 QATWBSOUZRFLEM-UHFFFAOYSA-N 381.432 2.823 0 50 GFAA Cc1cc(C(=O)N2CCC(n3cc(-c4ccccc4)nn3)CC2)c(=O)[nH]c1C 19813138 BFLAIZWAEBRYRS-UHFFFAOYSA-N 377.448 2.728 0 50 GFAA O=C(NCCc1cn2ccsc2n1)N1CCC[C@H](OCc2cccnc2)C1 426613622 LAJVPCNCEXHPHB-KRWDZBQOSA-N 385.493 2.724 0 50 GFAA CC(C)NC(=O)c1ccccc1NC(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 225410954 DDJJFPBSYIYHQG-CVEARBPZSA-N 394.475 2.638 0 50 GFAA biogenic Cc1noc(C)c1CN1CCc2c(C(=O)N[C@@H](C)Cn3cccn3)csc2C1 426573292 OYFSGOZQZKJRJW-ZDUSSCGKSA-N 399.520 2.926 0 50 GFAA CC(C)Cn1nccc1NC(=O)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 95531819 UKGGPZGDUJDQFO-JKSUJKDBSA-N 386.452 2.650 0 50 GFAA CS(=O)(=O)c1ccc(-c2noc(-c3cccc(N4CCCNC4=O)c3)n2)cc1 177729353 LFQZHQQDFVVVFQ-UHFFFAOYSA-N 398.444 2.727 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(Cc1nc3ccc(C)c(C)c3[nH]1)CCN2C 95363508 ZVSWHFIDOMQDMD-JOCHJYFZSA-N 383.540 2.698 0 50 GFAA O=C(NCCc1nc(-c2cccnc2)no1)c1cccc([C@H]2CCCNC2)c1 95366831 WEPZSQPHRZSLDF-KRWDZBQOSA-N 377.448 2.571 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95518411 QLFCGVILDHZBSU-SFHVURJKSA-N 378.480 2.628 0 50 GFAA CN1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@H]1c1ccccc1 248038275 LNTGZZQIHWMBNG-PWRODBHTSA-N 377.488 2.853 0 50 GFAA Cc1noc([C@H]2CCCCN2C(=O)NCc2nc(Cc3ccccc3)no2)n1 534656822 ABMUAGHBTWDLTD-OAHLLOKOSA-N 382.424 2.789 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3ccccc3-c3ncc[nH]3)cc2C1 299801488 ZJAHUVOOKGAQKJ-UHFFFAOYSA-N 378.480 2.819 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC(Nc3cccnn3)CC2)ncn1 275574505 GLZBUGTXJPATLD-UWJYYQICSA-N 397.527 2.963 0 50 GFAA Cn1cc([C@@H]2C[S@](=O)CCN2C(=O)c2ccc(CCC(F)(F)F)cc2)cn1 277839985 ZWWUHNXIHAFUHR-RKOGDMNLSA-N 399.438 2.861 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)OCc2ccc(Br)s2)c(C)o1 751743353 MQSAYIJSIPIKEC-UHFFFAOYSA-N 394.268 2.677 0 50 GFAA Cc1nn(CC(F)F)c(C)c1C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1 760636935 HXVAIOMRCXIION-UHFFFAOYSA-N 386.443 2.894 0 50 GFAA NCCc1ccc(C(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)cc1 1704353487 YHGPRSLCYDUHQO-KNQAVFIVSA-N 375.472 2.724 0 50 GFAA COc1ccc(-c2oc3cc(C)n([C@@H](C)C(=O)O)c(=O)c3c2CC(=O)O)cc1 1848443489 WACXIMYXPCIQQF-NSHDSACASA-N 385.372 2.851 0 50 GFAA COC(=O)CCCC[C@@H]1SC[C@H](NC(=O)c2ccccc2)[C@H]1OC(C)=O 12379844 PVEAODUKPHUVRQ-XYJFISCASA-N 379.478 2.566 0 50 GFAA biogenic COc1cccc(-c2cc(CC3(O)CCN(Cc4cnc(C)n4C)CC3)on2)c1 12438883 SHKIFOANZHTBRM-UHFFFAOYSA-N 396.491 2.962 0 50 GFAA NC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccccc2Cl)CC1 12863491 SBUGVYBFAUPTGZ-UHFFFAOYSA-N 385.851 2.930 0 50 GFAA Cc1ccccc1N1CCN([C@@H]2CCCN(C(=O)C(=O)c3ccccc3)C2)CC1 15065824 XGHFIGMRUSMIAM-OAQYLSRUSA-N 391.515 2.991 0 50 GFAA Cc1ncc2c(c1-c1noc(C3CCN(C)CC3)n1)CCN(c1cnccn1)C2 19853851 QUMMQRSHQFHKEE-UHFFFAOYSA-N 391.479 2.602 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772216 OQXNNLYFKHPTSJ-ZDUSSCGKSA-N 380.370 2.612 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1857736472 QHELJKFCIIKKSC-VQIMIIECSA-N 376.412 2.639 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)N2CCc3ccccc3C2)C[C@H]1NC(=O)c1ccc[nH]1 1875249442 SZLQESOXLFHQHX-PWIZWCRZSA-N 381.476 2.513 0 50 GFAA CCN(Cc1nc(C)no1)C(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1875251169 OSNBMDFGQZHTOV-AWEZNQCLSA-N 384.440 2.569 0 50 GFAA O=C1CC[C@@H](C(=O)NCC2(c3ccc(Br)cc3)CCCC2)CN1 151467981 LKZMZGKWAQZEAR-CYBMUJFWSA-N 379.298 2.903 0 50 GFAA O=C(N=c1ccn(-c2ncccc2F)[nH]1)c1ccc(Nc2ncccn2)cc1 1875254119 WDBWNIGTABDJMI-UHFFFAOYSA-N 375.367 2.614 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](c3ccccn3)C3CC3)C2)c1C 1875397675 JUVJKJKEQCEEIE-MJGOQNOKSA-N 394.523 2.510 0 50 GFAA Cc1cc(=NC[C@H](O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[nH]c(CO)n1 1875305301 PFECRRIQBWCUPY-LBPRGKRZSA-N 395.303 2.882 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@@]3(NC(=O)CC4(C)CCCC4)CCC[C@H]23)n1 1775990048 CCFXZCJMIRKOQU-JTSKRJEESA-N 399.539 2.766 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 328593346 XBRMXZBXHYPKKQ-OAGGEKHMSA-N 382.501 2.966 0 50 GFAA Nc1ncc(C(=O)N[C@@H]2CCS(=O)(=O)c3ccc(Cl)cc32)cc1Cl 2325739201 DKWMKGJFMJRRRB-GFCCVEGCSA-N 386.260 2.619 0 50 GFAA O=C1N[C@H]2CCN(Cc3ccc(OCCN4CCCCC4)c(Cl)c3)C[C@H]2O1 2325784202 HQNZVLYUSTXRTR-PKOBYXMFSA-N 393.915 2.887 0 50 GFAA O=C(O)c1cnn(C[C@@H]2C[C@@H](O)[C@H](NCc3cccc(-c4ccccn4)c3)C2)c1 2325786205 RFSGJTATSOJUOZ-ZLGUVYLKSA-N 392.459 2.573 0 50 GFAA CC(C)(C)[C@H]1CC[C@H](NC(=O)C2CCN(c3ccc(-c4nn[nH]n4)cn3)CC2)C1 2325807368 UTUJKQRFARUEON-IRXDYDNUSA-N 397.527 2.809 0 50 GFAA CC1CCN(CCc2cccc(NC(=O)c3cnc(O)c4cncn34)c2)CC1 2325825958 JEZRWYAVUDMZMP-UHFFFAOYSA-N 379.464 2.962 0 50 GFAA C[C@H](NC(=O)C(=O)N(c1ccncc1)C1CCNCC1)c1cccc2cc[nH]c12 2325859392 XRRQJAAXKZCJGI-HNNXBMFYSA-N 391.475 2.525 0 50 GFAA O=C(Cc1sccc1Br)NCC(=O)Nc1ccc2c[nH]nc2c1 2325860984 AUNSDPIPFLGCNU-UHFFFAOYSA-N 393.266 2.684 0 50 GFAA CC(C)OCc1ccc(C(=O)N[C@@H]2CCN(c3cnnc(O)c3Cl)C2)cc1 891006375 RIEPYCLCEHJBSS-OAHLLOKOSA-N 390.871 2.769 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)c2ccc(F)cc2)cc1 816597 NNYANGZHIKWISI-UHFFFAOYSA-N 392.452 2.652 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)c2ccc(-n3nc(C)cc3C)cc2)C[C@@H]1O 2356138281 ICWCPXMMEAZQTN-RXVVDRJESA-N 385.464 2.567 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3cccc(F)c3)n2C)s1 4736260 KOXWDEOKFSNJDI-UHFFFAOYSA-N 378.458 2.766 0 50 GFAA CCOC(=O)CN1C(=O)S/C(=C/c2cc(OC)c(OC)cc2Cl)C1=O 4818774 NNXBFCBTBGOLQD-AWNIVKPZSA-N 385.825 2.957 0 50 GFAA Cc1ccc(OCC(=O)N(Cc2ccc(F)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 4866347 FLQQTVHFBZUDDS-GOSISDBHSA-N 391.464 2.729 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NS(=O)(=O)c2ccc(SC)cc2)c1 6579022 CCWVZIHVOYIZPA-UHFFFAOYSA-N 395.458 2.783 0 50 GFAA COc1ccc(CN2C(=O)O[C@@H]3CN(Cc4cccc(O)c4)C[C@@H]32)cc1OC 55224743 YUZXGSBGLCIMTQ-FXAWDEMLSA-N 384.432 2.615 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@@H](C(=O)N2CCN(c3ccccc3F)CC2)C1 59741048 WVIIOKCACZNEAM-MRXNPFEDSA-N 375.488 2.759 0 50 GFAA CCOc1ccc(CN2CCN(c3nc(C)ncc3CC)C[C@@H]2CCO)cc1 107006857 MCYSBXGCOJXLQZ-FQEVSTJZSA-N 384.524 2.819 0 50 GFAA COc1ccc(C)cc1-n1c(SCC(=O)O)nnc1[C@H]1CCCN(C)C1 67769887 VRQWJMPYPOJSRW-ZDUSSCGKSA-N 376.482 2.570 0 50 GFAA O=C(N[C@H]1CC[C@H](CO)CC1)c1nnn(-c2ccccc2F)c1C(F)(F)F 246473846 CYOTWTUFDHGKBJ-XYPYZODXSA-N 386.349 2.706 0 50 GFAA COc1ccc(OC)c(NC(=O)c2ccc(N(C)S(C)(=O)=O)c(C)c2)c1 65363903 IRSFYJGPDMSWKO-UHFFFAOYSA-N 378.450 2.660 0 50 GFAA O=S(=O)(Nc1ccccc1CO)c1ccc(I)cc1 8730195 JGPMHZBKFFMVJP-UHFFFAOYSA-N 389.214 2.584 0 50 GFAA CC[C@H]1CN(C(=O)CCSc2nnc(-c3ccncc3)o2)CC[C@@]1(C)O 67769634 ZVISOOVXCMJEMI-KBXCAEBGSA-N 376.482 2.623 0 50 GFAA CSc1ccc(CN(C(=O)Cc2nc3nc(C)cc(O)n3n2)C2CC2)cc1 63884763 OTABXXPZWBPJSW-UHFFFAOYSA-N 383.477 2.594 0 50 GFAA CCOC(=O)c1ccc(C(=O)OCC)c(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c1 2801101 LMIYGGSMPMMYTQ-ZIAGYGMSSA-N 389.404 2.646 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(Cl)cc2)CN1C1Cc2ccccc2C1 32541262 UWVAMCGCWKPALB-CTNGQTDRSA-N 383.923 2.786 0 50 GFAA COc1ccc(-n2ccnc2CN2CCCn3nc(CCC(=O)O)cc3C2)cc1 72428657 ADNFADLXFLRFKO-UHFFFAOYSA-N 395.463 2.501 0 50 GFAA CCCC[C@H]1C(=O)N(C)CCN1C(=O)c1cn(CCC2CCCCC2)nn1 72164409 PXUINJOWEWYWGR-SFHVURJKSA-N 375.517 2.722 0 50 GFAA O=C(c1ccccc1)[C@H]1CCCN(C(=O)c2cc(=O)n(-c3ccccc3)[nH]2)C1 77520536 RQBYOQPNAQBMRR-KRWDZBQOSA-N 375.428 2.901 0 50 GFAA Cc1cccc2[nH]c([C@@H]3CCCN(C(=O)c4cnc5ccccn5c4=O)C3)nc12 77388690 FKTYNJWCTMDZHT-OAHLLOKOSA-N 387.443 2.899 0 50 GFAA COc1cccc(CCNc2ncnc3c2CCN(C(=O)c2cccnc2)C3)c1 71416286 HPNFLQHLRFIKHB-UHFFFAOYSA-N 389.459 2.733 0 50 GFAA C[C@@H]1[C@H](C(=O)NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 242167627 WYDGKHCOZBRDDA-BPQIPLTHSA-N 376.497 2.742 0 50 GFAA O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cccc(-n2cccn2)c1 77459972 BKTWMQYXHDPMHU-UHFFFAOYSA-N 385.427 2.526 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1csnc1C)CC2 262841632 SFQGMMAAEHOJKF-CQSZACIVSA-N 376.434 2.683 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1C[C@H](c2ccccc2)[C@@](F)(CO)C1 452946881 VKBCDWAZHKSCAH-VFNWGFHPSA-N 387.455 2.728 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@H](N4CCOCC4)C3)cc2F)n1 173837171 ADGGQJDLODNVLI-KRWDZBQOSA-N 387.459 2.567 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95499198 JFDIFIYTACJPMZ-GFCCVEGCSA-N 388.522 2.755 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)CCn3nnc4ccccc43)C2)c1 95388732 PLFWHUJIMVSUKP-QGZVFWFLSA-N 378.432 2.926 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(-c3nc(C(C)(C)C)no3)[nH]c2C1 95502620 SJPFJDXVAHLBAI-LLVKDONJSA-N 381.436 2.836 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccon3)CC2)CN1Cc1ccc(F)c(F)c1 91518626 RITFDBYZUZVVIX-UHFFFAOYSA-N 375.375 2.608 0 50 GFAA O=C(CCN1C[C@@H]2c3ccccc3OC[C@]2(C(=O)O)C1)NC1CCCCCC1 95529130 GTIRDIZXWYMVLC-XMSQKQJNSA-N 386.492 2.778 0 50 GFAA O=C(c1ccc2nccnc2c1)N1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1 91781845 HIJXDAASWZMMHE-QFIPXVFZSA-N 378.476 2.885 0 50 GFAA O=C(NCc1ccc(F)cc1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 92020491 MRACWIJGRKVSIY-WMLDXEAASA-N 388.468 2.615 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1 95372225 PJZHESAIZIALAK-ZDUSSCGKSA-N 391.401 2.858 0 50 GFAA CCCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(-n3cnnn3)cc2)C1 95522076 HWDQSIPGRRSKNT-QGZVFWFLSA-N 379.468 2.679 0 50 GFAA C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1ccc2cncn2c1 297448028 JIKINACZGFVFAP-AWEZNQCLSA-N 379.468 2.870 0 50 GFAA Cc1cnn(Cc2ccc(Cl)cc2)c1NC(=O)N[C@H]1CCC(=O)N(C)C1 299793278 IHQGJQLBPIAKEV-HNNXBMFYSA-N 375.860 2.636 0 50 GFAA O=C(NCCN1CCC(c2ccccc2)CC1)c1nnc(O)c2ccccc12 952873421 WSQXSWRAWOCIJD-UHFFFAOYSA-N 376.460 2.945 0 50 GFAA Cn1c(NC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)nc2cccnc21 274460502 JVFYNWFYCAPDSK-OAQYLSRUSA-N 377.448 2.849 0 50 GFAA COc1cccc2c1CCC[C@@H]2NC1CCN(S(=O)(=O)C(F)(F)F)CC1 194912410 VQJQAQNUOCXHLC-HNNXBMFYSA-N 392.443 2.976 0 50 GFAA C[C@@H](C(=O)N1CCCN(Cc2cccnc2)CC1)c1nnc(O)c2ccccc12 1506423816 WYHQZJNOMBYGLR-MRXNPFEDSA-N 391.475 2.568 0 50 GFAA O=C1CCCN1CCN1C[C@@H]2CN(CC3CC3)C[C@@]2(CCc2ccccc2)C1 1772809238 PZVFKQWABYPPAK-ISKFKSNPSA-N 381.564 2.885 0 50 GFAA Cc1cc(CNC(=O)c2cnn(-c3nccc(-c4cccs4)n3)c2C)on1 12020420 PJWJFRPCWZTDLF-UHFFFAOYSA-N 380.433 2.926 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@@H](CNC(=O)c3ccc(F)cc3)C2)nc(N)n1 12597258 OIGXAAJNLGBKPA-AWEZNQCLSA-N 399.470 2.604 0 50 GFAA CSc1ncccc1C(=O)N1CCC(n2nccc2NC(=O)C2CC2)CC1 12716291 CMEDDMJGDCYKOL-UHFFFAOYSA-N 385.493 2.826 0 50 GFAA Cc1cc(-c2ccnc(-n3ncc(C(=O)N[C@H](C)CO)c3C3CC3)n2)c(C)s1 14887816 VHVDUDYKUFQBSI-LLVKDONJSA-N 397.504 2.996 0 50 GFAA CCN(CC)C(=O)c1sc2ncnc(NCCCN3CCOCC3)c2c1C 14979001 GZLYGLVJJOLLDK-UHFFFAOYSA-N 391.541 2.616 0 50 GFAA Cc1ccc(CC(=O)NCc2nnc3cc(-c4nc(C5CC5)no4)ccn23)cc1 169776289 SYVPYZCJMYCRCI-UHFFFAOYSA-N 388.431 2.824 0 50 GFAA COc1cccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccc(C)cc3)CC2)c1 169779807 PYRBHJOKNKXJLE-UHFFFAOYSA-N 392.459 2.897 0 50 GFAA COc1cc(Oc2cc(C(=O)N3CC[C@@H](N(C)C)C3)ccc2OC)ccc1CN 1857696364 XFKNKMRFRVCRDL-QGZVFWFLSA-N 399.491 2.731 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)C1(CCN(c3ncccn3)CC1)OCC2 1857699488 VSSXUOIUJJOXIH-UHFFFAOYSA-N 384.505 2.889 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(c2ncnc3[nH]cnc23)CC1 1857735175 LIZDQGWRTIDRHL-UHFFFAOYSA-N 379.468 2.630 0 50 GFAA Cc1cc2[nH]cc(C(=O)N3C[C@H](C(C)C)O[C@H](c4ccccc4)C3)c(=O)n2n1 1875243981 HGXSFEQETXXSDR-MSOLQXFVSA-N 380.448 2.569 0 50 GFAA CC1=C(C(N)=O)[C@@H](c2ccc(F)cc2)N2NC(c3ccccc3Cl)=NC2=N1 940685 INUZFGARJMTFHT-MRXNPFEDSA-N 383.814 2.916 0 50 GFAA COCCc1cc(=O)[nH]c(-c2ccc(CN3CCOC4(CCCC4)C3)cc2)n1 23128406 AEUUIIRPNIKGBV-UHFFFAOYSA-N 383.492 2.771 0 50 GFAA N[C@@H]1CCCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 157988965 PYHKHZSFPXRWLA-GFCCVEGCSA-N 378.270 2.986 0 50 GFAA Cc1cccc(C2(C(=O)Nc3ccn(CC(=O)N4CCOCC4)n3)CCCC2)c1 265326406 XBERPFXBOGSXNM-UHFFFAOYSA-N 396.491 2.501 0 50 GFAA C[C@@H](NC(=O)c1cnc(C2CC2)nc1N)c1cc(F)ccc1N1CCC(O)CC1 807035279 NGJHRCGOCQSJRZ-GFCCVEGCSA-N 399.470 2.527 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)NC[C@H](O)Cc2cccc(Cl)c2)ccn1 834810647 JSMKSVCURQVBCB-MRXNPFEDSA-N 375.856 2.663 0 50 GFAA CC[C@H](C)n1ncc2c(C(=O)N[C@H]3c4ccccc4OC[C@@H]3O)cc(C)nc21 1875297841 FNBJQRCWWDFREI-IXDGSTSKSA-N 380.448 2.935 0 50 GFAA Cc1cnc2n1CC[C@@H](NC(=O)N(C)[C@H](c1ccc(F)cc1)c1ncccn1)C2 1875329464 XBGMHFHOIBLUDK-IEBWSBKVSA-N 394.454 2.866 0 50 GFAA CCc1cc(C(=O)N(C)C[C@@H](C)NC(=O)c2cc3ccccc3o2)cc(O)n1 1875303293 LQWGMZRGHURVAN-CYBMUJFWSA-N 381.432 2.986 0 50 GFAA CCOc1ccc(/C=c2\sc3nnc(-c4ccccc4)n3c2=O)cc1OC 4694797 SFIFGKWMQIACAR-ATVHPVEESA-N 379.441 2.773 0 50 GFAA Brc1cc2c(cc1CSc1nnnn1-c1cccnc1)OCO2 4709098 DRKJFLVLGKBGCG-UHFFFAOYSA-N 392.238 2.841 0 50 GFAA CC(C)(C)n1ccc(-c2nc(C3CCOCC3)nn2[C@H]2CCS(=O)(=O)C2)c1 2100543094 LOJFGVNJWRTZRV-INIZCTEOSA-N 392.525 2.755 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)C1 136108307 BREKILRDFPTFFU-ABAIWWIYSA-N 399.274 2.921 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1c(OC)cccc1OC 1125651 JKYRMAXLYIXKGR-UHFFFAOYSA-N 375.377 2.760 0 50 GFAA O=C(COc1ccccc1)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1 4700274 WNIKHMMTZLLSKH-UHFFFAOYSA-N 393.531 2.874 0 50 GFAA O=C(CO)N1CCC(c2n[nH]c(-c3ccc(Cl)cc3)c2-c2ccncn2)CC1 6718469 CATQHDWESBRRQA-UHFFFAOYSA-N 397.866 2.885 0 50 GFAA in-man COc1cccc(NC(=O)CSc2nc(O)c(C)c(=O)n2-c2ccccc2)c1 8571885 CIBTVBZVUFOQBB-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA CCC(=O)Nc1cccc(OCC(=O)NCc2cc(-c3cccnc3)no2)c1 55575895 FFMVINAGZUVVKI-UHFFFAOYSA-N 380.404 2.780 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3cccc(F)c3C)CC2)cc(-n2cccn2)n1 65364407 LZLPJHBBLVITFC-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA O=C(CCN1CCC[C@H](c2nnc3ccccn23)C1)N1CCc2ccccc2C1 65470302 OKTIAGRKSJHYST-FQEVSTJZSA-N 389.503 2.884 0 50 GFAA CN1CCN(CCc2nc3cc(NC(=O)C4CCCCC4)ccc3n2C)CC1 22930740 PRJVPXAFOQMHAB-UHFFFAOYSA-N 383.540 2.882 0 50 GFAA NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnc2c(-c3ccccc3)cnn2c1 67446683 XSCJCRKXGVRAGM-NRFANRHFSA-N 383.455 2.809 0 50 GFAA O=S(=O)(/C=C/c1ccc(Br)cc1)NC[C@H]1CCn2ccnc2C1 328639226 WTLHTYNCMHHUNX-XYYIANASSA-N 396.310 2.798 0 50 GFAA COC(=O)c1csc(S(=O)(=O)N(C)[C@H](C)[C@@H]2Cc3ccccc3O2)c1 433486136 JXUPXOVEWQVEHO-ABAIWWIYSA-N 381.475 2.547 0 50 GFAA COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@H]1[C@H]2c3ccccc3CC[C@H]21 154542222 FTYWNJYTBOLOBU-WDYCEAGBSA-N 386.473 2.509 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)Nc1nnc([C@@H]2CCCO2)s1 36360182 LLCAFBKMYVKSKW-AWEZNQCLSA-N 385.449 2.518 0 50 GFAA Cn1nccc1[C@H](O)c1cc2n(n1)CCCN(Cc1cccc3cc[nH]c13)C2 219842382 OOBIJKLBUFCIBZ-OAQYLSRUSA-N 376.464 2.586 0 50 GFAA O=C(Nc1cccc(-n2ccnn2)c1)N[C@@H]1CCN(c2c(F)cccc2F)C1 130410467 KPWKJNDEBTYPHC-CQSZACIVSA-N 384.390 2.946 0 50 GFAA Cc1nc(CNC(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)no1 71416362 JRSZBOHCEIOWJO-QFIPXVFZSA-N 390.443 2.541 0 50 GFAA Cc1ccc(C(=O)O)cc1S(=O)(=O)N1CCCN(CC2CCCCC2)CC1 237812365 UDLMYCMVZBLSIW-UHFFFAOYSA-N 394.537 2.970 0 50 GFAA Cc1[nH]c2ccccc2c1C(=O)[C@H](C)OC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O 241587888 OXXLUTSKRVQONV-RRFJBIMHSA-N 396.443 2.766 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)ccc1-n1cncn1 173088417 FCWNFSFMNIDBGB-MRXNPFEDSA-N 395.507 2.686 0 50 GFAA CCc1cc2c(=O)n(NC(=O)c3ccc4c(c3)OCO4)c(=S)[nH]c2s1 17076778 SHGJUJYLMTZFTK-UHFFFAOYSA-N 375.431 2.796 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@@H]3CCCN(C)C3)csc2C1 426489882 HXVBXBQKZJBIJK-OAHLLOKOSA-N 388.537 2.735 0 50 GFAA O=S(=O)(NCc1ccncc1OC[C@@H]1CCOC1)c1ccc(Cl)s1 288673574 SZNITIOZWARYNY-LLVKDONJSA-N 388.898 2.690 0 50 GFAA O=C(NCCN1CCC(c2ccccc2)CC1)NC[C@@H](O)c1cccc(O)c1 426407484 FHJJXXVLXFVNTC-OAQYLSRUSA-N 383.492 2.604 0 50 GFAA CN(Cc1nc(-c2ccncc2)no1)C(=O)[C@@H]1CCCN(Cc2ccco2)C1 95378843 JHLSWCPYXHMZPN-MRXNPFEDSA-N 381.436 2.595 0 50 GFAA O=C(Nc1cccc(-c2cscn2)c1)C1CCN(CCn2cnnc2)CC1 95530738 QMDHGDKUDUBILQ-UHFFFAOYSA-N 382.493 2.752 0 50 GFAA COCc1noc(CN2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)n1 91830410 OMHMBLKIXQLWKS-UHFFFAOYSA-N 398.507 2.663 0 50 GFAA CCN(CCS(=O)(=O)c1ccc(C)cc1)C(=O)c1n[nH]c2c1CCCC2 96153052 PQUDOAFRUBBLIW-UHFFFAOYSA-N 375.494 2.533 0 50 GFAA COc1ccc([C@@H](NC(=O)CCC(=O)c2ccc(F)cc2)[C@H]2C[C@@H](O)C2)cn1 243932541 BXGARTUEOSEXHN-LDBYXDLTSA-N 386.423 2.821 0 50 GFAA CC1(C)C(=O)Nc2cc(C(=O)Nc3ccccc3CN3CCNC3=O)ccc21 293323924 AIWNKRUPMREGLG-UHFFFAOYSA-N 378.432 2.694 0 50 GFAA CNC[C@H]1CCN(C(=O)c2ccc(OCc3csc(C)n3)c(OC)c2)C1 299739448 ONJLQWNNGAPROC-CQSZACIVSA-N 375.494 2.721 0 50 GFAA Cn1nc(-c2cccs2)cc1C(=O)N[C@H]1CCCN(C(=O)c2ccco2)C1 828188847 BVDLGQSVFRXSFN-ZDUSSCGKSA-N 384.461 2.776 0 50 GFAA O=C(NCc1ccc(-c2ccccc2Cl)o1)N1CCN(CCCO)CC1 584903873 ZTWRPHRFXMZAOQ-UHFFFAOYSA-N 377.872 2.810 0 50 GFAA Cn1ccnc1C(=O)N1CCC[C@H](CNC(=O)c2cccc(C(F)(F)F)c2)C1 952964235 NGYJHXPFEFOVCA-CYBMUJFWSA-N 394.397 2.721 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@@H]1O 1565507389 FRCKIZFTWLYEKD-VXKWHMMOSA-N 395.547 2.905 0 50 GFAA Cc1ccccc1-n1ncc(C(=O)N2CCCNC(=O)[C@@H]2C)c1C(F)(F)F 189242267 ULZQJXQFZUVRPE-LBPRGKRZSA-N 380.370 2.550 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCOCC34CCC4)cc2)c(C)c1CCC(=O)O 191602406 CUMDNWDBUAIUHY-UHFFFAOYSA-N 397.475 2.901 0 50 GFAA COc1cc(CN2CC[C@H](O)[C@H](C(=O)O)C2)ccc1OCc1ccccc1F 1615956898 NBFDVOJUADHOKR-AEFFLSMTSA-N 389.423 2.681 0 50 GFAA C[C@H](O)c1nc2cc(-n3ccnc3-c3ccc(OCC(=O)O)cc3)ccc2n1C 1775978909 XLMKWGSSMASEFS-ZDUSSCGKSA-N 392.415 2.943 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CC(=O)N(c2ccccc2)C1 11865978 SCIWDUXQDNVHBG-LJQANCHMSA-N 377.488 2.820 0 50 GFAA CCS(=O)(=O)N1C[C@H](C(=O)NCCC2=CCCCC2)Oc2ccccc21 13678227 NGCAONMVGNEXEY-GOSISDBHSA-N 378.494 2.610 0 50 GFAA CCc1c(O)nc(SCC(=O)Nc2cc(C)on2)n(-c2ccccc2)c1=O 15919276 RAEAPKBLZBIDGH-UHFFFAOYSA-N 386.433 2.528 0 50 GFAA CC(C)NC(=O)C1CCN(C(=O)c2ncn3c2CO[C@H](c2ccccc2)C3)CC1 169758538 KQHWTBJSNIYTCB-IBGZPJMESA-N 396.491 2.531 0 50 GFAA CCCNC(=O)c1cc2c(s1)CCOC21CCN(C(=O)c2ccon2)CC1 1857684349 KGYMGWUZJKODPY-UHFFFAOYSA-N 389.477 2.580 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)CCOC21CCN(Cc2cnc[nH]2)CC1 1857684865 IAYJXUHTVDQNJT-UHFFFAOYSA-N 386.521 2.818 0 50 GFAA CCc1c(C)cc(C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)c(=O)n1C 1857697910 QVJAJZDTFIIJTN-UHFFFAOYSA-N 390.487 2.887 0 50 GFAA CCS(=O)(=O)N1CCCOc2cccc(c2)CC[C@H]2CCCCN2CC1 1857698242 ZFRDDDXZLQYHFW-LJQANCHMSA-N 380.554 2.908 0 50 GFAA CCOC(=O)c1coc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857706106 KPNNXWNJVAMNGC-HXUWFJFHSA-N 384.436 2.709 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857717729 VQTGVPXAZCGSNO-QKLQHJQFSA-N 385.851 2.593 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3CCCC3)C[C@]23CC[C@H]1O3)C1Cc2ccccc2C1 1857719726 TYJVPEJNRHZHIZ-JVNMPXIPSA-N 380.532 2.940 0 50 GFAA CN(c1ccccc1)C1CCN(C(=O)c2csc(S(C)(=O)=O)c2)CC1 119149124 PFAKVRVCKSDJIS-UHFFFAOYSA-N 378.519 2.893 0 50 GFAA C[C@@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)(C)CN(C)C 121274550 JWRYNORHGOVLJN-GOSISDBHSA-N 389.588 2.706 0 50 GFAA CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2ccnn2C)cc1 451490444 LZBRAWWQUQJDMI-GOSISDBHSA-N 390.509 2.931 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCCC[C@@H]3[C@H](C)NC(=O)c3cocn3)n[nH]2)o1 1875342116 YFQSJCTVNJNEFA-SUMWQHHRSA-N 397.435 2.779 0 50 GFAA O=C(CCc1ccccc1C(F)(F)F)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875402373 DVGPWHCQGXNXRI-IAOVAPTHSA-N 381.398 2.790 0 50 GFAA CCc1nc2cc(F)ccc2cc1C(=O)N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O 1875400626 GSODPCRSGQXSOV-SMHULIPUSA-N 382.439 2.702 0 50 GFAA CS(=O)(=O)C1CC2(C1)CN(C(=O)C1(c3ccc(Cl)c(F)c3)CCC1)C2 1875405728 NDVGJIFKRHNCAC-UHFFFAOYSA-N 385.888 2.936 0 50 GFAA Cc1noc(C2(NC(=O)Nc3nnc(CCC(C)C)s3)CCOCC2)n1 888100378 FSEKADKQOSJZKD-UHFFFAOYSA-N 380.474 2.646 0 50 GFAA COc1cccc(OC)c1[C@H]1CCN(C(=O)c2ccc(Cn3cncn3)cc2)C1 2325786707 VYBDVUZVMPABGK-SFHVURJKSA-N 392.459 2.973 0 50 GFAA Cc1coc(C)c1C(=O)N1CCN(C2CN(C(=O)C[C@@H](C)CC(C)C)C2)CC1 2325794028 OOTXWXHXXCOZMA-INIZCTEOSA-N 389.540 2.937 0 50 GFAA CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(C(=O)OC)cc1 631166 FKSRAKXAFGLJRS-UHFFFAOYSA-N 387.432 2.834 0 50 GFAA O=C(CSc1nnnn1-c1ccccc1)Nc1nsc(-c2ccccc2)n1 1805648 PYDZEMJQGKSGPN-UHFFFAOYSA-N 395.473 2.912 0 50 GFAA CCCCOc1ccc(/C=c2/sc3nc(-c4cccnc4)nn3c2=O)cc1 1816395 XROYNFNYBCHWMQ-SFQUDFHCSA-N 378.457 2.940 0 50 GFAA O=C(Cn1nnc(-c2ccc(F)cc2)n1)NCc1ccccc1C(F)(F)F 4985023 LSSQXQTVZBLWJH-UHFFFAOYSA-N 379.317 2.814 0 50 GFAA COc1ccc(C)cc1NC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 6699027 CRCNLTDMSYFPJX-UHFFFAOYSA-N 389.477 2.542 0 50 GFAA CNC(=O)[C@H](C)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67871785 HOWABEFHAPSJQG-LBPRGKRZSA-N 383.473 2.998 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CNCCC3(O)CCCC3)C2=O)cc1 67894071 WJYFTOMSCUZPBJ-HSZRJFAPSA-N 388.552 2.948 0 50 GFAA COc1ccccc1N1CCN(CCc2ccc3c(c2)sc(=O)n3C)CC1 13779683 RTHIBOYVHBRSHH-UHFFFAOYSA-N 383.517 2.973 0 50 GFAA in-vitro CCOCCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccco3)nn2CC)C1 20201798 VLQQUJYIGWSYKR-MRXNPFEDSA-N 388.512 2.642 0 50 GFAA O=C(c1cccc2ccccc12)[C@H]1CCCN(C(=O)CCN2CCOCC2)C1 23366531 PFXMWZDJYDPSGB-IBGZPJMESA-N 380.488 2.983 0 50 GFAA CCC(=O)N(Cc1cccc(OCCN2CCOCC2)c1)Cc1ccccn1 20917718 NMEFKWXMSYCZGI-UHFFFAOYSA-N 383.492 2.731 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)CCC(=O)Nc2cccc(O)c2)C[C@H]1O 67650022 WAUCDJDPNUBYEK-IAGOWNOFSA-N 388.489 2.858 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCC[C@H](c3cc(=O)[nH]cn3)C2)cc1)C1CCC1 65376339 SYDBXDZDLIHRDY-INIZCTEOSA-N 380.448 2.528 0 50 GFAA COc1ccc(CN2C[C@@H](C(=O)O)C[C@H](C(=O)Nc3ccc(F)cc3)C2)cc1 71746899 IGGRHXFXBMEJJX-HOTGVXAUSA-N 386.423 2.996 0 50 GFAA CCc1noc([C@@H](C)N2CCN(C(=O)CCc3cn(C)c4ccccc34)CC2)n1 151272937 SEJDNSOEKDLLKQ-MRXNPFEDSA-N 395.507 2.962 0 50 GFAA Cc1cc(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)on1 71750535 SCVCHNCQUWOCCE-IBGZPJMESA-N 387.455 2.950 0 50 GFAA CN(C)CCCN1C(=O)CC[C@@H]2CN(C(=O)/C=C/c3cccc(F)c3)CC[C@@H]21 14878703 OXMSNTTYJKCDED-YJWJXRIHSA-N 387.499 2.630 0 50 GFAA Cc1ccc(Cn2nc(C)c(/C=C/C(=O)N3CCO[C@@H](CC(=O)O)C3)c2C)cc1 237842667 NYGGWTSGQILYRA-SGQUHAKNSA-N 397.475 2.572 0 50 GFAA C/C=C/c1ccc(OCC(=O)N2CCC[C@H](N(C)CC(=O)O)CC2)c(OC)c1 262937949 NAXBNUPQRXOJLM-YXMMZVCTSA-N 390.480 2.505 0 50 GFAA Cn1cc(CN2CCNC(=O)[C@@H]2CCO)c(-c2ccc(C3CCCCC3)cc2)n1 72475654 WUIBAEPEKVREIR-NRFANRHFSA-N 396.535 2.818 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)c2ccc(NC(=O)[C@H]3C[C@H]3C)cc2)CC1 378148923 KTEGLMCTYASSDQ-DYVFJYSZSA-N 397.479 2.618 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)c2ccccc2N2CCOCC2)CC1 509397350 RTADFWYUKHJREO-UHFFFAOYSA-N 395.503 2.884 0 50 GFAA CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)c2cnn(C3CCCC3)c2C)c1 131677934 YGXQEFAWFWQJEN-CYBMUJFWSA-N 390.509 2.706 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c1 82230675 XZRMCVRUSBPYGU-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CCOC(=O)[C@H](Oc1ccccc1OC)[C@H](O)c1ccc(OC)c(OC)c1 196166496 WXFAFGNQMYMUDX-RTBURBONSA-N 376.405 2.757 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@H]1CCCN(C(=O)CCc2ccccc2)C1 426571328 ADINDMVUIHIUBE-IBGZPJMESA-N 381.524 2.750 0 50 GFAA O=C(C[C@H]1C=CCC1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 95523029 MGTKMXPREZPSNZ-INIZCTEOSA-N 382.508 2.769 0 50 GFAA COCc1noc(CNC(=O)Nc2cccc(NC(=O)CC(C)C)c2C)n1 97711737 FWQPQVYIEZGXKJ-UHFFFAOYSA-N 375.429 2.831 0 50 GFAA O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCC[C@H](OCCO)C1 178656651 SHVWOCKADGTNRM-FQEVSTJZSA-N 395.459 2.527 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)c(OC)c1 95368211 DTBGUMGPYOAMHD-ZWKOTPCHSA-N 381.476 2.835 0 50 GFAA Cc1c(NC(=O)NC2CCN(CCc3ccccc3)CC2)cccc1C(N)=O 97474931 MQPMAXYUBWFFFX-UHFFFAOYSA-N 380.492 2.923 0 50 GFAA O[C@@H](COc1cccc(CN2CCCCCCCC2)c1)CN1CCOCC1 95521674 MTZCMVMCKRXYGS-OAQYLSRUSA-N 376.541 2.915 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)CCCc2nc(O)c3ccccc3n2)c1 252481435 CMEGGUOFRVDTEB-UHFFFAOYSA-N 394.431 2.665 0 50 GFAA Cc1noc([C@H]2CN(C(=O)Nc3cn(C)nc3C3CCCCC3)CCN2C)n1 297398312 MIYWGIJBXXBSAF-MRXNPFEDSA-N 387.488 2.680 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCC(n4ccnc4)CC3)C2)cc1 299530271 NBIXEACCNMFTKC-IBGZPJMESA-N 380.492 2.907 0 50 GFAA CCn1nc(-c2ccc(C(=O)N3CC(c4ccccn4)C3)cc2)nc1N(C)C 534591378 GBMFAQYPBJZZMX-UHFFFAOYSA-N 376.464 2.666 0 50 GFAA O=C([C@H]1CCCO1)N1CCC2(CC1)CN(Cc1ccc(Cl)s1)CCO2 827921082 HRJBJMKVLQWFRC-OAHLLOKOSA-N 384.929 2.774 0 50 GFAA Cc1ncc(CN2CCC(CNC(=O)COc3ccccc3Cl)CC2)[nH]1 827841864 WCXZOAXCHGDBLX-UHFFFAOYSA-N 376.888 2.779 0 50 GFAA COC(=O)C[C@@H](c1cccc(Oc2ncccn2)c1)c1c(O)cc(C)n(C)c1=O 824134532 GEAGCFSZYZSMAS-INIZCTEOSA-N 395.415 2.677 0 50 GFAA CC[C@H](C)C(=O)Nc1cccc(C(=O)NCc2nnnn2-c2ccccc2)c1 952982646 QJHZCKSIHCCQDB-AWEZNQCLSA-N 378.436 2.577 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(Cl)cc3)C[C@H]2CCC(=O)O)CC1 1565507274 HZNNRIWHQXDWFR-MJGOQNOKSA-N 379.932 2.643 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@H](Cc4ccccn4)[C@@H](O)C3)cc2c1 1615733613 KLHLJZVMNZSMIO-KKSFZXQISA-N 379.460 2.770 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C1=Cc2ccccc2OC=C1 1529191685 BSLTWQZWRWVSRJ-QGZVFWFLSA-N 399.472 2.788 0 50 GFAA OC[C@@]12CNC[C@H]1CN(Cc1nc3ccccc3n1Cc1ccccc1Cl)C2 1772700426 ARSKLWAWYBXBMK-JTSKRJEESA-N 396.922 2.752 0 50 GFAA CCCS(=O)(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 11841990 QCLIJJFDRHZTBU-SFHVURJKSA-N 386.464 2.519 0 50 GFAA O=C(CCc1nnc(Cc2ccc3c(c2)OCO3)o1)NCCc1cccc(F)c1 12441682 RUAOVJAGHSVGNS-UHFFFAOYSA-N 397.406 2.820 0 50 GFAA CCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 12860220 DBVQDANUBZUVIW-AWEZNQCLSA-N 383.423 2.957 0 50 GFAA Cc1nc2c(sc3nc(N4CCOCC4)c4c(c32)CC(C)(C)OC4)c(=O)[nH]1 13570331 YKJGOULFDPOUGR-UHFFFAOYSA-N 386.477 2.529 0 50 GFAA COC[C@@H]1CCCCN1Cc1nc(-c2ccc(OC)c(OC)c2OC)no1 14962626 LUTMKFVIUODRME-ZDUSSCGKSA-N 377.441 2.763 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2F)CCCN(C(=O)C2CCOCC2)C1 14971950 ODEYBUAWZNJDDK-NRFANRHFSA-N 377.456 2.967 0 50 GFAA O=C(O)[C@H]1CN(CC2CCCCC2)CC12CCN(C(=O)c1ccncc1)CC2 1857690633 IBMZGUPFBUNZQL-LJQANCHMSA-N 385.508 2.901 0 50 GFAA O=C(c1ccccc1OC(F)(F)C(F)F)N1CCO[C@@H]2C[C@H](CO)C[C@@H]21 1857695665 SUSIBJCYXYMBAR-SCDSUCTJSA-N 377.334 2.535 0 50 GFAA O=C1CCO[C@H]2CN(Cc3nc4ccccc4[nH]3)C[C@@H]2N1Cc1ccccc1 1857708983 XCBYOYFSFWBUSO-PMACEKPBSA-N 376.460 2.565 0 50 GFAA Cc1cc(C[C@@H]2CN(c3ccnc(-c4ccc5c(c4)OCO5)c3)C[C@H]2O)n[nH]1 1857717518 WZRHTOPHOPQUAP-DNVCBOLYSA-N 378.432 2.549 0 50 GFAA CCc1ccc(C(=O)N2C[C@@H]3[C@H](CNC(=O)C4CCC4)[C@H]4CC[C@]3(C2)O4)s1 1857738054 PPBXVOPBSZQLPV-BIZBXSGISA-N 388.533 2.846 0 50 GFAA O=C(c1ccccc1-c1ccccc1F)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1857738761 XLVBTELEIMVPLV-QVKFZJNVSA-N 377.419 2.958 0 50 GFAA Cc1nc(O)nc(O)c1CC(=O)N1C[C@H](C(C)(C)C)O[C@H](c2ccccc2)C1 1875247848 QUVGOAYFAQDYTH-DLBZAZTESA-N 385.464 2.754 0 50 GFAA C[C@H](O)Cc1nnc(SCC(=O)n2c3c(c4c2CCCC4)CCCC3)n1C 1077867 PZCFJMBQZCROEL-ZDUSSCGKSA-N 388.537 2.730 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)Cn2nc(C(F)(F)F)c(Cl)c2C)cn1 416094226 LMWMEFDUUGAGIE-UHFFFAOYSA-N 389.765 2.880 0 50 GFAA CC(=O)Nc1ccc(CNCCn2cc(C(=O)Nc3ccccc3C)nn2)cc1 12278617 JLUQECGXGKYCKQ-UHFFFAOYSA-N 392.463 2.587 0 50 GFAA C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)[C@@H]1CN 156631574 HGCRYQGRVRAIPS-DZGCQCFKSA-N 378.519 2.780 0 50 GFAA C[C@@H](O)c1cn(Cc2ccc(C(=O)N[C@@H](Cc3ccccc3)C3CC3)o2)nn1 1875317591 DTKKENSILILUKG-KDOFPFPSSA-N 380.448 2.724 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1cccc(-c2cc[nH]n2)c1 1875401310 IJSSMHQJVZQSQA-DOTOQJQBSA-N 378.436 2.524 0 50 GFAA Nc1ccc(-c2cc(Cl)c(Cl)c3[nH]c4c(c23)CN(C(=O)CO)CC4)cn1 1772820592 VVUOUIPXYFIWLE-UHFFFAOYSA-N 391.258 2.996 0 50 GFAA COc1ccc(-c2ccc(C(=O)NCc3cnn4c3CNCC4)c(F)c2)cc1 2325857139 QPAFXMYZYXDMSL-UHFFFAOYSA-N 380.423 2.731 0 50 GFAA CCOC(=O)C1=C(c2ccc(OC)cc2)NC(=O)N[C@H]1c1ccc2c(c1)OCO2 831854 UIOXYAFIQOEHQU-IBGZPJMESA-N 396.399 2.752 0 50 GFAA COc1ccccc1CNC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O 882463 DGMUZGRDGHLZOA-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSc2nnc(C3CCCCC3)n2N)cc1 1049771 CNHJMMGKDLYWED-UHFFFAOYSA-N 388.497 2.729 0 50 GFAA O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1cccc(NC(=O)c2ccco2)c1 1110841 JIWPWOKHNVBCBD-UHFFFAOYSA-N 375.340 2.668 0 50 GFAA CCCCc1nc(CN2CCc3nc(C4CCOCC4)nn3CC2)c(Cl)[nH]1 2356136219 KZQBCEBHQYLZKS-UHFFFAOYSA-N 392.935 2.950 0 50 GFAA O=C(O)c1c(N2C[C@H](O)[C@@H](N3CCCCC3)C2)noc1-c1ccc(Cl)cc1 2356144161 LGJADVSBIALZNE-GJZGRUSLSA-N 391.855 2.729 0 50 GFAA Cc1c(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)nc2ccccn12 2356145811 JGOZSBHPVDLVGI-QFIPXVFZSA-N 390.491 2.619 0 50 GFAA O=S(=O)(Cc1ccccc1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 2734890 SVIHWBSWZYMSCJ-UHFFFAOYSA-N 394.518 2.803 0 50 GFAA CC(C)[C@@H](NC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccccc1)C(=O)O 4769919 IGLVFZBSZQBERJ-XCMFGDQWSA-N 384.407 2.822 0 50 GFAA CSc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCCCC3)CC2)cc1 4986337 VUVQXUVOLVONCT-UHFFFAOYSA-N 382.551 2.822 0 50 GFAA COc1ccc(CCC(=O)NC[C@H](C)NC(=O)CCc2ccc(OC)cc2)cc1 6182939 LOBDPOWDLXHJPS-KRWDZBQOSA-N 398.503 2.890 0 50 GFAA O=C(Nc1cccc(N2C(=O)CCCC2=O)c1)c1ccc(-n2cncn2)cc1 225410627 QKKGHIYXIOSTQO-UHFFFAOYSA-N 375.388 2.563 0 50 GFAA COCCN1CCC(CN(Cc2cnc(SC)nc2)C[C@@H]2CCCO2)CC1 55270884 VNYOJZCAIRFJSV-IBGZPJMESA-N 394.585 2.538 0 50 GFAA O=C1CCCN1CC[C@H]1CCCCN1c1ncnc2sc3c(c12)CCNC3 65531792 RLUFYKDTBWYWKL-CQSZACIVSA-N 385.537 2.708 0 50 GFAA O=C(c1nc2sccn2c1CN1CCC(O)CC1)N1CCCCCCC1 20866995 GJOHRXVGIBYQLF-UHFFFAOYSA-N 376.526 2.759 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)[C@@H]2OCCc3ccccc32)cc1 136714552 ZQVGBEFPYCAUSL-LJQANCHMSA-N 388.489 2.968 0 50 GFAA CCc1cn[nH]c1C1CCN(C(=O)c2cnc3sc(C)c(C)n3c2=O)CC1 67725485 RLXMRBKYHCQURQ-UHFFFAOYSA-N 385.493 2.678 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 72437443 YSNOXPJLNGGYKD-CQSZACIVSA-N 382.482 2.604 0 50 GFAA O=C(c1cc(-n2cnnn2)ccc1O)N1CCC[C@@H](CCc2ccc(F)cc2)C1 71497960 MWGHKBRMVSNHQS-INIZCTEOSA-N 395.438 2.992 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)Nc1cnn(C[C@H]2CCCO2)c1 363435741 WFTCAVQZMSKXSA-LJQANCHMSA-N 397.479 2.506 0 50 GFAA O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@@H](N2CCCS2(=O)=O)C1 366930412 RWOHCDGLMXJHBT-OAHLLOKOSA-N 381.473 2.735 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)N2Cc3ccccc3N(C)C[C@@H]2C)c1 488221071 RGYNWOOSSNGHRD-INIZCTEOSA-N 396.491 2.935 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@H](CNC(=O)[C@H]2CCCN(C)C2)O3)n1 39358015 BVPRELCESISOTN-PKOBYXMFSA-N 380.492 2.522 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(C(=O)CCC3CC3)CC2)C1 71388775 JHDVAMKMGWTHOR-IBGZPJMESA-N 398.551 2.591 0 50 GFAA Cn1cc([C@H]2CN(c3cc(N4CCCCC4)ncn3)CC23CCOCC3)cn1 333672698 JFMKRXUTSQNNKC-GOSISDBHSA-N 382.512 2.601 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@H](c2ccc(OC)nc2)C2CC(O)C2)s1 222921293 ANMNJXKYLNYTPM-SSDMNJCBSA-N 376.482 2.529 0 50 GFAA C[C@@]1(C(=O)NCCCn2cc(Cl)cn2)CC1(Br)Br 17081731 OEFFEJJDPZVYOR-JTQLQIEISA-N 399.514 2.939 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2[C@@H](C)CCC[C@H]2C)c1C(=O)OC(C)C 17080893 GAENXTZOLUPPIX-TXEJJXNPSA-N 395.525 2.922 0 50 GFAA Cc1cnn(C[C@H]2CN(C(=O)c3ccccc3NCc3cccnc3)CCO2)c1 176145183 ILJWOQSEGOXPJX-LJQANCHMSA-N 391.475 2.740 0 50 GFAA COc1cc(F)ccc1[C@H](C(=O)O)N1CCC(CCN2CCCC2=O)CC1 95390613 NGWNKHFVIUSDMY-LJQANCHMSA-N 378.444 2.685 0 50 GFAA CCN(CC)C(=O)c1cccc(S(=O)(=O)N(C)CC[C@@H]2CCCCO2)c1 95361749 QDOSCTIWFKHJMB-KRWDZBQOSA-N 382.526 2.748 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3ccc(CCC(C)(C)O)cc3)C[C@@H]2N)cc1 91625835 WVOCIEOBISQBHA-RTWAWAEBSA-N 382.504 2.966 0 50 GFAA O=C(CN1CCC[C@@H](c2ccccc2)C1)NCc1ccccc1-n1cncn1 95384846 FSBWEVBAFRIZKF-HXUWFJFHSA-N 375.476 2.763 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N[C@H]3CCCN(C(=O)C4CC4)C3)cc2)c(N)n1 426674417 XUSGBZNYNKNQBH-SFHVURJKSA-N 378.476 2.770 0 50 GFAA O=C(CCCc1cn[nH]c1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95374526 DFOVTMOMVWIGHZ-KSEOMHKRSA-N 380.492 2.527 0 50 GFAA NC(=O)N[C@H](CC(=O)N1CC[C@H](C(=O)O)C1)c1cccc(Oc2ccccc2)c1 299743361 NIHPNQRIIALQKP-MAUKXSAKSA-N 397.431 2.512 0 50 GFAA O=C(CN1CCC(NC(=O)Nc2ccc(-c3ccco3)cc2)CC1)NC1CC1 299769763 PSYBDRHHAVOMQH-UHFFFAOYSA-N 382.464 2.811 0 50 GFAA CC[C@H](C)n1cc(C(=O)NCc2ccco2)c(=O)c(C(=O)NCC(F)(F)F)c1 299797557 BGEBGNHQMRRJTG-NSHDSACASA-N 399.369 2.634 0 50 GFAA O=C1CO[C@H](CNc2nc3ccccc3o2)CN1CC1CCN(CC2CC2)CC1 299780017 SLNGXWOEDXXLMN-GOSISDBHSA-N 398.507 2.589 0 50 GFAA Cn1nccc1CN1CCOC2(CCN(Cc3cccc4ncccc34)CC2)C1 825660968 OVKIWRCQUORQSI-UHFFFAOYSA-N 391.519 2.835 0 50 GFAA O=C(NCCCn1ccccc1=O)c1cccc(-c2cnn(CC3CC3)c2)c1 584887770 GQASQSSVPXZXNB-UHFFFAOYSA-N 376.460 2.942 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@@H]2CC[C@H]1CN(CC(=O)N(C)C)C2 1073380526 VUKWXOBKXKZZGC-CABCVRRESA-N 378.904 2.665 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CC[C@@H]1Cc2ccccc2NC1=O 268959626 XGYOKSGNVWCOIR-APWZRJJASA-N 378.428 2.616 0 50 GFAA Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)[C@H](C(N)=O)c1ccccc1 275432383 GIYHQJGMHQZYBD-BQFCYCMXSA-N 376.501 2.522 0 50 GFAA Cn1cc(-c2oncc2C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cn1 170607863 WPWDQYRXSNVPQU-UHFFFAOYSA-N 385.855 2.687 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 192145972 SQTZCPPILLKJOR-CYBMUJFWSA-N 375.856 2.899 0 50 GFAA Cc1ccc(NC(=O)[C@H]2COCCN2CC2CCC2)cc1C(=O)N(C)C(C)C 192551077 OOVMXOSZLDYNJU-HXUWFJFHSA-N 387.524 2.915 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)Nc3nc(-c4cnn(C)c4)cs3)CC2=O)cc1F 741608923 YFOHTCBMMCMLQA-LBPRGKRZSA-N 399.451 2.983 0 50 GFAA COc1cc(OC2CC2)ccc1C(=O)N1CCC([C@H](O)c2nccn2C)CC1 790799941 JRJQXZCMRGUNDW-IBGZPJMESA-N 385.464 2.556 0 50 GFAA COc1ccc2[nH]cc(C(=O)N3CCC[C@H](C(=O)c4ccccn4)C3)c(=O)c2c1 1506425912 SMZIZHVZDAJHRW-AWEZNQCLSA-N 391.427 2.667 0 50 GFAA Cc1n[nH]cc1C(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 11663719 LBZOFAKPUXALDN-FQEVSTJZSA-N 388.418 2.651 0 50 GFAA O=C(NCCc1nc(-c2ccccc2)no1)[C@H]1CCC(=O)N(C2CCCC2)C1 12708006 QRGPUTYSOSRGPZ-INIZCTEOSA-N 382.464 2.577 0 50 GFAA COc1ccc(OC)c(C(=O)NC[C@H]2Cc3cc(-c4cnccn4)ccc3O2)c1 14883057 FFLPDXWIRLRXCU-QGZVFWFLSA-N 391.427 2.894 0 50 GFAA CCc1ccc(CN2CCc3nnc(CCNC(=O)C4CCCCC4)n3CC2)o1 14886571 DJWCJJYJYMBGRH-UHFFFAOYSA-N 399.539 2.731 0 50 GFAA O=C(Nc1cccnc1)[C@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860254 KTGXFRCYPBHWRV-HNNXBMFYSA-N 393.896 2.916 0 50 GFAA CCOc1ccc([C@H]2NC(=O)N(Cc3c(C)noc3C)C3=C2C(=O)OC3)cc1 169760851 DGHUTKWYSWHXAF-GOSISDBHSA-N 383.404 2.768 0 50 GFAA Cc1cccc(OCC(=O)N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)c1 169772318 KPXLAVZJLPXPGA-UHFFFAOYSA-N 394.397 2.840 0 50 GFAA COc1cccc(-c2nccn2-c2cccc3c2nnn3C)c1O[C@H](C)C(=O)O 1857689687 KCRMJMKMXCVZJZ-GFCCVEGCSA-N 393.403 2.682 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)c(C)o1 1857694752 WDHGZDZTQFXKOB-PMACEKPBSA-N 386.496 2.698 0 50 GFAA Cc1nc(CCNC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)no1 1857717374 MYXFSXDSZRSXQC-GFCCVEGCSA-N 389.843 2.748 0 50 GFAA COc1cccc(OCc2nc([C@H]3C[C@@H](N)[C@H](O)C3)n(-c3cccc(F)c3)n2)c1 1857717634 QQKZTRNYPRVIHF-MJXNMMHHSA-N 398.438 2.560 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2CC[C@@]34OCCCN3C(=O)C[C@@H]24)c1 1857732439 QRFYALCSYVEDET-OFNKIYASSA-N 392.455 2.926 0 50 GFAA Cc1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2[C@H](C)O)sc1Br 408425358 FTOXCVKUROQKHU-INTQDDNPSA-N 382.345 2.989 0 50 GFAA O=C1C[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1 132616215 UVBAAFHZFZTPTH-SJORKVTESA-N 380.448 2.745 0 50 GFAA COc1cc(CN2CC[C@H](Nc3ncncc3Br)C2)cc(OC)c1 481961247 YGQYRMXCXWATQR-ZDUSSCGKSA-N 393.285 2.943 0 50 GFAA Cc1cn(-c2ccccc2)nc1C(=O)N1CC=C(C2(C(=O)O)CCOCC2)CC1 1875293770 BJNMHDSQSXBYEN-UHFFFAOYSA-N 395.459 2.834 0 50 GFAA O=C(NC[C@H](c1ccccc1)C(F)F)N[C@H](CCc1ccncc1)C(=O)O 1875291005 LEDVTDYDPXPINH-HZPDHXFCSA-N 377.391 2.816 0 50 GFAA C[C@@H](CC(=O)NCc1cn([C@H]2C[C@H](C(=O)O)C2)nn1)Cc1ccc(Cl)cc1 1875306132 UQPAMCMMEGLOQO-SUYBPPKGSA-N 390.871 2.852 0 50 GFAA C=CC(=O)NCCC[C@@H]1[C@@H](C)CCCN1C(=O)Cc1ccc2c(cnn2C)c1 1875386272 MCIXONNVEBNHKD-QFBILLFUSA-N 382.508 2.825 0 50 GFAA COc1ccc(C)cc1CCNC(=O)N1CCC[C@@]12CCC[S@@](=N)(=O)C2 1875393791 SWLAQFKJKMTTAX-AFMDSPMNSA-N 379.526 2.931 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)c1c[nH]nc1[C@H]1CCCNC1)CC3 1875315218 LMWXWLVQQGWFBP-LSDHHAIUSA-N 377.492 2.954 0 50 GFAA Cc1nnc(CN(C)C(=O)Nc2ccc(OCC(=O)N(C)C)c(Cl)c2)s1 888101929 PAAJHUUDMNQISH-UHFFFAOYSA-N 397.888 2.631 0 50 GFAA O=C1C[C@@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c1cccc(F)c1 20350883 MRNOCDDCSWDWNS-WKOQKXSESA-N 393.462 2.789 0 50 GFAA NCC1(c2ccccc2)CCN(C(=O)c2ccc(-n3cncn3)c(F)c2)CC1 2325769219 YVEGFALHHRDJPO-UHFFFAOYSA-N 379.439 2.539 0 50 GFAA O=C(C[C@H]1CN(C(=O)c2ccccc2)C2(CCC2)CO1)N1CC[C@]2(CCCO2)C1 2325785301 PAWUENTUBNVIPI-WMZHIEFXSA-N 398.503 2.622 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 670775 JIHWHVATVAGZST-UHFFFAOYSA-N 376.478 2.907 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](NCCc3ccc(OC)c(OC)c3)C2=O)cc1 852356 RZOOTQVPEHNXEY-SFHVURJKSA-N 398.459 2.567 0 50 GFAA CCN1C(=O)[C@@](O)(CC(=O)c2cccnc2)c2cc(Br)ccc21 4555022 OFHSWUFAUSPNAW-QGZVFWFLSA-N 375.222 2.671 0 50 GFAA O=C(c1csc(C2CC2)n1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 112622803 PAFYHUOYPRPJHG-SFHVURJKSA-N 396.516 2.584 0 50 GFAA Cn1nccc1C(=O)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67714108 RKFAWYKPIFYVEZ-UHFFFAOYSA-N 384.823 2.876 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCc3cccs3)C2=O)c1 67921863 NKOBBYYSWSLDAA-LJQANCHMSA-N 378.469 2.539 0 50 GFAA O=C(Cc1cc2ccccc2[nH]c1=O)N[C@H]1CCN(c2ncccc2Cl)C1 137403864 WWNIVDLZRSNLKS-HNNXBMFYSA-N 382.851 2.514 0 50 GFAA COC[C@H](COCCCNC(=O)Nc1ccc(Br)cc1)OC 2052858 PBLKEPUESQCABM-CQSZACIVSA-N 375.263 2.639 0 50 GFAA Cc1ccc(C(=O)O)cc1NC(=O)c1cc2ncc(Br)cn2n1 2793331 GHLILXWQVHXGHP-UHFFFAOYSA-N 375.182 2.751 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1cnn(Cc2ccc(F)cc2Cl)c1 2805025 WTJOAORPZLAWOY-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)c2cc3ccccc3oc2=O)cc1OC 4581003 MRZOHXVESLCTCR-HNNXBMFYSA-N 397.383 2.756 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)c2cncs2)C[C@H]1c1ccc(Br)cc1 425011190 PUPNPCZPCLDYNS-QWHCGFSZSA-N 395.278 2.934 0 50 GFAA CC(=O)N1CCN(C(=O)[C@@H](C)NCC2(c3cccc(C)c3)CCCCC2)CC1 120441009 COYTWYWMEZDCSA-LJQANCHMSA-N 385.552 2.866 0 50 GFAA CCN(CC)C(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72131858 BKUAMDGKLQSHIZ-QFIPXVFZSA-N 393.531 2.877 0 50 GFAA CC(C)(C)NC(=O)c1cccc(NC(=O)N2CCO[C@H]([C@@H]3CCCO3)C2)c1 363962105 PWXPXJZCIMHGRV-IRXDYDNUSA-N 375.469 2.627 0 50 GFAA CC(=O)N(Cc1noc(C(C)C)n1)[C@@H]1CCN(c2ccc(OC(F)F)cn2)C1 364295707 ADLUTMVUIZQXMQ-CYBMUJFWSA-N 395.410 2.817 0 50 GFAA CCN1CC2(CCN(C(=O)c3cnc(-c4ccccc4)nc3C)CC2)OC1=O 77321498 FEDSXFOZIDJYER-UHFFFAOYSA-N 380.448 2.899 0 50 GFAA CC(C)[C@@H](CO)NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1 72125425 JMRZEBDLWSXBMU-JOCHJYFZSA-N 380.532 2.832 0 50 GFAA O=C(c1cnc2nc(O)nc(O)c2c1)N1CCC[C@H](c2ccc(F)cc2)CC1 378494655 XIUNDGCFFSFURI-LBPRGKRZSA-N 382.395 2.985 0 50 GFAA COCCOc1c(Cl)cc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1Cl 263060563 OLOHCETVTLAKRF-VIFPVBQESA-N 377.224 2.957 0 50 GFAA CCOc1ccccc1CN1CCNC(=O)[C@H]1CC(=O)N1CCCCCCC1 14949487 VBPSOVWRNPGWGM-LJQANCHMSA-N 387.524 2.569 0 50 GFAA Cc1c(C(=O)N(CC(=O)O)C2CCOCC2)cnn1-c1cccc(Cl)c1 237727519 ADEXZHUEPPFEDN-UHFFFAOYSA-N 377.828 2.540 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C[C@@H](C)O1 229763980 KYBWEQXGFHZWMO-JZXOWHBKSA-N 385.508 2.887 0 50 GFAA CC1(C)Cc2cc(CNC(=O)N3CCC[C@@H](c4cc(O)ncn4)C3)ccc2O1 426415283 GJUVLADCFUTSHI-OAHLLOKOSA-N 382.464 2.985 0 50 GFAA COc1ccc(C2(C(=O)NCCc3csc(N)n3)CCCC2)cc1OC 426597179 FMKQNNODHOYLIU-UHFFFAOYSA-N 375.494 2.913 0 50 GFAA Cc1cc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)c2cnn(C(C)C)c2n1 176676407 SZOWXXFZDRDRGJ-GOSISDBHSA-N 398.555 2.563 0 50 GFAA C=CCOC(=O)CNCCNC(=O)OCC1c2ccccc2-c2ccccc21 147617239 DJKAWYLXAYJHDC-UHFFFAOYSA-N 380.444 2.844 0 50 GFAA CCn1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)c(C)n1 95383699 LMNUPZPTWDXYJY-GOSISDBHSA-N 378.480 2.871 0 50 GFAA CN(CC(=O)N(C)C)C[C@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1 95530410 GZAOJJSVSHCKFQ-QGZVFWFLSA-N 385.474 2.980 0 50 GFAA CC(C)(C)CN1CCC[C@]2(CCN(c3cc(C(=O)NC4CC4)ccn3)C2)C1=O 426685212 AZWFIAJBLFBGLC-JOCHJYFZSA-N 384.524 2.839 0 50 GFAA COc1ccc(C2(CNC(=O)c3ccc(-n4cnnc4)nc3)CCCC2)cc1 97681905 SYFUYICTTAZFNC-UHFFFAOYSA-N 377.448 2.913 0 50 GFAA C[C@H](Cc1ccc2c(c1)OCO2)c1cn(Cc2nnc3n2CCCCC3)nn1 91602362 RJBLGFAZKJZSQQ-CQSZACIVSA-N 380.452 2.719 0 50 GFAA COc1cc(C(=O)N2CCOC3(CCCC3)C2)ccc1OC1CCN(C)CC1 95506859 POHIKOYGBIKNJH-UHFFFAOYSA-N 388.508 2.953 0 50 GFAA Nc1ncc(-c2cc(C(=O)N3CCCOCC3)c3cc(Cl)ccc3n2)cn1 23479207 XIDPINQFBVCSRM-UHFFFAOYSA-N 383.839 2.790 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N(C)C[C@H]3CCCC[C@@H]3O)CC2)cc1 182659915 ARMSKQVLFYZTLC-QUCCMNQESA-N 387.524 2.792 0 50 GFAA COC(=O)c1nc(-c2ccccc2)oc1S(=O)(=O)NCc1ccc(F)cc1 824216719 OYFSSFNTLMYYOJ-UHFFFAOYSA-N 390.392 2.746 0 50 GFAA Cc1ccc2nc(C)c(C)c(C(=O)NCc3ccc(S(N)(=O)=O)cc3)c2c1 825206789 JQVIVYNYJBWMHW-UHFFFAOYSA-N 383.473 2.737 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)Nc1ccc(CC(=O)NC3CC3)cc1)CC(=O)N2 824750812 ATHTXEPERZRLFV-GOSISDBHSA-N 393.443 2.581 0 50 GFAA COCCN1C[C@@H](C(=O)N2CCC(Oc3cccc(Cl)c3)CC2)CCC1=O 824412450 UAQQYSAFIZJBHN-HNNXBMFYSA-N 394.899 2.595 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)NC[C@@H]1CCOC1)CC2 276602598 VOLYSZAWROGJEG-WMZOPIPTSA-N 391.537 2.697 0 50 GFAA CN1CC[C@H](NC(=O)N2CCc3ccnc(O)c3C2)[C@@H]1c1ccc(F)c(F)c1 277101037 OZQFWZKIQMFLHD-ROUUACIJSA-N 388.418 2.579 0 50 GFAA O=C(NCc1ccc(CN2CCOCC2)o1)[C@H]1C[C@@H]1c1cccc(F)c1F 170595051 HBLGASAMKCYBIC-SJORKVTESA-N 376.403 2.810 0 50 GFAA C[C@@H]1C[C@H]1[C@H](NC(=O)Cn1nc2n(c1=O)CCCCC2)c1ccc(Cl)cc1 170640574 AEVLHFKWGHQRGH-VVFCZOMOSA-N 388.899 2.938 0 50 GFAA CC[C@H](C)[C@H](NC(=O)Cc1c(-c2ccccc2)oc2c(=O)cc(C)oc12)C(N)=O 1772492990 MBAOWNTVDZFHQZ-SGTLLEGYSA-N 396.443 2.920 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCN(C(C)C)CC2)nc1 11663890 MMNVQUTYUXRCOK-UHFFFAOYSA-N 398.555 2.752 0 50 GFAA C[C@H](c1ccncn1)N(C)c1nc2nonc2nc1N(C)Cc1ccccc1 11812825 PKOOHGKRIWGUPT-CYBMUJFWSA-N 376.424 2.637 0 50 GFAA CC(C)(C)CN1CCC[C@]2(CCN(C(=O)Cn3c(=O)oc4ccccc43)C2)C1 11879660 BLWNQIKAJAGKHK-QFIPXVFZSA-N 385.508 2.955 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)C4(C)CC4)C3)C2=O)c1OC 12197546 QCJOJUBGOBQLPA-JOCHJYFZSA-N 386.492 2.845 0 50 GFAA CCOC(=O)CN(C)C(=O)Cc1c2c(n(Cc3ccccc3)c1C)CCCC2=O 12711658 ZKOGXVJFJBRDDY-UHFFFAOYSA-N 396.487 2.928 0 50 GFAA Cn1c(CNC(=O)c2nnn(-c3ccccc3)c2-n2cccc2)nc2ccccc21 206648771 ICBXJMHLNZTBBH-UHFFFAOYSA-N 397.442 2.875 0 50 GFAA Cc1cccc(CN2CCC3(CC2)CN(Cc2ncc[nH]2)C[C@@H]3C(=O)O)c1F 1857688190 WTNNTVBBNJVIDQ-QGZVFWFLSA-N 386.471 2.656 0 50 GFAA CC(C)=CCCN1C[C@@H]2[C@H](CNC(=O)c3cc(C)nc(C)n3)[C@H]3CC[C@]2(C1)O3 1857734710 NUWJFNDNTUSUKZ-XHYAQGIWSA-N 384.524 2.659 0 50 GFAA CCCCN1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NCCn2ccnn2)C1 1875243149 SLQLWKUTLDUWCS-QFIPXVFZSA-N 395.555 2.559 0 50 GFAA CC(C)[C@H]1CN(Cc2cnc(N(C)CC(=O)O)nc2)C[C@@H](c2ccccc2)O1 1875247822 PUKIHNRSJABHKS-MOPGFXCFSA-N 384.480 2.596 0 50 GFAA COc1ncc(COC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c(C)n1 838087362 BNMQUWWOLIXGLG-FVQBIDKESA-N 391.468 2.872 0 50 GFAA C[C@H](NC(=O)C(=O)N[C@H]1C[C@H]2C=C[C@H]1CC2)c1ccc(-c2cncnc2)cc1 1875271406 FNOQEZABRPAZKR-OFVDUGFESA-N 376.460 2.792 0 50 GFAA CC(C)[C@@H](C(=O)N[C@H](C)C1CCN(C(=O)c2cc3cnccc3[nH]2)CC1)N(C)C 1875332432 RPCGUHJSKCVRPD-QRWLVFNGSA-N 399.539 2.506 0 50 GFAA CCOc1cccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397081 KOXWVWOJPVJAGU-GOSISDBHSA-N 397.523 2.562 0 50 GFAA O=C(O)[C@H](CC1CC(F)(F)C1)NC(=O)[C@H](c1ccccc1)N1CCCCC1=O 1875305557 FDFQTRXQFWGSAN-RDJZCZTQSA-N 394.418 2.745 0 50 GFAA COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2-c2ccc(F)cc2)cc1 1073145 ZFSNDPTUFUVHRS-UHFFFAOYSA-N 379.391 2.843 0 50 GFAA biogenic O=C(CN1CC(F)(F)C[C@@H]1CCO)N1CC=C(c2c[nH]c3ccccc23)CC1 2325808730 FETOLDPRQLAZAH-INIZCTEOSA-N 389.446 2.876 0 50 GFAA Cc1nc(C2CC2)ccc1C(=O)NC[C@@H](C)n1cc(-c2cn(C)nc2C)nn1 2325865784 QJYNPDKVCLHVOI-GFCCVEGCSA-N 379.468 2.559 0 50 GFAA O=C(NC(=S)Nc1cccnc1)c1cccc(I)c1 1170177 FRSZXSGFOBBANK-UHFFFAOYSA-N 383.214 2.813 0 50 GFAA COc1cc(-c2o[nH]c(=N[C@@H](C)Cn3nc(C)cc3C)c2C(=O)O)ccc1F 2356163239 TVLIYCMUVAZDCF-NSHDSACASA-N 388.399 2.923 0 50 GFAA CCOC(=O)c1cc(NC(=O)COc2ccccc2)ccc1N1CCOCC1 4705141 UYFDSMAMLVWCTN-UHFFFAOYSA-N 384.432 2.717 0 50 GFAA CC1=C[C@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@H]4[C@]2(O)[C@H]1O)[C@H]1[C@@H](C[C@H]3C)C1(C)C 101725491 ONMDPPVVEFWDOD-DVBBJZJXSA-N 388.504 2.614 0 50 GFAA COCCNC(=O)[C@@H]1C[C@@H](Sc2ccc(F)cc2)CN1Cc1cccnc1 59322789 JODBLGJKABYINS-MOPGFXCFSA-N 389.496 2.719 0 50 GFAA COc1ccc(NC(=O)CC(=O)N(C)[C@@H](CN(C)C)c2ccccc2)c(OC)c1 55042433 JEBRVRNIJNCIGD-IBGZPJMESA-N 399.491 2.794 0 50 GFAA CCn1ccnc1CN(C)C[C@@]1(O)CCCN(CCC2CCCCC2)C1=O 67674464 DVIUEPLTSRHYTE-NRFANRHFSA-N 376.545 2.659 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)N[C@@H](C(=O)O)c1ccccc1 61720180 MISCWZKSLHWPOJ-LJQANCHMSA-N 397.818 2.506 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)Nc3ccc(C)c(F)c3)nn2)n1 65363834 GWJOQGIANWQNJR-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA CNS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)Cc2ccc(C)c(F)c2)c1 252509781 YVIGJNARNJEFPQ-UHFFFAOYSA-N 384.860 2.968 0 50 GFAA CCC1(CC)NC(=O)N(CC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1=O 121348111 XJAXPDRXASAEMK-SFHVURJKSA-N 398.438 2.537 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)c1cccc2c1CCC2 122059550 ZOKGKOKAFWIJBI-OAHLLOKOSA-N 385.489 2.861 0 50 GFAA COc1cc(N2CCC[C@@H](N(C)CCc3ccc(OC)c(OC)c3)C2)ncn1 72170463 GBYBMSSBHBXIOS-QGZVFWFLSA-N 386.496 2.646 0 50 GFAA CN(C[C@H](O)COc1cccc(CN2CCC(CO)CC2)c1)C1CCCCC1 14977445 UJHHFBXVMNQOMH-QFIPXVFZSA-N 390.568 2.895 0 50 GFAA O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@H]1CN(Cc2ccccc2)CCO1 156148648 PXDMCLKDBSLMLG-HXUWFJFHSA-N 390.443 2.689 0 50 GFAA COc1cc(OC)cc(N2CCC(NC(=O)[C@H]3CCN(C)[C@@H](C)C3)CC2)c1 368162303 ITJZXLHHHDBIBS-HOTGVXAUSA-N 375.513 2.519 0 50 GFAA CC(=O)c1cc(CN2CCOC[C@@H]2CC(=O)Nc2cccc(F)c2C)n(C)c1 72423470 KSRYLEZNUOEHLM-SFHVURJKSA-N 387.455 2.905 0 50 GFAA O=C(N[C@H]1CCCc2c1cnn2CCO)c1occc1COc1ccccc1 372267288 QAEAZFQNSWSTCH-SFHVURJKSA-N 381.432 2.855 0 50 GFAA C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC[C@@H](c2ccnc(N)n2)C1 241383350 MUPOAQNQOQBHTP-UOSJIABYSA-N 383.540 2.712 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1ccc2c(c1)OCO2 71283889 AUCFXSBHSKRPAO-UHFFFAOYSA-N 383.791 2.931 0 50 GFAA CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccnc2)CC1 242346954 ZKOWLIRKPCQQET-UIFIKXQLSA-N 398.551 2.798 0 50 GFAA Cc1ccc(F)cc1NC(=O)CNc1nc(-c2cccnc2)nc2c1CNC2 72143468 XPJYUFRAWVJLKL-UHFFFAOYSA-N 378.411 2.640 0 50 GFAA CC(C)Cc1nnc(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)s1 44920159 YZLBEOWTZRLNBM-UHFFFAOYSA-N 387.440 2.738 0 50 GFAA Cc1cc(N2CCCN(c3nccc(-c4c(C)nn(C)c4C)n3)CC2)ccn1 48187870 RXZAPTQKNFLQIF-UHFFFAOYSA-N 377.496 2.914 0 50 GFAA Cc1nc(-c2cccc(NC(=O)NC3CCC(S(C)(=O)=O)CC3)c2)no1 175662464 FYHHLOPSZVNXKR-UHFFFAOYSA-N 378.454 2.522 0 50 GFAA COC[C@H](NC(=O)N1CCC(NC(=O)c2ccccc2C)CC1)c1ccco1 175753818 LNFHMPPFPJOTGN-SFHVURJKSA-N 385.464 2.880 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)NCc2ccc3c(c2)CCCO3)CC1=O 223742016 KJAIRILZOKDRFG-KRWDZBQOSA-N 380.444 2.690 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@H](C)Oc4ccc(C)cc43)ccc21 177596265 ROTXVRWMEBTCIC-AWEZNQCLSA-N 386.473 2.880 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(Cc1ccc(-n3cccn3)cc1)CC2 91818647 FCENQINUWDCJPE-UHFFFAOYSA-N 376.508 2.965 0 50 GFAA CCc1nn(C)c(NC(=O)N2CCC[C@@]3(C2)C(=O)N(C)c2ccccc23)c1C 96149178 CEUUJYOXALWCOH-NRFANRHFSA-N 381.480 2.833 0 50 GFAA COc1ccccc1-n1cc(C(=O)N(C)Cc2nc(-c3cccnc3)no2)cn1 91665402 NCEYQUZAZPSQFH-UHFFFAOYSA-N 390.403 2.598 0 50 GFAA CN(C)CCN(C)C(=O)c1cccc(OC2CCN(c3ccncc3)CC2)c1 96165621 BMEMNPAGIFLDAM-UHFFFAOYSA-N 382.508 2.763 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3C[C@@H](C(=O)O)[C@H](c4ccccn4)C3)[nH]n2)cc1 97785483 ZACNIXOGWNESHW-HZPDHXFCSA-N 376.416 2.721 0 50 GFAA O=C(N1CCCC1)N1CC[C@]2(O)CCN(Cc3ccc(Cl)s3)C[C@@H]2C1 95392265 YHLHSYLWSAKFLJ-RDTXWAMCSA-N 383.945 2.876 0 50 GFAA COc1c(F)c(F)c(CN2C[C@H]3CC[C@@H]2CN(C(=O)N(C)C)C3)c(F)c1F 95363367 HWHUNDDYPHZEHQ-GHMZBOCLSA-N 389.393 2.829 0 50 GFAA Cc1nc[nH]c1CSCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 534576706 YKNNYZKJHGMKOL-GOSISDBHSA-N 387.553 2.867 0 50 GFAA CC(C)=CCN1CCC(N2C[C@@H](COc3ccc(F)cc3)OCC2=O)CC1 299797353 ONBNSBABWMRYCN-FQEVSTJZSA-N 376.472 2.863 0 50 GFAA CCOc1ccc(S(=O)(=O)NCc2nncn2C2CCCCC2)cc1C 823380619 MCXVHBREKBYKNK-UHFFFAOYSA-N 378.498 2.969 0 50 GFAA c1cc(OCCN2CCOCC2)ccc1CN1CCCN(C2CCCC2)CC1 952984304 ZOYKSNBPODRWHC-UHFFFAOYSA-N 387.568 2.848 0 50 GFAA COc1ccc(/C=C/CN[C@H]2C3CN4CCN(C3)CC2(c2ccccc2)C4)cc1 952984311 KBEYMKBKIFLJKL-LZTDRJJHSA-N 389.543 2.866 0 50 GFAA NC(=O)COc1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1Cl 952974280 VOHDBBOLZVBZBW-UHFFFAOYSA-N 395.290 2.575 0 50 GFAA Cc1ccc(C(=O)NCC(C)C)cc1NC(=O)[C@@H]1CCCN(C(=O)N(C)C)C1 952980057 FBKNAIQIRYCHTM-QGZVFWFLSA-N 388.512 2.713 0 50 GFAA Cc1nccc(N2CCN(C(=O)c3occc3COc3ccccc3)CC2)n1 185430175 LLYFIZKDLDRXKC-UHFFFAOYSA-N 378.432 2.919 0 50 GFAA Cc1ccc(C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)c(O)c1 277649550 XZKXMWYZKQXHQI-IFXJQAMLSA-N 384.480 2.552 0 50 GFAA CC(C)N1CCC(NC(=O)[C@H](C)SCC(=O)Nc2ccc(F)cc2)CC1 170120587 XZRRTMSHZRQGLG-AWEZNQCLSA-N 381.517 2.875 0 50 GFAA Cc1cnn(-c2ccc(OC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)cc2)c1 170609430 VMNYSIZBRXIYSO-UHFFFAOYSA-N 397.456 2.722 0 50 GFAA O=C(c1ccc(N[C@@H]2CCCN(Cc3ccc(F)cc3)C2)nc1)N1CCOCC1 1704356716 ISJFQDMGYQPRNZ-HXUWFJFHSA-N 398.482 2.770 0 50 GFAA O=C(O)COc1ccc(/C=c2\sc3nc4ccccc4n3c2=O)cc1Cl 2156438 DGEPEMZBWNFRGD-NVNXTCNLSA-N 386.816 2.574 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN2Cc2cnn(C)c2C)cc1 11819641 ZMIBCSYNABSSKI-FQEVSTJZSA-N 378.480 2.826 0 50 GFAA Cc1nnc(SCC(=O)N[C@H]2CCCN(CCc3ccccc3)C2)s1 14975106 CSUBTVDORYNEOZ-INIZCTEOSA-N 376.551 2.762 0 50 GFAA CCN1CCN(c2nc(C)c3c(n2)C[C@@H](c2ccc(OC)cc2)CC3=O)CC1 16651016 XZFFVDHBMOYGAE-QGZVFWFLSA-N 380.492 2.848 0 50 GFAA O=C(NCc1ccc(F)cc1)c1cc2n(n1)C[C@@H](c1ccc3c(c1)OCO3)OC2 169769977 WOSNWXGDEQMMNO-FQEVSTJZSA-N 395.390 2.952 0 50 GFAA CCOc1ncccc1C(=O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857697828 NZBGQNHBJGJKGX-QFIPXVFZSA-N 394.475 2.974 0 50 GFAA Cc1ccnc(N2CCC(N3C[C@H](COc4ccc(F)cc4)OCC3=O)CC2)c1 1857698425 QVVDXHSXCMDPRD-HXUWFJFHSA-N 399.466 2.804 0 50 GFAA O=C(c1ccc(N2CCCC2)c(Cl)c1)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1857714902 RNEBUBZNXPEDBW-YLJYHZDGSA-N 389.927 2.875 0 50 GFAA Cc1cnnc(N2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)c1C 1875241627 UZMBNCBBAQPJLH-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)C1 779855828 OTSIQWBKSBGJCQ-IPMKNSEASA-N 384.480 2.579 0 50 GFAA CCOC(=O)c1cnn(C2CCN(C(=O)Nc3ccnc(F)c3F)CC2)c1 856904771 CIMSQBYLQZADBU-UHFFFAOYSA-N 379.367 2.602 0 50 GFAA COC(=O)[C@@H]1CCC2(CCC2)N(C(=O)c2ncn3c2COc2ccccc2-3)C1 1875319118 ZLZLHYNZGFUKCQ-CQSZACIVSA-N 381.432 2.713 0 50 GFAA C[C@@H]1CC[C@@H](C(=O)NCC2(O)CCN(C(=O)CCCC(F)(F)F)CC2)C1 1775992519 QSYCINMFDUAPDH-ZIAGYGMSSA-N 378.435 2.625 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)C2=Cc3cc(Cl)ccc3OC2)C1 1775959234 PPMNBMDHRLRMAC-HUUCEWRRSA-N 375.812 2.796 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3c(C)cccc3C)CC2)c1 1074473 UZAWBHKUHFOFOG-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA aggregator O=C(C1CCOCC1)N1CC[C@]2(C1)C(=O)N(Cc1nccs1)c1ccccc12 2100545544 VOZCGHGELBXIPC-OAQYLSRUSA-N 397.500 2.587 0 50 GFAA CCCCn1nc(CC)nc1[C@H]1OCC(=O)N[C@@H]1c1ccc(OC)c(OC)c1 2100555544 VYZDPOAHBOYCEC-MOPGFXCFSA-N 388.468 2.587 0 50 GFAA COc1ccc(-c2ccncc2)cc1CN[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O 2325785589 FLCDTGXJBXZGLB-MAODMQOUSA-N 378.476 2.883 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccc(F)cc2)nc1 2325785656 HOQAUOMEPGRQMX-GDIGMMSISA-N 396.422 2.779 0 50 GFAA Cc1cc(C)cc(-c2n[nH]c(=NC(=O)c3cc([C@@H]4CCCN4)nn3C)s2)c1 2325799395 SMMSNQXDYFNHHR-AWEZNQCLSA-N 382.493 2.654 0 50 GFAA CN(C)Cc1ccc2c(c1)CCN(C(=O)CCc1nc(O)c3ccccc3n1)C2 2325802906 DTXXEOHSLLECIF-UHFFFAOYSA-N 390.487 2.915 0 50 GFAA NC[C@@H](CC(=O)N[C@@H]1CCCc2n[nH]cc21)c1ccc(Br)s1 2325808293 MXNOCUQDRIIIBR-MWLCHTKSSA-N 383.315 2.860 0 50 GFAA O=C1COc2ccc(C(=O)N3CCC[C@@H](c4cccc(C(=O)O)c4)C3)cc2N1 2325810062 BCKGIAUCRQIMBE-MRXNPFEDSA-N 380.400 2.736 0 50 GFAA CN1CC[C@](C)(CNC(=O)C[C@H](NC(=O)c2ccc(O)cc2)c2ccccc2)C1 2325810595 SZSQBJLBQHWFNV-NZQKXSOJSA-N 395.503 2.711 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(Br)ccc2N)CC1 67796634 NSBBOZGRMDSCEH-UHFFFAOYSA-N 384.274 2.724 0 50 GFAA CCC(CC)C(=O)Nc1cccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 2864886 KYICEAKOENYZHK-UHFFFAOYSA-N 389.477 2.961 0 50 GFAA CCCCC(=O)Nc1ccc(C(=O)N2CCN(CCCCOC)CC2)cc1 55166294 KBKCMEUFOYBQIR-UHFFFAOYSA-N 375.513 3.000 0 50 GFAA CCCn1ncnc1[C@H](C)NC(=O)CCCc1nc(-c2cccc(OC)c2)no1 55060957 HHFQDHJGBFQVSY-AWEZNQCLSA-N 398.467 2.947 0 50 GFAA C[C@H](N[C@@H]1CCC[C@@H]2OCC[C@@H]21)C(=O)NC1CCN(Cc2ccccc2)CC1 245794572 XVMHIKIYAUYQJF-UPZYVNNASA-N 385.552 2.703 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)NC(C)(C)C)Cc2ccccc2)cc1 22185104 PJBPTIXSFFBCDO-UHFFFAOYSA-N 390.505 2.801 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(-c3ccc(CO)cc3)nc2)CC1 67774540 NKLSBYDPBMEEKN-UHFFFAOYSA-N 393.487 2.716 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)Cc3cnc(C)[nH]c3=O)CC2)c1 67946268 NFLVBVGFHVPCDW-UHFFFAOYSA-N 391.475 2.726 0 50 GFAA Cc1cc(-c2cc(C(=O)N[C@@H]3CCC(=O)N(C)C3)c3c(C)noc3n2)c(C)o1 134095261 NSJLAABPDKCQTJ-CYBMUJFWSA-N 382.420 2.759 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1cc3ccccc3o1)CC2)C1CCC1 20599927 ZWBSDOHAYVAJDH-UHFFFAOYSA-N 393.491 2.541 0 50 GFAA CCN1CCN(C2CCN(Cc3nc(-c4ccc(Cl)cc4)no3)CC2)CC1 20205088 LGEYDECYSFREKB-UHFFFAOYSA-N 389.931 2.992 0 50 GFAA CCn1cc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 1460411 BGZONIBVLOVGMX-GJZGRUSLSA-N 388.468 2.571 0 50 GFAA COC(=O)C1=NN(C(=O)c2ccc(Br)cc2)[C@](O)(C(C)(C)C)C1 5060246 GJJQEHXRLZGZRA-MRXNPFEDSA-N 383.242 2.559 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@@H]1CCOC[C@H]1OCc1ccccn1 219344096 PGULSMCYYYIVOF-SJLPKXTDSA-N 376.840 2.848 0 50 GFAA COc1cccc([C@@H](O)CNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1 363404602 NJVIENZRPPNDPT-KNQAVFIVSA-N 397.519 2.940 0 50 GFAA NC(=O)[C@@H](NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1 363830087 WZEWTTJUHHVKKS-XLIONFOSSA-N 398.482 2.564 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)Cc3cnc4ccccn34)CC2)OC1=O 77505081 UXKNGTSQBCXYRU-INIZCTEOSA-N 384.480 2.879 0 50 GFAA O=Cc1cc(I)c(F)c(I)c1 79449491 QOHZTGBAXWWHTP-UHFFFAOYSA-N 375.906 2.847 0 50 GFAA Cc1cc(=O)oc2cc(OCCN3CCC[C@@H](c4nnc5n4CCC5)C3)ccc12 158384446 LCUIZORMNUZGHR-MRXNPFEDSA-N 394.475 2.898 0 50 GFAA C[C@H]1CCc2n[nH]c(C(=O)Nc3nn(C)c4cccc(N5CCOC5=O)c34)c2C1 72476155 RXHFXVCPRNRNSF-NSHDSACASA-N 394.435 2.630 0 50 GFAA CCCc1cc([C@@H]2CCCN2S(=O)(=O)c2ccc3c(c2)OCCO3)no1 33270211 UXCXEAYRARONMY-INIZCTEOSA-N 378.450 2.924 0 50 GFAA CC[C@@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](N3CCCC3)C2)c1 127935224 NJARJGOTZTZYBS-YLJYHZDGSA-N 386.540 2.985 0 50 GFAA Cc1ccc(-c2csc3ncn(CCC(=O)NCCCC(=O)O)c(=O)c23)cc1 262765963 SIWRKEJXBCFGFS-UHFFFAOYSA-N 399.472 2.805 0 50 GFAA CCCN1CC[C@H](CNC(=O)N2CC(Cc3cc(OC)cc(OC)c3)C2)C1 378050778 UIIISWSCWWRKEN-MRXNPFEDSA-N 375.513 2.620 0 50 GFAA O=C(O)c1cccc(S(=O)(=O)N[C@@H]2CCCN(C3CCCCCC3)C2)c1 72168582 DILIETQVWVAWAE-MRXNPFEDSA-N 380.510 2.850 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)cc1F 173298337 PXTZRSDCSREGCX-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA CCn1ccc2ccc(CN3CCC4(CC3)C[C@H](C(=O)O)N(C(C)=O)C4)cc21 82083110 JBOMUSVUBGXWQH-HXUWFJFHSA-N 383.492 2.949 0 50 GFAA CN(CC[C@H](O)c1ccccc1)C(=O)NCC1(N2CCOCC2)CCCCC1 426359552 DBUNBLLRXXSXCG-FQEVSTJZSA-N 389.540 2.787 0 50 GFAA COc1cc(CN[C@H]2CC(=O)N(C3CC3)C2)ccc1OCc1c(C)noc1C 174935181 YGWLHJCCDDWIPV-INIZCTEOSA-N 385.464 2.732 0 50 GFAA COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc2c(OC)ccc(OC)c2n1C 334162695 XFXIMCKKJQKMGK-MRXNPFEDSA-N 396.443 2.710 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)s1 91381797 CABXZQPYENQRML-UHFFFAOYSA-N 386.521 2.867 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccccc1Cn1cncn1 178215224 QJQYEJWKSODCRE-GOSISDBHSA-N 395.850 2.515 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCNC(=O)[C@@H]3c3ccc(F)cc3)c(C)c2c1 97785001 YTLDGBATWORFJZ-IBGZPJMESA-N 381.407 2.937 0 50 GFAA O=C(CCc1ccc(O)cc1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2=O 91779375 DWRMZQFJKUVBOR-VQTJNVASSA-N 378.472 2.974 0 50 GFAA CC(=O)N1CCc2[nH]cnc2C12CCN(Cc1ccc3c(ccn3C)c1)CC2 91288746 MNXARUJHQSIBHI-UHFFFAOYSA-N 377.492 2.797 0 50 GFAA CCSCCC(=O)N1CCC[C@@]2(CCC(=O)N(Cc3cnc(C)cn3)C2)C1 91625410 PYIAICVNDYAYIA-HXUWFJFHSA-N 390.553 2.659 0 50 GFAA CSC[C@H](CCO)NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 179683004 UAJLRMHKDWSKOF-TUKIKUTGSA-N 376.881 2.722 0 50 GFAA Cc1nc(-c2cccc(C(=O)N[C@H](C)c3nncn3C)c2)nc2c1CCCC2 534675346 SCXOWWPFTRYGAV-CQSZACIVSA-N 376.464 2.950 0 50 GFAA CC[C@H](C)n1nccc1NC(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 299782399 HEYKOSNJHVXHIJ-HNNXBMFYSA-N 385.468 2.933 0 50 GFAA CC(=O)N1CCCN(C(=O)Nc2ccc(OC[C@@H]3CCCCO3)cc2)CC1 299766255 MKMWPVQVCJYWGZ-IBGZPJMESA-N 375.469 2.721 0 50 GFAA COc1ccccc1-c1cc(CNC(=O)Cn2nc(C)c(C(C)=O)c2C)on1 952868752 AAKNWMRNODHEHR-UHFFFAOYSA-N 382.420 2.683 0 50 GFAA CC[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2C(=O)N2c3ccccc3C[C@@H]2C)C[C@@H]1O 408022364 WMFYLLHAPSGPDC-IXOZGNAGSA-N 384.520 3.000 0 50 GFAA COc1cccc(N[C@H](CNC(=O)CS(=O)(=O)C(C)(C)C)C(C)(C)C)c1 170599096 VHVPYTFBXVWDIW-MRXNPFEDSA-N 384.542 2.851 0 50 GFAA Cc1ccc(CN2CC[C@@H](NS(=O)(=O)c3ccc4c(c3)CCC4)C2=O)cc1 190603693 KIWAZCFLEUHVSD-HXUWFJFHSA-N 384.501 2.563 0 50 GFAA COc1cccc(CN(CCN(C)C)C[C@@H]2CCCO2)c1OCCCN(C)C 1506400158 ANXGITKUWWAQRR-FQEVSTJZSA-N 393.572 2.568 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3n[nH]cc3Cl)CC1)OCC2 1704338148 NFRWFAUEYBEXDH-UHFFFAOYSA-N 391.855 2.785 0 50 GFAA CCOC(=O)[C@]1(Cc2cccc(Cl)c2)CCCN(C(=O)CCNC(C)=O)C1 11999103 MPQAUJAIYMYEQS-FQEVSTJZSA-N 394.899 2.581 0 50 GFAA O=C(c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)N1CCC[C@H](O)C1 12436300 VNODPEFGVDAFHJ-FQEVSTJZSA-N 395.503 2.722 0 50 GFAA O=C(NC[C@H]1COc2ccccc2O1)c1coc(COc2ccccc2F)n1 12713133 CMJGHTKIRDHVMI-ZDUSSCGKSA-N 384.363 2.963 0 50 GFAA CN(C)CCNC(=O)CCC1CCN(Cc2cn(C)nc2-c2ccccc2)CC1 12718011 ZGUMZSFXJKWZBU-UHFFFAOYSA-N 397.567 2.757 0 50 GFAA CC(C)=CCN1CC(=O)N(CC2CCOCC2)C[C@@H](OCc2cccnc2)C1 14530423 KKXBNQHMAHBEMJ-NRFANRHFSA-N 387.524 2.504 0 50 GFAA COc1cc(OC)cc(C(=O)NCCc2nnc(SCC(C)C)n2C)c1 14991583 AFTQUXAWOVJWAS-UHFFFAOYSA-N 378.498 2.553 0 50 GFAA Cc1scc(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 16604645 WXTMTXWBWFEFMN-UHFFFAOYSA-N 380.491 2.638 0 50 GFAA O=C(CCc1nnc(Cc2ccc(-c3ccccc3)cc2)o1)N[C@H]1CCOC1=O 19770665 SYNUQYBZESZVAQ-SFHVURJKSA-N 391.427 2.692 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N(CC1CCC1)C[C@H]1CCCO1 1857714263 OIILLERDHFZDSU-MRXNPFEDSA-N 379.526 2.709 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cccc(C(F)(F)F)c2)[C@H]1c1cnn(C)c1 1857716988 ULAPOGFXLANCGT-IRXDYDNUSA-N 396.413 2.583 0 50 GFAA Cc1c(NCC(=O)N2c3ccccc3C[C@H]2C)cccc1C(=O)N1CCOCC1 149361189 KUGAZKHNGAELIC-MRXNPFEDSA-N 393.487 2.857 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3nnn(C4CCNCC4)c3C)CC2)cc1 151838411 NUTWSOSCESJKPA-UHFFFAOYSA-N 383.496 2.503 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1ncc3ccccn13)CC2 909516367 KROCBYHYLNHZFI-MRXNPFEDSA-N 395.415 2.566 0 50 GFAA CCN(CC(=O)N1CCC(C(=O)NCCC(C)C)CC1)[C@H]1CCOC(C)(C)C1 810043240 RBGKYQJLMGZDKZ-IBGZPJMESA-N 395.588 2.667 0 50 GFAA COCCCOCC(=O)N1Cc2cnn(-c3ccccc3F)c2CC(C)(C)C1 952893531 UOHWYEPZOPNKBD-UHFFFAOYSA-N 389.471 2.975 0 50 GFAA O=C(N1CCN([C@H]2CCNC2)CC1)C1(Cc2ccc(Cl)cc2)CCCC1 952845910 KJBQIJJQKPJBIB-IBGZPJMESA-N 375.944 2.949 0 50 GFAA Cn1cc([C@@H]2CCCCN2C(=O)Cn2cc(NC(=O)CC(C)(C)C)cn2)cn1 1875254260 XKQUJLWKUCHPRB-KRWDZBQOSA-N 386.500 2.745 0 50 GFAA CC[C@@H]1CC[C@](O)(C(=O)N2CCC(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1875271777 SYTDCQSAEPOXSH-OXQOHEQNSA-N 379.522 2.701 0 50 GFAA CCO[C@H]1CN(C(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)C[C@@H]1CO 1875268112 XOFRIHGHBDSHAZ-CJNGLKHVSA-N 392.887 2.514 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)c3ccc([S@](C)(=N)=O)cc3)cn2)C[C@@H](C)O1 1875292224 AQMOVRHZEHQMIG-MWSMCUOVSA-N 388.493 2.983 0 50 GFAA NC1CC([C@H](F)C(=O)NCc2cccc(-c3nc(CC(F)(F)F)no3)c2)C1 1875328515 WOYRQGXTKHSYPP-YIZWMMSDSA-N 386.349 2.533 0 50 GFAA O=C(NC[C@@H]1CC(F)(F)CO1)NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1 1875301750 SHKFOZXLALOQSR-OCCSQVGLSA-N 396.356 2.580 0 50 GFAA Cc1nc(C)c(CN2C[C@@H](c3cncn3C)[C@H](CNC(=O)C3(C)CC3)C2)s1 1775962809 IQIISMAWLQHXKP-HZPDHXFCSA-N 387.553 2.625 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)[C@H]1CCc2nncn2CC1 898687473 LXHSXUPNACHLNW-NSHDSACASA-N 392.385 2.784 0 50 GFAA COc1ccc(CNc2ccc(C(F)(F)F)cc2S(N)(=O)=O)c(OC)c1 1772820904 SJWQTYFWCGZZOE-UHFFFAOYSA-N 390.383 2.982 0 50 GFAA O=C(CCC(=O)c1cccs1)N[C@H]1C[C@@H](NC(=O)c2ccc3c(n2)CCC3)C1 2325826163 RCSKAMBGIROJRE-GASCZTMLSA-N 397.500 2.672 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSC1=N[C@@H](c2ccccc2)CC(=O)N1 652299 COAPWAOOJUTNQF-MRXNPFEDSA-N 397.456 2.762 0 50 GFAA O=C(Cc1ccccc1)Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1 1188177 MYZLRPOXUIVINT-UHFFFAOYSA-N 390.443 2.526 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2cc(CN(CC)CC)c(CC)o2)CC[C@H]1O 2356146232 XOHWOKYZUYBELB-CTNGQTDRSA-N 380.529 2.669 0 50 GFAA COc1ccc(N(CC(=O)NCc2ccccc2C)S(C)(=O)=O)cc1Cl 2979508 JVJJYZVKMPGTPN-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA Cc1cc(NC(=O)Cn2nc3c(cc2=O)CCCC3)ccc1Br 3296550 DTPUVDBCJFYUDK-UHFFFAOYSA-N 376.254 2.832 0 50 GFAA COc1cc(CNCc2ccccc2)cc(Br)c1OCC(N)=O 6703444 ZKQQOWPSNUWENT-UHFFFAOYSA-N 379.254 2.612 0 50 GFAA CS(=O)(=O)N1CCN(C(=O)c2sc3cc(Cl)ccc3c2Cl)CC1 6729095 PYOOXNNEUOTAJU-UHFFFAOYSA-N 393.317 2.926 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)Nc2ccc(C(N)=O)c(C)c2)C1 111762328 LXYJXAFXWCTXAM-OAHLLOKOSA-N 382.464 2.751 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccc4c(c3)OCCO4)C[C@@H]2N1CCc1ccc(F)cc1 59429745 XABPTPPSCGHZCW-GHTZIAJQSA-N 398.434 2.845 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN2CCN(c3ccc(F)cc3)CC2)cc1 54530466 YRBOINMLUDIOPE-UHFFFAOYSA-N 385.439 2.763 0 50 GFAA O=S1(=O)C=C[C@@H](NCc2ccc(-c3ccn(CCCC(F)(F)F)n3)o2)C1 20168646 GJZXECBJYAYETH-GFCCVEGCSA-N 389.399 2.886 0 50 GFAA CN1CCC[C@H](NC(=O)c2cc(-c3cnc(N(C)C)nc3)nc3ccccc23)C1 23619026 JDKBBELKZDJCTD-INIZCTEOSA-N 390.491 2.582 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCc3cccs3)C2=O)c1 67921862 NKOBBYYSWSLDAA-IBGZPJMESA-N 378.469 2.539 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@@H](c1ccc2c(c1)CCO2)C1CC(O)C1 219097833 MZRITAFOFZJVMR-XWTGJVNOSA-N 381.428 2.521 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccc4nn[nH]c4c3)CC2)cn1 328638568 PEDQJLGZZUJOKX-OAHLLOKOSA-N 379.468 2.526 0 50 GFAA CS(=O)(=O)c1ccc2c(c1)CCN([C@H]1CCCN(c3ccccc3)C1=O)CC2 328680845 CGPZOEQWCAHATE-NRFANRHFSA-N 398.528 2.686 0 50 GFAA COc1cccc(OCC(=O)N2C[C@@H](NC(C)=O)[C@H](c3ccc(C)cc3)C2)c1 77300597 PXOUTZAXHCYWEB-LEWJYISDSA-N 382.460 2.513 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N[C@H](c1ccccc1)c1ccccn1 72478680 KHTNVDDKGCLGFQ-JOCHJYFZSA-N 375.476 2.610 0 50 GFAA Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)c1ccc(-c2cncnc2)cc1F 372283213 RQKBWZYNZVOHSY-FQEVSTJZSA-N 390.418 2.904 0 50 GFAA CCOc1ccc(-c2nc(C)c(C(=O)N3CCO[C@H](CC(=O)O)C3)s2)cc1 262874188 YBKHEXUQRSTAQD-OAHLLOKOSA-N 390.461 2.833 0 50 GFAA Cc1ccccc1-c1ncc(-c2nccn2CCS(=O)(=O)N(C)C)s1 72406839 JBSCRJIIODVICT-UHFFFAOYSA-N 376.507 2.873 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)N[C@H]1CCOc2ccccc21 172721808 DLNOYDMLXAFXST-SFHVURJKSA-N 386.473 2.789 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2C[C@@H](C)C[C@H](C)C2)c1C(=O)OC(C)C 17080899 ZMZGZVCARHFOBZ-RYUDHWBXSA-N 395.525 2.637 0 50 GFAA CN(Cc1cccc(OCCN2CCOCC2)c1)Cc1ccc2c(c1)OCO2 222861747 GCGXMSYLJHLRQS-UHFFFAOYSA-N 384.476 2.758 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@@H]1CCCN(Cc2nc3ccccc3[nH]2)C1 426727062 ZIFZVOIAFQIOQA-MRXNPFEDSA-N 379.512 2.667 0 50 GFAA Cc1ncncc1C(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95362185 IFTRLBKAPALTEL-PWIZWCRZSA-N 384.430 2.766 0 50 GFAA CC(=O)c1cc(CC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cs1 97413295 JBTDVHOVMMWNJT-UHFFFAOYSA-N 386.473 2.566 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H]3CCCN(C)C3)csc2C1 426489881 HXVBXBQKZJBIJK-HNNXBMFYSA-N 388.537 2.735 0 50 GFAA O=C(NCc1ccc(Oc2ccccc2)cc1)[C@H]1CC(=O)N(c2cn[nH]c2)C1 178180540 MZOFSFQUXGTQNT-INIZCTEOSA-N 376.416 2.871 0 50 GFAA O=C(O)[C@@H](c1ccsc1)N1CCN(c2nnc(C(F)(F)F)s2)CC1 95383936 LIPICXBVOLDXHZ-SECBINFHSA-N 378.401 2.566 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@@H](C)Nc2ncnc3nn(C)cc23)cc1 162971499 MJKDRCSZYPHVSP-CYBMUJFWSA-N 388.497 2.567 0 50 GFAA Cc1oncc1S(=O)(=O)N1CCC[C@](C)(Cc2ccc3c(c2)OCO3)C1 91656979 WPSVVKHTNCYLJN-GOSISDBHSA-N 378.450 2.745 0 50 GFAA O=C(C[C@@H](Cn1cccc1)c1ccc(Cl)cc1)NC[C@H]1CCS(=O)(=O)C1 263586962 AFHVIUQCIYXSAS-WBVHZDCISA-N 394.924 2.866 0 50 GFAA O=C(O)C[C@@H](NC(=O)CN1C(=O)CSc2ccccc21)c1ccc(F)cc1 299749062 JAMUTJUPUHDIDO-CQSZACIVSA-N 388.420 2.597 0 50 GFAA Cc1cc(CC(=O)NC[C@@H]2CCCN(Cc3noc(-c4ccccc4)n3)C2)on1 827861501 JILMPRZVFHDDFR-INIZCTEOSA-N 395.463 2.604 0 50 GFAA Cc1nc2ccc(CC(=O)N[C@@H]3CCCN(Cc4cccc(O)c4)C3)cc2[nH]1 827849441 GSCPDDDVPSRDDN-GOSISDBHSA-N 378.476 2.900 0 50 GFAA COc1ccc(-c2nnc(C)o2)cc1NC(=O)CN1CCOc2ccccc2C1 952962686 FKJWOGCUCCUEBL-UHFFFAOYSA-N 394.431 2.887 0 50 GFAA C[C@H](C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccc(Cl)s1 275867463 ZRDBLMDTRWVIPA-NWDGAFQWSA-N 379.917 2.610 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NC[C@](C)(O)c3ccc(F)cc3)c2O1 192646518 YITQTRWGUGLLTQ-IBGZPJMESA-N 379.453 2.725 0 50 GFAA Cc1ccc(O[C@@H](C)C(=O)Nc2nnc(SCC(=O)N(C)C)s2)cc1C 1506403653 UUOALWGHNXAUQX-LBPRGKRZSA-N 394.522 2.741 0 50 GFAA Cc1noc(C)c1CCCNC(=O)[C@@H]1CCC(=O)N(CCc2ccccc2)C1 11814419 MWZMUFWKWKCLEA-LJQANCHMSA-N 383.492 2.822 0 50 GFAA O=C(NCCc1ccccn1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 11937701 OGMYRAWBNZVBMI-UHFFFAOYSA-N 393.487 2.834 0 50 GFAA O=C(Cn1nnnc1CN1CCCCCC1)NCC1(c2ccccc2)CCCC1 12300255 ZOWKQVGAYYHZGF-UHFFFAOYSA-N 396.539 2.677 0 50 GFAA CCCCn1c(CN2CCC[C@@H](O)C2)cnc1S(=O)(=O)CCCC(C)C 12316362 WYUZLJYRFOOHLE-GOSISDBHSA-N 385.574 2.850 0 50 GFAA O=C(c1cccc(OC2CCN(C(=O)[C@@H]3CC=CCC3)CC2)c1)N1CCOCC1 14981376 NSWVJRGHCNLYAL-GOSISDBHSA-N 398.503 2.885 0 50 GFAA COc1ncc(CN2CC[C@@]3(CCCN(Cc4ccc(F)cc4)C3=O)C2)cn1 15070798 GVESYMGQGQSWAX-NRFANRHFSA-N 384.455 2.639 0 50 GFAA COc1ccc(CN[C@@H]2CNC(=O)c3cc(-c4cccs4)nn32)cc1OC 169754499 KZLVBLOSLWQJCB-SFHVURJKSA-N 384.461 2.661 0 50 GFAA O=C(c1cc(F)ccc1F)N1CC[C@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778201 VUNAXPWWYYIKSF-LBPRGKRZSA-N 386.362 2.571 0 50 GFAA CCCCCCNC(=O)N1C[C@@H]2[C@H](CNC(=O)C3(C)CC3)[C@H]3CC[C@]2(C1)O3 1857717167 XIBYHDYBLMMJRN-BIZBXSGISA-N 377.529 2.672 0 50 GFAA COc1ccc(C(=O)N2CCC(C3CCN(c4cnccn4)CC3)CC2)cn1 1857723699 RFBTWQKTJOUNAR-UHFFFAOYSA-N 381.480 2.649 0 50 GFAA CC(C)c1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)no1 1857733399 JDEWIXPAFRUICL-OPYAIIAOSA-N 381.432 2.713 0 50 GFAA Cc1cc(F)cc(CN2C[C@@H]3[C@H](CNC(=O)c4[nH]cnc4C)[C@H]4CC[C@]3(C2)O4)c1 1857741333 NUEUKDUNMGUSTO-JZJXAQOMSA-N 398.482 2.575 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC2CCC2)C[C@H]1NC(=O)c1ncoc1CC 1875245191 OHHNRNKYWZLQAP-YSVLISHTSA-N 377.485 2.599 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](NC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)C2)c1 246972945 QAYGZZRVNNYYEF-WFVVYAPDSA-N 386.492 2.794 0 50 GFAA Nc1cc(O)nc2nnc(SCc3ccc(C(=O)c4ccccc4)cc3)n12 16039561 MXLMCHMLJNDYMB-UHFFFAOYSA-N 377.429 2.935 0 50 GFAA CCc1nc(CN2CC[C@@](c3nc(-c4ccccn4)no3)(C(F)(F)F)C2)n[nH]1 952894273 YLKQZTHWXTXTLF-MRXNPFEDSA-N 393.373 2.518 0 50 GFAA Cc1cccc(CCC(=O)N[C@@H](CO)Cc2cncs2)c1Br 1875323144 YVCIQVBLLUVNNS-CYBMUJFWSA-N 383.311 2.866 0 50 GFAA Cc1nc[nH]c1CC(=O)N1CCC[C@@H]1CNC(=O)c1oc2ccccc2c1C 1875310367 NPIBMLJNZBPHPB-OAHLLOKOSA-N 380.448 2.736 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3ccc4cc[nH]c4c3)C2)c1C 1875397557 DOZHRYSPYGPXEA-GOSISDBHSA-N 392.507 2.645 0 50 GFAA CN(C[C@H]1CCCN(C(=O)c2cnc3cc[nH]c3c2)C1)C(=O)CC[C@H]1CCOC1 1875338636 FKOFLHLJZYCYJB-DLBZAZTESA-N 398.507 2.690 0 50 GFAA O=C1c2ccccc2CCN1CCNC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1 886093712 DFDAPBNWCILWCR-HXUWFJFHSA-N 397.519 2.676 0 50 GFAA CCNc1nc(NC(C)(C)C)nc(Oc2ccc(=O)n(-c3ccccc3)n2)n1 1133870 UTMBAOULEZRHHV-UHFFFAOYSA-N 381.440 2.852 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cc(=O)nc3sccn23)C[C@@H](c2ccccc2)O1 2100543546 USWKXDHOXMEXFQ-SJORKVTESA-N 383.473 2.994 0 50 GFAA Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1ccc(N3CCOCC3)cc1)C(=O)N2 941070 NUPBIIGSDCCPHO-HXUWFJFHSA-N 394.475 2.901 0 50 GFAA CCc1nc2ccccc2n1CC(=O)N[C@](C)(C(=O)O)c1cc(F)ccc1F 2325743366 FHTHOKFMRMEHSG-FQEVSTJZSA-N 387.386 2.993 0 50 GFAA COc1ccc(-n2[nH]c(=NC(=O)N3CC[C@](N)(c4ccccc4)C3)cc2C)cc1 2325773104 SUGJSPCXQJVWSW-JOCHJYFZSA-N 391.475 2.703 0 50 GFAA O=C(C[C@@H]1C(=O)Nc2ccc(Cl)cc21)NC1(C(=O)NCC2CC2)CCCC1 2325798293 HBXGGUPADDNPOM-HNNXBMFYSA-N 389.883 2.721 0 50 GFAA O=C1N[C@H](c2ccc(OCc3ccccc3)cc2)C(=O)N2CC3(CCC3)OC[C@H]12 2325808997 PIXRPUUEAZDNSD-WOJBJXKFSA-N 392.455 2.587 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Br)cc2)CC1 1116017 JFBHYAQINHBNSR-GFCCVEGCSA-N 385.258 2.517 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(N)=O)Cc2ccc(Cl)c(Cl)c2)cc1 1150994 CIEUSOSTJINAOJ-UHFFFAOYSA-N 387.288 2.978 0 50 GFAA CCc1nc(N2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)ncc1C 106952277 ACIBNJJDLNFCLY-INIZCTEOSA-N 376.451 2.699 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)NCC[C@H]1COc2ccccc2O1 55228536 LGQMEISDCMQRIV-AWEZNQCLSA-N 383.404 2.999 0 50 GFAA CCOc1ccccc1[C@@H](CC)NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2 116337640 FIEVGGXQQRLGDL-GOSISDBHSA-N 388.489 2.801 0 50 GFAA Cc1cc(N2CCC([C@H](C)N3CCN(C)CC3)CC2)nc(-c2cccnc2)n1 65376622 FGVLIPWTCPQERU-SFHVURJKSA-N 380.540 2.699 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2cc(-n3cccn3)nc(C)n2)CC1 65363332 COJPBOSVINLDHT-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA COCCN(C[C@H]1CCCN2CCCC[C@@H]12)C(=O)c1cc(-c2ccncc2)[nH]n1 409414271 OOGZCDNDXMFHDM-NQIIRXRSSA-N 397.523 2.825 0 50 GFAA COc1cccc(OC)c1OCCN1CCC2(CC1)Nc1ccccc1NC2=O 65398906 WSNIQBAFKXWHRK-UHFFFAOYSA-N 397.475 2.981 0 50 GFAA COc1ccccc1-n1cc(CN2CCN(C3CCCC3)[C@H](CCO)C2)cn1 36385744 PAUAUIWDDIYZAM-HXUWFJFHSA-N 384.524 2.692 0 50 GFAA CCNC(=O)c1ccnc(N2C[C@@H](c3ccccc3)[C@@H]3[C@H]2C2CCN3CC2)c1 72173788 DVVXCCPKCAPMJH-KSEOMHKRSA-N 376.504 2.898 0 50 GFAA COc1cc(CN2CC[C@@H](NC(=O)Cc3n[nH]c4ccccc34)C2)cc(OC)c1 121347207 DZEJKCZORAJOIT-MRXNPFEDSA-N 394.475 2.513 0 50 GFAA Cc1noc([C@@H]2CCCN(c3nccc(N[C@@H]4CCCO[C@H]4C(C)C)n3)C2)n1 328635076 NDIOLGRBYICMAC-NUJGCVRESA-N 386.500 3.168 0 50 GFAA CCCc1cc(CN(C)c2nc(-c3cccnc3)nc3c2CCNCC3)n[nH]1 72480922 NFUPDVZBQDYWQD-UHFFFAOYSA-N 377.496 2.539 0 50 GFAA CC[C@H]1COCCN1C(=O)c1cccc(-n2nc(C)c3ccccc3c2=O)c1 77470905 MNRZIGKZSBPBKB-KRWDZBQOSA-N 377.444 2.945 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1ccc(CC(=O)O)cc1 217614314 VPZFHNULFOWYNS-OAHLLOKOSA-N 385.372 2.571 0 50 GFAA biogenic O=C1CN(c2ccc(-c3nc(-c4cccc(C(F)(F)F)c4)no3)cn2)CCN1 39460860 KJRNYNJVYYETQH-UHFFFAOYSA-N 389.337 2.754 0 50 GFAA CC[C@@H]1CCc2nc(NC(=O)[C@@H]3COCCN3CC(F)(F)F)sc2C1 332216187 WUVPVYWDHSVPMK-PWSUYJOCSA-N 377.432 2.860 0 50 GFAA CCS(=O)(=O)Nc1ccccc1C(=O)NCC1([C@H](O)c2ccccc2)CC1 155866570 FPXRBLGAPXXHKE-GOSISDBHSA-N 388.489 2.692 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@@H]1CCCN(Cc2cc(=O)[nH]c(=O)[nH]2)C1 71681370 GGRPJYMXTSQYHO-LJQANCHMSA-N 389.455 2.825 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CCc3ncccc3C2)nc2cccnc21 77297724 LLEKNPBBPQZCMY-INIZCTEOSA-N 393.491 2.941 0 50 GFAA CCOc1ccccc1CCC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O 157416566 WXFBSSJQBGVTEN-KRWDZBQOSA-N 382.460 2.948 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCO[C@@H](C(F)(F)F)C3)c2)o1 71419207 TUIYGAKOCSKGDH-OAHLLOKOSA-N 390.383 2.910 0 50 GFAA CCn1ccc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 71763746 TUGQVUZYEMKVTP-LJQANCHMSA-N 386.471 2.941 0 50 GFAA C[C@H](O)c1ncc(C(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)s1 241862554 SRARNODOLXSHSZ-OLZOCXBDSA-N 392.500 2.578 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)N1CCO[C@@]2(CNCCOC2)C1 72156295 NAQSKPFQLNPODK-NRFANRHFSA-N 383.448 2.702 0 50 GFAA CCn1c(Cc2ccc(OC)cc2)nnc1SCC(=O)NCc1ccco1 17078911 XGGKPNJKRYNRMK-UHFFFAOYSA-N 386.477 2.899 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)Nc1cc(F)c2c(c1)NC(=O)CO2 426606797 UABADEDFPASHNZ-UHFFFAOYSA-N 389.387 2.861 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)N[C@@H]2COc3ccccc3C2)CC1 193305282 NULWRFDELRSTRZ-SFHVURJKSA-N 381.476 2.921 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(-c2ccc(C(=O)N3CCCC3)cn2)c1 426404352 QWXFPOBBJGXCFI-LJQANCHMSA-N 379.460 2.893 0 50 GFAA CC(C)[C@@H]1C(=O)NCCN1C(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 177087237 SQWWFAYGQFNZPX-CQSZACIVSA-N 387.509 2.852 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)c2cc(OC)ccc2O)C3)c1 96153999 JKIDJQGIBPDELY-UHFFFAOYSA-N 379.416 2.998 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)NCc1ccccc1-n1cncn1 426535417 HECVRIBXQQLXSR-UHFFFAOYSA-N 382.493 2.944 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 95373024 DBPBDDZABGYSNG-PWIZWCRZSA-N 384.430 2.766 0 50 GFAA O=C(NCCCc1nc2ccccc2s1)[C@@H]1CC(=O)N(Cc2ccncc2)C1 95531030 WFWKRZREIVVHNT-MRXNPFEDSA-N 394.500 2.789 0 50 GFAA Cn1ccnc1[C@@H](O)C1CCN(C(=O)Nc2ccccc2-n2cccn2)CC1 96160098 LTSMBYBUSGDTPM-SFHVURJKSA-N 380.452 2.583 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2nccc(-c3cccnc3)n2)CC1 96130460 ITZJQUMAHSQPMH-UHFFFAOYSA-N 375.432 2.510 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)C3CCN(C4CCCCC4)CC3)C2)cc(=O)[nH]1 95389207 JBJPAJMEKGPPAI-GOSISDBHSA-N 386.540 2.829 0 50 GFAA O=C1CC[C@H](CN2CCCN(C[C@@H]3CCNC(=O)CC3)c3ccccc32)CCN1 294837863 AWSXVBMATXSTMF-OALUTQOASA-N 398.551 2.536 0 50 GFAA O=C1N[C@H]2c3ccc(I)cc3C(=O)N2c2ccccc21 252498163 QVPUQBUYBIBJDE-CYBMUJFWSA-N 376.153 2.694 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCc1nnc(-c2ccsc2)o1 299750188 MTFGNFOWZDAMCY-HNNXBMFYSA-N 383.429 2.769 0 50 GFAA CC(C)CN1C[C@H](C(=O)N2CCC3(CC2)OCCc2ccsc23)CC1=O 540916009 GUEOKHSLCBAXJC-MRXNPFEDSA-N 376.522 2.643 0 50 GFAA C[C@@H]1CCCN(CCOc2ccccc2CN2CCN(c3cnccn3)CC2)C1 822413207 VYQWNGANUGNEEW-HXUWFJFHSA-N 395.551 2.910 0 50 GFAA Cn1cc(C(=O)N2CCC(CNC(=O)C3CCOCC3)CC2)c2ccccc21 827763678 HPQUOIVOSGJSMF-UHFFFAOYSA-N 383.492 2.573 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCO2)N1CCC([C@H](O)c2cccs2)CC1 952986975 CRSJIYFEPDNHEP-SFHVURJKSA-N 395.502 2.654 0 50 GFAA COc1cccc([C@@H](CNC(=O)c2cn(C)c(=O)c3ccccc23)N(C)C)c1 277091393 KOZRUKSVNVXQTM-HXUWFJFHSA-N 379.460 2.580 0 50 GFAA O=C(O)[C@@H]1[C@@H](C(=O)Nc2ccc(I)cc2)[C@H]2C=C[C@H]1C2 100293259 RVGHVGYEUBBIMP-VDUILEQBSA-N 383.185 2.753 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N(C)Cc2cnc(-c3ccccc3)s2)C1 1506419067 WRIXMUQTMGSDEA-HNNXBMFYSA-N 395.550 2.845 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](O)[C@H](Cc3cnccn3)C2)c2ccc(C)c(C)c2n1 1529166868 BLVYWJWYPOTOPM-OXQOHEQNSA-N 376.460 2.626 0 50 GFAA CN(C[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1cc(O)nc2cc(F)ccc12 1529103568 DLAKCBNLSPENTO-ZDUSSCGKSA-N 385.439 2.943 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3cc4cccc(Cl)c4n3C)C[C@@H]12 1704297167 IJFWGAAXLBAVEB-UZLBHIALSA-N 389.883 2.843 0 50 GFAA OC[C@]12CN(Cc3cc[nH]n3)C[C@H]1CN(Cc1ccc(-c3ccccc3F)o1)C2 1772701679 ORTVFXOJZYLEJM-KSFYIVLOSA-N 396.466 2.735 0 50 GFAA CCCCN(C)C(=O)C[C@]1(c2ccccc2Cl)CC(=O)N(CCOC)C1=O 11813286 JGQVMLMIUPZIEP-HXUWFJFHSA-N 394.899 2.632 0 50 GFAA Cc1nc(CN(C)C[C@@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)cs1 12747848 KKLCCYUDCLECQX-IBGZPJMESA-N 395.475 2.715 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)Cc2ccsc2)CC1 15079484 IRSHXDJYJAVGMV-LJQANCHMSA-N 391.581 2.910 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CC2)C[C@H]3C(=O)N2C[C@H](C)O[C@H](C)C2)c1 18061677 GHQKRHOLMYHMCU-NSHGMRRFSA-N 384.520 2.802 0 50 GFAA C[C@@H](NC(=O)C[C@H]1NC(=O)c2ccccc2NC1=O)C12CC3CC(CC(C3)C1)C2 206241487 HKCZEKGWCBMHBD-LQQJBVTDSA-N 395.503 2.848 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N[C@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@@H]1O 1857531286 DPFAJUZSWZJXIK-RLCCDNCMSA-N 388.855 2.596 0 50 GFAA CC(C)c1cc(C(=O)N2CC[C@H](O)[C@@]3(CCCNC3=O)C2)c(O)c(C(C)C)c1 1857687375 UQSPMMXSLHYYJP-PGRDOPGGSA-N 388.508 2.742 0 50 GFAA O=C(Nc1ccccc1OCCc1ccccn1)[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857731432 IJMBAICMGDVHEF-LDQXTDLNSA-N 381.476 2.799 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@H](C(=O)O)c3ccccc3)cc2)C[C@H](C)O1 237628618 HGGONKLSTKVCMH-FTRWYGJKSA-N 382.460 2.852 0 50 GFAA Cc1c(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)sc2ncnc(O)c12 253601341 YKFXDQBQZSQXQV-OLZOCXBDSA-N 383.429 2.646 0 50 GFAA CN(C)Cc1ccc(C(=O)N2CCc3c(ncn3CCc3ccccc3)C2)cn1 375102088 SNKLFCQCFOELOI-UHFFFAOYSA-N 389.503 2.781 0 50 GFAA Cc1cc(F)c(Br)cc1NC(=O)C(=O)N1CC[C@@H]([C@@H]2CCOC2)C1 377001528 PXJAZVCUZMGHMR-VXGBXAGGSA-N 399.260 2.720 0 50 GFAA CC(C)=CC(=O)NCc1cn([C@H]2CCN(c3ccc(Cl)cc3F)C2=O)nn1 1875282097 MOGRKCYKAJQPGD-INIZCTEOSA-N 391.834 2.631 0 50 GFAA CC(C)n1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3ccc4cc[nH]c4n3)CC1)O2 1875394441 JBDIDBZRKBCYHP-INIZCTEOSA-N 395.463 2.831 0 50 GFAA CN(C)C(=O)c1cnc(N[C@@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@H]2O)c(Cl)c1 1875399484 XQNZIMCGCSBHMR-VCTAVGKDSA-N 398.294 2.538 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)cn1 1875384888 JSCCJTILBRSWCK-LAVPKYONSA-N 381.436 2.585 0 50 GFAA Cc1nnc([C@]23CC[C@H]2CCN3C(=O)Cc2c(C)nn(CC(F)(F)F)c2C)o1 1875404541 MBHRUNQRZGWXQD-GUYCJALGSA-N 397.401 2.834 0 50 GFAA O=C(NCC(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1)c1cc(F)cc(F)c1 899425081 NWDLZTQQHXTPOD-ZBEGNZNMSA-N 376.325 2.886 0 50 GFAA Cc1oc(-c2ccccc2Cl)cc1C(=O)N1CCO[C@@H](c2nnn(C)n2)C1 2100478107 RTYXOOVHAPZBSB-MRXNPFEDSA-N 387.827 2.646 0 50 GFAA COc1ccc(C(=O)NC(=S)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1 1232241 SCJDRKKHMQRHFR-UHFFFAOYSA-N 396.472 2.620 0 50 GFAA O=C1CCN(c2ccccc2C(=O)NCc2cccc3ncsc23)C(=O)N1 2356156949 XWWMJPLEGGBNHY-UHFFFAOYSA-N 380.429 2.673 0 50 GFAA CCCn1nc(N(CC(=O)Nc2cccc(C)c2C)S(C)(=O)=O)cc1C 2356157817 SFXQQKFROPSAIN-UHFFFAOYSA-N 378.498 2.623 0 50 GFAA CCOC(=O)[C@H](C)Oc1cc2oc(=O)c(CC(=O)OC)c(C)c2cc1Cl 2858563 DGACKCBDSXIVDK-JTQLQIEISA-N 382.796 2.801 0 50 GFAA O=C(C1CCN(Cc2cccnc2)CC1)N1CCN(Cc2ccccc2)CC1 4676944 BCUYNVWVMXPHKO-UHFFFAOYSA-N 378.520 2.638 0 50 GFAA CCC[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)OC 4764340 RWJCTEYKWWBVCL-BHYGNILZSA-N 378.469 2.785 0 50 GFAA Cc1nccnc1N1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1 409964377 PKHHNFMZLXMSHJ-UHFFFAOYSA-N 375.432 2.935 0 50 GFAA CNc1cc(C(=O)NCc2cccnc2N(C)CCc2ccccn2)ccn1 67642567 CUGWTDXPRUOAHK-UHFFFAOYSA-N 376.464 2.522 0 50 GFAA Cc1ccc(NC(C)(C)C(=O)NCc2cccnc2N2CCN(C)CC2)cc1 67847045 CISYTGLOUOREBH-UHFFFAOYSA-N 381.524 2.649 0 50 GFAA CN1CCc2n[nH]c(C(=O)N3CCC[C@]4(C=Cc5ccccc5O4)CC3)c2C1 67804272 GRJSKOBGXLPRGH-QFIPXVFZSA-N 378.476 2.868 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)c2nnnn2C)cc1NC(=O)Nc1ccccc1 252495640 OUXINWWHVHPVFJ-CYBMUJFWSA-N 379.424 2.654 0 50 GFAA Cn1nc2ccccc2c1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 475906063 MUGLIQDBSZWTJS-OAHLLOKOSA-N 381.411 2.749 0 50 GFAA Cc1c(Br)cnn1[C@H](C)C(=O)N(C)Cc1cn2ccccc2n1 6527577 AFDSWWUBTDXUPC-GFCCVEGCSA-N 376.258 2.821 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)N1CC[C@]2(CN(C)C(=O)O2)C1 72172914 ISOGHLPWROTHCS-SFHVURJKSA-N 375.812 2.970 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)CC2)cn1 328655245 YFNBYISWLHOBHH-KRWDZBQOSA-N 382.512 2.715 0 50 GFAA COCc1cc(CN2CCN(Cc3ccccc3)[C@H](CCO)C2)ccc1OC 39532239 LDSBFQHPRFKDCU-JOCHJYFZSA-N 384.520 2.910 0 50 GFAA O=C(O)[C@H]1CC2(CCNCC2)CN1C(=O)C(c1ccccc1)c1ccccc1 72166312 QLICXCFZDXIXEJ-LJQANCHMSA-N 378.472 2.874 0 50 GFAA CCOCCCN1C(=O)CC[C@@H]2CN(Cc3ccc4nccnc4c3)CC[C@@H]21 14969206 ANEGBENVHZNHQT-NQIIRXRSSA-N 382.508 2.869 0 50 GFAA O=C1NC[C@@]2(CCCN(Cc3c(-c4ccccc4)nc4ncccn34)CC2)O1 72149724 QUVWNLIKLHCYDN-NRFANRHFSA-N 377.448 2.861 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@H]2N(C)C)cc1 77376345 PRRBJADJLKHXFS-LEWJYISDSA-N 375.476 2.746 0 50 GFAA COc1ncccc1C(=O)N1C[C@@H](NC(=O)C2CC2)[C@H](c2ccc(C)cc2)C1 77456763 SHCKJJZOXWYKAX-RBUKOAKNSA-N 379.460 2.533 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCCN(C(=O)c2ccccc2S[C@H](C)C(=O)O)C1 262393091 AQTUIKCYOIQPBK-CABCVRRESA-N 392.521 2.876 0 50 GFAA O=C(N1CCC[C@H](N2CCN(c3ccc(F)cc3)CC2)C1)C1(O)CCCCC1 72131986 FTFWJQOTROBPSV-FQEVSTJZSA-N 389.515 2.634 0 50 GFAA COc1ccc(C(=O)N[C@H](C(=O)N2CCC(c3ccn[nH]3)CC2)C(C)C)cc1 172385436 JGEROXWKUIHUSC-IBGZPJMESA-N 384.480 2.579 0 50 GFAA CC[C@@H](NS(=O)(=O)CC[C@@H]1CCCCN1C(C)=O)c1ccc(OC)cc1 242164625 WWOKAWYPENNVMX-PKOBYXMFSA-N 382.526 2.857 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC[C@H](Cn2cc(C(C)(C)N)nn2)C1 48351436 AJKFMHWJAKFLLM-AWEZNQCLSA-N 375.904 2.986 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cccc(-n3cccn3)c2)C2CC(O)C2)cn1 223556733 QKRUYDROAPBNJB-OUNSHVDWSA-N 378.432 2.518 0 50 GFAA C[C@@H](NC(=O)NC1CCN(C(C)(C)C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 175758545 WXEAJVVWANXNTN-CYBMUJFWSA-N 399.532 2.852 0 50 GFAA CC(=O)N(C)c1ccc(-c2ccc(C(=O)NC3(C(N)=O)CCCC3)cc2)cc1 426436558 MXEPYAQIIWAZSM-UHFFFAOYSA-N 379.460 2.864 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@H]2CC[C@@H]1CN(Cc1ccc(C(=O)O)cc1)C2 95517273 YODYBRCIRGZKOS-ZWKOTPCHSA-N 383.448 2.613 0 50 GFAA CCn1cnnc1CN1CCC(Oc2ccccc2C(=O)N2CCCCC2)CC1 95510023 HVESRWLDWYYXEH-UHFFFAOYSA-N 397.523 2.968 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2ccco2)C1)c1cc(=O)c2cccc(F)c2[nH]1 97117302 CYUAGSVEWMTXTO-CQSZACIVSA-N 383.423 2.902 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3C[C@H]4CC[C@@H]3CN(S(C)(=O)=O)C4)oc2c1 91779675 HTWMRXFICNCMQL-LSDHHAIUSA-N 376.478 2.546 0 50 GFAA O=C(Nc1nnc(-c2ccccc2)s1)N1CCCN(c2ncccn2)CC1 23542707 SZWBQMRBUIXEFG-UHFFFAOYSA-N 381.465 2.739 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(Cc2cccc(OC)c2)CC1 96164815 VGZBIZZKXADZTI-UHFFFAOYSA-N 380.496 2.931 0 50 GFAA Cc1cccc(OC2CN(C(=O)Nc3cc(NS(C)(=O)=O)ccc3C)C2)c1 96152727 GZKCRSRJCINAPS-UHFFFAOYSA-N 389.477 2.970 0 50 GFAA O=C(O)[C@@H](c1cnn(Cc2ccccc2)c1)N1CCC(Oc2cccnc2)CC1 95388095 UVFKXSCJCAWJLI-OAQYLSRUSA-N 392.459 2.996 0 50 GFAA COc1cccc2[nH]cc(CC(=O)N[C@@H](C)C3(N4CCOCC4)CCCC3)c12 182195919 HDKDDQFWFNCNLA-INIZCTEOSA-N 385.508 2.869 0 50 GFAA Cc1cc(C(=O)N(C)[C@@H]2CCSC2)ccc1NS(=O)(=O)C(F)(F)F 163335132 YEFPVKFHRWZJJT-LLVKDONJSA-N 382.429 2.834 0 50 GFAA O=C(CCOc1ccccc1)N1CCC2(CC1)CN(Cc1ccncc1)CCO2 827920949 CSMZVFPAQLBTAL-UHFFFAOYSA-N 395.503 2.744 0 50 GFAA COCCCn1c(C)cc(O)c([C@H](CC(=O)OC)c2ccc(F)c(F)c2)c1=O 824396637 ZDOJEILPMARSIX-CQSZACIVSA-N 395.402 2.872 0 50 GFAA CCCc1nnc(-c2cccc(C(=O)N3CC[C@]4(CN(C)C(=O)O4)C3)c2)s1 823020291 MMQJQOGKNRHTQC-IBGZPJMESA-N 386.477 2.824 0 50 GFAA C[C@@H]1CCCN1S(=O)(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 185231644 QADAIQXSDPBCPB-SECBINFHSA-N 376.360 2.896 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)[C@H]1C[C@H]3C=C[C@@H]1C3)C2 1565530879 ULWNQLBNKFOLGM-LESCRADOSA-N 375.476 2.702 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2cc(F)cc(C(F)(F)F)c2)CC1 186638857 JPMFBARBNMOROM-UHFFFAOYSA-N 376.350 2.856 0 50 GFAA CC(C)Oc1ccc(S(=O)(=O)N2CC[C@](C(=O)O)(C(F)(F)F)C2)cc1 275258682 IMLDVKXCJCHCKU-AWEZNQCLSA-N 381.372 2.502 0 50 GFAA O=C(CCN1CCN(c2ccccn2)CC1)N1CCN(C2CC2)c2ccccc21 187545810 WDCRPBAPSYXNMC-UHFFFAOYSA-N 391.519 2.609 0 50 GFAA O=C(O)Cc1csc(NC(=O)c2nnn(-c3ccccc3)c2C(F)(F)F)n1 170671095 CPZDFMSJVSKVLC-UHFFFAOYSA-N 397.338 2.622 0 50 GFAA Cc1c(NC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cccc1OCC(F)(F)F 170620797 CBNALQDOCSPJDN-LLVKDONJSA-N 380.388 2.587 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCO[C@@H](c2cccc(O)c2)C1 188716542 WGNIBWDEELLAKB-GOSISDBHSA-N 384.823 2.840 0 50 GFAA CC(C)(C)OCc1cc(CNc2cc(N3CCCC[C@@H]3CO)ncn2)no1 192358994 DTGSYTJTIGNAPG-OAHLLOKOSA-N 375.473 2.743 0 50 GFAA CCCN(CC)c1ccc(C(=O)N2CCC[C@H](c3nc(N(C)C)no3)C2)cn1 194446200 WMASSIOBZVSVHA-INIZCTEOSA-N 386.500 2.787 0 50 GFAA COc1cc(C)ccc1C(=O)NCC1CCN(C(=O)CCn2ccnc2C)CC1 1506415882 RDIPNINBXUCJTI-UHFFFAOYSA-N 398.507 2.567 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529174773 XXEKINNUQQEUTJ-XMSQKQJNSA-N 392.503 2.892 0 50 GFAA Cc1ccc(-c2csc(NC(=O)C[C@@H]3C(=O)NCCN3C(C)C)n2)s1 1529191714 CYNGBGPXIYOTGY-CYBMUJFWSA-N 378.523 2.717 0 50 GFAA O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@H](O)[C@](CO)(Cc2ccccc2)C1 1529195138 GGGORUOZOGAVKX-PKOBYXMFSA-N 394.393 2.529 0 50 GFAA Cn1cncc1C(=O)N1CCCN(C(=O)C2(c3ccccc3)CCCCC2)CC1 1704344955 RDAVNALLDHJNLA-UHFFFAOYSA-N 394.519 2.997 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)CCc3cn[nH]c3)CC2)cc1 11662738 CBHNZCUSRCFJLX-UHFFFAOYSA-N 384.524 2.764 0 50 GFAA COC(=O)c1ccccc1-c1cc(C)cc2c1O[C@H](CNC(=O)[C@H]1CCOC1)C2 12027320 DEWFFSOFJYPKAO-RDJZCZTQSA-N 395.455 2.905 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C[C@@H]3CCOC3)CC2)c(Cl)c1 12718703 MZVRSTRSAFFUQR-HNNXBMFYSA-N 396.915 2.596 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1ccccn1)C2 14745404 PWXBEEPCQXGOCH-INIZCTEOSA-N 399.564 2.524 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)c3cccs3)C[C@]23CC[C@H]1O3)c1ccccc1 1857726310 LGCVRUXKCBKCSU-BIZBXSGISA-N 382.485 2.798 0 50 GFAA COc1ccc(Cl)cc1-n1nc(-c2ccccn2)nc1[C@H]1CC[C@@H](N)[C@H](O)C1 1857726485 UCDLCUWJYCPSRL-DXCKQFNASA-N 399.882 2.947 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)N3CCC4(CCc5ccccc54)CC3)CC2=O)s1 1857727548 SVCVFJCAZSRCDR-INIZCTEOSA-N 396.516 2.706 0 50 GFAA O=C(NCc1ccc(F)cc1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 222185999 MRACWIJGRKVSIY-PBHICJAKSA-N 388.468 2.615 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@H]2CCOC3(CCOCC3)C2)CC1 333492487 ZQHUBTBJNOFDIR-KRWDZBQOSA-N 389.496 2.671 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@H](c3cccc(F)c3)C2)n(-c2ccccc2)n1 237981298 XMLWXBHWDCPZLA-IBGZPJMESA-N 395.390 2.923 0 50 GFAA O=C(NC1CC1)c1cn([C@H]2CC[C@@H](NCc3ccc(F)c(F)c3)CC2)nn1 247736017 KTHZJQFXUXRMFM-OTVXOJSOSA-N 375.423 2.722 0 50 GFAA CCc1ccc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1 252523102 BWQYQVYYQUVCOS-INIZCTEOSA-N 378.519 2.780 0 50 GFAA O=S(=O)(c1ccc(Br)cc1)N1CCN(Cc2ccccc2)CC1 19681836 GETTWQGXWARMQE-UHFFFAOYSA-N 395.322 2.956 0 50 GFAA in-vitro CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 363403789 FLMJNPXFJIMWHL-RTWAWAEBSA-N 394.519 2.665 0 50 GFAA O=C1N=CC=C[C@@H]1c1noc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1 904753339 DOVNOVQDCIPMBX-QGZVFWFLSA-N 397.394 2.746 0 50 GFAA O=C(NC1CCCC1)c1cnc(N2CCC[C@H](Cn3ccnn3)C2)c(Cl)c1 1875264986 ZRFNMWYWHMBQIU-AWEZNQCLSA-N 388.903 2.916 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NC12CCC(CO)(CC1)CC2 1875329671 CJFSOYLYLHDODX-UHFFFAOYSA-N 381.476 2.873 0 50 GFAA CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ncc(-c3ccc(F)cc3)o2)CC1 1875300809 RHBBRQPYYHZWGM-LBPRGKRZSA-N 390.415 2.641 0 50 GFAA Cc1cc(C(=O)N[C@](C)(C(=O)O)c2cc(F)ccc2F)c2nc(C)n(C)c2n1 1875304555 NPUTZEYLIAEWGE-IBGZPJMESA-N 388.374 2.593 0 50 GFAA Cc1cc(Br)ccc1NCC(=O)NC[C@H](CCO)c1ccncc1 1875320361 AFRBYXPYBZAYQB-HNNXBMFYSA-N 392.297 2.847 0 50 GFAA CCSCCN1CCCNC(=O)CC[C@H](c2ccccc2)CCNC(=O)C1 2100533411 NZJIXWPZPQCUFJ-IBGZPJMESA-N 391.581 2.632 0 50 GFAA COc1cc(-c2ccc(N3CC(=O)NCC3=O)c(C)c2)cnc1C(F)(F)F 2325756968 TWEDJQZKOBSTRZ-UHFFFAOYSA-N 379.338 2.547 0 50 GFAA O=S(=O)(N1CCCCC1)N1CCN(c2cc(Cl)ccc2Cl)CC1 644433 LDYQUWYSUXJHLR-UHFFFAOYSA-N 378.325 2.846 0 50 GFAA CCOC(=O)CN1C(=O)[C@](O)(CC(=O)c2ccc(Cl)s2)c2ccccc21 1109333 NMCDCCOQHZNNII-SFHVURJKSA-N 393.848 2.772 0 50 GFAA COc1cc2c(cc1CN1CCC[C@]3(CCc4cnc(N(C)C)nc43)C1)OCO2 2356136887 AETADZIEDAHDKX-QFIPXVFZSA-N 396.491 2.760 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356165832 QCYRTDRUJMKTII-ZWOKBUDYSA-N 391.899 2.636 0 50 GFAA COC(=O)CN1C(=O)[C@](O)(CC(=O)c2ccc3ccccc3c2)c2ccccc21 4555344 BBCQSBSWPVSGBN-QHCPKHFHSA-N 389.407 2.820 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(OC)c1OC 4603817 VHRREUSYQCPEHL-HNNXBMFYSA-N 380.466 2.628 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1c(F)cccc1F 4749155 MIHZBDDBHKMCSH-UHFFFAOYSA-N 390.371 2.808 0 50 GFAA COc1ccc(CNC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)cc1 6189069 GLLOQSWXBVFWQE-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA C[C@@H]1CCCN(c2ccccc2OS(=O)(=O)c2cnn([C@H]3CCOC3)c2)C1 225445028 CFRCXETZPYERCI-CVEARBPZSA-N 391.493 2.849 0 50 GFAA CCOc1ccc(OC[C@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)cc1 225835810 WWKCPAAOUHAXQF-ZHRRBRCNSA-N 397.427 2.646 0 50 GFAA CCN(CC)C(=S)S[C@@H]1CC(=O)N(c2ccc(NC(C)=O)cc2)C1=O 100915256 OBTSMJKKLRPEJE-CQSZACIVSA-N 379.507 2.637 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCCCN1CCOCC1 20051408 VHYVVUCCENTHFN-UHFFFAOYSA-N 381.835 2.895 0 50 GFAA COc1cc(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)cc(OC)c1 20910702 WMRCBGJMSHWMIY-KRWDZBQOSA-N 376.522 2.834 0 50 GFAA COc1ccc(-n2c(C)nnc2SCC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)cc1 247416621 MWOAIKFSWAPEHF-WIOUJZMWSA-N 384.505 2.837 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nc2c(cnn2C2CCOCC2)c(=O)[nH]1 66354669 RVEJWGYZBXCGGM-DNVCBOLYSA-N 393.491 2.707 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)c3c(F)cccc3Cl)CC2)n1 67622784 ZVTFTKFCJWYHMQ-UHFFFAOYSA-N 377.851 2.972 0 50 GFAA CCC(=O)N[C@H](c1nnc2n1CCN(Cc1ccc(F)cc1F)CC2)C(C)C 20452672 HTJKAAHMMXVLQB-IBGZPJMESA-N 391.466 2.838 0 50 GFAA COc1nc(OC)nc(N2CCC(c3[nH]ncc3-c3cccc(C)c3)CC2)n1 67690548 OMFVAOYAHYLAIU-UHFFFAOYSA-N 380.452 2.971 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN(C)CCC(C)(C)O)C2=O)cc1 67675543 QBXVJHMFZRSDBP-QFIPXVFZSA-N 376.541 2.756 0 50 GFAA Cc1cccc(CN2CCN(C(=O)[C@H](Cc3cnc[nH]3)n3cccc3)CC2)c1 63848755 FAXYUJUDOWNXPN-NRFANRHFSA-N 377.492 2.648 0 50 GFAA COc1cccc(CC2=NO[C@H](C(=O)NCc3ccc(-n4cccn4)cc3)C2)c1 11840268 YKMHVSYQIGDRQX-NRFANRHFSA-N 390.443 2.885 0 50 GFAA COc1ccc2c(c1)C[C@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1c(C)nn(C)c1C)CC2 328622243 IIGVZZDFWLMODG-YCRNBWNJSA-N 396.535 2.712 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)NC2(CO)Cc3ccccc3C2)C[C@@H](C)O1 363130837 BIUQJCOPTLNQHM-IAGOWNOFSA-N 395.503 2.952 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c(=O)c1CCC(=O)N[C@@](C)(CO)C1CCCCC1 157993668 BKIMGACGCLVRGK-QFIPXVFZSA-N 398.507 2.520 0 50 GFAA O=C(CCOC[C@@H]1CCCO1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 153091651 ONXRLYRXNBGDQJ-PMACEKPBSA-N 398.507 2.854 0 50 GFAA C[C@@H](C1CCN(c2nc(C(C)(C)C)nc3c2cnn3C)CC1)N1CCOCC1 72131792 GRQSQPKRHAGYHJ-HNNXBMFYSA-N 386.544 2.598 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N[C@@H]2CCCN(C3CCCCCC3)C2)cc1 72149611 KQBSPTWVRSHLRZ-MRXNPFEDSA-N 380.510 2.850 0 50 GFAA Cc1nc(C)n(C[C@@H]2CN(C(=O)c3ccc(-c4csc(C)n4)cc3)CCO2)n1 333452537 MDGFNZVOJOCFHD-SFHVURJKSA-N 397.504 2.868 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)Nc2cc(C(N)=O)ccc2F)C1 454531582 YDUKMYFOJBBIOO-OAHLLOKOSA-N 384.455 2.910 0 50 GFAA C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)[C@H]2CSCN2C(=O)c2ccccc2)C1 241124126 JFUWFOXPLAYQLI-MJQMVNBJSA-N 389.565 2.684 0 50 GFAA CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)N[C@H]2CCCC[C@H]2C)C1=O 242048189 VTNGLMQBTUROSU-DAESXHAQSA-N 387.480 2.547 0 50 GFAA CN1CCN(c2ccc(NS(=O)(=O)c3ccc(C(F)F)cc3)nc2)CC1 288490368 CZCQTEZHWZMJOW-UHFFFAOYSA-N 382.436 2.572 0 50 GFAA COc1ccc(CCN2C(=O)CC[C@@H]3CN(C(=O)c4cncs4)CC[C@@H]32)cc1 20512812 CPRMKVAIXSMDDB-AEFFLSMTSA-N 399.516 2.848 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2c[nH]nc2-c2ccccc2)CC1=O 82137759 UNGNDCXPUHVLMT-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA N[C@@H]1CC[C@H](C(=O)N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)C1 91746346 STVNSLMVYWJXFC-YSDNAHFUSA-N 381.520 2.668 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCc1noc(-c3ccccc3)n1)C2 91536609 WRYIHWZIALFMTI-INIZCTEOSA-N 379.416 2.655 0 50 GFAA NC(=O)c1c(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)sc2c1CCCCCC2 239402608 QVMVBPAPBMXUBR-LWWSYDQCSA-N 388.489 2.967 0 50 GFAA COc1ccc(F)cc1CN1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95521660 OBGDTTOYORJVFZ-UHFFFAOYSA-N 398.482 2.843 0 50 GFAA O=C(N[C@H]1CC[C@H](O)CC1)[C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 244608515 FEAPOPOMMSMMKG-MQSCRBSSSA-N 399.579 2.783 0 50 GFAA O=C(c1cc[nH]n1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940196632 WYOZVKFXVOVAGK-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA O=C(NCCc1csc(-c2ncccn2)n1)[C@H]1CCCN(Cc2ccco2)C1 952991159 ZRXBUUYPCQHHKM-HNNXBMFYSA-N 397.504 2.764 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N2CCc3ccccc3C2)cc1C(=O)N(C)C 952975063 XVBPUKCYBRSWJH-HNNXBMFYSA-N 381.476 2.782 0 50 GFAA O=C([C@H](Cc1ccccc1)NCC1=Cc2ccccc2OC1)N1CCOCC1 185162689 VFKNHAKNQBFEMS-NRFANRHFSA-N 378.472 2.522 0 50 GFAA O=S(=O)(c1cnn(CC(F)F)c1)N(Cc1ccccc1)C[C@H]1CCCO1 186624701 ZUIDJLSHABXWFK-OAHLLOKOSA-N 385.436 2.518 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)ccc1F 729421035 ILLHTYXQKMHIDJ-INIZCTEOSA-N 394.443 2.850 0 50 GFAA Cn1nc(C(=O)N2CCN(c3cncc4ccccc34)CC2)cc1OC(F)F 194288537 YIIMNWBVZAYJEB-UHFFFAOYSA-N 387.390 2.532 0 50 GFAA COc1cccc(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1OC 1529178779 PIAHTTDCSZJIQD-OXQOHEQNSA-N 392.455 2.928 0 50 GFAA Cc1cc(N2CCN(Cc3nnc(C)s3)CC2)nc(-c2ccccc2O)n1 1529190336 HIVMIMJFPQPTPW-UHFFFAOYSA-N 382.493 2.640 0 50 GFAA CCCN(Cc1ccccn1)C(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1ccccc1C 1529112609 PHOUIAUFYKGMIW-RTWAWAEBSA-N 381.476 2.727 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N3C[C@@H](O)[C@H](Cc4ccccn4)C3)o2)CC1 1704357039 OAIZFGAGLOTULS-YLJYHZDGSA-N 383.492 2.582 0 50 GFAA COc1ccccc1CN1CCCC[C@H]1CCn1cc(C(=O)NC2CC2)nn1 11882237 RZGOGROBQUOKIY-SFHVURJKSA-N 383.496 2.624 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)[C@H]1CCCCN1CCc1ccccc1 12076052 CPSUXSLRGDWKIO-HXUWFJFHSA-N 376.464 2.698 0 50 GFAA CSc1nnc(CNC(=O)CCn2nc(C)cc2C)n1-c1ccc(F)cc1 12207387 WOCGTKNTLFNYFC-UHFFFAOYSA-N 388.472 2.648 0 50 GFAA O=C(CC[C@@]1(Cc2ccc3c(c2)OCO3)CCC(=O)N1)NCc1ccsc1 12210191 YJJGATNVZBRHIB-FQEVSTJZSA-N 386.473 2.765 0 50 GFAA CC(C)N(Cc1cnn(C)c1)C(=O)CCc1nnc(CCc2ccccc2)o1 12314412 PSPBZZRKKWTLBZ-UHFFFAOYSA-N 381.480 2.958 0 50 GFAA O=C(NCc1cccnc1N1CCN(c2ccccn2)CC1)[C@H]1CC=CCC1 12717256 RRZPVSRSCVYURK-SFHVURJKSA-N 377.492 2.776 0 50 GFAA COC(=O)CCCC(=O)N[C@@H]1CCCc2c1cnn2-c1ccc(F)cc1F 12725610 ZLQSSKLNUBNSDW-OAHLLOKOSA-N 377.391 2.987 0 50 GFAA O=C(NC[C@@H]1CCCO1)[C@@H]1C[C@H](CN2CCCC2)CN(CCc2ccccc2)C1 14748959 NNKNPPJVZBFWQP-ZLNRFVROSA-N 399.579 2.558 0 50 GFAA CC(C)c1noc(-c2cn(C3CCN(C(=O)Cc4ccc(F)cc4)CC3)nn2)n1 169777480 WEFFALGQQICSDG-UHFFFAOYSA-N 398.442 2.997 0 50 GFAA N=c1[nH]c2cc(C(=O)N[C@H]3CC(=O)N(c4cccc(Cl)c4)C3)ccc2s1 1857719150 FECLUOAAUZFTDT-LBPRGKRZSA-N 386.864 2.898 0 50 GFAA CCN(Cc1nc(-c2cccc(C)c2)no1)C(=O)[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857730574 RSGHXHSBFIVMJJ-RCCFBDPRSA-N 384.480 2.551 0 50 GFAA Cc1ccc(NC(=O)CN2CCc3ccc(S(=O)(=O)N(C)C)cc32)cc1C 115569021 LGIAEXLNOXNWLG-UHFFFAOYSA-N 387.505 2.555 0 50 GFAA CCc1ccc(C(=O)Nc2cc(C3CCOCC3)[nH]n2)cc1S(C)(=O)=O 156365295 FIBVYFKGIQHYOC-UHFFFAOYSA-N 377.466 2.522 0 50 GFAA Cn1nnc2c1C[C@H](C(=O)N1CCN(c3c(Cl)cccc3Cl)CC1)CC2 377984886 MKTAYTGSYMIAKG-GFCCVEGCSA-N 394.306 2.576 0 50 GFAA NC(=O)NC[C@@H]1CCN(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1 1875258195 JMKYTXKGRDRGTH-FQEVSTJZSA-N 394.519 2.788 0 50 GFAA CN(Cc1nc(O)c2ccccc2n1)C(=O)CCCN1Cc2ccccc2C1=O 1875281184 UGTHOLJRIYXBRS-UHFFFAOYSA-N 390.443 2.730 0 50 GFAA O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NCC1(OCCO)CCCC1 1875274825 IDDDVCHRNNLQCG-OAHLLOKOSA-N 398.912 2.581 0 50 GFAA C=CC(=O)N(C)CC(=O)N1Cc2cnn(-c3ccc(F)cc3)c2CC(C)(C)C1 1875366264 HKVQLYLROZVKQA-UHFFFAOYSA-N 384.455 2.567 0 50 GFAA COc1cc(C)cc(C)c1[C@H](C)NC(=O)C1CCN(c2cc(O)ncn2)CC1 1875309853 QPTQZEDKCIHMFH-HNNXBMFYSA-N 384.480 2.901 0 50 GFAA CCn1nc2c(c1C(=O)N1CCOc3c(cccc3OC)C1)C[C@H](C)O[C@@H]2C 1875314217 NJFNJOYAQKSIQM-UONOGXRCSA-N 385.464 2.969 0 50 GFAA COc1ccccc1/C=C/CN1CC[C@H](Oc2ccnc(CNC(C)=O)c2)C1 886044862 IDBXUXQMLBWOGK-XYASWCNUSA-N 381.476 2.893 0 50 GFAA Brc1ccccc1-c1noc(C2CCN(Cc3nc[nH]n3)CC2)n1 888101387 PVODLWITVGBHAE-UHFFFAOYSA-N 389.257 2.997 0 50 GFAA CCC[C@@H](CC)C(=O)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(C)n2)C1 1775990963 GRLUROXIBPNFMT-DYESRHJHSA-N 375.513 2.872 0 50 GFAA Cc1ccc(OCCNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1C 2812128 BRZWLWOQTIGXLS-UHFFFAOYSA-N 388.489 2.788 0 50 GFAA Cn1nnc([C@@H]2CN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)CCO2)n1 2100482557 ILKHVVXWSHYPCM-INIZCTEOSA-N 389.887 2.666 0 50 GFAA CCOCC1(C(=O)NC[C@H]2CN(C(=O)c3ccc4cc[nH]c4n3)CC[C@@H]2C)CC1 2325793629 BAZCSUZHHYIUJK-RDJZCZTQSA-N 398.507 2.594 0 50 GFAA CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)[C@H]3CCCc4nc(C)[nH]c43)C2)ccn1 2325806416 SBISGPOZESQSOO-MOPGFXCFSA-N 397.523 2.665 0 50 GFAA CC1(C)C[C@H](C(=O)N2CCC(O)(c3cc[nH]n3)CC2)CN1Cc1ccccc1 2325807857 YJLYDLAPCPGVAJ-SFHVURJKSA-N 382.508 2.520 0 50 GFAA N[C@@H]1CCc2c(C(=O)Nc3ccc(-n4nccc4C(F)(F)F)cc3)n[nH]c2C1 2325856263 HXRJHXFPEDBITG-SNVBAGLBSA-N 390.369 2.683 0 50 GFAA Cc1cc(C(=O)NCc2nc3cc(Br)cnc3[nH]2)cc(C)c1CN 2325857826 QTKAOIQIVJUDTG-UHFFFAOYSA-N 388.269 2.726 0 50 GFAA O=C(c1cccc2ncnn12)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356134470 OJNBOUYGUSMEDA-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA Cc1ccc(S(=O)(=O)Oc2ccc(C(=S)N3CCC(O)CC3)cc2)cc1 2810807 RHLHDYIDURKDOI-UHFFFAOYSA-N 391.514 2.895 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCCN(C(=O)[C@H](C)Oc2ccccc2)CC1 8567358 ZFWHFIKEVJKILW-OALUTQOASA-N 396.487 2.982 0 50 GFAA CN(C)c1ncc(CN[C@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)s1 55199074 BBCNFJABOYCINO-HNNXBMFYSA-N 378.929 2.796 0 50 GFAA C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1CCC(CN2CCCCC2=O)CC1 118851822 OHYVKWJJOTZHIE-QGZVFWFLSA-N 389.515 2.897 0 50 GFAA COC[C@H]1CCCN(C(=O)c2ccc(N3CCCN(CC(C)C)CC3)nc2)C1 67847438 PJLSGLUYWZDDHY-IBGZPJMESA-N 388.556 2.748 0 50 GFAA Cc1nnc(-c2cccc(C(=O)N3CCN(Cc4cccc(O)c4)CC3)c2)o1 119291018 NYAUZTGOUDEBDE-UHFFFAOYSA-N 378.432 2.709 0 50 GFAA Cc1nc(CC(=O)NCc2cccnc2N(C)CCc2ccccn2)cs1 67446917 FMGWKQIXXNMCDU-UHFFFAOYSA-N 381.505 2.779 0 50 GFAA Cc1cc(-n2cccn2)ccc1NC(=O)NC1CCN(c2ncccn2)CC1 252478231 AFWSGKKPSHFVME-UHFFFAOYSA-N 377.452 2.761 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)Cn3ccc(=O)c4ccccc43)CC2)n1 219851214 DBSVHLREJVXEKU-UHFFFAOYSA-N 380.448 2.914 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252549478 RHVHXLBLWGBJBV-MRXNPFEDSA-N 394.406 2.953 0 50 GFAA Cc1cnc(N2CCC[C@@]3(CN=C(O)C3)C2)nc1N1CCC[C@]2(CN=C(O)C2)C1 329805984 NOBGXZWHFGNRGZ-LEWJYISDSA-N 398.511 2.679 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NCC(=O)Nc3ccccc3)C2)c1 363188462 KOQSGJWCGTUQCW-SFHVURJKSA-N 393.487 2.911 0 50 GFAA O=C(N[C@@H]1CCCN(CCCc2ccccc2)C1)c1nnc2n1CCCCC2 72154530 ZCOFYWNILHTXAN-LJQANCHMSA-N 381.524 2.832 0 50 GFAA CCN(C)C(=O)CN1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 77487433 JSAXGLSGEQWNTD-UHFFFAOYSA-N 377.916 2.633 0 50 GFAA CC(C)N1CCC(N[C@@H]2CC[C@@H]2NC(=O)CCc2nc3ccccc3[nH]2)CC1 72122430 WPCFYHLVPFEGMR-UXHICEINSA-N 383.540 2.605 0 50 GFAA Cc1cc(S(=O)(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)sc1Cl 239722326 CCDIRBWOLDMAFX-UHFFFAOYSA-N 393.962 2.961 0 50 GFAA COc1ccc(N2CCN(C(=O)CCc3ccc(C)c(OC)c3)CC2=O)cc1 82161130 ISAQPDXVMCWXDD-UHFFFAOYSA-N 382.460 2.820 0 50 GFAA CCNC(=S)Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1 17076833 OFAXMZNBOHYTOA-UHFFFAOYSA-N 375.519 2.740 0 50 GFAA O=C(O)c1cccc(N2CCN(Cc3ccc(Br)s3)CC2)n1 263444835 YEKRBMXOXZJFLI-UHFFFAOYSA-N 382.283 2.926 0 50 GFAA COc1ccc(OC)c(-c2cc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)no2)c1 175301731 HZDPKDFRTAGSRG-FXAWDEMLSA-N 380.400 2.747 0 50 GFAA C[C@H](Cn1cncn1)NC(=O)N1CCC(CCC(=O)Nc2ccccc2)CC1 426726687 BRJCWGWILVUHGZ-MRXNPFEDSA-N 384.484 2.507 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Nc1cccc(Cl)c1Cl 239425820 VHQHLRDEWOJBSN-JVWCJPHESA-N 391.254 2.985 0 50 GFAA O=C(c1cccc(S(=O)(=O)N[C@@H]2CCCOC2)c1)N1CCCCCCC1 95380756 MZFNYWSEHVWAFT-QGZVFWFLSA-N 380.510 2.550 0 50 GFAA C[C@@H](CNC(=O)c1cccc(-c2cc(C(=O)NC3CC3)ccn2)c1)n1ccnc1 426581355 XBTYPQCQUYQMJB-HNNXBMFYSA-N 389.459 2.828 0 50 GFAA Cc1nc(CCNC(=O)Nc2ccc(N3CCCC3=O)cc2)nc2c1CCC2 96148513 SOWWYVHVYCBIBZ-UHFFFAOYSA-N 379.464 2.765 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(Cc1cnn3c(C)cc(C)nc13)CC2 96150710 NAFLXEZARYPOHM-UHFFFAOYSA-N 393.539 2.829 0 50 GFAA COc1ccc(CN2CC(c3ccccn3)C2)cc1OC[C@@H](O)CN(C)C(C)C 95511845 QWCGRGSPGSAATQ-FQEVSTJZSA-N 399.535 2.770 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)N2CCN(c3ccncc3)CC2)cc1 97619027 QSTBPVXMELDDCQ-MRXNPFEDSA-N 379.464 2.951 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)nc(C)n1 95376581 ZIFWMKGOTGHVPP-CEWLAPEOSA-N 378.476 2.501 0 50 GFAA Cc1ccccc1N1CCCN(C(=O)c2coc(CN3CCOCC3)c2)CC1 95362452 USZYXTZDCTYXRM-UHFFFAOYSA-N 383.492 2.773 0 50 GFAA O=C(CN1CCCC1)N1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2 96164498 DJKCKNIYAHPUDN-NRFANRHFSA-N 395.547 2.870 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(CN3CCC(Cc4ccc(F)cc4)CC3)n2C)C1 252540172 OUXXACPNZWAJBV-KESTWPANSA-N 399.514 2.791 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)c3cn(C)nc3-c3ccccc3)CC2)n1 183949812 UMVWNNSJHBRWIX-UHFFFAOYSA-N 390.491 2.963 0 50 GFAA CCOc1ccc(C=c2sc3nc(-c4cccs4)nn3c2=O)cc1OC 254318983 RQOZKFZAXPLRFX-UHFFFAOYSA-N 385.470 2.835 0 50 GFAA COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@]12C 253604837 RKZIYOHKBLFLTH-XKUUBIQESA-N 394.552 2.757 0 50 GFAA O=C(Nc1cccnc1N1CCOCC1)N1CC[C@@H](Oc2cccc(F)c2)C1 183505621 JJFAOEGPYHPWEU-QGZVFWFLSA-N 386.427 2.743 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)NCc3nc4cccc(C)c4[nH]3)CC2)nc1 584886643 VNASMAVQHNATHM-UHFFFAOYSA-N 379.464 2.768 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)c2ccc(-c3ccno3)o2)n1 952983290 SXNNNNGRPXASFQ-NSHDSACASA-N 378.410 2.967 0 50 GFAA Cc1cc(C(=O)N2CC[S@](=O)C[C@@H]2c2cnn(C)c2)cc(C)c1OC(F)F 277416492 HZUXOLDATNFWHT-RXAIFQJESA-N 397.447 2.584 0 50 GFAA CCN1CCN(c2ccc(C(F)(F)F)cc2S(=O)(=O)NC(C)C)CC1 170610822 YYOQQCBFZXJNTL-UHFFFAOYSA-N 379.448 2.534 0 50 GFAA COCCN(C)c1ccc(CN2CCC[C@H](C(=O)Nc3cccc(C)n3)C2)cn1 191242139 ZHGCROYWZBAHLX-IBGZPJMESA-N 397.523 2.718 0 50 GFAA COC(=O)[C@H](CNC(=O)C(F)(F)c1ccc(F)cc1)Oc1ccc(F)cc1 759927635 OQMWSJFUQOCNIY-HNNXBMFYSA-N 385.313 2.793 0 50 GFAA C[C@H](Cc1ccc2c(c1)OCO2)CN1CCC(=O)N(Cc2cscn2)CC1 1506405721 LDSWCMIHBOAFCS-OAHLLOKOSA-N 387.505 2.785 0 50 GFAA NC(=O)/C(=C\c1ccccc1)NC(=O)c1ccccc1I 1163398 HAUKKSNOOBNVGU-GXDHUFHOSA-N 392.196 2.547 0 50 GFAA Cn1ccnc1CN1C[C@H]2CN(Cc3cnc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772808391 OWJAYHSFQZSHIU-OFNKIYASSA-N 390.535 2.710 0 50 GFAA CCCCNC(=O)[C@@H]1C[C@H](COc2cccnc2)CN(Cc2ccncc2)C1 14748789 VSPQQHUZEVJNNV-VQTJNVASSA-N 382.508 2.910 0 50 GFAA CCCCc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccnc3)CC2)cc1 16604698 TVNFAVMEUQRUFF-UHFFFAOYSA-N 387.505 2.571 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccc(F)cc4)c2=O)CCCCC3)no1 169760301 KHIGKIQHWOQUJO-UHFFFAOYSA-N 384.411 2.536 0 50 GFAA CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc2c(cc1Br)OCO2 4599446 VSHNGTSABVWOTR-AWEZNQCLSA-N 397.225 2.759 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cnn(-c3ccccc3Cl)c2)CC12CCOCC2 1857693874 QJEUDXHEWGCRNA-HNNXBMFYSA-N 375.856 2.839 0 50 GFAA CCN(Cc1ccncc1)C(=O)[C@@H]1C[C@H](C(=O)O)N(C)[C@@H]1c1ccccc1F 213315641 KCACRDCNRWPAEN-BHIYHBOVSA-N 385.439 2.715 0 50 GFAA CS(=O)(=O)Nc1nc2c(s1)CN(C(=O)C13CC4CC(CC(C4)C1)C3)CC2 408081134 RAGYQCRDDNUFHP-UHFFFAOYSA-N 395.550 2.616 0 50 GFAA CC1CCN(C2CCC(NC(=O)N3CCC[C@@H]3[C@H]3COCC[C@@H]3O)CC2)CC1 369174043 LHQPOGZRMONDKX-BFGFKNPTSA-N 393.572 2.601 0 50 GFAA COC1(OC)CCOC[C@@H]1NC(=O)c1csc(-c2c(F)cccc2F)n1 912851056 JRKAGMKHMDFHFQ-ZDUSSCGKSA-N 384.404 2.596 0 50 GFAA Cc1ccc([C@H](C)[C@@H](O)C(=O)N[C@@H](C(=O)N2CCCC2)c2ccccc2)cc1 1875254756 IGIYYKDXBKYOQX-IOMROCGXSA-N 380.488 2.939 0 50 GFAA COc1ccc(OC)c(NC(=O)C[C@@H](NCCC2=CCCCC2)C(=O)O)c1 2856207 AFTBUXCWKWDELU-QGZVFWFLSA-N 376.453 2.966 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(C(=O)c3cc(C(C)C)[nH]n3)CC3(CC3)C2)n[nH]1 2325794785 REDLGZFAHODAIV-UHFFFAOYSA-N 398.511 2.758 0 50 GFAA COc1ccc2ccnc([C@H](C)NC(=O)c3cnn4ccc(CN)cc34)c2c1 2325857357 YTGBNUQRBISYAG-ZDUSSCGKSA-N 375.432 2.841 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2CCNC(=O)[C@@H]2c2ccc(F)cc2C)c1 2325888913 LNANMBYIEUTMQA-IBGZPJMESA-N 381.407 2.572 0 50 GFAA COC[C@H](NC(=O)c1ccc(-c2cc(OC)c(C)[nH]c2=N)cc1)c1ccccn1 2356150127 MZOZYJBOYNVZMJ-IBGZPJMESA-N 392.459 2.991 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)c1ccc3nnc([C@H](O)C(C)C)n3c1)C2 2356165485 BEMQODAVFNWIML-LJQANCHMSA-N 380.448 2.626 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C(=O)Cc4cccc(C(F)(F)F)c4)C[C@@H]13)O2 2356165760 MXAWWCIPDXZTIA-DFEOGRTESA-N 382.426 2.816 0 50 GFAA CN(Cc1ccc(CN2CCC[C@@H](C(=O)c3ccccc3)C2)o1)S(C)(=O)=O 106973143 PVDADBNMNOQAMO-QGZVFWFLSA-N 390.505 2.766 0 50 GFAA COc1c(C)cc(S(=O)(=O)NCc2noc(-c3cccs3)n2)cc1C 225520621 CUSBHUBPJAJYRY-UHFFFAOYSA-N 379.463 2.902 0 50 GFAA COc1ccc(C2=NO[C@H](C(=O)N3CCN(Cc4ccc(F)cc4)CC3)C2)cc1 20602471 YAYQBZGHELIVGH-NRFANRHFSA-N 397.450 2.672 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1CCc1ccccc1 100468960 AIXQBKIXOBZQGQ-HXUWFJFHSA-N 397.906 2.832 0 50 GFAA O=C(c1ccc(N2CCCCCCC2)nc1)N1CCC(N2CCOCC2)CC1 67514405 LBHNUTHOTVIZFT-UHFFFAOYSA-N 386.540 2.789 0 50 GFAA CCCN(Cc1cccc(OC[C@@H](O)CN2CCN(CC)CC2)c1)CC1CC1 20600396 SNGCOBBRQDKPQQ-QFIPXVFZSA-N 389.584 2.686 0 50 GFAA COC(=O)c1ccsc1NC(=O)CN1CCN(C/C=C/c2ccccc2)CC1 20220953 GBYFHFMCTKUJAH-VMPITWQZSA-N 399.516 2.804 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCc2c(c(C(=O)O)nn2C)C1 67691344 GUKWJOMWTIFSTB-UHFFFAOYSA-N 376.416 2.687 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]3(CCCN(Cc4ccccc4F)C3=O)C2)nc(C)n1 12300618 IHYGBUMCXPDONP-QFIPXVFZSA-N 396.466 2.887 0 50 GFAA CCOc1nc(C)ccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 252482097 CXXJZRUAQOQKEN-IBGZPJMESA-N 381.476 2.752 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)c3csc([C@H]4CCCO4)n3)CC2)s1 121799619 CITUXOGKRCUFTA-CQSZACIVSA-N 391.518 2.963 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F 123761574 HLUUQBKJUOVPKI-NWDGAFQWSA-N 386.376 2.501 0 50 GFAA CCc1cc(C(=O)Nc2ccc(CCN3CCC(C(N)=O)CC3)cc2)ccc1O 486025669 FAQGRNOKKVTLLF-UHFFFAOYSA-N 395.503 2.947 0 50 GFAA O=C(NS(=O)(=O)CC(F)(F)F)c1cc(OCC2CC2)c2ccccc2n1 129959837 ZRTQRKMRMVVSPV-UHFFFAOYSA-N 388.367 2.646 0 50 GFAA Cc1cc(N2CCN(C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)CC2)nc(C(C)C)n1 155246968 FOQRJCHCJQVLIA-NXHRZFHOSA-N 387.528 2.554 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCc2c(nc(-c3cccnc3)nc2N(C)C)C1 72165884 MNOUUOROVUDJCK-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA CN(c1ccc2nnnn2n1)C1CCN(c2ccccc2C(F)(F)F)CC1 367175018 YNQDZGUFFGFPOR-UHFFFAOYSA-N 377.374 2.643 0 50 GFAA COCc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)Nc2cc(F)ccc2F)o1 72426528 GEYMIAFEGSAIHU-ZDUSSCGKSA-N 394.374 2.574 0 50 GFAA CN(C)CC(C)(C)NC(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71767929 NXYVMRHTYOVMSF-DEOSSOPVSA-N 393.531 2.990 0 50 GFAA O=S(=O)([C@@H]1CCCN(c2ccnc3ccncc23)C1)N1CCc2ccccc21 333219698 RNRTVLVURFAFMG-QGZVFWFLSA-N 394.500 2.991 0 50 GFAA C[C@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)[C@@H]1CCOC1 237482954 RMMZKZLMLQWLII-CMPLNLGQSA-N 397.353 2.744 0 50 GFAA C[C@@H]1CCC[C@H](NC(=O)CN2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C2=O)[C@@H]1C 241121737 JDPIQTJSTHWUOZ-XNWVLMOPSA-N 396.491 2.572 0 50 GFAA Cc1nn2c(nnc3c(=O)n(C[C@H]4CCCO4)ccc32)c1-c1ccc(F)cc1 40392067 JIQSPJYSYFXHDT-OAHLLOKOSA-N 379.395 2.733 0 50 GFAA COc1cccc(CN2CCN(C(=O)N[C@@H]3C[C@H]3c3ccccc3)CC2=O)c1 426623386 XYLRCAFDTLZYGF-VQTJNVASSA-N 379.460 2.605 0 50 GFAA CC(C)NC(=O)CCN1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426412280 MJQKEBLVKWLLOX-OAQYLSRUSA-N 393.478 2.694 0 50 GFAA Cc1cc2c(cc1NC(=O)NCCCn1ccnc1C(C)C)n(C)c(=O)n2C 96132588 VHYFSLLITXIUST-UHFFFAOYSA-N 384.484 2.717 0 50 GFAA CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc2cnn(C(C)C)c2nc1C 291441520 BHVINWLIXZIFAH-SFHVURJKSA-N 377.448 2.638 0 50 GFAA CCNc1ccnc(N[C@@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)n1 91636411 NYDGSHUYFAPOBH-MRXNPFEDSA-N 397.527 2.785 0 50 GFAA CC[C@@H](C)[C@H](NC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1)C(=O)O 238899989 HNUPIHOETWAZJL-NNFUDEMPSA-N 399.491 2.818 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2CCN(C(=O)c3ccc(C)c(O)c3)CC2)n1 95355973 LJSAXKGAZFYTNC-UHFFFAOYSA-N 380.370 2.780 0 50 GFAA NC(=O)[C@H]1CCCN(C(=O)CN2CCCCC[C@@H]2/C=C/c2cccs2)C1 181955178 SDXPDFGJQKJKQL-YXWZHEERSA-N 375.538 2.730 0 50 GFAA CN(C(=O)Cc1csc(-c2cccnc2)n1)c1ccc(N2CCOCC2)nc1 182994072 SUQJNFJACQUVQZ-UHFFFAOYSA-N 395.488 2.642 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc4ccccc4n3)C[C@H]2CCO)CC1 257371998 HFMKIIAXWUVUBW-HSZRJFAPSA-N 396.579 2.976 0 50 GFAA Cc1cnn(Cc2cc(C(=O)N3CCC([C@H](O)c4ccccc4)CC3)no2)c1 163194948 LBQHOMYKPXUMFF-HXUWFJFHSA-N 380.448 2.814 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Br)N1C[C@@H](CCO)[C@@H](CO)C1 1347591275 STOFSUOYZWFDED-NXEZZACHSA-N 396.203 2.531 0 50 GFAA O=C(NCc1ccc(Cl)cc1)N[C@H]1COCC[C@@H]1OCc1ccccn1 1565507171 RSCAVDRYMVGNHB-ROUUACIJSA-N 375.856 2.909 0 50 GFAA CC[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2C(=O)N2c3ccccc3C[C@H]2C)C[C@H]1O 408022361 WMFYLLHAPSGPDC-HGNHLGAKSA-N 384.520 3.000 0 50 GFAA CCc1nnc([C@H]2CN(C(=O)Nc3cnn(-c4ccccc4)c3C)CCO2)o1 276074422 UWPGKABWIPXHBY-MRXNPFEDSA-N 382.424 2.732 0 50 GFAA O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCO[C@]2(CCOC2)C1 170082788 IFNDGSBCHLFMHV-QGZVFWFLSA-N 381.354 2.523 0 50 GFAA CN1CC[C@H](NC(=O)c2ccc(Sc3ccccc3Cl)nn2)CC1=O 170606092 NIBIWYAVKIUPLW-NSHDSACASA-N 376.869 2.632 0 50 GFAA CCCN(Cc1ccccc1)C(=O)NCC1(N2CCOCC2)CC(OCC)C1 192545721 NMIGHGQRGRQOOY-UHFFFAOYSA-N 389.540 2.878 0 50 GFAA O=C(NC[C@@H](c1cccnc1)N1CCCCC1)c1nnc(O)c2ccccc12 1506407696 KYBOASCSMYIFBX-SFHVURJKSA-N 377.448 2.687 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)cc1Cl 1071188 SIWRDICZESWQNL-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(C/C(=C\C(C)C)c3ccccc3)C[C@]2(CO)C1 1772819032 NSSZXSJTSASWTI-POXLGUGUSA-N 386.536 2.515 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 5724376 OKEQFUMTESNXDI-SNVBAGLBSA-N 386.832 2.702 0 50 GFAA COC(=O)[C@@H](NC(=O)c1coc(COc2ccc3ncccc3c2)n1)C(C)C 12449086 VYPDMVUKOJGQBV-SFHVURJKSA-N 383.404 2.729 0 50 GFAA COc1ccc(/C=C2\SC(=O)N(CC(=O)Nc3cccnc3)C2=O)cc1OC 13571719 LUZJKQYECCXQBI-SXGWCWSVSA-N 399.428 2.774 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1cc(F)ccc1F 14948648 YRRSKZWEXDKEGQ-SFHVURJKSA-N 384.390 2.544 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCCCc3cccnc3)CCC2=O)cc1 15076142 MAIOBEIUHAQWDM-FQEVSTJZSA-N 395.503 2.620 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)Cc4ccc(Cl)cc4)nnc3c2)n1 169776156 VAQLJMXVUNTTSR-UHFFFAOYSA-N 396.838 2.854 0 50 GFAA O=C(Cc1cccc(Cl)c1)N1CC[C@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778127 AQVMHOSBTBOHPQ-HNNXBMFYSA-N 398.854 2.875 0 50 GFAA NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3 970581 JQZCQPBWXZIKFT-UHFFFAOYSA-N 385.514 2.963 0 50 GFAA CC[C@@]1(C(=O)NCc2cccs2)C[C@@H]2CC[C@H]1N2C(=O)C1CCOCC1 1857677725 BFOWKNIPTCDNAI-XAUMDUMWSA-N 376.522 2.951 0 50 GFAA COc1ccnc(C(=O)N2CCC3(CCc4c(O)nc(C5CC5)nc43)CC2)c1 1857715307 LSAVTIWYDJKEPL-UHFFFAOYSA-N 380.448 2.583 0 50 GFAA C/C=C/CCCC(=O)NC[C@H]1[C@H]2CN(Cc3cnsc3)C[C@]23CC[C@H]1O3 1857740889 RMJYTTUOCZMMEE-PUZZEVCZSA-N 375.538 2.985 0 50 GFAA CCCn1cc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c(C)n1 1857741487 VGJXHDWBLJNPJD-JQVVWYNYSA-N 394.475 2.516 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N[C@](C)(CN)CC(C)C 225478704 OLEAOOPOSYLPQL-HNNXBMFYSA-N 393.347 2.808 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)c(F)c1 478818468 DCPZWALNXVHDGC-UHFFFAOYSA-N 376.428 2.825 0 50 GFAA Cc1c(C(=O)Nc2ccc(OCC(=O)O)c(Cl)c2)cnn1C1CCOCC1 262908946 HHKYJOKMCKOTED-UHFFFAOYSA-N 393.827 2.912 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(=O)n(C)c3)n2C[C@@H]2CCOC2)[C@H]2CCCC[C@@H]12 910152604 GITXUZZJYBDXBS-NEPXVJNWSA-N 397.523 2.695 0 50 GFAA Cc1nc([C@H](C)OC(=O)[C@@H]2CC(=O)Nc3ccc(Br)cc32)no1 1875260201 QUUIJMZFEPNCKE-WRWORJQWSA-N 380.198 2.871 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2csc([C@H]3CCCNC3)n2)C[C@H]1c1ccccc1 1875279874 JJLXHWFPIGOHQH-HRCADAONSA-N 385.489 2.551 0 50 GFAA O=C(N[C@H]1C[C@H]1C1CCN(C(=O)/C=C/c2cn[nH]c2)CC1)OCc1ccccc1 1875270931 LROLTMHQYKFZDF-ZBWOGFRMSA-N 394.475 2.976 0 50 GFAA Cc1oc(Br)cc1-c1nc(-c2cc3c(nc2O)CCNC3)no1 1875283654 YZHYOKJQONALJX-UHFFFAOYSA-N 377.198 2.814 0 50 GFAA Cc1ccccc1CC1(O)CCN(C(=O)[C@H]2[C@H]3CC[C@@]2(c2ccnn2C)C3)CC1 1875395835 NGGVEFIWDJYKAG-LEEZEASISA-N 393.531 2.992 0 50 GFAA Cc1nc([C@@H]2COC[C@@H]2NC(=O)c2ccc(OC3CCC3)cc2Cl)n[nH]1 1875401940 WVUSTSCQCKPWBQ-ZBFHGGJFSA-N 376.844 2.610 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc1OC1CCCC1 1875400453 AKRIGRCZHOPJNN-KFKAGJAMSA-N 399.491 2.783 0 50 GFAA O=C(N[C@@H]1CC12CCN(C(=O)[C@@H]1C[C@H]1C1CCC1)CC2)c1occ2c1CCOC2 2325793924 LQEDEYZKERZACH-IPMKNSEASA-N 398.503 2.899 0 50 GFAA O=C(CN1CC[C@H](C(F)(F)CO)C1)N1CC=C(c2c[nH]c3ccccc23)CC1 2325809893 YEBKBOZMUPDRGS-INIZCTEOSA-N 389.446 2.733 0 50 GFAA C[C@H](Sc1nc(CC(=O)Nc2cc(C(F)(F)F)ccn2)cs1)C(N)=O 879421651 JIRPVAUPHAPIKC-ZETCQYMHSA-N 390.412 2.704 0 50 GFAA Cc1sc2nc(CN3CCOCC3)nc(N[C@@H]3CCN[C@H]4CC[C@H]43)c2c1C 2332239227 CWQXOJRNRLMNLK-OWCLPIDISA-N 387.553 2.693 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCn3ccccc3=O)C2=O)cc1 2356142618 ZPTCJFMLDWRYKQ-HSZRJFAPSA-N 393.487 2.735 0 50 GFAA CCn1cncc1CN1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 2356151180 VZIDJWUNIHYLNL-UHFFFAOYSA-N 390.491 2.941 0 50 GFAA COc1ccc(N2C(=O)C[C@H](SCC(=O)Nc3ccc(F)cc3)C2=O)cc1 100040457 GBQSSLKTVJVMOL-INIZCTEOSA-N 388.420 2.838 0 50 GFAA O=C(Nc1cnc2n1CCCC2)c1cccc(OCC(=O)N2CCCCC2)c1 67447170 BKOAULSPMOMBKJ-UHFFFAOYSA-N 382.464 2.863 0 50 GFAA CC[C@@]1(C(=O)O)C[C@H](C(=O)NCc2ccco2)[C@H](c2ccc(OC)cc2)N1C 67690934 ZBEMUPQFQAPAAU-WFXMLNOXSA-N 386.448 2.831 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N[C@@H](CCN)C(F)(F)F)ccc12 423736132 PEZIHTQUAPGBKI-HNNXBMFYSA-N 377.370 2.738 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2cnn(CC(C)C)c2)CC1 328645587 SDHFYLBLFIHWQM-NRFANRHFSA-N 384.528 2.732 0 50 GFAA Cc1nc2c(cnn2C(C)C)c(C)c1CCC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 252538924 NIYVTQHTXTYWMD-YAKQMPQVSA-N 382.508 2.789 0 50 GFAA O=C([C@@H]1C[C@H]1c1cccnc1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328636883 VSYZIVSKNKNLMW-CEXWTWQISA-N 378.476 2.860 0 50 GFAA O=C(CN1CCN([C@@H]2CC[C@H]3SCCS[C@H]32)CC1)Nc1ccc(F)cc1 230119468 FUPLTKWTKGAMQE-LMMKCTJWSA-N 395.569 2.761 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CN[C@@H](C(=N)O)c2ccc(F)cc2)CC(=O)N1C 328620094 GQXLZDFYQLOMBO-GDIGMMSISA-N 387.459 2.562 0 50 GFAA Cc1[nH]c2c(c1C(=O)N1CCC(=O)N(CC3CC3)[C@H](C(C)C)C1)C(=O)CCC2 71523853 JJWPDBMNZWQVPR-KRWDZBQOSA-N 385.508 2.951 0 50 GFAA CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 154333351 XWNSEMFEYYFBKI-LYRGGWFBSA-N 385.291 2.995 0 50 GFAA O=C(CC1C[C@@H]2CC[C@H](C1)N2)Nc1ccc2nc(N3CCOCC3)sc2c1 237903753 JCAOYPQZXQKULU-GOOCMWNKSA-N 386.521 2.992 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(c3cnccn3)CC2)C1 71775999 OVSMLUUOTLXYHR-HXUWFJFHSA-N 393.535 2.516 0 50 GFAA Cc1cccc(OC[C@@H]2CCCN(C(=O)CCc3c(C)nc(=O)[nH]c3C)C2)c1 72431322 REQPKLCUWUAIID-GOSISDBHSA-N 383.492 2.945 0 50 GFAA O=C(CCC(=O)N1CCN(c2nsc3ccccc23)CC1)NC1CCCC1 49550244 ATFMGSANMJDDDG-UHFFFAOYSA-N 386.521 2.784 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95518412 QLFCGVILDHZBSU-GOSISDBHSA-N 378.480 2.628 0 50 GFAA O=C(c1ccnc(N2CCN(CCOc3ccccc3)CC2)c1)N1CCCC1 96136098 IOQUQXWDWBRZAC-UHFFFAOYSA-N 380.492 2.519 0 50 GFAA CCS[C@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91504040 ZGFPWLCVLDPDIJ-MRXNPFEDSA-N 375.538 2.954 0 50 GFAA COc1cccc(NC(=O)N2CCN(CCOc3cccc(OC)c3)CC2)c1 96142314 HOIPCAIGLOFDFS-UHFFFAOYSA-N 385.464 2.932 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccnnc1 96150447 IUCWLXIWRRHDPQ-IBGZPJMESA-N 382.508 2.902 0 50 GFAA O=C(c1cnccn1)N1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2 95378220 YROGQABTBKAWHJ-LJQANCHMSA-N 390.487 2.878 0 50 GFAA CCCCN1CCc2[nH]cnc2C12CCN(c1ccc(C(=O)NCC)cn1)CC2 95520462 GHEHUOBDOKAWOQ-UHFFFAOYSA-N 396.539 2.708 0 50 GFAA COc1ccc(CC(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3=O)cc1 95381875 IMKJFEXUCHODKS-VQTJNVASSA-N 378.472 2.887 0 50 GFAA CSCC[C@@H](CO)NC(=O)COc1cc2oc(=O)c(C)c(C)c2cc1Cl 253414809 YRJNJVRPKFDQFN-LBPRGKRZSA-N 399.896 2.672 0 50 GFAA biogenic O=C(NCCCSCc1ccc(F)cc1)N1CCN(c2ncccn2)CC1 584896900 KHZGUSSFYIRREN-UHFFFAOYSA-N 389.500 2.771 0 50 GFAA O=S(=O)(c1ccc2nc(O)sc2c1)N1CCCN(C2CCCC2)CC1 952975811 XKRWOHAHKBDIOJ-UHFFFAOYSA-N 381.523 2.641 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCN(c3ncccc3Cl)CC2)CC1 952870234 YRJICROBGXEACA-UHFFFAOYSA-N 385.899 2.557 0 50 GFAA Cc1cccc(NC(=O)CN2CC[C@H](c3ccc4c(c3)OCO4)[C@@H](O)C2)c1C 1565514930 QDVJJGCYMFVSDQ-MJGOQNOKSA-N 382.460 2.821 0 50 GFAA Cc1n[nH]nc1C(=O)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F 189176427 YKDOJQWKWPQMOU-OAHLLOKOSA-N 381.402 2.640 0 50 GFAA O=C1CCC(CCC(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)=NN1 1506417934 UIHDAZSWPVRKBS-UHFFFAOYSA-N 383.279 2.688 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CCc3n[nH]c(C)c3C2)s1 1506406362 HJLOQAMEEXTHRS-UHFFFAOYSA-N 378.479 2.798 0 50 GFAA O=C(c1cccnc1NCCn1nc(-c2ccccc2)ccc1=O)N1CCCC1 1529172034 DIUHXSAVMYWIDS-UHFFFAOYSA-N 389.459 2.653 0 50 GFAA C[C@@H](O)c1nc2cc(-n3ccnc3-c3ccccc3OCC(=O)O)ccc2n1C 1775982730 DFDGRUDLHBFRBV-CYBMUJFWSA-N 392.415 2.943 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)C1 12027800 KYELNGSKJIEBPL-SFHVURJKSA-N 395.547 2.700 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)NCCCc2ccccc2)c1=O 12217328 DSHJNNZAYBWBQJ-UHFFFAOYSA-N 383.492 2.617 0 50 GFAA CCN1C(=O)S/C(=C\c2cc(Br)ccc2OCC(=O)O)C1=O 2844132 LCXRVHWWKMILHV-WDZFZDKYSA-N 386.223 2.969 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCN(C(=O)N3CCCCC3)CC2)c(C)c1 2857740 SAPNJFLHCOFDOS-UHFFFAOYSA-N 379.526 2.524 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)NCCc1ccnn1C)C2 1857685784 UAWFNRXPFVUJKP-CYBMUJFWSA-N 385.493 2.612 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857724517 ZLYMECNZRSYXGJ-UPVQGACJSA-N 394.515 2.786 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3cccc(OC(F)F)c3)C[C@]23CC[C@H]1O3 1857735017 CRJBOXKJQRDBEZ-TVKQPGBESA-N 380.435 2.794 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2[nH]c3c(c2C)C(=O)CCC3)CC1 1857738347 DAIHTVISTVXHPZ-UHFFFAOYSA-N 394.475 2.766 0 50 GFAA Cn1c([C@H]2CCCCN2C(=O)c2cccc(OCC(N)=O)c2)nc2ccccc21 115757479 BZLLMYDPLDJJKI-LJQANCHMSA-N 392.459 2.805 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3CCC4(CCNCC4)CC3)n2)cc1 252478651 ARGULTYWNQXGGA-UHFFFAOYSA-N 384.480 2.670 0 50 GFAA COc1cccc(CC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 1704312864 AJCYVRSYGSAFGW-QFIPXVFZSA-N 380.492 2.600 0 50 GFAA O=C(CCc1ccccn1)N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403369 UVFIXLCRAAQSRP-DUXKGJEZSA-N 390.487 2.834 0 50 GFAA CC(=O)c1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1 1130683 ZCFFCIODCPZFDN-LJQANCHMSA-N 386.473 2.989 0 50 GFAA CC1(C)CCCC[C@H]1CC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2ncnn12 2325794038 OZVHEVZKFGOMAM-ULQDDVLXSA-N 395.507 2.761 0 50 GFAA O=C1c2ccccc2C(=O)N1CCc1nc2ccccc2c(=O)n1Cc1ccco1 1211846 KAKVXVHTDFIFRI-UHFFFAOYSA-N 399.406 2.877 0 50 GFAA CN(C)C(=O)CCC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356145143 CTSOVUFXLBYOCR-QHCPKHFHSA-N 392.503 2.818 0 50 GFAA COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)N1CCCO[C@H](CF)C1 416949952 RGCAQWDHUNWDTO-MRXNPFEDSA-N 395.475 2.903 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)c2ccc([C@@H]3CCCO3)s2)CC1 67674170 PVKOQQNZWIOUPT-INIZCTEOSA-N 386.521 2.676 0 50 GFAA O=C(O)c1cn(C[C@@H]2CCCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)nn1 67473286 BZTYSGGGTUZUMS-CQSZACIVSA-N 379.420 2.524 0 50 GFAA CC(=O)c1ccc(NC(=O)Cn2c(-c3nonc3N)nc3ccccc32)cc1 678349 KYZLBFNIQZNZKF-UHFFFAOYSA-N 376.376 2.510 0 50 GFAA COc1cccc(COC[C@@H](O)CN2CCO[C@@H](c3ccc(F)cc3)C2)c1 229698194 MZPUOAFWEYJTAM-PZJWPPBQSA-N 375.440 2.785 0 50 GFAA O=C(Nc1cc(Cl)ccc1O)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2794730 LAXUYPCRUGDTII-UHFFFAOYSA-N 395.810 2.654 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@H](O)c2c(F)cccc2F)n1C 328640322 QANJVHUMNOBBDM-AEFFLSMTSA-N 377.435 2.924 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)Cc3ccn(C)c3)C2)c1 12438605 MTHBIZNIUFMOBE-SFHVURJKSA-N 397.519 2.911 0 50 GFAA NC(=O)c1ccc(-c2nc(CN3CC[C@H](Oc4cccnc4)C3)cs2)cc1 154696843 GOYPAPUPNQTUDR-SFHVURJKSA-N 380.473 2.957 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)n1 72434107 KXLXKZCZTQPUGR-UHFFFAOYSA-N 393.413 2.832 0 50 GFAA O=C1NCCN1CCN1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 368009536 XBQSSLBENGRFCI-MRXNPFEDSA-N 375.517 2.787 0 50 GFAA CC1(C)CN(C(=O)NCc2ccc(N3CCCCC3)nc2)C[C@@]2(CCOC2)O1 280391936 WXQDMFQPMSCJMJ-OAQYLSRUSA-N 388.512 2.551 0 50 GFAA C[C@H](O)c1cc2n(n1)CCCN(Cc1cnc(NCc3ccccc3)nc1)C2 219172519 YYSOFDLCPQTIQH-INIZCTEOSA-N 378.480 2.744 0 50 GFAA Cc1nc(N2CCN(C(=O)c3cccc(F)c3)CC2)cc(-n2cnc(C)c2C)n1 72446843 MBUJOURKURIRKN-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA COc1cc(CC(=O)N2CCCN(c3ccc(F)c(F)c3)CC2)ccc1O 451529605 GUYJALWEDWVQID-UHFFFAOYSA-N 376.403 2.960 0 50 GFAA Cc1ccccc1NC(=O)[C@@H]1CN(C(=O)c2coc3c2C(=O)CCC3)CCO1 72478229 MCCHILQKNUPSLD-SFHVURJKSA-N 382.416 2.587 0 50 GFAA CC(C)c1ccc(N2C[C@H](C(=O)N3CCC(c4ncn[nH]4)CC3)CC2=O)cc1 221165906 UBGDETKIMNWFTM-QGZVFWFLSA-N 381.480 2.687 0 50 GFAA C[C@H]1CN(CCCCNC(=O)c2cc(N(C)C)c3ccccc3n2)C[C@H](C)O1 241657591 PXNHVQLROSGRQR-IRXDYDNUSA-N 384.524 2.920 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3nccn3C)csc2C1 426689149 IRYZTCVUWYKUMS-UHFFFAOYSA-N 399.520 2.617 0 50 GFAA CC(C)[C@H]1C(=O)NCCN1C(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 177087250 SQWWFAYGQFNZPX-AWEZNQCLSA-N 387.509 2.852 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC2CCN(C)CC2)CN1Cc1cccc2ccccc12 20919123 ZFIJTWHNBJLVCK-GGAORHGYSA-N 394.563 2.603 0 50 GFAA O=C(c1ccccc1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 91625918 GCWCGYZRZCKFSW-UHFFFAOYSA-N 378.476 2.726 0 50 GFAA C[C@@H]1CCCCN1CC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91504572 NAYJHANAPLERCJ-LJQANCHMSA-N 398.551 2.687 0 50 GFAA O=C(NCc1nnc2n1CCC2)Nc1ccc2c(c1)C(F)(F)OC(F)(F)O2 96139169 QUNFNNCQRQGFCZ-UHFFFAOYSA-N 387.293 2.555 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1F 95522088 OMVDECTYAJFNER-UHFFFAOYSA-N 396.466 2.783 0 50 GFAA O=C(NCCN1CCCCC1)c1ccc(-c2ccc3nc(CO)[nH]c3c2)cc1 534582480 AGLPTBSTFOTGAR-UHFFFAOYSA-N 378.476 2.938 0 50 GFAA NC(=O)c1cc(-c2cccc(C(=O)NCC3(Cn4cccn4)CC3)c2)cs1 534651114 IBCRQLBRGANTJK-UHFFFAOYSA-N 380.473 2.921 0 50 GFAA Cc1ccc(Cl)c(OC[C@H](O)CSc2nnc(-c3cnccn3)n2C)c1 184720954 KJHDDMVVGCGDHG-LBPRGKRZSA-N 391.884 2.766 0 50 GFAA O=C(NC[C@H]1CCN(C2CCCCC2)C1)N1CCN(c2ccccc2)C(=O)C1 584896028 HKXLFEHJGJRUPX-GOSISDBHSA-N 384.524 2.699 0 50 GFAA COCC(=O)Nc1cc(NC(=O)[C@@H](c2cccc(F)c2)N(C)C)ccc1OC 952966923 HJRJZQXWTXUUDL-LJQANCHMSA-N 389.427 2.661 0 50 GFAA COc1ccc(S(=O)(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)cc1F 952967361 ZAQSMZNYYYIKEM-HNNXBMFYSA-N 380.441 2.599 0 50 GFAA O=C(Nc1ccc(CNC(=O)c2cnn(-c3ccccc3)n2)cc1)c1ccncc1 749136895 KVVCYAYHZCVKSP-UHFFFAOYSA-N 398.426 2.845 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCC2(c3ccccc3F)CCCC2)C1 1506413157 HHDQOOJUPVOQOG-MRXNPFEDSA-N 384.517 2.830 0 50 GFAA Cc1cc(C)n(C[C@H](C)N2CCN(c3cc(O)nnc3-c3ccccc3)CC2)n1 1506397401 SYHJDGJLPZZLJY-SFHVURJKSA-N 392.507 2.873 0 50 GFAA O=C(N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1)C1(c2ccccc2F)CC1 1704303120 WXLFLLFUYGVIHS-WMZHIEFXSA-N 397.446 2.764 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2)CCCN(S(=O)(=O)c2cccnc2)C1 12434504 BPXUFWHUDKJJSA-FQEVSTJZSA-N 388.489 2.658 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2C(=O)N[C@H]3CCCC[C@H]3N2C(=O)c2ccco2)c1 13856432 YHVQUFHTUQQOGA-RCCFBDPRSA-N 395.459 2.869 0 50 GFAA Cc1cccc(CC(=O)N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c1 14980924 BUICWEUWNMVLKF-LJQANCHMSA-N 383.536 2.519 0 50 GFAA Cc1ccc(OCc2cc(C(=O)N[C@H](Cn3ccnc3)C(C)(C)C)no2)cn1 15063286 JERXULGJMKXAIG-GOSISDBHSA-N 383.452 2.998 0 50 GFAA O=C(c1ccccc1)[C@H]([C@@H](c1ccccc1)N1CCOCC1)N1CCOCC1 19364532 DILBRNVHMMLSJR-YADHBBJMSA-N 380.488 2.644 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2cccn2)C[C@@H]1O)c1ccc(Nc2cccnc2)cc1 1857532681 FKGMMICNUWXBKO-XPGWFJOJSA-N 377.448 2.591 0 50 GFAA Cc1ccc(N2CCC(N3CC[C@H](O)[C@@]4(CCCNC4=O)C3)CC2)cc1Cl 1857690362 IVSZGDPBNPDBOV-PZJWPPBQSA-N 391.943 2.580 0 50 GFAA O=C(N1CCCOc2cccc(c2)CC[C@@H]2CCCCN2CC1)C1(CO)CC1 1857703372 JQUMUCHUDHWAQS-FQEVSTJZSA-N 386.536 2.857 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857725470 XXWBVIKZDLNEJB-VXKWHMMOSA-N 380.488 2.857 0 50 GFAA O=C(O)c1ccc(CN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1 1857729881 IJYFAFKQWHWHOO-JQVVWYNYSA-N 378.428 2.659 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@H](c2ccccc2OC)[C@@H](C(=O)O)C1 248032398 LTEWIGGVZZVFLG-KGLIPLIRSA-N 377.872 2.945 0 50 GFAA CC1([C@@H]2CCCN(C(=O)N[C@@H](C[C@@H]3CCCO3)C(F)(F)F)C2)OCCO1 847244361 CCHZZQJMBSHQKD-RDBSUJKOSA-N 380.407 2.671 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1CCc2c(O)nc(O)nc2C1)c1ccc2ccccc2c1 1875308070 RPFSDZSUXHAAKU-KBPBESRZSA-N 392.459 2.665 0 50 GFAA O=C(N=[S@]1(=O)CCC[C@]2(CCCN2)C1)c1cccc(Oc2cnccn2)c1 1875392985 CDSHFDCRTBOKIJ-WINIVTDRSA-N 386.477 2.793 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CN(C(=O)c1cccc(-n3ccnc3)c1)C2 1875301620 NCWHMGANMHGDFH-YJBOKZPZSA-N 382.464 2.954 0 50 GFAA O=C(N[C@@H](C1CCOCC1)C(F)(F)F)c1c(C(F)F)nc2cnccn12 2325761979 SZSPRXPLDTYHQI-LBPRGKRZSA-N 378.301 2.754 0 50 GFAA CCOCC1(C(=O)NC[C@H]2CN(C(=O)c3ccc4cc[nH]c4n3)CC[C@H]2C)CC1 2325793630 BAZCSUZHHYIUJK-WBVHZDCISA-N 398.507 2.594 0 50 GFAA CCCN(CCNC(=O)c1ccc(C)n1C)C(=O)C[C@@H]1OCc2ccccc21 2325794788 RKJSQBTYMHHVBI-FQEVSTJZSA-N 383.492 2.964 0 50 GFAA C[C@H](CC(=O)Nc1cccc(NC(=O)c2cc3ccccc3n2C)c1)NC(N)=O 2325874260 GBVGAGSLECPWEL-CYBMUJFWSA-N 393.447 2.816 0 50 GFAA O=C(Nc1ccnc(O[C@H]2CCOC2)c1)c1cnn(-c2ccc(F)cc2F)c1 127497149 FVZBXEIHYYFUAM-HNNXBMFYSA-N 386.358 2.966 0 50 GFAA CCOC(=O)C1=C(N)Oc2c(c(C)nn2-c2ccccc2)[C@H]1c1ccncc1 634329 NDLHOGBISUPLRK-QGZVFWFLSA-N 376.416 2.833 0 50 GFAA COC(=O)C1=CN(C2CCCC2)C=C(C(=O)OC)C1c1ccc2c(c1)OCO2 1140753 MPGKCBBUAQOHLQ-UHFFFAOYSA-N 385.416 2.871 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 1158454 IIMKOUOKNHPZSZ-UHFFFAOYSA-N 398.893 2.896 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2oc3cc(OC)ccc3c2C)CC[C@@H]1O 2356156418 AVPFIFJIKRMMBG-OXJNMPFZSA-N 375.421 2.828 0 50 GFAA COc1ccc(-c2cnc3c(N4CC[C@@H](O)C4)nccn23)c2ccc(C)nc12 2356157762 PPLWPGMDGRUVJJ-CQSZACIVSA-N 375.432 2.833 0 50 GFAA CCOc1c(Br)cc(CNCCCN2CCOCC2)cc1OC 2886588 IMXSDKBNPVPNPO-UHFFFAOYSA-N 387.318 2.668 0 50 GFAA Cn1cc(CCCN[C@@H]2CCOC[C@H]2[C@@H]2CCCN2C(=O)OC(C)(C)C)cn1 222308913 BHLNBJBFWSGADB-QRVBRYPASA-N 392.544 2.747 0 50 GFAA CN(C)CCCn1c(=O)n(Cc2c(F)cccc2F)c2ccc(C(=O)O)cc21 55392788 GJEGZZOCJBPRPP-UHFFFAOYSA-N 389.402 2.779 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)c(=O)n1C 65376545 KNYWBUOKSHFVEG-PZJWPPBQSA-N 376.456 2.838 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3ccc(F)c(F)c3)CC2)C1 67742258 TZPMNZTZVWLBMN-MRXNPFEDSA-N 377.479 2.920 0 50 GFAA C[C@@]1(C2CCN(c3cc(-c4ccccc4)nc4ncnn34)CC2)N=C(O)N=C1O 330050824 MKDTWGSXYDZMES-FQEVSTJZSA-N 391.435 2.651 0 50 GFAA CCN1CCN([C@H]2CCN(C(=O)N[C@@H](C3CCCCC3)C(F)(F)F)C2)CC1 482306896 DSJQGSAOWUSUBE-IRXDYDNUSA-N 390.494 2.919 0 50 GFAA Cc1cc(N2CCN(C(=O)c3ccc(C)c(C)c3)CC2)nc(N2CCCC2)n1 35477269 WJJJQTWDXICAAZ-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CC(=O)N1CCC(Cc2ccccc2)CC1 241383221 MTJZANLJPICYSM-VWPQPMDRSA-N 384.520 2.741 0 50 GFAA Cc1csc(CN2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)n1 71761344 NFYAJHMTKBEDMS-KRWDZBQOSA-N 376.570 2.750 0 50 GFAA CC1(C)CC(=O)c2cc(C(=O)N3CCN[C@@H](c4ccccc4)C3)c(O)nc2C1 333786607 WPEPGDYUFFWLKL-GOSISDBHSA-N 379.460 2.729 0 50 GFAA CC(=O)Nc1cccc(-c2cc(C(=O)O)cc(S(=O)(=O)NC(C)C)c2)c1 71748202 BXUXVSHSSRIHCG-UHFFFAOYSA-N 376.434 2.697 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc(C(=O)O)c(C)n1 263359978 TWNDQMCMHCMICG-KRWDZBQOSA-N 397.431 2.649 0 50 GFAA COc1ccc(C(C)(C)CNC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)cc1 174434680 UUIYORPTHGXNGM-KRWDZBQOSA-N 385.512 2.675 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCN(Cc3cccc4ccccc34)CC2)CC1 20161746 XHUDLWIEHJLCHB-UHFFFAOYSA-N 379.504 2.743 0 50 GFAA Cc1ccc(C(=O)NC2CCN(C3CCCCC3)CC2)cc1S(C)(=O)=O 177230935 FFJAORVJZFUEMP-UHFFFAOYSA-N 378.538 2.925 0 50 GFAA O=C(C[C@H]1C=CS(=O)(=O)C1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 82114900 LSFQZGVSMQHUDC-GFCCVEGCSA-N 389.304 2.590 0 50 GFAA O=C(N[C@@H](c1ccncc1)c1ccc(Cl)cc1)N1CCN(CCCO)CC1 426478781 MPHUQQDMJREDJS-LJQANCHMSA-N 388.899 2.534 0 50 GFAA Cc1cc(N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)nc(N(C)C)n1 95521588 ALMPRLSOGSVUFP-GOSISDBHSA-N 377.496 2.875 0 50 GFAA Cn1cccc1C(=O)C(=O)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95508206 FBXKKZGKLFJIMB-DFQSSKMNSA-N 399.441 2.575 0 50 GFAA CCNc1ccnc(N2CCC3(CCC(=O)N(CCc4cccnc4)C3)CC2)n1 95360233 CSVUWCVDQVSNRM-UHFFFAOYSA-N 394.523 2.755 0 50 GFAA CN(C[C@H](O)COc1ccccc1CN1CCCOCC1)C1CCCCC1 95499288 FJCILMUIPVPNIB-NRFANRHFSA-N 376.541 2.913 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(Cc3ccccc3F)[C@@H](CCO)C2)cc1 23128815 MPQQTYTVRHDXJB-NRFANRHFSA-N 385.483 2.853 0 50 GFAA O[C@@H](COc1ccc(CN2CCCOCC2)cc1)CN1CCc2ccccc2C1 96150000 PVCRMHCRJZSQCY-HSZRJFAPSA-N 396.531 2.707 0 50 GFAA CCOC(=O)Cc1ccc(NC(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)cc1 95507917 QGRKTYFZBQLVJM-KRWDZBQOSA-N 387.480 2.659 0 50 GFAA CN(C)c1nc(N2CCC[C@@H](c3nccn3Cc3cscn3)C2)ncc1F 95528663 JCPINCOLUWNFBY-CYBMUJFWSA-N 387.488 2.767 0 50 GFAA CC(C)[C@@H](NCc1csc(-c2ccccc2F)n1)C(=O)N1CCOCC1 180077227 RGHUBHJNUPVCKV-QGZVFWFLSA-N 377.485 2.922 0 50 GFAA COCCn1ccc2c(OCC(=O)NC[C@H]3COc4ccccc4O3)cccc21 263587516 HQTDMTQTUPIFAC-INIZCTEOSA-N 396.443 2.623 0 50 GFAA O=C(c1cc(-c2ccccc2)no1)N1C[C@@H]2CC[C@H]1CN(c1ncccn1)C2 1565511632 YXLSNPKFPHJMML-WBVHZDCISA-N 375.432 2.873 0 50 GFAA O=C(Cc1noc2ccccc12)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O 191166974 BKPHMCGRZVPEJP-KRWDZBQOSA-N 399.397 2.956 0 50 GFAA O=C(CCNc1ncc(C(F)(F)F)cc1Cl)N1CCOC[C@]12CCOC2 195187885 UNGKQILRJWIIKD-OAHLLOKOSA-N 393.793 2.574 0 50 GFAA CN1C(=O)c2ccc(NC(=O)COc3ccc(Br)cc3)cc2C1=O 678748 XUDPYEYCAYNMQM-UHFFFAOYSA-N 389.205 2.692 0 50 GFAA CCOc1ccc(CCCC(=O)N2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)cc1C 1704351697 JHCVWCGLWSGMLQ-UYAOXDASSA-N 385.508 2.810 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)[C@@H]3CC(=O)OC34CCCC4)CC1)OCC2 1704337416 WYIXMCYHKLBHTO-KRWDZBQOSA-N 399.487 2.962 0 50 GFAA Cc1ccc(S(=O)(=O)c2c(N)n(CCCO)c3nc4ccccc4nc23)cc1 3166763 LJNWLZKRCZPMSL-UHFFFAOYSA-N 396.472 2.690 0 50 GFAA COc1ccc(-c2oc3cc(C)n(CCC(=O)O)c(=O)c3c2CC(=O)O)cc1 1848442579 BEOUJHOLWFYMGV-UHFFFAOYSA-N 385.372 2.680 0 50 GFAA OC[C@]12CN(Cc3cc[nH]n3)C[C@@H]1CN(Cc1ccc(-c3ccccc3F)o1)C2 1772701680 ORTVFXOJZYLEJM-OPAMFIHVSA-N 396.466 2.735 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CN(c3cnccn3)C[C@@]2(CCc2ccccc2)C1 1772815473 SEZGBKLJEOQZEA-NFBKMPQASA-N 388.519 2.781 0 50 GFAA O=C(c1c(F)cccc1F)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 11697646 IKLVXOPQALWTFK-UHFFFAOYSA-N 396.401 2.856 0 50 GFAA Cc1ccc(C(=O)NCCc2nnc3n2CCN(C/C=C/C(C)C)CC3)c(C)c1 11965637 LYLNQDDHOUVVKV-AATRIKPKSA-N 395.551 2.938 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(NC(=S)NC(=O)C2CCCCC2)c1 12138821 SPXUBSVJBSQGAQ-KRWDZBQOSA-N 389.521 2.989 0 50 GFAA CCc1ccc(CN(C)C(=O)C[C@H]2C(=O)NCCN2Cc2ccccc2)cc1 12578815 OXXOMZLMEQSPDU-NRFANRHFSA-N 379.504 2.598 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)cc2c1OCO2 19771202 SVJHNFAAJWCXPJ-FQEVSTJZSA-N 398.503 2.535 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)[C@H](C)Oc4ccccc4)C3)nn2)n1 169778142 WBPXIDCNIUKTFL-LSDHHAIUSA-N 396.451 2.692 0 50 GFAA COc1ccc(C(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)c(OC)c1 6701806 ZYFSTFKBLVFLCW-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA CCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)c(OC)c1 6243950 AKJGASBGHDUTCR-UHFFFAOYSA-N 378.450 2.644 0 50 GFAA CCCCN1CCC[C@]2(CCc3c(N4CC(O)C4)nc(-c4cccnc4)nc32)C1 1875250482 DAIPUUXYAFIQBR-QHCPKHFHSA-N 393.535 2.799 0 50 GFAA CN1CCC2(CCN(C(=O)N[C@H]3CCN(c4ccc(Cl)cc4)C3)CC2)C1=O 445091340 LEKXBBAMQZVGKL-INIZCTEOSA-N 390.915 2.573 0 50 GFAA Cc1c(S(=O)(=O)Nc2c(-c3cccc(F)c3)n[nH]c2C2CC2)cnn1C 864096432 FYKBRRFZAXGMSC-UHFFFAOYSA-N 375.429 2.936 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(C(=O)[C@H]3C[C@]34CCNC4)CC2)n1 952894501 NNAZHTLNCAOPIW-JPYJTQIMSA-N 392.503 2.858 0 50 GFAA COc1cccc([C@H](CN2C(=O)N3CC(F)(F)C[C@@]3(C)C2=O)N2CCCC2)c1 1875291238 SACOLVNKRXRPGO-LPHOPBHVSA-N 393.434 2.894 0 50 GFAA O=C(N=[S@]1(=O)CCC[C@@]2(CCCN2)C1)c1cccc(CN2CCCC2)c1 1875393411 MYCSMQKRURUFAG-FNZWTVRRSA-N 375.538 2.807 0 50 GFAA COc1ccccc1C(=O)N1CC[C@H](C)[C@@H](CNC(=O)C23CCC(CC2)O3)C1 1875315184 KOQYWIAJXCSCOY-HRIHSXELSA-N 386.492 2.621 0 50 GFAA CC(C)C[C@@](C)(CNc1ncnn2cccc12)NC(=O)C[C@@H]1CC=CCN1C 1875327955 QUZTZFPEBDBFLI-UWJYYQICSA-N 384.528 2.713 0 50 GFAA CC1CC(n2nnc3c2CN(c2ccnc(C(=O)N4CCCCC4)c2)CC3)C1 894940189 QYIOXMJUZAOKKC-UHFFFAOYSA-N 380.496 2.833 0 50 GFAA CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccc3c(c2)OCCO3)c1 854131 QZSOZHJYTJPVFP-UHFFFAOYSA-N 390.461 2.741 0 50 GFAA CCN1C(=O)N[C@@H](c2ccc(Br)cc2)C(C(=O)OCCOC)=C1C 2757340 WCAKNJFIYPSXOD-HNNXBMFYSA-N 397.269 2.999 0 50 GFAA CCC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccc(F)cc3)CC2)cc1 22535098 MNTWOTUEQFPHDH-HXUWFJFHSA-N 386.467 2.980 0 50 GFAA Cc1nc2c([nH]1)C[C@@H](NC(=O)Cc1c(C)nn(-c3ccccc3F)c1C)CC2 2325781501 XSRJCTIGXHHYFL-HNNXBMFYSA-N 381.455 2.876 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C(=O)c2c[nH]nc2-c2cccc(F)c2)C1 2356146698 QSQHYCVCHJAQSC-NRFANRHFSA-N 392.438 2.539 0 50 GFAA Cc1nc2c(NC(=O)C3CCN(C(=O)c4ccccc4C)CC3)cccn2n1 2356150082 KYXKWAMSTUXGRH-UHFFFAOYSA-N 377.448 2.837 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC3(CC2)OCCc2sccc23)c1C 2356152525 NUISSJNIALWVFF-UHFFFAOYSA-N 387.505 2.855 0 50 GFAA CC(C)CNC(=O)[C@H]1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)[C@H](O)C1 2356158980 GXBFPNWBMWBXRC-APHBMKBZSA-N 386.414 2.737 0 50 GFAA O=C(O)c1cccc(NC(=O)c2ccc3c(c2)C(=O)N(c2nccs2)C3=O)c1 3202596 IHSDWXOWBZYKST-UHFFFAOYSA-N 393.380 2.894 0 50 GFAA O[C@]12C[C@H](C(Cl)(Cl)Cl)O[C@]1(O)C[C@@H](C(Cl)(Cl)Cl)O2 8580848 ILZPXCIRVHHHJM-GUCUJZIJSA-N 380.866 2.682 0 50 GFAA Cc1ccccc1Nc1nc(N)nc(CN2CCN(c3ccccc3)CC2)n1 54147125 CDIHHIJKEHTGQU-UHFFFAOYSA-N 375.480 2.828 0 50 GFAA CN1CCC2(CC1)Nc1cc(F)ccc1-c1nc(=O)c(-c3ccccc3)nn12 170620098 LGZHCNSVVXXDOL-UHFFFAOYSA-N 377.423 2.915 0 50 GFAA Cc1cccc(C)c1Oc1ncccc1CNC(=O)C[C@H]1CN(C)CCN1C 20541035 CVTGOJIZUOJODF-IBGZPJMESA-N 382.508 2.743 0 50 GFAA COC1CCN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)CC1 20534125 ZAXROTNPDOGNNU-UHFFFAOYSA-N 397.523 2.836 0 50 GFAA O=C(NCc1ccccc1)C1CCN(c2cc(N3CCCCC3)ncn2)CC1 110120117 AUFGAWUZIBIIMT-UHFFFAOYSA-N 379.508 3.000 0 50 GFAA CC(C)NC(=O)c1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1 20149196 SCXMOYPKLRHIQV-UHFFFAOYSA-N 381.476 2.909 0 50 GFAA CC(C)c1nnc(S)n1CCNC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1 120228601 BQZQUVDNRXFELC-GFCCVEGCSA-N 389.308 2.847 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)[C@]1(C)CC1(Br)Br 2091082 WNBCMJZLCKTCMS-LBPRGKRZSA-N 393.123 2.891 0 50 GFAA O=C(COc1ccc2c(c1)CCCC2)N1CCS(=O)(=O)C2(CCCCC2)C1 330067209 FJVSUUPJUKKRIO-UHFFFAOYSA-N 391.533 2.904 0 50 GFAA Cc1nc([C@H]2CCCN(c3ncc(C)c(N(C)C)n3)C2)cc(N2CCCC2)n1 72439768 MXJLAQYEOAQBDK-KRWDZBQOSA-N 381.528 2.934 0 50 GFAA CCCc1cc(CN(C)c2nncc(-c3cc(OC)c(OC)c(OC)c3)n2)n[nH]1 12433604 CCPHAKWVIAULRW-UHFFFAOYSA-N 398.467 2.876 0 50 GFAA COc1cccc(C[C@H]2CN(C(=O)Cc3ccc4[nH]c(C)nc4c3)CCO2)c1 71754314 TZASQKUCGZEYLX-IBGZPJMESA-N 379.460 2.893 0 50 GFAA O=S(=O)(c1cccnc1)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1 72154695 CQGCFMHKMMAGLG-FQEVSTJZSA-N 389.496 2.898 0 50 GFAA CCOc1ccc(-n2ccc3c(cnc4nc(C(F)(F)F)nn43)c2=O)cc1 38783787 AGUBJCMBZNJCBO-UHFFFAOYSA-N 375.310 2.846 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)N1CC[C@@H](Cc2cnn(C)c2)C1 363756705 CBWGXJIMESRVGM-HNNXBMFYSA-N 394.483 2.751 0 50 GFAA CS(=O)(=O)c1ccc([C@H](O)CN2CCC([C@@H](O)c3ccccc3)CC2)cc1 154791194 YPMXQDDNHLQSDB-RTWAWAEBSA-N 389.517 2.569 0 50 GFAA O=C(N[C@@H]1CCOc2c1ccc(Cl)c2Cl)C1CCS(=O)(=O)CC1 364590700 QBVMJDZFPWNGNP-GFCCVEGCSA-N 378.277 2.758 0 50 GFAA Cn1ccc(N2CC[C@@H](NC(=O)c3ccc(C(=O)Nc4ccccc4)cc3)C2)n1 367001316 PJRNMNQWHKMJRR-LJQANCHMSA-N 389.459 2.681 0 50 GFAA O=c1[nH]nc([C@@H]2CCCN(c3ncnc4sccc34)C2)n1-c1ccccc1 71416298 IPXDTMPXOPCJFE-CYBMUJFWSA-N 378.461 2.949 0 50 GFAA CCc1nn2c(nnc3c(=O)n(C[C@H]4CCCO4)ccc32)c1-c1ccc(F)cc1 40391824 RZXBMONXRLYAKD-OAHLLOKOSA-N 393.422 2.987 0 50 GFAA COC(=O)c1c(NC(=S)N2CCC(C)CC2)sc(C(=O)N(C)C)c1C 17078368 CLVFIZWHIPMXBA-UHFFFAOYSA-N 383.539 2.974 0 50 GFAA Cc1nc(-c2ccccc2)oc1C(=O)N1CCC(CN2CCN(C)CC2)CC1 174736420 HGDZYVACJRJTPV-UHFFFAOYSA-N 382.508 2.750 0 50 GFAA O=c1c(Cc2c(F)cccc2Cl)c(O)ccn1CCCN1CCOCC1 20219219 NEHOGKXGYWUECI-UHFFFAOYSA-N 380.847 2.660 0 50 GFAA COc1cc(OC)cc(N2C[C@@H](C(=O)NC[C@H]3C[C@@H]3c3ccccc3)CC2=O)c1 177060229 RROYGBQSLXFREL-LLGFUMIMSA-N 394.471 2.977 0 50 GFAA Cc1cc(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)nc(C)n1 92062215 CIOWVZQCRHXDDT-UHFFFAOYSA-N 382.512 2.758 0 50 GFAA C[C@@H]1[C@H](N2CCOCC2)CCN1C(=O)c1c[nH]nc1-c1ccc(Cl)s1 290809116 FDVPCJDZUXLRLE-DGCLKSJQSA-N 380.901 2.727 0 50 GFAA Cc1nc(CNC(=O)c2cnc(-c3cccs3)nc2O)nc2c1CCCC2 91665467 LDARZNRCTPSAFD-UHFFFAOYSA-N 381.461 2.818 0 50 GFAA CCOc1ccccc1[C@@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95387474 AVRTXXRKKWZBBH-SFHVURJKSA-N 375.494 2.794 0 50 GFAA CC[C@@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)N2CCCOCC2)c1 95379340 GFDIAIZVEXNBOD-QGZVFWFLSA-N 380.510 2.502 0 50 GFAA COCCN1CCC(CN(C)C(=O)c2cc(-c3ccc(OC)cc3)[nH]n2)CC1 91713654 CQHJOIVOJBHWDR-UHFFFAOYSA-N 386.496 2.516 0 50 GFAA COc1ccc([C@@H]2[C@H](C(=O)NC[C@@H]3CCCN4CCCC[C@H]34)CC(=O)N2C)cc1 253400197 DRUXYJWJUPVKGV-RJJVWVDVSA-N 399.535 2.595 0 50 GFAA biogenic CCc1c(C(=O)N2CCC(C(=O)O)CC2)nnn1-c1ccc(OC(C)C)cc1 299744037 NNHNVCQDKXAMFI-UHFFFAOYSA-N 386.452 2.554 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(C)Cc2nc(O)c3sccc3n2)CC1 534669373 GXMUTKDWTHMVKT-UHFFFAOYSA-N 386.481 2.524 0 50 GFAA CC1=NC2(CCN(C(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)C(=O)N1 299784812 HWFWZNOIOJUHCF-UHFFFAOYSA-N 379.420 2.789 0 50 GFAA COCCCn1cnnc1[C@@H](C)NC(=O)Nc1ccc(-n2ccnc2C)cc1 299783638 WDSPIVFRYZQFAW-CQSZACIVSA-N 383.456 2.691 0 50 GFAA Cc1cccc2nc(COCC(=O)NCCN3CC[C@H](c4ccccc4)C3)[nH]c12 670467450 BJBBRYJWDRFUAO-IBGZPJMESA-N 392.503 2.994 0 50 GFAA COc1cccc(N2C[C@@H](NC(=O)C3(N4CCCC4)CCCCC3)CC2=O)c1 952872086 JDZYPULIQAGGSJ-KRWDZBQOSA-N 385.508 2.715 0 50 GFAA Nc1snnc1C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 166671868 YDJQIELWOZTPNX-UHFFFAOYSA-N 390.472 2.962 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2ccc(Cl)cc2Br)cn1 275436220 FPJCAMZDJBETFG-ZBFHGGJFSA-N 397.704 2.946 0 50 GFAA CCc1nc(C2CCN(C(=O)Cc3csc(-c4cccnc4)n3)CC2)n[nH]1 191585140 LIKGCLVJQCTNBA-UHFFFAOYSA-N 382.493 2.834 0 50 GFAA Cc1cc(S(=O)(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)sc1Cl 191920588 MKFZTRBJFOODHO-SNVBAGLBSA-N 382.960 2.640 0 50 GFAA CN1C(=O)[C@]2(CCCN(C(=O)/C=C/c3cc(CO)cs3)C2)c2ccccc21 1506419076 WWVQEEMQVVYJCI-CQQBXOTJSA-N 382.485 2.790 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)c2ccc(N3CCCCC3)cc2)N1 1506399779 IPZHXGUQIMDEGZ-FQEVSTJZSA-N 392.503 2.993 0 50 GFAA CCC(=O)Nc1ncc2c(n1)C[C@@H](c1cc(OC)c(OC)c(OC)c1)CC2=O 795692 FBGAPVSIGRYAQI-LLVKDONJSA-N 385.420 2.764 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(F)c(Cl)c2)cc1 1141818 UQERZNQVSWKNAP-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)c2ccc(Cl)cc2)cc1 1151039 OSAGGDJXWLAADS-UHFFFAOYSA-N 394.880 2.823 0 50 GFAA CN(c1ccc(C(=O)NCc2ccccn2)cc1)S(=O)(=O)c1ccccc1 854620 VVJDBRVSKFNKFQ-UHFFFAOYSA-N 381.457 2.837 0 50 GFAA O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC(Cc2ccc(O)nc2)CC1 1772712962 WWAGEPLPJLRBJJ-LJQANCHMSA-N 380.492 2.880 0 50 GFAA CC(C)CC(=O)Nc1ccnn1C1CCN(C(=O)CN2CCCCC2)CC1 12023337 AWQRCNUVXWHLSI-UHFFFAOYSA-N 375.517 2.517 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)CSc2ccccn2)CC1)C1CC1 12449103 DDIDJCLPDZDPNO-UHFFFAOYSA-N 385.493 2.582 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@H]1CCCN(C(=O)Cc2cccnc2)C1 15062819 MLWFFCFTDFQOSO-LJQANCHMSA-N 394.519 2.739 0 50 GFAA COC(=O)c1ccc(CN2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)cc1 15072359 ONDHTRVEEFRDNK-FQEVSTJZSA-N 388.508 2.761 0 50 GFAA CCCOC(=O)c1cccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)c1 1747834 OOTBFCQQGLFERO-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA COCc1cc(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)ccc1OC 19227222 JMMIHDPZNUFRIU-IBGZPJMESA-N 390.549 2.972 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4cccc(Cl)c4)nnc23)n1 169781031 FAHFIHIFKYTQCY-UHFFFAOYSA-N 382.811 2.925 0 50 GFAA Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 2859061 CKZRUVRRAVUDGY-UHFFFAOYSA-N 378.881 2.795 0 50 GFAA COCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(Cl)c3)C2)s1 4975658 CAAHBLRWGAXZKE-SNVBAGLBSA-N 380.857 2.638 0 50 GFAA COc1ccc(Cc2nnc(SCC(=O)Nc3ccccc3O)n2C)cc1 4999534 FJLFAOGZYAXVDQ-UHFFFAOYSA-N 384.461 2.851 0 50 GFAA CN(CCc1ccccn1)C(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857667536 CVXCJPWKRIPOAC-INIZCTEOSA-N 379.464 2.925 0 50 GFAA O=C(c1ccc2ncsc2c1)N1C[C@@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857715361 OJLYEHDHCOETDA-OBZYLPMUSA-N 380.469 2.505 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccnc4)[C@H]4CC[C@]3(C2)O4)cc1 1857737076 VZXJPVJVVOWNFN-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA O=C(CCc1cccc(O)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857740406 HZJKZYVOPXHPFQ-VIZSFHNOSA-N 392.455 2.626 0 50 GFAA C[C@@](CO)(NC(=O)c1cnc(C2CC2)nc1O)c1cccc(C(F)(F)F)c1 912106400 IVIKTNCILYIKOD-KRWDZBQOSA-N 381.354 2.716 0 50 GFAA Cc1[nH]c2ccccc2c1C1CCN(C(=O)[C@@H](N)Cc2ccnc(O)c2)CC1 1875319501 FQGSBMRSQKGAIK-SFHVURJKSA-N 378.476 2.853 0 50 GFAA C=CC(=O)N[C@@H](C)[C@H]1CN(C(=O)c2cc(-c3ccc(Cl)cc3)on2)CCO1 1875386213 LCYALKHVWGSHHE-YVEFUNNKSA-N 389.839 2.527 0 50 GFAA CC[C@@H]1CN(C(=O)CC2(OC)CCC2)CC[C@H]1NC(=O)c1cc(C(F)F)[nH]n1 1875333882 OUKHVZYRQYNBRW-CHWSQXEVSA-N 398.454 2.663 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)N[C@@H]3[C@H]4Cc5cc(F)ccc5[C@H]43)CC2=O)c1 888101826 PIAGIEXYRFAJGG-AZKPVJIOSA-N 395.434 2.577 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NC2CCCC2)C[C@H]1NC(=O)c1cncc(Cl)c1 2100543582 VPFFJFHFFWWCOU-JCURWCKSSA-N 379.888 2.707 0 50 GFAA N=c1nncc(-c2cccc(C(=O)NCCc3c[nH]c4cc(F)cc(F)c34)c2)[nH]1 2325869679 XWQNWFUOPHUELE-UHFFFAOYSA-N 394.385 2.683 0 50 GFAA Cc1nc(C(=O)N(C)[C@@H]2CN(C(=O)CCCCC(C)C)C[C@H]2O)sc1C 2325879075 GTLAURZYIYPVLU-HZPDHXFCSA-N 381.542 2.620 0 50 GFAA O=C(c1cccc(Oc2ccccc2)c1)N1CCC2(CC1)OCC[C@H](O)[C@@H]2O 2356159492 CYAUFYXKCFCZIO-PMACEKPBSA-N 383.444 2.596 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)N1CCC[C@]2(CCc3c[nH]c(=N)nc32)C1 2356162204 BTXYPPDRBYHCIV-QFIPXVFZSA-N 388.475 2.708 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cnc4c(c3)c(C)nn4C)CC2)oc1C 111154223 CVNBBWCKFDPWPN-UHFFFAOYSA-N 396.495 2.524 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN([C@@H]2CCCC[C@@H]2OC)CC1 20228044 DDSPTLXNWPWAQQ-MSOLQXFVSA-N 378.513 2.788 0 50 GFAA COCCN1CC[C@H](CN(C)Cc2c[nH]nc2-c2ccc(OC)c(F)c2)C1 23158908 XYXMBYYXCKZSMG-OAHLLOKOSA-N 376.476 2.625 0 50 GFAA COc1ccc(OC)c(CN(C(=O)Cc2cnc3ncnn3c2)C2CCCC2)c1 55324951 XMFFTQFMJBXPRI-UHFFFAOYSA-N 395.463 2.655 0 50 GFAA CCN(C(=O)c1csc2nc(-c3cccc(Cl)c3)cn12)[C@H]1COC[C@@H]1O 67954754 IFXBRGFJOWCPAH-HOCLYGCPSA-N 391.880 2.938 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C[C@@H](O)c2ccccc2F)CC1 328650604 VOMKZWFEKCKWBA-WIYYLYMNSA-N 386.471 2.552 0 50 GFAA CN1[C@@H](c2ccccc2Cl)[C@@H](C(=O)NCc2ccccn2)C[C@@]1(C)C(=O)O 67804174 AAYPFXUYSXUMPN-KNBMTAEXSA-N 387.867 2.888 0 50 GFAA O=C1[C@@H](NC(=O)N2CCCC[C@H]2CCc2ccccc2)CCN1C1CCOCC1 119079130 CYDGFTGUWLNCSO-FPOVZHCZSA-N 399.535 2.963 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC[C@@H](CN)C3)nc2)cc1 67934628 JTDFYYYONSIEEB-SFHVURJKSA-N 382.508 2.628 0 50 GFAA CC(C)[C@H]1CN(CC(=O)N2CCCCC2)CCC(=O)N1Cc1ccc(F)cc1 71763379 IAQNHKXMRHGINX-HXUWFJFHSA-N 389.515 2.897 0 50 GFAA O=C(CCc1cncc(F)c1)N(Cc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 121617504 RGSDVNKZJJYAOU-QGZVFWFLSA-N 394.443 2.508 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2CC(=O)N[C@H](C)c2cccs2)n1C 431952178 QCBIOVISYCKKIT-GDBMZVCRSA-N 388.537 2.851 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1cccc(Cl)c1)CC(=O)N2 33011460 MIQYVQYHNCQSMP-ZDUSSCGKSA-N 379.811 2.746 0 50 GFAA CCn1ccnc1CN(C)C(=O)c1cn(Cc2ccccc2C(F)(F)F)nn1 72154572 BXBUOVAVOGBFRM-UHFFFAOYSA-N 392.385 2.834 0 50 GFAA CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 124074024 FKMNPNKEQZZQML-GOSISDBHSA-N 387.505 2.876 0 50 GFAA CCn1cc(CNC(=O)c2coc(COc3cccc4cccnc34)n2)cn1 14972613 HUIIZNIADYYWNX-UHFFFAOYSA-N 377.404 2.948 0 50 GFAA Cc1ccc(OCc2ccc(C(=O)N3CCNC[C@H]3c3nccn3C)o2)c(C)c1 261767691 QYHGVRHOAXTSLB-SFHVURJKSA-N 394.475 2.996 0 50 GFAA CN(c1ccccc1)c1ccc(CN2CCn3nc([C@H](O)CO)cc3C2)cc1 219024542 ZAPWRQIUQIJTFX-JOCHJYFZSA-N 378.476 2.693 0 50 GFAA O=C(CCc1cc2n(n1)CCNC2)Nc1ccccc1CCc1ccccn1 72429481 VZVRTKUXBHRKCK-UHFFFAOYSA-N 375.476 2.738 0 50 GFAA Cc1ccnc(-c2noc([C@@H]3CCCN(C(=O)Cc4ccc(F)cc4)C3)n2)n1 378044131 XFOMKSFOXTXWMS-OAHLLOKOSA-N 381.411 2.923 0 50 GFAA O=C(c1ccnc(OCC(F)(F)F)c1)N1CCC(C(=O)N2CCCCC2)CC1 158700504 FJEIWFAZYHCZFA-UHFFFAOYSA-N 399.413 2.887 0 50 GFAA O=C(O)CN(C(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)C1CCOCC1 238114340 YZQVFCWSQRMVKK-UHFFFAOYSA-N 397.353 2.597 0 50 GFAA Cc1nn2c(ncc3c(=O)n(NC(=O)c4ccncc4)ccc32)c1-c1ccccc1 40396307 VHSBBKXMYRWEQR-UHFFFAOYSA-N 396.410 2.799 0 50 GFAA CCc1onc(C)c1NC(=O)N1CCOC[C@@H]1c1ncnn1-c1ccccc1 284650714 CQHKLHLUWGNTKK-OAHLLOKOSA-N 382.424 2.732 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@@H](O)c3ccccc3Cl)c2c1 241911231 UATQZOFUONNMRY-MRXNPFEDSA-N 377.853 2.832 0 50 GFAA CCCOc1ccc(CNC(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cn1 176170209 JZFVNQMROPUSAT-UHFFFAOYSA-N 398.511 2.745 0 50 GFAA COCCN1CCC(CN(C)C(=O)c2ccc(-c3cncc(N)c3)cc2)CC1 426647398 WFZZWNMLNONHRU-UHFFFAOYSA-N 382.508 2.761 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)CCCc3cccs3)C2)CCC1=O 95504089 YSLITZXDLAKERB-FQEVSTJZSA-N 378.538 2.948 0 50 GFAA C[C@@H]1CN(C(=O)c2ccc(CN3CCCC3)o2)CC[C@@]1(O)C1CCOCC1 91829265 DZRBHGHLWSOICO-IERDGZPVSA-N 376.497 2.515 0 50 GFAA COc1cccc(SCC(=O)N2CCN(Cc3cccc(C)c3)C(=O)C2)c1 244691694 JHMCOECOTFZQRH-UHFFFAOYSA-N 384.501 2.967 0 50 GFAA CCCC[C@@]12[C@@H]3[C@H]4[C@@H]([C@@H]5[C@H]1[C@@H]3[C@@]5(Br)C41OCCO1)C21OCCO1 252428370 ZTNRQRIGEAIPNV-RZTSEPGWSA-N 383.282 2.548 0 50 GFAA CN(C(=O)Nc1nc(-c2cccc(Cl)c2)ns1)[C@H]1CCN2CCO[C@H]1C2 297222293 PRCHWVSNNAUVMX-KBPBESRZSA-N 393.900 2.795 0 50 GFAA O=C(CCC[C@@H]1NC[C@@H]2CNC[C@H]1C2)N1CCC(Oc2ccccc2F)CC1 1940196059 HEJSJRGLNKXHCJ-QKLQHJQFSA-N 389.515 2.563 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NC[C@H]3CCCN(S(C)(=O)=O)C3)cc2)o1 952967086 YRJJDZIMPCFJRD-OAHLLOKOSA-N 376.478 2.656 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ccc1C 170598315 JAJCZQXZAYSHGL-QRWLVFNGSA-N 389.521 2.923 0 50 GFAA O=C(O)c1ccc(NS(=O)(=O)c2cc(Br)cc3c2OCC3)cc1 170594907 APBXOJMKURWKME-UHFFFAOYSA-N 398.234 2.883 0 50 GFAA COCc1noc(CN2CCN(Cc3ccccc3Oc3cccnc3)CC2)n1 189635717 JYVNMJSGZHDBFN-UHFFFAOYSA-N 395.463 2.721 0 50 GFAA O=C1CCCC[C@H](C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)N1 193904073 LQNGWWGGGZEGQN-MRXNPFEDSA-N 398.425 2.929 0 50 GFAA CCCn1ncnc1[C@H](C)NS(=O)(=O)c1ccc(-c2onc(C)c2C)o1 1506396191 PJPXZAHBKWSGMG-LBPRGKRZSA-N 379.442 2.592 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N3CC[C@@H](O)CC(C)(C)C3)c(C)s2)n[nH]1 1506418544 QYDNRKJELWGCRW-CYBMUJFWSA-N 383.539 2.927 0 50 GFAA O=S(=O)(NCc1ccc2c(c1)OCO2)c1ccc(Br)s1 1119014 KMGREHDPJOBHRB-UHFFFAOYSA-N 376.253 2.718 0 50 GFAA Cc1cccnc1NCCNS(=O)(=O)c1cc(-c2ccno2)sc1C 1506407389 VSLKVXQSDAAYJJ-UHFFFAOYSA-N 378.479 2.805 0 50 GFAA COCCN1C[C@H](C(=O)Nc2ccc(-c3cccc(F)c3F)cn2)CCC1=O 1506397751 XDPTVUSWUPFFRF-CQSZACIVSA-N 389.402 2.850 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)CC(=O)Nc3cc(Cl)ccc3C)C2)n[nH]1 1506420871 CAHVVXTTXXCZDC-ZDUSSCGKSA-N 375.860 2.810 0 50 GFAA CN(CC1CCN(Cc2ccccc2)CC1)c1nccc(N2CCC[C@H](O)C2)n1 1529195944 RYLYRTNRVHRGEK-NRFANRHFSA-N 395.551 2.786 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H]2CCCOC2)ccc1F 1704309055 WWPHYRJYPKPNSY-GFCCVEGCSA-N 377.416 2.712 0 50 GFAA CCOc1cc(S(=O)(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)ccc1Cl 1704301180 NRGUZDKITPPVGX-RHSMWYFYSA-N 396.896 2.670 0 50 GFAA CC(C)[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)N1C(=O)c2ccccc2C1=O 839320 KFBRSEWDNVAZEZ-SFHVURJKSA-N 380.400 2.717 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)c1cn(C/C=C/c2ccccc2)nn1 11703186 LRPOPGKOVMMBGO-RMKNXTFCSA-N 385.431 2.502 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N4CCOCC4)cc3o2)cc1OC 11771356 NUIBPQKRKSRYEV-UHFFFAOYSA-N 382.416 2.908 0 50 GFAA O=C([C@H]1CCC(=O)N(C2CCCCCC2)C1)N1CCN(C2CCCC2)C(=O)C1 11815659 YBFYUYGSXRMYMS-KRWDZBQOSA-N 389.540 2.561 0 50 GFAA O=C(NCC1CC1)[C@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 12074630 QBAOFJWMNSSMJS-NRFANRHFSA-N 381.564 2.856 0 50 GFAA O=C1CCN(Cc2cccc(OCCO)c2)CCN1Cc1cccc(Cl)c1 12454909 JNLVKPDFSXJOAL-UHFFFAOYSA-N 388.895 2.946 0 50 GFAA NC(=O)C1CCN(C(=O)c2ccc(CN3CCc4ccccc4C3)cc2)CC1 19375392 NXWZFMRZENLPIH-UHFFFAOYSA-N 377.488 2.582 0 50 GFAA O=C(Nc1ccnn1C1CCN(C2Cc3ccccc3C2)CC1)[C@@H]1CCOC1 19835527 YSUVLDDBKUYFNP-GOSISDBHSA-N 380.492 2.662 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc(OC)c(OC)c2)ccc1Cl 2852801 SYZRJEBCIXECFE-UHFFFAOYSA-N 385.825 2.945 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3ccc(NC(C)=O)cc3)n2)c1 5400112 KPUXQXHVSOSZKA-UHFFFAOYSA-N 392.415 2.516 0 50 GFAA COc1cc(OC)cc(C(=O)N(C)c2c(C)n(C)n(-c3ccccc3)c2=O)c1 4870156 BPHMXCLSRUTHSX-UHFFFAOYSA-N 381.432 2.778 0 50 GFAA COc1ccccc1-c1ncc(CN2CCC3(CC2)CC(=O)NCCO3)s1 1857685156 PLFDBNBOIOBFMN-UHFFFAOYSA-N 387.505 2.690 0 50 GFAA O=C1C[C@H]2N(Cc3cnn(-c4ccc5ccccc5c4)c3)CC[C@]23OCCCN13 1857726573 XTCUJJAQEYYLDV-GGAORHGYSA-N 388.471 2.949 0 50 GFAA Cc1cc(S(=O)(=O)Nc2cc(C)n(CC(F)(F)F)n2)sc1C(=O)O 416963309 VSDZUPMHHFOIHU-UHFFFAOYSA-N 383.373 2.623 0 50 GFAA Nc1nccnc1C(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)cc(Cl)c1 114678510 FAGKIHZXZZLRLW-GFCCVEGCSA-N 380.235 2.609 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)Nc1nnc(C(F)F)s1 152339191 IVZIAHLQUCKBQQ-UHFFFAOYSA-N 388.421 2.576 0 50 GFAA O=C(c1cccc(-n2ccnc2O)c1)N1CCC(Oc2cncc(Cl)n2)CC1 845962174 WGTNMHMUPHGJOJ-UHFFFAOYSA-N 399.838 2.705 0 50 GFAA CNC(=O)CCCCC(=O)N1CCOC[C@H]1c1c(C)nn(-c2ccccc2)c1C 952887986 IXJOTJDURUFPKA-IBGZPJMESA-N 398.507 2.695 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(c3nccc(-n4ccnc4)n3)C[C@H]21 1875273617 UFQPIGVJJRMTMR-VQHPVUNQSA-N 396.495 2.744 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)c2cc(Cl)nn2-c2ncccc2Cl)c2ncnn21 1875294079 MCTJRCZLWGQTME-PSASIEDQSA-N 378.223 2.601 0 50 GFAA CCC[C@H](C)N(C)C(=O)[C@@H](Cc1cn(-c2cncc(C(=O)O)c2)nn1)C1CC1 1875326156 CJZPOMFOKPIZGN-UGSOOPFHSA-N 385.468 2.576 0 50 GFAA C[C@H](Cc1ccc(F)cc1Cl)N[C@@H]1C[C@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875311540 DUCROZJLHMDVIS-FVEFGIFQSA-N 395.862 2.734 0 50 GFAA COc1ccc2oc(=O)c(C(=O)N3CCN(c4ccccc4F)CC3)cc2c1 718945 VJPKJWCZFZXYGI-UHFFFAOYSA-N 382.391 2.903 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC2CCCC2)cc(OC)c1O 1152025 ILOSCKXGGPJYLS-INIZCTEOSA-N 376.409 2.523 0 50 GFAA Cc1ccc(NC(=O)C[C@H]2C(=O)NCCN2C(=S)Nc2ccccc2)c(C)c1 8682757 SHUKGFKSOARXNZ-SFHVURJKSA-N 396.516 2.829 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)[C@@H]3CCCCc4ccccc43)ccc2N1 2325760683 FRPPHZLHCVHKJP-MRXNPFEDSA-N 384.457 2.861 0 50 GFAA CCc1nccn1[C@@H](C)CC(=O)NCC1(NC(=O)c2ccoc2Cl)CC1 2325794889 VJINSKJFQSJXTO-LBPRGKRZSA-N 378.860 2.722 0 50 GFAA Cc1nnc(COc2ccc(NC(=O)c3ccc4c(c3)C[C@@H](C)NC4)cc2)n1C 2325814031 HGOUMHLAMVPCLD-CQSZACIVSA-N 391.475 2.989 0 50 GFAA Cc1csc2c(C(=O)NC[C@H]3CN(C)CCN3Cc3ccccc3)ncnc12 2325857160 RGZAYJRBHUWVCO-KRWDZBQOSA-N 395.532 2.546 0 50 GFAA O=C1N(CCO)CCC[C@@]12CCCN2Cc1c[nH]nc1-c1ccc(Cl)cc1 2356137271 VSYDSSPIDDCDJZ-HXUWFJFHSA-N 388.899 2.679 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)NCCc3ccccc3)cs2)no1 6681833 KGPPEZYRVIWHBE-UHFFFAOYSA-N 391.474 2.818 0 50 GFAA CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)CCc1c(C)nc(=O)[nH]c1C 55252777 SVPJJRMEPHXLMR-UHFFFAOYSA-N 381.480 2.595 0 50 GFAA CCNC(=O)N1CCC(n2cc(Oc3ccccc3)c(=O)c(C(=O)O)c2)CC1 55369984 MDBQQYZFMFYBPR-UHFFFAOYSA-N 385.420 2.705 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN(C)Cc3cccs3)C2=O)c1 67982155 HWAUURASZBATLR-FQEVSTJZSA-N 392.496 2.881 0 50 GFAA O=C(c1ccc2c(c1)OCO2)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 20233882 WMZYCGQWNSYCQH-KRWDZBQOSA-N 387.457 2.840 0 50 GFAA Cc1nn(-c2ccc(N3CCCC3)nn2)c2c1[C@H](c1cccc(O)c1)CC(=O)N2 65362945 UZKCMVYHTQXAKI-INIZCTEOSA-N 390.447 2.751 0 50 GFAA O=C1N[C@@](Cc2ccc(F)cc2)(C2CCNCC2)C(=O)N1Cc1cccc(F)c1 67692215 GOZZCAFGLCXHJP-QFIPXVFZSA-N 399.441 2.998 0 50 GFAA CN(C)CCNC(=O)c1cccc(CNC(=O)NCc2ccc(C3CC3)cc2)c1 252488099 IJMCYXWDTLMGDA-UHFFFAOYSA-N 394.519 2.855 0 50 GFAA C[C@@H](NC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1)c1nnnn1C 252489809 KBDWOGOJLILRIB-LLVKDONJSA-N 382.390 2.879 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)Nc3cc(-c4cccnc4)n[nH]3)cc2C[C@@H]1C 131341335 MBRIZQQNLUGGJO-LBPRGKRZSA-N 397.460 2.570 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)c4cccc(Cl)c4)CC3)ncn2)c1C 72446650 GBOAMPJAJROCCV-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA O=S(=O)(c1ccc2ccccc2c1)N1CCS(=O)(=O)C2(CCCCC2)C1 333029834 BXKFPTZZBSIDDB-UHFFFAOYSA-N 393.530 2.962 0 50 GFAA CO[C@@H](C)c1cccc(NC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1 127752267 TUUISDWNEHLZEM-HNNXBMFYSA-N 393.447 2.805 0 50 GFAA O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1 262680876 ZQXWMGONSLOXEW-GOSISDBHSA-N 399.422 2.879 0 50 GFAA C[C@@H](NC(=O)C1CCCC1)C(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 333740008 LHRIMKHYEVFVRV-HIFRSBDPSA-N 390.446 2.889 0 50 GFAA O=C(c1ccc(NC[C@@H]2CCOC2)nc1)N1CCC(Oc2cccnc2)CC1 71748380 AFSMCWDEPXPJQA-INIZCTEOSA-N 382.464 2.609 0 50 GFAA CC(C)N(C)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72170566 ZSEUHCQEPPJXEX-OAQYLSRUSA-N 379.504 2.911 0 50 GFAA Cc1ccc(N2CCN(C(=O)COCc3nc4ccc(C)cc4[nH]3)CC2=O)cc1 82091294 XGJWWSLYUAZUMI-UHFFFAOYSA-N 392.459 2.572 0 50 GFAA Cn1ccnc1[C@@H](O)c1cc2n(n1)CCN(Cc1cc(F)cc(Cl)c1)C2 223260151 NNOXGCZNORZHCC-KRWDZBQOSA-N 375.835 2.507 0 50 GFAA COCc1nc(NCC2(c3ccccc3)CCOCC2)cc(C2CC(N)C2)n1 220049002 LNIRQEHXVRNNFC-UHFFFAOYSA-N 382.508 2.988 0 50 GFAA Cc1cccc2nc(CN(C)C(=O)NC[C@H]3CCCN(C(=O)C4CC4)C3)[nH]c12 426503319 OLXQKJNUZRTEMU-OAHLLOKOSA-N 383.496 2.661 0 50 GFAA C[C@H](CC(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1)n1ccnc1 92020634 ZWCRPCSWQKCZTK-GOSISDBHSA-N 395.507 2.661 0 50 GFAA CC[C@H](NC(=O)c1cc(OC)cc(C(=O)O)c1)c1ccc(S(C)(=O)=O)cc1 97547570 UOBMQVHRXSBXQJ-KRWDZBQOSA-N 391.445 2.678 0 50 GFAA O=C(c1ccc2oc(Cc3ccc(Cl)cc3)nc2c1)N1CCOC[C@H](O)C1 95530449 FLDPCZQOPPBXNZ-MRXNPFEDSA-N 386.835 2.905 0 50 GFAA O=C([C@@H]1CCS(=O)(=O)C1)N(CCc1ccc(Cl)cc1)Cc1cccnc1 97474994 WNOUVBYOLOHWEC-QGZVFWFLSA-N 392.908 2.741 0 50 GFAA O=C(NC[C@H](O)c1ccccc1C(F)(F)F)c1cccc(-n2cnnc2)c1 91526825 DDLCRKWDTYLVQE-INIZCTEOSA-N 376.338 2.750 0 50 GFAA CC(C)Cc1nc(CNC(=O)N2Cc3cnc(-c4ccccc4)nc3C2)no1 426647013 HHKJJAASWOMSSP-UHFFFAOYSA-N 378.436 2.951 0 50 GFAA COc1cccc(Cl)c1[C@@H](C(=O)O)N1CCC(O)(c2cccnc2)CC1 95354754 DKGACSOTXAZAGP-KRWDZBQOSA-N 376.840 2.853 0 50 GFAA CCOC(=O)c1sc2ccccc2c1NC(=O)N1[C@H]2CC[C@@H]1CC(=O)NC2 97823612 GMWXDVTYXZPEMF-NEPJUHHUSA-N 387.461 2.963 0 50 GFAA COc1nn(C)c(C)c1NC(=O)NC[C@H](C)Cn1nc(C)cc1C(F)(F)F 96139062 LOAFSHUZINJDQB-VIFPVBQESA-N 388.394 2.719 0 50 GFAA C[C@]12CC[C@@H](O)C[C@@H]1CC[C@H]1[C@H]2C(=O)C[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254418794 BIEADAHRODWPEW-XJJKYIIXSA-N 388.504 2.783 0 50 GFAA Cc1nc(N2CCN(c3nc4ccccc4s3)CC2)cc([C@H]2C[C@H](N)C2)n1 252571035 XPACXQVKCOJMRX-SHTZXODSSA-N 380.521 2.926 0 50 GFAA CSCCCN1CCC(N2C[C@@H](COc3ccc(F)cc3)OCC2=O)CC1 299794761 KREISSWTZYTTAS-IBGZPJMESA-N 396.528 2.649 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC(OCc2ccccn2)CC1 828182400 VESBMTRYDMHXBX-UHFFFAOYSA-N 381.476 2.740 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N1CCCN(c2ccc(F)cc2)CC1 952873051 UULDSWFLBYTECC-UHFFFAOYSA-N 390.480 2.728 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2cccnc2OC)cc1 1565508690 CPIXDRGFDVGEJR-MSOLQXFVSA-N 381.476 2.835 0 50 GFAA Cc1ccn2ncc(C(=O)NCc3ccccc3CN3CCC(O)CC3)c2c1 270974425 BFDNMDKCXWBIHR-UHFFFAOYSA-N 378.476 2.529 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)c2cccc(NC(=O)c3cccnc3)c2)[C@@]12CCCO2 273716673 QRXGMQGOBJYQAM-KNKQGSTJSA-N 395.459 2.790 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCC[C@@H](c2cc(O)ncn2)C1 1506403347 NYNDQHAMKJEGTK-CYBMUJFWSA-N 388.855 2.879 0 50 GFAA Cc1ccccc1-c1ncc(CN2CCC3(CC2)C[C@@](O)(CO)CCO3)s1 1704342035 CPAKERSMDVCLJI-HXUWFJFHSA-N 388.533 2.987 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(Cc3cnc(N(C)C)nc3)CC1)OCC2 1704297889 AWEHHHVOQQFPHS-UHFFFAOYSA-N 398.507 2.624 0 50 GFAA COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c1cc(Cl)c(O)c(OC)c1 815876 DMLMQLXEOFATRF-UHFFFAOYSA-N 395.839 2.976 0 50 GFAA O=C(NCc1[nH]nc2ncccc12)C1CCN(C(=O)c2ccccc2Cl)CC1 1772814454 AFYCUSCPPKHXPY-UHFFFAOYSA-N 397.866 2.780 0 50 GFAA CN(C)C[C@]12CN(C(=O)CCC3CCCC3)C[C@@H]1CN(C(=O)C1CC=CC1)C2 1772706562 SYEADELUVHEOJC-NFBKMPQASA-N 387.568 2.772 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N(C)Cc2n[nH]c3c2CCCC3)n[nH]1 12316188 DCNFYYVIPVIACB-UHFFFAOYSA-N 381.484 2.652 0 50 GFAA COc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCOCC2)n3C)cc1 13689268 XWCPAGGQJILXJA-UHFFFAOYSA-N 380.448 2.666 0 50 GFAA CN1CCN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CC1=O 19792469 UYXVZPONZLGUJR-UHFFFAOYSA-N 377.448 2.585 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)Cc4ccc(C)cc4)CC3)nn2)n1 169777514 XBLWLZMALQRSPJ-UHFFFAOYSA-N 394.479 2.995 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2n2ccnc2-c2cnn3c(C)cc(C)nc23)on1 1857684395 MFTOTHHAUNFHHQ-QAPCUYQASA-N 378.436 2.936 0 50 GFAA COc1nc2c(cc1Cn1ccnc1C1CC1)C(=O)N(CCc1ccccn1)C2 1857698582 ZBMUWZLAYHKTAQ-UHFFFAOYSA-N 389.459 2.806 0 50 GFAA CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NCc1ccn(-c2ccccc2)n1 328593568 KATAOEODBFWIQJ-UHFFFAOYSA-N 399.520 2.801 0 50 GFAA CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(CCc2cc(Cl)c3c(c2)OCCCO3)C1 328931963 IDAWLPPIRSWLLA-ZBFHGGJFSA-N 392.887 2.932 0 50 GFAA O=C(c1ccccc1NCC(F)(F)F)N1CCC2(CCC2)S(=O)(=O)CC1 868878331 YLZDETQSLPCVIJ-UHFFFAOYSA-N 390.427 2.844 0 50 GFAA O=C(O)c1ccc(CS(=O)(=O)N2CC3(CCOCC3)c3ccccc32)cc1 1875266465 OIRYIJJGTLRAOK-UHFFFAOYSA-N 387.457 2.783 0 50 GFAA C[C@H](Oc1ccc(Br)cc1Cl)c1noc(-c2nnn(C)n2)n1 1875286370 RRTRCMRVBLENAR-LURJTMIESA-N 385.609 2.816 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2cc(NC(=O)OCC)ccc2Cl)[C@@H](C)C1 1875381537 YCWFTCVKPOQDEC-LBPRGKRZSA-N 379.844 2.767 0 50 GFAA C[C@H]1C[C@H](CNC(=O)c2cc3cnccc3[nH]2)CN1C(=O)c1coc(C2CC2)n1 1875309657 HGCMECNOZMIRSK-QWHCGFSZSA-N 393.447 2.709 0 50 GFAA CCn1nc(C(=O)N(Cc2cccc(C(N)=O)c2)C2CC2)c2c1[C@H](C)O[C@H](C)C2 1875404005 PMEQYQCQTTYBNO-KGLIPLIRSA-N 396.491 2.829 0 50 GFAA CS(=O)(=O)c1ccc(F)c(OC[C@@H]2CN(Cc3ccccc3)CCO2)c1 1775989825 SMIXQFXBWKPTCV-INIZCTEOSA-N 379.453 2.509 0 50 GFAA Cc1nnc(NC(=O)c2cccc(S(=O)(=O)N3CCCCCC3)c2)s1 708126 AZTIXESJNOQKHQ-UHFFFAOYSA-N 380.495 2.664 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N[C@H]2C[C@H](C(=O)NC(C)C)C[C@@H]2O)cc1 2100537793 WKFJUASMLFZCAP-BVSLBCMMSA-N 394.515 2.980 0 50 GFAA CN(C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2)[C@H]1CCCc2ccccc21 880985783 YKIALTIKECFHTK-KRWDZBQOSA-N 399.472 2.954 0 50 GFAA Cn1cc([C@@H]2[C@H](C(=O)N[C@@H]3CCCc4occc43)CC(=O)N2C(C)(C)C)cn1 225453463 YCFFBLJUZJIMJZ-GPMSIDNRSA-N 384.480 2.895 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)NCc1ccccc1Cn1cccn1 55182461 AVPFVDJFHWBSGG-UHFFFAOYSA-N 382.489 2.818 0 50 GFAA CCCNC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613197 ONGKVGPUMSTKGM-UHFFFAOYSA-N 376.881 2.547 0 50 GFAA CN1CC[C@@H]2[C@@H](CCCN2C(=O)NC2CCN(CCc3ccccc3)CC2)C1 246046655 XQEXVPXHJKDNJV-RBBKRZOGSA-N 384.568 2.819 0 50 GFAA Cc1nc(CNC[C@@]2(O)CCCN(Cc3ccccc3F)C2=O)sc1C 20202705 NPFISTPKZMISNT-IBGZPJMESA-N 377.485 2.542 0 50 GFAA CN(CC(C)(C)CN1CCOCC1)[C@@H]1CCCN(C2Cc3ccccc3C2)C1 23372835 UBGSCDBDPNCBJV-JOCHJYFZSA-N 385.596 2.908 0 50 GFAA COC(=O)[C@H](C)N(C)C(=O)c1csc2nc(-c3ccc(OC)c(F)c3)cn12 67688386 JVCNPFSKOZKPCQ-JTQLQIEISA-N 391.424 2.844 0 50 GFAA CCSCCn1cnc2c(=O)[nH]c(Nc3ccc(Cl)cc3)nc(=O)c21 20293649 GASWVUANOXKBBX-UHFFFAOYSA-N 377.857 2.630 0 50 GFAA Cc1nnc(CN(C)C(=O)c2coc(COc3cccc4cccnc34)n2)o1 67695292 AJXSNTUIECWQBS-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA Cc1ccc2oc(C(=O)NC[C@@H](c3ccccc3)N3CCOCC3)cc(=O)c2c1 28292267 GWFQGFQQRHJPKH-IBGZPJMESA-N 392.455 2.905 0 50 GFAA CCc1ccc(NC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)cc1CC 252489489 JRVOVVIVXAWVKV-UHFFFAOYSA-N 390.505 2.899 0 50 GFAA O=C(Nc1ccccc1Oc1cccc(F)c1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252519097 AXNYTEOMOKJDAQ-HNNXBMFYSA-N 394.406 2.953 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCOC[C@](O)(CN4CCCC4)C3)c2)o1 77406760 GDSLFHYHMODTLQ-QFIPXVFZSA-N 384.476 2.554 0 50 GFAA CCCc1oncc1C(=O)N1CCC[C@]2(CCC(=O)N(CCCOC)C2)C1 77341289 TVWMXUYFQZEGNM-HXUWFJFHSA-N 377.485 2.508 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H]2CC[C@H]2NC2CCN(C(C)C)CC2)c(C)s1 72475351 INVNWXGMEXYPDZ-SJORKVTESA-N 385.599 2.637 0 50 GFAA CC(C)C(=O)N1CCC(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1 120965604 XOKRFMGBZWQTQZ-QGZVFWFLSA-N 375.488 2.805 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)c1cc(C)n(C)n1)CC2 328652297 WIJJYQWDLWHMGC-GOSISDBHSA-N 386.521 2.833 0 50 GFAA Cc1ccccc1[C@@H]1C(O)=NCCN1C(=O)c1cc2c(nc1O)CCCC2=O 329569570 LXLLBZQPOVBRES-GOSISDBHSA-N 379.416 2.768 0 50 GFAA Cc1coc(-c2cccc(NC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)c2)n1 154768227 NZJJVCPOGOFIJF-NRFANRHFSA-N 390.399 2.957 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCN[C@H](C)C3)cc2)c(C)c1Br 155210387 DWZIYYXIJYYEKV-LLVKDONJSA-N 377.286 2.686 0 50 GFAA COC(=O)N1CCCc2cc(NS(=O)(=O)NCc3ccccc3)ccc21 71589784 YQXFHJPAPDHMOI-UHFFFAOYSA-N 375.450 2.652 0 50 GFAA COc1cc2c(cc1OC)CCN(C(=O)c1ccc(-c3ncon3)cc1)CC2 369089454 ZUOSLXVGFXTVFF-UHFFFAOYSA-N 379.416 2.995 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 370798294 LNDIEROBRWMQJU-SGMGOOAPSA-N 384.307 2.932 0 50 GFAA CN(c1ccccc1)c1ccc(CN2CCn3nc([C@@H](O)CO)cc3C2)cc1 219024470 ZAPWRQIUQIJTFX-QFIPXVFZSA-N 378.476 2.693 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)O)[C@@H]21 216627183 ZVMXAIYIRBWSAF-LJQANCHMSA-N 396.399 2.683 0 50 GFAA biogenic O=C(O)c1ccccc1CCC(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 262701902 AXGLQYWEIYEMNW-IBGZPJMESA-N 398.503 2.959 0 50 GFAA CN(C)c1ncnc2c1CCN(S(=O)(=O)c1cccc(Cl)c1Cl)C2 71753494 NVEOTGPQHBKGJN-UHFFFAOYSA-N 387.292 2.596 0 50 GFAA CCc1nn2c(nnc3c(=O)n(CCCC(=O)O)ccc32)c1-c1ccccc1 40388400 SAGBWNRJPZCTSE-UHFFFAOYSA-N 377.404 2.533 0 50 GFAA CN(C)CC(C)(C)NC(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71767928 NXYVMRHTYOVMSF-XMMPIXPASA-N 393.531 2.990 0 50 GFAA CCn1ncc2cc(C(=O)N3CCC[C@H](Oc4ncccc4F)C3)c(C)nc21 282685499 LKZUDNNDOJSHDA-HNNXBMFYSA-N 383.427 2.977 0 50 GFAA COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C[C@H](C)c4ccccc43)cc2)[nH]1 130751635 XCKZGKJSSDQJHY-AWEZNQCLSA-N 391.427 2.645 0 50 GFAA CCOCCCN1CC[C@H](N2C(=O)[C@@H]3C[C@@H]4CCCC[C@H]4N3C2=O)[C@@H](C)C1 239653910 BLOVERYUVJTGPE-FKSLSLAPSA-N 377.529 2.719 0 50 GFAA Brc1ccc2nc(CN3CCN(C[C@H]4CCOC4)CC3)oc2c1 241720786 QSHJARWXPJTCLN-CYBMUJFWSA-N 380.286 2.744 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC[C@H](c3nccn3Cc3ccccc3)C2)c[nH]1 82098127 LNCVKRRFUKTXST-SFHVURJKSA-N 376.460 2.948 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)NCCc3nc(C(F)(F)F)cs3)C2)n1 174264427 AHKLQBANOJZWPI-SNVBAGLBSA-N 389.403 2.985 0 50 GFAA O=C(NCc1ccccc1Cl)C1CCN(C(=O)NC2CCOCC2)CC1 426493195 NUMUVXHIMNIVRW-UHFFFAOYSA-N 379.888 2.557 0 50 GFAA O=C(N[C@H](c1ccccc1)c1ccncc1)N1CCN(C2CCCC2)C(=O)C1 426411597 ZCQWUFLYMYSCKS-OAQYLSRUSA-N 378.476 2.967 0 50 GFAA COc1cccc(CC(=O)N2CCN(c3ccccc3Cl)C(=O)C2)c1OC 82099309 DBFGXKQKFIBTRB-UHFFFAOYSA-N 388.851 2.775 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCC4CCNCC4)csc3C2)nc1 426621748 PVGUMRJAMZBUCE-UHFFFAOYSA-N 398.576 2.993 0 50 GFAA Cc1cc(C)c(N2C[C@@H](C(=O)NCc3nnc4n3CCCCC4)CC2=O)c(C)c1 193158874 YPEYPILMAYBMDP-KRWDZBQOSA-N 395.507 2.599 0 50 GFAA CCNc1ccnc(-c2cccc(C(=O)N(Cc3cnn(C)c3)C3CC3)c2)n1 426429028 VKDQRXJOIDANJD-UHFFFAOYSA-N 376.464 3.114 0 50 GFAA COCN(c1noc(C)c1C)S(=O)(=O)c1ccccc1Br 140926391 IKXAQUWRNLFKGW-UHFFFAOYSA-N 375.244 2.853 0 50 GFAA Cn1c(CN2CCOCC2)nnc1C1CCN(Cc2ccccc2Cl)CC1 96138936 FGEWGKLEYZTCKS-UHFFFAOYSA-N 389.931 2.680 0 50 GFAA CCO[C@H]1C[C@@H](O)C12CCN(C(=O)CN1CCC(c3ccccc3)CC1)CC2 91593479 PHQWRKXKUNCDSY-RTWAWAEBSA-N 386.536 2.645 0 50 GFAA COc1cc([C@H](C(=O)O)N2CCN(c3ccccc3)CC2)cc(OC)c1OC 95375429 HPEQVCXWTJBYHS-LJQANCHMSA-N 386.448 2.660 0 50 GFAA CCCN(Cc1cccc(OC)c1)C(=O)[C@@H](c1cccnc1)N1CCOCC1 95385998 GZZKSGQRAFRJJN-OAQYLSRUSA-N 383.492 2.902 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCC(c2nccn2Cc2ccccn2)CC1 95526487 POCWYAGUOCXZDA-UHFFFAOYSA-N 390.491 2.948 0 50 GFAA CCNc1ccnc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 95365914 MCNCABGVPQZXQQ-UHFFFAOYSA-N 394.523 2.755 0 50 GFAA N[C@H](Cc1ccccc1)C(=O)N1CCC(c2nccn2Cc2cccnc2)CC1 95516773 QRQNFHQCZVFBAF-OAQYLSRUSA-N 389.503 2.602 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2ccc(N(C)C)cc2)CC1 95366146 IPVUSGQUHVULHV-UHFFFAOYSA-N 383.540 2.921 0 50 GFAA Cc1cc(C)nc(N2CCC[C@H](C(=O)NC[C@H]3CCCN4CCCC[C@@H]34)C2)n1 238950619 ZALXBUPLKWCELC-AABGKKOBSA-N 385.556 2.691 0 50 GFAA O=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCn2c1nc1ccccc12 334162969 KONUUCFPMGEBTL-UHFFFAOYSA-N 376.825 2.608 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C(=O)c4ccc(F)cc4)N4CCC[C@@H]4[C@@H]3C2=O)cc1 245327753 QGOXTTHFVIUWDE-FYQPLNBISA-N 392.430 2.969 0 50 GFAA Cc1nccc(C2CCN(CCN3CCN(Cc4ccccc4)CC3)CC2)n1 252505382 VQPHSPIWFZLQRC-UHFFFAOYSA-N 379.552 2.782 0 50 GFAA CN(C)c1nc(-c2cccc(C(=O)N(CC3CCC3)C[C@H]3CCCO3)c2)n[nH]1 299798350 RPHLKMLKBIDLBQ-GOSISDBHSA-N 383.496 2.959 0 50 GFAA COc1ccccc1-n1cc(CNC(=O)CSc2nc(C)cc(C)n2)cn1 670435783 XDLIEGHWASMARR-UHFFFAOYSA-N 383.477 2.696 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NC[C@H]1CCN(c2ccccc2F)C1 952988424 NYWOWODDQYGLPX-QGZVFWFLSA-N 383.467 2.663 0 50 GFAA Cc1cc(C)n(CC(=O)NC[C@@H]2CCCN(c3ncc(Cl)cc3F)C2)n1 952981969 UYEHAXPHHRPQSU-AWEZNQCLSA-N 379.867 2.720 0 50 GFAA CN1CC[C@H](CNC(=O)NC[C@@H]2CCC[C@H]2O)[C@@H]1c1ccc(Cl)c(F)c1 270724377 XDWVCJMKMKGYIB-JFTQMJAMSA-N 383.895 2.932 0 50 GFAA C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)NCc1ccccc1N1CCCCC1 186602621 JMFZUPZFHJZHGB-GOSISDBHSA-N 388.556 2.664 0 50 GFAA Cn1cc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)c2ccccc2c1=O 277101254 PADDBBUGRLRIQX-FQEVSTJZSA-N 389.455 2.632 0 50 GFAA C[C@@H](N)[C@@H](C)C(=O)NCCSCCOc1cccc(Br)c1 192048390 RMKGWJGTDUWMHD-VXGBXAGGSA-N 375.332 2.661 0 50 GFAA CCc1nc(CN2CCC[C@H](CNC(=O)c3ccc(Cl)cc3F)C2)n[nH]1 1506405048 BQVCJSAOKDDYEB-GFCCVEGCSA-N 379.867 2.802 0 50 GFAA COc1ccc2c(c1)[C@H](NC(=O)c1cnc3ccccn3c1=O)CC(C)(C)O2 1506406421 KKIJWMOHJXJQCW-MRXNPFEDSA-N 379.416 2.735 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 909168 DJGDSNJZNRODIA-YWPYICTPSA-N 388.342 2.991 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCCc3cccc(OCCNC(C)=O)c32)c1 12364284 MUPCHCGPVBPYFC-UHFFFAOYSA-N 398.459 2.812 0 50 GFAA biogenic,in-vitro CNS(=O)(=O)c1cc(NCC2CC2)cc(C(=O)Nc2ccc(OC)cc2)c1 14541730 YSMQSAUDSXOSPZ-UHFFFAOYSA-N 389.477 2.678 0 50 GFAA CC(C)(CO)CNC(=O)[C@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 15065554 JGRYXYVONPGCKS-AWEZNQCLSA-N 386.414 2.579 0 50 GFAA COc1ccc(-c2noc([C@H]3CCCN3C(=O)c3cnccn3)n2)cc1OC 169792136 JCMBUOFIWWFGHP-CQSZACIVSA-N 381.392 2.521 0 50 GFAA O=C1CCCCN1CCCC(=O)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857701186 FVBQPCLUDXWGDP-MZKRTTBSSA-N 384.520 2.764 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2oc3c(OC)c(OC)ccc3c2C)CC[C@@H]1O 1857725647 HFHKFVNTKGYHHB-KKSFZXQISA-N 391.464 2.744 0 50 GFAA COc1cc(-c2nccn2[C@@H]2CCC[C@H](CO)C2)cc(Cl)c1OCC(N)=O 1857731917 TYZMTYDJCGKXNX-GXTWGEPZSA-N 393.871 2.800 0 50 GFAA CN(C)c1ccc(CN2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)cn1 1875248611 ALJXSRVFLQRIGK-NFBKMPQASA-N 397.519 2.808 0 50 GFAA CC(C)=CCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1cc(=O)n(C)c3ccccc13)C2 216433692 PTXYWZJZNVULCH-SJORKVTESA-N 393.487 2.568 0 50 GFAA Cc1nc(-c2cccc(NC(=O)c3ccc(CN4C(=O)CCC4=O)cc3)c2)n[nH]1 363371353 HLZXHTRNPVLFJB-UHFFFAOYSA-N 389.415 2.681 0 50 GFAA C[C@]1(C(=O)NCc2cnc3n2CCCC3)CCCN(C(=O)c2ccccc2)C1 375305350 ZTXWLEWYPDKNPD-QFIPXVFZSA-N 380.492 2.778 0 50 GFAA Cc1ccc(C=c2sc3nc([C@@H]4COc5ccccc5O4)nn3c2=O)cc1 263630906 IOCWKEQWYWXZBP-INIZCTEOSA-N 377.425 2.520 0 50 GFAA CC(C)c1ccccc1Oc1ccccc1C(=O)NC[C@H](O)Cn1ccnn1 1875265860 ICUATNIFGLTENS-INIZCTEOSA-N 380.448 2.985 0 50 GFAA CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cncc(C(=O)O)c1 1875268913 KPRBMZHDVHSCFG-LJQANCHMSA-N 381.476 2.983 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2ccc(-c3noc([C@H]4CCCO4)n3)cc2)cn1 1875384884 JSCCJTILBRSWCK-BXZDMCNWSA-N 381.436 2.585 0 50 GFAA N[C@@H](Cc1ccc(NC(=O)Cc2cccc(CC(F)(F)F)c2)cc1)C(=O)O 1875305160 JJSJTPAERRWDMU-INIZCTEOSA-N 380.366 2.927 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3ccc4[nH]ccc4c3)C2)c1C 1875396799 BZFGLSQBTJEUAK-GOSISDBHSA-N 392.507 2.645 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)C1(c2cccc(C(F)(F)F)c2)CC1 1875402651 JCCSWSXYCBVATC-KBRIMQKVSA-N 393.409 2.889 0 50 GFAA O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@@H]1CS(=O)(=O)Cc2ccccc21 888092848 KNPMITSBSKRZSM-OAHLLOKOSA-N 399.390 2.756 0 50 GFAA COCc1[nH]nc(NC(=O)CN(C)Cc2ccncc2)c1-c1ccc(OC)cc1 2100477906 IKMFHQJYWGLQKA-UHFFFAOYSA-N 395.463 2.697 0 50 GFAA C[C@@]1(NC(=O)c2ncn3cc(Cl)ccc23)CCN(C(=O)[C@@]23CCC[C@@H]2C3)C1 2325794736 OYYPHPABYGMCOC-SMHULIPUSA-N 386.883 2.899 0 50 GFAA COc1cc(C(=O)NC[C@]2(C)CCN(C)C2)ccc1CNC(=O)OC(C)(C)C 2325810518 OZURWFAQHFBNSU-NRFANRHFSA-N 391.512 2.792 0 50 GFAA O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 623000 NZLZHGMARVZMOL-UHFFFAOYSA-N 389.458 2.961 0 50 GFAA O=C1c2ccccc2C(=O)N1Cc1nc2ccccc2c(=O)n1-c1ccncc1 754056 CDBQQIVBKFUROB-UHFFFAOYSA-N 382.379 2.577 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)NCCc1c[nH]c2ccc(Cl)cc12 2337781 RLEHZJTZPRAOEO-UHFFFAOYSA-N 381.819 2.776 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3S(=O)(=O)N3CCCCC3)C2=O)cc1 2356138227 JBFIUHBRLBQIRA-FQEVSTJZSA-N 391.537 2.687 0 50 GFAA Cc1ncccc1CN1C(=O)[C@]2(CCN(Cc3nccn3C)C2)c2ccccc21 2356154472 XHZYHARVMMPHOP-QHCPKHFHSA-N 387.487 2.814 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356158389 ZYEOEGIUWUEVAD-FQEVSTJZSA-N 386.883 2.871 0 50 GFAA COc1ccccc1[C@@H]([C@@H](O)C(=O)c1c[nH]c2ccccc12)N1CCOCC1 101016390 RBTFANDLWWTNGH-RBBKRZOGSA-N 380.444 2.794 0 50 GFAA COc1cc2c(cc1OC)[C@@H]([C@H]1c3cc4c(cc3CCN1C)OCO4)OC2=O 22242045 FLMLIWNNRKBNAQ-UXHICEINSA-N 383.400 2.873 0 50 GFAA COCc1cc(N[C@@H](CN2CCOCC2)c2ccccc2)nc(C(C)(C)C)n1 469872160 OOESTGQWBVPTSU-IBGZPJMESA-N 384.524 3.406 0 50 GFAA CCC[C@H](C)Oc1nc(N)c2[nH]c(=O)n(CCCCCN3CCCCC3)c2n1 68201338 LFMPVTVPXHNXOT-HNNXBMFYSA-N 390.532 2.925 0 50 GFAA in-vitro O=C1C[C@]2(CCN(C(=O)NCC3(c4cccc(F)c4F)CCCC3)C2)CN1 280035028 NNZWNWMEDBTTNV-LJQANCHMSA-N 377.435 2.698 0 50 GFAA O=C(CCc1nc(-c2ncccn2)no1)N1CCC[C@H]1Cc1ccc(F)cc1 363463383 JNOPSVBFAXTUKU-INIZCTEOSA-N 381.411 2.832 0 50 GFAA CS(=O)(=O)c1ccccc1C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 363630598 WMSNRMQXNRQKSE-AWEZNQCLSA-N 392.908 3.000 0 50 GFAA COc1ccc2c(c1)C(=O)N(Cc1ccccc1)C(=O)/C2=C\N1CCOCC1 32609502 MOEPHEPRIQIFOS-HKWRFOASSA-N 378.428 2.551 0 50 GFAA Cc1nnsc1CN1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72127294 HNBQBZNMGDNQBA-CWFSZBLJSA-N 384.505 2.637 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCn2nc([C@@H](O)c3ccccc3)cc2C1 219902321 SCLBEHXLUHQQKS-IBGZPJMESA-N 385.899 2.930 0 50 GFAA CC[C@H]1CN(C)c2ccccc2CN1S(=O)(=O)c1cnc2c(c1)c(C)nn2C 157211788 XXRLOCCBIUJZHX-INIZCTEOSA-N 399.520 2.696 0 50 GFAA CC(C)(C)n1cc(C(=O)N2CCO[C@@H](C(=O)O)C2)c(-c2ccc(F)cc2F)n1 236775615 FDZVCVJWUDMGHR-OAHLLOKOSA-N 393.390 2.509 0 50 GFAA COc1ccc(Cc2noc(-c3ccc(N4[C@H]5CC[C@@H]4CNC5)nc3)n2)cc1 72145798 JULFXHKPCYZIAU-CALCHBBNSA-N 377.448 2.672 0 50 GFAA Cc1sc2nc(Cc3noc([C@@H]4OC[C@H]5COCC[C@@H]54)n3)nc(O)c2c1C 377774319 GVVWMEBNTZGNBA-JRPNMDOOSA-N 388.449 2.712 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cc(N)nc(Cl)c3)CC2)oc1C 171889174 RLSRVWSUDLTFJZ-UHFFFAOYSA-N 377.876 2.564 0 50 GFAA COc1ccc(CC(=O)N2CC(=O)N(c3cccc(C)c3)C[C@@H]2C)cc1OC 82091343 CZRYIYYBQWPGFK-INIZCTEOSA-N 382.460 2.819 0 50 GFAA CCNc1ncc(CN2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)O)C2)cn1 426414670 PTPYNJIFSLDZSK-IPJJNNNSSA-N 380.492 3.379 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@H]1O)C1CCN(C(=O)CCc2ccccc2)CC1 176609871 YQHJDMSHJBGVKW-FYYLOGMGSA-N 392.499 2.632 0 50 GFAA CCc1cccc2c(C(C)=O)cn(CC(=O)N3CCN(c4cnccn4)CC3)c12 426602539 QOKRIMCILBIRGV-UHFFFAOYSA-N 391.475 2.545 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCNC[C@H]4C)csc3C2)nc1 426537466 JUAWGYWQJHTSHU-OAHLLOKOSA-N 384.549 2.698 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccc(C[C@H]4CCCNC4)cc3)CC2)CC1=O 95531087 IAAQYDDHNFXNQP-LJQANCHMSA-N 383.536 2.703 0 50 GFAA CS(=O)(=O)c1cccc(NC(=O)NCc2noc(-c3cccs3)n2)c1 239591413 BBHFCVUDWGGXMX-UHFFFAOYSA-N 378.435 2.523 0 50 GFAA CN(Cc1c[nH]nc1-c1ccc(F)cc1)C(=O)c1cnc2sccn2c1=O 97729773 RFCJIMAAWAIEAA-UHFFFAOYSA-N 383.408 2.557 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](CCC(=O)NCc2ccc(C)o2)C1 95496858 RRXUBHFAJQOATK-INIZCTEOSA-N 385.464 2.940 0 50 GFAA COc1cc(C(=O)N2CCC(c3nccn3CCCN(C)C)CC2)ccc1O 95524375 SPCRXDSXLSIYJJ-UHFFFAOYSA-N 386.496 2.569 0 50 GFAA Cc1ccccc1COC1CN(C(=O)Nc2cccc(NS(C)(=O)=O)c2)C1 96140924 IFEZIVBOXHNIIE-UHFFFAOYSA-N 389.477 2.799 0 50 GFAA Cc1nc(CCNC(=O)c2cnc(-c3ccccn3)nc2O)sc1Cl 91493733 ILCFXPNXNHSQRN-UHFFFAOYSA-N 375.841 2.635 0 50 GFAA O=S(=O)(c1ccc2nc(O)nc(O)c2c1)N1CC2(CCC2)[C@@H]1c1ccccc1 292660810 JEXPAXWYDGLXNB-KRWDZBQOSA-N 397.456 2.957 0 50 GFAA CCc1ccc(CC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cc1 181359531 GRQFWFGHRRWDOR-IBGZPJMESA-N 378.538 2.645 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@H]1Sc2ccccc2NC1=O)c1cccs1 299742028 ARZAVMYCRNZMNR-SMDDNHRTSA-N 376.459 2.883 0 50 GFAA O=C(Cc1cccs1)N1CCC2(CC1)NC(=O)N(c1cccc(Cl)c1)N2 263617475 NYTMROZUQPOVNY-UHFFFAOYSA-N 390.896 2.997 0 50 GFAA O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21)Nc1nc2ccccc2s1 34863283 AQZKODBLWDKBDP-OSAQELSMSA-N 376.507 2.961 0 50 GFAA biogenic Cc1cc(C(=O)NCC2CCN(C(=O)c3cccn3C3CC3)CC2)nc(C)n1 952966410 WJKRWDIDMUSROZ-UHFFFAOYSA-N 381.480 2.512 0 50 GFAA Cc1noc(-c2ccnc(N3CCC[C@@H](CNC(=O)c4oc(C)nc4C)C3)c2)n1 952988791 KSFZLYXEUFCYEY-HNNXBMFYSA-N 396.451 2.691 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)Nc1cccc(C(=O)NCCOC)c1C 952991428 PFLXSHADDHXZAJ-OAQYLSRUSA-N 395.503 2.757 0 50 GFAA Cc1ccc(OCC(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)cc1 1565506635 QVVQACFDWPRKQR-MJGOQNOKSA-N 379.460 2.532 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1cscn1)c1cccc(-c2ncc[nH]2)c1 1565509471 FVAFBTQKFRGBIO-IRXDYDNUSA-N 384.461 2.637 0 50 GFAA CC[C@H]1CN(C(=O)C2(C)CCN(Cc3ccccc3)CC2)CCN1C[C@@H](C)O 165709136 MGUHGJAJHICLCJ-CTNGQTDRSA-N 387.568 2.592 0 50 GFAA CN1CCC(N(C)[C@H]2CCCC[C@@H]2N(C)S(=O)(=O)c2cccs2)CC1 167078696 JIQYLUJAPCZVLK-IRXDYDNUSA-N 385.599 2.706 0 50 GFAA CC(C)(C)CS(=O)(=O)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 170626309 QSQFBMGKNOGRNA-UHFFFAOYSA-N 391.371 2.861 0 50 GFAA COc1cccc2c1CCN(C(=O)N[C@@H](C)c1nnnn1-c1ccccc1)CC2 194447451 VOMGKVPEULHUNN-HNNXBMFYSA-N 392.463 2.542 0 50 GFAA COC[C@@H](C)N(CC(=O)N1C[C@H](C)O[C@H](C)C1)Cc1ccc(SC)cc1 1506402292 VVRVBZSVWHDEDZ-ZACQAIPSSA-N 380.554 2.881 0 50 GFAA COc1cccc(CN(C)[C@H]2C[C@H]3C[C@@H](O)C[C@H]3C2)c1OCCn1ccnc1 1704351077 RYVJCUUNYKHICR-FGYAAKKASA-N 385.508 2.952 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3cnc(C)cn3)CC1)OCC2 1704345006 SYYQLBGDIUFVLC-UHFFFAOYSA-N 383.448 2.506 0 50 GFAA CCc1ccccc1N1CCN(S(=O)(=O)c2cc(OC)ccc2OC)CC1 1121533 RYTCOJAGKUISTJ-UHFFFAOYSA-N 390.505 2.777 0 50 GFAA Cc1ccc(-n2c3c(cc(C(=O)N4CCOCC4)c2=O)C(=O)CC(C)(C)C3)cc1 1138387 NRTZZAYKXIKCHE-UHFFFAOYSA-N 394.471 2.773 0 50 GFAA CCOc1ccc(-c2nccn2-c2ccc3c(c2)ncn3CCO)cc1CO 1775980995 FUPUOYOHZJPQJH-UHFFFAOYSA-N 378.432 2.772 0 50 GFAA CCOC(=O)CN1C(=O)[C@](O)(CC(=O)c2ccc(Cl)cc2)c2ccccc21 894966 UYDFRFAQGBIOAH-FQEVSTJZSA-N 387.819 2.710 0 50 GFAA COC(=O)C1[C@@H](c2ccccc2)C(C(=O)N2CCOCC2)[C@@H]1c1ccccc1 897626 HFJKDTBIAOUSBU-IKJYFWGWSA-N 379.456 2.832 0 50 GFAA CCc1c(C(=O)NCCN(CC)CC)c(=O)cc(C)n1Cc1ccccc1OC 12510797 KPBXLSWXFGXKEX-UHFFFAOYSA-N 399.535 2.848 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NC1Cc3ccccc3C1)C2 14531821 MGZPVTDQIAEMKT-GOSISDBHSA-N 378.520 2.753 0 50 GFAA CCN(CC)c1ncccc1CNC(=O)CN1C[C@H](c2ccccc2)CC1=O 19111184 GBGQKBPSJFVWHL-LJQANCHMSA-N 380.492 2.560 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2cccs2)[C@@H](CCO)C1 19225977 MBGOLBCRQDJXKH-HNNXBMFYSA-N 376.551 2.835 0 50 GFAA S=C(Nc1ccccc1)N[C@@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3 19637659 WZVSEUQOHORVNL-LVKMRUPZSA-N 378.545 2.541 0 50 GFAA COc1ccc(-c2cc(N3CCC[C@@H](NC(=O)c4ccccn4)C3)[nH]n2)cc1 169753881 PCLJAQIXKBRZLN-MRXNPFEDSA-N 377.448 2.879 0 50 GFAA COc1ccc(OCC(=O)N2CCC3(CC2)NC(c2ccc(C)cc2)=NO3)cc1 169755013 TZIUURWXGNTCNY-UHFFFAOYSA-N 395.459 2.683 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc(Br)o2)c1 2754744 HHJSGHCHUBYUEY-UHFFFAOYSA-N 382.166 2.868 0 50 GFAA COC(=O)c1ccsc1NC(=O)c1ccsc1NC(=O)[C@@H]1CCCO1 4750159 OGKWCIYQXKRCBF-NSHDSACASA-N 380.447 2.966 0 50 GFAA CCS(=O)(=O)N(C)c1ccc(C(=O)Nc2ccc(OC)cc2OC)cc1 6697484 DIZVMRQMRODKGX-UHFFFAOYSA-N 378.450 2.742 0 50 GFAA CC(=O)Oc1ccc(/C=c2/sc3nc(-c4ccc(Cl)cc4)nn3c2=O)cc1 2533665 FBFNDLWRMVPOBK-MHWRWJLKSA-N 397.843 2.944 0 50 GFAA C[C@H]1C(=O)N2CCC[C@@H]2CN1Cc1ccccc1OCCCCn1ccnc1 1857682552 VYVLLZPBSPSTBU-AZUAARDMSA-N 382.508 2.937 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4cn[nH]c4)C3)nc2c1 1857696842 FISFBWHDEXLTGK-CQSZACIVSA-N 383.452 2.525 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NCCNc4ncccc4C)CC3)nc2n1 1857697040 SDTMGEGXJGWFRJ-UHFFFAOYSA-N 394.479 2.679 0 50 GFAA O=C(c1ccc(CSc2nnc[nH]2)o1)N1C[C@H]2CC[C@@H](C1)N(CC1CC1)C2 247797395 DJPRGBBSFSZGEM-GJZGRUSLSA-N 387.509 2.636 0 50 GFAA CS(=O)(=O)CCCN[C@@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 368351497 HMOBHFVGWZMVSC-PXNSSMCTSA-N 393.480 2.601 0 50 GFAA COc1ccc([C@@H](CNC(=O)C[C@H](CN)OC)c2c[nH]c3ccccc23)cc1 262971441 XQXBVTUBPDVUEG-IEBWSBKVSA-N 381.476 2.788 0 50 GFAA O=c1cc(N2CCN(c3nncc4ccccc34)CC2)cnn1Cc1ccccc1 1875263022 DCPABCHZKSHIMJ-UHFFFAOYSA-N 398.470 2.561 0 50 GFAA CC1(C)Cc2ccc(C(=O)NC[C@H]3CCc4nnc(C(F)F)n4C3)c(O)c2O1 1875300445 CJQQZHWZTATRLW-SNVBAGLBSA-N 392.406 2.627 0 50 GFAA C=CC(=O)N[C@@H]1CCCN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)C1 1875389449 OXQSICQQDKYAET-GFCCVEGCSA-N 381.354 2.973 0 50 GFAA O=C(c1csc(COc2ccccc2)n1)N1CCNC[C@@H]1c1ccncc1 2325768485 KVHHGVWJLBJAFG-GOSISDBHSA-N 380.473 2.904 0 50 GFAA C[C@H](CC(F)(F)F)C(=O)N[C@@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 2325794878 UWLNGVVLUOBGAU-DYVFJYSZSA-N 379.467 2.660 0 50 GFAA CC(NC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)(C1CC1)C1CC1 856123747 ZSDXIKILRBMZAR-UHFFFAOYSA-N 391.518 2.607 0 50 GFAA CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 880983111 SLNYVOMHKLYRGE-KRWDZBQOSA-N 399.472 2.954 0 50 GFAA C[C@H](Sc1nnc(N2CCOCC2)n1C1CC1)C(=O)c1ccc(F)cc1 115454234 RKHXOIZTVGVZGQ-LBPRGKRZSA-N 376.457 2.952 0 50 GFAA C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)C1CCN(c2ccc3nncn3n2)CC1 122616453 LXGWDBNSPARLJP-QVKFZJNVSA-N 390.491 2.781 0 50 GFAA Cc1ccc(C2=NS(=O)(=O)N(C)C(C(=O)N3[C@H](C)CCC[C@H]3C)=C2)cc1 20366853 NCCNEAOVYUYEEH-HUUCEWRRSA-N 375.494 2.648 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC[C@@H](c3ccco3)N3CCN(C)CC3)no2)cc1 22938352 LWUYNNGWANCEQR-IBGZPJMESA-N 394.475 2.962 0 50 GFAA COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCc1cc(OC)no1 409414592 NDOVSJSFJUILLN-PKOBYXMFSA-N 393.528 2.745 0 50 GFAA biogenic Cc1ccccc1-c1noc(CCC(=O)NCCc2[nH]nc3c2CCCC3)n1 65526156 GEFJHBFBIFWMEL-UHFFFAOYSA-N 379.464 2.938 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N(C)Cc2nnc(C)o2)no1 11839448 XTGICXLGTXZNBN-UHFFFAOYSA-N 392.799 2.879 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1 252508760 XSWQVONIOBZAQA-SNVBAGLBSA-N 398.389 2.960 0 50 GFAA COc1ccc(CCC(=O)N2CCc3c(nc(-c4ccccc4)[nH]c3=O)C2)cc1 72143632 GUBVGESHCZJVOV-UHFFFAOYSA-N 389.455 2.963 0 50 GFAA C[C@@H]1[C@H](C(=O)NCCC(=O)N2CCCCC2)CCCN1C(=O)OC(C)(C)C 253427558 WBZVVIHNCMMLMB-HZPDHXFCSA-N 381.517 2.541 0 50 GFAA CC(=O)N(CC(=O)O)[C@H]1CCCN(C(=O)C[C@H](C)c2ccccc2F)CC1 328626109 DVCOZJRHDJKEIB-HOCLYGCPSA-N 378.444 2.634 0 50 GFAA Cn1cc(CN(Cc2c(C(=O)N3CCCC3)nc3sccn23)C2CC2)cn1 71760049 ICXMVFBLUJKVDC-UHFFFAOYSA-N 384.509 2.530 0 50 GFAA O=C(CN1CC[C@H](Oc2cccnc2)C1)Nc1ccc(N2CCCCC2)nc1 154624690 FFADOVUMDWHNBB-IBGZPJMESA-N 381.480 2.559 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N2CCN(c3ncccc3C)CC2)c1 77387167 WWYGEVRXOVWIIY-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)NCCN2CCCC2)CC1 39466983 VAYPQQHPGGYDSM-UHFFFAOYSA-N 393.915 2.555 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)CN3Cc4ccccc4C3)cn2)c1 215175177 UWQFDNZGDOINCF-UHFFFAOYSA-N 376.460 2.855 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@H]1C(=O)NCCc1nc(C)c(C)s1 72432363 YUXRIGRRKYZZDO-KRWDZBQOSA-N 378.586 2.615 0 50 GFAA Cc1cccc(C(=O)Nc2ccccc2C(=O)N[C@@H]2CCc3nc(C)nn3C2)c1 171457694 UICHFIJXKNRNTB-QGZVFWFLSA-N 389.459 2.892 0 50 GFAA O=C(N[C@H]1CCOC2(CCCCC2)C1)N[C@H]1CCCN(CC(F)(F)F)C1=O 130255241 CDAYHJCTYZXWSM-KBPBESRZSA-N 391.434 2.721 0 50 GFAA CCOc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)NCCC2=CCCCC2)cc1 13596299 XLHQNGKDVNIBND-NRFANRHFSA-N 399.535 2.783 0 50 GFAA O=S(=O)(C1=Cc2ccc(OC(F)F)cc2CC1)N1[C@H]2CC[C@H]1CC(O)C2 158627361 HVJJDVQKHFEROZ-KBPBESRZSA-N 385.432 2.893 0 50 GFAA O=C(N[C@@H]1CCc2n[nH]cc2C1)C1(S(=O)(=O)c2ccccc2)CCCCC1 377434169 MFFFFMLPWCVRGU-MRXNPFEDSA-N 387.505 2.560 0 50 GFAA O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCCC[C@H]1c1nnc2n1CCCC2 333479974 XSOZVXUXWDWIRG-KBPBESRZSA-N 388.484 2.907 0 50 GFAA CNC(=O)[C@H]1CCCCN1CC(=O)Nc1ncc(Cc2cccc(C)c2)s1 173207106 XUFOATWRQQLHJX-QGZVFWFLSA-N 386.521 2.581 0 50 GFAA Cc1nn(CC(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)c(=O)c2ccccc12 46508395 MZIPKSCIHLHVEA-GOSISDBHSA-N 393.443 2.901 0 50 GFAA O[C@H]1[C@H](N2CCN(c3ccccc3F)CC2)c2ccccc2C12CCNCC2 82039391 OCVMZWOHMLEZRH-YADHBBJMSA-N 381.495 2.685 0 50 GFAA O=C(C1CCN(C2CCOCC2)CC1)N1CCC([C@@H](O)c2cccs2)CC1 426398981 FGOMKUNAVIRQGU-HXUWFJFHSA-N 392.565 2.911 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@@]2(c3ccccc3)CC23CCCC3)cc1 426649824 ZIOGWXZFBGIBQC-NRFANRHFSA-N 384.501 2.852 0 50 GFAA C[C@@H](O)C(=O)N1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95530071 IAGFVFQQEJHNIT-GOSISDBHSA-N 386.536 2.867 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCCC[C@H]3CO)csc2C1 426399360 GFOOJKDYCUBJMN-HNNXBMFYSA-N 389.521 2.898 0 50 GFAA c1ccc2c(-c3cnnc(N4CCC(N5CCOCC5)CC4)n3)cccc2c1 23366554 MMZOAPCSUATBLK-UHFFFAOYSA-N 375.476 2.993 0 50 GFAA O=C(NCCc1noc([C@@H]2CCCO2)n1)Nc1snnc1-c1ccccc1 95504359 WNDNTJUXYBVKTG-LBPRGKRZSA-N 386.437 2.804 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)N[C@H]3CCCN(c4cnccn4)C3)cc2)o1 95512396 RLGSOSXXWYWOPN-INIZCTEOSA-N 379.424 2.626 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C[C@@H](O)[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 253498272 SHIBSTMRCDJXLN-KDKHBOCISA-N 390.520 2.575 0 50 GFAA biogenic,in-vitro O=C(C[C@H](Cn1cccc1)c1ccc(Cl)cc1)NC[C@H]1CCS(=O)(=O)C1 263586960 AFHVIUQCIYXSAS-NVXWUHKLSA-N 394.924 2.866 0 50 GFAA CCN(C(=O)c1cccc(-c2nc(C)ccc2OC)c1)[C@@H]1CCS(=O)(=O)C1 299756031 BPCRBZLVEWEJQM-QGZVFWFLSA-N 388.489 2.715 0 50 GFAA Cc1cc(C)n(CCCC(=O)NCC2CCN(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3C4)CC2)n1 952974414 BPBBHNUTFCSSOI-QHAWAJNXSA-N 398.551 2.847 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)CCn2ccnc2C)cc1 1565510981 GNGLUFKQYHBGBJ-UXHICEINSA-N 382.508 2.713 0 50 GFAA COc1ccc([C@H]2CN(Cc3ccc(NC(C)=O)cc3)C[C@@H]2NC(C)=O)cc1 1565512212 FGPXMWBXKJSMNJ-YADHBBJMSA-N 381.476 2.758 0 50 GFAA CCOC(COCCNC(=O)c1cc(OC)ccc1Br)OCC 170614316 DQKONFGPUUTPKF-UHFFFAOYSA-N 390.274 2.603 0 50 GFAA CCOc1cccc2[nH]cc(CC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)c12 188071607 FLVDJCSHYPOOBK-INIZCTEOSA-N 385.508 2.726 0 50 GFAA O=C(Nc1cncnc1N1CCCC1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 760634916 XONPIZZHAADESY-KRWDZBQOSA-N 391.475 2.557 0 50 GFAA C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)CCc1nc2ccccc2[nH]c1=O 1506414746 RVUHYEPMOPPXLR-AWEZNQCLSA-N 393.443 2.847 0 50 GFAA O=C(c1ccc(OCc2ccccc2F)cc1)N1C[C@@H]2COCC[C@]2(CO)C1 1772705338 QYTGXCHWAPMTFA-XMSQKQJNSA-N 385.435 2.876 0 50 GFAA CCN1C[C@H](CN(C)c2nnnn2-c2ccc(Oc3ccccc3)cc2)CC1=O 1772704781 SXNONPGKHKKWFE-INIZCTEOSA-N 392.463 2.759 0 50 GFAA COc1cccc(NC(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2Cl)c1 12004104 VVHBPZARXPXTCO-UHFFFAOYSA-N 394.836 2.667 0 50 GFAA CN(C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1)C(C1CC1)C1CC1 12194131 NFNNRBHRMPJJCT-LJQANCHMSA-N 387.568 2.746 0 50 GFAA COC(=O)c1ccc(-c2noc(CN3CCCC[C@@H]3c3nccn3C)n2)cc1 12300093 CFEKUHAOWLZVOY-MRXNPFEDSA-N 381.436 2.984 0 50 GFAA CCN(CCn1cccn1)C(=O)c1cc(COc2ccc(C)cc2OC)on1 12718615 DOQXANDYTDZSBD-UHFFFAOYSA-N 384.436 2.929 0 50 GFAA CCN1CCN(C2(C(=O)N(C)Cc3ccc(C)o3)Cc3ccccc3C2)CC1 19744853 RCZOMWSBMAZHLX-UHFFFAOYSA-N 381.520 2.722 0 50 GFAA COc1cccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1 2868978 UYCSXWHNIVJWTO-CQSZACIVSA-N 392.452 2.874 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)c3ccc(Cl)cc3NC)Cc3c[nH]nc32)n[nH]1 1857529947 NCJORQKHVVIPRG-CYBMUJFWSA-N 385.859 2.573 0 50 GFAA COc1cc(-c2nc(CNC(=O)c3c(C)cc(C)n(C)c3=O)c(C)o2)ccc1O 1857674955 FIAFEGTWCSJCNW-UHFFFAOYSA-N 397.431 2.610 0 50 GFAA Cc1nn(C)c2c1[C@H](NS(=O)(=O)c1ccc3nc(O)cc(C)c3c1)CCC2 1857678909 CWVDJFZIILCBNG-MRXNPFEDSA-N 386.477 2.647 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCCCn3ccnc3)sc12 1857703546 MPOREAAPLGGXSG-UHFFFAOYSA-N 388.537 2.648 0 50 GFAA O=C([C@@H]1CCn2nccc2C1)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 1857708910 TXBJIZUCDJABBJ-CQSZACIVSA-N 393.409 2.975 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2ccc(N3CCCC3)c(Cl)c2)CC[C@@H]1O 1857710146 JPVRSSCLMCOXBX-ICSRJNTNSA-N 380.916 2.926 0 50 GFAA CCn1cnnc1[C@@H]1CN(Cc2nc3ccc(Br)cc3o2)CCO1 241946700 UNGOFVKAXLJETO-AWEZNQCLSA-N 392.257 2.775 0 50 GFAA COCc1ccc(NC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)cc1 242338943 ZDSWUYMIXMSDCH-UHFFFAOYSA-N 394.518 2.934 0 50 GFAA C[C@]1(C2CCN(Cc3ccc(CN4CCCCC4)s3)CC2)NC(=O)NC1=O 23191582 DNSLEKPDKWDQJE-HXUWFJFHSA-N 390.553 2.544 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1ccn(C(C)C)n1)CC2 262799882 OBSQJQSGLPSOSS-MRXNPFEDSA-N 387.436 2.696 0 50 GFAA C[C@H](NC(=O)c1cc(O)nc2c1CCCC2)C(=O)N1c2ccccc2C[C@H]1C 821863327 KXUCMTDSEKLPST-KGLIPLIRSA-N 379.460 2.762 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2F)CN(C(=O)[C@H]2C[C@]23CCNC3)C1 952892727 BWYOFYWDILBMGR-ZHRRBRCNSA-N 382.483 2.922 0 50 GFAA Cc1nn(-c2ccccc2F)c(C)c1[C@H]1COCCN1C(=O)c1n[nH]c(C)c1O 952887018 HBLJUSHBMOQNHA-MRXNPFEDSA-N 399.426 2.579 0 50 GFAA Cc1nc([C@@H](C)OC(=O)[C@H]2CC(=O)Nc3ccc(Br)cc32)no1 1875260199 QUUIJMZFEPNCKE-HQJQHLMTSA-N 380.198 2.871 0 50 GFAA Cc1c(C(=O)NS(=O)(=O)C[C@H]2CCCCC2(F)F)sc2cncn12 1875303986 VRLXFVTWZHMQOU-SNVBAGLBSA-N 377.438 2.589 0 50 GFAA CC(C)[C@H](C(=O)N[C@H](C)C1CCN(C(=O)c2cc3cnccc3[nH]2)CC1)N(C)C 1875332430 RPCGUHJSKCVRPD-FOIQADDNSA-N 399.539 2.506 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2CCc3nc(C(F)(F)F)ncc3C2)c1 1875371389 YUUCFABDGKFGIT-UHFFFAOYSA-N 376.338 2.818 0 50 GFAA C[C@H]1CN(C(=O)c2cccc3c[nH]nc23)C[C@@H]1NC(=O)c1coc(C2CCC2)n1 1875333905 PIMBGNUBQWUJQV-LRDDRELGSA-N 393.447 2.709 0 50 GFAA O=C(CSc1nnnn1-c1ccc(F)c(Cl)c1)NCCc1ccccc1 1089953 PSUWBJMQRHTNOV-UHFFFAOYSA-N 391.859 2.906 0 50 GFAA O=C(N[C@H]1[C@H]2CC[C@@H]1N(C(=O)CCCCCF)C2)c1ccn(-c2cccnc2)n1 2325871956 BCXMLRIJURYDNR-QSFXBCCZSA-N 399.470 2.516 0 50 GFAA CCc1ncc(CN(CC(=O)O)Cc2cnn(-c3ccc(OC)cc3)c2)s1 2325877016 HMVQJGZHDLDUPW-UHFFFAOYSA-N 386.477 2.987 0 50 GFAA CC(=O)Nc1ncc(S(=O)(=O)Nc2[nH]nc(-c3ccccc3)c2C)s1 225399781 CSBOOTRQONTPDE-UHFFFAOYSA-N 377.451 2.601 0 50 GFAA COCC(=O)N1CCC[C@H]1c1ccc(C(=O)N(C)CCc2ccccn2)s1 23214903 ULTVFXGJWCRSQU-INIZCTEOSA-N 387.505 2.768 0 50 GFAA NC(=O)[C@@H]1CCCN1Cc1cccc(-c2nc(-c3ccc(F)cc3)cc(=O)[nH]2)c1 20683345 HUGNHWGQKJJMJF-IBGZPJMESA-N 392.434 2.693 0 50 GFAA NC(=O)c1cccnc1N1CC[C@@]2(CCCN(CCC3CCCCC3)C2=O)C1 20363798 RYXJRLPYYDBWQS-QFIPXVFZSA-N 384.524 2.970 0 50 GFAA CC(C)C[C@H](CCC(=O)N1C[C@H](C)O[C@H](C)C1)C(=O)N1C[C@@H](C)O[C@H](C)C1 246385773 AMVBREKNZILUQJ-ZRSRNVLSSA-N 382.545 2.701 0 50 GFAA COC(=O)[C@@H](NC1CCN(c2nc(C)c3cc(OC)ccc3n2)CC1)C(C)C 55037146 MQMPAOISMCHUNC-IBGZPJMESA-N 386.496 2.703 0 50 GFAA Cc1nc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc(-n2cccn2)n1 23144295 OBSWTIUOJPSJNE-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3c2c(-c2ccccn2)nn3C)cc2c1OCO2 65534920 RDZWRPDCLZRNAH-GFCCVEGCSA-N 378.388 2.694 0 50 GFAA Cc1nc([C@H](C)NC(=O)c2coc(COc3cccc4cccnc34)n2)n[nH]1 67649008 BBOPHKHDOBDGRI-NSHDSACASA-N 378.392 2.719 0 50 GFAA C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](CNS(C)(=O)=O)C1 229646407 WSFUKHIVBRCTJR-STQMWFEESA-N 380.432 2.907 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC3(CCNCC3)CC2)c1)c1cccnc1 252487628 HYKNBHUIOWLRFZ-UHFFFAOYSA-N 378.476 2.940 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3ccc4c(c3)CCO4)CC2)C1 12442037 MFHNCPNXDCVDAP-IBGZPJMESA-N 383.536 2.577 0 50 GFAA O=C(CCc1ccccc1)N1CCC(C(=O)N2CCC[C@@H]2CN2CCCC2)CC1 363136760 NFDAQLYBFXKINO-JOCHJYFZSA-N 397.563 2.945 0 50 GFAA CSc1ccc(-c2ccc(=O)n(CC(=O)N=c3[nH]c4ccccc4[nH]3)n2)cc1 71282912 UIZUPDCZASPQHL-UHFFFAOYSA-N 391.456 2.569 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@@H]2CNCCC[C@@H]21 366454525 STFLGQFSNQUTJQ-DYVFJYSZSA-N 393.413 2.890 0 50 GFAA O=C(c1cc(OCc2ccccc2)ccc1O)N1CCN(c2cnccn2)CC1 130393629 BWWSURAYHDOWOU-UHFFFAOYSA-N 390.443 2.724 0 50 GFAA CC(C)[C@H](CO)Nc1ccc(C(=O)N2CCC(Oc3cccnc3)CC2)cn1 71745205 KIKOMIIGAOCEGF-IBGZPJMESA-N 384.480 2.589 0 50 GFAA O=C1[C@@H]2[C@@H](CCCN2c2nnc(C(F)(F)F)s2)C(=O)N1Cc1ccccc1 373899242 JJBXUPFYFRIRDP-NEPJUHHUSA-N 396.394 2.711 0 50 GFAA Cc1c(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cnn1C1CCOCC1 159073013 JQILVAQBMZKJMM-HXUWFJFHSA-N 396.491 2.637 0 50 GFAA NC(=O)c1cc(CNC(=O)N2CCC(F)(Cc3ccc(Cl)cc3)CC2)on1 454718429 ZFXMSHMQBWNWMJ-UHFFFAOYSA-N 394.834 2.683 0 50 GFAA O=C(c1cccc2[nH]ccc12)N1CCCN(S(=O)(=O)c2ccccc2)CC1 176105847 DVXRYNBDQKHIAM-UHFFFAOYSA-N 383.473 2.705 0 50 GFAA O=C(COc1ccc(F)cc1F)NCCc1csc(-c2ncccn2)n1 91974363 PELMNJWPQOTYQR-UHFFFAOYSA-N 376.388 2.616 0 50 GFAA C[C@@H]1CCC(=O)N1c1cccc(NC(=O)N2CCN(C3CCCC3)C(=O)C2)c1 96153556 YFLCUQKFDRNPOB-OAHLLOKOSA-N 384.480 2.821 0 50 GFAA COc1ccc(C)cc1[C@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95386068 VQNFINQGHIGZKY-GOSISDBHSA-N 375.494 2.712 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2cn(C)nc2C(F)(F)F)[C@H](c2ccccc2)CO1 293629810 WSVVQRJHNPLPOT-YPMHNXCESA-N 389.399 2.590 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2Cc2cccc(F)c2)cc1-n1cnnn1 180731025 ZDDAMRWYFSHNNN-KRWDZBQOSA-N 381.411 2.657 0 50 GFAA Cc1cc(NC(=O)CN2CCC[C@@H](c3nncn3C3CC3)C2)n(C(C)(C)C)n1 180878117 JDKQWLBJPIXNDE-OAHLLOKOSA-N 385.516 2.691 0 50 GFAA O=C1CCCCCCN1CC(=O)N1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1 181331968 IRAVWCMAZCEAEF-GOSISDBHSA-N 395.507 2.970 0 50 GFAA CCc1ccccc1OC1CN(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)C1 534576720 UERNIRIFKMAORY-UHFFFAOYSA-N 381.432 2.899 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CC[C@H]2OCc3cnnn3[C@H]2C1 299772582 CLZQNAVSUOBDBS-RBUKOAKNSA-N 375.432 2.635 0 50 GFAA O=C(NCCCSCc1ccccc1Cl)N1CCN2C(=O)OC[C@H]2C1 584894819 RWPUVOOXVBRWKY-CQSZACIVSA-N 383.901 2.809 0 50 GFAA O=C(NCCc1nnc2n1CCCC2)c1ccccc1NCc1cccnc1 166351734 WGCIKCKRLGEVHO-UHFFFAOYSA-N 376.464 2.594 0 50 GFAA CC(=O)NC[C@H]1CCn2ncc(C(=O)Nc3cccc(C(F)(F)F)c3)c2C1 276747338 BUTMUEDOMUNWAY-LBPRGKRZSA-N 380.370 2.853 0 50 GFAA COc1cc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2C)ccc1Cl 170616168 LBJCANCZYQDTEI-UHFFFAOYSA-N 383.853 2.675 0 50 GFAA O=C1NCCN1c1ccc(CN[C@H]2CCCc3c2cnn3-c2ccccn2)cc1 11661016 KRHDRQVHVSLDIN-IBGZPJMESA-N 388.475 2.964 0 50 GFAA O=C(NCC1CC1)[C@@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 12074627 QBAOFJWMNSSMJS-OAQYLSRUSA-N 381.564 2.856 0 50 GFAA CC(C)C(=O)NCCc1nnc2n1CCN(Cc1ccc3ccccc3c1)CC2 12212232 AKRJWGYXHXEKCI-UHFFFAOYSA-N 391.519 2.804 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)Cn2nc(C)cc2C)C1 12472600 AAVRSFUTESHWLJ-HXUWFJFHSA-N 398.551 2.922 0 50 GFAA CN(C)c1ncc(CN2CCC[C@@H]2C(=O)Nc2cccc(-n3cccn3)c2)s1 12589307 NPTRCTOVYJMSIA-GOSISDBHSA-N 396.520 2.998 0 50 GFAA COCC(=O)N1CCC[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3)CC[C@@H]21 15004998 PMCZYBOFPFDSHD-ZBFHGGJFSA-N 384.398 2.805 0 50 GFAA COc1ccc(OC)c(CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 19211537 DYYLQBVFOFKTGU-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA CCN(C)C(=O)c1ccc([C@H]2CCCN2C(=O)CCCn2cncn2)s1 19953118 OOMXLDIEFUVYEL-CQSZACIVSA-N 375.498 2.575 0 50 GFAA Cl[Sn](c1ccccc1)(c1ccccc1)c1ccccc1 169743172 NJVOZLGKTAPUTQ-UHFFFAOYSA-M 385.482 2.892 0 50 GFAA in-vitro COc1cc(C)c(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)cc1C 2696572 JAYBIWJKXFULSP-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)[C@@H]3NC(=O)CCc2cnccn2)c(F)c1 1857689100 DPBGVOLGZDVIOR-YPGOJHLTSA-N 398.482 2.584 0 50 GFAA CCc1[nH]nc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1C 1857697468 AUCXDPJYOMCOEJ-OAQYLSRUSA-N 381.480 2.774 0 50 GFAA COc1cc(-c2nccn2CC[C@H]2CCCOC2)cc(Cl)c1OCC(N)=O 1857702069 YPKNRPIQGBDLDZ-CYBMUJFWSA-N 393.871 2.893 0 50 GFAA O=C(NCc1ccc2c(c1)CCCC2)[C@H]1CC[C@H](Nc2ncc(F)cn2)[C@@H](O)C1 1857702757 BVFQSLVTFYGDRZ-IHPCNDPISA-N 398.482 2.752 0 50 GFAA O=C(C1CCC1)N1CCC[C@@]2(CN(Cc3ccncc3Cl)CC[C@H]2O)C1 1857703763 YQYGBCPUYAKUHF-UYAOXDASSA-N 377.916 2.711 0 50 GFAA Cc1ncc(C)c(N2C[C@@H]3[C@H](CNC(=O)c4cccs4)[C@H]4CC[C@]3(C2)O4)n1 1875241307 AGESCCIALOWNQC-QCBUCWTNSA-N 384.505 2.569 0 50 GFAA COc1ccc([C@H](CC(=O)N2CCc3c(nc(C(C)C)n3C)C2)NC(C)=O)cc1 112664397 DDNPXFAXSXCITL-SFHVURJKSA-N 398.507 2.704 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC1)c1ccc(Cl)cc1 120250315 GFMDGIKOIQJFSD-RBUKOAKNSA-N 385.895 2.549 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)NCc1cccnc1OCC(F)(F)F)CO2 124329264 IAEWOFWAIGQSAC-AWEZNQCLSA-N 396.365 2.899 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@H](C)[C@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237346712 ISRIKHAUGJGJAT-DYVFJYSZSA-N 385.464 2.661 0 50 GFAA CN1CC[C@H](NC(=O)c2ccccc2S(C)(=O)=O)[C@H]1c1ccc(F)c(F)c1 240551617 GUVSDUWOUDTMBS-FUHWJXTLSA-N 394.443 2.544 0 50 GFAA CC(C)c1nc(C2CCN(C(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)CC2)no1 253418357 ONEULVORUYGOAM-CQSZACIVSA-N 395.467 2.814 0 50 GFAA CC(C)Cn1nnc2c1C[C@@H](c1nc(-c3ccc4nc(O)[nH]c4c3)no1)CC2 952893867 LCPORPRDVDSIOV-LBPRGKRZSA-N 379.424 2.839 0 50 GFAA COc1ccc(-c2cc(NC(=O)c3cc(S(C)(=O)=O)c(C)o3)ncn2)cc1 1875356136 HBQGLQNOBYQJQL-UHFFFAOYSA-N 387.417 2.709 0 50 GFAA O=C(N1CC[C@H](OC(F)F)C1)[C@]1(O)CCc2cc(Br)ccc2C1 888100346 BTFYPDVYBOKFCG-BBRMVZONSA-N 390.224 2.509 0 50 GFAA C[C@H]1CCn2ncc(C(=O)N3CC[C@@H](Nc4cnc5ccccc5n4)C3)c2C1 1775988364 GZNDVMNBBRLLSL-LSDHHAIUSA-N 376.464 2.735 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3cccc4c3CCC4=O)C1)CC2 2356158706 WBTQUZVYYPXKTE-HSZRJFAPSA-N 390.487 2.792 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C(=O)NCCN(C)C)C23CC4CC(CC(C4)C2)C3)cc1 4428163 GKWCPILEDIIPBG-IOFSEFHDSA-N 397.563 2.988 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2C(=O)NCCN2C(=S)Nc2ccccc2)c1 8682847 GMDZMIXGHXJMPN-QGZVFWFLSA-N 382.489 2.521 0 50 GFAA CCCO[C@@H]1CCCN(C(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)CC1 225401778 XCUMXPKSPFGGJX-GOSISDBHSA-N 397.560 2.737 0 50 GFAA O=C(CNS(=O)(=O)Cc1ccccc1C(F)(F)F)N1CCc2ccccc21 113286748 VSVDVQOXIRLZIR-UHFFFAOYSA-N 398.406 2.714 0 50 GFAA CCNC(=O)[C@H](C)N1C(=O)C2(CCN(CCC(C)C)CC2)Nc2ccccc21 55153211 ZMWJOAAEKQAKNK-KRWDZBQOSA-N 386.540 2.850 0 50 GFAA c1cc2c(cc1-c1n[nH]cc1CN1CCCC[C@@H]1CCN1CCOCC1)OCO2 20997241 COSVCNGTYPYPIP-LJQANCHMSA-N 398.507 2.882 0 50 GFAA Brc1ccc2[nH]c3nc(SCCN4CCOCC4)nnc3c2c1 20324880 IGKCHCRBHSDDCQ-UHFFFAOYSA-N 394.298 2.693 0 50 GFAA CC[C@@H](C)C(=O)C(=O)NC[C@H]1Cc2c(F)ccc(-c3nc(C)cnc3C)c2O1 20449130 NUICAKHNYJKLNM-BXUZGUMPSA-N 385.439 2.934 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)Nc3cncnc3N3CCCC3)c2C)cc1 252499131 RVVNUOJCHJVCCR-UHFFFAOYSA-N 391.479 2.840 0 50 GFAA Cc1cc(NC(=O)Nc2cccc(-n3ccnn3)c2)cc(N2CCN(C)CC2)c1 252478190 AFHVMWWKLHEYFK-UHFFFAOYSA-N 391.479 2.972 0 50 GFAA Cn1cc(CCCN[C@@H]2CCOC[C@@H]2[C@H]2CCCN2C(=O)OC(C)(C)C)cn1 252510775 BHLNBJBFWSGADB-IPMKNSEASA-N 392.544 2.747 0 50 GFAA O=C(NCC1CCN(Cc2cccs2)CC1)c1ccc(-n2ccnc2)nc1 145731541 PNIFSNHGHHPGBS-UHFFFAOYSA-N 381.505 2.971 0 50 GFAA O=C(O)[C@H]1C[C@@H](C(=O)NCc2ccccn2)CN(Cc2cc3ccccc3o2)C1 72145102 QODDHNGYCIZNGS-SJORKVTESA-N 393.443 2.667 0 50 GFAA Cc1cc(F)cc(S(=O)(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)c1 328617241 CNWXLGQVIFDBPE-LLVKDONJSA-N 391.390 2.890 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)c2cc(COc3cccc(C(F)(F)F)c3)[nH]n2)C1 11936464 QGSDQIMSYGSJAG-CQSZACIVSA-N 382.386 2.784 0 50 GFAA Cn1cnc(CCN2Cc3c(C(=O)NCC4=CCCCC4)cccc3C2=O)c1 72478655 BGIWVMIUONXLDW-UHFFFAOYSA-N 378.476 2.849 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@H]2CNCCC[C@H]21 366454527 STFLGQFSNQUTJQ-SUMWQHHRSA-N 393.413 2.890 0 50 GFAA O=C(c1cccc(CNc2ccncn2)c1)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 329470416 YFBRAYZTDLFMKR-FPOVZHCZSA-N 391.519 3.178 0 50 GFAA O=C(c1cc(C(=O)N2CCNC[C@@H]2c2ccccc2Cl)c[nH]1)N1CCCC1 262046286 UOJPLOIRAXLCFJ-GOSISDBHSA-N 386.883 2.691 0 50 GFAA COC[C@H]1CN(C(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)CCO1 172625671 KKAICRFXEJXPOO-HXUWFJFHSA-N 395.459 2.709 0 50 GFAA CCOCCOCc1cccc(CNC(=O)C(=O)Nc2ccc3[nH]ccc3c2)c1 441749618 KVWDFMNHMSDLCY-UHFFFAOYSA-N 395.459 2.976 0 50 GFAA COC1(CNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)CCC1 378604418 CLAWCXWMKLQEBY-CQSZACIVSA-N 396.434 2.826 0 50 GFAA Cc1ccc(CN2CCN(c3nccc(-c4c(C)nn(C)c4C)n3)CC2=O)cc1 48087894 JSXOVKKJGDALFW-UHFFFAOYSA-N 390.491 2.651 0 50 GFAA COc1cc(OC)cc([C@@H]2CCN(C(=O)Cn3c(=O)oc4ccccc43)C2)c1 175407405 JHEUPCNLWMMGTD-CQSZACIVSA-N 382.416 2.628 0 50 GFAA Cn1c(CNC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)nc2ccccc21 426734269 JGVRJOBUHCMJAL-KRWDZBQOSA-N 379.464 2.859 0 50 GFAA CCOCCN1CCN(C(=O)c2ccc3nc(-c4ccccc4)cn3c2)CC1 82092154 FKVJIEFBWJUBRL-UHFFFAOYSA-N 378.476 2.796 0 50 GFAA Cc1ccc2nc(COCC(=O)NCc3cccc(-n4cccn4)c3)[nH]c2c1 97756386 ZKXXVKIZSHHSMJ-UHFFFAOYSA-N 375.432 2.890 0 50 GFAA Cc1nc2n(n1)C[C@H](NC(=O)N1CCC(c3noc4cc(F)ccc34)CC1)CC2 291417743 YIYDTTKXUMYTGY-OAHLLOKOSA-N 398.442 2.771 0 50 GFAA COCCn1cnnc1[C@@H](C)NC(=O)Nc1cc2c(C)cc(=O)oc2cc1C 96166249 QSMFDQMWKUBZKF-CYBMUJFWSA-N 385.424 2.530 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(F)c2)C1)C(=O)c1ccc(=O)n(C)c1 95498454 IEHUZKGKNWWGRW-IBGZPJMESA-N 399.510 2.941 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)Nc1ccc(F)c(F)c1)CCN2C 95359716 QKDKYWYVOUONGH-LJQANCHMSA-N 380.439 2.515 0 50 GFAA CCCNC(=O)c1cccc(C(=O)NCC2CCN(c3ccncc3)CC2)c1 180548605 HZPRWAPUQROSBT-UHFFFAOYSA-N 380.492 2.868 0 50 GFAA NC(=O)c1ccc(CNC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1 298693012 SWOZVKPRASDZIR-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA COc1ccccc1OC1CN(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 534673866 HLWHRMWDXBMYFE-KRWDZBQOSA-N 381.476 2.994 0 50 GFAA Cc1cc(C)n([C@H]2CCN(C(=O)NCCc3noc(-c4ccccc4)n3)C2)n1 670437280 WHHKWWOFCRYLBF-KRWDZBQOSA-N 380.452 2.749 0 50 GFAA O=S(=O)(c1cnc(-c2ccccc2)s1)N1CCC([C@@H]2CCNC2)CC1 923641411 TXXUBLWFZGLGAN-MRXNPFEDSA-N 377.535 2.820 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccn2)CN1Cc1ccc2ccccc2c1 55167504 ONKQNSZWMGXGHA-FPOVZHCZSA-N 389.455 2.781 0 50 GFAA CNC(=O)c1ccc(CNC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 170620670 OMTYWNAFJXWNQR-GOSISDBHSA-N 389.402 2.608 0 50 GFAA O=C(NC[C@@H](O)c1c(F)cccc1Cl)[C@H]1CCN(c2ccc(F)cc2)C1=O 741290847 JZAHLDCCQSJFJJ-CZUORRHYSA-N 394.805 2.821 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H](C(=O)c3ccccn3)C2)c2c(C)nn(C)c2n1 1506396774 VTVCCPAOWVOCQI-OAHLLOKOSA-N 377.448 2.715 0 50 GFAA CCOC(=O)c1[nH]ncc1CN1CCC[C@H](C(=O)c2ccc(OC)cc2C)C1 11663823 MIJKGAMPNGSFDQ-HNNXBMFYSA-N 385.464 2.998 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2)NCc1nnc2n1CCC2 11998665 OZPNLQXHWKPZNL-KRWDZBQOSA-N 390.443 2.791 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@@H](NC(=O)CN2CCCC2=O)C1 12021058 NIUDXRUONYUMEC-KRWDZBQOSA-N 384.455 2.764 0 50 GFAA CCN(CC)CCC(=O)NC[C@@H]1Cc2cc(-c3cnccn3)cc(Cl)c2O1 12055321 PNKOPBGSULRKRQ-INIZCTEOSA-N 388.899 2.949 0 50 GFAA Cc1cccc(-c2nc(CN3CCC(N4CCNC(=O)CC4)CC3)c(C)o2)c1 12714327 FTSBIQZUOXICLQ-UHFFFAOYSA-N 382.508 2.745 0 50 GFAA Cn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCC1CCCCC1)C2 14732298 CKKSZHNZCCRVRN-INIZCTEOSA-N 376.570 2.636 0 50 GFAA O=C(CS(=O)(=O)Cc1ccccc1)N1CCN(c2cccc(Cl)c2)CC1 2734673 BXDXLLLLMNOKHI-UHFFFAOYSA-N 392.908 2.604 0 50 GFAA COc1ccc(-n2nc(C(=O)c3ccccc3)c(C(F)(F)F)cc2=O)cn1 1402541 QVNAXISCGBQIHV-UHFFFAOYSA-N 375.306 2.886 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H](C)Oc1ccc(OC)cc1 2848524 DQQFTWDXCPEIIK-LBPRGKRZSA-N 389.404 2.905 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@H]2C[C@@H]1/C(=C/OC)C(=O)OC 257402578 DAXYUDFNWXHGBE-SMCPSILYSA-N 384.476 2.700 0 50 GFAA biogenic O=C(c1cc(C(F)(F)F)ccc1F)N1CCC[C@@H](C(=O)N2CCOCC2)C1 366174902 RJHOPHXICIRKIE-GFCCVEGCSA-N 388.361 2.556 0 50 GFAA COC(=O)[C@@H](CNC(=O)[C@@H](N)CC1CC(F)(F)C1)Cc1ccc(Cl)cc1 1875305070 FNCFQHKIXRVDCA-HIFRSBDPSA-N 388.842 2.551 0 50 GFAA COCC[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2c1cc(-c2ccccn2)nc(C)n1 1775991553 KYWCRQRRURTLFE-QTLCSOKXSA-N 395.507 2.746 0 50 GFAA Cn1c(=O)c2c(-c3ccccc3Cl)n(-c3ccccc3N)cc2n(C)c1=O 1056937 YPCNIASFKZUDDF-UHFFFAOYSA-N 380.835 2.931 0 50 GFAA COc1cc(-c2cc(=NC(=O)c3cccc4c3COC4)[nH][nH]2)cc(OC)c1OC 2100545445 VLNRRMJVTNVXNU-UHFFFAOYSA-N 395.415 2.807 0 50 GFAA C[C@]1(NC(=O)c2ncn3cc(Cl)ccc23)CCN(C(=O)[C@@]23CCC[C@@H]2C3)C1 2325794735 OYYPHPABYGMCOC-CAYVGHNUSA-N 386.883 2.899 0 50 GFAA O=C(Nc1ccc2c(c1)CNCCC2)c1nc2c(Br)cccn2n1 2325857936 VHTTYWQKLBBVIC-UHFFFAOYSA-N 386.253 2.780 0 50 GFAA NCc1nnc(CCC(=O)Nc2c[nH]c3cc(Br)ccc23)s1 2325858872 DVHKDXHPBZRCAX-UHFFFAOYSA-N 380.271 2.812 0 50 GFAA Cn1c(CN2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)nc2ccccc21 2356152420 ILNOQWULXBESRG-BSRJHKFKSA-N 396.535 2.834 0 50 GFAA COC(=O)Cc1c(C)c2ccc(OCC(=O)NC3CCCCC3)cc2oc1=O 2843068 SARBSRYSRUEVDG-UHFFFAOYSA-N 387.432 2.645 0 50 GFAA CN(C)CCOC(=O)CC12CC3CC(C1)CC(CC(=O)OCCN(C)C)(C3)C2 4031868 ZTJPLOSZPXAFPI-UHFFFAOYSA-N 394.556 2.563 0 50 GFAA Cn1c(SCC(=O)Nc2ccc(N3CCOCC3)cc2)nnc1-c1ccco1 4414898 WQUSJQWIUQBKJW-UHFFFAOYSA-N 399.476 2.643 0 50 GFAA CNC(=O)/C(=C\c1ccc(OC)cc1)NC(=O)c1ccccc1Br 4755650 YERXYCIOLJLCCL-LFIBNONCSA-N 389.249 2.975 0 50 GFAA CCOc1cccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCOCC2)c1 7389845 FBZMRCCWNVZKNW-UHFFFAOYSA-N 384.432 2.961 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cc1 7960123 ZJBSHNYNDSQIGS-UHFFFAOYSA-N 396.871 2.934 0 50 GFAA Cc1ccc(CCC(=O)NCc2nc(CC(=O)NC3CCCCC3)no2)cc1 109432963 PWXRWNHRTOUMSN-UHFFFAOYSA-N 384.480 2.618 0 50 GFAA Cc1ncc(CN2CCN(C(=O)Cc3ccc(-n4cccn4)cc3)CC2)s1 110942633 SDLBRFJROGRCMR-UHFFFAOYSA-N 381.505 2.524 0 50 GFAA COc1cccc(-c2ccc(N3CCC(N4CCO[C@H](CN)C4)CC3)cc2)c1 20514019 MTZVIVOGKZDZON-HSZRJFAPSA-N 381.520 2.991 0 50 GFAA CCOc1cc(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)ccc1O 20450039 YNCBXANLVPLPJT-KRWDZBQOSA-N 376.522 2.921 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 67620668 PRKDUXWZEJPCSB-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA CS(=O)(=O)c1ccc(-c2c(-c3ccccc3)ncn2Cc2ncn[nH]2)cc1 67787537 FXEFQBVRLRCREJ-UHFFFAOYSA-N 379.445 2.787 0 50 GFAA Cc1sc(NC(=O)[C@@H](C)n2ncc(Br)c2C)c(C(N)=O)c1C 2780777 FVAWRMJMNYCYAM-MRVPVSSYSA-N 385.287 2.931 0 50 GFAA CC(C)CN(C)Cc1ccc(C(=O)NCc2cnc3ccccc3c2)c(=O)[nH]1 77344009 VJQZEBILUPXMSH-UHFFFAOYSA-N 378.476 2.941 0 50 GFAA Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1CCC(c2cnn(C)c2)CC1 123097770 WDBMCYQWFKATNO-UHFFFAOYSA-N 384.871 2.982 0 50 GFAA O=S(=O)(Cc1ccccc1F)N[C@@H]1COCC[C@@H]1OCc1ccccc1 218998857 LEFZMESLMIQNPQ-MOPGFXCFSA-N 379.453 2.619 0 50 GFAA O=C(N[C@@H]1CCCN(CCc2ccccc2)C1)c1ccccc1-c1nc[nH]n1 72420329 PBSUNHYQXFHRTG-GOSISDBHSA-N 375.476 2.909 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCOC[C@@H]1c1nc(-c2ccccc2)no1 374319839 CGGKRODFUFOQFU-OAHLLOKOSA-N 379.372 2.679 0 50 GFAA CN(CCc1ccccc1)CCN1CC2(CCN(C(=O)C3(C)CC3)CC2)OC1=O 77343938 JKMCLPDXFSWKOT-UHFFFAOYSA-N 399.535 2.774 0 50 GFAA CC(C)CN1C(=O)N(C)C2(CCN(Cc3cccc4nccnc34)CC2)C1=O 14755869 IWPCABGLKCWQKE-UHFFFAOYSA-N 381.480 2.514 0 50 GFAA CCOc1ccccc1N1CCN(CC(=O)Nc2ccc3nsnc3c2)CC1 13324568 PNJVMNKHNLTNFD-UHFFFAOYSA-N 397.504 2.851 0 50 GFAA O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 332872173 MLBBTUGSDRRARU-LXZJYRNTSA-N 378.444 2.683 0 50 GFAA C[C@@H]1C[C@@H]1c1nnc2ccc(N3CCC(NC(=O)NC4CCCCC4)CC3)nn12 333620530 YIHNCMIIWIYUTM-PBHICJAKSA-N 397.527 2.848 0 50 GFAA COc1ccccc1C(=O)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71747998 KWQUUFRWOIWKAR-SFHVURJKSA-N 399.535 2.634 0 50 GFAA C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 241869076 SUFNZSBFNQAHBB-QWHCGFSZSA-N 388.434 2.690 0 50 GFAA COc1ccc2nc(-c3ccc(C)o3)cc(C(=O)NCCN3CCOCC3)c2c1 17080847 PKQCLGZPRGGRLI-UHFFFAOYSA-N 395.459 2.874 0 50 GFAA O=S(=O)(N[C@@H]1CCCCN(CC2CC2)C1)c1ccc(-c2ccon2)s1 82134303 DIXPDFTVGSWEAM-CQSZACIVSA-N 381.523 2.946 0 50 GFAA CCC[C@@H]1CN(C(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@H]1NS(C)(=O)=O 82137817 DQPBCTMHDKCHJM-CRAIPNDOSA-N 377.510 2.575 0 50 GFAA O=C(c1cn2cc(Cl)ccc2n1)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95386317 IKQFVVFAOOXPTB-WMLDXEAASA-N 388.899 2.703 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(C(=O)NCCC[C@H]2CCOC2)CC1 426538074 JKNSJPYIQCIQJZ-IBGZPJMESA-N 387.524 2.883 0 50 GFAA CS(=O)(=O)C1(c2nc(-c3cccc(Br)c3)no2)CCOCC1 291940234 PUBXGKLZOSYKOW-UHFFFAOYSA-N 387.255 2.549 0 50 GFAA Cc1nn(CC(=O)N[C@H](c2cccnc2)C(F)(F)F)c(=O)c2ccccc12 91494549 ZACAFHIHUSTLPO-MRXNPFEDSA-N 376.338 2.520 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)c3cnc(C)nc3)CC2)cc1 95527905 NDSJFPNWGLTNRI-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA CN(CC(=O)N1CCC2(CCC(=O)N(C)CC2)CC1)Cc1ccccc1F 244873559 WSDDKNMDPKFKQE-UHFFFAOYSA-N 375.488 2.509 0 50 GFAA CS(=O)(=O)c1ccc(C2(C(=O)NCC3CCOCC3)CCCCC2)cc1 244873149 WKUQVPWYPUYNAK-UHFFFAOYSA-N 379.522 2.835 0 50 GFAA O=C(NC[C@@]1(O)CCCNC1)c1ccc(-c2ccc(OC(F)F)cc2)cc1 534674490 BNXOXZTTXFJFOY-HXUWFJFHSA-N 376.403 2.799 0 50 GFAA COc1ccc(-c2nn3ccn(Cc4ccccc4OC)c(=O)c3c2CO)cc1 263615164 AYHZYGVAGSRLFQ-UHFFFAOYSA-N 391.427 2.721 0 50 GFAA CCNC(=O)N1CCC(NC(=O)c2ccc(-c3cnn(C)c3CC)cc2)CC1 584887483 VQCIGRQTRUYDMR-UHFFFAOYSA-N 383.496 2.573 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 1565511241 XHCVMMGUXQOGFP-MSOLQXFVSA-N 381.428 2.731 0 50 GFAA C[C@@H]1CN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)CCN1CC(C)(C)O 188648234 GBVSRQLQESIOMA-GFCCVEGCSA-N 399.413 2.984 0 50 GFAA COC[C@H](NS(=O)(=O)c1ccc(-c2onc(C)c2C)o1)c1ccccn1 1506403857 WMABSGATUNRACR-AWEZNQCLSA-N 377.422 2.612 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)CN1C[C@@H](c2ccccc2)CC1=O 1506417715 BHSSTJJMJWVXRW-HNNXBMFYSA-N 380.423 2.677 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1F 1704313283 IDSKUKJYQNVOAP-ZDUSSCGKSA-N 391.443 2.788 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccc(Br)cc2)C(N)=O)cc1 1172028 NXEXMKWHDQSRFP-XNTDXEJSSA-N 375.222 2.714 0 50 GFAA COc1cc(-c2onc(N3CC(N4CCCCC4)C3)c2C(=O)O)ccc1F 1772704360 IHPVODFHDNSDCW-UHFFFAOYSA-N 375.400 2.862 0 50 GFAA Cc1nc2c(c(=O)n1C)CCN(C(=O)c1c(Cl)ccc3ncccc13)CC2 1775981091 OBLVKUJRSPBUHT-UHFFFAOYSA-N 382.851 2.531 0 50 GFAA CCCN1CCC[C@H](c2nc(COc3cccc(OC)c3)nn2CCO)CC1 1772813774 SPWUIHKFBKNPTD-KRWDZBQOSA-N 388.512 2.838 0 50 GFAA Cc1ccc(CC(=O)N2CCCN(Cc3cccc(OCCO)c3)CC2)cc1 1775983655 QFAATCKSRKUYCL-UHFFFAOYSA-N 382.504 2.643 0 50 GFAA COC(=O)[C@@H](NC(=O)CCc1nnc(Cc2cccc(C)c2)o1)c1ccccc1 11718703 CBQLDZZSNSZESF-NRFANRHFSA-N 393.443 2.932 0 50 GFAA CCOC(=O)N1CCC(NC(=O)c2cc(Cc3ccc(F)cc3)no2)CC1 11963329 TXUASHOTXHTCPZ-UHFFFAOYSA-N 375.400 2.755 0 50 GFAA O=C(NCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)c3ccoc3)CC2)C1 15064351 PAJGSJYDUUGDKQ-IBGZPJMESA-N 395.503 2.913 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@@H](C)n3cnc4ccccc4c3=O)CC2)c1C 16021167 XDFXWOULOCGEKZ-GOSISDBHSA-N 390.487 2.923 0 50 GFAA CN(C)C(=O)[C@@H]1C[C@@H](Sc2nccn2C)CN1Cc1c(F)cccc1F 19229309 WBNYHFMPAGSGGT-WBMJQRKESA-N 380.464 2.522 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCc4ccccn4)CC3=O)sc2c1 1857667246 GLTDRVWZJYBJLJ-AWEZNQCLSA-N 380.473 2.712 0 50 GFAA CC(=O)N1CCC(N2CCC[C@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)CC1 1857709142 HQNWWLDPSPOECQ-QFIPXVFZSA-N 386.540 2.770 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)C2CCN(c3nc4ccc(Cl)cc4o3)CC2)C1 1857718987 CESPYABPZPNETI-OAHLLOKOSA-N 376.888 2.860 0 50 GFAA O=C(CC1CCCC1)N1CCC2(CC1)CN(C[C@@H]1CCCOC1)C(=O)CCO2 1857724744 BBMKWFLGIBRGCK-IBGZPJMESA-N 392.540 2.603 0 50 GFAA Cc1ccccc1[C@@H](CN1CCn2nc(C(=O)O)cc2C1=O)N1CCC(C)CC1 1875250521 IGTLGHIMZYIYRU-HXUWFJFHSA-N 396.491 2.819 0 50 GFAA CN(C(=O)c1cccnc1-n1cccn1)[C@H]1CCCN(c2ccccc2)C1=O 115501787 HDRAPAFZZAJMOM-SFHVURJKSA-N 375.432 2.535 0 50 GFAA O=C(NCc1ccnc(N2CCCCC2)c1)c1cccc(N2CCOC2=O)c1 126733638 FJNSFLYQPFWGFF-UHFFFAOYSA-N 380.448 2.959 0 50 GFAA O=C(O)[C@H]1CCCN1C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 238089788 WIPJXFYFGXUTSK-CYBMUJFWSA-N 386.408 2.824 0 50 GFAA C[C@@H](NC(=O)c1cc(O)nc2c1CCCC2)C(=O)N1c2ccccc2C[C@H]1C 821863332 KXUCMTDSEKLPST-ZIAGYGMSSA-N 379.460 2.762 0 50 GFAA CCc1cccc(Cc2cnc(NC(=O)c3nnn([C@H]4CCNC4)c3C)s2)c1 823531354 BUQSCDBKIIZMRU-INIZCTEOSA-N 396.520 2.983 0 50 GFAA C=CC(=O)N(C)CC(=O)N[C@@H]1CC2(CCC2)Oc2ccc(Br)cc21 928929675 TYWNTRJJQDUAQB-CQSZACIVSA-N 393.281 2.956 0 50 GFAA CC(C)Cn1nnc2c1C[C@H](c1nc(-c3ccc4nc(O)[nH]c4c3)no1)CC2 952893866 LCPORPRDVDSIOV-GFCCVEGCSA-N 379.424 2.839 0 50 GFAA C[C@H](C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccc1Cl 1875294827 OJKMUWMPOLUUBE-JTQLQIEISA-N 398.834 2.874 0 50 GFAA c1ccc(CN2CNC3=N[C@@H](c4ccccn4)n4c(nc5ccccc54)N3C2)nc1 20101454 TXYKFICQMJMONQ-HXUWFJFHSA-N 396.458 2.570 0 50 GFAA CCC(CC)CN1C[C@H](CC(=O)NC2(c3cncn3C)CC2)OCC12CCC2 2325785375 TXDZHJMYNZFCKD-SFHVURJKSA-N 388.556 2.975 0 50 GFAA C[C@@H](CNC(=O)C(C)(C)C1CCCCC1)N(C)C(=O)C[C@H]1CCC(=O)N1C 2325794323 YRRCTKIFNUKQLI-DOTOQJQBSA-N 379.545 2.567 0 50 GFAA Cn1ncc(C(=O)N[C@@]2(C(=O)O)CCc3ccccc32)c1Cc1ccccc1 2325840680 LCXZGUBAHBJECS-QFIPXVFZSA-N 375.428 2.667 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCCc3oc(Br)cc3C2)C1 2325889151 BOTRCQABEPHDLK-LBPRGKRZSA-N 381.270 2.742 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCC(c3nccc(C(F)(F)F)n3)CC2)C1 2325889197 DZDKETBTKXYFJV-AWEZNQCLSA-N 396.413 2.626 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccc(C)c(C)c3)CC2)ccc1F 936475 TVMZREJZDPJDTP-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CCN(c4ccc(F)cc4)CC3)n2)c1 1419214 QODORGMQBDYQAY-UHFFFAOYSA-N 393.470 2.967 0 50 GFAA CCNS(=O)(=O)c1ccc(CCC(=O)Nc2cc(C)ccc2OC)cc1 4857714 JAXUPGPJBJXQQZ-UHFFFAOYSA-N 376.478 2.873 0 50 GFAA CNc1cc(-n2nc(C)cc2NC(=O)[C@H](C)Cc2ccc(OC)cc2)ncn1 410797292 NWLNLHMXQHBPMZ-CYBMUJFWSA-N 380.452 2.838 0 50 GFAA COC(=O)c1ccc(O)c(NC(=O)[C@H](c2ccccc2)N2CCSCC2)c1 225737462 OJKFHACFVBPXJE-SFHVURJKSA-N 386.473 2.907 0 50 GFAA O=C(NCCCn1ccnc1)c1ccc([C@H]2CCCN2Cc2ncc[nH]2)s1 20295251 HTUXHVDPZNNJPZ-OAHLLOKOSA-N 384.509 2.825 0 50 GFAA Cc1c(NC(=O)Cn2ncc(N3CCCC3)cc2=O)cccc1-n1cccc1 20255207 HHTSWYMLSALMTA-UHFFFAOYSA-N 377.448 2.581 0 50 GFAA CC(C)c1noc(CCNC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)n1 115825610 NTOJBKDHIDTMJZ-INIZCTEOSA-N 385.468 2.573 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccccc3C)[C@@H](CCO)C2)cc1CO 20210942 SBCZCNHVGUKAAD-QHCPKHFHSA-N 398.547 2.955 0 50 GFAA C[C@@H](CCc1ccccc1F)C(=O)Nc1cccc(CN2CCNC(=O)C2)c1 462396250 RUTQKBWKTDWUQV-INIZCTEOSA-N 383.467 2.965 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CNCCC3(O)CCCC3)C2=O)cc1 67894068 WJYFTOMSCUZPBJ-QHCPKHFHSA-N 388.552 2.948 0 50 GFAA Cc1nn(-c2ccc(N3CCCC3)nn2)c2c1[C@H](c1ccc(O)cc1)CC(=O)N2 65364349 GRZUREONOHZDMC-INIZCTEOSA-N 390.447 2.751 0 50 GFAA CC[C@H](NC(=O)c1cc(Cn2c(C)nc3ccccc32)on1)c1ccnn1C 67641797 BXWMNKFIZHBLSQ-HNNXBMFYSA-N 378.436 2.996 0 50 GFAA CCNC(=O)N1CCC(n2cc(CN3CC[C@H]3c3ccc(F)cc3)nn2)CC1 23430743 JFJBXOVZDMITEI-IBGZPJMESA-N 386.475 2.731 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3cc(F)ccc3F)CC2)C1 67431965 GSUXRDCSXIBGLQ-HNNXBMFYSA-N 377.479 2.920 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@@H](O)c2c(F)cccc2F)n1C 328640325 QANJVHUMNOBBDM-FUHWJXTLSA-N 377.435 2.924 0 50 GFAA CC(C)(C)c1ccc(CN2CCN(Cc3cc4n(n3)CCCNC4)CC2)cc1 72153072 GXKQKAKCDZZVQF-UHFFFAOYSA-N 381.568 2.992 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)Nc1nocc1C)CC2 328655832 YUCBZBHGKWOAON-MRXNPFEDSA-N 388.493 3.480 0 50 GFAA O=C(c1cccc(Oc2ccccc2)c1)N1CCN(C(=O)[C@H]2CCCO2)CC1 6730812 VFXKJRSAYVWXFP-HXUWFJFHSA-N 380.444 2.942 0 50 GFAA C[C@H]1C(=O)[C@@H](C(=O)Nc2nc3ccccc3s2)C(=O)N1Cc1ccccc1 122036097 VTCDJGWJYSNJOQ-LRDDRELGSA-N 379.441 2.851 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCN([C@H]3CCc4ccccc4C3)CC2)n(C)n1 72408519 JLKWDFDWZRPUBQ-NRFANRHFSA-N 380.536 2.934 0 50 GFAA Cc1ccc([C@@H](C)NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)cc1F 374496907 QETBSVPMPZITQC-OAHLLOKOSA-N 397.516 2.795 0 50 GFAA O=C(NCc1ccoc1)[C@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71738807 WTWNMHOPYUPIFA-FQEVSTJZSA-N 382.508 2.667 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)Nc1ccc(-n2cccn2)nc1 171511316 SMXRYOZAWLJSES-IBGZPJMESA-N 390.491 2.953 0 50 GFAA CCc1nc(C)sc1C(=O)N1CCc2nnc(Cc3ccccc3)n2CC1 216266900 DMFYRDWKUJFTLW-UHFFFAOYSA-N 381.505 2.895 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1ccc(C(=O)O)cc1)CC2 237834076 CLVCYHAEPNRUMT-ZDUSSCGKSA-N 393.365 2.923 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H]1CCN(C(C)C)C1=O 172118111 DJZVXEWICDVCJO-OAHLLOKOSA-N 391.468 2.909 0 50 GFAA COc1cc(OCc2ccccc2)ccc1CN1CCOC[C@H]1CC(=O)N(C)C 72477490 LLGNEQGMHLQMLR-HXUWFJFHSA-N 398.503 2.953 0 50 GFAA CSc1ccsc1C(=O)N1CCCC[C@H]1COC(=O)N1CCOCC1 377415781 ZVZDWXQIHMJFGX-ZDUSSCGKSA-N 384.523 2.934 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCC[C@H](c2ccncn2)C1 426494306 NTNYMKDFCSDWGK-INIZCTEOSA-N 378.436 2.651 0 50 GFAA CNC(=O)[C@H](NC(=O)NC1CCN(c2cccc(C)c2)CC1)c1ccccc1 426509296 FRHFJJPTWKPXCD-HXUWFJFHSA-N 380.492 2.750 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC[C@@H](c3ccc(C(=O)O)cc3)C2)cn1 95380552 SSAJFCZOZZIDTO-MRXNPFEDSA-N 377.466 2.560 0 50 GFAA CCc1cnc(C)nc1-c1cccc(C(=O)NCCCn2ccccc2=O)c1 426423806 WPHCYWYVAHOSPX-UHFFFAOYSA-N 376.460 2.996 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC2(CCC(=O)N(CCCO)C2)CC1 91619939 JUGVNTBQRCZQKQ-UHFFFAOYSA-N 378.900 2.876 0 50 GFAA CSCCN1CCN(C(=O)Nc2cccc(C(=O)NCC(C)C)c2)CC1 97527167 KSLACQGUENGEPI-UHFFFAOYSA-N 378.542 2.585 0 50 GFAA O=C(Nc1nnc2n1CCCC2)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 162561942 YECCSSPZNIVVKM-GFCCVEGCSA-N 394.401 2.883 0 50 GFAA CCOC(=O)[C@@H]1CCCN(CC2=CC(C)(C)N3C(=O)C(=O)c4c(C)ccc2c43)C1 334160858 NQIFOPXGLVIVLQ-OAHLLOKOSA-N 396.487 2.975 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)COc3ccc4c(c3)OCO4)C2)c1 95361316 ZRTYFEVPIWKNRF-INIZCTEOSA-N 383.400 2.899 0 50 GFAA CN(C)CC(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@H]1CCCO1 95530412 OEZOCFBMROSXTG-HXUWFJFHSA-N 391.531 2.607 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@@H]1CCCN(c2ncccn2)C1)c1nnc2ccccn12 252478262 AHCWPALHGZFMDU-IAGOWNOFSA-N 393.495 2.639 0 50 GFAA Cc1cc(C)cc(CNC(=O)c2cn3c(n2)CCN(c2nnc(C)s2)CC3)c1 1940195399 AMVSVLDROTUXFE-UHFFFAOYSA-N 396.520 2.653 0 50 GFAA COc1ccc(CN2CCn3nc(CNC(=O)C4CCCC4)cc3C2)cc1F 299790438 AYMJPSRXCYBTPL-UHFFFAOYSA-N 386.471 2.853 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1CCC2(CC1)CN(C[C@H]1CCOC1)CCO2 828171146 LKWHSKLNWOCJGE-QGZVFWFLSA-N 383.492 2.511 0 50 GFAA Cc1cccc(-c2nnc([C@@H]3CC(=O)N(c4ccc5c(c4)OCCO5)C3)o2)n1 1326363364 QMRUTOUTNOALFU-CYBMUJFWSA-N 378.388 2.732 0 50 GFAA CCn1nc(CC(C)C)cc1C(=O)Nc1ccccc1N1C(=O)N[C@@H](C)C1=O 952970727 CUJFRMCPZVYOME-ZDUSSCGKSA-N 383.452 2.799 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2ccc3c(c2)OCCO3)cc1Cl 952988492 RMSZEJQLZXSAPP-UHFFFAOYSA-N 376.796 2.948 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ncnc3[nH]cc(Br)c23)CC1 90635889 CLUNNCWOKMEGMR-UHFFFAOYSA-N 382.262 2.778 0 50 GFAA in-vitro CCCOc1ccc(-c2nc(C(=O)N3CCOC[C@H]3C(=O)O)cs2)cc1 268963778 BCVWUTHGPNYMQF-HNNXBMFYSA-N 376.434 2.525 0 50 GFAA CN(Cc1ccc(Br)o1)S(=O)(=O)c1ccc(C(=O)O)cc1F 170011970 CTZKNZGPXJZKIE-UHFFFAOYSA-N 392.202 2.700 0 50 GFAA COc1ccc(NC(=O)N2CCOC[C@@H]2C)c(I)c1 278259083 YZZNCQYYFRZOEV-VIFPVBQESA-N 376.194 2.552 0 50 GFAA CC[C@H]1CCN(CC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)[C@@H]1C 170599726 ABAQACVEQNENAL-OLZOCXBDSA-N 387.933 2.649 0 50 GFAA O=C(NC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1CCCN(CC(F)(F)F)C1 194319996 HORYURRDJJKPFG-MRXNPFEDSA-N 397.441 2.682 0 50 GFAA O=C(c1cncc(N2CCC3(CC2)OCCc2sccc23)n1)N1CCCC1 1704303845 JUAVHUIHUPHNFO-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA COc1cc(CN2C[C@@H]3CNC[C@]3(CO)C2)ccc1OCc1cccc(C)c1 1772711364 BMXPNSUHIDDAOK-NZQKXSOJSA-N 382.504 2.596 0 50 GFAA C=CC(=O)N[C@@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 5725739 PQSKRDCYDLWOAX-NSHDSACASA-N 396.683 2.670 0 50 GFAA Cc1cc2nc(CNC(=O)[C@H]3CCCN(C4CCN(C)CC4)C3)[nH]c2cc1C 11814151 YCFGAXXCJIMLQF-KRWDZBQOSA-N 383.540 2.602 0 50 GFAA O=c1c2c3c(sc2ncn1CCCO)C[C@@H](NCCc1ccccc1)CC3 12055091 DGDBWIXVJRNUQE-INIZCTEOSA-N 383.517 2.530 0 50 GFAA Cc1nn(C)cc1[C@@H]1C[C@H]2CN(C3Cc4ccccc4C3)C(=O)[C@]23CCCN13 12385338 BRVIFSRQEHOHPJ-HARLFGEKSA-N 376.504 2.634 0 50 GFAA Cc1ncc(CN2CCCC[C@H]2C(=O)Nc2ccc(-n3cccn3)cc2)cn1 12713060 GAFVVMRQNVXHHN-FQEVSTJZSA-N 376.464 2.964 0 50 GFAA Cc1cc(C)n(CC(=O)NCc2cccnc2N2CCc3ccccc3C2)n1 12716983 HUNUYXGEQPEPQL-UHFFFAOYSA-N 375.476 2.774 0 50 GFAA Cc1cc(=O)c(O)c(C2(CC(=O)NCc3nnc4ccccn34)CCCCC2)o1 1857526872 FEFJVCVJOBNRKP-UHFFFAOYSA-N 396.447 2.605 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857673040 MHKTZAXUNGLFRT-HSZRJFAPSA-N 392.455 2.901 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C)nc32)C1 1857683503 HOVKAUDZLOQOSG-OAQYLSRUSA-N 383.496 2.951 0 50 GFAA Cc1nonc1CN1C(=O)C[C@H]2[C@@H]1CCN2Cc1cccc(C(F)(F)F)c1 1857685554 XRHZJXZORQXVJR-HOTGVXAUSA-N 380.370 2.772 0 50 GFAA COc1ccc(C(=O)NCCN2CCCC2)cc1Oc1cccc(OC)c1CN 1857689603 HSTRLJRJAHWUAJ-UHFFFAOYSA-N 399.491 2.780 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NCc1cn2nc(C)sc2n1 1857718581 LLLRVUFFMHQCKZ-UHFFFAOYSA-N 385.478 2.505 0 50 GFAA COCCCn1c(C(=O)N2CCC[C@@H](C)C2)cc2c(=O)n3ccccc3nc21 5270825 WZVWCTBTKNORRG-OAHLLOKOSA-N 382.464 2.558 0 50 GFAA CC(C)(CCC(=O)O)NC(=O)[C@H]1CCN(c2ccccc2Br)C1=O 236839977 HEWQETAZCCGSHH-LLVKDONJSA-N 397.269 2.562 0 50 GFAA Cc1occc1C(=O)NC1CCN(Cc2nc(-c3cnn(C)c3)cs2)CC1 242338977 ZDYHIFZNSLLZOL-UHFFFAOYSA-N 385.493 2.839 0 50 GFAA O=C(C[C@H](O)C(Cl)(Cl)Cl)NCc1ccc(-n2ccnc2)c(F)c1 906406495 BWASHPMDKRHRRU-LBPRGKRZSA-N 380.634 2.749 0 50 GFAA CC(C)(C)c1noc(-c2ccccc2C(=O)N2CCN[C@@H](c3cn[nH]c3)C2)n1 828184120 FSQWMXVUHVRLLB-MRXNPFEDSA-N 380.452 2.544 0 50 GFAA Cc1nc(C)c(C(=O)NCCCCc2cn(-c3ccc(C(=O)O)cc3)nn2)s1 1875324734 LISDQUBQYNXFGK-UHFFFAOYSA-N 399.476 2.792 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@@H]4CC[C@@H](C)C4)C3)CC2)cc1 1875328550 XTRFBKGHKSVDMU-YLJYHZDGSA-N 381.520 2.734 0 50 GFAA Cn1cc(-c2ccc(C(=O)N3CC[C@H](C4CC4)[C@H]3c3nc(O)n[nH]3)cc2)cn1 1875401993 XYIZUHAQJHZZBU-SJORKVTESA-N 378.436 2.524 0 50 GFAA CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1 646126 BORKIIQZECPNOD-HNNXBMFYSA-N 378.519 2.778 0 50 GFAA Cn1nc(C(=O)NC2CCCC2)c2c1CCN(Cc1nc3ccccc3n1C)C2 14533632 GPWWGPFNWRLISC-UHFFFAOYSA-N 392.507 2.538 0 50 GFAA COc1ccc(-c2nc(=NC3CCC(N4CCCC4=O)CC3)o[nH]2)cc1OC 2325775572 KVKYQINBBJYCQE-UHFFFAOYSA-N 386.452 2.521 0 50 GFAA C[C@]1(C(=O)N[C@@H]2CCN(C(=O)c3ccc4c(c3)NCC4)C[C@@H]2F)CCCS1 2325827166 YBLJMJDCXIKAJV-RZQQEMMASA-N 391.512 2.609 0 50 GFAA O=C(N[C@H]1CCCn2nccc21)[C@@H]1CO[C@H](CNCc2ccccc2Cl)C1 2332237547 AOLIBSREUUGHNC-BQFCYCMXSA-N 388.899 2.683 0 50 GFAA CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1-c1cccnc1 917228 YEVNNKFKRDEPBE-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA COc1ccc(CNC2=NC(=O)C[C@H](C(=O)Nc3ccc(F)cc3)S2)cc1 1107390 UZFLDMDDNJKAGZ-MRXNPFEDSA-N 387.436 2.951 0 50 GFAA C[C@@H]1CN(C(=O)c2ccc(-c3cncc(N)n3)cc2)CCN1c1ccc(F)cn1 2356144859 PEKMFSHYXHELPY-CQSZACIVSA-N 392.438 2.611 0 50 GFAA CCOc1ccccc1N(CC(=O)N[C@@H](C)c1ccccc1)S(C)(=O)=O 2959317 OEYZGFHIYVTSQY-HNNXBMFYSA-N 376.478 2.729 0 50 GFAA COc1ccc(C(=O)N(Cc2sccc2C)[C@H]2CCS(=O)(=O)C2)cc1 4858176 BRCOEANZRYNGKR-HNNXBMFYSA-N 379.503 2.895 0 50 GFAA CO[C@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CCCc2ccccc2)C1 55153979 QZEVAYNPRRFERK-IBGZPJMESA-N 391.537 2.530 0 50 GFAA COc1ccccc1[C@@H]1CCCN1C(=O)NC[C@@H](C(C)C)N1CCN(C)CC1 170838736 VPAFFAOJOMWKDO-PMACEKPBSA-N 388.556 2.814 0 50 GFAA CCn1ncc(Cl)c1CN(C)C(=O)CCn1ncc(Br)c1C 2802629 HHQAKCBDNWGNDU-UHFFFAOYSA-N 388.697 2.873 0 50 GFAA CN1CCCN(c2nccc(C3(c4ccccc4Cl)CCNCC3)n2)CC1 72434336 KUAWHPVZUZWAEO-UHFFFAOYSA-N 385.943 2.941 0 50 GFAA CC(C)(C)OC(=O)[C@@]12CCC[C@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2 252489638 JVGGKNTUBFQSHQ-HRAATJIYSA-N 382.464 2.851 0 50 GFAA C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cccc(C(=O)N(C)C)c1 362453550 SBNUTAVCZQDUPN-CQSZACIVSA-N 378.432 2.799 0 50 GFAA Cc1nn(CCO)cc1CN1CCC[C@H](c2[nH]ncc2Cc2ccccc2)C1 77489662 BCSHOURDMTWBHR-IBGZPJMESA-N 379.508 2.877 0 50 GFAA CN1[C@H]2CC[C@H]1CC(NC(=O)Nc1cc(F)c(F)cc1N1CCOCC1)C2 333225123 WYBKHOXJJMPAMI-KBPBESRZSA-N 380.439 2.548 0 50 GFAA CN(C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1)C1CCNCC1 237090901 OAOMIXQWZFAHFY-SFHVURJKSA-N 389.499 2.821 0 50 GFAA CC(C)NC(=O)CCN1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71771865 VYEOTBYUXKRWLS-LJQANCHMSA-N 377.504 2.799 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1CCN(c2ccnc(N3CCCC3)n2)CC1 77136036 SPMYVUSYGLYAMN-UHFFFAOYSA-N 385.899 2.622 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N3CC(=O)N[C@H]4CCCC[C@@H]43)ccc12 131162609 DHBSTLIHAMRAEK-HKUYNNGSSA-N 389.459 2.612 0 50 GFAA CCN(CC)CCCNc1nc(-c2ccncc2)nc2c1CCN(C(C)=O)C2 72151914 OHLOQODGSOBPMT-UHFFFAOYSA-N 382.512 2.587 0 50 GFAA Cc1ccc2nc(CNC(=O)N3CCCC[C@@H]3CCN3CCCC3=O)[nH]c2c1 426595130 ZDEMQWZQVAJHSN-MRXNPFEDSA-N 383.496 2.948 0 50 GFAA Nc1ncc(-c2ccc(C(=O)N3CCCC[C@@H]3CCn3cccn3)cc2)cn1 426677763 ROKLSSKGIGYXJG-LJQANCHMSA-N 376.464 3.007 0 50 GFAA CCNc1ccnc(N[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)n1 92045434 SJGIJCANEQKUFV-OAHLLOKOSA-N 383.500 2.661 0 50 GFAA Cc1ccc(-c2nc(C)c(C(=O)N3CCN(C[C@@H]4CCOC4)CC3)s2)o1 178090265 SUXZXUQWAVHMNL-HNNXBMFYSA-N 375.494 2.814 0 50 GFAA O=C1COc2c(F)cc(NC(=O)NCCCN3Cc4ccccc4C3)cc2N1 96165981 OZVCFPSBEZHFMQ-UHFFFAOYSA-N 384.411 2.684 0 50 GFAA CN(Cc1cnn(-c2ccccc2)c1)C(=O)COCc1nc2ccccc2[nH]1 91416646 HXDBGVYJZYFQSV-UHFFFAOYSA-N 375.432 2.924 0 50 GFAA O=C([C@@H](O)Cc1ccccc1)N1CCC(c2nccn2Cc2ccccn2)CC1 92061869 CTIVDIQQRQJTQC-NRFANRHFSA-N 390.487 2.636 0 50 GFAA Cc1nonc1OCCNC(=O)Nc1ccc(OC[C@@H]2CCCCO2)cc1 96161500 KJHWZJAEWDDLHW-INIZCTEOSA-N 376.413 2.526 0 50 GFAA O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)c1cccnc1OCC(F)(F)F 180960859 WDZFSYISBJMCNE-CYBMUJFWSA-N 393.365 2.837 0 50 GFAA CCCCNS(=O)(=O)c1cccc(NC(=O)NCCc2scnc2C)c1 296282661 JCWLQPPMBNZELV-UHFFFAOYSA-N 396.538 2.894 0 50 GFAA CN(C)c1ccncc1C(=O)N1CCN(c2ncc(Cl)cc2Cl)CC1 183523184 BPFJSOVBKZYIAQ-UHFFFAOYSA-N 380.279 2.812 0 50 GFAA COc1ccc(CNC(=O)CCc2ccc3c(c2)OCCCO3)cc1C(=O)O 299749193 JJYGTDUCQQZJHD-UHFFFAOYSA-N 385.416 2.804 0 50 GFAA Cc1c(-c2ccc(C(=O)NCCc3nnc(N)s3)cc2)cnn1C(F)F 534592022 ODYFXPPPNMZCQM-UHFFFAOYSA-N 378.408 2.660 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)c3cc(C)no3)C[C@@H]1N(Cc1cccs1)CC2 534659593 RDSMGJCHGZLKEZ-DKSSEZFCSA-N 375.494 2.987 0 50 GFAA Cc1cccc(C)c1OC[C@@H](C)NC(=O)N1CCC[C@H](CS(C)(=O)=O)C1 299153825 QXJHATPUAVURBD-SJORKVTESA-N 382.526 2.537 0 50 GFAA Cc1nccn1CCC1CCN(C(=O)Nc2cccc(-n3cnnn3)c2)CC1 299770673 USFSOBPXAAXMHA-UHFFFAOYSA-N 380.456 2.501 0 50 GFAA Cc1ccsc1CN(CC(C)C)C(=O)CCN(C)[C@@H]1CCS(=O)(=O)C1 952974768 NHWLCOPOUBHYNU-MRXNPFEDSA-N 386.583 2.550 0 50 GFAA Cc1nn(C)c(C)c1CN(C1CC1)S(=O)(=O)c1ccc(-c2ccno2)o1 952977899 LKYSUSVKCMRBRK-UHFFFAOYSA-N 376.438 2.638 0 50 GFAA COC(=O)N1CCC[C@H](C(=O)Nc2cccc(-c3ccc4c(c3)OCCO4)n2)C1 170623162 NMKGFIHJNYLYMW-HNNXBMFYSA-N 397.431 2.937 0 50 GFAA CCOC(=O)[C@]12CC[C@H](N3CCOCC3)C[C@@H]1CCN(Cc1ccco1)C2 215228151 RBIJCIXVEFGAKL-WFXMLNOXSA-N 376.497 2.536 0 50 GFAA CO[C@H]1CN(C(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)C[C@H]1Cc1cc(C)no1 1704299564 ROVRDQLIESQNNH-NLHWGLJWSA-N 388.508 2.720 0 50 GFAA Cc1c(Cl)ccc(S(=O)(=O)N2CCC(CO)(CN(C)C)CC2)c1Cl 1772705113 WDSHOEBBHJDAOK-UHFFFAOYSA-N 395.352 2.627 0 50 GFAA O=C1CCCN1CCCc1nc(-c2ccc(F)c(F)c2)nn1[C@@H]1CCOC1 1772806826 KMAAYISNDPNUGW-CQSZACIVSA-N 376.407 2.740 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2cn(CCCc3ccccc3)nn2)C1 11753491 CIGUJPWCRQTKCP-IBGZPJMESA-N 397.523 2.632 0 50 GFAA COCCN1CCC(CN(Cc2ccc(OC)c(O)c2)C[C@H]2CCCO2)CC1 11841531 QFAUYFQBKCBYPX-HXUWFJFHSA-N 392.540 2.740 0 50 GFAA C[C@@H](CCn1cccn1)NC(=O)c1cn(Cc2ccc(F)cc2Cl)nn1 12583548 RCKOAMHLDSYGKQ-LBPRGKRZSA-N 376.823 2.524 0 50 GFAA CCCc1cc(C(=O)N2CCN(S(=O)(=O)c3cccs3)CC2)cs1 13745140 CZDLERGDXFSQRG-UHFFFAOYSA-N 384.548 2.909 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCCc1ccccc1F)C2 14532605 LAXHRVIMMUPBJM-KRWDZBQOSA-N 384.499 2.875 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(CCc1ccccc1)CC2 14541568 NMJOCCDRMSBSCV-UHFFFAOYSA-N 392.503 2.943 0 50 GFAA O=C(N[C@H]1CCCCNC1=O)c1ccccc1-c1nc(-c2ccccc2)no1 19300007 KIACJBQQOSVQIP-KRWDZBQOSA-N 376.416 2.802 0 50 GFAA CN(C)[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(-c4ccccc4)s3)C[C@@H]12 1857692221 UWLGHOYRFOMLGQ-SCTDSRPQSA-N 376.547 2.574 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)c(OC)n1 1857701040 LBZYEGSTOQCRSZ-GDBMZVCRSA-N 392.496 2.660 0 50 GFAA CN(C)CCOc1cc(CNC(=O)[C@@H]2COc3ccc(Cl)cc3C2)ccn1 123993943 LALDIXOMQZAOCK-INIZCTEOSA-N 389.883 2.543 0 50 GFAA CC(C)Cc1cc(CN2C[C@@H]3OC(=O)N(CCc4ccc(F)cc4)[C@@H]3C2)n[nH]1 248197040 QTETUCKKAWIBHH-UXHICEINSA-N 386.471 2.995 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCC3(CC2)C[C@H]3CN(C)C2CC2)c1C 367357524 BUKDVAFLUGKGRD-INIZCTEOSA-N 377.554 2.640 0 50 GFAA CNC(=O)c1ccc(Cl)cc1NC(=O)c1cc(F)cc(N2CCOCC2)c1 822824814 SNIZFYUBTWBFKT-UHFFFAOYSA-N 391.830 2.928 0 50 GFAA COc1ccc(Cc2cnc(NC(=O)[C@H]3COCCN3CC(F)F)s2)cc1 952845669 AXXBLGNWWQKBSN-OAHLLOKOSA-N 397.447 2.647 0 50 GFAA CCc1nnc(-c2ccc(NC(=O)N3CCN(CC)[C@@]4(CCOC4)C3)cc2)o1 1875274249 YPNABXMLGJHFFT-FQEVSTJZSA-N 385.468 2.628 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@@H]([C@H](C)c2ccccc2)C1 1875297493 STZVMAFOOGBMIV-MLGOLLRUSA-N 376.478 2.810 0 50 GFAA O=C(C[C@H]1COc2ccccc2O1)NS(=O)(=O)Cc1c(F)cccc1Cl 1875289329 IYIYKWNERCDVGR-NSHDSACASA-N 399.827 2.655 0 50 GFAA O=C1CC[C@@H](N2Cc3c(cccc3-c3ccc(F)c4[nH]ccc34)C2=O)C(=O)N1 1875357145 ZWUAVDHZFDDGRC-QGZVFWFLSA-N 377.375 2.735 0 50 GFAA O=C(O)c1csc([C@@H]2CCCN2C(=O)c2ccc(CN3CCCC3=O)cc2)n1 888091456 IYHDIYWUBFDSNG-INIZCTEOSA-N 399.472 2.941 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1c1ccc(N2CCCC2)nc1F 39961324 DWCQZHQUMYNFSA-LSDHHAIUSA-N 393.459 2.944 0 50 GFAA in-vitro O=C(N[C@@H]1C[C@H](C(=O)NCC2=CCCCC2)C[C@H]1O)c1cc2ccccc2o1 2100483478 WYXQZVZWBRUVSW-RCCFBDPRSA-N 382.460 2.919 0 50 GFAA O=C(COC(=O)C1(n2cncn2)CC1)N1c2ccccc2CCc2ccccc21 2325781045 FWBHGVODCAOUKL-UHFFFAOYSA-N 388.427 2.774 0 50 GFAA O=C(NC[C@@H]1CCN1Cc1ccccc1)C(=O)Nc1cnc2ccc(F)cc2c1 2325857771 OHKZXCWIQZAJLA-IBGZPJMESA-N 392.434 2.703 0 50 GFAA Cc1ccccc1[C@H]1CN(C(=O)Cc2sc(-c3ccn(C)n3)nc2C)CCN1 913478830 RDQSDBOOVFWMFB-GOSISDBHSA-N 395.532 2.876 0 50 GFAA CC(C)N1C[C@@H](NC(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)CC1=O 1477970103 MZYHDEZVSYBOKY-AWEZNQCLSA-N 399.322 2.834 0 50 GFAA Cc1ccc(-c2nnc(N3CCN(S(C)(=O)=O)CC3)c3ccccc23)cc1 1114683 BZRQHMRJRYXLMX-UHFFFAOYSA-N 382.489 2.687 0 50 GFAA aggregator Cc1cc(CN2CCC(C)CC2)c(C)c(CN2CCO[C@@H](c3nnnn3C)C2)c1 2356139195 NXEZNEIIEZRVOD-OAQYLSRUSA-N 398.555 2.632 0 50 GFAA Cc1cc(C)cc(N(CC(=O)NCCSCc2ccco2)S(C)(=O)=O)c1 2989237 NZDDVNRKBGWALL-UHFFFAOYSA-N 396.534 2.712 0 50 GFAA Cc1ccnc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)c1 6701698 CYXYHICFGYVJPX-HNNXBMFYSA-N 379.869 2.835 0 50 GFAA COc1ccc(CN2CCN(Cc3nccs3)C[C@H]2CCO)c(C)c1C 104299442 VQUBWYQJFOEAPP-GOSISDBHSA-N 375.538 2.837 0 50 GFAA CC(=O)N[C@@H](C)C(=O)NCc1nc(-c2ccc(C)cc2)c(-c2ccccn2)[nH]1 67955988 OZJRFJBZKYWKSA-AWEZNQCLSA-N 377.448 2.588 0 50 GFAA CCN1CCC(N2CCC[C@@H](N3CCN(c4ccccc4OC)CC3)C2)CC1 22913164 ZNMJCYUGJJLKHP-OAQYLSRUSA-N 386.584 2.766 0 50 GFAA CN(Cc1nc2ccccc2n1C)C(=O)COc1cccc(N2CCCC2=O)c1 111098237 GEXRBEUJICCHAU-UHFFFAOYSA-N 392.459 2.738 0 50 GFAA CCN1CC[C@H](CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 247288762 ZZMVKWNVKIZLKV-IEBWSBKVSA-N 383.458 2.899 0 50 GFAA Cc1cc(CN2CCC3(CC2)c2ccccc2[C@@H](n2ccnc2C)[C@@H]3O)n(C)n1 20235996 KVFMTIKZGMRLIC-YADHBBJMSA-N 391.519 2.731 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccc4c3OCO4)C[C@@H]2CCO)cc1 22932913 MPIDYJKJGGAKGP-FQEVSTJZSA-N 398.503 2.883 0 50 GFAA Cn1nc([C@H]2CCCN(C(=O)Nc3ccccc3)C2)n(-c2ccccc2)c1=O 67885818 UNHRYMRBAJHOQB-INIZCTEOSA-N 377.448 2.983 0 50 GFAA O=C(c1cn(C[C@H]2CCCNC2)nn1)N(Cc1ccccn1)C1CCCCC1 67790234 DUMMMVANNMEVLA-KRWDZBQOSA-N 382.512 2.648 0 50 GFAA C[C@@H]1CCN(C(=O)C2=CC(c3ccco3)=NS(=O)(=O)N2C)[C@H]2CCCC[C@@H]21 35312642 RERZDHKTOIPMBG-FMKPAKJESA-N 391.493 2.570 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252549477 RHVHXLBLWGBJBV-INIZCTEOSA-N 394.406 2.953 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)Nc4ccccc4F)CC3)ncn2)c1C 72437880 YMCUOZMVGCIWAT-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA CCn1ccnc1[C@@H]1C[C@H]2CN(C3Cc4ccccc4C3)C(=O)[C@]23CCCN13 11818894 POXXIBPUDKNYMS-LEDOBFOHSA-N 376.504 2.808 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCN(Cc4cccc(F)c4)C(=O)C3)c2)no1 150852465 MBTCLDZGJMSMBX-UHFFFAOYSA-N 394.406 2.669 0 50 GFAA O=C(Cc1cccc(F)c1)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 238037638 CCGQFFCJCMUHEK-UHFFFAOYSA-N 384.407 2.944 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CCCOCC1 71764890 RBRYODILTYUZNK-UHFFFAOYSA-N 378.476 2.829 0 50 GFAA CCN(CC)CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71419089 UJYYNXAVHSAGFT-LJQANCHMSA-N 377.504 2.753 0 50 GFAA CC1(C)CC(=O)c2cc(C(=O)N3CCN[C@H](c4ccccc4)C3)c(O)nc2C1 333786609 WPEPGDYUFFWLKL-SFHVURJKSA-N 379.460 2.729 0 50 GFAA C[C@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)CC[S@@]1=O 242178814 XBBHPADSAISGIQ-MQNRADLISA-N 381.567 2.610 0 50 GFAA O=C(CC[C@@H]1CCCOC1)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1 175486387 YPQQUKLSUXKCAC-KRWDZBQOSA-N 399.491 2.645 0 50 GFAA COc1nc2c(cc1C(=O)NCc1ccccc1CN1CCCC1=O)CCC2 92045511 SCQMJNVCXOOHOW-UHFFFAOYSA-N 379.460 2.631 0 50 GFAA CCCn1ccnc1CN1CCC[C@H](c2nnc(CN3CCCCC3)n2C)C1 426615152 MLPWKDNWPMDREV-SFHVURJKSA-N 385.560 2.787 0 50 GFAA COc1ccc(CN(C)C(=O)[C@H]2Cc3ccccc3C(=O)N2)c2cccnc12 97136914 MOUYRYVWFQIJDL-GOSISDBHSA-N 375.428 2.557 0 50 GFAA Cc1ccnn1CC(=O)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95392097 KIKMBKWDEPBJPR-MAODMQOUSA-N 386.446 2.559 0 50 GFAA COCCN1CCC[C@@H](CN(C)c2ncnc3c2Cc2ccccc2OC3)C1 97547745 MPDUBDSCJWBPBJ-KRWDZBQOSA-N 382.508 2.754 0 50 GFAA COCCn1c(C)cc2cc(NC(=O)N3C[C@@H]4CC[C@H](C3)C(=O)N4C)ccc21 96131758 LXORUUFLAWTMAW-QAPCUYQASA-N 384.480 2.681 0 50 GFAA COc1cccc(-c2ccc(NC(=O)[C@H]3CCCN(C(=O)CCO)C3)cc2)c1 95525381 MWTXWCZAFZKGJZ-SFHVURJKSA-N 382.460 2.922 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1 95353874 RJSHAGVSLYLPJQ-HXUWFJFHSA-N 382.508 2.545 0 50 GFAA C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1cccc2c1NC(=O)CO2 180754612 GPEULJDZNNXSFU-NSHDSACASA-N 376.359 2.894 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccccc1 253413027 SUGLCWZRPYGOGR-KEZQHZCBSA-N 383.536 2.929 0 50 GFAA biogenic CSCC1CCC(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2F)CC1 295584578 WVSFRPSVMXUFEC-HSBZDZAISA-N 388.530 2.531 0 50 GFAA Cc1noc([C@@H]2CCCCN2C(=O)NCc2nc(Cc3ccccc3)no2)n1 534656821 ABMUAGHBTWDLTD-HNNXBMFYSA-N 382.424 2.789 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cc(Cl)ccc1F 266409032 ZJAYKYCURQAUHK-LBPRGKRZSA-N 385.848 2.904 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)C(=O)NCC[C@H](C)N1CCOCC1 534672434 CTFREAQTLLDJCZ-KRWDZBQOSA-N 387.528 2.556 0 50 GFAA O=C(CCc1cccc(Cl)c1)N[C@@H]1C[C@@H](C(=O)N2CCCC2)CC[C@H]1O 1940193574 CCGBMHHZYUWREI-CGTJXYLNSA-N 378.900 2.541 0 50 GFAA O=C([C@H]1OCC(=O)N(C2CC2)[C@@H]1c1cccnc1)N1[C@H]2CCCC[C@H]1CCC2 1940195585 ZHAPXQZFNUYZNI-PZBISTMVSA-N 383.492 2.836 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccc(Cn3cccn3)c2)Cc2ccccn2)N1 828276005 XBJCWOKKNFIQOI-NRFANRHFSA-N 375.476 2.607 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2cccc3cc[nH]c23)[C@@H]1c1cnn(C)c1C 275250679 GOMGKWITVBNJRQ-PGRDOPGGSA-N 395.507 2.536 0 50 GFAA CC(=O)Nc1cccc(CN2CCC[C@H](c3[nH]ncc3CN3CCOCC3)C2)c1 275930200 KQDBUMDMSQOXEN-IBGZPJMESA-N 397.523 2.580 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NOC[C@H]1CCOC1)OCc1ccccc1 170607697 NEGGOQDKIWGWFP-VQTJNVASSA-N 398.459 2.608 0 50 GFAA Cc1ccc([C@@H]2CCN(C(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)C2)c(C)c1 279333923 CCIBZTBSKUKMCF-QGZVFWFLSA-N 376.460 2.818 0 50 GFAA CC(C)c1csc(NC(=O)C(=O)N2CCN(c3ccccc3F)CC2)n1 192607868 DUZNANVWJDJNGO-UHFFFAOYSA-N 376.457 2.693 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](C(=O)c3ccccn3)C2)c2c(C)nn(C)c2n1 1506396758 VTVCCPAOWVOCQI-HNNXBMFYSA-N 377.448 2.715 0 50 GFAA CCOc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCCOC(C)=O)cc1 2099755 ORHHTRYQUMPJEY-HMMYKYKNSA-N 396.443 2.536 0 50 GFAA biogenic COc1cccc(NC(=O)N2CCCN(C(=O)COCc3ccccc3)CC2)c1 1775982273 NICQFVLZCHJTTK-UHFFFAOYSA-N 397.475 2.978 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)cc1 11763629 GYPXAXBRVXIBDS-HXUWFJFHSA-N 383.536 2.724 0 50 GFAA O=C(CCc1nnc(CCCCc2ccccc2)o1)NCCCN1CCCC1=O 12385563 UXBUQBKJRCIOKM-UHFFFAOYSA-N 398.507 2.696 0 50 GFAA COc1ccc(C(=O)NCCc2nnc(SCC(C)C)n2C)c(OC)c1 14879991 MEKBJWGERKPUEI-UHFFFAOYSA-N 378.498 2.553 0 50 GFAA CC[C@@H]1CN(CC(=O)NCCCc2cccnc2)Cc2cc(OC)ccc2O1 14882289 UKIJZMRPQDTQHF-LJQANCHMSA-N 383.492 2.812 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)N1CCCC1 16651000 IHEPLPOMXIIHFX-UHFFFAOYSA-N 380.491 2.716 0 50 GFAA CC(C)NC(=O)C1CCN(C(=O)c2ncn3c2CO[C@@H](c2ccccc2)C3)CC1 169758537 KQHWTBJSNIYTCB-LJQANCHMSA-N 396.491 2.531 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cc(C)ccc4C)nnc3c2)n1 169776151 ANEDNRAVXWUEMN-UHFFFAOYSA-N 376.420 2.889 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(Cc3cc(-c4cccnc4)no3)CCN12 1857703945 XGXHDIJMDACJPA-JOCHJYFZSA-N 390.443 2.986 0 50 GFAA O[C@@H]1CN(Cc2c(-c3ccccc3)nc3ncccn23)C[C@H]1Cc1ccncc1 1857717971 INBXNQHHVWWLNU-TZIWHRDSSA-N 385.471 2.827 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(C3CCNCC3)CC1)OCC2)N1CCCC1 1857707166 HEBOKSULKIAFMH-UHFFFAOYSA-N 389.565 2.600 0 50 GFAA COc1ccc(CC(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c(OC)c1 1857710361 SQKJNHYROOJXDY-GMAHTHKFSA-N 398.503 2.777 0 50 GFAA O=C(c1csc(-c2ccc(C(F)(F)F)cc2)n1)N1CC[C@H](O)[C@H](CO)C1 1857719376 LATXGKNOYYYQQL-FZMZJTMJSA-N 386.395 2.644 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(Cc3nc4ccccc4[nH]3)C1)CC2 1857727137 LSWYHESWTVIRRN-NRFANRHFSA-N 378.480 2.605 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3)c1ccc(Cl)o1 1857732457 REKIHWLUPUCFMA-NVAPZFDKSA-N 393.896 2.799 0 50 GFAA C[C@@H](N)[C@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 237327168 FGLUKKMWZYHERX-ZJUUUORDSA-N 381.723 2.850 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2Cc3ccccc3N(C)C[C@H]2C)c1 246303484 BYIKNLFQXFWLCI-MRXNPFEDSA-N 380.492 2.715 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)N[C@@H](C)Cc2ccsc2)c1=O 14982694 WXBUZWDPJOBSHI-AWEZNQCLSA-N 389.521 2.677 0 50 GFAA O=C1CCCN1Cc1ccc(C(=O)N2CC[C@]3(C2)C(=O)Nc2ccccc23)cc1 363941678 ZEJNVLQPGJNXOL-HSZRJFAPSA-N 389.455 2.545 0 50 GFAA CC(C)c1ccccc1Oc1ccccc1C(=O)NC[C@@H](O)Cn1ccnn1 1875265861 ICUATNIFGLTENS-MRXNPFEDSA-N 380.448 2.985 0 50 GFAA C[C@H]1C[C@@H](NC(=O)c2cc(Cl)nn2-c2ncccc2Cl)c2ncnn21 1875294081 MCTJRCZLWGQTME-WCBMZHEXSA-N 378.223 2.601 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(c2ccccc2F)C[C@@H]1C 1875262041 CGGJLQTWPBGFRT-QFBILLFUSA-N 399.466 2.830 0 50 GFAA CC(=O)N1CCN(Cc2ccc(NC(=O)c3n[nH]c4ccc(C)cc34)cc2)CC1 2325726862 FEEFUVNUDGQORF-UHFFFAOYSA-N 391.475 2.788 0 50 GFAA CCn1c(=O)c(C)nc2cc(C(=O)Nc3ccc4ncnc(O)c4c3)ccc21 2325727013 PDCCRGTYNMSCCH-UHFFFAOYSA-N 375.388 2.626 0 50 GFAA CCc1ncc2c(n1)CC[C@H](C(=O)Nc1nnn(Cc3ccccc3F)c1C)C2 2325773512 LDJPIHQQUZIHBG-AWEZNQCLSA-N 394.454 2.870 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccc(F)cc1 815553 JNFGRFDBKIJUSR-MRXNPFEDSA-N 378.425 2.535 0 50 GFAA COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCc2ccc3c(c2)OCO3)cc1 844466 CPLVEVCCUOIRRT-LJQANCHMSA-N 396.399 2.795 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cn4cccnc4n3)C2=O)cc1 2356140010 QAWZULIYMCSNIF-JOCHJYFZSA-N 389.459 2.840 0 50 GFAA COc1cc(NC(=O)CSc2nnc(-c3ccc(C)cc3)n2N)cc(OC)c1 2447838 FASMJYNIILSEKB-UHFFFAOYSA-N 399.476 2.715 0 50 GFAA CCOc1ccc(C(=O)Nc2ccc(N3CCOCC3)c(C(=O)OC)c2)cc1 4711521 QLYLNCDTGHMQEF-UHFFFAOYSA-N 384.432 2.961 0 50 GFAA CC(=O)N1CCC(C(=O)Nc2sc3c(c2C(N)=O)CCCCCC3)CC1 6729465 SWSGAIKKQQNFEB-UHFFFAOYSA-N 377.510 2.703 0 50 GFAA Cc1ccc(-c2nc(-c3ccc(S(C)(=O)=O)cc3)no2)cc1S(C)(=O)=O 109610753 NRROAZOXSDVLLH-UHFFFAOYSA-N 392.458 2.519 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1ccc(Cl)cc1Cl 101127883 JTZFHKVDVOTUHR-RFHZTLPTSA-N 377.227 2.835 0 50 GFAA CCOc1ccc(CN2CCc3nnc([C@H](CC(C)C)NC(C)=O)n3CC2)cc1 20601471 AKNRIDMNFBHHDR-FQEVSTJZSA-N 399.539 2.958 0 50 GFAA COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)N1CCCO[C@@H](CF)C1 416949951 RGCAQWDHUNWDTO-INIZCTEOSA-N 395.475 2.903 0 50 GFAA OCC[C@@H]1CN(Cc2ccc(-n3cccn3)cc2)CCN1Cc1ccccc1 22932703 YSKAMAVCVYBNCF-HSZRJFAPSA-N 376.504 2.941 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCC[C@@H](c2cccc(C(=O)O)c2)C1 108048894 KJUCMAIHCZXBAY-LJQANCHMSA-N 388.489 2.941 0 50 GFAA O=C(c1nn(-c2cccc(F)c2F)c2c1CCC2)N(CCO)Cc1cccnc1 421788832 YOZBAFRVIPWORW-UHFFFAOYSA-N 398.413 2.669 0 50 GFAA O=S(=O)(c1ccsc1)N1CCc2[nH]nc(COc3ccccc3)c2C1 23542848 HDURISZONZSXNI-UHFFFAOYSA-N 375.475 2.797 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCCc1ccccc1 20600136 AIPZATLZPMRPKD-JOCHJYFZSA-N 396.531 2.959 0 50 GFAA COc1ccccc1C1=NN(C(C)=O)[C@@H](c2ccccc2NS(C)(=O)=O)C1 252482405 DESKRKYADUYVCY-GOSISDBHSA-N 387.461 2.764 0 50 GFAA Cc1noc([C@H]2CCCCN2S(=O)(=O)c2cccc3c2OC(F)(F)O3)n1 333225535 XIOMUKMLYWKWBE-SNVBAGLBSA-N 387.364 2.615 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCC3(CC2)C[C@H](C(=O)O)N(C(=O)C2CC2)C3)c1 72435897 YWGGSXGRNZUAGN-GOSISDBHSA-N 384.476 2.621 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N(CCC(=O)O)C[C@@H]3CCCO3)c2)n1 237665732 JCMJQKCQKNOPOS-IBGZPJMESA-N 385.464 2.644 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(C(=O)c3cccnn3)CC2=O)cc1 82121461 ZKVSXYGGBDIRDX-HXUWFJFHSA-N 386.455 2.885 0 50 GFAA CCNc1ccnc(-c2cccc(C(=O)N3CCC[C@]4(CCN(C)C4)C3)c2)n1 426620281 RUGNGZFDCXDKCG-JOCHJYFZSA-N 379.508 3.133 0 50 GFAA CCN(C[C@H](O)c1cccc(O)c1)C(=O)c1cc(-c2cccc(OC)c2)n[nH]1 91616548 HVXOMDNPPBPTSK-FQEVSTJZSA-N 381.432 2.987 0 50 GFAA C/C=C(\C)CN[C@@H]1C[C@@H](C(=O)NCCOC)N(Cc2cccc(Cl)c2)C1 20999869 FSQVNRFGBKZMRD-PVLFMVMASA-N 379.932 2.601 0 50 GFAA CN1CCc2nc[nH]c2C12CCN(Cc1cnn(-c3ccccc3F)c1)CC2 95516319 FIWAEBJEFYAJSN-UHFFFAOYSA-N 380.471 2.714 0 50 GFAA CCCc1nc(C(=O)N(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)cs1 97480170 UBUYZQHHZCJFLG-HNNXBMFYSA-N 378.519 2.925 0 50 GFAA CCN(CC)C(=O)c1coc(CN2CCN(C/C=C/c3ccccc3)CC2)n1 91914641 FBRFCWPBPIEEDJ-DHZHZOJOSA-N 382.508 2.988 0 50 GFAA O=C1COc2cc(NC(=O)N3CCC[C@H](C(=O)c4ccccn4)C3)ccc2N1 97568766 SKPLQMKYJNWBEV-ZDUSSCGKSA-N 380.404 2.539 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N(C)C[C@@H]3CCCC[C@H]3O)CC2)cc1 182659934 ARMSKQVLFYZTLC-AZUAARDMSA-N 387.524 2.792 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)NCc3cccc4[nH]ccc34)cnn2c1 67867147 AZTBTDSGDSWHFV-UHFFFAOYSA-N 376.464 2.982 0 50 GFAA CCCOc1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)cc1Cl 952975413 RNYYYGOCFQVPBB-UHFFFAOYSA-N 388.899 2.945 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1cscn1)C1(c2ccccc2F)CC1 1565510526 KYWRTTCYRUOQIF-IRXDYDNUSA-N 376.453 2.804 0 50 GFAA Cc1c(-c2cc(CN[C@H](CO)c3ccc(Br)cc3)on2)cnn1C 274424260 FNMDLSHXMVVENT-QGZVFWFLSA-N 391.269 2.969 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CCC(C(=O)C(F)(F)F)CC1 274709868 KWGYKOREKGCJFC-INIZCTEOSA-N 396.409 2.590 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2ccc(Br)nc2)C1 276384252 QFXMSBRSSCPLDC-GFCCVEGCSA-N 384.274 2.973 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(-c4csc(C)n4)cc3)C(=O)[C@H]2C1 278177769 VEWSIUZLBNCCIN-CZUORRHYSA-N 385.445 2.839 0 50 GFAA O=C([C@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCC(c2cnccn2)CC1 170607753 GCLOQUHILAZFFM-HNNXBMFYSA-N 384.867 2.889 0 50 GFAA CCC1=C(C(=O)N2CCCN(Cc3noc(C(C)(C)C)n3)CC2)CCCO1 188028945 WQHRXBDYGFYOOV-UHFFFAOYSA-N 376.501 2.876 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)Cc3cnc4c(C)cccn34)C1)CC2 1704343668 MNFKPSMWJSTXHC-JOCHJYFZSA-N 375.476 2.790 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC[C@@H]4C[C@@H](O)CC[C@@]43CO)[C@]1(O)CC[C@H]2C1=CC(=O)OC1 1848443835 CDMVQQAHEQVSMF-XSLGZVAPSA-N 390.520 2.577 0 50 GFAA O=C(c1ccc(-n2cnnc2)cc1)N1CCCN(Cc2ccncc2Cl)CC1 1772807717 SVPGDGJXKNJGJX-UHFFFAOYSA-N 396.882 2.664 0 50 GFAA Cc1nccnc1N1C[C@H]2CN(Cc3coc(C(C)C)n3)C[C@]2(CCC(=O)O)C1 1772804217 JLDSHNRHZBDCBP-IIBYNOLFSA-N 399.495 2.700 0 50 GFAA OC[C@]12CCOC[C@H]1CN(Cc1cn(-c3ccccc3)nc1-c1ccncc1)C2 1772703510 MBBKGIRAXPZLNN-NFBKMPQASA-N 390.487 2.765 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2ncc[nH]2)C1)N1CCN(Cc2ccccc2)CC1 11818942 OQPIKYOKTMWHRQ-OAQYLSRUSA-N 395.551 2.746 0 50 GFAA CCN(CC)C(=O)C[C@@]1(c2ccccc2Cl)CC(=O)N(CCCOC)C1=O 11910031 NXGBNWAMZHSTNB-FQEVSTJZSA-N 394.899 2.632 0 50 GFAA COC[C@@H](C)N1CCC(n2nccc2NC(=O)c2ccc3c(c2)OCO3)CC1 12708198 PXVRDACEXRQYAX-CQSZACIVSA-N 386.452 2.536 0 50 GFAA OCC[C@H]1CN(Cc2nc3ccc(F)cc3[nH]2)CCN1Cc1ccc(F)cc1 19771457 PWLSCZPSRXKSEP-SFHVURJKSA-N 386.446 2.910 0 50 GFAA CCc1nnc(-n2ccc3c(cnc4c(-c5ccc(F)cc5)c(C)nn43)c2=O)[nH]1 19821361 NNGLIBMDCBZIAV-UHFFFAOYSA-N 389.394 2.828 0 50 GFAA COc1ccc(-c2ccc3nnc(CNC(=O)c4cccc(OC)c4)n3n2)cc1 169778550 AQQCPXORXNJWMD-UHFFFAOYSA-N 389.415 2.739 0 50 GFAA COc1ccc(C(=O)N[C@H]2C[C@H](Cn3cccn3)C[C@@H]2O)cc1OC1CCCC1 1857532807 AKRIGRCZHOPJNN-SNRMKQJTSA-N 399.491 2.783 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(c3cc(N4CCCCC4)ncn3)CCN12 1857670833 FCSKTHJRVRLEDF-JOCHJYFZSA-N 393.491 2.721 0 50 GFAA O=C(CCc1cnccn1)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857671293 DHEXRUCNHRQZHF-WOJBJXKFSA-N 381.476 2.683 0 50 GFAA Cc1csc(CNc2cccc(C(=O)NC34CC(C)(C3)OC43COC3)c2)n1 1875298817 OJYRKBWPXZNIEA-UHFFFAOYSA-N 385.489 2.884 0 50 GFAA O=C(CN1CC[C@H](c2ccccc2)NC1=O)N[C@H]1c2ccccc2CC[C@H]1CO 1875321782 VEIZLNBPKHOIIB-CZTZKLFOSA-N 393.487 2.555 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)c2cc(C3CC3)no2)CCCCN1 2100533090 ZVPXEEPYXBIMBI-KRWDZBQOSA-N 388.512 2.539 0 50 GFAA CN(C[C@H](O)CN1CCc2ccccc2CC1)c1cnc2cc(F)c(F)cc2n1 2325708713 QEZCDTNBONTUAD-KRWDZBQOSA-N 398.457 2.806 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCCn1ncc2ccccc2c1=O 2325732304 NYFBVSTYWYVOIN-KPFFTGBYSA-N 385.508 2.990 0 50 GFAA Cc1nc(N[C@@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@H]2O)cc(=O)n1-c1ccccc1 2325785517 BXVMJINKKFOMJS-ZTFGCOKTSA-N 399.882 2.642 0 50 GFAA CN1C[C@H](O)C[C@@H]1CNC(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 887602965 NYKUSZPNLGSTIA-GGPKGHCWSA-N 392.503 2.664 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccccc2Cl)S(C)(=O)=O)cc1OC 824371 SGDKZOHBXPGEOZ-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA COc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)cc1 2279224 JSADMOOEAJWDDR-INIZCTEOSA-N 380.400 2.723 0 50 GFAA Cn1nc(C(=O)N2CCC3(CC2)OCCc2sccc23)c2ccccc2c1=O 2356164171 IDZSSZGAAKPYEX-UHFFFAOYSA-N 395.484 2.699 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCc1ccccc1 2872298 FLASAZGVZYTPIM-UHFFFAOYSA-N 388.489 2.556 0 50 GFAA COCCNC(=O)c1cnn2c1N[C@H](c1ccc(OC)cc1)C[C@H]2C(F)(F)F 2945215 DKRZYGJWELFHBV-GJZGRUSLSA-N 398.385 2.928 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O 4535720 BSRAGXJNZJMFMY-BHYGNILZSA-N 378.469 2.943 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1CCN(S(=O)(=O)c2cccs2)CC1 6698974 OMMIUMBMQSSMIY-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA CNC(=O)[C@H]1CCCN(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)C1 111266002 GFEUPPFRGLSWNY-UWJYYQICSA-N 397.544 2.680 0 50 GFAA Cc1ccc(CN(CCN(C)C)C(=O)c2nn(C)c(=O)c3ccccc23)s1 55368813 XZCOFKDZHUKUNF-UHFFFAOYSA-N 384.505 2.507 0 50 GFAA CCOC(=O)[C@@H]1CC[C@H](C(=O)OCC)N1C(=O)Cc1c[nH]c2c(C)cccc12 225761710 JGFZVNNMEBZFIP-CALCHBBNSA-N 386.448 2.505 0 50 GFAA CCN(Cc1ccc(C(=O)N(C)C)cc1)c1cc(N2CCCC[C@H]2CO)ncn1 249294820 JXOOYOVEOGRTJX-IBGZPJMESA-N 397.523 2.556 0 50 GFAA Cc1noc(C)c1NC(=O)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 67739737 IFUZCEYDJYNIMW-UHFFFAOYSA-N 382.424 2.577 0 50 GFAA COc1ccc(C(=O)N(C)C2CCN(Cc3ncc(C)c(OC)c3C)CC2)nc1 463950508 YDDJFVYYRLZKEC-UHFFFAOYSA-N 398.507 2.847 0 50 GFAA Cc1oc2ncn(C)c(=O)c2c1C(=O)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 118521980 XXOQBBBKSVRQIN-GFCCVEGCSA-N 396.230 2.605 0 50 GFAA O=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccncc1 67817797 RCEAZYIRWBQRRO-HSZRJFAPSA-N 392.503 2.895 0 50 GFAA CC[C@@H](CO)N(Cc1ccc(CN(C)S(C)(=O)=O)o1)Cc1ccccc1C 63844611 YDCIYWFOGKXOEU-SFHVURJKSA-N 394.537 2.753 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](C(=O)O)N(C(=O)C2CC2)C3)cc1C 72474429 SDMLWXALLOHPAU-GOSISDBHSA-N 384.476 2.621 0 50 GFAA Cc1nc(CN2CCC(C(=O)Nc3ccn(Cc4ccncc4)n3)CC2)cs1 171680868 SSVJAIBMJOQXDP-UHFFFAOYSA-N 396.520 2.942 0 50 GFAA C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(Br)c(C(=O)O)c2)C1 37300696 MREQQDIYHPEDFV-AOOOYVTPSA-N 376.272 2.814 0 50 GFAA C[C@H](C1CCN(C(=O)c2cc(-c3ccccc3)n(C)n2)CC1)N1CCOCC1 72456867 VAWFODJZHSWUGE-QGZVFWFLSA-N 382.508 2.660 0 50 GFAA COc1cc(C(=O)N[C@@H]2CCc3[nH]ncc3C2)ccc1OCc1cscn1 172033643 HOMHTEZPDBGGLQ-CQSZACIVSA-N 384.461 2.741 0 50 GFAA Cc1ccc(Cl)c(C(=O)N[C@@H]2CCN(Cc3c(C)noc3C)C[C@H]2O)c1 426421730 DZCMFQMDNGJAFM-QZTJIDSGSA-N 377.872 2.618 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)N[C@H]2CCCN(c3cnccn3)C2)cc1 95525546 VMHHMBBQNRRFOY-KRWDZBQOSA-N 377.452 2.761 0 50 GFAA O=C1C[C@@H](Nc2ccc(N3CCOCC3)cc2)C(=O)N1c1cccc(Cl)c1 95531958 MVEZEOUOYHGOHS-GOSISDBHSA-N 385.851 2.921 0 50 GFAA O=C(c1ccon1)N1CCC2(CCN(Cc3ccc(F)cc3)CC2)[C@H](CO)C1 97307515 TVFSVRFIFJVIMR-KRWDZBQOSA-N 387.455 2.551 0 50 GFAA O=C(NCCc1nc(-c2cccnc2)no1)c1cccc([C@@H]2CCCNC2)c1 95366830 WEPZSQPHRZSLDF-QGZVFWFLSA-N 377.448 2.571 0 50 GFAA COc1ccc(CNC(=O)c2cc(N3CCCC3=O)ccc2F)cc1C(=O)O 299752688 VBARGIDVMBLCBA-UHFFFAOYSA-N 386.379 2.589 0 50 GFAA COc1ccc(OC)c(-c2cccc(C(=O)N3CCN(CCCO)CC3)c2)c1 299769831 RHKLNEPGJOJBJN-UHFFFAOYSA-N 384.476 2.511 0 50 GFAA COCCn1ccnc1CN1CCC[C@@H](CNC(=O)c2ccc3c(c2)CCC3)C1 824466569 VUVALUJSPPXLST-SFHVURJKSA-N 396.535 2.660 0 50 GFAA CC(=O)Nc1ccccc1SCC(=O)NC[C@H]1CC(=O)N(C2CCCC2)C1 827846340 FACZNTGYUHUBLL-OAHLLOKOSA-N 389.521 2.644 0 50 GFAA O=C(CCn1cccn1)NCC1CCN(c2nnc(-c3ccccc3)s2)CC1 952975628 FULWDZHSPDCUHQ-UHFFFAOYSA-N 396.520 2.825 0 50 GFAA CC(C)c1nn(-c2ccccc2)cc1CN[C@H]1CCCC[C@H]1NS(C)(=O)=O 170085064 XWFUAFXVIYPJLR-RBUKOAKNSA-N 390.553 2.946 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)N1CCC([C@@H](O)c2cccs2)CC1 1506416471 BQJZIKCLOBFNAP-HXUWFJFHSA-N 397.500 2.820 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(Cc3ccc(CC(=O)O)cc3)C1)CC2 1704314699 RTMAJIPRZLSBIF-JOCHJYFZSA-N 380.492 2.650 0 50 GFAA COc1cccc(N2CCC(N3CC(=O)N[C@@H](Cc4ccccc4)C3)CC2)c1 1772712549 RVTPLCQAIFHNIP-IBGZPJMESA-N 379.504 2.707 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)c3c(C)nn4ncccc34)cn2)c1 1775978567 UJCRAUHTLIBAAT-UHFFFAOYSA-N 376.420 2.504 0 50 GFAA COCc1noc(CN2CCCN(C(=O)c3cc4ccccc4s3)CC2)n1 1772814410 XRYIVAWHRHBLQL-UHFFFAOYSA-N 386.477 2.779 0 50 GFAA O=C(NC[C@@H]1COCCO1)c1csc2nc(-c3ccccc3Cl)cn12 11664813 GENLQDSGXYIIPM-LLVKDONJSA-N 377.853 2.861 0 50 GFAA Cc1ccccc1N1CCN([C@H]2CCCN(C(=O)CCN3CCCCC3)C2)CC1 11667932 IYKHNULCHRBCBY-QFIPXVFZSA-N 398.595 2.984 0 50 GFAA O=C(NCc1ccc(Cl)s1)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 11937193 QEWIECWZTJMODU-CYBMUJFWSA-N 377.897 2.894 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCCn4cncn4)C3)C2)c1 12297461 QJCRNMSBCFQTGL-JOCHJYFZSA-N 381.524 2.881 0 50 GFAA COc1ccc(CNCc2cc(C)no2)cc1OC[C@H](O)CN1CCCCC1 12386020 PMBPVSPXAJSQML-GOSISDBHSA-N 389.496 2.507 0 50 GFAA Cc1c(CC(=O)NCc2cccnc2)c2c(n1C[C@@H]1CCCO1)CCCC2=O 12449297 GMQZGAQQXGKTEG-KRWDZBQOSA-N 381.476 2.748 0 50 GFAA COc1ccc(CCN2C[C@H](NC(=O)Nc3ccccc3OC)CC2=O)cc1 12714405 YHJGTYSAVQVERK-MRXNPFEDSA-N 383.448 2.669 0 50 GFAA CCOC(=O)[C@@]1(CCOc2ccccc2)CCCN(C(=O)Cn2cccn2)C1 15074425 HGGZLSVKQUVFJX-OAQYLSRUSA-N 385.464 2.524 0 50 GFAA O=C(CN1CCCCC1=O)NCc1cccnc1Oc1ccc(F)cc1F 15077924 XAIGODWQBLWAID-UHFFFAOYSA-N 375.375 2.781 0 50 GFAA Cc1nc(N2CCCC2)ncc1-c1ccc2c(=O)[nH]c(N3CCCCC3)nc2n1 169681455 YVZZYZXVBJBYFI-UHFFFAOYSA-N 391.479 2.674 0 50 GFAA CC[C@@]1(C(=O)NCCc2cccs2)C[C@@H]2CC[C@H]1N2C(=O)c1cncn1C 1857669955 GNTZMORADOYCHC-JNAXZKDPSA-N 386.521 2.614 0 50 GFAA CCCC(CCC)C(=O)N1CCC[C@]2(CO)CCN(Cc3nccn3C)C[C@@H]12 1704309505 XBOAZFXIXMBZHD-DENIHFKCSA-N 390.572 2.812 0 50 GFAA CN(C)c1nc2sc(C(=O)N[C@@H](CC(=O)O)c3ccccn3)cc2s1 1875291655 HPQIOVLYMUBJEO-JTQLQIEISA-N 376.463 2.765 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cccc4cc[nH]c34)C2)c1C 1875397106 LNBOOVXLNAWMNY-GOSISDBHSA-N 392.507 2.645 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)c3sccc3Cc3nn[nH]n3)cc2)c1C 1875356598 MORGCWJDPYYIKF-UHFFFAOYSA-N 379.449 2.907 0 50 GFAA CCc1oc2ccccc2c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(O)n2)C1 1875310559 UNKWJHPOWPVCLI-AWEZNQCLSA-N 393.443 2.988 0 50 GFAA COC(=O)c1ccc(N2C(=O)C[C@H](NCCc3ccc(Cl)cc3)C2=O)cc1 708719 NPNPAVVCZIDHJC-KRWDZBQOSA-N 386.835 2.591 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OC)c(C(C)(C)C)c2)CC1 6702147 RIPMRMLJPSMGBF-UHFFFAOYSA-N 383.510 2.957 0 50 GFAA CC(C)C1(C(=O)N2CC[C@]3(C2)c2ncn(C)c2CCN3C(=O)[C@H]2CC2(C)C)CC1 2325776797 AAXGAIYWHLILLY-MWTRTKDXSA-N 398.551 2.715 0 50 GFAA O=C(Oc1ccc(Cl)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1 1230481 AXUZGTLDBKMTJP-UHFFFAOYSA-N 381.837 2.580 0 50 GFAA Cc1cc(-n2nc(CC(N)=O)nc2[C@H]2CC[C@@H](N)CC2)nc2cc(Cl)ccc12 2356149746 AGXUDGJLBWLOCZ-XBXGTLAGSA-N 398.898 2.790 0 50 GFAA COc1ccc(NC(=S)N[C@@H](NC(=O)N(C)C)C(Cl)(Cl)Cl)cc1 3130674 ICUSXWNQFYTKHY-JTQLQIEISA-N 399.731 2.949 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2cc(-c3ccc(CC)cc3)[nH]n2)CC[C@H]1O 2356161092 GAURHUDXAUYDNA-WIYYLYMNSA-N 385.464 2.717 0 50 GFAA O=C(C[C@H]1CS(=O)(=O)C[C@@H]1CC(=O)Oc1ccccc1)Oc1ccccc1 4076200 GVCFLJQZKCZCLA-HOTGVXAUSA-N 388.441 2.639 0 50 GFAA CCOc1c(I)cc(CN[C@@H](CC)CO)cc1OC 4670854 RMMJAYHZDJQZTQ-NSHDSACASA-N 379.238 2.559 0 50 GFAA C[C@@H](Sc1nnc(-c2cccnc2)n1C)C(=O)Nc1ccc2c(c1)OCO2 9304387 WYSNQXWGHIPBCD-LLVKDONJSA-N 383.433 2.725 0 50 GFAA Cc1cnn(C)c1NC(=O)Cn1ccc(-c2cnn(-c3ccc(F)cc3)c2)n1 23214534 ALVBHAXIXHPQHM-UHFFFAOYSA-N 379.399 2.556 0 50 GFAA CN1CCN(CCOCc2ccccc2)CC12CCN(C(=O)c1ccco1)CC2 67739949 CYABFFXTHSHTNO-UHFFFAOYSA-N 397.519 2.719 0 50 GFAA CCOc1ccc(-c2c(-c3ccccc3)ncn2Cc2nnn[nH]2)cc1CO 67842090 KNKWDJSRJBPHQI-UHFFFAOYSA-N 376.420 2.670 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccccc2CNC(=O)CCNC(=O)[C@H]2C[C@@H]2C)C1 229764581 IIQJQXAGHGWZPW-NYUBLWNDSA-N 385.552 2.943 0 50 GFAA O=C(CN1CC[C@H]2CCOC(=O)[C@H]21)Nc1ccccc1C(=O)Nc1ccccc1 230190876 PZCMPPNSIRKJQT-YWZLYKJASA-N 393.443 2.515 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(c3cc(N(C)C)ncn3)C2)cc1OC 72474461 MDSXIYURTVLUIT-SFHVURJKSA-N 399.539 2.703 0 50 GFAA C[C@@H]1CN(c2ccc(NCc3cnc(N4CCOCC4)nc3)cc2)C[C@@H](C)O1 124845381 GDFGYAXIEFAAJB-IAGOWNOFSA-N 383.496 2.539 0 50 GFAA NC(=O)c1ccc(-c2noc([C@H]3CCCN(C(=O)Cc4ccccc4)C3)n2)cc1 363948195 QFYMDVFVOGKFNS-SFHVURJKSA-N 390.443 2.784 0 50 GFAA CN(C)c1ncc(NC(=O)N2CCC(CN3CCc4ccccc43)CC2)cn1 154942286 CEELHCOFPOBVST-UHFFFAOYSA-N 380.496 2.849 0 50 GFAA Cn1nccc1[C@@H]1[C@H](C(=O)Nc2ccc3[nH]ccc3c2)CCC(=O)N1C1CC1 367932422 LDLWRHXCTWKLKW-UZLBHIALSA-N 377.448 2.982 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCCc3ccccc3)C2=O)c1 71753469 QXJBMQPNVVKKPV-QFIPXVFZSA-N 386.467 2.520 0 50 GFAA CCN1CCN(CCCN2CC3(CCN(C4CCCCC4)CC3)OC2=O)CC1 72434866 QKSASXFUTIVMER-UHFFFAOYSA-N 392.588 2.634 0 50 GFAA CCc1c(C(=O)N2CCCN(C3CC3)CC2)nnn1-c1ccc(OC(C)C)cc1 172837066 XRFSKEHAHKKCSX-UHFFFAOYSA-N 397.523 2.927 0 50 GFAA O=C(O)[C@H]1CN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)CCO1 238123403 PYYGEWYVHLBGFR-CQSZACIVSA-N 399.230 2.893 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1CCN(c2ccnc(N3CCCC3)n2)CC1 82230429 ZCXCQKWJMOSHSZ-UHFFFAOYSA-N 389.862 2.832 0 50 GFAA COc1c(C)cnc(CN(C)C(=O)NC2CCN(CCOC(C)C)CC2)c1C 176625878 ZPFLBECCSJCOJL-UHFFFAOYSA-N 392.544 2.738 0 50 GFAA COc1ccc(-c2ocnc2C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 288329889 LNOQJGPFXLQSHW-LBPRGKRZSA-N 383.370 2.964 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N(C[C@@H]2CC=CCC2)C[C@H]2CCCO2)cc1 227170233 QSAIKWFLQNXUQZ-NVXWUHKLSA-N 379.478 2.911 0 50 GFAA C[C@@H](NC(=O)c1cc(=O)n(-c2ccccc2)[nH]1)c1ccc2c(c1)OCCCO2 222993390 JURIKXFEZIDMST-CQSZACIVSA-N 379.416 2.818 0 50 GFAA Cc1cccc(CC(=O)NCc2cc3n(n2)CCCN(C(=O)C2CCC2)C3)c1 91391365 LGZJLNRAIALDRR-UHFFFAOYSA-N 380.492 2.583 0 50 GFAA CNc1cc(C)nc(N2CCC[C@]3(CCC(=O)N(Cc4ccccn4)C3)C2)n1 91655906 SSYMDBFFCOUYME-NRFANRHFSA-N 380.496 2.631 0 50 GFAA CCc1nc(CNC(=O)N2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)no1 426380257 ABTQIVAQKHOAID-ZWKOTPCHSA-N 380.448 2.845 0 50 GFAA COc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2cc3ncccn3n2)cc1 97698757 UQKNGKWIQGIJIC-GOSISDBHSA-N 380.448 2.602 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3ncnc4c3ncn4C3CC3)CC2)cc1 292389404 IBUPEWQQZWUQNR-UHFFFAOYSA-N 376.464 2.686 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2C[C@H](N(C)C)Cc3ccccc32)nn1 179500216 BLTMLBKLMFLFDG-QGZVFWFLSA-N 379.439 2.848 0 50 GFAA CN(Cc1cnc(-c2ccccc2)s1)C(=O)CN1C(=O)COc2cccnc21 95517210 POQJBOCDGAJPIM-UHFFFAOYSA-N 394.456 2.589 0 50 GFAA O=C(NCCN1CCCCC1=O)Nc1ccc(OC[C@@H]2CCCCO2)cc1 299779254 QLBKTCXLLJHIDV-SFHVURJKSA-N 375.469 2.769 0 50 GFAA CN(C[C@H]1CCCN2CCCC[C@@H]12)C(=O)CCc1nc(O)c2ccccc2n1 299754355 CQEABHXMZGKDIQ-APWZRJJASA-N 382.508 2.991 0 50 GFAA biogenic O=C(c1cnc2c(c1)CCCC2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 299769440 XLRMAKXWNZNTRL-UHFFFAOYSA-N 379.460 2.647 0 50 GFAA Cc1c(NC(=O)CN(C)C)cccc1NC(=O)[C@H]1CC(=O)OC12CCCCC2 823678322 IWSKICDMRIYXJS-OAHLLOKOSA-N 387.480 2.700 0 50 GFAA CN(C[C@@H]1CCN(c2ccccc2)C1)C(=O)CCS(=O)(=O)c1ccccc1 952980224 YOGVTUOSKBHIOC-SFHVURJKSA-N 386.517 2.835 0 50 GFAA COc1ccc(NC(=O)c2cc(=O)n(C)c3ccccc23)cc1C(=O)N(C)C 952989751 TYCGLDDHCRRNEP-UHFFFAOYSA-N 379.416 2.501 0 50 GFAA CCc1nccn1CC(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565509170 KSORWENPHKTBFX-XLIONFOSSA-N 378.520 2.536 0 50 GFAA Cc1noc(C)c1CO[C@H]1COCC[C@@H]1NC(=O)c1ccc(-c2cc[nH]n2)cc1 1565509925 NHBVNOXAJASUFW-PMACEKPBSA-N 396.447 2.786 0 50 GFAA Cn1cc(C(=O)C[C@H]2CCCN2C(=O)[C@@H]2CCCN2Cc2ccccc2)cn1 269403679 DKUAXRBKBIIHFI-UXHICEINSA-N 380.492 2.649 0 50 GFAA CN(C)C(=O)C[C@@H]1CN(CC2CCS(=O)(=O)CC2)c2ccc(Cl)cc21 271188772 BVSLFUKPBOYKSU-CQSZACIVSA-N 384.929 2.547 0 50 GFAA C[C@@H](NC(=O)c1cc(Cl)cn1C)c1ccc(N2CCCS2(=O)=O)cc1 185845364 PPYDLASBSYYBPU-GFCCVEGCSA-N 381.885 2.709 0 50 GFAA CN(C)C1(CNC(=O)c2cccc(-c3noc(C(F)(F)F)n3)c2)CCOCC1 277691552 NQMVAIVCQJOBCV-UHFFFAOYSA-N 398.385 2.596 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@@H]1CC12CCOCC2)c1ccc(Br)cc1 170066328 ZFCBUZYFESATAV-UONOGXRCSA-N 382.254 2.898 0 50 GFAA CS(=O)(=O)c1ccc(N[C@H]2CCCc3ccccc32)c(S(C)(=O)=O)c1 170620541 ZRJBCVKTDRDCAP-INIZCTEOSA-N 379.503 2.983 0 50 GFAA CC[C@H](C(=O)OC)N(C)CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1 170602761 FBZACFGNGIVXDE-CABCVRRESA-N 389.477 2.902 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)[C@@H](C)n1ccc2ccccc2c1=O 279157449 HWRUZJGAGWNYPB-MRXNPFEDSA-N 392.459 2.741 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1C[C@H](CO)[C@H](c2ccsc2)C1 188880879 AJSIIEFHJDYLHN-YPMHNXCESA-N 392.424 2.559 0 50 GFAA CCS(=O)(=O)C1CCN([C@H](C(=O)N2CCCCC2)c2ccccc2)CC1 193243844 ULNJSWFMQHSSKI-IBGZPJMESA-N 378.538 2.639 0 50 GFAA C[C@@H]1CN(S(=O)(=O)CCc2ccc3c(c2)CCO3)c2ccc(F)cc2O1 193469273 ZWJIQFLFDMBVFM-CYBMUJFWSA-N 377.437 2.920 0 50 GFAA O=C(N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1)C1(CO)CC1 1529133196 GEMFENSUTOMWAG-VQTJNVASSA-N 381.428 2.829 0 50 GFAA CCOC(=O)N1CCC(N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)CC1 1529154067 XACRNWBFAOZNFE-UTKZUKDTSA-N 383.492 2.691 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)COc1ccc(Cl)cc1Cl 1704307944 AOFUNFSIAUPJFM-UHFFFAOYSA-N 385.295 2.994 0 50 GFAA Cc1ccc2c(CCNC(=O)c3cc(N4CCOCC4)no3)c(C)[nH]c2c1C 1772810108 IZUXFHZHQBZNFZ-UHFFFAOYSA-N 382.464 2.890 0 50 GFAA Cc1ccccc1-n1nnnc1SCC(=O)Nc1ccc2nccnc2c1 5346068 LBNGLZOVPXDKBU-UHFFFAOYSA-N 377.433 2.645 0 50 GFAA O=C(N[C@@H]1CCCc2nc(N3CCC(CO)CC3)ncc21)c1ccc(F)cc1 12706233 KTODXFPVZDSSTD-GOSISDBHSA-N 384.455 2.632 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNCc2ccc(Cl)c(F)c2)CC1 14970793 IUVAOYQHEZHGCL-UHFFFAOYSA-N 376.863 2.832 0 50 GFAA Cc1ccc(C(=O)N2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)cc1 15065618 JMLSCIFKKJDTPP-QGZVFWFLSA-N 382.464 2.644 0 50 GFAA COCc1ccc(CN2CCC[C@H](CNS(=O)(=O)Cc3ccccc3)C2)o1 15068611 FBYGNVRTBGDJGX-GOSISDBHSA-N 392.521 2.758 0 50 GFAA COc1cccc(C[C@]2(CO)CCCN(C(=O)c3[nH]nc4c3CCCC4)C2)c1 19745227 CTXGBSNGNHGFJN-JOCHJYFZSA-N 383.492 2.755 0 50 GFAA CCCN1C[C@H](n2ccnc2-c2cnc(=NCc3ccccc3)[nH]c2)CC1=O 1857670055 NLPBJWPAUHBLCX-GOSISDBHSA-N 376.464 2.558 0 50 GFAA O=S(=O)(N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1nccs1)C2)c1ccc(Cl)cc1 1857704958 MIHINWVQKJBKGS-LAQFHYBYSA-N 397.953 2.985 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)cc1O 1857706306 PTDDBCAQZKQPEE-QFIPXVFZSA-N 395.459 2.894 0 50 GFAA COc1ncccc1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857717282 PFBHZYAQRAEXEJ-PMACEKPBSA-N 381.476 2.768 0 50 GFAA O=C(O)CCN(C(=O)c1ccn(-c2ccccc2Cl)n1)C1CCOCC1 238079605 MRQRQFZNWWSGDB-UHFFFAOYSA-N 377.828 2.622 0 50 GFAA COc1cc2nc(NC3CCN(Cc4ccccn4)CC3)nc(N)c2cc1OC 264680890 ZSHSEGZDTVZDPT-UHFFFAOYSA-N 394.479 2.701 0 50 GFAA O=S(=O)(CCCCF)Nc1cc(N2CCOCC2)ccc1Br 864096575 JHVDPYWVVYIDIX-UHFFFAOYSA-N 395.294 2.777 0 50 GFAA COc1cc(CNC(=O)N2CC[C@@H](C)C2)ccc1CNC(=O)N1CC[C@H](C)C1 1875272647 CDPHKWZEFONLGU-CVEARBPZSA-N 388.512 2.798 0 50 GFAA Cc1cn2c(n1)[C@H](C)C[C@H](C(=O)N1CCc3c(ccc(F)c3F)[C@@H]1C(=O)O)C2 1875304252 FGYFZRVWEJWGQU-YOIRWDDOSA-N 389.402 2.804 0 50 GFAA COC(=O)c1nc2ccc(NC(=O)c3nnc(O)c4ccccc34)cc2s1 1875336028 QHZTVFAXXPXWOM-UHFFFAOYSA-N 380.385 2.984 0 50 GFAA Cc1ccccc1Oc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)nc1 1875402511 IFVJIYHCQYAZTJ-NSISKUIASA-N 392.459 2.948 0 50 GFAA C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1cnc(C2CC2)s1 888101357 LLELYYZMYPESGT-ZWNOBZJWSA-N 377.491 2.577 0 50 GFAA CCn1cnc2c(N3CC[C@]4(NC(=O)[C@@H]5C[C@H]5C5CC5)CCC[C@@H]34)ncnc21 1775990173 DLJUUFOODXRCGZ-YJPQMCDFSA-N 380.496 2.510 0 50 GFAA O=C(CN1C(=O)CCCc2ccccc21)N[C@@H]1CC[C@@H](C(=O)O)CCC1(F)F 2325797865 YYPSCYDANZVXPW-GDBMZVCRSA-N 394.418 2.751 0 50 GFAA Cc1cccc(Oc2cc(CNC(=O)C(C)(C)[C@]3(O)CCNC3)ccn2)c1C 2325800745 DOOMETUONVGYDS-QFIPXVFZSA-N 383.492 2.858 0 50 GFAA O=C1NC[C@H]2CN(CCC23CCC3)C(=O)CCNCC=CCc2ccccc21 2325893986 DASHPYRHDLFDNY-IBGZPJMESA-N 381.520 2.527 0 50 GFAA COc1cc(NS(=O)(=O)c2ccc(Nc3ccco3)cc2)nc(OC)n1 1232269 KEQFNFKDSQUPFY-UHFFFAOYSA-N 376.394 2.631 0 50 GFAA Cc1ncccc1CN1C(=O)[C@@]2(CCN(Cc3nccn3C)C2)c2ccccc21 2356154471 XHZYHARVMMPHOP-HSZRJFAPSA-N 387.487 2.814 0 50 GFAA COC(=O)[C@@H]1C(=O)C[C@@H](c2ccc3c(c2)OCO3)[C@H]1c1ccc2c(c1)OCO2 4532599 LGIWOAOMGYWGOB-CJMONDIMSA-N 382.368 2.773 0 50 GFAA COc1cc([C@H]2NC(=O)c3c(sc4c3CCN(C)C4)N2)cc(OC)c1OC 4854417 OXRWNDWIIGBRPZ-KRWDZBQOSA-N 389.477 2.616 0 50 GFAA O=C(CSc1ccncc1)N1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 55052767 FACHVKDWMXLWLA-HXUWFJFHSA-N 396.560 2.987 0 50 GFAA O=C1NCCN(C(=O)c2cc(COc3ccccc3)on2)[C@@H]1c1ccc(F)cc1 12057984 HFZHQVBFVAJWHR-LJQANCHMSA-N 395.390 2.706 0 50 GFAA Cn1cc(-c2ccccc2)c(NC(=O)NCCC(=O)NCc2ccccc2)n1 252485546 GYKOHXNATAUSMT-UHFFFAOYSA-N 377.448 2.915 0 50 GFAA O=C(Nc1cccnc1N1CCC(CO)CC1)c1ccc(OC(F)F)cn1 483041590 ASCHAUXYEBLLSR-UHFFFAOYSA-N 378.379 2.539 0 50 GFAA O=C(CCCc1cccs1)N[C@@H]1COCC[C@H]1Oc1ccc(CO)cc1 219933397 ISFCUZGBIYSICF-RTBURBONSA-N 375.490 2.916 0 50 GFAA O=S(=O)(c1cnc2ccccc2c1)N1CCC[C@H](c2nncn2C2CC2)C1 330286734 AVTQFXKXNWEBMR-HNNXBMFYSA-N 383.477 2.730 0 50 GFAA COCCN1C[C@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)CC1=O 122537431 PALOAPQWESEEII-OAHLLOKOSA-N 378.432 2.663 0 50 GFAA O=C1CC2(CCN(C(=O)[C@@H]3CCCO3)CC2)CN1Cc1ccc(Cl)cc1 77387572 CZCMOPXWFXZSSF-KRWDZBQOSA-N 376.884 2.860 0 50 GFAA O=C(COCc1ccccc1)N1CCn2nc([C@@H](O)c3ccccc3)cc2C1 218899839 KCCBDGLQNCWWRZ-QFIPXVFZSA-N 377.444 2.524 0 50 GFAA O=C([C@H]1Cc2cc(F)ccc2O1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 172594863 CARWQKYPLUCULM-LJQANCHMSA-N 381.407 2.636 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3C[C@@H](C)Oc4ccc(C)cc43)CC2)n1 175060203 KSGFWBUQDZIDDZ-OAHLLOKOSA-N 382.464 2.824 0 50 GFAA Cc1ccc(N2CC[C@H](Nc3cc(C(=O)N4CCOCC4)ccc3C)C2=O)cc1 177209795 WYSMXRPKMRBHKT-FQEVSTJZSA-N 393.487 2.993 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H]1O[C@H](n2cc(F)c(N)nc2=O)CS1 85210707 AUTCQXVTOIJYOT-AYWUYMJWSA-N 399.488 2.557 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(-c3ccc(F)cc3)nc21 20616291 LEYLFPRWYVBYGH-UHFFFAOYSA-N 389.408 2.693 0 50 GFAA CN(C)[C@H]1CCN(C(=O)Nc2ccc(-n3cnc4ccccc43)cc2)C[C@@H]1O 95502008 ALWBOOYPBNXOSQ-PMACEKPBSA-N 379.464 2.554 0 50 GFAA CC(=O)NCc1ccc(N2CCC(c3nccn3Cc3cccnc3)CC2)nc1 95501506 ZCYFDLWVLHVVRJ-UHFFFAOYSA-N 390.491 2.742 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCc1cnn2cccnc12 97729987 LJJJRFBIFMDNAS-UHFFFAOYSA-N 378.436 2.595 0 50 GFAA CC(=O)Nc1ccsc1C(=O)N1CCC2(CC1)Nc1ccccc1NC2=O 91665777 WDGMRSIINHSBIJ-UHFFFAOYSA-N 384.461 2.746 0 50 GFAA O=C1[C@H]2O[C@H]2C(=O)[C@H]2[C@@H]1[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 238856703 WXYXLXQSWBFNEH-AZKZZTNASA-N 396.868 2.984 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)N(Cc1ccsc1)C1CCCC1 95512015 UESNYUZCXLXRLG-UHFFFAOYSA-N 386.521 2.876 0 50 GFAA CNC[C@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237082261 SCYXNYFMULZXRV-CYBMUJFWSA-N 377.286 2.706 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(Cc4c(C)nn(C)c4C)C3)CCC2=O)cn1 91943047 ITIYMSKCNDUNFM-JOCHJYFZSA-N 396.539 2.540 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccco1)c1ccc(NC(N)=O)cc1 299026091 PZEPWSNVLUMGTR-XJKSGUPXSA-N 384.436 2.642 0 50 GFAA Cc1ccc(NC(=O)N2CCCN(C3CCCC3)CC2)cc1S(C)(=O)=O 180264473 QXVVWVBSDNHQHV-UHFFFAOYSA-N 379.526 2.881 0 50 GFAA Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NCc1cccc(CN2CCOCC2)c1 180795346 QVBVWIGIMXMETK-FQEVSTJZSA-N 397.523 2.905 0 50 GFAA COCc1cc(NC(=O)N2CCC(CN3CCc4ccccc43)CC2)ncn1 181035311 LIVXOGYIYZZRBF-UHFFFAOYSA-N 381.480 2.930 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)CCO1 299752614 UTUSSHLZFYBDQD-ZCNNSNEGSA-N 381.428 2.681 0 50 GFAA CCC(=O)N1CCOC[C@]2(CN(Cc3ccccc3-c3ccco3)CCO2)C1 72130869 UIDANMCFTJHWQP-QFIPXVFZSA-N 384.476 2.786 0 50 GFAA COc1ccccc1[C@@H]1CCCN1CC(=O)Nc1nc(C)c(C(=O)O)s1 299784828 MYOHYDNQHLLTHB-ZDUSSCGKSA-N 375.450 2.934 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccccc1OC[C@@H]1CCCO1 827861556 RCKGMRWGLJMOKP-HNNXBMFYSA-N 379.416 2.593 0 50 GFAA Cc1cc2nc(CN(C)C(=O)N[C@@H]3CCCN(C(=O)C(C)C)C3)[nH]c2cc1C 584894978 UCYSBQZIBQVDSK-MRXNPFEDSA-N 385.512 2.968 0 50 GFAA O=C(CCN1C[C@@H]2CC[C@H]1CN(c1ncccn1)C2)NCc1ccc(Cl)cc1 1565510152 DTTQBOZCNXEOPR-HKUYNNGSSA-N 399.926 2.737 0 50 GFAA Cc1nc2c(c(N3CCC[C@H](c4[nH]ncc4CN4CCOCC4)C3)n1)CCCC2 275562428 IHUYXGIZPGHPBU-KRWDZBQOSA-N 396.539 2.603 0 50 GFAA O=C(Nc1ccc(O[C@H]2CCOC2)cc1)c1cnn(CCO)c1-c1ccccc1 170614644 RNDIVTJERPWNNJ-IBGZPJMESA-N 393.443 2.962 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)CCc3cc(Cl)no3)C1)CC2 1704344733 XSOGKVLDHUMMIQ-LJQANCHMSA-N 389.887 2.623 0 50 GFAA CCOc1cc(CN2CC[C@H]3[C@H](CCC(=O)N3CCOC)C2)ccc1OC 12132259 AHPADJXWTBXPMS-MSOLQXFVSA-N 376.497 2.553 0 50 GFAA O=C(NCc1cnn(-c2ccccc2)n1)[C@H]1CC(Cc2cccc(Cl)c2)=NO1 12455520 JSSPMXWYJAVVET-LJQANCHMSA-N 395.850 2.925 0 50 GFAA CC(C)CCN1C(=O)N(CCN(C)C)C(=O)C12CCN(CC(C)(C)C)CC2 14733807 VRPXZQNXEUFAJH-UHFFFAOYSA-N 380.577 2.739 0 50 GFAA Cc1cc(OCC(=O)N[C@@H](c2nc(-c3nnc[nH]3)no2)C(C)C)ccc1Cl 154329512 KRYYMNNTZADBBO-CQSZACIVSA-N 390.831 2.709 0 50 GFAA CCS(=O)(=O)N1CCCOc2cccc(c2)CC[C@@H]2CCCCN2CC1 1857698241 ZFRDDDXZLQYHFW-IBGZPJMESA-N 380.554 2.908 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4F)C[C@]34CC[C@H]2O4)cn1 1857715480 UEGWWJRLCFCRGR-KLJZETAQSA-N 395.478 2.939 0 50 GFAA Cc1cncc(N2CCC[C@](O)(CN(C)Cc3cc4cc(F)ccc4[nH]3)C2)n1 1857734266 GWTGSTGYZZMKEK-NRFANRHFSA-N 383.471 2.869 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N4CCc5nocc5C4)CC3=O)sc2c1 1857735574 FOVCFQOOLWBWEQ-GFCCVEGCSA-N 382.445 2.531 0 50 GFAA O=C(c1cnc2cccnn12)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1875250342 QEZLAVVXMODUFP-IEBWSBKVSA-N 392.459 2.617 0 50 GFAA O=C([C@H]1C[C@H](O)C1)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1875251327 YOLSVCWPGFZGPI-IDPBPBMLSA-N 381.428 2.827 0 50 GFAA COCCCCNC(=O)Nc1ncnc2c1c(C)c(C)n2C[C@H]1CCCO1 225679477 ILCPVWRNQOAUKM-OAHLLOKOSA-N 375.473 2.775 0 50 GFAA Cc1cccc(NC(=O)CN2CCN(Cc3ccc(C(=O)O)cc3)CC2)c1C 263580533 WAVIJQMIAGJIFL-UHFFFAOYSA-N 381.476 2.758 0 50 GFAA CC(=O)Nc1ccc(CNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)cc1 811998554 ZRWOIXFTDATIEH-MRXNPFEDSA-N 375.375 2.726 0 50 GFAA Cc1ccc([C@](O)(Cc2noc(-c3nnc4ccccc4n3)n2)C(F)(F)F)o1 810304856 WNCLDSFJHVNXPS-MRXNPFEDSA-N 391.309 2.969 0 50 GFAA Cc1ccc(C[C@H](CO)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCC2)cc1 817595120 QBRGTWLJNXAGHV-MSOLQXFVSA-N 376.497 2.708 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccccc2SCc2cn3ccccc3n2)CN1 1875252945 MVFTWTZDGKGDPR-CQSZACIVSA-N 380.473 2.635 0 50 GFAA O=C(N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1)[C@@]1(F)CNCC12CCC2 1875292796 SVIHXEZFPTZIAQ-GUYCJALGSA-N 397.376 2.511 0 50 GFAA C[C@@H](c1noc(-c2cc(Br)cc3nc(O)[nH]c23)n1)n1ccnc1 1875270675 MXBFOVJCGZOURD-ZETCQYMHSA-N 375.186 2.887 0 50 GFAA O=C(c1cccc(CS(=O)(=O)c2ccccc2)c1)N1CCNC[C@H]1C1CCC1 1875287381 HZWZLIBSVWPEHX-NRFANRHFSA-N 398.528 2.875 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(F)c(COCC2CC2)c1 1875403129 QNVFKPHGGPCYFP-CWFSZBLJSA-N 387.455 2.518 0 50 GFAA CN1C(=O)[C@H](CC(=O)Nc2ccc(F)cc2)N(Cc2cccs2)C1=S 1077792 FXLDSWUHIFVNKM-AWEZNQCLSA-N 377.466 2.844 0 50 GFAA CCOC(=O)C1=C(c2ccccc2)NC(=S)N[C@H]1c1ccc2c(c1)OCO2 1111796 RYCRCHGBIHEQSL-SFHVURJKSA-N 382.441 2.909 0 50 GFAA O=C(OCCc1ccc2c(c1)CCO2)[C@@H]1CCCCN1C(=O)c1cccnc1 2325740419 RGJNRVYLPRFBPR-IBGZPJMESA-N 380.444 2.797 0 50 GFAA C[C@@H](Sc1nncn1C)c1cccc(NC(=O)c2ccn(CCN(C)C)n2)c1 2325800721 CQVVSOCWGLBWBU-CQSZACIVSA-N 399.524 2.679 0 50 GFAA Clc1cccc(-c2nccc(=NCc3ccnc(N4CCNCC4)c3)[nH]2)c1 2325859925 QBNFEGOTVIHBLX-UHFFFAOYSA-N 380.883 2.636 0 50 GFAA CCOC(=O)c1ccc(NC(=O)Cn2cnc3sc(CC)cc3c2=O)cc1 958876 ANVROPKCSWPPKP-UHFFFAOYSA-N 385.445 2.836 0 50 GFAA CCn1ncc(Br)c1C(=O)Nc1sc2c(c1C(N)=O)CCC2 2487645 SNTVXAWGEXKZDV-UHFFFAOYSA-N 383.271 2.567 0 50 GFAA O=C(C1Cc2ccccc2C1)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356148981 CIBVMEXWQSCNGX-XMMPIXPASA-N 389.499 2.980 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCO[C@H]4C[C@H](CO)C[C@@H]43)ncnc21 2356166022 TYISECWXAHUCCA-NJAFHUGGSA-N 387.528 2.801 0 50 GFAA CCN(C[C@@H]1CCCO1)C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 225517946 ZRBZVINPPOURTE-AWEZNQCLSA-N 389.521 2.754 0 50 GFAA CCn1cc(-c2cc(C(=O)N(C)Cc3nncn3C)c3ccccc3n2)cn1 63847245 HYQJAQXUXJAUEW-UHFFFAOYSA-N 375.436 2.519 0 50 GFAA Cn1c(CNC(=O)c2cc(COc3ccccc3F)[nH]n2)nc2ccccc21 67954636 DUDWTKWXDIFWHI-UHFFFAOYSA-N 379.395 2.945 0 50 GFAA Cc1n[nH]c(C)c1C[C@H](C)N1CCn2nc(C(=O)Nc3ccccc3)cc2C1 67851508 UDAXDNONMLHTPR-AWEZNQCLSA-N 378.480 2.922 0 50 GFAA O=C1N[C@](Cc2ccccc2Cl)(C2CCNCC2)C(=O)N1Cc1cccnc1 67789525 OEGRKTJJCYCYIW-OAQYLSRUSA-N 398.894 2.768 0 50 GFAA COC(=O)c1cccc(N2CC(=O)N(Cc3nc4ccccc4nc3C)C2=O)c1 470826517 PFAYXZXEZIZWFK-UHFFFAOYSA-N 390.399 2.694 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1nn(Cc2cccc(F)c2)cc1Cl 2804898 LIGRTWTVCQDEGS-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA COc1ccc(NC(=O)c2nnc(CN(CCO)[C@@H]3CC[C@@H](C)C3)s2)cc1 252527926 DSHSBABRMKTSKS-UKRRQHHQSA-N 390.509 2.782 0 50 GFAA CC(C)c1ccc(C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)nc1 368667473 RWFLXYGMJGGKMB-SJORKVTESA-N 379.460 2.854 0 50 GFAA Cc1ccnn1CC(=O)N1CC[C@H]2[C@H](CCC(=O)N2CCC2=CCCCC2)C1 219510586 RKMREKMYBLGVPY-UXHICEINSA-N 384.524 2.922 0 50 GFAA NC(=O)c1cccc(C[C@H]2CCN(C(=O)Cc3ccc(F)c(F)c3F)C2)c1 72143095 ANABPQYTFYATJH-CYBMUJFWSA-N 376.378 2.837 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3ccc(F)c(Cl)c3)CC2=O)c1 77377071 NFRHYZHYEGGNRG-UHFFFAOYSA-N 376.815 2.972 0 50 GFAA O=C(c1ccc(N[C@H]2CCCOC2)nc1)N1CCC(Oc2cccnc2)CC1 71754347 PRHBKSDAXUGRLP-KRWDZBQOSA-N 382.464 2.751 0 50 GFAA O=C(O)[C@@H]1CC2(CCNCC2)CN1C(=O)CSCc1ccccc1Cl 72159326 ZXVDXIJIYNCGCL-HNNXBMFYSA-N 382.913 2.629 0 50 GFAA O=S(=O)(Cc1ccc(F)cc1)N[C@@H]1COCC[C@@H]1OCc1ccccc1 222774475 SWGSXAGIOITOJE-MOPGFXCFSA-N 379.453 2.619 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)[C@H]3C[C@H]3c3cccnc3)cc(Cl)c2O1 242339244 ZGEQMSSRRRYPOO-ONERCXAPSA-N 392.864 2.667 0 50 GFAA Cn1c(CNC(=O)N2CCC(OCc3ccccn3)CC2)nc2ccccc21 426530425 MFRIJDWXTLMISP-UHFFFAOYSA-N 379.464 2.859 0 50 GFAA CCn1nc(C)c(CNC(=O)N2CCN(C3Cc4ccccc4C3)CC2)c1C 426717058 YBJKENANTOOLQT-UHFFFAOYSA-N 381.524 2.514 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3cc[nH]n3)csc2C1 426509378 MSCNKZLLUSJQOW-UHFFFAOYSA-N 385.493 2.607 0 50 GFAA Cn1nc(C2CC2)cc1NC(=O)Cn1ccc(-c2ccc3c(c2)OCCO3)n1 48501575 ISITZKKCTOIYIJ-UHFFFAOYSA-N 379.420 2.571 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)NCc3cn4c(C)cccc4n3)CC2)nc1 426589725 FRZKLGGTIUZHCQ-UHFFFAOYSA-N 379.464 2.539 0 50 GFAA COc1cccc(N2CCN(C(=O)c3cccc(-c4ncc[nH]4)c3)CC2=O)c1 82148417 WRPPRGKFDMJUEC-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1C[C@H](CO)[C@H](CN2C[C@H](C)O[C@H](C)C2)C1 91656240 GUSMBYKANPMJGL-CYGHRXIMSA-N 378.513 2.501 0 50 GFAA NCCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1cccc(-c3ccccc3)c1)CC2 91792785 DAQYATBPRDKANN-RTWAWAEBSA-N 380.488 2.685 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1CN(C(=O)C(F)(F)F)c1ccccc1 239046276 FMKSDXUBMCDTLT-YZXKGSGOSA-N 390.361 2.593 0 50 GFAA O=C(N1CCCC1)N1CC[C@]2(O)CCN(Cc3ccccc3Cl)C[C@@H]2C1 95375234 ZIGVNTOLRMGBNV-YLJYHZDGSA-N 377.916 2.815 0 50 GFAA Cc1ccccc1C1(C(=O)Nc2cnn(CC(=O)N3CCOCC3)c2)CCCC1 291739138 CUBXLVAUCOVYCZ-UHFFFAOYSA-N 396.491 2.501 0 50 GFAA Cc1c(CN2C[C@@H](CN3CCOCC3)[C@@H](CO)C2)[nH]c2ccc(Cl)cc12 91505620 DHSJGQGJJMWSPA-HZPDHXFCSA-N 377.916 2.502 0 50 GFAA O=C1CC2(CCN(C(=O)N3CCCC3)CC2)CN1Cc1cc(F)cc(F)c1 91679653 NKLCRLLFBKAEMD-UHFFFAOYSA-N 377.435 2.995 0 50 GFAA Cc1csc(S(=O)(=O)N2CCC[C@]3(CCC(=O)N(CC4CC4)C3)C2)c1 91876845 DEGXIEZAXQJPFS-GOSISDBHSA-N 382.551 2.860 0 50 GFAA O=C(c1ccc2[nH]c(=O)[nH]c2c1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 179910189 QXSOWFJMKKOUML-UHFFFAOYSA-N 379.342 2.549 0 50 GFAA O=C1NC(=O)[C@@]2(Cc3ccccc3N3CCCC[C@H]32)C(=O)N1c1ccccc1 247964999 YXXRVSYQDSBZML-AVRDEDQJSA-N 375.428 2.871 0 50 GFAA CCc1nn(C)c(OC)c1CNC(=O)NCc1ccccc1CN1CCCC1 180284923 VOKBJCULBQUBON-UHFFFAOYSA-N 385.512 2.586 0 50 GFAA O=C(CN1CCC(c2ccccc2)CC1)N[C@H](c1ccccn1)[C@H]1C[C@@H](O)C1 243893175 AOVOWYRUSWOFNG-MZKRTTBSSA-N 379.504 2.889 0 50 GFAA O=C(NCCCC(=O)N1CCCC[C@@H]1c1nc2ccccc2[nH]1)c1cnccn1 253402952 GUQZOKJOEDQLRZ-GOSISDBHSA-N 392.463 2.617 0 50 GFAA Cn1ccc2c(NC(=O)CC[C@H]3N=C(O)N(Cc4ccco4)C3=O)cccc21 252527604 CZKBWUZYYFXVHI-MRXNPFEDSA-N 380.404 2.815 0 50 GFAA Cc1n[nH]c(C)c1[C@@H](C)NC(=O)c1ccc(-c2cc(N(C)C)nc(N)n2)cc1 534640108 NGDQURGJUAJYIL-LLVKDONJSA-N 379.468 2.623 0 50 GFAA CN(C)c1cncc(-c2cccc(C(=O)NCc3csc(N(C)C)n3)c2)n1 534665377 SOCKSGBSIDRHKD-UHFFFAOYSA-N 382.493 2.662 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)N=c1[nH]n(C)c3cccc(Cl)c13)CC(=O)N2 1940196617 VYMZATOSANHOCE-GFCCVEGCSA-N 384.823 2.722 0 50 GFAA CC[C@H]1CN(CC(=O)NCC[C@H]2CCCN2C)Cc2ccc(Cl)cc2O1 299771514 PXHRDUSIZPMQND-MSOLQXFVSA-N 379.932 2.914 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)[C@H]3CN(C)c4ccccc4O3)cc2)CC1 823764835 JZMWZBPMTLZJNT-OAQYLSRUSA-N 381.476 2.996 0 50 GFAA CC(C)C(=O)N1CCC[C@@H](NC(=O)N2CC(Oc3cccc(Cl)c3)C2)C1 584888967 OBKIESZWURGTLZ-OAHLLOKOSA-N 379.888 2.760 0 50 GFAA C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)[C@H]2CSCN2C(=O)C2CCCC2)C1 408260099 DCHCXDIXVODQDK-QTUASDBPSA-N 394.581 2.866 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccn1C1CCCC1 185394934 NIQPQSDJVMGTQH-FQEVSTJZSA-N 395.503 2.803 0 50 GFAA NC(=O)C1CCN(Cc2cccc(NC(=O)c3coc(C4CCC4)n3)c2)CC1 194056691 LKIIRLHGVCNIPY-UHFFFAOYSA-N 382.464 2.892 0 50 GFAA C[C@H](NC(=O)c1cnn2ccccc12)c1cc(F)ccc1N1CCC(O)CC1 755461411 NWIYQZZBNQXVLL-AWEZNQCLSA-N 382.439 2.926 0 50 GFAA O=C(N[C@@H](Cc1cnc[nH]1)C(=O)O)c1ccc(CSc2ccccn2)cc1 1506404053 AXLDJKAEIJJZLJ-INIZCTEOSA-N 382.445 2.523 0 50 GFAA CC(=O)c1ccc(N2CN=c3s/c(=C\C=C\c4ccccc4)c(=O)n3C2)cc1 1137473 QTJPDCWLTGUGAP-AWUCTABVSA-N 389.480 2.661 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)CCc3n[nH]c4c3CCCC4)C1)CC2 1704337863 FZTAWKBWBDGMHE-JOCHJYFZSA-N 379.508 2.826 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)Cc2nc(C)cs2)CCC1=O 11873587 LMRPPJJKIIOEKW-MRXNPFEDSA-N 387.505 2.857 0 50 GFAA CCOC(=O)CN(C)Cc1cccc(OC[C@H](O)CN(C)C2CCCCC2)c1 12050836 INYLTGNHHVCGIK-HXUWFJFHSA-N 392.540 2.686 0 50 GFAA CCOC(=O)CN(C)C(=O)c1cc(COc2ccc(Cl)cc2OC)on1 12053428 BCKMEYVURRPLEU-UHFFFAOYSA-N 382.800 2.551 0 50 GFAA CN(C)C(=O)CCC(=O)N1CCC[C@@H](C(=O)c2ccc(C(F)(F)F)cc2)C1 12193584 DNNHEARXHBCDKP-CQSZACIVSA-N 384.398 2.995 0 50 GFAA O[C@@H](COc1ccccc1CNCCc1ccccc1)CN1CCSCC1 12716049 CPKVGTVMGHZETQ-OAQYLSRUSA-N 386.561 2.807 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1cc(F)ccc1F 14948645 YRRSKZWEXDKEGQ-GOSISDBHSA-N 384.390 2.544 0 50 GFAA CCc1csc(CCNC(=O)[C@H]2CCC(=O)N(Cc3ccccc3F)C2)n1 14952218 ZKJIJGZMKZMNCR-HNNXBMFYSA-N 389.496 2.942 0 50 GFAA Cc1nnc(SCC(=O)N[C@@H]2CCCN(CCc3ccccc3)C2)s1 14975103 CSUBTVDORYNEOZ-MRXNPFEDSA-N 376.551 2.762 0 50 GFAA Cc1ccccc1C(=O)N1CCCC[C@H]1CCn1cc(C(=O)NC2CC2)nn1 14994443 KUIGQXWBOUGSDM-KRWDZBQOSA-N 381.480 2.564 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCC[C@H]4CO)nc3)n2)c1OC 15072515 LOXQUOLJSLPQEV-AWEZNQCLSA-N 382.420 2.777 0 50 GFAA O[C@H](CN1CCNCC1)Cn1c2ccccc2c2cc(Br)ccc21 19288091 XVXPAKUWKWBDDA-OAHLLOKOSA-N 388.309 2.823 0 50 GFAA Cc1ccsc1CN1CCc2nnc(CNC(=O)c3ccccc3)n2CC1 19739607 YGCKQLIPFFQSOU-UHFFFAOYSA-N 381.505 2.636 0 50 GFAA COC(=O)C[C@H](c1ccc(OC(C)C)cc1)c1c(O)n2ccccc2nc1=O 205948729 BCJPQQHPGQQEQM-MRXNPFEDSA-N 382.416 2.882 0 50 GFAA O=S(=O)(CC1CCCC1)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857690248 YBKDIJLPHFEHNL-GBESFXJTSA-N 398.956 2.964 0 50 GFAA Cc1cnc(CN2CCC3(CC2)CN(CCCc2ccccc2)C[C@@H]3C(=O)O)[nH]1 1857691055 SXWZHBBSKRWGIT-HXUWFJFHSA-N 396.535 2.950 0 50 GFAA Cc1nc(-c2cccnc2)ncc1C(=O)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1C2 1857709012 ZOQRYKPVISOEAK-POAQFYNOSA-N 377.492 2.793 0 50 GFAA CN(CCNC(=O)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1)c1ccccc1 1857716786 FCPXTRKIDJNTKY-HNNXBMFYSA-N 394.500 2.902 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NCc1ncon1 1857723340 BDHDAHRDAUFYSE-LLVKDONJSA-N 375.816 2.787 0 50 GFAA Cc1ccc(F)cc1CNC(=O)[C@H]1CC(=O)N(c2nnc(C(C)C)s2)C1 1857726857 GJJRSFSTCPHUIE-ZDUSSCGKSA-N 376.457 2.778 0 50 GFAA O=C(c1cnc[nH]1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857735021 CUUUUGWYILRJSE-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA Cc1ccc(Br)c2c1C(C)(C)CN2S(=O)(=O)c1cnn(C)c1 225385983 YGDJWESSAZYCKQ-UHFFFAOYSA-N 384.299 2.978 0 50 GFAA CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(C(C)C)[nH]n1 265328247 FWSGCCWUWFBZTM-UHFFFAOYSA-N 382.386 2.940 0 50 GFAA Cc1ccc2occ(CC(=O)N3C[C@H](C(=O)O)C[C@H](c4cnn(C)c4)C3)c2c1 902496862 YJPFKVVCGDJLNC-LSDHHAIUSA-N 381.432 2.734 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C3CCN(C(=O)C4CCC4)CC3)C1)CC2 1704302675 BSAYEAHDSJMCLN-HSZRJFAPSA-N 397.567 2.614 0 50 GFAA Cc1ccc(C[C@@H](CO)NC(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCC2)cc1 817595126 QBRGTWLJNXAGHV-ROUUACIJSA-N 376.497 2.708 0 50 GFAA O=C(COc1ccc(Br)cc1F)N=c1cc[nH]c2cccnc12 821656332 FYCGLKIRQASOPO-UHFFFAOYSA-N 376.185 2.971 0 50 GFAA C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)N1Cc1cn(C[C@@H]2CCOC2)nn1 864097325 OYYKVDDDBVHWBN-NXOAAHMSSA-N 393.532 2.533 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)N1CC[C@H](O)CC12CC2)N1CCCCC1 1875289000 OUKCFDAZOBIZKT-PKOBYXMFSA-N 387.524 2.921 0 50 GFAA Cc1ccc2[nH]c(C(=O)NCC3(CO)CN(C(=O)OC(C)(C)C)C3)cc2c1C 1875329357 RRDIJGULIVTUJN-UHFFFAOYSA-N 387.480 2.744 0 50 GFAA O=C(Cc1ccncc1)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1875395858 NRRCQVWTXOFJQO-UHFFFAOYSA-N 399.516 2.815 0 50 GFAA O=C(N[C@@H]1CCCc2c(O)cccc21)N1CCC2(CC1)CCS(=O)(=O)CC2 888102493 YVOQGJVWZCUMFR-QGZVFWFLSA-N 392.521 2.770 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2100473584 HEIXAQRHFZDJRT-QHCPKHFHSA-N 393.487 2.904 0 50 GFAA CN1CCN(C(=O)c2ccc(SCc3nc4ccccc4[nH]3)cc2)[C@H](CO)C1 2325763071 YIWXBPRHJGLETP-INIZCTEOSA-N 396.516 2.604 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2cccc(F)c2)cn1 2325786123 CROFAQZVGACBAJ-JSNMRZPZSA-N 396.422 2.779 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1ccnnc1)C(=O)N[C@H]1CCc2ccccc21 2325810642 VUKQKHGQHKEEQK-ROUUACIJSA-N 382.464 2.716 0 50 GFAA CC(C)CC1(C(=O)Nc2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3)CCC1 2325888001 JZRUJJPXBXVOHM-QGZVFWFLSA-N 397.475 2.603 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 1175761 PUAHEXLZLPDRSU-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2cc(C)no2)C[C@H]1NC(=O)Nc1ccccc1 2356149781 BBQSXDNPHBJTMI-BMGDILEWSA-N 386.452 2.605 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@]23CCCN(Cc2ccccn2)C3=O)no1 2356152380 GWYKRTOWCYLZGB-NRFANRHFSA-N 382.464 2.990 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2cccc(Cn3cccn3)c2)C1=O 2356165883 JIPHVZDUAKFIIB-JOCHJYFZSA-N 380.492 2.939 0 50 GFAA Cc1ccc(Cl)cc1S(=O)(=O)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 222034299 XADIRNBALBQSRL-BBRMVZONSA-N 382.913 2.812 0 50 GFAA O=C(NCCc1cccnc1)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 110229578 LHSCFFWIEKGLPS-FQEVSTJZSA-N 389.455 2.904 0 50 GFAA COCCN1CCN(C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)CC1 225521990 SHPPERBVKGDKTE-QGZVFWFLSA-N 383.439 2.639 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)NCc3cnc4c(C)cccn34)CC2=O)cc1 55575902 HBMPZBYHRPJSTO-SFHVURJKSA-N 376.460 2.616 0 50 GFAA Cc1cc(CNC[C@@]2(O)CCCN(CCCc3ccccc3)C2=O)cc(C)n1 67727025 HMXPXGCEWLVCON-QHCPKHFHSA-N 381.520 2.774 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)CCCc3cccs3)C2)CC1 20204345 VMHOJYKLPOMKPY-QGZVFWFLSA-N 393.553 2.836 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(-n4nc(C)cc4C)ncn3)CC2)c1 67604789 BUEKSAHQQONLAO-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)s1 71749474 HUJQIBYIWSIHKP-OAHLLOKOSA-N 375.538 2.652 0 50 GFAA COc1ccccc1N1C[C@@H](Nc2nc(C(C)C)nc3c2cnn3C)CC1=O 72147020 ABTGYCCURHFRSP-ZDUSSCGKSA-N 380.452 2.713 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2ccc(F)cc2)[C@H](CCO)C1 39362402 AEJOAUNVBHAMBE-GOSISDBHSA-N 388.512 2.912 0 50 GFAA CN(Cc1noc2c1CCCC2)c1nc(-c2cccnc2)nc2c1cnn2C 72417826 PQXZDOOEDQXMOT-UHFFFAOYSA-N 375.436 2.929 0 50 GFAA CS(=O)(=O)c1nc(C(=O)N[C@@H]2CCCc3ccc(F)cc32)c2ccccn12 477477884 RJYBYBSAMUKUKC-OAHLLOKOSA-N 387.436 2.684 0 50 GFAA CN(Cc1cn2c(n1)CCCC2)S(=O)(=O)c1ccc2c(c1)C(C)(C)C(O)=N2 328619133 FNLPEILGJKKRJG-UHFFFAOYSA-N 388.493 2.919 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c(Cl)c1 72140583 ACFKAEGAQZUJCT-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA Cc1ccc(-c2nc(C)c(C(=O)N3CCN4C(=O)N=C(O)[C@H]4C3)s2)c(C)c1 329242054 ABLBSZNIZNOPOZ-CQSZACIVSA-N 384.461 2.952 0 50 GFAA CC(=O)Nc1ccccc1NC(=O)CN[C@H](C)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 216293203 IGFMYNLJZJHLMB-NSFRYCMZSA-N 385.508 2.893 0 50 GFAA COCCn1cncc1CN1C[C@H](c2ccc(C)cc2)[C@@H]2[C@H]1C1CCN2CC1 72152531 HUVKLUHPJFZYGJ-DNVJHFABSA-N 380.536 2.900 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)[nH]n1 123797053 JOFIIDVAHOCCFF-UHFFFAOYSA-N 398.486 2.770 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 158916733 XWGIKTTWVRIYBZ-IBGZPJMESA-N 390.487 2.776 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)CC1 127898756 AODWEXXFOHIERS-CQSZACIVSA-N 396.894 2.568 0 50 GFAA O=C([C@@H]1Cc2cc(F)ccc2O1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 172594858 CARWQKYPLUCULM-IBGZPJMESA-N 381.407 2.636 0 50 GFAA Cc1nc2nc[nH]n2c(=O)c1NS(=O)(=O)c1ccc(C2CCCCC2)cc1 136829756 ZXQGDTNSMACPEB-UHFFFAOYSA-N 387.465 2.575 0 50 GFAA NC(=O)C1(NC(=O)NCC[C@H]2CCCCN2Cc2ccccc2)CCCCC1 426604252 HFIMHIVEYAXRFF-LJQANCHMSA-N 386.540 2.919 0 50 GFAA CCn1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(OC)cc2)C3)c(C)n1 95365365 QAGFKPIRGJCHOX-RBUKOAKNSA-N 382.508 2.957 0 50 GFAA Cn1cc(SCC(=O)N2CCCO[C@@H](Cn3cccn3)C2)c2ccccc21 426388126 GXEPRCBZAAMAJX-MRXNPFEDSA-N 384.505 2.785 0 50 GFAA COCCN(Cc1cccs1)C(=O)Nc1ccc2c(c1)OCC(=O)N2C 519622485 UDJAITOALRRUSJ-UHFFFAOYSA-N 375.450 2.784 0 50 GFAA CCNc1ncc(CN2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95365895 AJSDZKJIBVUJRJ-BHDDXSALSA-N 393.535 2.979 0 50 GFAA C[C@H]1CCCN(c2ccccc2)N1C(=O)c1cnc(-c2cccnc2)[nH]c1=O 91655933 BVJLFJHLCIJZNA-HNNXBMFYSA-N 375.432 2.878 0 50 GFAA CNC[C@H]1CCN(C(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)F)C1 178984024 DGDDRCUDMXAKQT-SNVBAGLBSA-N 387.793 2.621 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(c2nccnc2N2CCCC2)CC1 95508232 LJLMLQOLDSKXEY-UHFFFAOYSA-N 383.544 2.609 0 50 GFAA Cc1c(C)c2ccc(OCC(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)cc2oc1=O 245239904 NFFRJLIAGVJWIQ-SHTZXODSSA-N 387.432 2.796 0 50 GFAA biogenic CN1C(=O)COc2cc(NC(=O)CCCc3nc(O)c4ccccc4n3)ccc21 252509939 YYVQQNZHNFJXIC-UHFFFAOYSA-N 392.415 2.652 0 50 GFAA O=C1c2ccccc2N2C(=O)CC[C@]2(C(=O)NCC2CC2)N1Cc1ccccc1 183494878 AUISLISBRDILDC-QHCPKHFHSA-N 389.455 2.692 0 50 GFAA COc1ccccc1OCc1ccc(C(=O)N(CC(=O)O)C2CCOCC2)o1 299753357 XYPQTDNVYQQELO-UHFFFAOYSA-N 389.404 2.573 0 50 GFAA COCCn1ccc2c(OCC(=O)NCCc3nc4ccccc4[nH]3)cccc21 263587902 MOZUNTLBIFKCHR-UHFFFAOYSA-N 392.459 2.902 0 50 GFAA O=C(NCCc1nc2ccccc2[nH]1)/C(=C/c1ccco1)NC(=O)c1ccco1 38144976 RWJGSXLIKABMFV-LGMDPLHJSA-N 390.399 2.879 0 50 GFAA O=C(CCc1cccnc1)NCC1CCN(Cc2ccc3c(c2)OCCO3)CC1 827822441 OCWJWMWCJYHMBY-UHFFFAOYSA-N 395.503 2.814 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)[C@H](c2cccnc2)N2CCCC2)n1 825264413 FQAODENBHWCMOD-INIZCTEOSA-N 379.386 2.652 0 50 GFAA Cc1cc(C)cc(OCCCN(C)C(=O)[C@H]2CC(=O)N(Cc3ccncc3)C2)c1 825139001 DJMQHDLYLZULII-FQEVSTJZSA-N 395.503 2.974 0 50 GFAA COc1ccc2cc(C(=O)Nc3ccc(C(N)=O)cc3)sc(=O)c2c1OC 824764522 BASPJLZESUZOIQ-UHFFFAOYSA-N 384.413 2.630 0 50 GFAA biogenic CCc1nnc(S)n1CCNC(=O)/C=C/C1=Cc2cc(Cl)ccc2OC1 170647745 LAEIEJJQWASXTH-ZZXKWVIFSA-N 390.896 2.931 0 50 GFAA CCCC[C@@H]1CN(C(=O)Cc2ccc(S(C)(=O)=O)cc2)C[C@H](C2CC2)O1 1529142951 ZCBMSTBAZQECSG-IEBWSBKVSA-N 379.522 2.829 0 50 GFAA CCCN1CCC([C@]2(C)NC(=O)N(Cc3cccc(OC)c3OC)C2=O)CC1 12003657 HSHYWXPJVNCWEY-NRFANRHFSA-N 389.496 2.636 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@@H]1CNC[C@H](C(=O)Nc2ccc3c(c2)CCC3)C1 14531908 IEKSCDUYJVKBLG-RBUKOAKNSA-N 395.478 2.795 0 50 GFAA CC(C)c1ccc(CN2CCc3nnc(CCNC(=O)C4CCC4)n3CC2)cc1 14964286 ZBLPICWBEAVLAU-UHFFFAOYSA-N 395.551 2.919 0 50 GFAA O=S(=O)(c1cccnc1)N1CCC[C@](CO)(Cc2cccc(Cl)c2)C1 15068087 LSXGPTLUVFTDGW-SFHVURJKSA-N 380.897 2.741 0 50 GFAA COCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(-n2nc(C)cc2C)cc1 15077619 YNSHUXACVDPPRM-LJQANCHMSA-N 384.480 2.845 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)Nc2cccc(C)n2)c1 16607434 PILCLFGNQDDBEB-UHFFFAOYSA-N 377.466 2.681 0 50 GFAA NC(=O)c1ccc([C@@H]2CCCN2C(=O)COCc2nc3ccccc3[nH]2)s1 19114319 BLQHQUVDWAACLJ-AWEZNQCLSA-N 384.461 2.604 0 50 GFAA c1cncc(CN2CCC[C@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)c1 19536456 QBCDDSOECNCPCU-NRFANRHFSA-N 394.519 2.593 0 50 GFAA CCCCNC(=O)c1ccc(Cn2ccn3nc4c(c3c2=O)CCCC4)cc1 169760221 DMMFDRACHBEBDZ-UHFFFAOYSA-N 378.476 2.953 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1cn(CCO)nc1C 1857677281 UTLRYZXSRLXRTG-QZNHQXDQSA-N 397.519 2.713 0 50 GFAA O=C(NCCOc1ccccc1)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857700359 GAOZJKAVVPBZKU-AWEZNQCLSA-N 381.457 2.844 0 50 GFAA CC(C)CCC(=O)NC[C@H]1[C@H]2CN(c3cc(C4CC4)ncn3)C[C@]23CC[C@H]1O3 1857734006 JORKCVQJISPLPG-ODULNIPZSA-N 384.524 2.890 0 50 GFAA O=C(CCc1cccc(F)c1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccn1 216562605 RASBNSMCWKKKLZ-XLIONFOSSA-N 381.451 2.803 0 50 GFAA COc1ccc2c(c1)CCC[C@H]2CC(=O)N(CCC(=O)O)C1CCOCC1 408513314 PWPHSPGTWBSSDQ-INIZCTEOSA-N 375.465 2.988 0 50 GFAA CC(C)(NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)NCC1CCCC1 126854234 VDWWDKSOXPFKTG-IBGZPJMESA-N 399.535 2.740 0 50 GFAA O=C1NC(=O)[C@@](CCc2ccccc2)(C2CCN(Cc3ccncc3)CC2)N1 11880956 FKWDZXSPVHPRAM-JOCHJYFZSA-N 378.476 2.505 0 50 GFAA CNC(=O)c1cn(CCC(C)C)cc(C(=O)N[C@H](C)c2cccs2)c1=O 14953659 CNAYPTGOJXZGEN-CYBMUJFWSA-N 375.494 2.807 0 50 GFAA CC(C)n1ccc(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)n1 262478433 KGBATLWKBLXVHZ-UHFFFAOYSA-N 384.436 2.653 0 50 GFAA CCc1cccc2c(CC(=O)NS(=O)(=O)c3cnn(CC(C)C)c3)c[nH]c12 1875290939 JIJJWYJSFBTQBW-UHFFFAOYSA-N 388.493 2.630 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCCSC[C@@H]2c2cnn(C)c2)cc1 1875373537 FDDCPKKUXDAZMS-GOSISDBHSA-N 384.505 2.889 0 50 GFAA Cn1cccc1-c1nnc2ccc(C(=O)N3CCN[C@H](c4ccccc4)C3)cn12 2100556519 DLQYXTKWIXRPAW-SFHVURJKSA-N 386.459 2.522 0 50 GFAA O=C(c1n[nH]c2cc(OC(F)(F)F)ccc12)N1CCNC[C@H]1c1ccncc1 2325753372 CEAWKXTUYJQCEX-HNNXBMFYSA-N 391.353 2.643 0 50 GFAA COC(=O)[C@H](CCSC(F)(F)F)NC(=O)c1cccc2c1CCCN2 2325769164 OYTFXHYOTSSTAC-ZDUSSCGKSA-N 376.400 2.959 0 50 GFAA CC(C)(C(=O)O)n1ccc(=NC(=O)c2ccc(-c3ccccc3CN)cc2)[nH]1 2325852167 VALNLQVCFNZUEC-UHFFFAOYSA-N 378.432 2.503 0 50 GFAA C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 878590704 WIPDQZAKWVKRSM-JLTOFOAXSA-N 391.475 2.542 0 50 GFAA COc1cccc(C[C@@]2(C(=O)O)CN(C(=O)Nc3ccc(C)cc3)CC[C@@H]2O)c1 2356154098 IBHVPTKDBYZQJI-SIKLNZKXSA-N 398.459 2.916 0 50 GFAA COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC[C@H]2CCCO2)cc1Cl 4986970 GRYJWVHRWRGSAA-WBMJQRKESA-N 380.828 2.699 0 50 GFAA CC(C)[C@H](NC(=O)CN1CCN(C[C@@H]2CCCCN2C)CC1)c1ccccc1 109752129 QJZDVBLBKOSPOY-GMAHTHKFSA-N 386.584 2.602 0 50 GFAA O=S(=O)(Cc1ccc(Br)cc1)NCCCN1CCCCC1 10280048 OMGBBXMSQAVVNV-UHFFFAOYSA-N 375.332 2.745 0 50 GFAA Cc1ccccc1OC[C@H](C)NC(=O)N1CCN(C(=O)c2ccccc2)CC1 56860480 LAKYDAIVMPWHDF-SFHVURJKSA-N 381.476 2.930 0 50 GFAA CCN1CCCC[C@H]1CNC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 111535689 NYWSMKNRGZDSTG-IBGZPJMESA-N 391.560 2.677 0 50 GFAA O=C1NCCN(Cc2ccc(Cl)c(F)c2)[C@@H]1CC(=O)N1CCCCCC1 55341997 ZBXMGNROQRRWIJ-QGZVFWFLSA-N 381.879 2.572 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)c2ccccc2-c2ncn[nH]2)s1 23582115 NCTIIMCPHWMOIY-AWEZNQCLSA-N 381.461 2.870 0 50 GFAA Cc1ccccc1C(=O)N[C@H](N[C@@H]1CCCS1(=O)=O)C(Cl)(Cl)Cl 22205060 CBBHITHUVKGANW-AAEUAGOBSA-N 399.727 2.545 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3cccn3-c3cccnc3)C2)CC1 20855403 BSJYSYVMERBMLC-FQEVSTJZSA-N 397.523 2.611 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CNCCc3ccccn3)C2=O)cc1 67856828 VWZKFOYTWXMDNZ-QHCPKHFHSA-N 381.520 2.891 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCN(c2cc(-n3cccn3)ncn2)CC1 65364951 JXZINRDSHGLXQG-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA Cc1cc([C@H](C(=O)O)N(CCN2CCOCC2)Cc2ccco2)ccc1F 63856434 ODXZSCRPCAJGNG-LJQANCHMSA-N 376.428 2.687 0 50 GFAA CCn1ccnc1CNC[C@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67457810 XXECLWZFSCSPKD-JOCHJYFZSA-N 384.524 2.670 0 50 GFAA C[C@@H](Sc1ccc(N)cc1)C(=O)OCCCN1C(=O)c2ccccc2C1=O 253428090 IDTPOZRLXPWPAK-CYBMUJFWSA-N 384.457 2.979 0 50 GFAA COc1cccc2c1OCC(CN1CCC(C(=O)O)(n3cc(C)cn3)CC1)=C2 77286833 IHVULTSMOIXMMJ-UHFFFAOYSA-N 383.448 2.552 0 50 GFAA C[C@H](NC(=O)Nc1ccccc1)C(=O)O[C@H](C)C(=O)N1[C@H](C)CCC[C@H]1C 239667634 BQXNELUDWFTVED-LVQVYYBASA-N 375.469 2.918 0 50 GFAA O=c1ccc2cc(S(=O)(=O)N3CCc4c(F)cc(F)cc4C3)ccc2[nH]1 481060817 PLJJXMOQGRKECY-UHFFFAOYSA-N 376.384 2.553 0 50 GFAA O=C(NCCOCCO)c1cccc(Sc2cccc(Br)c2)n1 158318418 CRTQFKVIUHIONA-UHFFFAOYSA-N 397.294 2.734 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H](C)CCS(C)(=O)=O)CC3(CCC3)C2)cc1 376157428 QPOTWBCWYBTOET-HNNXBMFYSA-N 379.522 2.837 0 50 GFAA COc1cc(Br)c(CNC(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)cc1OC 377776522 VKSJEKKNTXPZGO-KNHMANMVSA-N 384.270 2.898 0 50 GFAA N[C@@H]1CCO[C@H]1C1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 333836472 UIXSXBYCYZDKFT-ZRNYENFQSA-N 391.487 2.584 0 50 GFAA CCOc1cccc(N2CCN(C(=O)c3ccccc3-c3nc(C)no3)CC2)n1 172989157 XMJDHSKQENEDGA-UHFFFAOYSA-N 393.447 2.801 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccc(-n3cccn3)cc2)C2CC(O)C2)cn1 223601263 QAMFQJQLGUXSNJ-OUNSHVDWSA-N 378.432 2.518 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(Cc2cccc3nonc23)CC1 82087353 NLOBUWYYSUIQHC-UHFFFAOYSA-N 383.404 2.730 0 50 GFAA Cc1nc(CNC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)no1 426544226 AEWMSAGUOOGPFR-UHFFFAOYSA-N 387.465 2.533 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3ccc(-n4ccnc4C)cc3)C2)n[nH]1 426627891 ZIIJNZZERKCPFE-KRWDZBQOSA-N 379.468 2.696 0 50 GFAA CCCc1cc(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)cs1 95391248 YBNDDLUVJTXPCW-APWZRJJASA-N 380.554 2.636 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91644081 CYXROHJKNBJKQE-UHFFFAOYSA-N 386.464 2.519 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2CC[C@]3(OC)CC[C@@H](OC)C[C@H]23)cc1 426489466 BKSCVTIKASTVIZ-SLYNCCJLSA-N 375.465 2.843 0 50 GFAA CC[C@H](C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1)n1cccn1 95518674 FUMMHOIDTNMZPU-LJQANCHMSA-N 378.480 2.880 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccn(C(C)(C)C)c3)C2)CCC1=O 91551742 CMNWBTLDMUDOMD-OAQYLSRUSA-N 375.513 2.734 0 50 GFAA COCCN1C(=O)[C@H]2CC[C@@H]1CN(Cc1cccc(-n3nc(C)cc3C)c1)C2 95523524 ASRKICZHLCEOIP-PZJWPPBQSA-N 382.508 2.558 0 50 GFAA O=C([C@H]1CCCCN1C(=O)C1CC1)N1CCc2[nH]c(-c3ccccc3)nc2C1 95505676 JSWPYLGSDWLOOG-LJQANCHMSA-N 378.476 2.753 0 50 GFAA Cc1nc2c(c(N3CCC[C@@H](N4CCCC4=O)C3)n1)Cc1ccccc1OC2 95511534 QVVRFRATTFAOIW-QGZVFWFLSA-N 378.476 2.859 0 50 GFAA O=C(CCc1ccc2[nH]ccc2c1)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1 180903231 GATVYGDVGKVWCD-IBGZPJMESA-N 397.500 2.711 0 50 GFAA CC(C)c1cnc(CN2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)s1 182947087 DIJGLDZLDQYZPW-UHFFFAOYSA-N 383.514 2.912 0 50 GFAA NC(=O)N[C@@H](CC(=O)N1CC[C@H](C(=O)O)C1)c1cccc(Oc2ccccc2)c1 299743365 NIHPNQRIIALQKP-YJBOKZPZSA-N 397.431 2.512 0 50 GFAA Cc1nc(C)n(CCCNC(=O)c2cccc(-c3csc(C(N)=O)c3)c2)n1 534631869 ICZABJVNSVHAMB-UHFFFAOYSA-N 383.477 2.542 0 50 GFAA CCc1cc(CN2CCOC3(CCN(Cc4[nH]c(CC)nc4C)CC3)C2)on1 823565719 XIDMKMATZGTMOU-UHFFFAOYSA-N 387.528 2.698 0 50 GFAA CC(=O)Nc1ccccc1SCC(=O)NC[C@@H]1CC(=O)N(C2CCCC2)C1 827846338 FACZNTGYUHUBLL-HNNXBMFYSA-N 389.521 2.644 0 50 GFAA Cc1ccc(-c2nn3c(C4CCN(S(C)(=O)=O)CC4)nnc3s2)cc1C 825186650 AKURENSKHAYDFX-UHFFFAOYSA-N 391.522 2.609 0 50 GFAA Cc1nn2cc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(C(C)C)cc4)C3)nc2s1 827696376 KJLQHYXFTNHOLO-OAHLLOKOSA-N 397.504 2.892 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)NCc1noc(-c2ccco2)n1 952967049 GQOURTODZXDNRG-UHFFFAOYSA-N 398.404 2.573 0 50 GFAA C[C@@H]1C[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCO1 271477103 CVTMKIRMQLKVCC-SLYNCCJLSA-N 389.540 2.546 0 50 GFAA CCN(C(=O)c1ccc(N2CCCC2)nn1)[C@H]1CCN(Cc2ccccc2)C1 186324776 KGAYHHCNZRPTEB-IBGZPJMESA-N 379.508 2.813 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2cc(F)cc(Br)c2)CC1 186669819 HPOOXGHACDYXBU-CQSZACIVSA-N 387.249 2.599 0 50 GFAA O=C(Nc1cnn(Cc2nnc3n2CCCC3)c1)N[C@H]1CCCc2occc21 277701548 HSELJTFIXGKVEY-HNNXBMFYSA-N 381.440 2.651 0 50 GFAA CCOc1cccc2[nH]cc(CC(=O)NC3CCN(C[C@H]4CCOC4)CC3)c12 188071626 FLVDJCSHYPOOBK-MRXNPFEDSA-N 385.508 2.726 0 50 GFAA Cc1cc(S(=O)(=O)Nc2cc3c(cc2F)CCC(=O)N3)cc(C(=O)O)c1F 763284007 WYBZTGACSHWWMA-UHFFFAOYSA-N 396.371 2.657 0 50 GFAA O=C(c1ccc(N[C@H]2CCCN(Cc3ccc(F)cc3)C2)nc1)N1CCOCC1 1704356714 ISJFQDMGYQPRNZ-FQEVSTJZSA-N 398.482 2.770 0 50 GFAA COc1cccc2c1C1(CCN(c3nc(C)c(C)cc3C(N)=O)CC1)OCC2 1704305469 JRNUXAWDJPWJPU-UHFFFAOYSA-N 381.476 2.874 0 50 GFAA COc1ccc(CCc2nnc(CCC(=O)N(C)C[C@@H]3CCCCO3)o2)cc1 11662632 JCLKXOCOIDHCBV-SFHVURJKSA-N 387.480 2.824 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCCC[C@H]2COC)n1Cc1ccccc1 11663388 IZYAASWBOQZZAN-SFHVURJKSA-N 391.537 2.726 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CCC[C@H](CO)C2)no1 12459415 IALRMSHJFVWCHF-LBPRGKRZSA-N 380.828 2.760 0 50 GFAA Cc1cc(C)nc(CCNC(=O)c2cc(COc3c(F)cccc3F)on2)n1 12578192 CUUTXZPZGMKVAL-UHFFFAOYSA-N 388.374 2.911 0 50 GFAA O=C(Cc1c(F)cccc1Cl)NCc1cccnc1N1CCC[C@H](O)C1 12835569 NPSNSEDRRDGZJX-AWEZNQCLSA-N 377.847 2.694 0 50 GFAA CN1C(=O)N(Cc2ccccc2)C(=O)C12CCN(Cc1cccc(O)c1)CC2 14540778 CNDGVMCJGABGCJ-UHFFFAOYSA-N 379.460 2.821 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(COc3ccccc3F)n2)C1 15065973 DRIMXBFXJWGBRY-CYBMUJFWSA-N 376.384 2.808 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3ccccn3)C2)cc1OC 15072398 JUDJCIXPJJKCJD-GOSISDBHSA-N 383.492 2.878 0 50 GFAA CCOCc1nnc(NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)s1 16652597 XUPWERJFCXXQHL-UHFFFAOYSA-N 392.456 2.705 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc(C(F)(F)F)cn1 206242926 PSVWJIJGESQLBP-CYBMUJFWSA-N 392.337 2.570 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3C[C@@H]4CCOC[C@]4(C(=O)O)C3)c2)cc1 1857668975 VWCRLKAFEXQFAY-PGRDOPGGSA-N 381.428 2.926 0 50 GFAA O=C(N1CCOc2ccc(CO)cc2C1)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2 1857697462 VUXPARWKXXMPBN-BGWNEDDSSA-N 392.499 2.653 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)c3sccc3Cl)C[C@]23CC[C@H]1O3)C1CC1 1857723664 PXYPJLSMYMFLSU-NMFBSDBYSA-N 380.897 2.547 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)N1CCc2ncccc2C1 1857726847 FXEUTEHNWDDYQW-HNNXBMFYSA-N 377.448 2.809 0 50 GFAA COc1cc2nc(N3CCN([C@@H](C)c4cccnc4)CC3)nc(N)c2cc1OC 265099610 DKVGMFNUYKOJDU-AWEZNQCLSA-N 394.479 2.507 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O)c1cnn(C)c1 164169636 POERQIHEEDXADC-AUUYWEPGSA-N 392.459 2.761 0 50 GFAA CN(C)C(=O)NC1CCN(C(=O)c2cc(-c3cccc(Cl)c3)on2)CC1 908808749 JYZKDMSSXIOYKV-UHFFFAOYSA-N 376.844 2.871 0 50 GFAA CC(C)[C@H](C(=O)NC[C@H]1C[C@H](CC(N)=O)CO1)c1cccc(C(F)(F)F)c1 1875310627 WDVFTRMMUTZTQU-VMGRFDJRSA-N 386.414 2.842 0 50 GFAA Cc1cccc2cc(C(=O)N3CCc4c(cnn4C)[C@@H]3C(=O)N(C)C)sc12 1875394785 WOJZGSYWXKWJSE-QGZVFWFLSA-N 382.489 2.771 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2cccc3c2N(C(=O)OC(C)(C)C)CC3)cn1 1875385479 UGGXBPBSRCZDFE-MZNJEOGPSA-N 384.480 2.981 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(Cc4cc5ccccc5[nH]4)CC3)n[nH]c21 1875395161 OLQUEMSRHUKWEB-CABCVRRESA-N 393.491 2.871 0 50 GFAA CCN(Cc1ccc(F)c(F)c1)C(=O)c1nc(C)c(C)c(N2CC[C@@H](N)C2)n1 1875401979 XRLHIWDCLNMLOO-OAHLLOKOSA-N 389.450 2.571 0 50 GFAA C[C@@H]1CCN(CC(=O)N(C)[C@]2(c3ccccc3Cl)CCCCC2=O)C[C@H]1O 956933820 NQTHJRWZXINVCK-FPDPHYFHSA-N 392.927 2.840 0 50 GFAA CCNC(=O)c1nn(C)cc1NS(=O)(=O)c1cc(C)c(Cl)cc1Cl 2325854242 UKFPCLPPMZYLCJ-UHFFFAOYSA-N 391.280 2.586 0 50 GFAA C=CC(=O)Nc1ccccc1CC(=O)N(C)c1cn(Cc2ccccc2)nn1 2325894212 XWBAQIQRVLUMAH-UHFFFAOYSA-N 375.432 2.656 0 50 GFAA CCCC1=C(C(=O)OCC)[C@@H](c2cc(OC)c(OC)c(OC)c2)NC(=O)N1 844167 JFXOGNNXERVWME-MRXNPFEDSA-N 378.425 2.684 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1ccc(OC(C)=O)cc1 851996 VJKDFJMVWMQYBX-QGZVFWFLSA-N 388.445 2.825 0 50 GFAA CCSCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc2c(c1)OCO2 2473573 IIHRYXVXHUVJDZ-INIZCTEOSA-N 378.450 2.682 0 50 GFAA Cc1nc(NC(=O)c2cc3n(n2)CCN(C)C3=O)cc(-c2ccccc2)c1C 2356163852 UAPUTFUUCUHHIC-UHFFFAOYSA-N 375.432 2.900 0 50 GFAA CC(=O)N1N=C(c2cccc(NS(C)(=O)=O)c2)C[C@H]1c1ccc(F)cc1 4036079 ISHCLLMTHIKKDD-SFHVURJKSA-N 375.425 2.895 0 50 GFAA Cc1ccccc1N1CCN([C@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)CC1 55386596 LTYXNFCUCAXSSG-FQEVSTJZSA-N 396.535 2.956 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN2CCN(c3ccccc3F)CC2)cc1 55059012 ULANXDDOQZTHLB-UHFFFAOYSA-N 385.439 2.763 0 50 GFAA O=C(NCc1ncc[nH]1)c1ccc([C@@H]2CCCN2CCCn2cccn2)s1 20866760 BQMMBMHZOOYTPN-HNNXBMFYSA-N 384.509 2.825 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)c1ccc(Cl)cc1Cl 104327911 WGFHSIVDHDSQFC-QBQNWWDVSA-N 377.227 2.691 0 50 GFAA CCC1(CC)CN(c2ccc(C(=O)N3CCC[C@@H](COC)C3)cn2)CCO1 67884941 KDGMLZRLOCODRF-QGZVFWFLSA-N 375.513 2.976 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CCn3nccc3C3CC3)[nH]c2C1 65397201 CWYLJRGQMFTCMA-OAHLLOKOSA-N 391.475 2.805 0 50 GFAA Cc1ccc(O[C@H]2CCN(S(=O)(=O)c3c(Cl)nc4ccccn34)C2)cn1 328633631 SRIVHPVZJNHYAO-AWEZNQCLSA-N 392.868 2.533 0 50 GFAA Cc1cccc2c1[C@@H](NC(=O)c1cc(COc3ccccc3F)[nH]n1)C(=O)N2 67676078 FSEKJRUXVDHQCQ-GOSISDBHSA-N 380.379 2.859 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCC[C@H]3CCC[C@H]32)c(Br)o1 230235458 KSUZZVWBRITFSP-RKDXNWHRSA-N 378.244 2.694 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)c1 72434272 GEFVLQRYYWUYNQ-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2NCc2cc(OC)c3c(c2)OCCO3)cn1 328631165 KDIIQGJIGQIHAO-BEFAXECRSA-N 386.452 2.633 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)CCn3ccnc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72412123 AJSWBUSWCLMLQZ-YMPZKCBVSA-N 378.520 2.979 0 50 GFAA Cc1ccc(C)n1-c1c(C(=O)Nc2cccc(-c3nncn3C)c2)cnn1C 363624518 GJQHKKSDRKKFOY-UHFFFAOYSA-N 375.436 2.875 0 50 GFAA Cc1c(F)cccc1NC(=O)N1CCN(c2cc(N3CCCC3)ncn2)CC1 72446900 RJRPVUMJHODNGH-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCN(c4ccccn4)CC3)cc2)n1 72125524 AZOJYKGTEHYWLL-UHFFFAOYSA-N 375.476 2.906 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)CCNC(=O)[C@@H]3C[C@H]3C)cc2F)C[C@@H](C)O1 240244178 DKPAXGFBBYDTEP-IXYNUQLISA-N 377.460 2.540 0 50 GFAA O=C(C1CC1)N1CCC(CNc2cc(-c3ccncc3)nc3ccnn23)CC1 72423842 SISACWNHYFKGJM-UHFFFAOYSA-N 376.464 2.852 0 50 GFAA O=C(N[C@@H](CC(F)F)C(=O)O)c1cccc(-n2ccc(C(F)(F)F)n2)c1 262967927 JSFHJZPWJFWJDV-JTQLQIEISA-N 377.269 2.729 0 50 GFAA O=C(N[C@@H](CC(=O)N1CCC(C(=O)O)CC1)c1ccccc1)c1ccccc1 238023396 YVIHPCHBVOYHKA-IBGZPJMESA-N 380.444 2.871 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCCN(CC3CCCCC3)CC2)ccc1F 238197922 MALCLBKIOPQYMM-UHFFFAOYSA-N 398.500 2.801 0 50 GFAA Cc1ccc(-c2nnc3n2CCCCC3)cc1NS(=O)(=O)C[C@@H]1CCCO1 172365137 MTSAUAXZKBOGHB-INIZCTEOSA-N 390.509 2.901 0 50 GFAA CN(C)c1cc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc(Cl)n1 130036422 ASLZRKULEQKNLN-MRXNPFEDSA-N 386.883 2.722 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CCN(c2ncnc3ccsc23)CC1 172664504 XQOAGTBOEDWCFF-UHFFFAOYSA-N 392.488 2.849 0 50 GFAA Cc1ccc(OCc2nc(CN3CCc4nn(C)c(=O)cc4C3)cs2)cc1 172798182 MTQBYSAAWCFMGB-UHFFFAOYSA-N 382.489 2.683 0 50 GFAA CCn1ccc2ccc(CN3CCC4(CC3)C[C@@H](C(=O)O)N(C(C)=O)C4)cc21 82083112 JBOMUSVUBGXWQH-FQEVSTJZSA-N 383.492 2.949 0 50 GFAA Cc1cc(N2CC[C@H](N3CCN(C)CC3)[C@H](CCC(=O)O)C2)nc2ccccc12 95368921 XGJZKNQFSPNNAC-NQIIRXRSSA-N 396.535 2.850 0 50 GFAA OC[C@H]1CN(CC(c2ccccc2)c2ccccc2)C[C@H]1CN1CCOCC1 91468824 CFSDQSUFJMIHQN-DHIUTWEWSA-N 380.532 2.691 0 50 GFAA CCN(Cc1nc(-c2ccc(C)cc2)no1)C(=O)N[C@@H](C)c1nncn1CC 426580969 PDJIJVSYZPNATM-AWEZNQCLSA-N 383.456 2.949 0 50 GFAA CN(CC1(CO)CCOCC1)C(=O)NC[C@H](c1ccccc1)N1CCCCC1 426536594 ZMXWSYJKNFIJAV-HXUWFJFHSA-N 389.540 2.644 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cc(=O)[nH]c3cc(F)ccc13)C2 95525346 DOEADMGTFHJPFV-GFCCVEGCSA-N 382.391 2.657 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(c2cc(C(C)C)ncn2)CC1 96149236 ZEIBVMVENNYPHV-UHFFFAOYSA-N 380.500 2.840 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)c2cccc3c2ccn3C)C1 95382884 FFZYKPIVJKLGIY-KRWDZBQOSA-N 379.508 2.956 0 50 GFAA CNC(=O)CN1CCCC[C@H]1C(=O)Nc1cccc(-c2cccc(OC)c2)c1 95517333 VXSJZHJNNUFPIC-FQEVSTJZSA-N 381.476 2.901 0 50 GFAA COc1ccccc1/C=C/CN[C@H]1CC[C@@H](n2cc(C(=O)NC3CC3)nn2)CC1 248181047 DIXGBSQYJGFMFT-QRXJYFKXSA-N 395.507 2.966 0 50 GFAA C[C@H](NCc1ccc(Br)cc1N1CCOCC1)c1nccn1C 183355817 YVXUWFJIGSTGEU-ZDUSSCGKSA-N 379.302 2.870 0 50 GFAA CCCOc1ccccc1CCNC(=O)N1CCC[C@@]2(CN(C)C(=O)O2)C1 584899020 RXVUTLQWNDUXSU-HXUWFJFHSA-N 375.469 2.644 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)NCc1nc2ccc(F)cc2[nH]1 670461007 GXIKARHYVUXKIU-UHFFFAOYSA-N 379.395 2.903 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNC(=O)C2CCN(C3CCOCC3)CC2)C1 670438663 NTJDLTYEFVTBIN-OAQYLSRUSA-N 399.579 2.792 0 50 GFAA Nc1ccc(C(=O)N2CCC[C@@H](CNC(=O)CCCc3cccs3)C2)cn1 952970829 VTDJGYXNEONJAS-HNNXBMFYSA-N 386.521 2.717 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)[C@@H]2CCOc3ccccc32)cc1OC 268936038 HSVYPFNDLSKBNE-CVEARBPZSA-N 385.416 2.902 0 50 GFAA Cn1cnnc1C1CCN(C(=O)c2ccc(C(=O)c3cccc(O)c3)cc2)CC1 187794391 CFIZJOYONPVOTD-UHFFFAOYSA-N 390.443 2.772 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1529195332 JYXQFZIWCNNLKZ-FOIQADDNSA-N 376.460 2.512 0 50 GFAA CC[C@H](C)Cc1nc(CCNC(=O)c2ccc(F)cc2)n(-c2ccnn2C)n1 1772816427 QHIKGEGLAKPKFP-AWEZNQCLSA-N 384.459 2.701 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(c1cc(C(C)C)ncn1)C2 1772708467 DCSRCKHXCLPGQZ-KNKQGSTJSA-N 388.556 2.944 0 50 GFAA CCN1C(=O)C[C@](CC(=O)N(C)Cc2csc(C)n2)(c2ccccc2C)C1=O 12054719 BGAZZWPYOYLKPF-OAQYLSRUSA-N 399.516 2.825 0 50 GFAA Cc1ccc(Cl)c(O[C@@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 13329745 MZWJEVFQNCULJN-AWEZNQCLSA-N 376.840 2.993 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1ccc(O)cc1)CC2 14541134 UDBJWQLLFUBGOQ-UHFFFAOYSA-N 393.487 2.864 0 50 GFAA COc1cccc(CN2C[C@H](C(=O)NCCCc3ccncc3)CCC2=O)c1 15069525 PBZAHVBYEITZIY-LJQANCHMSA-N 381.476 2.578 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN(C)C3CCCCC3)C2=O)c1 15072781 IRCNICSMXYHJTC-OAQYLSRUSA-N 378.488 2.952 0 50 GFAA COc1ccc2oc(=O)c(C(=O)N3CCN(Cc4ccccc4)CC3)cc2c1 19757282 QZHFEPJMDOSPMF-UHFFFAOYSA-N 378.428 2.760 0 50 GFAA Cc1cccc(C(=O)Nc2ccccc2C(=O)NCCCN2CCOCC2)c1 19831357 LWHLIJIXJVBTMT-UHFFFAOYSA-N 381.476 2.699 0 50 GFAA COc1ccc(-n2c(=O)nc(O)c3ccc(-c4cc(OC)ccc4O)nc32)cc1 1857526519 KFJVZGOHCMTEFF-UHFFFAOYSA-N 391.383 2.876 0 50 GFAA CN1C(=O)CCO[C@H]2CN(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)C[C@@H]21 1857709940 ZGTDPDWLHVKMTI-STQMWFEESA-N 391.777 2.822 0 50 GFAA COc1cc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)ccc1F 1857727642 WJCMPCRMCMLVAB-KPLVRAHFSA-N 396.418 2.749 0 50 GFAA CCc1ccc(CN2C[C@@H]3[C@H](CNC(=O)CSC)[C@H]4CC[C@]3(C2)O4)s1 1875241074 OCOVWPZCUXRBMQ-DODZYUBVSA-N 380.579 2.769 0 50 GFAA O=C(c1ccccc1-n1cccn1)N1C[C@@H]2CC[C@H](C1)C(=O)N2CC1CCC1 212548178 BWAYUEQJIKKNPI-MSOLQXFVSA-N 378.476 2.735 0 50 GFAA Cn1nc(C(=O)N2CCCC[C@@H]2Cc2cccc(Br)c2)ccc1=O 421718734 PGVJCJIOMDNQML-OAHLLOKOSA-N 390.281 2.780 0 50 GFAA CC(C)Cc1ccccc1C(=O)NCc1ccc(S(=O)(=O)CCO)cc1 252484472 FXKCQAHXHONKAA-UHFFFAOYSA-N 375.490 2.581 0 50 GFAA CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2ccc(C(=O)O)cc2)C1 262313262 QDASAAHYLRTRFO-CQSZACIVSA-N 386.370 2.648 0 50 GFAA CON1CCC(c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)CC1 952895292 TVLXKYUPMPHWLL-QGZVFWFLSA-N 397.401 2.916 0 50 GFAA Fc1cnc(N2CC[C@@](c3nc(-c4ccccn4)no3)(C(F)(F)F)C2)cn1 952892534 DPGQCYYTXPVMIW-OAHLLOKOSA-N 380.305 2.771 0 50 GFAA O=C(NC[C@@H]1CCCN(C[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)C1)c1ccccc1 1875264930 OZUJIHSLKULLRU-LBFUUBPISA-N 392.543 2.637 0 50 GFAA COc1ccc(OC)c([C@@H](O)[C@@H](C)NC(=O)C23CCC(OC)(CC2)CC3)c1 1875271773 LMECSZZUKWSQPO-ZEIMHADYSA-N 377.481 2.981 0 50 GFAA CC(C)n1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)Cc3ccsc3)CC1)O2 1875394359 GWBBGLFESNNWPD-HNNXBMFYSA-N 375.494 2.945 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOC[C@H]2c2nc3ccccc3s2)CC1 1875362996 UNLCPYSVIBCTSC-INIZCTEOSA-N 385.489 2.621 0 50 GFAA O=C(CCc1ccccc1C(=O)O)NCCCCn1cc(-c2cncs2)nn1 1875326386 IRTOBHMOEJLNER-UHFFFAOYSA-N 399.476 2.629 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CCC2)[C@@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1 1775997216 CECACEIZBGCFTK-ITTUMRLJSA-N 396.531 2.565 0 50 GFAA O=C(COC(=O)c1cccc(N2C(=O)CCC2=O)c1)Nc1ccccc1Cl 1062553 LZWREFXSVJAKDQ-UHFFFAOYSA-N 386.791 2.789 0 50 GFAA O=C1N(CCO)c2ccccc2[C@@]12CCN(c1ccc(-c3ccccc3)nn1)C2 2100480660 NIRSBPHKFVHCET-QHCPKHFHSA-N 386.455 2.631 0 50 GFAA O=C(NC[C@H](F)CO)c1cccc(-n2cc(-c3ccc4cnccc4c3)nn2)c1 2325869499 QKKYGDCZJOIAFV-SFHVURJKSA-N 391.406 2.543 0 50 GFAA Cc1cc(F)c(S(=O)(=O)NCCc2ccnc3ccccc23)cc1C(=O)O 2325875671 ZLWYBACQJOHQQA-UHFFFAOYSA-N 388.420 2.902 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nc2cc(Br)cnc2O)cc1 2325889644 DHAFITGJCILIIU-UHFFFAOYSA-N 376.210 2.951 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@](C)(O)[C@@H](O)CO3)c2ccc(C)c(C)c2n1 2356143272 AYVRAHFYKLWGNV-UGKGYDQZSA-N 398.503 2.667 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]3CCCO3)cc2)cc1 4001741 WMDLSPZOAUCNND-KRWDZBQOSA-N 376.434 2.614 0 50 GFAA CO[C@@](C(=O)Nc1c(C)nn(CC(=O)O)c1C)(c1ccccc1)C(F)(F)F 55072090 DTQZVQZXOXHWSZ-MRXNPFEDSA-N 385.342 2.627 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCN(c3ccc(NC(C)=O)cc3)CC2)c1 8903402 PKSVQAIFUANUBM-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)[C@H]1CCCN(c2ccccn2)C1 58090203 REJHJHQAQWLNQZ-IBGZPJMESA-N 375.476 2.843 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnn(C(C)C)c2)C[C@@H]1CCO 23358465 ZKHCSQOVJPXPRV-NRFANRHFSA-N 386.540 2.932 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN(C)Cc3cnn(C)c3)C2=O)cc1 67434846 AANPDYXJWZKGCS-JOCHJYFZSA-N 384.524 2.529 0 50 GFAA Cc1nonc1OCCNC(=O)c1ccc([C@H]2CCCN2C(=O)C(C)C)s1 20232697 OCSWNPZTMKJQLX-CYBMUJFWSA-N 392.481 2.568 0 50 GFAA NC(=O)c1cccnc1N1CC[C@]2(CCCN(CCC3CCCCC3)C2=O)C1 20363800 RYXJRLPYYDBWQS-JOCHJYFZSA-N 384.524 2.970 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(C)cc3)[C@H](CCO)C2)cc1CO 22853438 DPLBKSOUUPSYAJ-HSZRJFAPSA-N 398.547 2.955 0 50 GFAA CCN(C(=O)c1coc(COc2ccc3c(c2)OCO3)n1)[C@@H]1CCCC[C@H]1O 67868942 MLMGPYYRQJIWMC-HZPDHXFCSA-N 388.420 2.748 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccnc(N)c2)CCC(=O)N1Cc1ccc(F)cc1 71440145 XQYOLGYRRKFIIB-SFHVURJKSA-N 384.455 2.702 0 50 GFAA O=C(Cn1c([C@H]2CC(=O)N(C3CC3)C2)nc2ccccc21)N1CCCCCC1 32497897 BEXGILMRLBJJTR-INIZCTEOSA-N 380.492 2.917 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@H](CNC(=O)[C@@H]2CCCN(C)C2)O3)n1 39358014 BVPRELCESISOTN-IEBWSBKVSA-N 380.492 2.522 0 50 GFAA Cc1oc(CN(C)C(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1C(=O)O 262475286 JVIGXTSKJRMBNV-UHFFFAOYSA-N 391.811 2.741 0 50 GFAA NC(=O)Nc1cccc(C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccc(Cl)cc3)C2)c1 366352271 DYTQZFLXINBTHI-JKSUJKDBSA-N 387.823 2.771 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3cccc(F)c3F)CC2)C1 71764163 RHXYMXMWNYHZML-INIZCTEOSA-N 377.479 2.920 0 50 GFAA Cc1ccc2nc(N3CCC[C@H](O)C3)c(CN3CCc4[nH]ncc4C3)cc2c1 72456721 SWKUASRMEXLMJT-IBGZPJMESA-N 377.492 2.786 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N3CCCCC[C@@H]3CCO)CC2)oc1C 496221876 KIZJPXIYXUIKSW-LJQANCHMSA-N 392.544 2.840 0 50 GFAA COc1cc(N2CCN(c3ccc(S(C)(=O)=O)cc3F)CC2)ccc1F 288517456 VSXILLINCAQUSU-UHFFFAOYSA-N 382.432 2.704 0 50 GFAA CN(C)Cc1nnc([C@@H]2CCCN(C(=O)c3csc4c3CCCC4)C2)n1C 426620232 NGWCHHDPXYDDPT-CQSZACIVSA-N 387.553 2.837 0 50 GFAA CCCc1nc(C)cc(N2CCC(NCc3ccc4[nH]c(=O)[nH]c4c3)CC2)n1 95520478 YBLDJEDFFQCFIY-UHFFFAOYSA-N 380.496 2.666 0 50 GFAA Cc1ccc(N2CC[C@H](CNC(=O)CCc3nc4ccccc4[nH]c3=O)C2)cc1 91691271 PDLBKHKKMNQTGC-QGZVFWFLSA-N 390.487 2.807 0 50 GFAA CCN1CC2(CCC1=O)CCN(C(=O)CN(C)Cc1ccc(F)cc1)CC2 92081023 GZJUTRDKNSSVJP-UHFFFAOYSA-N 375.488 2.509 0 50 GFAA O=C(O)CN1CCC[C@@H](C(=O)OCC2c3ccccc3-c3ccccc32)C1=O 95079047 MGRKRIDEUOZPNJ-GOSISDBHSA-N 379.412 2.665 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCSc1ncn[nH]1 95531140 CMHVBEUCCGHYEJ-MRXNPFEDSA-N 396.472 2.964 0 50 GFAA O=C1C[C@@H](CNC(=O)N2CCC[C@@H]2c2ccncc2)CN1Cc1ccccc1 179304214 AIMYLUDYWKDEGE-AZUAARDMSA-N 378.476 2.977 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC(c3cc(=O)[nH]c(C)n3)CC2)cc1 23506046 DBUXKCBOQOLQCP-UHFFFAOYSA-N 379.464 2.652 0 50 GFAA Cc1cc(S(=O)(=O)N[C@@H](c2ccccn2)[C@H]2C[C@H](O)C2)c(Cl)cc1F 244794639 QQVPDVCCTCRARX-PSTGCABASA-N 384.860 2.973 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1C(=O)O 299750246 NAMVTZIMLIWQKD-NSHDSACASA-N 392.358 2.576 0 50 GFAA Cc1cc(=O)c2cccc(-c3cccc(C(=O)N4CCC[C@@H](C(N)=O)C4)c3)c2[nH]1 534646733 HUANOVCFPXZZEL-QGZVFWFLSA-N 389.455 2.841 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)c1ccc(CN2CCCC2)o1 299771953 YDRNGORDTMMVOI-UHFFFAOYSA-N 380.448 2.822 0 50 GFAA COCC(=O)Nc1ccc(Cl)c(NC(=O)Cc2cn3ccsc3n2)c1 824313329 JCALGOGSZOZPLA-UHFFFAOYSA-N 378.841 2.815 0 50 GFAA CSCCN1CCC(NC(=O)N2CCN(c3ccccc3)C[C@@H]2C)CC1 584895578 BTDMDEDJFARKFU-KRWDZBQOSA-N 376.570 2.734 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2C(=O)Cc2ccc(S(C)(=O)=O)cc2)n1 952987479 MNNOFIRQXJNRAP-HNNXBMFYSA-N 377.466 2.503 0 50 GFAA Cn1cccc1-c1cc(C(=O)NCc2noc(-c3c(F)cccc3F)n2)n[nH]1 952989841 PMSBAVSKOYXPPE-UHFFFAOYSA-N 384.346 2.673 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)N2CCC(c3ncc[nH]3)CC2)c1)C1CCC1 408521163 KEZHGZQSUNCRSC-UHFFFAOYSA-N 388.493 2.717 0 50 GFAA Cc1c([C@H]2OCC[C@@H]2C(=O)N(C)CCOc2cccc(Cl)c2)cnn1C 275195249 AACMWYIXXHSLNE-WMZOPIPTSA-N 377.872 2.997 0 50 GFAA O=S(=O)(/C=C/c1ccc(Br)cc1)NC[C@@H]1CCc2nccn2C1 275218555 BTDJSUZAMPCWLY-RNVIBTMRSA-N 396.310 2.798 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@H](c3nncn3C)C2)ncn1 275653648 KTCAQAKIXNWXDM-FCEWJHQRSA-N 385.516 2.605 0 50 GFAA CCN1C(=O)CCc2cc(NC(=O)N3C[C@@H](OC)C[C@@H]3c3nc(C)no3)ccc21 275974442 MVHCAZVBKHMMRU-DOTOQJQBSA-N 399.451 2.671 0 50 GFAA CC[C@H](NC(=O)c1nnc(O)c2ccccc12)c1ccc(S(C)(=O)=O)cc1 1506427711 MNWAIEQGKKGDFL-INIZCTEOSA-N 385.445 2.620 0 50 GFAA COc1cccc(CN(CCN(C)C)C[C@H]2CCCO2)c1OCCCN(C)C 1506400164 ANXGITKUWWAQRR-HXUWFJFHSA-N 393.572 2.568 0 50 GFAA COc1cccc([C@H]2CCN(CCS(=O)(=O)c3ccccc3)C2)c1OC 1529104315 NODMKPYPXBNNHO-INIZCTEOSA-N 375.490 2.967 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCC[C@H](C4(O)CC4)C3)c2)o1 1772813915 AZPOOPLXLUZXMO-INIZCTEOSA-N 376.478 2.884 0 50 GFAA Cc1ccc(S(=O)(=O)NCCNc2ccc(Nc3ccncc3)nn2)cc1C 11697853 CQUMUOXPFLWDRA-UHFFFAOYSA-N 398.492 2.622 0 50 GFAA CC[C@H](O)CNC(=O)c1sc2ncnc(NCCc3ccccn3)c2c1C 11782529 GSFDKVVFRNEGQC-AWEZNQCLSA-N 385.493 2.550 0 50 GFAA CCN(CCO)C(=O)CC[C@]1(Cc2ccc(OC)c3ccccc23)CCC(=O)N1 11787243 DITNBIBRSACKSY-QHCPKHFHSA-N 398.503 2.661 0 50 GFAA O=C(CCc1nnc(CCC2CCCCC2)o1)N1CCN(c2ncccn2)CC1 12578213 BQPOSNKNSABSDF-UHFFFAOYSA-N 398.511 2.654 0 50 GFAA CN(C[C@@H]1Cc2ccccc2O1)C(=O)CC[C@@]1(Cc2ccco2)CCC(=O)N1 14989269 RFHKRNSSBWLFIX-PGRDOPGGSA-N 382.460 2.713 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](NCCc3ccc(OC)c(OC)c3)C2=O)cc1 18116905 RZOOTQVPEHNXEY-GOSISDBHSA-N 398.459 2.567 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)cn1)N1CC[C@@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1857531283 DHNDATQPSGVVPZ-GOEBONIOSA-N 398.854 2.963 0 50 GFAA CCc1noc(C)c1C(=O)N[C@@H]1CC[C@H](NC(=O)c2ccc(Cl)cn2)C1 1857684554 SFVVRDNKDGVREO-QWHCGFSZSA-N 376.844 2.675 0 50 GFAA CCCc1nnc(N2C[C@H](C(=O)NCCCCc3ccccc3)CC2=O)s1 1857733667 UAHUBWOYEPIEFG-MRXNPFEDSA-N 386.521 2.983 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccncc4)C[C@]34CC[C@H]2O4)c(C)o1 1857734737 PCLIRKDRCCTKTB-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3)C1Cc2ccccc2C1 1875250145 AYRCLFCTTRMLIA-FBHSLPMESA-N 389.499 2.597 0 50 GFAA C[C@]1(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCCN1C(=O)c1ccccc1 116632253 PFEDXFJQLSYEPG-HNAYVOBHSA-N 397.441 2.682 0 50 GFAA NC(=O)c1ccc(NC(=O)[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c(F)c1 844414068 YSIYDOPUBKAKCB-GASCZTMLSA-N 385.395 2.568 0 50 GFAA C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H](C)N1Cc1cn(C[C@H]2CCOC2)nn1 864097329 OYYKVDDDBVHWBN-YYIAUSFCSA-N 393.532 2.533 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@]2(c3cccnc3)C[C@H]2C1 1875329247 MRXKTYIRPGBYMV-MIZPHKNDSA-N 393.487 2.929 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCc3nc(CCC(C)(C)C)ncc3C2)C1 1875371153 QXBZAUGTCJTYEX-INIZCTEOSA-N 384.524 2.765 0 50 GFAA CCNc1ncc(C(=O)N[C@@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@H]2O)cc1Cl 1875403548 WFPTWGJGWDUZPR-VCTAVGKDSA-N 398.294 2.586 0 50 GFAA CCOc1nc(Nc2ccc(C(=O)N3CCOCC3)cc2OC)nc2[nH]ccc12 1772572824 OTTOCUYGSZUQOI-UHFFFAOYSA-N 397.435 2.581 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3nc(-c4ccccc4Cl)oc3c2)C(=O)N1 1857797981 HRARBFAMUXBXSU-AWEZNQCLSA-N 383.791 2.683 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCCC[C@H]1c1cnc(=N)[nH]c1)c1ccc(C)cc1 2325879066 GQFQCQXRPBDZFH-MOPGFXCFSA-N 381.480 2.519 0 50 GFAA CCOc1ccccc1NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 972033 IPLKYVNZFCPTEP-CQSZACIVSA-N 392.477 2.887 0 50 GFAA CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1 1130121 JPOXGMYSDHQYBZ-UHFFFAOYSA-N 396.896 2.504 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCC[C@@H](c2cc[nH]n2)C1 2356143480 JIZCWYZNIVKNFO-CQSZACIVSA-N 386.521 2.642 0 50 GFAA O=C(c1cn(CC(=O)N2CCC[C@]23CCCNC3=O)c2ccccc12)C1CC1 2356150155 OITTVUQCVCJJJB-QFIPXVFZSA-N 379.460 2.505 0 50 GFAA O=C(Cc1ccccc1F)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356152623 SAMMELHMKXDDRX-SPEDKVCISA-N 388.483 2.655 0 50 GFAA CC1(C)CC(NC(=O)C(=O)Nc2ccc(Br)cc2)CC(C)(C)N1 3178194 QQRFLGRIDNNARB-UHFFFAOYSA-N 382.302 2.813 0 50 GFAA in-vitro Cc1ccc(N2CCC[C@]3(CCCN3CC(=O)Nc3cnn(C)c3C)C2=O)cc1 2356164943 MZFAEEUIGNMSML-JOCHJYFZSA-N 395.507 2.637 0 50 GFAA CN(C)c1cccc(CCC(=O)OCCn2cc(Br)ccc2=O)c1 225391217 XTGRQMQZWXWDNG-UHFFFAOYSA-N 393.281 2.853 0 50 GFAA CC(C)S(=O)(=O)c1ncc(CN(C)[C@@H]2CCOC2)n1CCc1ccccc1 20449480 NCZXIRHUUATMPA-GOSISDBHSA-N 391.537 2.529 0 50 GFAA CCOC(=O)CNc1ccccc1C(=O)N(C)Cc1nc2ccc(F)cc2[nH]1 55283218 PBDOMAIWUFWLPV-UHFFFAOYSA-N 384.411 2.949 0 50 GFAA Cc1ccccc1-c1cc(O)c2c(c1)CN(CCCn1nnnc1C)CCO2 67650721 SKWWMDZOCXWEQL-UHFFFAOYSA-N 379.464 2.947 0 50 GFAA O=C(c1cc(COc2cccc(F)c2)[nH]n1)N1CCN[C@@H](c2ccccc2)C1 67603604 UMDWDLUCKMPYGU-HXUWFJFHSA-N 380.423 2.915 0 50 GFAA O=C1CN(Cc2cccc(O[C@@]34CCCN(CC3)C4)c2)CCN1C1CCCC1 67513967 ZZVONLCSAIXBIE-QHCPKHFHSA-N 383.536 2.891 0 50 GFAA O=C(Cc1csc(-c2ccccn2)n1)NCc1ccnc(O[C@@H]2CCOC2)c1 118946624 YPMKGNNEFSJXNF-MRXNPFEDSA-N 396.472 2.627 0 50 GFAA CCN(CC)CCc1ccc(NC(=O)NC2CCN(CCN(C)C)CC2)cc1 252488093 IJIJFBRWMUWKME-UHFFFAOYSA-N 389.588 2.718 0 50 GFAA CN(C(=O)CCN1CCCCCC1=O)[C@@H]1CCCN(C2Cc3ccccc3C2)C1 12432117 XLOMYWFHHCLBBM-OAQYLSRUSA-N 397.563 2.869 0 50 GFAA O=C1N[C@@H]2CS[C@@H](CCCCC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)[C@@H]2N1 252513320 YGNSTQMBYJBWHB-RWUPOKPHSA-N 377.554 2.749 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)n(C)n1 215420037 BGMLIAZWLONUHN-GFCCVEGCSA-N 377.452 2.805 0 50 GFAA CCCCN1CCN([C@H](C(=O)N2CCCCCCC2)c2ccccc2)C(=O)C1=O 77437920 KJIRMRSPKHYKKA-FQEVSTJZSA-N 399.535 2.991 0 50 GFAA Cc1ccc(NC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1F 13320440 XDONXJJAJORHKE-UHFFFAOYSA-N 395.431 2.812 0 50 GFAA Cn1cc([C@]2(C)NC(=O)N(CCCOc3ccc4ccccc4c3)C2=O)cn1 158975095 TUJNDMRIUZPCHS-NRFANRHFSA-N 378.432 2.809 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12)n1c(S)nnc1-c1cccs1 126827716 LPGQDESJQXVDIX-FDYHWXHSSA-N 378.523 2.930 0 50 GFAA COc1ccccc1N1CCC(NC(=O)NC[C@](C)(O)c2ccsc2)CC1 172615413 PFTARXABZBJQCG-FQEVSTJZSA-N 389.521 2.932 0 50 GFAA COc1cccc([C@](C)(CC(=O)O)NC(=O)c2cc3c(nc2O)CCCC3)c1 263120223 GQYZUWJXXCKQAG-NRFANRHFSA-N 384.432 2.795 0 50 GFAA NC(=O)c1c(SCC(=O)c2ccc(F)cc2)sc2c(O)cc(=O)[nH]c12 40288303 OIVVTCWFYZGSRZ-UHFFFAOYSA-N 378.406 2.508 0 50 GFAA Cc1noc(C)c1[C@@H]1CCCN1C(=O)NCCc1nc(-c2cccnc2)no1 426397995 BXADAXZZNAYOBG-HNNXBMFYSA-N 382.424 2.826 0 50 GFAA CCn1c(C)ccc(C(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3)c1=O 92003316 CKDOLWNYQXOYOO-WOJBJXKFSA-N 379.504 2.913 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H](C)Cn3cccn3)csc2C1 426573291 OYFSGOZQZKJRJW-CYBMUJFWSA-N 399.520 2.926 0 50 GFAA O=C(CCn1cccn1)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95360040 RPFMYQZNQRGYQX-MAODMQOUSA-N 386.446 2.640 0 50 GFAA Cc1c(C(=O)N2CCC3(CCC(=O)N(CCc4cccnc4)C3)CC2)ccn1C 92001429 WFKQQJTZWXBEOI-UHFFFAOYSA-N 394.519 2.816 0 50 GFAA CCS(=O)(=O)c1ccc(CNC(=O)[C@H]2CCN(C3CCCCC3)C2)cc1 181366713 AYHDIHGGFXCWRN-KRWDZBQOSA-N 378.538 2.751 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCc1cccc(OCC(=O)O)c1 299753084 WTOVBYGEIFIDKW-FQEVSTJZSA-N 394.427 2.730 0 50 GFAA CSc1nccc(N2CCC(CNC(=O)COCc3ccccc3)CC2)n1 824958992 HDOUDWJSRVBDEF-UHFFFAOYSA-N 386.521 2.748 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)[C@H]2COc3c(cccc3OC)C2)c1C 824424287 FYKHUTRXMVVSLJ-MRXNPFEDSA-N 398.459 2.570 0 50 GFAA CN(C)C[C@]1(CO)CCCN(C(=O)NCC2(c3ccc(F)cc3)CCCC2)C1 584893919 CEVFZPWERCBFDN-OAQYLSRUSA-N 391.531 2.983 0 50 GFAA Cc1ccc(SC2CCN(C(=O)NC3CCS(=O)(=O)CC3)CC2)cc1 584892546 IULVCCUYBSICQG-UHFFFAOYSA-N 382.551 2.838 0 50 GFAA C[C@@H]1Cc2cc(-c3nnc(N(C)Cc4cccc(C(N)=O)c4)n3C)ccc2O1 1339735027 IVTFAJFUDBMHCR-CYBMUJFWSA-N 377.448 2.541 0 50 GFAA O=C(c1ccco1)N1CCCN(Cc2cc3cc4c(cc3nc2O)OCO4)CC1 952985162 DINBBXZRPKHSTR-UHFFFAOYSA-N 395.415 2.610 0 50 GFAA O=C(Nc1cn[nH]c1)[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1 894889048 VQNATZHZRKOOGO-SNVBAGLBSA-N 376.342 2.837 0 50 GFAA Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@H](C)n1nnc(-c2ccccc2)n1 186100049 RJADISKBOKOMDE-JTQLQIEISA-N 379.346 2.601 0 50 GFAA Cc1ccc2cccc(C(=O)NC3CCN(S(=O)(=O)C(C)(C)C)CC3)c2n1 277316984 VYZLBQAVUQORFW-UHFFFAOYSA-N 389.521 2.866 0 50 GFAA CC1(C)COCCN1CCNC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 188030178 YCLXLGHDXGUITM-QGZVFWFLSA-N 399.894 2.673 0 50 GFAA Cn1nc([C@@H]2CCCO2)cc1NC(=O)N1CCN(CCc2ccccc2)CC1 279080800 UJIVGLFMNGVMGT-IBGZPJMESA-N 383.496 2.664 0 50 GFAA COc1ccc(S(=O)(=O)N2C[C@H](CO)[C@H](c3ccsc3)C2)c(C)c1F 188874443 DVFCDUNCYMRWGB-KGLIPLIRSA-N 385.482 2.601 0 50 GFAA O=C1CCN(Cc2cncnc2)CCN1Cc1cccc(C(F)(F)F)c1F 1506411033 WIGHISVZKIZJEU-UHFFFAOYSA-N 382.361 2.869 0 50 GFAA COc1ccc(C(=O)NCc2ccncc2C)cc1OC1CCN(C(C)=O)CC1 12320338 TWJMNGHQUTWTQS-UHFFFAOYSA-N 397.475 2.718 0 50 GFAA O[C@@H](COc1ccccc1CNCC1(O)CCCCC1)CN1CCCCC1 12592952 KDVIWGJBBKBAIT-HXUWFJFHSA-N 376.541 2.697 0 50 GFAA Cc1ccccc1N1CCN([C@H]2CCCN(C(=O)c3snnc3C)C2)CC1 15061797 JJQGANCYICPSBF-KRWDZBQOSA-N 385.537 2.582 0 50 GFAA O=C1C[C@@H](NC2CCN(Cc3ccco3)CC2)CN1C1Cc2ccccc2C1 15076576 IYMBQODMKFBIEU-HXUWFJFHSA-N 379.504 2.602 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 17822435 MKOLLYPARQRULR-PHIMTYICSA-N 378.288 2.564 0 50 GFAA Cc1nn(C)c(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1C 1857674182 WDIKIZDHFUGPIK-NRFANRHFSA-N 381.480 2.530 0 50 GFAA COc1ccccc1Cc1nc([C@H]2CCn3ncnc3C2)n(-c2ccccn2)n1 1857677075 WMOAXNKDRPKQPS-INIZCTEOSA-N 387.447 2.583 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)C1(CCN(Cc3cncn3C)CC1)OCC2 1857686714 DDJQHLWOVWOLLF-UHFFFAOYSA-N 388.537 2.684 0 50 GFAA CC(=O)N1CC[C@@]2(C1)Cn1c(nnc1C(c1ccccc1)c1ccccc1)CO2 1857689671 JLRNIOKPIGVCAC-HSZRJFAPSA-N 388.471 2.980 0 50 GFAA O=C(O)[C@@H]1CN(CC2CCCCC2)CC12CCN(C(=O)c1ccncc1)CC2 1857690632 IBMZGUPFBUNZQL-IBGZPJMESA-N 385.508 2.901 0 50 GFAA Cc1ncc(CN2CCC3(CC2)OCCc2cc(C(=O)NC4CC4)sc23)cn1 1857706402 IOSZKFKLENDXRO-UHFFFAOYSA-N 398.532 2.803 0 50 GFAA O=C(Cn1cccn1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857733925 FZIUQYHQYPYJBW-UHFFFAOYSA-N 389.459 2.552 0 50 GFAA O=C1CCCC[C@@H](C(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)N1 332920599 PADQKVAXFZJJSV-KBPBESRZSA-N 398.290 2.664 0 50 GFAA CC1(C)CN(C(=O)C(=O)N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c2cccc(Cl)c21 246813332 IYADDGLDGDJHFV-HFBAOOFYSA-N 376.884 2.894 0 50 GFAA C[C@H](N)[C@@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2Br)C1=O 262743331 JPWMAGHQRAHVDJ-GUTXKFCHSA-N 394.313 2.530 0 50 GFAA O=C(CN1CCN(Cc2cccc(C(=O)O)c2)CC1)Nc1ccccc1Cl 263503052 WEKJRYITZGZQJK-UHFFFAOYSA-N 387.867 2.795 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3ccc(C(F)(F)F)c(O)n3)CCN2)c1 870154046 XQPZPPKSHPXKBF-HNNXBMFYSA-N 381.354 2.601 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CC[C@H](C(=O)O)[C@@H](C)C2)cc1 952884228 LMBMSIGWQUCLTL-YOEHRIQHSA-N 375.469 2.672 0 50 GFAA C[C@@H]1CN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)Cc2cncnc21 1875290783 CQHABAYKJCVANJ-CYBMUJFWSA-N 375.436 2.833 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C)cc2O3)c2c1CCC2 1875394401 HWSQHIRHZYLEOU-GOSISDBHSA-N 381.476 2.708 0 50 GFAA CC(=O)NC(C)(C)c1noc([C@@]2(O)CCc3cc(Br)ccc3C2)n1 888100153 QYVUMJACXOULFA-QGZVFWFLSA-N 394.269 2.580 0 50 GFAA CC(C)(C)CC(=O)N1CC[C@@H](Oc2ccnc(CNC(=O)c3cccnc3)c2)C1 1775997128 WTLTVJGBZJKFJD-LJQANCHMSA-N 396.491 2.823 0 50 GFAA CN1CCN(c2ccc(C(=O)N3CC4(COc5ccccc5C4)C3)cc2)CC1 2100537800 WSHSSWXXFKIYCN-UHFFFAOYSA-N 377.488 2.516 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1nc(-c2ccccc2)ncc1Cl 2325797097 JHAIQUVRZTUVEI-IAOVAPTHSA-N 397.866 2.563 0 50 GFAA O=C(C[C@H]1Cn2nc3ccccc3c2NC1=O)Nc1ccc2c(c1)CNCCC2 2325857122 QBRPKVVYJJXRSX-INIZCTEOSA-N 389.459 2.669 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NC[C@@H]3CCCO3)cc2)cc1 639870 IRUYXYLTCBAGIR-SFHVURJKSA-N 388.489 2.729 0 50 GFAA O=C1OC[C@H]2CN(C(=O)c3ccccc3-c3nc(-c4ccccc4)no3)C[C@@H]12 2356134315 IZGFIBYVSDGUFW-RHSMWYFYSA-N 375.384 2.649 0 50 GFAA CC(=O)N1C[C@@H]2c3cccc4c3OC[C@]2(CNC(=O)CCc2cccc(c2)O4)C1 2356135018 MLEKIRFINQSANP-XXBNENTESA-N 392.455 2.866 0 50 GFAA COc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc4c(c3)OCCO4)n2)cc1 4810731 YVABXGHJPMBMSL-UHFFFAOYSA-N 398.444 2.982 0 50 GFAA CCN(C(=O)CN1CCC2(CC1)OCCO2)c1nc2ccc(C)cc2s1 4857776 DDXCJXAJWMPSDC-UHFFFAOYSA-N 375.494 2.797 0 50 GFAA CCOc1ccc2nc(NC(=O)[C@@H]3CC(=O)N([C@H](C)COC)C3)sc2c1 8245121 OWCJMHWYAIKMJO-VXGBXAGGSA-N 377.466 2.517 0 50 GFAA CN(Cc1ccncc1)Cc1nnc(CC2CCNCC2)n1-c1ccccc1 55393397 OJOWZFKNFIDTOF-UHFFFAOYSA-N 376.508 2.836 0 50 GFAA Cc1nc2cc(N3C[C@@H](C(=O)Nc4ccccc4C(N)=O)CC3=O)ccc2s1 170564218 BFBAXKRCQAVUIF-LBPRGKRZSA-N 394.456 2.695 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CC[C@@H](N(C)C)C2)no1 11874710 ARAHOLMHLHHDGZ-CYBMUJFWSA-N 379.844 2.692 0 50 GFAA O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N1CCOC2(CCCCCC2)C1 120234283 SDUJBDBITOHVPU-IAGOWNOFSA-N 376.497 2.504 0 50 GFAA COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H](C)Oc1ccccc1 427027374 BDSHTAXGUXSSEY-YJYMSZOUSA-N 384.407 2.975 0 50 GFAA O=C(c1ncccc1O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 71761057 RBFSMFFBUSATNB-VHKYSDTDSA-N 385.414 2.768 0 50 GFAA OC1(CN2C[C@H]3CCC[C@@]3(c3nc(Cc4ccccc4)no3)C2)CCOCC1 328602168 AOIZSDWMEXGBKT-XMSQKQJNSA-N 383.492 2.555 0 50 GFAA CCOC(=O)/C(=C/[C@@H]1OC(C)(C)O[C@H]1COCc1ccccc1)CC(=O)OC 36442942 YUXYPBBQAFUGSA-BVVDNCSCSA-N 392.448 2.776 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccc(C)c(C)c4)CC3)nn2)n1 72117793 JFJMJSSELJSHTO-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)C1 130426948 VLHGUGLVRLTOKI-MJGOQNOKSA-N 380.444 2.747 0 50 GFAA Cn1cc(C(=O)O)c(C(=O)Nc2nc3ccc(Br)cc3s2)n1 20615050 UXKBAFLCGCOUPM-UHFFFAOYSA-N 381.211 2.743 0 50 GFAA NS(=O)(=O)c1ccc(F)c(-c2nc(C3CC3)nn2-c2cccc(F)c2)c1 96137480 QFCKRWSSMBICSE-UHFFFAOYSA-N 376.388 2.737 0 50 GFAA CCOC(=O)c1cccnc1-c1ccc(C(=O)NCc2nnc(CC)o2)cc1 426444863 CZKBELHZKQNLDI-UHFFFAOYSA-N 380.404 2.801 0 50 GFAA O=C(CCN1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1)NC1CC1 426397367 IVPKBFWBMAONBT-NRFANRHFSA-N 377.479 2.921 0 50 GFAA CC(C)OCC(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91829109 GYKICTIAXKWJTK-UHFFFAOYSA-N 380.435 2.731 0 50 GFAA C[C@H](c1ccc(F)cc1)N1CC[C@@H](N2CCn3c(nnc3C(F)(F)F)C2)C1=O 293048319 KIPSDLLURLFZOI-BXUZGUMPSA-N 397.376 2.614 0 50 GFAA CCc1n[nH]c(-c2cccc(NC(=O)N3CCC[C@]4(CC3)CNC(=O)O4)c2)n1 95508320 RBZHMNLWQFFGQC-IBGZPJMESA-N 384.440 2.531 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)Cc1cn2ccsc2n1 91468440 KQQQOBPJBXDSCU-LBPRGKRZSA-N 378.461 2.976 0 50 GFAA Nc1nnc(CCNC(=O)C[C@@H](c2ccccc2)c2ccc3c(c2)OCO3)s1 95523198 XBRBCGSMMLEWNL-HNNXBMFYSA-N 396.472 2.730 0 50 GFAA COCC(=O)N1CCC(C(=O)N2CCCC[C@H]2CCc2cccs2)CC1 91626291 YFPZSKLSNGSTLK-KRWDZBQOSA-N 378.538 2.947 0 50 GFAA COc1ccccc1-c1nc(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)no1 295435168 OIPGPTKGUYMFMZ-UHFFFAOYSA-N 393.447 2.908 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(C(=O)O)[C@@H]3CC[C@@]21C 254381485 RIUISGYIXPQHGQ-LKKJMWJTSA-N 392.492 2.669 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2)C1=O)NCCSc1ccccc1 252537459 LFUAQRFGAZKYMV-QGZVFWFLSA-N 383.473 2.610 0 50 GFAA O=C(c1ccc[nH]1)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940196214 SABIGEZUZPAQNS-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA O=C1CO[C@H](COc2ccc(F)cc2)CN1C1CCN(CC2CCC2)CC1 299799433 SFSAZOCCGFLGBS-FQEVSTJZSA-N 376.472 2.696 0 50 GFAA CC[C@@H](C(=O)N1CCc2nnc(Cc3cccnc3)n2CC1)c1ccccc1 299765559 AGFWKJHEXCZDMV-LJQANCHMSA-N 375.476 2.842 0 50 GFAA CS(=O)(=O)NC1CCN(C(=O)C[C@@H](Cc2ccccc2)c2ccco2)CC1 827913344 IIMFDZUVRGKWPM-QGZVFWFLSA-N 390.505 2.536 0 50 GFAA O=C(c1ccc(Cl)c(NC(=O)N2CC[C@@H]3CNC[C@@H]32)c1)N1CCCCC1 1076012920 FXEGPCTYBYRXIV-PBHICJAKSA-N 376.888 2.792 0 50 GFAA COc1ccc(C(=O)N2CCC(CNC(=O)C3CCOCC3)CC2)cc1Cl 952976620 SDHMQKDLCCNXPF-UHFFFAOYSA-N 394.899 2.744 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@@H](n3cc(C(=O)O)cn3)C2)sc1Cl 276479682 IBIKCHJQQHCSMT-LLVKDONJSA-N 389.886 2.630 0 50 GFAA C[C@H](c1ccccc1)n1c(CN2C[C@H]3[C@H](C2)C3(CO)CO)nc2ccccc21 1772811090 ORDJYIDFZOEIFO-NEWSRXKRSA-N 377.488 2.678 0 50 GFAA O=C(NCc1ccc(F)cc1F)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772807614 ZPLDISJXQIMQFW-LBPRGKRZSA-N 393.459 2.679 0 50 GFAA Cc1ccc(-c2ccccc2CN2C[C@@H]3CN(Cc4cnc[nH]4)C[C@@]3(CO)C2)o1 1772805691 PMHKNQXNMHZHBF-AUSIDOKSSA-N 392.503 2.904 0 50 GFAA CC[C@H](c1nc(COc2cccc(F)c2)nn1-c1cnn(C)c1)n1cccn1 1772806898 GQLYPCCUTPJXJX-QGZVFWFLSA-N 381.415 2.915 0 50 GFAA Cn1nccc1-c1cccc(Cc2ccc(OCC(=O)N3CCOCC3)cc2)c1 1772709450 KJLJSJAINWBIMY-UHFFFAOYSA-N 391.471 2.916 0 50 GFAA O=C(c1cc[nH]n1)N1C[C@@H]2CN(C(=O)C3CCC3)C[C@@]2(CCc2ccccc2)C1 1772707068 QVTYWQQWZLVGFH-CVDCTZTESA-N 392.503 2.743 0 50 GFAA O=C(NCc1ccncc1)c1ccc(OC2CCN(Cc3ncc[nH]3)CC2)cc1 11664529 REKWTQSTSRTLEV-UHFFFAOYSA-N 391.475 2.778 0 50 GFAA CC1(C)CC(=O)c2cnc(N3CCN(Cc4ccc5c(c4)OCO5)CC3)nc2C1 19899928 CSGHYWSEZAZJFP-UHFFFAOYSA-N 394.475 2.683 0 50 GFAA O=C(CCc1ccncc1)N[C@H]1CCC[C@@H](NC(=O)COc2ccc(F)cc2)C1 1857696023 IMLOXHXCEDETOJ-RBUKOAKNSA-N 399.466 2.776 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4ccccn4)[C@H]4CC[C@]3(C2)O4)c(C)cn1 1857712880 VSAYTWYDGWJUKF-VTAPXXACSA-N 378.476 2.507 0 50 GFAA Cc1cc2cccc(C(=O)N3CCC4(CCc5c(O)nc(=N)[nH]c54)CC3)c2o1 1857725397 URNKVVQRBREFPH-UHFFFAOYSA-N 378.432 2.770 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857733775 YAVZALVUWFPOGY-UEXGIBASSA-N 384.382 2.879 0 50 GFAA CC(C)c1nc(C2CCN(C(=O)[C@H](C)n3nnc(-c4ccccc4)n3)CC2)no1 253418354 ONEULVORUYGOAM-AWEZNQCLSA-N 395.467 2.814 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)N2CCCC(C)(C)C2)cc1 497402322 URVDLSBLISJGFN-UHFFFAOYSA-N 388.555 2.528 0 50 GFAA CN(C(=O)c1ccc(N2CCCC2)nn1)[C@H]1CCN(c2ccccc2Cl)C1=O 264763017 NXEKGHBYYYTETQ-KRWDZBQOSA-N 399.882 2.608 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3cc4c(nc3O)CCCC4)C1)CC2 1704300552 YRWGLXDIPGALSU-JOCHJYFZSA-N 378.476 2.885 0 50 GFAA COC(=O)[C@H](CNC(=O)[C@@H](N)CC1CC(F)(F)C1)Cc1ccc(Cl)cc1 1875305072 FNCFQHKIXRVDCA-ZFWWWQNUSA-N 388.842 2.551 0 50 GFAA Cc1ncncc1C(=O)N1CCC2(CC1)C[C@H](O)c1nn(C3CCCC3)cc1O2 1875394317 FGFXYOGQDDUECX-KRWDZBQOSA-N 397.479 2.588 0 50 GFAA C[C@@H]1CCS[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H]1CCSC1 1875357795 XCIWUBQZFUAAGW-PYHPYESLSA-N 390.574 2.780 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)c2ccnc(OCc3ccccc3)c2)o1 1775957275 LSLNZBAZNJCIQS-IAGOWNOFSA-N 394.431 2.554 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)COc2ccc(C)c3c2C(=O)C[C@H]3C)s1 2325702852 RNEHDLXKQWZSBK-LLVKDONJSA-N 393.486 2.939 0 50 GFAA O=C1CCN(C[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)C(=O)N1Cc1ccc2c(=O)cc[nH]c2c1 2325779777 BRECGDKMCRVKSZ-BHEBFOIGSA-N 391.471 2.975 0 50 GFAA CC(C)(C(=O)N1C[C@@H]2CCN(C(=O)C3(C4CC4)CC3)C[C@@H]2C1)N1CCCCC1 2325794767 QEZNSMWEYJSNPY-ZWKOTPCHSA-N 387.568 2.748 0 50 GFAA CC(C)c1cc(NC(=O)c2cccc(C3(F)CNC3)c2)n(-c2ncccn2)n1 2325801023 RJXKLUDLDCVOGX-UHFFFAOYSA-N 380.427 2.806 0 50 GFAA O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)c1c[nH]c2nc(Cl)ccc12 2325804658 CNEDYMQLVJMDMF-HNNXBMFYSA-N 384.867 2.713 0 50 GFAA O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2)c1)N1CCOCC1 1057602 OJUIULCGMHBDJW-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA CCNC(=O)C[C@H]1C(=O)N(c2ccc(F)cc2)C(=O)N1Cc1cccs1 1070195 NTXQTDPUOHLHOZ-HNNXBMFYSA-N 375.425 2.751 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356143482 JKHJIFHBMAQLFS-BOCKYXSRSA-N 375.472 2.677 0 50 GFAA CCN(CC)C(=O)c1cccc(-c2cnc3cncc(N4CCC(O)CC4)n23)c1 2356161037 CWIBITJFFKUJNY-UHFFFAOYSA-N 393.491 2.839 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCc2nc(C3CC3)nn2CC1 2356166007 SMWBNVNMRRYKLH-UHFFFAOYSA-N 390.491 2.585 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(c3ccccc3OCC)CC2)cc1 4139771 SGJHROQXBGZFNL-UHFFFAOYSA-N 390.505 2.995 0 50 GFAA COCC(=O)N1CCC[C@H]1c1ccc(C(=O)Nc2ccc3[nH]nnc3c2)s1 23399397 FJRHNEBKCKMCMV-AWEZNQCLSA-N 385.449 2.582 0 50 GFAA COc1ccc(NC(=O)CSc2nc(O)cc(=O)n2-c2ccc(C)cc2)cc1 20036507 LEYNCYKXMPOEGQ-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA CC(C)(C)c1cnc(CNC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)o1 472398182 YKPHVPUTJSEZKK-UHFFFAOYSA-N 399.472 2.950 0 50 GFAA CC(C)c1nnc([C@@H]2CN(S(=O)(=O)c3c(F)cccc3Cl)CCO2)o1 328626934 MFCBNIIUCRJEQK-LBPRGKRZSA-N 389.836 2.748 0 50 GFAA CCc1ccc(CNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)cc1 252522833 BGMQTVKZDOOAQV-UHFFFAOYSA-N 382.508 2.540 0 50 GFAA Cc1nc(-n2[nH]c(-c3ccccc3)cc2=O)[nH]c(=O)c1Cc1ccc(F)cc1 4002754 UVBYPSJJKCCCGJ-UHFFFAOYSA-N 376.391 2.954 0 50 GFAA Cc1nc(NCCNC(=O)c2ccc(F)cc2F)cc(-n2cnc(C)c2C)n1 72437250 UWHFYUINFRYCAO-UHFFFAOYSA-N 386.406 2.708 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@@H](N(C)Cc3ccccc3)C2)c(=O)n1C 72144921 YEOPWHWEVWGEEI-LJQANCHMSA-N 381.520 2.993 0 50 GFAA O=C(O)c1cc(-c2ccccc2F)cc(S(=O)(=O)NC[C@H]2CCCO2)c1 71749388 NOPMCMMNBITNNZ-CQSZACIVSA-N 379.409 2.648 0 50 GFAA Cc1nn(-c2ccccc2F)c(C)c1[C@@H]1COCCN1CC(=O)N(C)C1CC1 329372686 JNUXHKUAQXVSCX-IBGZPJMESA-N 386.471 2.622 0 50 GFAA CCn1cc(CN2C[C@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cn1 72151911 XVFGTUHEGZOHBL-STZQEDGTSA-N 380.492 2.694 0 50 GFAA CN1C[C@H](C(=O)N(C)C(C)(C)c2ccc3c(c2)OCO3)c2ccccc2C1=O 365837676 XFJKMIUSUUMQAT-KRWDZBQOSA-N 380.444 2.978 0 50 GFAA NC(=O)c1cccnc1N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 72156919 MMTOQPLVSFDCPX-OAQYLSRUSA-N 386.446 2.951 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)NCc1ccc(C(=O)O)cc1 71280242 ZSBAPPLEBYSBOQ-UHFFFAOYSA-N 397.818 2.578 0 50 GFAA Cc1nc(CC2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)no1 426387013 ZRDZTFRIQLGUPN-IBGZPJMESA-N 383.496 2.617 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccccn2)C(=O)c2ccc3cccc(F)c3n2)N1 91364670 LXZGYPZIYNOQBC-INIZCTEOSA-N 378.407 2.690 0 50 GFAA CN1CC[C@@]2(CCC1=O)CN(Cc1cccc(F)c1C(F)(F)F)CCN2C 95379395 WIEYUJCTTXFYOB-SFHVURJKSA-N 387.421 2.973 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@H]2CCCN(CCc3ccc(OC)cc3)C2)cn1 95505217 WAFGUTOCABZSMK-GOSISDBHSA-N 397.523 2.554 0 50 GFAA CC(=O)C(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95501412 AEMBCFUDVMLJMJ-UHFFFAOYSA-N 392.883 2.971 0 50 GFAA Cc1ccccc1CSCCNC(=O)c1ccc(N2CC(=O)NC2=O)cc1 91486257 LDTZCHLFFXJCQA-UHFFFAOYSA-N 383.473 2.714 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)NCc1c[nH]nc1-c1cccs1 96161035 PAZGWFQOYKQPBU-UHFFFAOYSA-N 379.445 2.624 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)sc2c1CCC2 245227381 FICJFSKNWWWKGM-NBLIUIFLSA-N 386.473 2.590 0 50 GFAA O=C(c1cnn(CCC(F)(F)F)c1)N1CCC(c2nnc3ccccn23)CC1 181799319 OHHDZQSJGCFOGL-UHFFFAOYSA-N 392.385 2.898 0 50 GFAA O=S(=O)(N[C@@H](c1cccs1)[C@H]1C[C@@H](O)C1)c1ccc(-c2ccn[nH]2)o1 252527634 DAXQDPRTBIEUNI-OHUAYANFSA-N 379.463 2.522 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)N3CCC4(CCCC4)C3)OCC(=O)N2C2CC2)cc1 1940197365 KXJDRSYBQHZSGA-RTWAWAEBSA-N 398.503 2.919 0 50 GFAA COc1ccccc1C(=O)N1CCC([C@]2(CCC(C)C)NC(=O)NC2=O)CC1 299756797 FWQVVKAOCDAQLP-NRFANRHFSA-N 387.480 2.562 0 50 GFAA COc1cccc(N2CCN(C(=O)NCc3cnc(C)cc3C)[C@H](C)C2=O)c1 584891285 DXHFYRNCUDBUHM-MRXNPFEDSA-N 382.464 2.654 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)C1)c1ccoc1 952967625 MUWVHMCZOBLSOM-GOSISDBHSA-N 392.459 2.807 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCC(=O)N4)C2)n1 952974637 ONRHHHONLTVNRP-AWEZNQCLSA-N 384.436 2.619 0 50 GFAA COc1cccc(CNC(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)n1 170616884 IDOMARZIUNOKGI-HNNXBMFYSA-N 378.473 2.631 0 50 GFAA CCS(=O)(=O)N1CC(CNC(=O)N(Cc2ccccc2)C2CCCCC2)C1 191086606 SJDCPZSFFYBKFO-UHFFFAOYSA-N 393.553 2.812 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)c3cc(=O)n(-c4ccccc4)[nH]3)C2)n1 1506397850 XQECBTWSFPNWCS-OAHLLOKOSA-N 395.463 2.767 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)c3cc4ccc(Cl)cc4n3C)C[C@@H]12 1704300787 ZRIGDLKRGBLNNR-UYAOXDASSA-N 375.900 2.751 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)N1CCC[C@@]2(CCc3c[nH]nc32)C1 1775978420 SOFNQORRLOTSQY-OAQYLSRUSA-N 392.463 2.684 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCCN(CC(=O)N(C)c2ccccc2)CC1 1772702356 RKIDUZNYTNMNCS-IBGZPJMESA-N 395.503 2.651 0 50 GFAA COc1ccc2ccccc2c1CNC(=O)C[C@H]1C(=O)NCCN1CC(C)(C)C 12203302 CTRSTZLAXPPBJV-IBGZPJMESA-N 397.519 2.701 0 50 GFAA COC(=O)CN(C)C(=O)Cc1c2c(n(CC(C)C)c1C)CC(C)(C)CC2=O 12199206 GEKWQIKNTBBHDH-UHFFFAOYSA-N 376.497 2.782 0 50 GFAA Cc1nc2ncccn2c1C(=O)N(C)[C@@H]1CCCN(CCc2ccccc2)C1 12433526 PQBSYMAGCHEWBA-LJQANCHMSA-N 377.492 2.817 0 50 GFAA CCn1ccnc1CNC(=O)c1coc(COc2cccc3cccnc23)n1 12445412 HBGFLCBOADIHJY-UHFFFAOYSA-N 377.404 2.948 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(Cc4cnn(C)c4C)C3)C2=O)c1 14979810 ZVVSQRGRRXXQIZ-QFIPXVFZSA-N 382.508 2.752 0 50 GFAA Cc1ccccc1C(=O)Nc1ccccc1C(=O)NCCCN1CCOCC1 16624057 PGPKOHGYXUYHDQ-UHFFFAOYSA-N 381.476 2.699 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)c4ccc(F)cc4Cl)nnc3c2)n1 169779275 BXWDGOQPNXFHSF-UHFFFAOYSA-N 386.774 2.810 0 50 GFAA COc1ccc2c(c1)c(C(=O)N[C@@H]1C[C@H]3CO[C@H](C(C)C)CN3C1)c(C)n2C 1857723810 XUFLOEFPUIBIPI-GUXCAODWSA-N 385.508 2.723 0 50 GFAA Cn1ccnc1CCNC(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857725873 QOPIQRKBKSPYPX-ZDUSSCGKSA-N 387.871 2.790 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)Cc4cccs4)[C@H]4CC[C@]3(C2)O4)ccn1 1857734165 MDIWUXKPZFARKN-QEUVDIPISA-N 383.517 2.794 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3CCCC3)C[C@]23CC[C@H]1O3)c1cncc(Cl)c1 1857734749 PRDBLUCFZWAMJR-JRBPQWBISA-N 375.900 2.887 0 50 GFAA CCSc1ncc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cn1 1857736723 SDSOAMUERBDYMK-OPYAIIAOSA-N 396.516 2.863 0 50 GFAA Cn1cccc1CNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363572358 DFBXXJWECCHXFZ-LJQANCHMSA-N 377.444 2.805 0 50 GFAA O=S(=O)(N1CCCC1)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704312481 CYXHXIHPXVHCMA-OAQYLSRUSA-N 398.532 2.764 0 50 GFAA C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 854666815 GXKKHBXJEPAKSW-VZVVXEKASA-N 386.492 2.703 0 50 GFAA COCC[C@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)C(C)(C)C 952845280 PLZIIYNBHFBZPP-IBGZPJMESA-N 395.588 2.668 0 50 GFAA CCn1c(=O)c(=O)n(CC(=O)N2c3ccccc3[C@H](C)[C@@H]2C)c2ccccc21 1875281053 NIWQHKNNQLQASE-CABCVRRESA-N 377.444 2.722 0 50 GFAA CCn1c(O)nc2cc(C(=O)N3CC[C@@H](n4c(=O)oc5ccccc54)C3)ccc21 1875274626 OLHJBUKNVIZBHH-CQSZACIVSA-N 392.415 2.757 0 50 GFAA O=C(C[C@H]1COc2ccccc2O1)NS(=O)(=O)Cc1cccc(Cl)c1 1875289284 FDCVLQMXEFUZJW-AWEZNQCLSA-N 381.837 2.516 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NC[C@H]3C[C@@H](CO)CO3)cc12 1875298480 BXICFMRCDNZBHP-SWLSCSKDSA-N 389.452 2.662 0 50 GFAA Cc1ccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)cc1C 1875301059 BNEZEDBNACWDEB-LJQANCHMSA-N 381.524 2.781 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H](CCO)c2cc(Cl)cc(Cl)c2)CC1 1875366285 NYUODWWYKZLXRA-INIZCTEOSA-N 385.291 2.958 0 50 GFAA CCn1nc(C)c(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C(F)F)cc3)C2)n1 1875327941 QIUJEZKZUDUDEC-OAHLLOKOSA-N 391.422 2.531 0 50 GFAA CC(C)=CC(=O)NC[C@@]1(C)CCCN(C(=O)[C@@H]2CCO[C@H]2c2ccncc2)C1 1775989237 HTWVYPWTYKXTRV-KAGYGMCKSA-N 385.508 2.870 0 50 GFAA O=S(=O)(NCCOC12CC3CC(CC(C3)C1)C2)c1ccc2c(c1)OCCO2 4751250 AFUWWCTVRSECQN-UHFFFAOYSA-N 393.505 2.722 0 50 GFAA CCn1c(O)nc2cc(C(=O)N(C)C3CCN(c4ccncc4)CC3)ccc21 2325757112 CZQYIKBNFNDNPO-UHFFFAOYSA-N 379.464 2.898 0 50 GFAA Cc1cccc(Oc2cc(CNC(=O)c3cnn4c3CNCC4)ccn2)c1C 2325768549 WJWCMXLNDDXVAM-UHFFFAOYSA-N 377.448 2.720 0 50 GFAA O=C(C[C@H]1CN(CC2CC=CC2)C2(CCC2)CO1)NC[C@@H]1CCCc2nccn21 2325785250 MACVGBYORCFCTO-PMACEKPBSA-N 398.551 2.857 0 50 GFAA Cc1c(-c2nc(C3(C)CCNCC3)no2)nnn1-c1cccc2cnccc12 2325787551 HBFNVJLOBNBOOM-UHFFFAOYSA-N 375.436 2.815 0 50 GFAA C[C@H]1[C@H](C)Cc2ccccc2N1S(=O)(=O)c1cn(C)nc1Br 2325829549 MNXWPZPCXMJHTC-MNOVXSKESA-N 384.299 2.959 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)NCc3n[nH]cc3Br)ccc21 2325889746 PXWSMXXZDISSBX-UHFFFAOYSA-N 389.253 2.567 0 50 GFAA C=CC(=O)Nc1ccc(CC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)cc1 2325894309 QZMGAFKXVPDKIC-KRWDZBQOSA-N 376.815 2.996 0 50 GFAA Cc1ccc(-n2c3c(cc(C(=O)NC[C@H]4CCCO4)c2=O)C(=O)CCC3)cc1 1108832 OUTGLQHFEDLVBL-MRXNPFEDSA-N 380.444 2.574 0 50 GFAA NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc2oc3ccccc3c2c1 2877188 TZKQUNRGRAEZIZ-GOSISDBHSA-N 394.452 2.961 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H]3CCCOC3)CC1)OCC2 2356170123 WDOQLRJGSKMXLI-INIZCTEOSA-N 375.465 2.521 0 50 GFAA CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C(=O)O)cc2)c1 4953989 ZKSFTJQUMFFMDG-UHFFFAOYSA-N 382.825 2.541 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)Nc1ccccc1 112016536 XTXWYFVUDOEOFU-WMZOPIPTSA-N 379.460 2.682 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC[C@](CO)(Cc3ccccc3F)C2)nn1 67604191 HSZQESMZGTUDGE-NRFANRHFSA-N 381.455 2.838 0 50 GFAA C[C@@H](C(=O)N1CCc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2C1)n1cnnn1 67605917 YVCFYAAYQROISJ-HNNXBMFYSA-N 399.458 2.876 0 50 GFAA CCOC(=O)[C@]1(O)c2cc(OC)c(OC)cc2CCCN1C(=O)c1ccccc1 22589382 CMBLDPMMTYZTTO-JOCHJYFZSA-N 399.443 2.501 0 50 GFAA O=C(c1ccccn1)N1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67673084 CYUNVKUEYJFDRY-UHFFFAOYSA-N 385.471 2.990 0 50 GFAA COc1ccccc1NC(=O)Nc1ccnn1C1CCN(C(=O)N(C)C)CC1 67851025 SFVDNMCDXRNVBC-UHFFFAOYSA-N 386.456 2.854 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(Cc3c(C(=O)N4CCCC4)nc4ccccn34)C2)n1 71763225 GDSDMUSCDGIOAI-GOSISDBHSA-N 392.507 2.831 0 50 GFAA CN1C(=O)N(c2ccc(-n3ccnn3)cc2)C(=O)[C@@H]1c1cc(F)c(F)c(F)c1 328594736 APTUKSFWNZIVBD-INIZCTEOSA-N 387.321 2.824 0 50 GFAA CC(C)c1nccc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)n1 71754146 MWKVJAPVIAJPQR-QGZVFWFLSA-N 385.556 2.555 0 50 GFAA Cc1noc([C@@H]2COCCN2C(=O)CCc2ccccc2OC(F)(F)F)n1 155467650 KYXAIAKOHCEPGY-ZDUSSCGKSA-N 385.342 2.809 0 50 GFAA O=C(N[C@H]1CCO[C@]2(CCOC2)C1)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 332872171 MLBBTUGSDRRARU-DOADOZAASA-N 378.444 2.683 0 50 GFAA Cc1ccsc1-c1cc(C(=O)O)cc(S(=O)(=O)NC[C@@H]2CCCO2)c1 71751835 NSDRWBURZQRKMR-AWEZNQCLSA-N 381.475 2.879 0 50 GFAA Cc1nc2n(n1)CCN(C(=O)Nc1ccc(C(=O)N3CCCCCC3)cc1)C2 378039954 TXXHLDOBPCTJDT-UHFFFAOYSA-N 382.468 2.650 0 50 GFAA Cc1ncsc1CCCNC(=O)N1CCN(c2ccc(Cl)cn2)CC1 426589959 JYJAHLMZTWIBEU-UHFFFAOYSA-N 379.917 2.964 0 50 GFAA NCCCOc1ccc(F)cc1C(=O)NCc1nncn1C1CCCCC1 426651362 PHGQLNFQGKABPR-UHFFFAOYSA-N 375.448 2.580 0 50 GFAA Cc1cc(OC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc(C)c1Cl 239339147 LTDXGLOQYGSKQK-PXQICXGYSA-N 385.847 2.915 0 50 GFAA O=S(=O)(c1cccs1)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95512760 BOKHDQMSJMCAHL-HNNXBMFYSA-N 388.518 2.956 0 50 GFAA Cc1cc(C)nc(N2CCC3(CCC(=O)N(CCCn4ccnc4)C3)CC2)n1 91860360 XFAQTXMBZWBLLC-UHFFFAOYSA-N 382.512 2.589 0 50 GFAA CC1(C)CN(c2nnc(-c3ccccc3)s2)CC[C@]1(O)CN1CCOCC1 91756032 VHIHZIVQIUMAST-FQEVSTJZSA-N 388.537 2.505 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)Nc2cccc(-n3cncn3)c2)CC1 96151726 NJNNLRLRRGTLCZ-UHFFFAOYSA-N 377.452 2.715 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N1CCC[C@@H](Cc2nc3ccccc3[nH]2)C1 92046811 QMRGUUDFKSATDB-ZDUSSCGKSA-N 377.448 2.619 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 91986369 XDPHBLZGQIMLCC-UHFFFAOYSA-N 381.451 2.807 0 50 GFAA O=C(NCc1nc2ccccc2c(=O)[nH]1)[C@H]1CCC(=O)N(C2CCCCCC2)C1 91737110 FRMKHJSTQAXLNA-HNNXBMFYSA-N 396.491 2.501 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@@H]2CCNC2)c1 95521661 MUMODIBIDJGFBJ-MRXNPFEDSA-N 387.524 2.573 0 50 GFAA CC[C@H](NC(=O)Nc1ccccc1CCC(=O)NC)c1cn2cccnc2n1 96149070 NDPFUWGSLSBDGT-HNNXBMFYSA-N 380.452 2.681 0 50 GFAA O=c1c2ccccc2nc(O)n1C[C@H]1CC[C@H](C(=O)Nc2ccncc2)CC1 245255641 JPZHZQVNJGTLMD-SHTZXODSSA-N 378.432 2.942 0 50 GFAA CCN1CCN([C@@H]2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)C2)CC1 182063054 XKAQYKMDDXLLIX-OFLPRAFFSA-N 375.479 2.984 0 50 GFAA CCCC(=O)N[C@@H]1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1 299589405 BQYVYKOMHRABFN-HZPDHXFCSA-N 391.537 2.650 0 50 GFAA CCN1C[C@H](CN(C)C(=O)c2ccc(-c3cnn4ccccc34)cc2)CC1=O 534587171 GNPQGSDBQFTGOL-INIZCTEOSA-N 376.460 2.942 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](O)[C@H](NC(=O)c2cccc(-c3cccc(F)c3)c2)C1 1940195006 HYOKCMINFFDZHM-DFQSSKMNSA-N 384.451 2.887 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1c(F)cccc1Cl 827968447 ZREYHGKWSGSOKR-UHFFFAOYSA-N 392.814 2.969 0 50 GFAA CC[C@H](C(=O)N1CCC(NC(=O)c2ccc3nc[nH]c3n2)CC1)c1ccccc1 271244838 BUPXLODVBSBWSD-KRWDZBQOSA-N 391.475 2.873 0 50 GFAA CC(C)(C)n1cc(C(=O)N2CCc3c(ncn3CCc3ccccc3)C2)nn1 189912152 ZFLKKTZSDLXDJO-UHFFFAOYSA-N 378.480 2.671 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@@H]3CCOc4c(C)cccc43)CC2)n1 191880113 LJDDAQIKTWORON-OAHLLOKOSA-N 387.509 2.764 0 50 GFAA CC(C)[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2c[nH]c3cccc(F)c23)CC1 195198920 PRTGUDUIDFSFSV-CYBMUJFWSA-N 395.500 2.868 0 50 GFAA C[C@H](Oc1ccc(Br)cc1)C(=O)N1CCN(c2ccccn2)CC1 5059743 GDJBOBHRRBPJPD-AWEZNQCLSA-N 390.281 2.960 0 50 GFAA CSCCCN1CCC[C@@H](CNS(=O)(=O)c2cccc3cccnc23)C1 11701866 BJVRNCYHOMNWIJ-INIZCTEOSA-N 393.578 2.978 0 50 GFAA OC1CCN(C[C@@H](O)COc2cccc(CNCCCC3CCCC3)c2)CC1 11768646 AYJVKGVYCIKGKY-JOCHJYFZSA-N 390.568 2.943 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@@H]3C(=O)NCCCc2ccccc2)n(C)n1 11964434 TZRNEONTWFYFBC-LJQANCHMSA-N 394.519 2.720 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)NCC[C@H]3CCCCO3)o2)c1 12072970 BEQMPYRGDSZQPK-QGZVFWFLSA-N 387.480 2.871 0 50 GFAA CCc1nnc(NC(=O)c2nnn(-c3cc(Cl)ccc3OC)c2C)s1 12274276 IBJMWNRFRMHGKS-UHFFFAOYSA-N 378.845 2.904 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@@H](C(=O)c2cccc(C(F)(F)F)c2)C1 12707226 GBLWQDCSAKEBKL-CYBMUJFWSA-N 386.370 2.873 0 50 GFAA COCc1c(C(=O)N2CCCC2)cnn1-c1nccc(-c2ccccc2OC)n1 14971201 IXKKFPDHGARBTR-UHFFFAOYSA-N 393.447 2.720 0 50 GFAA c1ccc(-c2noc(CN3CCN([C@H]4CCc5ccccc5C4)CC3)n2)nc1 19790861 XMIURZWQSZYFIH-IBGZPJMESA-N 375.476 2.807 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccc(C)c(F)c4)nnc23)n1 169776017 UBJHNDDHXIROGR-UHFFFAOYSA-N 380.383 2.719 0 50 GFAA O=C(CCC1CCCC1)N[C@@H]1CCC[C@@H](NC(=O)CCn2ccccc2=O)C1 1857693642 FYENRKKUCGJYGN-RTBURBONSA-N 387.524 2.752 0 50 GFAA COc1cccc(-c2nc(C(=O)NC3CCN(c4ncccn4)CC3)c(C)[nH]2)c1 119651732 OEMTWSPWCQGRKF-UHFFFAOYSA-N 392.463 2.583 0 50 GFAA Cc1cc(C(=O)N2CCC(O)(C(=N)O)CC2)c2ccc(Br)cc2n1 328590183 XUAUELGZZXASHN-UHFFFAOYSA-N 392.253 2.808 0 50 GFAA CS(=O)(=O)C1(C(=O)NCC2(c3ccc(Br)s3)CCC2)CC1 376035967 GFNGZIFGAPYGLN-UHFFFAOYSA-N 392.340 2.626 0 50 GFAA O=C([C@@H](Cc1ccc(F)cc1)c1ccccc1)N1CC[C@](CCO)(C(=O)O)C1 1875313920 XYNOFRIUDSATHP-SIKLNZKXSA-N 385.435 2.838 0 50 GFAA O=C(O)Cc1cccc(CNC(=O)N[C@H](CCO)c2ccc(Cl)cc2)c1 1875307243 LNJBWTDASMETJH-QGZVFWFLSA-N 376.840 2.890 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@H]4CC[C@@H](C)C4)C3)CC2)cc1 1875328549 XTRFBKGHKSVDMU-XLIONFOSSA-N 381.520 2.734 0 50 GFAA Cc1ccc([C@@H](O)[C@H](C)NC(=O)CCn2cc(Br)cn2)cc1F 2325800236 YZTUBTBCLWFHOU-ZBEGNZNMSA-N 384.249 2.722 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccccc2OC)ccc1O 862483 WLRHUAJDQRNCDI-GOSISDBHSA-N 383.404 2.676 0 50 GFAA Cc1nc2ccc(C(=O)N3CC[C@H](O)[C@](CCC(C)C)(C(=O)O)C3)cc2nc1C 2356148592 HQOZLDIJDKQDFT-SIKLNZKXSA-N 399.491 2.961 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 2356164019 AWOZPPTUHUAXIH-ICSRJNTNSA-N 395.906 2.563 0 50 GFAA Cn1c(CNC(=O)c2ccccc2F)nnc1SCC(=O)c1ccccc1 2868768 ZEKWURDSGUDUBS-UHFFFAOYSA-N 384.436 2.859 0 50 GFAA O=C1N(C2CC2)CCC[C@@]12CCCN2S(=O)(=O)c1ccc(F)cc1Cl 2356169738 XSJMKGMRXXYQMT-QGZVFWFLSA-N 386.876 2.787 0 50 GFAA CC[C@@H](C)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 4794506 VFBACQGDAHTASH-OIISXLGYSA-N 378.469 2.943 0 50 GFAA COc1ccc(Cl)c(S(=O)(=O)N2CCCC[C@@H]2[C@@H](O)C(F)(F)F)c1 221987389 JURLXIYGSCLMMP-DGCLKSJQSA-N 387.807 2.815 0 50 GFAA COc1ccccc1[C@H](C)NC(=O)CN1C(=O)O[C@@]2(CCc3ccccc32)C1=O 225826021 DQLRNVXJVLULQW-RCDICMHDSA-N 394.427 2.693 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)Nc2ccc(C(N)=O)c(C)c2)C1 111762326 LXYJXAFXWCTXAM-HNNXBMFYSA-N 382.464 2.751 0 50 GFAA O=Cc1ccc(OC(=O)C2CCC(N3C(=O)[C@H]4CC=CC[C@@H]4C3=O)CC2)cc1 101069273 JKJHXBIRNCTKRD-VHZYLWGESA-N 381.428 2.915 0 50 GFAA Cc1nc(NCCNC(=O)Nc2cccc(F)c2C)cc(-n2ccnc2C)n1 67621884 QAGKUYHUEJOAOJ-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA CCNc1cc(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)nc(C)n1 67621262 AEUPFBCUTARLGL-UHFFFAOYSA-N 378.480 2.589 0 50 GFAA CC(C)c1cc(C2CCN(C(=O)Cn3cnc4ccccc4c3=O)CC2)[nH]n1 67788722 VFINTAPKAZWTSA-UHFFFAOYSA-N 379.464 2.649 0 50 GFAA C[C@H](C(=O)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1)N1CCCC1=O 67880036 UBMZPDYHRPBPOE-MRXNPFEDSA-N 380.492 2.717 0 50 GFAA O=C(Nc1ccccc1F)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528650 LJWQCPTYSQMWCS-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccccc3-n3cncn3)C2)CN1CC1CC1 77377346 MMQHDIUFLZSDFE-JOCHJYFZSA-N 393.491 2.522 0 50 GFAA O=C(Nc1ccc2c(c1)CNCC2)N1CCN(c2ncnc3sccc23)CC1 333255339 DDOOSMUCIDAQSO-UHFFFAOYSA-N 394.504 2.691 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)CCc3nncn3C)C2)cc1 77489436 BLFDTGXHBIDLRR-QGZVFWFLSA-N 378.480 2.852 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)N(C)Cc3cnccn3)CC2)cs1 172289312 JBRAEJMDNYQFSM-UHFFFAOYSA-N 388.541 2.549 0 50 GFAA CC(C)c1ncc(C(=O)N2CCC(n3cc(-c4cccnc4)nn3)CC2)cn1 48465004 PMBHVUJXGUAMGB-UHFFFAOYSA-N 377.452 2.731 0 50 GFAA CCOc1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)cc1OCC 47386891 GWFLMMUMVSFVPW-UHFFFAOYSA-N 376.497 2.668 0 50 GFAA Cc1c(C(=O)N2CCC3(CC2)[C@@H](OCCO)C[C@H]3O)sc2ccccc12 91462079 WWFHHNRIMJMBPU-SJORKVTESA-N 375.490 2.574 0 50 GFAA CCc1c(C(=O)N2CCN(C)[C@@]3(CCC(=O)N(CC)CC3)C2)csc1C 95383525 AGWRTBMMAXZUGK-HXUWFJFHSA-N 377.554 2.778 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)CCCc1cccs1)CCN2C 95353939 PQUSLJHJQHOUQH-FQEVSTJZSA-N 377.554 2.616 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)NCc1nc3ccc(C)c(C)c3[nH]1)CC(=O)N2 91651495 JHIZUKHVGQZPCP-HNNXBMFYSA-N 378.432 2.931 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(c3ncc(C(C)C)cn3)CC2)n1C 96163030 WLCFVEJOCCCILG-UHFFFAOYSA-N 380.500 2.666 0 50 GFAA CC(C)n1c([C@H]2CCCN2C(=O)CCc2nnc(O)nc2O)nc2ccccc21 334161134 UOANWEXDZIZACO-MRXNPFEDSA-N 396.451 2.510 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ncnc4[nH]cnc34)C2)CN1CCc1ccccc1 91643319 CIMWHQFQQJFFOU-QFIPXVFZSA-N 390.491 2.805 0 50 GFAA O=C(CCO)N1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95511496 CVGRNEWAFDOING-UHFFFAOYSA-N 386.536 2.869 0 50 GFAA C[C@@H](NS(C)(=O)=O)C(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1 91644588 QMCIFJKRGZLJLB-QGZVFWFLSA-N 386.517 2.533 0 50 GFAA Cn1c(CO)nnc1[C@H]1C[C@H](NC(=O)CCc2ccc(-c3ccccc3)cc2)C1 244788038 QICCNRYULGYDLP-MXVIHJGJSA-N 390.487 2.969 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)N3CCC[C@H](Nc4ccc(F)cc4)C3)nn2)CC1 247708998 HMEGWJYOGTZWKO-RYQLBKOJSA-N 386.475 2.576 0 50 GFAA O=C(CCc1cncc(F)c1)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 181882808 ZECHXSZOGVRADP-UHFFFAOYSA-N 375.831 2.678 0 50 GFAA O=S(=O)(CCOc1ccccc1)NC1CCN(Cc2cccs2)CC1 377840237 QGXIJNQOYQUCPN-UHFFFAOYSA-N 380.535 2.711 0 50 GFAA COCCn1cnnc1[C@H](C)NC(=O)c1ccc(N2CCCC2)c(Cl)c1 824466626 YKGMXSVGIDJNEN-ZDUSSCGKSA-N 377.876 2.669 0 50 GFAA O=C(NCCc1nc(C2CC2)no1)N1CCO[C@H](c2ccc(Cl)cc2)C1 584901672 HTRPYVROUODJQR-HNNXBMFYSA-N 376.844 2.926 0 50 GFAA Cc1ncn(CCNC(=O)N2CCN(c3nsc4ccccc34)CC2)c1C 670461914 LLFPJNOMXNEJJJ-UHFFFAOYSA-N 384.509 2.641 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3cccnc3)no2)nc(N)n1 952860296 LIDCSYREAYJVJX-INIZCTEOSA-N 393.451 2.680 0 50 GFAA COc1cc(C(=O)NC2CCC(C(=O)O)CC2)cc(OC)c1Br 268943929 UKBYUORHJIGFSS-UHFFFAOYSA-N 386.242 2.840 0 50 GFAA Cc1occc1-c1nnc(NCc2c(C(C)C)nn(C)c2N2CCOCC2)o1 185864400 VYFHNHNLJYTECF-UHFFFAOYSA-N 386.456 2.944 0 50 GFAA O=C(NC[C@](O)(c1ccccc1)C(F)(F)F)c1coc(C2CCOCC2)n1 767987824 FOYHEKVMXVRZBV-KRWDZBQOSA-N 384.354 2.749 0 50 GFAA CCn1c(NCc2csc(-c3cnccn3)n2)nc2cc(C(=O)O)cnc21 1506427647 LUEUJLMGXLCWSP-UHFFFAOYSA-N 381.421 2.675 0 50 GFAA O=C(CCc1cccnc1)N1C[C@@H]2CN(Cc3ccc4c(c3)OCCO4)CC[C@@H]21 1775980849 CTGTYHYGXLWPGT-PMACEKPBSA-N 393.487 2.518 0 50 GFAA Cc1cccnc1CCNC(=O)c1cnn(-c2nccc(-c3cccnc3)n2)c1C 12454807 DMZYDIIXYYSQNP-UHFFFAOYSA-N 399.458 2.709 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)c1cn(Cc2ccccc2C(F)(F)F)nn1 12583061 PEDIHNKDFALXFE-UHFFFAOYSA-N 392.385 2.741 0 50 GFAA COc1ccc(NC(=O)NCCN2CCN(c3ccccc3)CC2)cc1OC 16622602 BWNAFORZNZOMQW-UHFFFAOYSA-N 384.480 2.648 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nc(-c3ccccc3)cc(=O)[nH]2)cc1 18283482 VJDJHACEXAMHPF-UHFFFAOYSA-N 395.440 2.954 0 50 GFAA COc1ccc(OC)c(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c1 169780831 FKVWBIOTZCLMJD-LLVKDONJSA-N 398.394 2.711 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)nc(C)n1 1875246716 KVIVLWDPHQNHQH-SFTDATJTSA-N 380.492 2.772 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)N1CCN(Cc2ccccc2)CC1 119095194 KVBKUJVACXJVEG-UHFFFAOYSA-N 395.507 2.576 0 50 GFAA COc1ccc(CC[C@@H](C)N2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)cc1 11910254 NQIKEOQFWLMLGF-MRXNPFEDSA-N 397.523 2.837 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2F)nc1)N1CCN2CCOC[C@H]2C1 373234002 USOHGLUCENWOQP-CQSZACIVSA-N 390.390 2.700 0 50 GFAA CO[C@@H](C(=O)O)C1CCN(C(=O)C2(c3ccc(C)c(C)c3)CCOCC2)CC1 1875305434 DJRVDOOGCGLBRE-LJQANCHMSA-N 389.492 2.690 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(OCCN4CCCCC4)CC3)n[nH]c21 1875394088 UTSHDWIMHOMWKJ-CVEARBPZSA-N 390.528 2.539 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(Cc3cnc(-c4ccccc4)nc3)CC1)O2 1875394027 YQVUVBFUESYNJB-GOSISDBHSA-N 391.475 2.728 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 784074 LAODADABVDUNSA-HXUWFJFHSA-N 395.484 2.704 0 50 GFAA Cc1ccc(-n2nnnc2SCC(=O)Nc2ccc3c(c2)COC3=O)cc1C 1004739 BDTOFQRFWAVKKB-UHFFFAOYSA-N 395.444 2.680 0 50 GFAA Cc1ccccc1[C@@H]1CN(C(=O)c2cnc3[nH]nc(O)c3c2C(C)C)CCN1 2325859759 JOGNHRJLPRCFMG-INIZCTEOSA-N 379.464 2.882 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CCn3c(nnc3C(F)(F)F)[C@@H]2C)cc1 2325887874 QYQPEQYIBRHWGU-JTQLQIEISA-N 379.342 2.638 0 50 GFAA COc1cccc(N(CC(=O)Nc2ccc(OC)c(Cl)c2)S(C)(=O)=O)c1 1110052 WHBUSQWNOSVSNU-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1nc(-c2ccccc2)cs1 1143904 RQOSDIHTGNUQGC-UHFFFAOYSA-N 399.453 2.593 0 50 GFAA O=C(c1cccc2c1COC2)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356154119 IRVWVMJCESTJBA-BSRJHKFKSA-N 398.503 2.618 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCCCc2ccccc2)C[C@H]1Nc1ncc(F)cn1 2356157758 PKVKOCUZYMIFAY-QXAKKESOSA-N 386.471 2.960 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c(OC)c1 4976025 AUKFJXDNVJJBLU-OAHLLOKOSA-N 386.423 2.873 0 50 GFAA CCC1(CC)[C@H](NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C[C@H]1OC 133270692 MRXTWPOBAHMLPT-HUUCEWRRSA-N 375.494 2.546 0 50 GFAA Cn1cnc2cc(C(=O)N(Cc3ccsc3)C[C@@H]3CCCO3)ccc2c1=O 55254194 QQOZKFKEUAXEGQ-INIZCTEOSA-N 383.473 2.816 0 50 GFAA CN(Cc1ccccc1)[C@@H]1c2ccccc2C2(CCN(CC(=O)O)CC2)[C@H]1O 20909267 RXDTYAOWUJRDJM-YADHBBJMSA-N 380.488 2.652 0 50 GFAA c1cnn(-c2cc(N3CCC(n4cc(-c5ccsc5)nn4)CC3)ncn2)c1 63845433 BNDKHLMBCBMNFS-UHFFFAOYSA-N 378.465 2.824 0 50 GFAA CCN1CC[C@@H](CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)C1 247288776 ZZMVKWNVKIZLKV-PKOBYXMFSA-N 383.458 2.899 0 50 GFAA COCc1nc(Cn2cnc(-c3ccccc3)c2-c2cnn3cccnc23)no1 65533838 LQLBVSOQLXBSBO-UHFFFAOYSA-N 387.403 2.838 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCCC[C@@H]3CN3CCOCC3)cc2)n1 110959184 SMJVJQLGMZBMOF-JOCHJYFZSA-N 396.535 2.875 0 50 GFAA O=c1oc2ccccc2n1CCN1CCc2nc[nH]c2[C@@H]1c1cccc(O)c1 67919718 OHWQSCLVTUXQAO-FQEVSTJZSA-N 376.416 2.671 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(Cc3c(Cl)ccc4cccnc34)C2=O)nn1 328608482 AOMUKOUIWNNSTK-INIZCTEOSA-N 398.854 2.928 0 50 GFAA CCn1cc(Cl)c(C(=O)Nn2c(C)nc3sc4c(c3c2=O)CCC4)n1 2777594 AJYDJKFKTNUEPE-UHFFFAOYSA-N 377.857 2.509 0 50 GFAA CCN1CCC[C@@H](NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)C1 252511134 ZUUWUZFLNCJSGQ-QGZVFWFLSA-N 394.541 2.513 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cccc(-n4cncn4)c3)CC2)oc1C 363141022 PMIZCBJLZXXXHJ-UHFFFAOYSA-N 394.479 2.514 0 50 GFAA CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)CCc1nc(-c2ccco2)no1 218886714 YCYLLLSCDNIIDU-KRWDZBQOSA-N 380.448 2.777 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)c2cnc(C(F)(F)F)nc2)CC1 154871287 GNFYBISZFGIWLN-UHFFFAOYSA-N 392.381 2.838 0 50 GFAA COc1ccc(F)c(-c2nc(CN3CCc4c(c(CO)nn4C)C3)c(C)o2)c1 71765197 GSXIBYUXLKDMRV-UHFFFAOYSA-N 386.427 2.582 0 50 GFAA CC(C)c1ccc(C(=O)N2CC[C@H](Cc3ccc(C(=O)O)cc3)C2)c(=O)n1C 72435502 KJTFJNKDNLEISH-MRXNPFEDSA-N 382.460 2.912 0 50 GFAA CN(C)C(=O)N[C@@H]1CCCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)C1 456897316 BZDBSJINMGEHPA-OAHLLOKOSA-N 383.414 2.999 0 50 GFAA CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)N1CCC2(CCCCC2)C1 174000281 JRRZMPCWEVDWPN-UHFFFAOYSA-N 389.521 2.764 0 50 GFAA CC(C)c1cc(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)nn1C 174348600 MCWJPYXHAARUCS-OAQYLSRUSA-N 384.524 2.719 0 50 GFAA CCOC(=O)c1nn(CCO)c2c1CN(Cc1cccc3ccccc13)CC2 20586473 SRCXRXBBDGPHLW-UHFFFAOYSA-N 379.460 2.764 0 50 GFAA Cc1[nH]nc(CCC(=O)N2CCC[C@@H](CNC(=O)c3ccc(F)cc3)C2)c1C 95526213 WDYIXZHSJGSPHE-INIZCTEOSA-N 386.471 2.767 0 50 GFAA C[C@@H](Cn1cccn1)C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95511704 XAVVZFXZVHZDJL-KRWDZBQOSA-N 378.480 2.565 0 50 GFAA CN(C)c1cc(-c2ccc(C(=O)N3CCC(c4cc[nH]n4)CC3)cc2)ncn1 426712801 SVPWVHRBYGTRFH-UHFFFAOYSA-N 376.464 2.953 0 50 GFAA O=C(NCc1csc(-c2ncccn2)n1)c1cccc([C@@H]2CCCNC2)c1 95384636 FIUNTNIVKDLCLR-MRXNPFEDSA-N 379.489 2.997 0 50 GFAA CN(CC(=O)N1CCC(CCN2CCCC2=O)CC1)Cc1ccccc1F 91873383 YZHPIKNRQHNBGV-UHFFFAOYSA-N 375.488 2.509 0 50 GFAA O=C(CCCN1CCCC1)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95502778 WJMGHBCEHZACSI-QGZVFWFLSA-N 387.553 2.970 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)CCn3c(=O)[nH]c4ccccc43)C2)cc1 95361503 AWCYLTVTMFLMDU-KRWDZBQOSA-N 393.443 2.824 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NCCc1ccc(O)cc1 299086540 LTHXSTWYYRQKSJ-LJQANCHMSA-N 382.460 2.754 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)c(C)o1 183065541 HEEBMVVRXWHUND-QGZVFWFLSA-N 398.912 2.902 0 50 GFAA CN(C)Cc1c(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)oc2ccccc12 183049681 UJQLIWXCNCMFGL-GOSISDBHSA-N 392.459 2.815 0 50 GFAA O=C(NCCOc1cccc2cccnc12)c1csc(-c2ncccn2)n1 828209867 IGFNMPXZWPNCSF-UHFFFAOYSA-N 377.429 2.957 0 50 GFAA CCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1CN1CCOCC1 952973161 BQOUGWNIVXLIIA-MOPGFXCFSA-N 387.524 2.790 0 50 GFAA CN(CCCC(=O)O)C(=O)/C=C/c1cc(Br)c2c(c1)OCCO2 269119124 GNVNVIRMIDLUQH-SNAWJCMRSA-N 384.226 2.557 0 50 GFAA C[C@H]1Sc2ccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)O)cc2NC1=O 268941789 KGZUSBNZMWLPRH-BDJLRTHQSA-N 382.441 2.771 0 50 GFAA CCc1cnccc1C(=O)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 184754953 PAWMIOZPPWOUGY-INIZCTEOSA-N 376.453 2.613 0 50 GFAA Cn1c(-c2ccc3c(c2)OCCO3)nnc1N1CCN(c2ccccc2)CC1 170594093 XUOQOXZAGIPDGB-UHFFFAOYSA-N 377.448 2.580 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2cc(S(N)(=O)=O)ccc2C)C[C@H](C(C)C)O1 1529167290 IGZPTSLWFCZOQA-CRAIPNDOSA-N 382.526 2.698 0 50 GFAA COCCn1c(CN2CC[C@@H]3CCCC[C@H]3C2)cnc1S(=O)(=O)CC1CC1 11663410 OOBHAHHVTPQTFZ-ROUUACIJSA-N 395.569 2.725 0 50 GFAA CC(C)c1ccc(N[C@H]2CCCN(C(=O)CN3C(=O)CSC3=O)C2)cc1 11938273 UNSBEPFNJQMFQA-INIZCTEOSA-N 375.494 2.908 0 50 GFAA CCCn1c(C)c(CC(=O)N2CCC[C@@H](C(N)=O)C2)c2c1CC(C)(C)CC2=O 12714914 YJQDIGKLYLJRBR-OAHLLOKOSA-N 387.524 2.628 0 50 GFAA COc1ccccc1OCc1nc2c3c(C)c(C)n(CCCO)c3ncn2n1 13624392 FQJNJLYIMUCGNK-UHFFFAOYSA-N 381.436 2.666 0 50 GFAA COC(=O)c1c(NC(=O)c2ccco2)c2cc(NC3CCOCC3)cnc2n1C 14530917 GDFWTBZJUBFFQV-UHFFFAOYSA-N 398.419 2.796 0 50 GFAA COCCN[C@@H]1CCc2c(sc3ncn(Cc4ccc(C)cc4)c(=O)c23)C1 15072350 CZAHFHXLJGLBAL-MRXNPFEDSA-N 383.517 2.908 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC3(CC2)NC(c2ccc(C)cc2)=NO3)c1 169754993 MRIJAWVDUWYACD-UHFFFAOYSA-N 395.459 2.926 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857673454 JAYGPHONWMGOHD-PMACEKPBSA-N 398.890 2.911 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)o1 1857729489 CMDHOGJZXZSRKS-QFIPXVFZSA-N 397.475 2.862 0 50 GFAA O=C(c1ccccn1)N1C[C@H]2CC[C@@H](C1)N(Cc1ccc3nsnc3c1)C2 247833280 LPGMMYMTIWJCIB-HOTGVXAUSA-N 379.489 2.823 0 50 GFAA Cn1cnc(-c2cccc(NC(=O)c3ccc(Cl)c(S(C)(=O)=O)c3)c2)n1 378617627 BGLVWGDJSMWSLL-UHFFFAOYSA-N 390.852 2.791 0 50 GFAA COc1ccc([C@H]2CCN(C(=O)c3cn4cc(CN)ccc4n3)[C@@H]2C)cc1F 1875292360 FTBRUDLKGMKITL-CJNGLKHVSA-N 382.439 2.959 0 50 GFAA CC1(C)C=Cc2cc(CN[C@@H]3C[C@@H](Cn4cc(C(=O)O)cn4)C[C@H]3O)ccc2O1 1875326574 MDNXOZGBNCCWSB-ATZDWAIDSA-N 397.475 2.695 0 50 GFAA CC(C)[C@@H](Oc1ccc(Br)cc1)c1noc(-c2nnn(C)n2)n1 1875317142 OZAAYFJYHFCIJE-LLVKDONJSA-N 379.218 2.799 0 50 GFAA CC(=O)N/C(=C/c1ccccc1)C(=O)N1CC[C@H](CO)[C@@H](c2ccccc2)C1 1875312486 FBBIQKHFCBBSCJ-SMCFQVJDSA-N 378.472 2.788 0 50 GFAA O=C(N[C@H](C1CCOCC1)C(F)(F)F)c1c(C(F)F)nc2cnccn12 2325761978 SZSPRXPLDTYHQI-GFCCVEGCSA-N 378.301 2.754 0 50 GFAA Cc1nc(C(=O)N2CCN(c3ccncc3)C[C@@H]2C)nn1-c1ccccc1Cl 2325761990 KXBYCHSVGAFHEV-AWEZNQCLSA-N 396.882 2.975 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)CO[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)CC2)[nH]1 2325783437 ZZKQDJFTCLLXJI-BMGDILEWSA-N 378.517 2.521 0 50 GFAA C[C@]1(C(=O)N[C@@H]2CCN(C(=O)c3ccc4c(c3)NCC4)C[C@H]2F)CCCS1 2325827165 YBLJMJDCXIKAJV-JXXFODFXSA-N 391.512 2.609 0 50 GFAA O=S(=O)(NCc1ccccc1)c1cccc(S(=O)(=O)c2ccccc2)c1 1196207 YCVFSCIMIHTEFJ-UHFFFAOYSA-N 387.482 2.998 0 50 GFAA Cc1c(Cl)cccc1S(=O)(=O)N1CCC[C@@]12CCCN(C1CC1)C2=O 2356143745 VNXGLUPYMCBIBF-GOSISDBHSA-N 382.913 2.957 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cccc(F)c1 2502898 QSMKBMMSRKNZES-MRXNPFEDSA-N 378.425 2.666 0 50 GFAA CCOC(=O)C(CNC(=O)c1ccccc1)(Oc1ccc(C)cc1)C(=O)OCC 2963064 BCWPZYYJPXVTEL-UHFFFAOYSA-N 399.443 2.669 0 50 GFAA CCNC(=O)C[C@H]1C(=O)N(c2ccccc2)C(=O)N1Cc1ccc(OC)cc1 4195491 PMPXTBODZUFCFV-SFHVURJKSA-N 381.432 2.559 0 50 GFAA CC[C@H](NC(=O)[C@@H](C)NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763982 ITQJMWBMKOWEGP-APWZRJJASA-N 398.459 2.940 0 50 GFAA COc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20568009 LURXBNYVSCGDQU-MRXNPFEDSA-N 398.459 2.536 0 50 GFAA CO[C@H](C(=O)Nc1ccnn1C1CCN(c2ncccn2)CC1)c1ccccc1 67784667 KQFMFPJVAAKHIF-IBGZPJMESA-N 392.463 2.841 0 50 GFAA O[C@@H]1CN(Cc2cccn2-c2ccncc2)CC[C@H]1c1ccc2c(c1)OCO2 67713456 XDKACTQDJODXRY-VQTJNVASSA-N 377.444 2.951 0 50 GFAA O=C(NCC1(c2cccc(F)c2)CCOCC1)c1cnnn1-c1ccccc1 65465809 JZKWGDAFDWIIIH-UHFFFAOYSA-N 380.423 2.885 0 50 GFAA Cc1cccc(C)c1Oc1ncccc1CNC(=O)C1CCS(=O)(=O)CC1 67473276 AEKNYUACQMGVMD-UHFFFAOYSA-N 388.489 2.932 0 50 GFAA CCOc1cc(CNC(=O)N[C@H]2CCN(c3ncccc3F)C2)ccc1OC 120007721 HYQHWNZWEYOQLY-HNNXBMFYSA-N 388.443 2.706 0 50 GFAA Cc1ccc(Nc2cc(N3CCN(C(=O)c4cnccn4)CC3)nc(C)n2)cc1 77134249 ODJCVOBNFFWXEP-UHFFFAOYSA-N 389.463 2.589 0 50 GFAA Cc1c(C(=O)N(C)Cc2nc(-c3ccccc3)no2)sc2nc[nH]c(=O)c12 72407415 DUNOKKKKGZFQBY-UHFFFAOYSA-N 381.417 2.615 0 50 GFAA Cc1onc(-c2ccccc2)c1C(=O)N1CCn2nc(CCC(=O)O)cc2C1 72431761 IVRSXGAXSHSWMP-UHFFFAOYSA-N 380.404 2.520 0 50 GFAA Cn1cc(-c2cncc(C(=O)Nc3ccccc3N3CCC(O)CC3)c2)cn1 363506034 DXYSPHKBHCXQEK-UHFFFAOYSA-N 377.448 2.696 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)c3snnc3C)CC2)cc1 12705058 PVLFZKGJMXAMHM-UHFFFAOYSA-N 388.537 2.882 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2c(-c3ccccn3)noc2C)C1=O 154706087 YARDTBBZWWYWCV-OAHLLOKOSA-N 392.415 2.589 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)c3ccccc3-n3cncn3)C2)cc1 72165201 RVQIRTAXEVQRGU-KRWDZBQOSA-N 377.448 2.993 0 50 GFAA Cn1c(=O)cc(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)c2ccccc21 444602844 NDMXXSBSPULLRX-UHFFFAOYSA-N 390.483 2.996 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)n1 237216335 GJVURGJHOSUDDE-LJQANCHMSA-N 391.427 2.841 0 50 GFAA COCc1nc(OC)c2c(C)c(C(=O)Nc3ncnn3C(C)(C)C)sc2n1 282832472 BWWXOLHTRQDHMJ-UHFFFAOYSA-N 390.469 2.754 0 50 GFAA O=C(NCCc1nc2ccccc2[nH]1)c1cn(Cc2cccc(Cl)c2)nn1 72121760 BHDCNJLDELSPND-UHFFFAOYSA-N 380.839 2.829 0 50 GFAA COC(=O)c1c(NC(=O)CSc2nnc(C3CC3)n2C)sc2c1CCC2 17080201 IZFIMASIFZSDCX-UHFFFAOYSA-N 392.506 2.760 0 50 GFAA CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2cc3n(n2)CCCC3)cc1 284933294 BNKCFMJRVCVWHY-UHFFFAOYSA-N 376.482 2.502 0 50 GFAA Cc1cc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)c(C)o1 82107751 KEQOEOMSROQNMG-GOSISDBHSA-N 387.524 2.835 0 50 GFAA COc1ccc(C(=O)[C@@H](O)[C@H](c2ccc(C)cc2)N2CCOCC2)cc1OC 20390200 ZTYFVEASKFFIJK-UNMCSNQZSA-N 385.460 2.629 0 50 GFAA Cc1nsc(C)c1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 292446194 NEFJCZWDOHHRMD-SUMWQHHRSA-N 389.525 2.612 0 50 GFAA Cc1ccc(NS(C)(=O)=O)cc1NC(=O)N1CCCC2(CCOCC2)C1 426491602 WXSRLBBIORJAEG-UHFFFAOYSA-N 381.498 2.791 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@H]1Cn1ccnc1 177816526 SAWXODZYAZQVRH-HNNXBMFYSA-N 390.369 2.787 0 50 GFAA Cc1cc(N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)nc(N)n1 91726161 DXGUDKISYOBRIE-VMPITWQZSA-N 377.492 2.900 0 50 GFAA CN(C)Cc1nnc(C2CCN(C(=O)c3csc4c3CCCC4)CC2)n1C 96138172 DPQYTYSKTROOJF-UHFFFAOYSA-N 387.553 2.837 0 50 GFAA O=S(=O)(N[C@H](c1cccs1)[C@H]1C[C@@H](O)C1)c1ccc(-c2ccn[nH]2)o1 252527635 DAXQDPRTBIEUNI-USBNGQNGSA-N 379.463 2.522 0 50 GFAA CC[C@@H](NS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1nc(C)cs1 183628618 CMVCDAZLLJZKAC-OAHLLOKOSA-N 391.518 2.716 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)[C@H]1COc2ccccc2O1 298970198 KSBAKBLAAZGCMW-HXUWFJFHSA-N 388.414 2.885 0 50 GFAA O=C(NCC1CCN(Cc2cnc(C3CCCCC3)nc2)CC1)[C@H]1CCOC1 827778544 HZYFYRKPJRCUMX-FQEVSTJZSA-N 386.540 2.889 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@H]4CCNC[C@H]4C)csc3C2)nc1 1565508487 NTDXRFFSSCSXCA-QRWLVFNGSA-N 398.576 2.992 0 50 GFAA Cc1cc(C)c(C(=O)N[C@H]2CCOC[C@@H]2Oc2ccc(C(N)=O)cc2)cc1C 1565530761 QVJLKYMTLLLOSY-PMACEKPBSA-N 382.460 2.677 0 50 GFAA COc1cccc([C@H]2CCN(Cc3cc4ccccc4n(C)c3=O)C[C@@H]2O)c1 1565515282 WRMBWEUZWDYOAF-IRLDBZIGSA-N 378.472 2.898 0 50 GFAA Oc1nc(NC[C@H](O)c2c(F)cccc2F)nc2c1cnn2-c1ccccc1 301402963 RNZANFNHVDUZKT-HNNXBMFYSA-N 383.358 2.945 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2cccc(OC3CCCC3)c2)C1 276631908 XDTWGMIJOZCQCO-KRWDZBQOSA-N 395.507 2.727 0 50 GFAA Cc1cc(S(=O)(=O)NCc2nnc(C3CC3)o2)sc1Br 170603632 MNECDAJRTVKOPJ-UHFFFAOYSA-N 378.273 2.558 0 50 GFAA Cc1ccc(S(=O)(=O)NCCNC(=O)c2cc(C)c3ccccc3n2)cc1 192771385 VCQZAVMBMNVWLN-UHFFFAOYSA-N 383.473 2.560 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NCc2ccc(F)c(Br)c2)nc1 194951453 REXSOUQKKHCLRD-UHFFFAOYSA-N 388.262 2.846 0 50 GFAA CCc1csc([C@@H]2CCCN(CC(=O)N3CC(=O)Nc4ccccc43)C2)n1 195382249 CVZNLDXHHHAILB-CQSZACIVSA-N 384.505 2.870 0 50 GFAA CN(Cc1ccc(OC(F)F)cc1)C(=O)Cn1cnc2ccsc2c1=O 198950599 RGESMKALUGRWEI-UHFFFAOYSA-N 379.388 2.718 0 50 GFAA COc1ccc(-c2nc(CN3C[C@@H](O)[C@H](Cc4cc(C)[nH]n4)C3)c(C)o2)cc1 1704299803 KKIMPTZVESORIQ-OXQOHEQNSA-N 382.464 2.726 0 50 GFAA COCCC(=O)N1C[C@@H]2CN(C(=O)c3cc[nH]c3)C[C@]2(CCc2ccccc2)C1 1772707087 YIXFYWRFUGWSSW-OFNKIYASSA-N 395.503 2.585 0 50 GFAA C[C@@]1(NC(=O)C2CC2)CCOC2(CCN(c3ccnc4ccccc34)CC2)[C@H]1O 1772710496 SFCJEVXRBGYXIE-FCHUYYIVSA-N 395.503 2.640 0 50 GFAA Cc1ccc2nccc(C(=O)N3CCCN(C(=O)c4cc(C)on4)CC3)c2c1 1772711655 BJTDLVBQWNSFJC-UHFFFAOYSA-N 378.432 2.828 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNCc2c(F)cccc2Cl)CC1 11842539 FIZISTWUGQAXGL-UHFFFAOYSA-N 376.863 2.832 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)CCn2cccn2)C1 12094286 KVPDHVBXBPXDMP-IBGZPJMESA-N 384.524 2.695 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@@H](C(=O)c2ccc(SC)cc2)C1 15072149 KYQXRXCXHKDLDQ-OAHLLOKOSA-N 378.494 2.966 0 50 GFAA O=C(c1ccc(F)cc1)N1CCC(n2cc(-c3nc(C4CC4)no3)nn2)CC1 169749792 GPPVSKQHJNDSTQ-UHFFFAOYSA-N 382.399 2.822 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cc3ccccc3s2)[C@H]1c1cnn(C)c1 1857715594 ZAZRDWIYBTXGOU-LPHOPBHVSA-N 384.505 2.779 0 50 GFAA COc1cc(CN2CC[C@H](Nc3ncc(Br)cn3)C2)cc(OC)c1 301565248 LYTFCWMYHPXZTH-AWEZNQCLSA-N 393.285 2.943 0 50 GFAA Cc1cnc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)nc1 952894314 NFJDDYOTYFFZJO-INIZCTEOSA-N 376.342 2.940 0 50 GFAA COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)c2cc(C(F)(F)F)nn2C2CC2)C1 1875311005 JDJYEWCRMHXJIP-MNOVXSKESA-N 388.390 2.834 0 50 GFAA CCC[C@H](Oc1ccc(Cl)cc1C)C(=O)N1Cc2nc(O)nc(O)c2C1 1875302171 CKTIRUPZXRVXIJ-HNNXBMFYSA-N 377.828 2.940 0 50 GFAA O=C(CN1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1)NCc1ccccn1 2325740888 KDADUIIKUWGCSK-QGZVFWFLSA-N 379.382 2.790 0 50 GFAA Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)NCCn1cnc(C)c1C 2325807631 IWELADBDUYBVHE-UHFFFAOYSA-N 383.477 2.687 0 50 GFAA O=C1N[C@@H](c2ccc(OCc3ccccc3)cc2)C(=O)N2CC3(CCC3)OC[C@@H]12 2325808994 PIXRPUUEAZDNSD-PMACEKPBSA-N 392.455 2.587 0 50 GFAA O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O)c1ccco1 1211410 ZGYADKBYZJTQPG-QGZVFWFLSA-N 394.383 2.663 0 50 GFAA biogenic CCC[C@H]1[C@H]2C[C@H](CN(S(=O)(=O)c3c(C)noc3C)C2)c2cccc(=O)n21 2356145636 GHMVIPPAQGJECO-XHSDSOJGSA-N 391.493 2.602 0 50 GFAA O=C(c1cccc2c1COC2)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356160051 ATZXDYUYXONMDS-HSZRJFAPSA-N 391.471 2.909 0 50 GFAA Cc1ncccc1C(=O)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 2356168991 RMSLHQWKWXEXBK-DENIHFKCSA-N 382.460 2.691 0 50 GFAA CSc1cccc(CNCc2c(C(=O)N3CCOCC3)nc3ccccn23)c1 23339785 ABBUWMVMRBFPAY-UHFFFAOYSA-N 396.516 2.818 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)[nH]n1 114705728 RPGQHBNXRZCOHE-MRXNPFEDSA-N 391.475 2.999 0 50 GFAA O=C(O)c1cnc2c(c1)n(Cc1ccncc1)c(=O)n2Cc1ccc(F)cc1 55041906 NLOVTZLGSXNDSN-UHFFFAOYSA-N 378.363 2.527 0 50 GFAA Cc1nn(C)cc1NC(=O)CN1CC=C(c2cnn(Cc3ccccc3)c2)CC1 65417403 BWRHZPIVAFRLGY-UHFFFAOYSA-N 390.491 2.701 0 50 GFAA C[C@]1(c2ccco2)NC(=O)N(C[C@H](O)CO[C@H]2CCCc3ccccc32)C1=O 246685156 QWPNBFIURFSRDJ-HZUJVAHNSA-N 384.432 2.502 0 50 GFAA O=c1c2c3c(sc2ncn1[C@H]1CCCN(Cc2ccccc2)C1)CNCC3 65528917 KTELGOKVPPOOFF-INIZCTEOSA-N 380.517 2.941 0 50 GFAA CC(=O)c1ccc(OCc2cc(C(=O)N(C)CCn3ccnc3C)no2)cc1 20601450 VXFJVECVBQVYDU-UHFFFAOYSA-N 382.420 2.733 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCCC2)N1CCC(Cc2ccccc2)CC1 61722059 FCDAFFIEQAUCNT-UHFFFAOYSA-N 379.504 2.994 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)c(Cl)c1Cl 328637928 WCNXWELPYZHODA-JTQLQIEISA-N 390.292 2.739 0 50 GFAA Cc1nc(CCC(=O)N2CCCN(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n[nH]1 72141792 DJKZALDHJAEYDR-IBGZPJMESA-N 387.503 2.944 0 50 GFAA COc1ccc(F)c(CN2CCC3(CC2)C[C@@H](C(=O)O)N(C(=O)C2CC2)C3)c1 72440389 ZAOPBFNEYHYLKW-SFHVURJKSA-N 390.455 2.512 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)o1 363237417 KHDRRZINHUQMLJ-KRWDZBQOSA-N 381.436 2.706 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2ccc3c(c2)OCO3)c2ccccc2C12CCNCC2 72408523 MJSCKZPYPDBZFI-UXHICEINSA-N 380.444 2.536 0 50 GFAA CN1CCN(c2ccc(-c3cc(O)cc(CC[C@@H]4CCCCN4)c3)nn2)CC1 71764010 HBZPPZFRFWPAER-IBGZPJMESA-N 381.524 2.676 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1 375688871 LLBDJWFYYXNLLO-AQNXPRMDSA-N 399.516 2.541 0 50 GFAA c1cn(-c2ccc(OC[C@H]3CCCO3)cc2)c(-c2cc3n(n2)CCCNC3)n1 72469182 FAOHYMXKWATDQP-LJQANCHMSA-N 379.464 2.787 0 50 GFAA CC[C@H]1Oc2cc([C@@H](C)NC(=O)N3CCOCC(F)(F)C3)ccc2NC1=O 378109852 FQIUJWHVUXBCBU-BXUZGUMPSA-N 383.395 2.534 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)c1cn(Cc3cccs3)nn1)C2 173697563 VCMPVSUAFIBWCY-UHFFFAOYSA-N 381.461 2.545 0 50 GFAA NC(=O)C[C@@H]1CCCN(C(=O)c2cccc(OCc3cn4ccccc4n3)c2)C1 174782377 BVWYVSRVJZJARQ-INIZCTEOSA-N 392.459 2.641 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@@H](O)C3)csc2C1 426411560 VAUQYULMAQSLPR-CQSZACIVSA-N 375.494 2.508 0 50 GFAA Cc1cccc(N2CCC(NC(=O)N3CCN(c4ccncc4)CC3)CC2)c1 426488425 WFIRYZVIFDCULI-UHFFFAOYSA-N 379.508 2.891 0 50 GFAA Cc1cccnc1C[C@H](C)NC(=O)N1CCN(c2nc3ccccc3o2)CC1 426490339 RXDHVVBHOUOTGD-INIZCTEOSA-N 379.464 2.994 0 50 GFAA COC(=O)c1sc(I)cc1I 83351213 YHKDNDZSUULRAD-UHFFFAOYSA-N 393.971 2.744 0 50 GFAA CC(C)c1cc(CN(C)C(=O)c2cccc(-c3nc(N(C)C)n(C)n3)c2)no1 426669154 RLRRXZQYHQFXHA-UHFFFAOYSA-N 382.468 2.932 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cnc(-c3ccccn3)nc1)C2 92107016 SCBOAQGQDOQDJA-CQSZACIVSA-N 376.416 2.528 0 50 GFAA CC(C)(C)c1ccc(OC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)cc1 239173610 OHACCAFHDGWNAZ-LXJANLPBSA-N 379.456 2.943 0 50 GFAA O=C(Cc1c[nH]c2cccc(Cl)c12)N1CCN(C(=O)c2ccccn2)CC1 293101774 WOMJRZPZUXCZQG-UHFFFAOYSA-N 382.851 2.743 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3snnc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95370522 XIRLGOYLESDSTD-RCCFBDPRSA-N 384.505 2.558 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95504782 UIGKBIAUPUMUHX-QGZVFWFLSA-N 390.491 2.948 0 50 GFAA Cc1[nH]ncc1CNC(=O)CC[C@H]1N=C(O)N(c2cccc3ccccc23)C1=O 252499004 RTJUFJDTTZJDJO-QGZVFWFLSA-N 391.431 2.597 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2C[C@@H](C(=O)N3CCCCC3)CC[C@H]2O)cc1Cl 1940195834 PKWSSBULEKYFQR-CGTJXYLNSA-N 378.900 2.920 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](c2nnc3sc(-c4ccc(Cl)cc4)nn23)C1 825554381 HVKJGAXVOQRQNI-LLVKDONJSA-N 397.913 2.645 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)NCc1noc([C@H]2CCCO2)n1 584891243 AAPXGXSUBYKQTJ-GFCCVEGCSA-N 377.470 2.598 0 50 GFAA CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccoc2C2(O)CCOCC2)C1 1326482903 PZZBAVTYIIVDJD-GOSISDBHSA-N 384.476 2.624 0 50 GFAA COc1cc(CN2C[C@@H]3CC[C@H]2CN(Cc2ccccn2)C3)cc2c1OCO2 1565527108 WFJILTFSOYPQNW-APWZRJJASA-N 381.476 2.915 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 269271656 MOYFLEUMNBMJNY-CHWSQXEVSA-N 377.286 2.834 0 50 GFAA O=C(c1cc2c(s1)-c1ccccc1CC2)N1CCC[C@@H](N2CCNCC2=O)C1 186635297 NMKRRGCVVRBNRY-QGZVFWFLSA-N 395.528 2.550 0 50 GFAA COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 186661856 XDFXSZUCKWCJET-SJLPKXTDSA-N 376.497 2.661 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@@H](Cn3ccnn3)C2)ncn1 275707928 NYRQANWLMXJKPJ-HLIPFELVSA-N 385.516 2.600 0 50 GFAA CN(Cc1ccccc1)c1ccc(NC(=O)NC[C@H]2CCS(=O)(=O)C2)cc1 170645304 XYBPJXRIOFLGRD-QGZVFWFLSA-N 387.505 2.879 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)c2ccccc2N2CCOCC2)C1 1506398588 SJBTVKOGGCJWON-QGZVFWFLSA-N 379.460 2.653 0 50 GFAA c1ccc(CN2CCCO[C@@H](CN3CCC(N4CCSCC4)CC3)C2)cc1 1506426641 PTGHFDQFEIWNAK-QFIPXVFZSA-N 389.609 2.791 0 50 GFAA Cc1ncc(CN(CCO)C(=O)c2ccccc2OC(F)(F)C(F)F)[nH]1 1704332142 PWVLWCZYXJZDAE-UHFFFAOYSA-N 375.322 2.590 0 50 GFAA COC(=O)CCNC(=O)c1ccc2nc(Cc3ccc(OC)c(OC)c3)oc2c1 11661223 IMVYAJFMIQYIJJ-UHFFFAOYSA-N 398.415 2.729 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2cc3c(cc2Cl)OCO3)C1)N1CCOCC1 12193919 WTNRFYKOGPSPHN-HNNXBMFYSA-N 394.899 2.920 0 50 GFAA O=C(CCC1CCN(C(=O)CCc2cccs2)CC1)NC[C@H]1CCCO1 12196033 HYEPSKUHHCNVKR-QGZVFWFLSA-N 378.538 2.995 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)CC4CC4)C3)C2=O)c1OC 12456819 DEMWKBUZZBINSI-JOCHJYFZSA-N 386.492 2.845 0 50 GFAA O=C(CCC1CCN(Cc2cccn2-c2ncccn2)CC1)NC[C@@H]1CCCO1 12595072 SKHNTDCWMYGVSX-FQEVSTJZSA-N 397.523 2.555 0 50 GFAA CCOC(=O)c1cnn(-c2nc(-c3ccccc3)cs2)c1CN[C@@H](C)CO 15068369 MRYMFZILWUJVIL-ZDUSSCGKSA-N 386.477 2.643 0 50 GFAA CCC(=O)N1CCN(c2ccccc2NC(=O)c2ccc3c(c2)OCCO3)CC1 16489905 VYWCVLSUOBPPBC-UHFFFAOYSA-N 395.459 2.769 0 50 GFAA COc1cc(CNCCc2ccccc2)cc(Br)c1OCC(N)=O 19871694 SPTMLBVQYFSRJX-UHFFFAOYSA-N 393.281 2.654 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)CCc1n[nH]c2ccccc12 1857527469 PCHDNCBIOYZYRU-KUHUBIRLSA-N 394.479 2.812 0 50 GFAA COc1ccc(-n2ccnc2-c2cnn3c(C)cc(C)nc23)cc1C(=O)N(C)C 1857684864 HZNHQIWFXKTXFE-UHFFFAOYSA-N 390.447 2.909 0 50 GFAA COc1ccc(C(=O)N[C@@H](C)c2nncn2C)cc1Oc1ccc(CN)cc1F 1857695958 GHXQUAWUDSRXND-LBPRGKRZSA-N 399.426 2.705 0 50 GFAA COc1ccc(CCC(=O)N[C@@H]2CN(C/C=C/c3ccccc3)CC[C@@H]2O)cc1 1857701779 OWOOOUMWSWZWPR-HDAYSWOHSA-N 394.515 2.893 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c2c(C)noc2n1 1857706604 NGHYSBADOGJPIT-ICSRJNTNSA-N 394.475 2.984 0 50 GFAA CC(C)[C@@H]1CN2C[C@H](NC(=O)c3ccc4nc(C(F)(F)F)[nH]c4c3)C[C@H]2CO1 1857720359 QIPPNSCZIFPSDU-WWGRRREGSA-N 396.413 2.809 0 50 GFAA Cc1nc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)cs1 1857721771 FOLALKHRNYOIHP-GMLUQMLDSA-N 383.517 2.861 0 50 GFAA CN(CC1CCC1)C(=O)[C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857739274 HGCNBBDHVCVEOJ-MRXNPFEDSA-N 384.505 2.740 0 50 GFAA Cc1c(C(=O)N2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)[nH]c2ccc(F)cc12 1857732617 YGBFKQLNJFEXLJ-FVJLSDCUSA-N 385.439 2.813 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1cccs1)N1CCN(c2cccc(O)c2)CC1 123267252 HNDWOIHPOLYIIT-GOSISDBHSA-N 399.516 2.797 0 50 GFAA CN1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)[C@@H]1c1ccccc1 248038264 LNTGZZQIHWMBNG-HBMCJLEFSA-N 377.488 2.853 0 50 GFAA COc1ccc(-n2ncc(C(=O)Nc3ccc(O)c(C)c3)c2C(F)(F)F)nn1 157329733 KEMNHPPLKUQJNE-UHFFFAOYSA-N 393.325 2.956 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccnc(-n2ccnc2)c1 267482492 VELUGSFGGNTOHP-FXAWDEMLSA-N 375.476 2.908 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)c2n[nH]c3ccc(Br)cc23)CC1(F)F 1875266291 FGNCJQILRULFAU-SECBINFHSA-N 388.168 2.507 0 50 GFAA COc1cc(CN[C@@H](Cc2ccc(F)cc2F)C(=O)O)cc(OC)c1OC 1875283224 JXWQBTGMUJWKOW-HNNXBMFYSA-N 381.375 2.776 0 50 GFAA COC(=O)[C@@H]1CCCC[C@@]1(C)NCC(=O)NC(=O)Nc1cc(C)ccc1C 1875308934 JBQGNHSWHXGREP-MGPUTAFESA-N 375.469 2.663 0 50 GFAA C[C@@H]1CCN(c2ccc3nnc(Br)n3n2)C[C@H]1C(=O)OC(C)(C)C 882511687 CXIIJRNYTCQEAE-GHMZBOCLSA-N 396.289 2.691 0 50 GFAA C[C@@H]1CCN(CC(=O)N(C)[C@@]2(c3ccccc3Cl)CCCCC2=O)C[C@@H]1O 956933822 NQTHJRWZXINVCK-FYINFDKHSA-N 392.927 2.840 0 50 GFAA CCc1ccccc1NC(=O)CSc1nnnn1-c1ccc(C(=O)OC)cc1 1439263 SKLZIAJPWZNXMR-UHFFFAOYSA-N 397.460 2.742 0 50 GFAA CC(C)(C)c1ccc(C(=O)N[C@@]2(C(F)(F)F)N=C3SCCN3C2=O)cc1 2504106 KZKDHXYXZCAQBI-MRXNPFEDSA-N 385.411 2.918 0 50 GFAA COC[C@@]12COC[C@@H]1CN(C(=O)Cc1ccccc1OCc1ccccc1)C2 2100555247 NQPSHBJEHTYYAF-REWPJTCUSA-N 381.472 2.930 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CC[C@H](c4nc(C)no4)C3)no2)cc1OC 1857798778 ARQFRJOSJBJDRG-ZDUSSCGKSA-N 384.392 2.680 0 50 GFAA Cc1ccccc1N1C(=O)CN(C(=O)c2ccc(N3CCOCC3)cc2)C[C@H]1C 11791469 JYJRVSNZSGCFFU-GOSISDBHSA-N 393.487 2.709 0 50 GFAA COCCn1c([C@@H](O)c2cccc(C)c2C)nnc1N(C)C1CC(F)(F)C1 2325768837 VZRDFJOMJZTNJE-INIZCTEOSA-N 380.439 2.857 0 50 GFAA COc1ccccc1-c1c[nH]cc1C(=O)N1CCC(Cc2nncn2C)CC1 2325770125 HAMTWUPLWQOODC-UHFFFAOYSA-N 379.464 2.914 0 50 GFAA O=S1(=O)CC[C@@]2(C(F)(F)F)CN(C[C@@H](O)c3cc4ccccc4o3)C[C@H]21 2325771747 MSJHBUJWHWTRSG-DAXOMENPSA-N 389.395 2.518 0 50 GFAA O=C1O[C@@H](CN2CC[C@](O)(c3cccc(Br)c3)C2)CC12CCC2 2325799466 ALINYJUAMDRPGF-CRAIPNDOSA-N 380.282 2.828 0 50 GFAA O=S(=O)(Cc1ccccn1)N1CCC[C@@H]1c1cncc(Br)c1 2325803957 MBEBZTPCSRIZQQ-OAHLLOKOSA-N 382.283 2.906 0 50 GFAA COc1cccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCc2ccc3c(c2)OCO3)c1 844449 MLDSRMDEOAKFFQ-IBGZPJMESA-N 396.399 2.795 0 50 GFAA Cc1ccc(-n2c(SCC(=O)N3CCOCC3)nc3ccccc3c2=O)cc1 1299840 DTOWGLHSNUCULG-UHFFFAOYSA-N 395.484 2.645 0 50 GFAA Cc1noc(C)c1C(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 2872841 QLIYBLHMJPGGPW-UHFFFAOYSA-N 378.435 2.801 0 50 GFAA COc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)cc1Cl 6703914 IYGBQNNYSYXSQF-UHFFFAOYSA-N 375.233 2.902 0 50 GFAA O=C(CS(=O)(=O)c1ccccc1)Nc1cccc(Cl)c1N1CCOCC1 8715388 ZBKOHXHJEBEKAY-UHFFFAOYSA-N 394.880 2.589 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H]2Cc2cc(F)ccc2F)cs1 416261081 UASREJPUHHBYLH-CYBMUJFWSA-N 386.445 2.521 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@@H]1OC 460119136 XUZPLEIBQNYDIX-BMFZPTHFSA-N 394.269 2.761 0 50 GFAA CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccc2c1OCCO2 115588105 DYHGILXPLYMKRY-QGZVFWFLSA-N 388.489 2.747 0 50 GFAA CCCN1CCCN(C(=O)c2cc(CN3CCc4ccccc4C3)on2)CC1 67771022 OSZIDVVVDNZTAP-UHFFFAOYSA-N 382.508 2.791 0 50 GFAA Cc1nc(-c2ccc(C(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c2sccc2n1 2356096804 DTXGPJNDNJTOPG-AWEZNQCLSA-N 387.486 2.584 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)Nc2nccs2)c(Cl)cc1Cl 1080284 YAIHNIODMZNMCI-UHFFFAOYSA-N 380.278 2.953 0 50 GFAA CCCNC(=O)CN(C)C(=O)CSc1nnc(-c2ccc(C(C)C)cc2)o1 171163088 OLXOPVWXMPSXGT-UHFFFAOYSA-N 390.509 2.937 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1ccc2c(c1)OCO2 39358334 HCJCVZIKTIRCQE-UHFFFAOYSA-N 390.443 2.814 0 50 GFAA COc1ccc(F)c(F)c1C(=O)N1CCCC[C@H]1CCN1CCN(C)CC1 219830099 PYHPUQSBWISHFD-HNNXBMFYSA-N 381.467 2.606 0 50 GFAA CCc1nnc(O)c(C(=O)N2CCn3c(C4CCCC4)nnc3[C@H]2C)c1CC 366085630 LHFOBUHQEFVFRJ-GFCCVEGCSA-N 384.484 2.773 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@@H]1CC(=O)NC(C)(C)c1ccccc1 72153130 GUTFPPLKNZFHMM-FQEVSTJZSA-N 379.504 2.737 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3ccnc(N4CCCCC4)n3)CC2)cc1 72140632 NJZABGKSBPDMIS-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCCC[C@H]1CCC(=O)O)c1c(F)cccc1F 236685224 AOCJPLSBBSONEI-BBRMVZONSA-N 382.407 2.778 0 50 GFAA CCN(CC)CCOc1ccccc1NC(=O)N1CCC[C@@H]1c1nncn1C 159164462 CRMUCPBNZINLHL-QGZVFWFLSA-N 386.500 2.905 0 50 GFAA NC(=O)CC1CCN(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)CC1 173948360 KAPQGPUILWPTGG-HNNXBMFYSA-N 378.904 2.606 0 50 GFAA COc1ccccc1-c1ccc(CN[C@H]2CCN(c3cnn(C)c3)C2=O)cc1 174406868 NKWBKPZNBPNHSP-FQEVSTJZSA-N 376.460 2.991 0 50 GFAA COc1ccccc1-c1noc(CCCC(=O)N2CCC(c3nc[nH]n3)CC2)n1 426716115 PIXOMLPCYRPSKS-UHFFFAOYSA-N 396.451 2.592 0 50 GFAA CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1CC[C@@H](C(=O)O)C1 263302317 XAFRYDVKFGPXQO-SUHUHFCYSA-N 385.258 2.641 0 50 GFAA O=C1CCC2(CCN(C(=O)N[C@H](c3ccncc3)c3ccc(F)cc3)CC2)N1 426387608 GRPFJJPMYYVUPK-IBGZPJMESA-N 382.439 2.764 0 50 GFAA Cc1ccc2[nH]cc(C(=O)N3CCC([C@H](O)c4ccccn4)CC3)c(=O)c2c1 220178587 INYIQNAINGWYPY-FQEVSTJZSA-N 377.444 2.817 0 50 GFAA Cn1cnc2c(C(=O)N3C[C@H](COc4ccccc4)OC(C)(C)C3)ccnc21 288023113 NALRWGVTVYFKLB-MRXNPFEDSA-N 380.448 2.667 0 50 GFAA CN1CCCC[C@H]1C(=O)N1CCc2ccc(NC(=O)c3ccccn3)cc2C1 95529824 BDZQGZCLGUQWBJ-FQEVSTJZSA-N 378.476 2.703 0 50 GFAA O=C1CC2(CCN(C(=O)c3cnccn3)CC2)CN1CCCc1ccccc1 91782236 QWLTWHNVECQOJI-UHFFFAOYSA-N 378.476 2.564 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC[C@@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n1 95504184 USLUYWQXDJMJAA-AWEZNQCLSA-N 390.434 2.945 0 50 GFAA CC(C)[C@H](O)C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95500582 BWQZZPCNHWEZTG-SFHVURJKSA-N 378.900 2.698 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)c2nc3cccc(C)n3c2F)CC1 95496949 CLMIDWKHMZZQND-UHFFFAOYSA-N 385.443 2.645 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CC[C@@H](Cc2ccc(CO)cc2)C1 91876841 RNAQZFOKKVYNQP-FQEVSTJZSA-N 390.483 2.893 0 50 GFAA O=C(NCc1nc(Cc2ccccc2)no1)c1cc(-c2ccccc2O)n[nH]1 91680517 SZAWWLHKUMWUKM-UHFFFAOYSA-N 375.388 2.686 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1cc(Cl)c[nH]1)CC2 299410588 QGKHETCTPGJIIC-CQSZACIVSA-N 378.812 2.900 0 50 GFAA CCOc1cc(C(=O)N2CCC[C@H](C(F)(F)F)C2)ccc1OCC(=O)O 299751854 RZIHAEMPLDTACZ-LBPRGKRZSA-N 375.343 2.963 0 50 GFAA O=C(O)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)C1CCOCC1 299750009 MJVTXIDMEZMDCM-UONOGXRCSA-N 387.354 2.781 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(C(=O)c2csc(-c3ccc(F)cc3)n2)C1 298607732 MBGZEQGCRANPSD-GFCCVEGCSA-N 382.482 2.846 0 50 GFAA COC(=O)c1cn([C@@H](CC(C)C)c2nc3ccccc3[nH]2)cc2c(=O)[nH]nc1-2 263587950 NHMGMCUBQZATBC-INIZCTEOSA-N 379.420 2.975 0 50 GFAA COCc1noc(CNC(=O)N2CCC(Sc3ccccc3C)CC2)n1 534661903 STGPJICGCFDXMA-UHFFFAOYSA-N 376.482 2.991 0 50 GFAA Cc1cccc(C(=O)N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)n1 1940194849 WXVACOCOIFCAME-DENIHFKCSA-N 382.460 2.691 0 50 GFAA CCc1ncc(S(=O)(=O)NCC[C@@H]2CCCCN2Cc2ccccc2)[nH]1 670465084 ISMRUJBAGIHYRG-KRWDZBQOSA-N 376.526 2.695 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(N2CCNC2=O)ccc1Cl 268944370 LYHLCOAGOHEJGD-KRWDZBQOSA-N 399.834 2.521 0 50 GFAA Cc1nn(C(C)C)c(C)c1-c1nc([C@H]2CCCN(C)C2)nn1-c1cnn(C)c1 1772819216 QQALIYBHXJINTD-INIZCTEOSA-N 382.516 2.871 0 50 GFAA Cc1cccc(CN2CCC(N3CCC(C(=O)N4CCCCO4)CC3)CC2)n1 11665920 YPUHBTCZGYBXST-UHFFFAOYSA-N 386.540 2.620 0 50 GFAA CC(=O)c1ccc(N2CCN(C(=O)c3cn(C4CCCCC4)nn3)CC2)cc1 12204156 LSPCYBYQWLPINV-UHFFFAOYSA-N 381.480 2.948 0 50 GFAA O=C(NCc1ccccn1)c1ccc(OC2CCN(Cc3ncc[nH]3)CC2)cc1 12306496 IRLQWUZESCABQT-UHFFFAOYSA-N 391.475 2.778 0 50 GFAA CC(C)c1ccc(CN2CCC[C@H](n3cc(C(=O)N4CCOCC4)nn3)C2)cc1 12326034 CXLSRCORCKDVBN-FQEVSTJZSA-N 397.523 2.711 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)[C@H]1CCC(=O)N(C2CCCCCC2)C1 12707244 RLPXZTICOQQVIA-SFHVURJKSA-N 395.507 2.845 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cccnc2C(F)(F)F)C[C@H]1C(=O)O 169725733 XNVGCNCBHUXDDH-NSHDSACASA-N 375.347 2.611 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N[C@H]1CCc2ccccc21)CCCC3 169778284 BEKRYBKQQHVXPF-KRWDZBQOSA-N 376.460 2.646 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ncc[nH]2)CC12CCN(C(=O)CC1CCCCC1)CC2 1857687720 BAIKFFLIUOGJKO-KRWDZBQOSA-N 388.512 2.505 0 50 GFAA NC(=O)CCCn1cc(-n2ccnc2-c2cc3ccc(Cl)cc3nc2O)cn1 1857705676 PZKKWZCANUCYER-UHFFFAOYSA-N 396.838 2.909 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)N[C@H]1CCCc2c1c(C)nn2C 1857708487 WTZCXAZIJQPRGN-INIZCTEOSA-N 385.493 2.579 0 50 GFAA CCc1cc(CN2C[C@@H]3[C@H](CNC(=O)C(C)(C)CC)[C@H]4CC[C@]3(C2)O4)on1 1857725650 HIQGQUBBATUCGM-XKGFGPFHSA-N 375.513 2.769 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1C[C@@H](O)[C@H](Cc2ccncc2)C1 1857726020 FQZFQSRTPIDJSB-IEBWSBKVSA-N 379.485 2.805 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1)N1CCCC2(CC2)C1 1857739962 AYXWIFDZDHSEFM-MRXNPFEDSA-N 396.516 2.884 0 50 GFAA N=c1nc(O)cc(N2C[C@H](c3ccc4c(c3)OCO4)O[C@H](c3ccccc3)C2)[nH]1 1875245251 RIBUSQZCZOQYDI-ZWKOTPCHSA-N 392.415 2.643 0 50 GFAA COc1ccc(C(=O)N2CCN(c3nc(C)cc(N4CCCCC4)n3)CC2)cc1 15824973 RXVRMXHHNUSEMT-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1cncn1COCc1ccccc1)C(=O)O 35395298 LPVKZCHCZSFTOJ-INIZCTEOSA-N 375.425 2.578 0 50 GFAA in-vitro Cc1ccc(-c2cc(C(=O)N[C@@H]3CC34CCN(C(=O)c3ccoc3)CC4)n[nH]2)o1 1875341928 ORDAEQGRWXXBIC-GOSISDBHSA-N 394.431 2.996 0 50 GFAA CN(CCN(C)C(=O)[C@@]1(C)C[C@H]2CC[C@H]1C2)C(=O)c1cccc2nc(O)oc12 1875332884 PETMBUCRWUTIRS-RXSFTSLZSA-N 385.464 2.890 0 50 GFAA C=CC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)cc2Br)[C@@H](C)C1 1875371164 RFCVTGAGDNNTNT-RYUDHWBXSA-N 399.260 2.601 0 50 GFAA O=C(O)CCc1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1 12429192 RCTYFLVEQDOWFA-UHFFFAOYSA-N 388.445 2.631 0 50 GFAA CCn1c(O)nnc1[C@@H]1C[C@H](OC)CN1Cc1nc(-c2ccsc2)oc1C 2325715675 BPJSTENMEGYBAH-ZFWWWQNUSA-N 389.481 2.991 0 50 GFAA CN1CCC(N(Cc2ccccc2F)C(=O)[C@@H]2CC(=O)Nc3ncccc32)CC1 2325771248 NESQKHSJFOFKFS-GOSISDBHSA-N 396.466 2.770 0 50 GFAA O=C(N=c1cc(-c2cc(F)cc(F)c2)[nH][nH]1)c1cnn(CC2CCOCC2)c1 2325806336 HNUICMLXTKVORQ-UHFFFAOYSA-N 387.390 2.652 0 50 GFAA C[C@@H]1[C@H](C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)[C@H](C(=O)O)[C@@H]1C 2325815734 MSNJXCPBLOZQLZ-KTQGLZRJSA-N 399.413 2.788 0 50 GFAA OCC[C@H](NCc1cccc(-c2nn[nH]n2)c1)c1ccc(Br)cc1 2325829680 PQDVLOYORRREHL-INIZCTEOSA-N 388.269 2.843 0 50 GFAA C[C@@H]1C[C@H](NC(=O)c2cccnc2Oc2ccccc2C(N)=O)c2nccn21 2325855875 SGSKYULCGWOUOH-DOMZBBRYSA-N 377.404 2.605 0 50 GFAA C[C@@H](O)Cn1cc(-c2nc([C@@H]3COc4ccccc43)nn2C2CCC2)ccc1=O 2325880169 XOVUMWAGLFFPGA-RDTXWAMCSA-N 392.459 2.737 0 50 GFAA Cc1c([C@H](C)NCc2cn(C)cn2)nnn1-c1cccc(Br)c1 903350864 FLVIQBZQYDWPSR-NSHDSACASA-N 375.274 2.923 0 50 GFAA CCOC(=O)c1c(NC(=O)c2nc3ncccn3n2)sc2c1CC[C@H](C)C2 924008 GDBZLWCTSUTWQX-JTQLQIEISA-N 385.449 2.740 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCC[C@@H](c2ncc[nH]2)C1 2356145746 UKXATOGOCWIHEI-OAHLLOKOSA-N 386.521 2.642 0 50 GFAA O=C(O)[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 221906917 BRKODXKTUZABBD-MRVWCRGKSA-N 375.812 2.817 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCC(n2cc(-c3cccnc3)nn2)CC1 55152867 VMEBXNSTIJXJRX-UHFFFAOYSA-N 392.419 2.938 0 50 GFAA Cc1cc2[nH]cc(C(=O)N3CCCC[C@@H]3CCc3cccc(O)c3)c(=O)n2n1 102815614 HPSVDUOWFVKLSY-MRXNPFEDSA-N 380.448 2.664 0 50 GFAA CCOC(=O)N1CCN(Cc2nc(-c3ccc(OC)cc3OC)oc2C)CC1 20293402 FEDBODPBPDCFBJ-UHFFFAOYSA-N 389.452 2.941 0 50 GFAA O=c1c2c3c(sc2ncn1CCc1cnn(-c2ccccc2)c1)CNCC3 65407242 KZUPCHZSYJSGOK-UHFFFAOYSA-N 377.473 2.532 0 50 GFAA O=C([C@H]1COc2ccccc2O1)N1Cc2cnn(Cc3ccc(F)cc3)c2C1 67841421 ZLBQHHRZXIPXBX-HXUWFJFHSA-N 379.391 2.753 0 50 GFAA COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(C)Cc1ccc([C@H]2C[C@H]2C)o1 248029196 SSWIKTDWZHDCGS-XPGWFJOJSA-N 396.487 2.961 0 50 GFAA Cc1cnc(NC(=O)[C@@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)[nH]1 135705048 ZQJIQJXHOPHHMO-SNVBAGLBSA-N 377.495 2.893 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2ccc(COC)o2)C[C@@H]1CCO 20541378 WIIQFCSYHFAKAQ-IBGZPJMESA-N 388.508 2.894 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)n1 65363790 KCOVLNBABYPFBP-UHFFFAOYSA-N 393.413 2.832 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(-c3cccc(O)c3)nc2)CC1 67805763 DFQWBJONGIUPJN-UHFFFAOYSA-N 379.460 2.929 0 50 GFAA Cc1ccc(NC(=O)c2cc3nccnc3cc2F)cc1C(=O)N1CCOCC1 471153796 ZBBDIIFQMLSOMH-UHFFFAOYSA-N 394.406 2.802 0 50 GFAA CCOc1ncc(C(=O)N[C@@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1Cl 252492303 MHXPOPPLQVLEOA-MRXNPFEDSA-N 391.830 2.804 0 50 GFAA Cn1nc(C(F)F)c2cc(C(=O)N3CCC[C@@H]3[C@H]3COCC[C@]3(C)O)sc21 329006526 NASRURNWGKMYRD-FMTVUPSXSA-N 399.463 2.965 0 50 GFAA Cc1cc(N2CCC(C(=O)N3CCc4ccccc4C3)CC2)n2nccc2n1 72425693 HHSLYRHXTSZJHN-UHFFFAOYSA-N 375.476 2.839 0 50 GFAA CN1CC2(CCN(S(=O)(=O)c3ccc(-c4ccccc4)cc3)CC2)CC1=O 77470951 DYQCDMWUJYLQDA-UHFFFAOYSA-N 384.501 2.987 0 50 GFAA CCOc1ccc(CNC(=O)N2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)cc1F 378365771 XGJPVJMJNOIAEN-SJLPKXTDSA-N 390.459 2.756 0 50 GFAA O=C(c1scc2c1OCCO2)N1CCC[C@@]2(CCC(=O)N(C3CC3)C2)C1 77519035 CKBSIBAYAIJNFJ-LJQANCHMSA-N 376.478 2.527 0 50 GFAA C[C@H](CS(C)(=O)=O)NC(=O)N1CCC(c2nc3ccccc3s2)CC1 172274445 FALSEMBGGGPDKV-GFCCVEGCSA-N 381.523 2.618 0 50 GFAA CSCC[C@@H](NC(=O)C1(n2cnnn2)CCCCC1)c1nc2ccccc2[nH]1 223227565 GLUQIDHLXGJTBQ-MRXNPFEDSA-N 399.524 2.819 0 50 GFAA Cc1cc(=O)c(C(=O)Nc2nc3cc(F)ccc3n2C)nn1-c1ccccc1 175491254 BTQCMMBVOJKPNA-UHFFFAOYSA-N 377.379 2.819 0 50 GFAA Cn1ccc2cc(NC(=O)CC[C@H]3NC(=O)c4ccccc4NC3=O)ccc21 334162216 PWTKWAYMKCWODC-QGZVFWFLSA-N 376.416 2.648 0 50 GFAA O=C(N[C@@H](c1ccccc1)c1ccncc1)N1CCC(N2CCOCC2)CC1 426405225 ZFGWJOOEUIIXOH-NRFANRHFSA-N 380.492 2.677 0 50 GFAA Cc1ccc(CC(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)cc1 91321213 AVTSUMQJTWGYJZ-FQEVSTJZSA-N 384.520 2.948 0 50 GFAA O=C(CCn1cc(Cl)cn1)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 95367557 OJJKYHKNPNVQIW-XJKSGUPXSA-N 379.917 2.506 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1cnn2ccccc12 91475152 AEMUJCRIUBZMAH-UHFFFAOYSA-N 378.480 2.609 0 50 GFAA C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)c1 299422264 USNWMHLMDRXRED-YSGRDPCXSA-N 391.471 2.812 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)nc(O)n1 253535395 OCSJDJFTAHQJAH-OXFYSEKESA-N 397.475 2.558 0 50 GFAA O=C(NC[C@H](c1ccccc1F)N1CCCC1)N1CCC(c2nc[nH]n2)CC1 534669085 DKKQCFFGMPLZQD-GOSISDBHSA-N 386.475 2.670 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)NC2(CN3CCOCC3)CCCCC2)no1 534634284 OVEKZRPYCDXWOO-GOSISDBHSA-N 376.501 2.865 0 50 GFAA O=C(NC1CCN(Cc2cccs2)CC1)c1ccc(N2CCOCC2)cc1 828158026 SXIXXXDDDXCGNS-UHFFFAOYSA-N 385.533 2.979 0 50 GFAA Cc1cccc(OC2CN(C(=O)N[C@H](C)c3ccc(S(C)(=O)=O)cc3)C2)c1 584886904 WVBAASZCUMHWAL-OAHLLOKOSA-N 388.489 2.932 0 50 GFAA Cc1cc(C(=O)NCc2cccc(CN3CCN(C)CC3)c2)c2n[nH]cc2c1 1326043856 PUKGZURYIIHHQD-UHFFFAOYSA-N 377.492 2.549 0 50 GFAA CCN1CCN(CC(=O)NCCOC23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)CC1 952967092 LWINELVTHNTFSY-IZQOUKSCSA-N 377.573 2.506 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)CCn1c(=O)oc2ccc(C)cc21 952988817 PUXYZVZMVKIQHZ-UHFFFAOYSA-N 381.432 2.610 0 50 GFAA C[C@H](NC(=O)Cn1ccc(=O)c2ccccc21)C1CCN(CC(F)(F)F)CC1 189645945 GEHVFLZLHZUXRT-AWEZNQCLSA-N 395.425 2.781 0 50 GFAA O=C(c1cc2ncccn2n1)N1CCCN(c2nc3ccccc3s2)CC1 1506424408 JRYSILNQRYHFRJ-UHFFFAOYSA-N 378.461 2.692 0 50 GFAA Cn1cc(CCC(=O)N2CC[C@]3(CCCN(CC4CCCCC4)C3=O)C2)cn1 11753465 YHOLROKGIJVGPZ-JOCHJYFZSA-N 386.540 2.774 0 50 GFAA O=C(CSc1nc(O)cc(=O)n1-c1ccc(F)cc1)NC1CCCCC1 13425543 XIJVLKQKBAQDSN-UHFFFAOYSA-N 377.441 2.618 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCc1ccc3c(c1)OCO3)C2 14746005 DNYKJMPAEQOHKS-MRXNPFEDSA-N 396.491 2.515 0 50 GFAA Cn1nc(C(C)(C)C)cc1NC(=O)Cn1ccc(-c2ccc3c(c2)OCO3)n1 19732019 YXDRPVDSGFFVIF-UHFFFAOYSA-N 381.436 2.949 0 50 GFAA Cc1ccc(NC(=O)c2ccc(CN3C(=O)NC4(CCOCC4)C3=O)cc2)cc1 169773455 NOTGGWFLIXOPIM-UHFFFAOYSA-N 393.443 2.848 0 50 GFAA CSc1cccc(NC(=O)Cn2c(-c3cnccn3)nc(C)c(C)c2=O)c1 169752719 OMGBWIJHZABUKU-UHFFFAOYSA-N 381.461 2.678 0 50 GFAA COc1cc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)ccc1F 1857670853 GMACXQQZBQHVCF-NRFANRHFSA-N 384.407 2.724 0 50 GFAA CC(C)c1nc(-c2nccn2-c2cccc(NS(=O)(=O)N(C)C)c2)co1 1857687830 HKYUOZVFIWKBHA-UHFFFAOYSA-N 375.454 2.869 0 50 GFAA CCCCC(=O)NC[C@H]1[C@H]2CN(C(=O)c3ccc(Cl)o3)C[C@]23CC[C@H]1O3 1857724821 FKRVCOQGTIEVBY-FGBSKUFISA-N 380.872 2.859 0 50 GFAA COc1ccccc1C1CCN(C(=O)[C@H]2CC(=O)N(c3nccs3)C2)CC1 1857725277 ZLQJZUQODLJWMS-HNNXBMFYSA-N 385.489 2.911 0 50 GFAA O=C1C[C@H]2N(Cc3ccc4c(c3)OCCO4)CC[C@]23OC[C@@H](c2ccccc2)N13 1857728100 NPILUQCYSZDBJC-ZEYPLWLESA-N 392.455 2.732 0 50 GFAA Cn1nc(C(F)(F)F)c2cc(C(=O)Nc3cccc4c3CCNC4)cnc21 911791297 YPVARTRNBLANOJ-UHFFFAOYSA-N 375.354 2.885 0 50 GFAA CNc1ncccc1CN1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1875250377 SXWOAYXINFUPBR-SIKLNZKXSA-N 383.492 2.784 0 50 GFAA COc1ccc(CC(=O)NC[C@H](CO)Cc2ccccc2Br)cc1 225444454 FKIDHBAYSSGRSG-OAHLLOKOSA-N 392.293 2.968 0 50 GFAA COCCOC1CCN(c2cc(N[C@@H]3CCCO[C@@H]3C(C)C)ncn2)CC1 328631397 KMUXQVOFYJWQJB-YLJYHZDGSA-N 378.517 2.724 0 50 GFAA COc1ccc(OC)c(CC(=O)Nc2cc(C)cc(N3CCN(C)CC3)c2)c1 240886239 IOAHOHUKDRLFFT-UHFFFAOYSA-N 383.492 2.945 0 50 GFAA CN1CCC(=O)Nc2cc(C(=O)NC[C@@H]3CCN(c4ccc(F)cc4)C3)ccc21 155814020 DNSWICBMCPRGQW-HNNXBMFYSA-N 396.466 2.860 0 50 GFAA CCc1cc(C(=O)N2CC[C@@](c3nc(C4CC4)no3)(C(F)(F)F)C2)cc(O)n1 952895153 RRLKAEOXSANPIT-QGZVFWFLSA-N 396.369 2.956 0 50 GFAA CC(C)Cc1ncnc(N2CCOC(F)(F)C2)c1I 2325735541 ANVJZULKOIPVRK-UHFFFAOYSA-N 383.180 2.709 0 50 GFAA O=S(=O)(Nc1ccccc1)[C@H]1CCCN(C2=NCCN2Cc2ccccc2)C1 2325841424 UJRDXKAOKFLCMW-FQEVSTJZSA-N 398.532 2.765 0 50 GFAA COc1ccc(F)c2[nH]c(C(=O)NCc3ccccc3N3CCNCC3)cc12 2325858055 ZYVFSQUNAUXZCP-UHFFFAOYSA-N 382.439 2.655 0 50 GFAA CCOC(=O)c1ccn(-c2ccc(NC(=O)N(C)[C@@H]3CC[C@H]3OC)cc2F)n1 932034020 HOQQIOSMPMZHLK-IAGOWNOFSA-N 390.415 2.829 0 50 GFAA C[C@H]1CCc2ccccc2[C@H]1NC(=O)C1CCN(c2ccc3nncn3n2)CC1 122617182 LXGWDBNSPARLJP-BTYIYWSLSA-N 390.491 2.781 0 50 GFAA COc1cccc([C@@H]2C(C(=O)Nc3cccnc3)=C(C)Nc3ncnn32)c1OC 956294 VBSNOBXAJBHSRQ-QGZVFWFLSA-N 392.419 2.618 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)c(OC)c1 1076293 JICWNLNJUGLPFW-AWEZNQCLSA-N 392.477 2.805 0 50 GFAA CN1C(=O)[C@H](CC(=O)Nc2ccc(F)cc2)N(Cc2ccc(F)cc2)C1=S 1185076 TZMULPPLVOOASK-INIZCTEOSA-N 389.427 2.921 0 50 GFAA CC(C)(C)C(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 2886256 HNZVFBBILISBFL-UHFFFAOYSA-N 398.535 2.803 0 50 GFAA O=C(c1ccncc1)N1CCC(NCc2cnn(-c3ccc(F)cc3)c2)CC1 102939000 CEKNTTWYFDWWQE-UHFFFAOYSA-N 379.439 2.801 0 50 GFAA Cc1sc2nc(S[C@@H]3CCN(CC(F)(F)F)C3=O)n(C)c(=O)c2c1C 109714702 XNKQOEYTJXRJMX-SECBINFHSA-N 391.440 2.867 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3nccs3)C[C@@H]2CCO)o1 20208796 XRTCZVHYUFNHOJ-KRWDZBQOSA-N 386.521 2.904 0 50 GFAA O=C(NCc1ncc[nH]1)c1ccc([C@H]2CCCN2CCCn2cccn2)s1 20866763 BQMMBMHZOOYTPN-OAHLLOKOSA-N 384.509 2.825 0 50 GFAA O=C(Cn1nc(Cl)ccc1=O)N1CCC[C@]2(C=Cc3ccccc3O2)CC1 65530183 RSMNDSVQASNIQD-FQEVSTJZSA-N 385.851 2.754 0 50 GFAA COc1ccc(C(=O)N2CCN(c3cc(N4CCCCC4)nc(C)n3)CC2)cc1 21793716 XOQXKJZQRKXCNH-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCC[C@H](c2[nH]ncc2-c2ccc(F)cc2)C1 67878564 BEFUEFLWASSEQI-AWEZNQCLSA-N 380.427 2.916 0 50 GFAA Cc1cc2ncn(Cc3cc(C(=O)N[C@H](C)c4cnn(C)c4)n[nH]3)c2cc1C 67955094 VQERGWKIYQPWCM-CQSZACIVSA-N 377.452 2.649 0 50 GFAA COc1ccccc1Oc1ncccc1CNC(=O)c1nnc2n1CCCC2 67982782 SCVOEVMXLYOJTP-UHFFFAOYSA-N 379.420 2.740 0 50 GFAA C[C@H]1CCc2ccccc2N1C(=O)CN1CCN(Cc2cccc(O)c2)CC1 471184400 BVCFHTRWPMVWER-SFHVURJKSA-N 379.504 2.878 0 50 GFAA Cn1cc(I)c(C(=O)N[C@@H]2CCCc3ccccc32)n1 657042 DWPQRXCJZIMRMJ-CYBMUJFWSA-N 381.217 2.832 0 50 GFAA Cc1sc(NC(=O)[C@H](C)n2ncc(Br)c2C)c(C(N)=O)c1C 2780778 FVAWRMJMNYCYAM-QMMMGPOBSA-N 385.287 2.931 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@H](N(C)CCN(C)C)C2)c(-c2ccccc2)n1 72170252 ZYTLNWDDDCWDEJ-IBGZPJMESA-N 381.524 2.550 0 50 GFAA CC[C@@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)CCN1CC(F)F 125214291 IMNBGDLEGDSRHE-CYBMUJFWSA-N 383.414 2.754 0 50 GFAA CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1 152200568 BFKISVJREFQPSX-LAUBAEHRSA-N 394.471 2.964 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2)C1 332298060 HFQNVVZSOPUTOL-GFCCVEGCSA-N 382.873 2.590 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@H](CC(=O)O)c1cccs1 236589593 NGFUGRNZFWRUQL-IAGOWNOFSA-N 386.473 2.916 0 50 GFAA CN(C)S(=O)(=O)N1CCc2ccc(NC(=O)C3(c4ccccc4)CC3)cc2C1 76871641 FTCYQQGYWOCQGP-UHFFFAOYSA-N 399.516 2.521 0 50 GFAA COc1ccc(N2CCN(C(=O)[C@H](C)Cc3cnc4ccccc4n3)CC2)nc1 457024178 OERFLXYDKBIUCA-MRXNPFEDSA-N 391.475 2.561 0 50 GFAA C[C@@H]1Cc2cc(-c3ccc(CNC(=O)NCCS(C)(=O)=O)cc3)ccc2O1 178963777 SEMRUVNMXFHISV-CQSZACIVSA-N 388.489 2.521 0 50 GFAA Cc1noc([C@H]2CCCCN2C(=O)c2cnc(-c3csc(C)n3)nc2O)n1 92021631 HCTGHLCWFYPZQU-CYBMUJFWSA-N 386.437 2.673 0 50 GFAA O=C1N(C2CCCCC2)CCC[C@@]12CCN(c1nnnn1-c1ccccc1)C2 91636296 AQWLGBMAMZZITD-NRFANRHFSA-N 380.496 2.814 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)c1cccnc1SC)C[C@@H]2CO 97815508 OIDSIBJZGJIRRD-MRXNPFEDSA-N 377.554 2.750 0 50 GFAA CN(C)c1cccc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)O)C2)c1 95361951 BIGKCMFLEOZQIG-HTAPYJJXSA-N 380.444 2.531 0 50 GFAA O[C@H](COc1ccc(CN2CCCOCC2)cc1)CN1CCc2ccccc2C1 96149999 PVCRMHCRJZSQCY-QHCPKHFHSA-N 396.531 2.707 0 50 GFAA CCNc1ccnc(N[C@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)n1 91636413 NYDGSHUYFAPOBH-INIZCTEOSA-N 397.527 2.785 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@H]([C@H](C)N)C1)c1ccc(Br)cc1 299739275 MRTYWIVCKURNLK-YLQAJVPDSA-N 396.329 2.602 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)N3CCC[C@H](c4ccncn4)C3)n2)cc1 534590195 GQPUQIDTUALOFZ-INIZCTEOSA-N 378.436 2.924 0 50 GFAA O=C(NCc1ncc2c(n1)CCOC2)c1cc2ccc(C(F)(F)F)cc2[nH]1 1349637933 VDBUBANPACHPRN-UHFFFAOYSA-N 376.338 2.979 0 50 GFAA O=C(Cc1cccs1)NCC1CCN(C(=O)c2n[nH]c3ccccc23)CC1 952985887 IFKZMFPXGHZDOH-UHFFFAOYSA-N 382.489 2.836 0 50 GFAA CC(C)c1ccnc(N2CCN(Cc3nc4ccc(Cl)cc4c(=O)[nH]3)CC2)n1 185861048 UKXBSVZWRZSLPR-UHFFFAOYSA-N 398.898 2.812 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)N1CCc2ccccc2C1 170600355 AARYANLDRVFUBB-NRFANRHFSA-N 377.488 2.988 0 50 GFAA CC(C)Nc1ncc(C(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)cn1 1704337939 ITQYHOSWGVWHQN-OXQOHEQNSA-N 391.475 2.833 0 50 GFAA Cc1cc(OC(C)(C)C(=O)N(CCO)Cc2cncn2C)cc(C)c1Cl 1704313249 HOXQENGUCQTJJD-UHFFFAOYSA-N 379.888 2.869 0 50 GFAA CN(C)C[C@@]12CN(C(=O)C3C(C)(C)C3(C)C)C[C@@H]1CN(c1ccncc1F)C2 1772812107 APTYSKZDULRFPI-OYHNWAKOSA-N 388.531 2.729 0 50 GFAA CCn1ccnc1CN(C)Cc1ccc(OC[C@@H](O)CN2CCCCC2)cc1 11819314 CCCUCYKVMIBYQH-FQEVSTJZSA-N 386.540 2.761 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N[C@H]3CCCN(c4ncccn4)C3)cc2)n1 11873044 CZZVSEMRRYJEQN-FQEVSTJZSA-N 390.491 2.737 0 50 GFAA Cc1c(C(=O)NCc2ccncc2)sc2ncnc(NC[C@@H]3CCCO3)c12 12026461 MISFTRIFDHVMPX-AWEZNQCLSA-N 383.477 2.916 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(Cc2ccc3nonc3c2)CC1 12196967 VFJODCBPFQWQRP-LJQANCHMSA-N 399.539 2.816 0 50 GFAA O=C(NCCCn1nnc2ccccc21)c1cn(CCC2CCCCC2)nn1 12315467 GYWPYXSVVRTKBE-UHFFFAOYSA-N 381.484 2.813 0 50 GFAA Cc1nnc(SCC(=O)N[C@@H]2CCCN(C3Cc4ccccc4C3)C2)s1 12431543 UOTJKRCRNLULMI-MRXNPFEDSA-N 388.562 2.687 0 50 GFAA COc1ccc(C)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)COc1ccc(C)cc1 14990283 QXQOVDTVTDISTB-LPHOPBHVSA-N 380.444 2.707 0 50 GFAA COc1cccc(CC(=O)N2CC[C@@H]3[C@H](CCCN3C(=O)c3ccco3)C2)c1 15067111 XQHKUWKCQPXBPN-IEBWSBKVSA-N 382.460 2.984 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc(-n3cnnn3)c2)s1 17950685 GOOBOHQMHHFEKR-BETUJISGSA-N 383.477 2.949 0 50 GFAA CC[C@@]1(C(=O)NCCc2ncc[nH]2)C[C@@H]2CC[C@H]1N2C(=O)Cc1ccc(F)cc1 1857670221 BKBDLHFCPPLDPG-NJNPRVFISA-N 398.482 2.610 0 50 GFAA CCCC(=O)N1CC[C@@]2(C1)Cn1c(nnc1Cc1c[nH]c3ccccc13)CO2 1857684374 LNLHMCDYLMGHQB-OAQYLSRUSA-N 379.464 2.652 0 50 GFAA CS(=O)(=O)N1CCCCN2CCCC[C@@H]2CCc2cccc(c2)OCC1 1857688838 JJGYGNBRBIFLGN-LJQANCHMSA-N 380.554 2.908 0 50 GFAA Cn1nc(-c2nccn2-c2cnn(CCCC(N)=O)c2)c2c(Cl)cccc21 1857690054 UECAZYLOMZKLMQ-UHFFFAOYSA-N 383.843 2.541 0 50 GFAA COc1ccc(C(=O)N[C@H](C)c2nncn2C)cc1Oc1ccc(CN)cc1F 1857695957 GHXQUAWUDSRXND-GFCCVEGCSA-N 399.426 2.705 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccccc2C(F)(F)F)[C@H]1c1cnn(C)c1 1857710007 CSIWEYSMYFIRQB-IRXDYDNUSA-N 396.413 2.583 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCN([C@H](C)c2cccnc2)CC1 115387253 YJJFHWDASVCPDL-OAHLLOKOSA-N 396.520 2.766 0 50 GFAA CCN(CC(=O)O)C1CCN(S(=O)(=O)c2ccccc2C(C)(C)C)CC1 328603776 HEKHIMOXQAJYFY-UHFFFAOYSA-N 382.526 2.544 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)Cc3ccn(C)c3)C2)cc1OC 12711258 CDSIUHJWGIXNSQ-FQEVSTJZSA-N 399.535 2.750 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(Cc4cccc5cc[nH]c45)CC3)n[nH]c21 1875395266 UOBJCDKLVLQEOO-CABCVRRESA-N 393.491 2.871 0 50 GFAA COc1ccc([C@](C)(O)CNC(=O)c2cnn(C)c2Cc2ccccc2)cc1 1875297980 KKHHKKSNOHBBCT-JOCHJYFZSA-N 379.460 2.657 0 50 GFAA CC(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)n3cnc(C(N)=O)c3n2)cc1 1875350223 FLKMVISESGPJQE-UHFFFAOYSA-N 399.410 2.950 0 50 GFAA CN(C)C(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(F)c3ccncc13)C2 1875394655 QTLXSBHUELWNQB-JECHBYEQSA-N 394.406 2.692 0 50 GFAA CS[C@H](CNC(=O)N1Cc2nc(O)nc(O)c2C1)c1cccc(Cl)c1 1875300604 KDRBZFOJASJDBO-CYBMUJFWSA-N 380.857 2.671 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)COc2ccc(Cl)cc2Cl)o1 1775957494 XOKHKBSDFOUGJG-ZYHUDNBSSA-N 386.235 2.652 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)c(O)n1 2100547397 IVQBEWOFLWJFLS-HSZRJFAPSA-N 393.487 2.936 0 50 GFAA CCOc1cc(NC2CCN(c3nc(N(C)C)c4ccccc4n3)CC2)ncn1 2325825413 PCMCXASHNDDANC-UHFFFAOYSA-N 393.495 2.965 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@H]1c1ccc(Br)cc1 623031 NJZGOXQVZHMHFC-AWEZNQCLSA-N 381.226 2.899 0 50 GFAA Cc1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@]12CCCN(C1CC1)C2=O 2356146103 RPVIZCVHLIVUCN-GOSISDBHSA-N 382.913 2.957 0 50 GFAA O=C1N(C2CC2)CCC[C@]12CCCN2S(=O)(=O)Cc1cccc(Cl)c1 2356149979 GQHUJFPOIUYWOB-SFHVURJKSA-N 382.913 2.789 0 50 GFAA COP(=O)(OC)Oc1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 2516830 SPVKDJVZEGSJSS-ZDUSSCGKSA-N 389.341 2.987 0 50 GFAA CCn1c(=O)n(CC)c2cc(NC(=O)CSc3nnc(C)s3)ccc21 4385335 NRTAJCDLZFGGIB-UHFFFAOYSA-N 377.495 2.734 0 50 GFAA COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC[C@@H]2CCCO2)cc1Cl 4986967 GRYJWVHRWRGSAA-BLLLJJGKSA-N 380.828 2.699 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N[C@@H](CC(=O)O)C(F)(F)F)cc1C 55243290 BFVNLTCMDJXPDD-AWEZNQCLSA-N 375.343 2.878 0 50 GFAA COc1ccccc1CN1C(=O)O[C@@H]2CN(Cc3cc(CC(C)C)[nH]n3)C[C@@H]21 23366604 YXDZOMRCDUUXNI-AZUAARDMSA-N 384.480 2.822 0 50 GFAA Cc1cc(C)n([C@H](C)CNC(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)n1 67973645 WGHVMBXINLFYHA-OAHLLOKOSA-N 377.452 2.612 0 50 GFAA CO[C@H]1C[C@H](c2nc(C3CC3)no2)N(S(=O)(=O)c2ccc(Cl)s2)C1 328645898 ZUGWSMRCKKKHRM-VHSXEESVSA-N 389.886 2.813 0 50 GFAA O=C(CN1CCc2c([nH]c3ccccc23)C1)Nc1nnc([C@@H]2CCCO2)s1 67895689 FWFSQSSEEADTLQ-INIZCTEOSA-N 383.477 2.868 0 50 GFAA Cn1nc(-c2cccs2)cc1C(=O)NCCc1nc(-c2ccccn2)no1 65531368 LDVIPDJKGQJXSY-UHFFFAOYSA-N 380.433 2.566 0 50 GFAA NC(=O)c1cccc(C[C@@H]2CCN(C(=O)CCN3CCc4ccccc43)C2)c1 72128463 YAEUZTOEBJVVGK-SFHVURJKSA-N 377.488 2.629 0 50 GFAA COC(=O)c1nscc1NS(=O)(=O)c1cccc(Br)c1C 479993532 POYIDSKJIVYHAQ-UHFFFAOYSA-N 391.268 2.801 0 50 GFAA O=C1CC[C@H]2CN(c3nc4ccccc4o3)CC[C@H]2N1CCCn1ccnc1 72438597 IMZPBEZGFUTPKH-FUHWJXTLSA-N 379.464 2.932 0 50 GFAA CC[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)c(=O)n2CC)c1cc(F)ccc1F 155036856 DDXJZEJRAFXFTC-HNNXBMFYSA-N 387.386 2.869 0 50 GFAA COc1c(C)cnc(Cn2nc([C@@H]3CCCNC3)n(-c3ccccc3)c2=O)c1C 72121085 LPVJMHICHFSHRJ-QGZVFWFLSA-N 393.491 2.570 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N2CCCN(CC3CCCCC3)CC2)cc1 238197074 AQUWCUWZUJOQRA-UHFFFAOYSA-N 380.510 2.662 0 50 GFAA O=C(NC1CCN(CC(F)(F)F)CC1)[C@H]1CCCN1Cc1ccc(F)cc1 176132650 XVRGUCYXNKNHKF-QGZVFWFLSA-N 387.421 2.933 0 50 GFAA CN(CCn1ccc2ccccc21)C(=O)NCC1CCN(C(=O)C2CC2)CC1 426478143 RGMLLOPRZSOMHW-UHFFFAOYSA-N 382.508 2.931 0 50 GFAA Cc1noc(C)c1CSc1nnc(C2CCNCC2)n1C[C@@H]1CCCO1 426478145 RHDMEFRIAZGUFK-HNNXBMFYSA-N 377.514 2.821 0 50 GFAA CN(CC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)no1)Cc1ccccn1 82139097 PGZFDWFQRQRZRE-GOSISDBHSA-N 377.448 2.927 0 50 GFAA CN1CCN(Cc2ccc(N3CCC[C@@H](c4nccn4CC4CC4)C3)nc2)CC1 95518500 RLGJCFWWPVRNTD-OAQYLSRUSA-N 394.567 2.820 0 50 GFAA CCNC(=O)c1ccnc(N2CC[C@@]3(CCCN(C4CCCCC4)C3=O)C2)c1 95371570 XBTCHGSJLJQLHP-QFIPXVFZSA-N 384.524 2.983 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)CCCc3cccs3)C2)CCC1=O 95504090 YSLITZXDLAKERB-HXUWFJFHSA-N 378.538 2.948 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)CCc3cccc(OC)c3)C2)CCC1=O 91574226 NJGPUKJOZHBVNR-QFIPXVFZSA-N 388.508 2.505 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(CO)[C@H]3CC[C@@]21C 253595421 DDRIWSPLTXTFNE-ADXOSAOISA-N 378.509 2.577 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)Nc1n[nH]c(C2CCCCC2)n1 252548525 PZWZHVCOQMKYDP-OAHLLOKOSA-N 396.451 2.971 0 50 GFAA O[C@@H](COc1ccc(F)cc1)CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 298206216 IZJAJWGPJZEVHC-SJLPKXTDSA-N 388.487 2.763 0 50 GFAA CN1CCC[C@@H](NC(=O)N(Cc2cccnc2)Cc2ccc3c(c2)OCO3)C1 534665454 QVLYZINSNBNPRD-GOSISDBHSA-N 382.464 2.616 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)c2ccnc(O[C@H]3CCOC3)c2)CC1 185026386 ANPNYHCIZPJSQU-NRFANRHFSA-N 395.503 2.952 0 50 GFAA CC(C)n1ccnc1CN1CCN(c2cc(=O)[nH]nc2-c2ccccc2)CC1 299776172 LBWPMQDYYSJYCX-UHFFFAOYSA-N 378.480 2.537 0 50 GFAA CCC(=O)N1CCOC2(CCN(C(=O)C3=Cc4ccccc4OC=C3)CC2)C1 822534005 PXMNDUZZUSWQHJ-UHFFFAOYSA-N 382.460 2.606 0 50 GFAA COc1ccc(CN(C(=O)CCS(C)(=O)=O)C2CCCCC2)c(OC)c1 824573064 IGXNMBXSJHSZMN-UHFFFAOYSA-N 383.510 2.800 0 50 GFAA O=C(N[C@@H](Cn1cccn1)c1ccccc1)C1CCN(C2CCOCC2)CC1 670460784 DLXGNEAAQXMJIQ-NRFANRHFSA-N 382.508 2.632 0 50 GFAA COc1cccc([C@@H](C)NC(=O)N2CCN(Cc3ccccc3CO)CC2)c1 670441122 JDKUBTQUQSWJFE-QGZVFWFLSA-N 383.492 2.776 0 50 GFAA O=C(Nc1ccccn1)c1ccc(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)cc1 584904495 YKGYWCBMHTVTLT-DFEHZGFQSA-N 377.400 2.795 0 50 GFAA CCc1ncc(S(=O)(=O)NCC[C@H]2CCCCN2Cc2ccccc2)[nH]1 670465085 ISMRUJBAGIHYRG-QGZVFWFLSA-N 376.526 2.695 0 50 GFAA O=C(NCc1cccnc1-n1cncn1)[C@@H](c1ccc(F)cc1)N1CCCCC1 952966928 XVVYVNCYBOTLIW-LJQANCHMSA-N 394.454 2.645 0 50 GFAA COCc1c(C(=O)N2CCC(Cc3nccn3C)CC2)cnn1-c1ccccc1 185908722 ZEZFBFYXHMLLRE-UHFFFAOYSA-N 393.491 2.847 0 50 GFAA O=C(CCOCC(F)(F)C(F)F)N[C@@H]1CCCN(c2ccccc2F)C1=O 189864728 XQSVRDFTQHPTBX-GFCCVEGCSA-N 394.340 2.744 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCc2nc(-c3ccccc3)cs2)C1 1506425639 FMCGHDBPQNKFCT-CQSZACIVSA-N 381.523 2.503 0 50 GFAA O=C(CCCN1CCCCC1=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1615740131 PCUWSCHFUARZJQ-WIYYLYMNSA-N 395.503 2.701 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(C3CCN(c4ccccc4)CC3)C2)CC1 12307542 QMSOULRWDVPGCR-OAQYLSRUSA-N 398.595 2.922 0 50 GFAA COc1ccc(C(=O)Nc2ccnn2C2CCN(C3CCOCC3)CC2)cc1 12471255 ILSFCUWPVWVOPY-UHFFFAOYSA-N 384.480 2.960 0 50 GFAA O=C(NCCN1CCCCC1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 12745063 INDJVVQOHRLARE-UHFFFAOYSA-N 399.535 2.682 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2coc(COc3cccc(F)c3F)n2)C1 15072557 HMMSFTQYWZRSRV-LBPRGKRZSA-N 394.374 2.947 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4F)CC3)C2=O)cc1 18181422 LMQKQGLMOSZHOA-FQEVSTJZSA-N 397.450 2.679 0 50 GFAA CNc1ncc(CN2CCC[C@@H](c3nc(-c4cccs4)cc(=O)[nH]3)C2)cn1 19592385 ZSXCVAIJFUEGJR-CQSZACIVSA-N 382.493 2.710 0 50 GFAA in-vitro O=C1C[C@@H](c2ccccc2Cl)Cc2nc(NCCN3CCOCC3)ncc21 19899347 PLDABFKBIWGMQX-AWEZNQCLSA-N 386.883 2.787 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NCc4ccc5c(c4)OCO5)CC3)nc2n1 1857672796 HKQVZUWQMYBLNQ-UHFFFAOYSA-N 394.431 2.793 0 50 GFAA CC(C)c1cc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)nc(=N)[nH]1 1857673118 OJBGNEYWEXZXHJ-RHSMWYFYSA-N 390.528 2.573 0 50 GFAA Cc1cc(C)c(-c2nccn2[C@@H]2C[C@H]3CO[C@@H](CC(=O)N(C)C)CN3C2)c(C)c1 1857712865 VNFJCGZQPMXSKJ-AABGKKOBSA-N 396.535 2.968 0 50 GFAA O=C(O)[C@H]1CCCN1C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 238089882 XPMGIXORAAKNSV-CYBMUJFWSA-N 386.408 2.824 0 50 GFAA Cc1ncc(C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c(C(C)C)n1 470445706 NREUCTPNTWAPJN-UHFFFAOYSA-N 382.464 2.942 0 50 GFAA CS(=O)(=O)CC1(CNC(=O)N2C[C@H]3CCCC[C@@]32c2ccccc2)CC1 361029131 JFEHDUKGIQGAQE-YLJYHZDGSA-N 376.522 2.922 0 50 GFAA NCCc1cc(=O)nc(-c2cccc(CN3CCC[C@H]3c3nccs3)c2)[nH]1 23192200 GORIFMVTIMKPSX-KRWDZBQOSA-N 381.505 2.732 0 50 GFAA C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)NCc1ccn(C)n1 498542316 SXPXRNQELQZMPF-WBMJQRKESA-N 393.285 2.854 0 50 GFAA O=C(Nc1ccc(=O)n(Cc2cccnc2)c1)c1ccn(Cc2ccccc2)n1 1875262363 IHYPATZHOGJRFA-UHFFFAOYSA-N 385.427 2.789 0 50 GFAA O=C(Nc1cn(-c2ccccc2C(F)(F)F)nn1)N1CCC[C@@](F)(CO)C1 1875270249 AGMQULOJGFRYMS-HNNXBMFYSA-N 387.337 2.614 0 50 GFAA O=C(Cn1c(Cc2ccc(F)cc2)noc1=O)NC1(c2ccccc2)CCC1 1875327704 HGQVMLVWUBAIBH-UHFFFAOYSA-N 381.407 2.762 0 50 GFAA Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cn(C)nc2C2CC2)[C@@H](C)CO1 1875393200 JAXQZXMZSHVWCV-YOEHRIQHSA-N 375.494 2.757 0 50 GFAA C[C@@H](NC(=O)c1ccnc(O)c1)C1CCN(C(=O)c2coc(C3CCC3)n2)CC1 1875303377 RHDOJVFTBUVYSR-CYBMUJFWSA-N 398.463 2.713 0 50 GFAA C[C@H]1CCCc2cc(C(=O)Nc3ccc(N4CCC(N(C)C)CC4)cn3)nn21 1875306613 MFBVAXFKSUCWFJ-HNNXBMFYSA-N 382.512 2.958 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3cc(F)c4ncccc4c3)CC1)O2 1875394572 NQTSZZHUMPXBFZ-INIZCTEOSA-N 396.422 2.598 0 50 GFAA CCNC(=O)C(C)(C)CN1C(=O)CCN(CC2CC(c3ccccc3)C2)C1=O 1875334617 XBOZOARPPBIUDP-UHFFFAOYSA-N 385.508 2.997 0 50 GFAA CC(C)(C)OC(=O)N1CCn2nc(NS(=O)(=O)c3ccccc3F)cc2C1 901979157 XVXPCCNVJUUJOJ-UHFFFAOYSA-N 396.444 2.574 0 50 GFAA CN1C[C@@H](O)[C@H](NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccc(F)cc23)C1 2325823448 STHMGXUJHFVJAP-WOJBJXKFSA-N 399.441 2.837 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2cccnc2Oc2ccccc2C(N)=O)c2nccn21 2325855878 SGSKYULCGWOUOH-WFASDCNBSA-N 377.404 2.605 0 50 GFAA CN1C(=O)[C@H](C(=O)NCc2ccc(N=c3cc[nH]cc3)cc2)Cc2ccccc21 2325859549 AKMDSDLXPBVNJN-FQEVSTJZSA-N 386.455 2.699 0 50 GFAA COc1ccc2nc(NC(=O)[C@H](C)N3C(=O)c4ccccc4C3=O)sc2c1 951197 SRKBSZAQLODGQE-JTQLQIEISA-N 381.413 2.928 0 50 GFAA COc1cc(C(=O)NC(=S)Nc2cccc(C(=O)O)c2)cc(OC)c1OC 1158423 KOKAEXQJPBCMAV-UHFFFAOYSA-N 390.417 2.537 0 50 GFAA COc1ccc(-c2onc(NCc3nc(C(F)(F)F)n[nH]3)c2C(=O)O)cc1 2356154888 OGGLTGYWXNTITI-UHFFFAOYSA-N 383.286 2.797 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)o1 2356167926 JAZPSWGHUXSLGT-QHCPKHFHSA-N 394.471 2.788 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(Br)c1 4011368 LEFMSGXTLUHQKW-CYBMUJFWSA-N 385.283 2.983 0 50 GFAA Nc1ccc2c(c1)OCCOCCOc1ccccc1OCCOCCO2 4255806 FFYZYAKXQMHVQE-UHFFFAOYSA-N 375.421 2.531 0 50 GFAA Cc1nn(CC(C)C)c(C)c1CC(=O)NCc1cc(S(C)(=O)=O)ccc1F 225708703 DCVJFWKOTCXARJ-UHFFFAOYSA-N 395.500 2.557 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c(F)cccc3F)C[C@@H]2CCO)CC1 20209335 ZWWMXKYZVONICI-SFHVURJKSA-N 381.511 2.706 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(C)o3)[C@@H](CCO)C2)cc1CO 23130400 PCAPUKHDLROHKM-FQEVSTJZSA-N 388.508 2.548 0 50 GFAA CNS(=O)(=O)c1ccc(CN2CCCN(CC3CC3)[C@@H](C(C)C)C2)cc1 71754047 LKPREYZAJMUJIL-HXUWFJFHSA-N 379.570 2.537 0 50 GFAA CCc1ccc(CNC(=O)NCc2cccc(OCCN3CCOCC3)c2)cc1 253396846 WGTGQWDZYCKQGG-UHFFFAOYSA-N 397.519 2.959 0 50 GFAA CN(C)c1nc(-c2ccccn2)nc2c1CCN(C(=O)[C@@H]1C[C@@H]3C=C[C@H]1C3)C2 71763390 YGBCMZMIDXCKLF-HLLBOEOZSA-N 375.476 2.702 0 50 GFAA COc1ccc(CN(C)C(=O)NCc2ccnc(-n3ccnc3)c2)c(OC)c1 363379816 XQIPPGXYWUYIDZ-UHFFFAOYSA-N 381.436 2.626 0 50 GFAA O=C(Nc1ccc(CN2CCCC2=O)cc1)[C@H]1CC(=O)N(c2ccccc2F)C1 363370661 NLQZYHLJIGJMRQ-INIZCTEOSA-N 395.434 2.940 0 50 GFAA O=C(O)c1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc2c([nH]c1=O)CCCC2)CC3 238123922 IVKYCONXWFAWOS-UHFFFAOYSA-N 391.427 2.632 0 50 GFAA Cn1nccc1N1CCC[C@H](NC(=O)c2cc(Cl)c3ccccc3n2)C1=O 451140436 GHWULPRUQOOCMI-HNNXBMFYSA-N 383.839 2.547 0 50 GFAA Cc1cc(S(=O)(=O)N2C[C@@H](C)C(=O)N(C)c3ccccc32)sc1C(=O)O 365574102 UJTTZRUBRDIGOA-LLVKDONJSA-N 394.474 2.563 0 50 GFAA COC(=O)c1ccc(NC(=O)NC[C@@H]2CCN(C(=O)Cc3ccccc3)C2)cc1 366512719 LLSSOBLJHZGERJ-KRWDZBQOSA-N 395.459 2.686 0 50 GFAA COc1ccc(N2CCN(Cc3cnc(-c4ccco4)nc3)[C@@H](C)C2=O)cc1 72167497 NQUVUUUPCFGJDU-HNNXBMFYSA-N 378.432 2.983 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCCS(=O)(=O)N2CCCC2)c2ccccc2N1 176093846 AYNBILVMWIMHNF-QGZVFWFLSA-N 379.526 2.676 0 50 GFAA Cc1cccc(-c2ncc(C(=O)N(C)Cc3ccc4c(c3)OCO4)c(=O)[nH]2)c1 82136944 YPIOXHYXIXMWOQ-UHFFFAOYSA-N 377.400 2.746 0 50 GFAA CCc1nn(C)c(NC(=O)NCCOc2nonc2C)c1-c1ccc(F)cc1 96154025 OKEBSRDPQKNYJA-UHFFFAOYSA-N 388.403 2.681 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2ccc(C)s2)CC1 96161733 GEUXVLNXJCPJRO-UHFFFAOYSA-N 384.509 2.933 0 50 GFAA CN(C)C[C@@H]1CN(C(=O)Cc2ccc3c(c2)c2ccccc2n3C)C[C@@H]1CO 91915237 HBVOEFZNBZAENX-QZTJIDSGSA-N 379.504 2.503 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Nc1ccc(Cl)c(Cl)c1 239415355 UFJHFFHNUULDFO-YCBBYDHLSA-N 391.254 2.985 0 50 GFAA CC(C)(C)c1cc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)[nH]n1 91745488 GAZQHLVSLJFUDS-UHFFFAOYSA-N 384.528 2.726 0 50 GFAA CCCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1c(C)n(C)c3ccc(OC)cc13)C2 97527187 CFGUOXKKLNQYLF-JKSUJKDBSA-N 383.492 2.968 0 50 GFAA CCOCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(-n2nc(C)cc2C)cc1 95519728 VBXVDRBFZBWTJB-IBGZPJMESA-N 384.480 2.845 0 50 GFAA Cn1cc(CCNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 299644755 JIXCDVVPWDIYAO-SFHVURJKSA-N 380.414 2.533 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)C1CCN(c2ccc(Cl)cn2)CC1 299748212 GLSGUAJSANSXMY-SFHVURJKSA-N 399.878 2.990 0 50 GFAA C[C@H](Oc1ccccc1)c1csc(NC(=O)c2cc3n(n2)CCN(C)C3=O)n1 1940196062 HQSDROMJDGALKX-LBPRGKRZSA-N 397.460 2.818 0 50 GFAA CCCCc1nc(-c2cccc(Cn3cccn3)c2)n(C[C@@H]2COCCO2)n1 822886125 VITOGABMAXHKMC-LJQANCHMSA-N 381.480 2.948 0 50 GFAA CN(C(=O)c1cccs1)c1ccccc1C(=O)NCCSc1nc[nH]n1 828180154 XNFIASNNVJUODQ-UHFFFAOYSA-N 387.490 2.665 0 50 GFAA O=C1CNC(=O)c2ccc(C(=O)N3C[C@@H]4CCCC[C@@]43c3ccccc3)cc2N1 1347679927 JVUYHPINHXZXCD-GAJHUEQPSA-N 389.455 2.910 0 50 GFAA Cc1ncnc(N2CCN(C(=O)CN3CCC(c4ccccc4)CC3)CC2)c1C 952982917 YVHHIODGGZCQHT-UHFFFAOYSA-N 393.535 2.622 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1cscn1)c1ccc2scnc2c1 1565509319 LZSKHNNWBTXUKS-ZFWWWQNUSA-N 375.475 2.857 0 50 GFAA O=C(CN1[C@H](C(=O)O)C[C@@H]2CCCC[C@H]21)Nc1ccc(Br)cn1 274715138 AWPZCEMQTYBTFZ-UHTWSYAYSA-N 382.258 2.500 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@@H](Cn3cncn3)C2)ncn1 275653552 KRWBHQVFLOWEEA-HLIPFELVSA-N 385.516 2.600 0 50 GFAA COCc1cccc(CNC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1 190194834 HPWNTPJJTOCIIC-QHCPKHFHSA-N 397.519 2.611 0 50 GFAA O=C(CCc1ccncn1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 192318786 LPPHZCOJVLVNES-UHFFFAOYSA-N 393.274 2.701 0 50 GFAA O=C(c1cc(-c2ccc(Cl)cc2)on1)N1CCN(CCN2CCCC2)CC1 193150670 KQFCMSPAKXUENZ-UHFFFAOYSA-N 388.899 2.849 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N(C)[C@@H](C)c2cc(-c3ccccc3)n[nH]2)cc1 1506421721 MBMRYARMQZGXHO-AWEZNQCLSA-N 398.488 2.818 0 50 GFAA CCc1cc(N2CCN([C@H](C(=O)O)c3ccc(OC(C)C)cc3)CC2)ncn1 1506420577 JYSBXSMROUEHAQ-FQEVSTJZSA-N 384.480 2.774 0 50 GFAA O=S(=O)(Cc1ccc(Cl)cc1F)N1CCC(N2CCSCC2)CC1 1506415526 YQCXYOHVAIJWNW-UHFFFAOYSA-N 392.949 2.822 0 50 GFAA O=S(=O)(Cc1ccc(Cl)cc1F)NCc1nc(O)c2ccccc2n1 1506406999 QJRXNFIVPNPEBN-UHFFFAOYSA-N 381.816 2.748 0 50 GFAA CN1CCC[C@H](c2nc(Cc3cn(C)c4ccccc34)n(-c3cnn(C)c3)n2)C1 1772813100 VUMVNALKWXKOAZ-INIZCTEOSA-N 389.507 2.893 0 50 GFAA CC(C)=CC(=O)N1CCC(Oc2cccc(C(=O)N(C)CCN(C)C)c2)CC1 11874689 CUGCQVOUHGQPCN-UHFFFAOYSA-N 387.524 2.656 0 50 GFAA O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)cc2)cc1 11906611 HIFVXPLKYYDPGB-UHFFFAOYSA-N 399.472 2.741 0 50 GFAA CCCC[C@@H]1CN(CC(=O)N(C)CCc2cnn(C)c2)Cc2ccccc2O1 12098994 GERRMMIIEJAIGW-HXUWFJFHSA-N 384.524 2.874 0 50 GFAA CCOC(=O)[C@@H]1CCCN(Cc2cc3ccc(F)cc3n(CCOC)c2=O)C1 12166903 DHUHRVJRHFNJEE-MRXNPFEDSA-N 390.455 2.562 0 50 GFAA CCn1ccnc1CN1CCC[C@@H](C(=O)Nc2cccc(-n3cccn3)c2)C1 12300392 AFIMKGXKAFKLDQ-QGZVFWFLSA-N 378.480 2.939 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)CCN3CCCO3)CC2)c1 12465216 CXLSSCYXBDOTPF-UHFFFAOYSA-N 389.496 2.680 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4cnc(C)cn4)C3)C2)c1 12745689 HOSDDSJDXGUTCN-QFIPXVFZSA-N 380.492 2.922 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCc1cccc(OC)c1)C2 14745760 TUHIPWBKCBIUDF-KRWDZBQOSA-N 382.508 2.795 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@@H]3CN(S(=O)(=O)C(C)C)CC[C@H]32)cs1 14980232 QTJNPHZLLSCDQR-GDBMZVCRSA-N 398.550 2.615 0 50 GFAA O=C(C1CCC1)N1CCC(n2cc(-c3nc(-c4ccccc4)no3)nn2)CC1 169777569 CBACGTBWYUPUPJ-UHFFFAOYSA-N 378.436 2.959 0 50 GFAA CCc1ccc(CNC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCC4)cc1 169778287 CFERLQAITUGLJH-UHFFFAOYSA-N 378.476 2.722 0 50 GFAA Cc1ncc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4cccs4)C3)C2)nc1C 1857685889 YXKGPWWBXFYESW-YLJYHZDGSA-N 386.521 2.649 0 50 GFAA COc1ccc(-c2nccn2-c2c(C)nn(CCO)c2C)cc1CN1CCCC1 1857705210 XVHMEJDEOVIIIR-UHFFFAOYSA-N 395.507 2.949 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cncc(O)c3)C1)CC2 1857708654 FWULJELRRPFTSL-NRFANRHFSA-N 382.464 2.701 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCCCO)CC[C@H]1NC(=O)c1ccc(Cl)cc1 1875243206 WHFQFOGULLPSAG-CGTJXYLNSA-N 396.915 2.532 0 50 GFAA COCC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](C(=O)O)C1 237116874 ZTOFSTFDTSNCPP-KGLIPLIRSA-N 384.270 2.577 0 50 GFAA COc1cc2c(cc1F)CC[C@@H]2NC(=O)[C@H](c1ccccc1)n1nnnc1C 1875294449 SHTGLQUSIQOYJC-HKUYNNGSSA-N 381.411 2.522 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3cncc(-c4ccoc4)c3)CC1)O2 1875394636 PZVMEUPPGYKLEN-QGZVFWFLSA-N 394.431 2.566 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC=C(c2cccc(O)c2)C1 1875312413 BHAFXWDWURYDPI-JOCHJYFZSA-N 376.456 2.981 0 50 GFAA C[C@@H](Cc1nccn1C)NC(=O)Nc1cccc(-c2n[nH]c3c2COCC3)c1 2325782109 ZAMYHBCHPPKUGD-ZDUSSCGKSA-N 380.452 2.636 0 50 GFAA O=C(O)C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)C[C@@H](C(F)(F)F)O1 2325809017 SKLFTKCPJNZFHT-SKDRFNHKSA-N 380.326 2.722 0 50 GFAA COCCOC(=O)Nc1cccc(NC(=O)C[C@H](O)c2nc3ccccc3[nH]2)c1 2325853944 IUPZPIJTOXOEAH-KRWDZBQOSA-N 398.419 2.820 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(NC1CCCCC1)n2Cc1ccccc1Cl 796601 GJXLZPXXXZYIJK-UHFFFAOYSA-N 387.871 2.870 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCc2ccccc2C1 2857301 AHKQYLPZQYLCCC-CYBMUJFWSA-N 378.881 2.592 0 50 GFAA O=C(O)c1ccc(NCN2C(=O)c3ccc(Br)cc3C2=O)cc1 4531767 IDXSPIHRFAVGGQ-UHFFFAOYSA-N 375.178 2.813 0 50 GFAA CCCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(Br)cc2)C1 6746639 FZHISVLSVHEIBH-LBPRGKRZSA-N 389.315 2.839 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1 10463168 MTFMFKBIXFVVIL-UHFFFAOYSA-N 381.372 2.549 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2C(=O)N[C@H]3CCCC[C@@H]3N2C(=O)c2ccco2)c1 9483609 YHVQUFHTUQQOGA-OKZBNKHCSA-N 395.459 2.869 0 50 GFAA COCCN1CCC(CN(Cc2cccc3nonc23)C[C@@H]2CCCO2)CC1 55245026 JDFKQNIKKHBFKW-IBGZPJMESA-N 388.512 2.562 0 50 GFAA Cc1cccnc1C(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccc(F)cc2)C1 67696674 RHYUXDORARBMJO-UHFFFAOYSA-N 394.406 2.671 0 50 GFAA Cc1cccn2c(CN3CCc4ccccc4C3)c(C(=O)N3CCOCC3)nc12 23543678 HTWAGXNNUDICQF-UHFFFAOYSA-N 390.487 2.673 0 50 GFAA O=C(c1ccc(F)cc1Br)N1CCN(C(=O)N2CCCCC2)CC1 142685278 LEFREMOJDVISNI-UHFFFAOYSA-N 398.276 2.952 0 50 GFAA COc1cc(C(=O)Nc2ncc3c(n2)CC(C)(C)CC3=O)cc(OC)c1OC 1407267 VXSQBHQKHXBONY-UHFFFAOYSA-N 385.420 2.910 0 50 GFAA biogenic CCNC(=O)C1(CNC(=O)NCc2ccc(F)cc2C(F)(F)F)CCC1 487116429 OHSNLCDIKFAWIS-UHFFFAOYSA-N 375.366 2.950 0 50 GFAA Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)c1cnc(Oc2ccccc2)cn1 125656398 MVJOQODXARVXOL-HXUWFJFHSA-N 388.427 2.891 0 50 GFAA CC(C)n1nccc1[C@@H]1OCCC[C@H]1C(=O)N(C)CCN1CCOC(C)(C)C1 375459549 KOYXDHDVLYYIEO-IEBWSBKVSA-N 392.544 2.501 0 50 GFAA Cc1noc(C)c1CCC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1 262700548 CDRZKMLBOASCSK-GOSISDBHSA-N 399.447 2.942 0 50 GFAA CN(CCC(=O)O)C(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 262895830 OXNVHMNSLLZZPT-UHFFFAOYSA-N 392.253 2.670 0 50 GFAA CSc1nc(C(=O)N2CCCn3nc([C@H](O)C4CCC4)cc3C2)cs1 220521052 HPWNJQPBNMGKGU-OAHLLOKOSA-N 378.523 2.941 0 50 GFAA CCC[C@H](NC(C)=O)C(=O)N1CCC(n2cc(C3CCCCC3)nn2)CC1 48360831 OBTNNBTYWSCDHH-SFHVURJKSA-N 375.517 2.794 0 50 GFAA C[C@@]1(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1S(N)(=O)=O 288057229 SHZZOSYCAJNOFH-FQEVSTJZSA-N 387.505 2.641 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)C1 136108278 BREKILRDFPTFFU-IAQYHMDHSA-N 399.274 2.921 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2O[C@@H]3OC(C)(C)O[C@@H]3[C@@H]3OC(C)(C)O[C@@H]23)cc1Cl 229921873 ZZEXILUHBFSHFY-DRXUAVOGSA-N 397.855 2.983 0 50 GFAA O=C(O)c1sc(I)cc1I 83351212 HEXSDZQKJQDRSB-UHFFFAOYSA-N 379.944 2.656 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCC[C@H](Cn2ccnc2)C1 426677707 PUNVLEZDGQPJDS-MRXNPFEDSA-N 380.452 2.590 0 50 GFAA CCc1noc(C)c1C(=O)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95372750 PQXOKGNMNYAMRI-IOMROCGXSA-N 381.476 2.953 0 50 GFAA CN(Cc1c[nH]nc1-c1ccc(F)cc1)C(=O)c1coc(CN2CCOCC2)c1 95354829 UXIOEQNARPDVNG-UHFFFAOYSA-N 398.438 2.913 0 50 GFAA CCn1cc(CN(C)C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)c(C)n1 426381785 UGJKEGLVUONNLT-UHFFFAOYSA-N 377.452 2.605 0 50 GFAA Cc1cnn(CC(=O)N2C[C@@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)c1 95381493 IPDUSGHBICRMSX-CEWLAPEOSA-N 386.446 2.559 0 50 GFAA CCCN1CCC[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1=O 92002805 HQLWSTZUGLOCQH-JOCHJYFZSA-N 380.492 2.796 0 50 GFAA CN(C)C[C@@H]1CN(Cc2c(-c3ccc(F)cc3)nc3ccccn23)C[C@@H]1CO 92061768 CGEUSGBKIQSVBK-QZTJIDSGSA-N 382.483 2.742 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Nc3cccc(Cl)c3)[C@@H]3OC(C)(C)O[C@H]3[C@@H]2O1 239310471 ILXDDQNPLLGHNZ-NJURLYQPSA-N 383.828 2.675 0 50 GFAA O=C(CN1CCC(c2ccccc2)CC1)N[C@@H](c1ccccn1)[C@H]1C[C@@H](O)C1 243893176 AOVOWYRUSWOFNG-ZRCGQRJVSA-N 379.504 2.889 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCCC[C@H]2c2ncon2)c1 182100569 LUYUUIRYXGWLMA-AWEZNQCLSA-N 383.857 2.884 0 50 GFAA CCCOc1ccccc1CNC(=O)N1CCC[C@@H](CN2CCN(C)CC2)C1 534660311 YUQMVZPQNOGWLE-IBGZPJMESA-N 388.556 2.644 0 50 GFAA CC[C@H]1C(=O)NCCN1C(=O)c1ccc(-c2n[nH]c(-c3cccc(C)c3)n2)cc1 534665494 CJIKPPLFTWMQSO-SFHVURJKSA-N 389.459 2.798 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccsc1C(=O)O)c1ccccc1-n1cccn1 822273978 QONLNMIFDHEAEX-LLVKDONJSA-N 377.447 2.672 0 50 GFAA C[C@@H](C(=O)NCCCc1csc(N)n1)N1C(=O)c2cccc3cccc1c23 827654530 PITXHXXGCGJNPM-LBPRGKRZSA-N 380.473 2.976 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)[C@@H](C)N(C)C2CCCCC2)c1C 952986314 GTQDKQZXSPWJLJ-MRXNPFEDSA-N 375.513 2.963 0 50 GFAA Cn1cccc1-c1cc(C(=O)NC[C@@H](c2cccnc2)N2CCCCC2)n[nH]1 952966133 HYYKUIVURYGYSO-FQEVSTJZSA-N 378.480 2.767 0 50 GFAA Fc1cnc2[nH]cc(I)c2c1I 66054202 RNKUSVGRMCQMAX-UHFFFAOYSA-N 387.921 2.911 0 50 GFAA in-vitro O=C(NC[C@@H]1CCCN(C(=O)C2CCOCC2)C1)c1ccc2ccccc2n1 952979696 IFJNLTRPLQLCBA-INIZCTEOSA-N 381.476 2.630 0 50 GFAA Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)C(=O)CCc1ccncc1 275537998 RYBOKSQPJPFHDM-IRXDYDNUSA-N 376.501 2.850 0 50 GFAA C[C@H](C(=O)NC[C@](C)(O)C1CCCC1)n1c(S)nnc1-c1cccs1 170645160 GIGWDTAJFXDCRU-DIFFPNOSSA-N 380.539 2.914 0 50 GFAA CCc1nc(C)c(NC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)s1 170601198 DHPCWPBKYQANBO-UHFFFAOYSA-N 383.495 2.952 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)N1CCc2ccccc2C1 170600356 AARYANLDRVFUBB-OAQYLSRUSA-N 377.488 2.988 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C3CCN(C(C)=O)CC3)CC1)OCC2 1704339236 GPTZZFUTANTYCH-UHFFFAOYSA-N 388.508 2.579 0 50 GFAA COc1cc(-c2n[nH]cc2CN2CCCC[C@H]2CCO)cc(OC)c1OC 12316622 DKMYSQDNZXLHQM-INIZCTEOSA-N 375.469 2.839 0 50 GFAA O=C(COc1ncnc2ccccc12)N[C@@H]1CCCN(CCc2ccccc2)C1 14969616 LHRRXBGFPPLKQI-LJQANCHMSA-N 390.487 2.832 0 50 GFAA CCn1ccnc1CNc1ccc(C(=O)N2CCC(Cn3cccn3)CC2)cn1 15073329 LRDYQYZQQBIQOF-UHFFFAOYSA-N 393.495 2.659 0 50 GFAA c1ccc(CN2CCN(c3nc(N4CCOCC4)c4ccccc4n3)CC2)cc1 19882756 FVMDKJMUUVLQFT-UHFFFAOYSA-N 389.503 2.789 0 50 GFAA CCc1cnc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)C4CCCCC4)C3)C2)nc1 1857687833 HLUHCMGXLXMLCO-KNQAVFIVSA-N 386.540 2.799 0 50 GFAA O=C(c1cccn1C1CC1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857732977 PJKRYMUMGHJSHF-JQVVWYNYSA-N 377.444 2.738 0 50 GFAA O=C(CCc1nc(-c2ccoc2)no1)N1CCN(c2ncccc2Cl)CC1 120112281 RLUDISOFPMPSFE-UHFFFAOYSA-N 387.827 2.659 0 50 GFAA CCOCc1ccc(CNC(=O)CN2CC[C@@H](c3ccccc3)[C@@H](CO)C2)cc1 368513013 ZOQRVFDBHSTZML-PKTZIBPZSA-N 396.531 2.937 0 50 GFAA CN(Cc1nccn1CC(F)(F)F)S(=O)(=O)[C@@H]1C[C@@H]1c1cccc(F)c1 914054875 LGKHDVZHYIRKSD-ZIAGYGMSSA-N 391.390 2.902 0 50 GFAA Cc1ccccc1CC1(O)CCN(C(=O)[C@@H]2[C@H]3CC[C@@]2(c2ccnn2C)C3)CC1 1875395836 NGGVEFIWDJYKAG-PTLVVNQVSA-N 393.531 2.992 0 50 GFAA Cc1ccc(CC(=O)N=[S@@](C)(=O)CC2CN(C(=O)c3ccccc3)C2)cc1 1875302370 MUZFMNPPRHJMPM-MHZLTWQESA-N 384.501 2.934 0 50 GFAA Cc1cnc([C@H](C)N2CCN(C(=O)c3sccc3-n3ccnn3)CC2)s1 888102523 IYDGUSKJDUEFSO-ZDUSSCGKSA-N 388.522 2.613 0 50 GFAA COc1ccc(CC2=NO[C@@H](C(=O)NCC[C@H]3COc4ccccc4O3)C2)cc1 11998509 LGRPCQFRFNZSII-GHTZIAJQSA-N 396.443 2.729 0 50 GFAA CCN1CCN(c2ccc(C(=O)Oc3cccc(-c4ncnn4C)c3)cc2)CC1 2325742651 JVINQVBKACCDGH-UHFFFAOYSA-N 391.475 2.843 0 50 GFAA O=C(c1ccn(-c2ccc(C(F)(F)F)cc2)n1)N1CCN(c2ncc[nH]2)CC1 2325792750 KHHNEVOWIDVBSB-UHFFFAOYSA-N 390.369 2.577 0 50 GFAA C[C@]12CN(C(=O)C3=COCCO3)C[C@@]1(C)CN(C(=O)C13CCC(CC1)CC3)C2 2325793932 MABXJOBAMOJPDQ-NJMHRBNOSA-N 388.508 2.542 0 50 GFAA O=C(CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC[C@@H]1CCCO1 810031 WBYSQASDQFMFIO-SFHVURJKSA-N 394.537 2.525 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)NC[C@H]2CCCO2)cc1 839809 DPZUXUPZHGIPHO-LJQANCHMSA-N 388.489 2.562 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)NCc2ccncc2)c2ccccc2)cc1 882618 SNUBFAVTWVHSBJ-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA CCN1C(=O)N[C@H](c2cc(Br)ccc2OC)C(C(=O)OC)=C1C 1074836 MKQMUNOREYYXHY-CQSZACIVSA-N 383.242 2.991 0 50 GFAA CCN1C(=O)N[C@@H](c2cc(Br)ccc2OC)C(C(=O)OC)=C1C 1074838 MKQMUNOREYYXHY-AWEZNQCLSA-N 383.242 2.991 0 50 GFAA COc1ccc(NC(=O)CCN2CCN(c3ccccc3F)CC2)c(OC)c1 2765192 OQZKGRNOBWRWAF-UHFFFAOYSA-N 387.455 2.994 0 50 GFAA Cc1ccc(-c2noc(CCCC(=O)N3CCC[C@]34CCCN(C)C4=O)n2)cc1 2356167686 XZCIFECJPIZRSJ-QFIPXVFZSA-N 396.491 2.981 0 50 GFAA COCCN1CCC(CN(Cc2cccc3nonc23)C[C@H]2CCCO2)CC1 55245028 JDFKQNIKKHBFKW-LJQANCHMSA-N 388.512 2.562 0 50 GFAA Cc1nc(CN2CCN(C(=O)N[C@@H](C)c3ccc4c(c3)OCO4)CC2)oc1C 114919715 UMIYFVAMEKZZOG-AWEZNQCLSA-N 386.452 2.609 0 50 GFAA CN(Cc1ccccc1Cl)Cc1cnc(S(C)(=O)=O)n1C[C@H]1CCCO1 55060952 NZHRYRRDPKWBGT-MRXNPFEDSA-N 397.928 2.751 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCc3nnc([C@H]4CCCO4)n3CC2)cc1 20909605 OXQSUGDBRMYGLV-GOSISDBHSA-N 394.479 2.587 0 50 GFAA O=C(c1cnc[nH]c1=O)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67604416 ACEGURONUDMDCE-UHFFFAOYSA-N 397.818 2.831 0 50 GFAA COc1ccc(CCn2nc(C(=O)O)c3c2CCN(C(=O)C2CCC2)C3)cc1 67909452 YZMILPAPGSENJD-UHFFFAOYSA-N 383.448 2.517 0 50 GFAA O=C(O)[C@H]1C[C@H](C(=O)NCc2cccnc2)CN(Cc2cc3ccccc3o2)C1 71776810 CHKUDUJHYZAWPH-ROUUACIJSA-N 393.443 2.667 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccccc2CNC(=O)CCNC(=O)[C@H]2C[C@H]2C)C1 229764577 IIQJQXAGHGWZPW-IIMDRIAPSA-N 385.552 2.943 0 50 GFAA Cc1ccc(-n2nnc(C(=O)NCc3nncn3-c3ccccc3)c2C2CC2)cc1 122474518 LVXCNDPUDUNVJM-UHFFFAOYSA-N 399.458 2.964 0 50 GFAA O[C@@H](CNC1CCCCC1)COc1ccc(I)cc1 238014135 CFYLTJQNEATIPR-AWEZNQCLSA-N 375.250 2.953 0 50 GFAA C[C@H]1CN(C(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)[C@H]1c1ccccc1 124488692 PVGSIXUEXWGOON-HXPMCKFVSA-N 381.407 2.869 0 50 GFAA C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 375603751 BRJWGNWZQOLIGO-MVKSYNGESA-N 381.476 2.664 0 50 GFAA Cn1c2c(cc(C(=O)NCCCN3CCCc4ccccc43)c1=O)CCCC2 216253375 PLPFLUOSIMPZOL-UHFFFAOYSA-N 379.504 2.837 0 50 GFAA CN(C)[C@@H](Cc1ccccc1)C(=O)N1CCC(NC(=O)c2ccsc2)CC1 171665561 QZRVCSUSPHTIEJ-IBGZPJMESA-N 385.533 2.642 0 50 GFAA COc1ccc(NC(=O)NCCNc2cc(N3CCCC3)ncn2)cc1Cl 72441675 JKSJYWYIQJPCTJ-UHFFFAOYSA-N 390.875 2.972 0 50 GFAA CCCN1CCN(Cc2cc(Cl)cc(Cl)c2)[C@H]2CS(=O)(=O)C[C@H]21 72470034 ZPQAKEWTZDGZDE-CVEARBPZSA-N 377.337 2.687 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NS(=O)(=O)N3CCCC3)C2)cc1 72165176 YRKBADLQZVGGPC-FQEVSTJZSA-N 379.570 2.780 0 50 GFAA Cc1ccccc1CN1CC[C@@H](Cn2ccnc2-c2cc3n(n2)CCNC3)C1 72412275 XBEDIHUTGBDESA-GOSISDBHSA-N 376.508 2.680 0 50 GFAA CN1CCCN(Cc2cc3n(n2)CCCN(C/C=C/c2ccccc2)C3)CC1 72161086 SOQWRZDLQSPOIK-BJMVGYQFSA-N 379.552 2.940 0 50 GFAA CCn1ccnc1CS(=O)(=O)[C@@H](C)c1nc(-c2ccc(OC)cc2)no1 131169379 YLTHRNDHCFEEQO-LBPRGKRZSA-N 376.438 2.638 0 50 GFAA Cn1cc(N2CCN(C(=O)c3cc4ccc(OC(F)(F)F)cc4[nH]3)CC2)cn1 173656536 LTBGKOPUJWAJMB-UHFFFAOYSA-N 393.369 2.762 0 50 GFAA Cc1cc(CN[C@H]2CCN(c3ccccc3OC(F)F)C2)nc(N(C)C)n1 241515629 OGQCGIKKCQCZAY-AWEZNQCLSA-N 377.439 2.821 0 50 GFAA CCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)c1nc(-c2cccc(OC)c2)no1 174656547 AJVBFVUFRKQBTH-BBRMVZONSA-N 386.452 2.714 0 50 GFAA CC(C)c1nc(-c2ccc(C(=O)N3CCC[C@H](CS(C)(=O)=O)C3)cc2)no1 426428464 YXNAEKOUJWLBSR-AWEZNQCLSA-N 391.493 2.757 0 50 GFAA CCn1cc(S(=O)(=O)N(Cc2ccccc2)Cc2ccnn2CC)c(C)n1 20615240 GCDKEAPDIKKPMQ-UHFFFAOYSA-N 387.509 2.819 0 50 GFAA CCCc1cc(N2CCC(N3CCN(c4ccncc4)CC3)CC2)nc(C)n1 95518185 ZKZGRJPSRNLIAH-UHFFFAOYSA-N 380.540 2.924 0 50 GFAA CS(=O)(=O)Nc1cccc(NC(=O)N(CCCO)Cc2cccs2)c1 96131125 IESSSFXEWKLBNZ-UHFFFAOYSA-N 383.495 2.536 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(c1cnc3ccccc3n1)CC2 95504497 HFZAOLRYYNRISH-UHFFFAOYSA-N 388.475 2.643 0 50 GFAA CCc1nn(C)c(NC(=O)N2CCC(C(=O)NCc3ccco3)CC2)c1CC 95497008 XBWMRYDEWQXKHZ-UHFFFAOYSA-N 387.484 2.698 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95386045 ZDXFRKDDYPNAOT-SFHVURJKSA-N 386.459 2.994 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(Cc1scnc1C)C2 95368873 KYMHSUCHHKACTA-GGPKGHCWSA-N 379.570 2.791 0 50 GFAA COc1ccc(NC(=O)N[C@H](C)Cc2cccs2)cc1NS(C)(=O)=O 95512876 ISVRRLALJCFZCD-LLVKDONJSA-N 383.495 2.881 0 50 GFAA CCn1ccnc1CN(C)C(=O)N[C@H](C)c1nc(-c2ccc(OC)cc2)no1 534653241 IWRBOBOONPBWMU-CYBMUJFWSA-N 384.440 2.864 0 50 GFAA CN1CCC(CNC(=O)CN2CCOc3ccccc3C2)(c2ccccc2)CC1 823759425 IVDLTJLZNSPDQR-UHFFFAOYSA-N 393.531 2.661 0 50 GFAA CCN(Cc1ccccc1)C(=O)C1CCN(Cc2c(CO)cnc(C)c2O)CC1 952978225 BIIFFUDQQNOSJJ-UHFFFAOYSA-N 397.519 2.849 0 50 GFAA COc1ccc2[nH]cc(CCNc3ccc(C(=O)N4CCOCC4)cn3)c2c1 881981510 GCXKGLWXPNHNOM-UHFFFAOYSA-N 380.448 2.699 0 50 GFAA CCCC[C@H]1C(=O)N(C)CCN1S(=O)(=O)c1ccccc1C(F)(F)F 952978538 AKLILJVFFKWKPL-ZDUSSCGKSA-N 378.416 2.727 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2CCOCC2)C3)c2c(C)noc2n1 1565526192 IUAFHHZVKVLNEX-WBVHZDCISA-N 384.480 2.555 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1C[C@@H]2CC[C@H]1CN(Cc1ccccn1)C2 1565506467 MYOFGZXTYHKVEZ-AEFFLSMTSA-N 388.475 2.603 0 50 GFAA O=S(=O)(c1ccc(Br)o1)N1CCO[C@@]2(CCc3ccccc32)C1 408213866 IYSPPTMORKZELG-INIZCTEOSA-N 398.278 2.905 0 50 GFAA C[C@@H]1CN(c2ccc(C(=O)Nc3cc([C@H]4CCCOC4)nn3C)cn2)C[C@@H](C)O1 279356981 PBUORTUJIYWBMB-INMHGKMJSA-N 399.495 2.575 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NC[C@H](O)c1ccccc1 192770828 ZEJNRRSWNVLZRV-MOPGFXCFSA-N 382.460 2.540 0 50 GFAA CC1CCN(c2ccc(CNC(=O)NC3CCN(CC4CC4)CC3)cn2)CC1 193678299 UDLXTVJMXWZFAK-UHFFFAOYSA-N 385.556 2.992 0 50 GFAA CCOc1ccc(CCCC(=O)N2CCC3(CC2)CN(C)C(=O)CO3)cc1C 1772817708 HUDVFHYURHGFRQ-UHFFFAOYSA-N 388.508 2.566 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)N1CCC(Cc2ccc(O)nc2)CC1 1772804045 DQFZNXAJXGNOPQ-UHFFFAOYSA-N 387.505 2.838 0 50 GFAA CC(C)CCNC(=O)c1cn(CC(C)C)cc(C(=O)NCc2cccnc2)c1=O 11913384 BABKYQORQZFDNC-UHFFFAOYSA-N 398.507 2.605 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(Cc3c[nH]cn3)C2)c(OC)c1 11933162 BGVVZZBQGASZRG-MRXNPFEDSA-N 386.496 2.736 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H](CNC(=O)c3cc4ccccc4[nH]3)C2)nc(C)n1 12206761 WIFZSSDXKZDCNN-INIZCTEOSA-N 391.475 2.857 0 50 GFAA COc1ccc(CCN2C[C@@H](NCc3cccn3-c3cccnc3)CC2=O)cc1 12448190 UJJSTXLHPYZQBC-IBGZPJMESA-N 390.487 2.814 0 50 GFAA COc1ccc(CN2CCc3c(c(C(=O)NCc4ccccc4)nn3C)C2)cc1 14536549 FADMHJLJQDEJLV-UHFFFAOYSA-N 390.487 2.917 0 50 GFAA c1ccc(CNc2nc3nonc3nc2N2CCC(N3CCCC3)CC2)cc1 14960628 BWZSTRHOVJQBII-UHFFFAOYSA-N 379.468 2.690 0 50 GFAA Cc1nc(CN(C)S(=O)(=O)c2cc(F)c(Cl)c(C(=O)O)c2)cs1 156506804 RYKYKEVXGDUTLQ-UHFFFAOYSA-N 378.834 2.763 0 50 GFAA CNC(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)c1cncc(-c3ccccc3)c1)C2 1857528124 JQGSASBUCRHLJK-KSZLIROESA-N 388.427 2.724 0 50 GFAA CCOCCC(=O)N[C@H]1CCC[C@@H](CNC(=O)COc2cccc(Cl)c2)C1 1857685984 CTRXWRRJDOAXGF-WBVHZDCISA-N 396.915 2.937 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)cc1F 1857698914 NPYGCRWPVAEPFZ-CYBMUJFWSA-N 376.457 2.778 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Cl)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857715540 WKYUMYFEIANYPG-CJNGLKHVSA-N 388.773 2.922 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)Nc3ccc4c(c3)OCO4)C1)CC2 1875245456 APEGKXNGNNIHIP-FQEVSTJZSA-N 382.420 2.731 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)ccn1 118893246 LCBRNPYPMKGQQO-UHFFFAOYSA-N 399.470 2.709 0 50 GFAA COC(=O)[C@H](C)N(C)C(=O)c1ccc(OCc2c(C)noc2C)c(OC)c1 328591367 REJDFUCIBHBANA-LBPRGKRZSA-N 376.409 2.513 0 50 GFAA Cn1nc(C(=O)O)nc1CNC(=O)OCC1c2ccccc2-c2ccccc21 1857783508 VAVRGWPYTAZYSY-UHFFFAOYSA-N 378.388 2.552 0 50 GFAA CNC(=O)Cc1ccc(-c2noc([C@H](C)n3ccc(C(F)(F)F)n3)n2)cc1 1875269701 ZBHAWRANJDUYNF-JTQLQIEISA-N 379.342 2.850 0 50 GFAA Cc1ncsc1-c1ccc(CNC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)cc1 1875318127 NEHIZGVDFVDVLQ-OAHLLOKOSA-N 391.493 2.620 0 50 GFAA CC(=O)N[C@H](CC(=O)Nc1ncc([C@H]2CCCCN2)cn1)c1ccc(C)cc1 1875325884 WOWQSOKRPRQSIM-RTBURBONSA-N 381.480 2.806 0 50 GFAA Cn1ccc(C(=O)N[C@H](CNc2cnc3cc(F)c(F)cc3n2)C(C)(C)C)n1 1875333712 JASGVBLSBLWMDF-MRXNPFEDSA-N 388.422 2.898 0 50 GFAA COc1cc(Br)cc2cc(C(=O)NCc3cccnc3)c(=O)oc12 4710234 XFIKRKBDFOWDDS-UHFFFAOYSA-N 389.205 2.889 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)NCCn1nc(-c2ccccc2)ccc1=O 2100482478 BVRBDBTVLBPWEM-UHFFFAOYSA-N 378.432 2.564 0 50 GFAA C[C@H]1Cn2nc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cc2CN1 2325855509 DEVGXFQNUHUEIB-AWEZNQCLSA-N 375.432 2.879 0 50 GFAA CC(=O)N[C@@H](Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl 677381 PSEFISGMWKEZPY-LBPRGKRZSA-N 384.716 2.970 0 50 GFAA COc1ccccc1C(=O)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1 893033 GQOYUUQYWXYYBY-UHFFFAOYSA-N 388.851 2.712 0 50 GFAA CS(=O)(=O)N(CC(=O)NCc1ccco1)c1ccc(Cl)c(Cl)c1 912500 CXYGMYQDBXVBJM-UHFFFAOYSA-N 377.249 2.669 0 50 GFAA COc1ccc(CN2Cc3nnc(-c4cc(C5CC5)[nH]n4)n3[C@@H](C)C2=O)cc1 2356146552 KVWCCIFYDJSMMQ-LBPRGKRZSA-N 378.436 2.658 0 50 GFAA Cc1nonc1CC(=O)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2CCC(C)C 2356160465 SZQGQVIHLJCKNY-NEPXVJNWSA-N 388.512 2.585 0 50 GFAA O=C(CCC(=O)Nc1ccc2c(c1)OCCO2)Nc1ccc2c(c1)OCCO2 4614082 YPQDJHAFKVGPNV-UHFFFAOYSA-N 384.388 2.586 0 50 GFAA CCCCc1ccc(S(=O)(=O)N2CCC(Cc3nncn3C)CC2)cc1 55133933 DKSOUIXAPSGIOK-UHFFFAOYSA-N 376.526 2.801 0 50 GFAA CCn1c(=O)c(C(=O)Nc2ncc(Br)cn2)c(O)c2ccccc21 170624587 BNVZVZBHIASHJG-UHFFFAOYSA-N 389.209 2.532 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNCc3cccc(C)c3)C2=O)c1OC 67934702 MUOVDFMPBXEWGM-QHCPKHFHSA-N 398.503 2.656 0 50 GFAA CC(C)(C)[C@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O 96024538 ZSSGCSINPVBLQD-GOSISDBHSA-N 382.439 2.854 0 50 GFAA in-vitro CC(=O)N1CCc2c(nc(N(C)C)nc2NCc2cc3cc(F)ccc3[nH]2)C1 77504695 VARNSLJNDYLUNN-UHFFFAOYSA-N 382.443 2.680 0 50 GFAA Cc1nc2cc(F)c(F)cc2n1CC(=O)Nc1cccc(N2CCNC2=O)c1 474912204 QFUBGOOMOUUJRG-UHFFFAOYSA-N 385.374 2.791 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)NCc1csc(-c2cccs2)n1 72477119 ZSTFQRCRZJTOSS-UHFFFAOYSA-N 387.534 2.810 0 50 GFAA CC(C)NS(=O)(=O)c1cccnc1NCc1ccccc1-c1cnn(C)c1 432863889 CGHDQDNPPNWICQ-UHFFFAOYSA-N 385.493 2.781 0 50 GFAA O=C(NCCc1csc(-c2ncccn2)n1)c1cccc(-n2cccn2)c1 77407518 PKIBSOUURVSHIC-UHFFFAOYSA-N 376.445 2.758 0 50 GFAA COc1cc(-n2cccc2)c(Cl)cc1C(=O)N1CCC[C@@H](NC(C)=O)C1 124783978 RHWPKAVXEVBJIY-CQSZACIVSA-N 375.856 2.880 0 50 GFAA Cc1cc(NC(=O)C2CCN(C(=O)c3ccnc(OC4CCC4)c3)CC2)no1 129951200 YFNZFNXCKNXMRF-UHFFFAOYSA-N 384.436 2.800 0 50 GFAA CN(C)c1nc(-c2ccccn2)nc2c1CCN(C(=O)c1ccc(O)cc1)C2 71388534 RSIUDLGGUSEGAM-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA Cc1ccc(-n2cc(C)cn2)c(NC(=O)N2CCO[C@@H](Cn3cc(C)cn3)C2)c1 158448203 HNPSWLJLXAIVQM-GOSISDBHSA-N 394.479 2.927 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)COc3ccc4c(c3)OCO4)C2)cc1 72157244 BTIPCHAWNPOVOK-MRXNPFEDSA-N 384.432 2.906 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccc(Cl)cc4)CC3)nn2)n1 72437463 MHRSWGNLRUGXDL-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA C[C@H]1CC[C@@H](C(=O)N[C@@H]2CC(C)(C)C[C@](C)(CNC(=O)[C@H]3CC[C@@H](C)O3)C2)O1 127748609 XLMYPUIANFGQKC-LELUHLQUSA-N 394.556 2.939 0 50 GFAA O=C(N[C@H]1CCOC2(CCCCC2)C1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 130254820 CDAYHJCTYZXWSM-UONOGXRCSA-N 391.434 2.721 0 50 GFAA COc1cccc(CN2CCN(Cc3c(OC)ccc(F)c3F)CC2=O)c1 72169698 BZVKXDMIDCWKHR-UHFFFAOYSA-N 376.403 2.826 0 50 GFAA Cc1cc([C@H]2CN(C(=O)c3ccccc3Cn3cncn3)CCO2)ccc1F 128609451 CPVIYXNTMWDKOA-HXUWFJFHSA-N 380.423 2.988 0 50 GFAA CC(C)(C)C(=O)Cn1cc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)nn1 174715488 YXDDMJKLOIUQNV-INIZCTEOSA-N 390.871 2.760 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCN(CC(F)(F)F)C(=O)C3)c2)cs1 285684731 FHZHKTCUWLHZNU-UHFFFAOYSA-N 383.395 2.965 0 50 GFAA CC(C)C[C@@H](CNC(=O)N[C@H]1CCOC2(CCCCC2)C1)N1CCOCC1 132238166 UAIMQLSFXVOVLC-OALUTQOASA-N 381.561 2.914 0 50 GFAA C[C@H](O)c1cc2n(n1)CCCN(Cc1ccccc1OCCn1ccnc1)C2 221415714 RMPRXKOHGTZXLG-KRWDZBQOSA-N 381.480 2.618 0 50 GFAA Cc1ccc(C)c(NC(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)c1 92066911 GRLJLPWHGDCDKA-MJGOQNOKSA-N 389.496 2.723 0 50 GFAA O=C(NCc1cc(C2CC2)[nH]n1)c1coc(COc2ccc3c(c2)OCO3)n1 91859185 VKLUJLMNFGKLJJ-UHFFFAOYSA-N 382.376 2.513 0 50 GFAA Nc1cc(=O)[nH]c(CCNC(=O)c2ccc3nc(C4CCCCC4)oc3c2)n1 95529721 LZTLVPWRRKOAJM-UHFFFAOYSA-N 381.436 2.514 0 50 GFAA Cc1cc(C(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)c2ccc(F)cc2n1 97831208 TVPYFGYPMTUTFX-FQEVSTJZSA-N 377.419 2.866 0 50 GFAA N[C@H]1CCN(C(=O)c2ccc(OC3CCN(CCc4ccccc4)CC3)cc2)C1 95511859 RCEKYCXINYXKIS-NRFANRHFSA-N 393.531 2.946 0 50 GFAA CCc1nnsc1C(=O)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95353902 VNKWLGFDJRWNMB-HNNXBMFYSA-N 382.493 2.760 0 50 GFAA CC(C)Cc1nc(CN2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)no1 91643354 CCGCSCSNUBCNNF-QGZVFWFLSA-N 390.528 2.652 0 50 GFAA Cc1cccc(N2CCN(CCC(=O)N[C@H](C)Cc3cccc(C)n3)CC2)c1 244678759 IJMPPPCENLAKMP-HXUWFJFHSA-N 380.536 2.958 0 50 GFAA CCN1CCO[C@@H](CNC(=O)NCc2ccc3cncn3c2)[C@@H]1c1ccccc1 298097403 WLTXSOXTUJJUAX-SFTDATJTSA-N 393.491 2.596 0 50 GFAA COc1ccc([C@H](CC(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)NC(C)=O)cc1 299749876 LXWYRSMJLGIQBN-LULLPPNCSA-N 388.464 2.507 0 50 GFAA COC(=O)c1c(NC(=O)c2ccccc2)c2cc(N)cnc2n1C[C@H]1CCCO1 299763136 ZNSAFWUOMGTKLR-OAHLLOKOSA-N 394.431 2.836 0 50 GFAA CN(C)[C@H]1CN(C(=O)c2cccc(-c3ccc(-c4ccno4)cc3)c2)C[C@@H]1O 584892878 NYLBLGHKRBDEBK-PMACEKPBSA-N 377.444 2.756 0 50 GFAA Cc1nc(-c2ccc(NC(=O)COCc3nc4ccc(F)cc4[nH]3)cc2)n[nH]1 952869328 PDBHQFUKKKLKOB-UHFFFAOYSA-N 380.383 2.951 0 50 GFAA CCN1CCC[C@]2(CCCN(S(=O)(=O)CCOc3ccc(F)cc3)C2)C1 952967382 JPQRXZPIWWGBAP-IBGZPJMESA-N 384.517 2.732 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@@H](c3c(OC)cccc3OC)C2)c1 408525715 WNEWLPJWIMNAIT-MRXNPFEDSA-N 390.461 2.823 0 50 GFAA CCN(C(=O)NCCc1cccc(C(N)=O)c1)[C@@H]1CCN(Cc2ccccc2)C1 184610754 LEDOBYCIFAZTEU-OAQYLSRUSA-N 394.519 2.634 0 50 GFAA CCOc1ccnc(N2CCN(C(=O)[C@H](C)c3cn(C)c4ccccc34)CC2)n1 185392848 MIFKWSIJYIXJAY-MRXNPFEDSA-N 393.491 2.819 0 50 GFAA CS(=O)(=O)c1ccc(NC(=O)NC[C@H](c2ccccc2)C(F)(F)F)cn1 186493025 MBXJHQXXOMSRRB-CYBMUJFWSA-N 387.383 2.953 0 50 GFAA CC(C)c1nnc2ccc(NS(=O)(=O)c3ccc(N4CCCC4=O)cc3)cn12 187782075 XXEVUHGCVHLHBQ-UHFFFAOYSA-N 399.476 2.780 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@H](C)c1nncn1C 193178305 KJNAWESHODPYSV-NSHDSACASA-N 389.456 2.832 0 50 GFAA COc1cccc(OCc2cc(C(=O)NC[C@@H](C)Oc3cccnc3)no2)c1 11934997 QKUJEVJUOHCYIX-CQSZACIVSA-N 383.404 2.855 0 50 GFAA C[C@H]1CN(c2ccccc2)CCN1C(=O)c1cn(Cc2ccc(F)cc2)nn1 12203428 AUZHPQBCIDVRKJ-INIZCTEOSA-N 379.439 2.816 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)c1cc(COc2cncc(Cl)c2)on1 12303576 VOVMLAWPUIBVQB-UHFFFAOYSA-N 389.843 2.957 0 50 GFAA CCN1CCN(C(=O)c2cc(COc3ccc4c(c3)CCCC4)on2)[C@@H](C)C1=O 12386536 MWUROYCHYQDUII-HNNXBMFYSA-N 397.475 2.825 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@@H]3CCC(=O)N(CC4CCCCC4)C3)CC2)n1 12574655 BLHQMHIZXQUABI-HXUWFJFHSA-N 398.551 2.858 0 50 GFAA CC(C)CN1C[C@H](OCc2ccncc2)CN(Cc2cccc(O)c2)CC1=O 14744670 FGCYUDWFLPXRME-OAQYLSRUSA-N 383.492 2.673 0 50 GFAA COc1ccc(C(=O)Nc2ccnn2C2CCN(Cc3ccon3)CC2)cc1 15065429 IMFYENNMBHRYNR-UHFFFAOYSA-N 381.436 2.969 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857667053 NWQSPHMMNIQZQY-UHFFFAOYSA-N 377.492 2.987 0 50 GFAA CC(C)NC(=O)N1CCC2(CC1)CC(=O)N(Cc1cccc(F)c1)CCO2 1857685846 WWXIWCIHJGFNOU-UHFFFAOYSA-N 377.460 2.527 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)cc1F 1857698916 NPYGCRWPVAEPFZ-ZDUSSCGKSA-N 376.457 2.778 0 50 GFAA O=C(Cc1ccccc1)NC[C@H]1[C@H]2CN(CCC(F)(F)F)C[C@]23CC[C@H]1O3 1857712061 KHOXNLWHLSGOTN-DODZYUBVSA-N 382.426 2.777 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC[C@H](c2ccccc2)N(C)C)cc1Cl 130499302 KVLRJGQACPEMSX-QGZVFWFLSA-N 396.896 2.708 0 50 GFAA CN1CCN(C(=O)c2csc(Br)c2)C[C@H]1c1nc(C2CC2)no1 367475575 CUCSLOYGDWNBGI-NSHDSACASA-N 397.298 2.900 0 50 GFAA OC1(Cc2ccc(F)cc2)CCN(c2cc(OC3CCOCC3)ncn2)CC1 1875287074 UJRGAQRINULCOP-UHFFFAOYSA-N 387.455 2.748 0 50 GFAA C[C@@H](CCNC(=O)NCc1cn(C2COC2)nn1)c1cccc(C(F)(F)F)c1 1875289034 PZMANPAMVALVRE-LBPRGKRZSA-N 397.401 2.861 0 50 GFAA Cn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)NCCCc1c[nH]nc1C(F)(F)F 1875395310 AKPICNNHENFEJI-PZSREKOKSA-N 381.402 2.579 0 50 GFAA O=C(Cc1coc2ccccc12)N1CCN(C(=O)C2CC2)C2(CCOCC2)CC1 1775962945 ZEYJMNHOGRHVAK-UHFFFAOYSA-N 396.487 2.995 0 50 GFAA O=C(O)C1CC2(C1)C[C@H](NS(=O)(=O)/C=C/c1ccc(F)cc1)CCS2 899948213 FJJFXPMTWSPWPV-GACNUBMISA-N 385.482 2.845 0 50 GFAA C[Si](C)(C)CCOCn1cc(I)c2c(N)ncnc21 204763300 BXKMOWOCDJAMIH-UHFFFAOYSA-N 390.301 2.930 0 50 GFAA CCN1CCc2c(cccc2NC(=O)c2ccc(-c3nnc(O)n3C)cc2)C1 2325804421 MKRXGBFOBOVPRX-UHFFFAOYSA-N 377.448 2.818 0 50 GFAA CC(C)[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc2c(-c3nn[nH]n3)c[nH]c12 2325807978 PUPZJIRYAKTGPM-KSSFIOAISA-N 393.495 2.683 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N=[S@](C)(=O)c2ccc(Br)cc2)C1 2325889347 LTMCCQOWKUGWTC-DAOPMYJZSA-N 399.310 2.857 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1 1142071 IOPVVMWPTRIOSQ-OAHLLOKOSA-N 376.478 2.630 0 50 GFAA Cc1ccc(C(=O)NC[C@H](Cc2cccc(F)c2)C(=O)N2CCOCC2)c(C)c1 225716602 APYOTJLBZPPOMQ-IBGZPJMESA-N 398.478 2.890 0 50 GFAA CS(=O)(=O)Cc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1 116158421 WCULLUZGXQFKMD-UHFFFAOYSA-N 377.846 2.825 0 50 GFAA C[C@H](CCc1ccccc1F)C(=O)Nc1cccc(CN2CCNC(=O)C2)c1 462396251 RUTQKBWKTDWUQV-MRXNPFEDSA-N 383.467 2.965 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(N(CC)Cc3cnn(C)c3)nc2)CCN1C(C)C 20203645 HNEZDHVOFIFHMZ-HXUWFJFHSA-N 398.555 2.786 0 50 GFAA CCn1ncc(NC(=O)c2ccc([C@H]3CCCN3Cc3nc[nH]c3C)s2)n1 23145427 DNBOIMRBZNTNOF-CQSZACIVSA-N 385.497 2.980 0 50 GFAA NC(=O)c1ccc([C@H]2CCCN2C(=O)c2cn3c4c(cccc4c2=O)CC3)s1 23251365 AMFNTOZOLQLAEA-OAHLLOKOSA-N 393.468 2.695 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 136507835 DQRKLJLCGIJAQU-JXFKEZNVSA-N 390.487 2.984 0 50 GFAA Cc1noc(CN(C)C(=O)c2coc(COc3cccc4cccnc34)n2)n1 67446895 ZCMRYJAKNTZOFL-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA Cc1nn(C)cc1-c1cc(C(F)(F)F)n2ncc(C(=O)N3CCCC3)c2n1 2780632 NFAAKMZMYYZJIK-UHFFFAOYSA-N 378.358 2.693 0 50 GFAA C[C@H]1CO[C@H](C)CN1C(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 120345924 NVNIICVYLSKPBP-GUTXKFCHSA-N 382.407 2.528 0 50 GFAA CC1=NN(C(=O)[C@H](C)Cn2nc(C(F)(F)F)cc2C)[C@@](O)(C(F)(F)F)C1 6787429 LBJVAORUMNJEIL-KRTXAFLBSA-N 386.296 2.706 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@H](CO)OC[C@H]1C 154165614 LXIUWVDQQKTXQO-IAQYHMDHSA-N 396.896 2.906 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CC(c3cccnc3)C2)nc2cccnc21 77375137 PPFGKMHHBPFEJU-MRXNPFEDSA-N 393.491 2.982 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(CC(=O)Nc2cccc3nonc23)CC1 13324538 YALNKXCHCONBBA-UHFFFAOYSA-N 385.855 2.945 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 237440080 LNDIEROBRWMQJU-OBJOEFQTSA-N 384.307 2.932 0 50 GFAA C[C@@H](O)CN(c1ccccc1)S(=O)(=O)c1cnn(-c2ccccc2F)c1 172890020 FCZXJHUMECXDHS-CQSZACIVSA-N 375.425 2.588 0 50 GFAA CCN1CCCN(CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1=O 241946695 UNEYLGXFVQUUPB-OAQYLSRUSA-N 379.504 2.641 0 50 GFAA COCc1nn2c(nnc3c(=O)n(Cc4ccccn4)ccc32)c1-c1ccccc1 40391320 KZNPRGSQSDNMQJ-UHFFFAOYSA-N 398.426 2.696 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3ccc4c(c3)CCCO4)CC2)c1 82126298 GKMWOLGQNXXBEF-UHFFFAOYSA-N 380.444 2.618 0 50 GFAA CCn1ncc2c(C(=O)N[C@H]3CCCC[C@@H]3C(N)=O)cc(-c3ccccc3)nc21 177705807 CJXAOZXXPBTMBU-YJBOKZPZSA-N 391.475 2.892 0 50 GFAA CC(=O)N1CCC(N(Cc2ncn(-c3ccccc3)n2)Cc2cncs2)CC1 292485914 SMUMBFVIIQILSZ-UHFFFAOYSA-N 396.520 2.737 0 50 GFAA Cc1ccc(CC(=O)N2CCC(c3nnc(CN4CCCC4)n3C)CC2)cc1 96140881 DVKIZNOAWAOOPG-UHFFFAOYSA-N 381.524 2.668 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)N3CCC(Oc4ncccn4)CC3)cc2)o1 96163112 ADNZDDSKYWFXPJ-UHFFFAOYSA-N 380.408 2.910 0 50 GFAA COCCCN1CCC[C@@]2(CCN(C(=O)c3ccccc3SC)C2)C1=O 91974138 LLHUJIGOCZMVLM-FQEVSTJZSA-N 376.522 2.900 0 50 GFAA CCN1C[C@@H](NC2CCN(c3cc(C)nc(-c4ccccc4)n3)CC2)CC1=O 96140467 ASLFSVQOUSGKPE-IBGZPJMESA-N 379.508 2.631 0 50 GFAA CSCCc1nc([C@@H](NC(C)=O)C(C)C)n(-c2ccccc2C(=O)O)n1 95504889 FNVSPDKQDQNLDB-INIZCTEOSA-N 376.482 2.704 0 50 GFAA CCOc1cc(CN2CCN(Cc3cccs3)[C@H](CCO)C2)ccc1O 95347209 YNCBXANLVPLPJT-QGZVFWFLSA-N 376.522 2.921 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)C3CCN(c4ccnc(N)n4)CC3)cc2)n1 95508529 HGVJJBUDZRYCLF-UHFFFAOYSA-N 391.479 2.716 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)c1cn3cc(C)ccc3n1)CC2 96149290 QNZNFFDMNGAKEY-UHFFFAOYSA-N 392.507 2.765 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(c2cc([C@H]3C[C@@H](O)C3)ncn2)CC1 244795318 RDYPTZVVQIUKIF-KDURUIRLSA-N 380.492 2.590 0 50 GFAA CCn1nc(C)c(CC(=O)N2CCC[C@H](N(C)Cc3ccccn3)CC2)c1C 294385650 DRKGLPLHKHTCPR-FQEVSTJZSA-N 383.540 2.970 0 50 GFAA COc1ccc(CNC(=O)[C@H]2CCC(=O)N2Cc2ccc(C)cc2)cc1C(=O)O 299752803 VMOLANSPNMSJQR-GOSISDBHSA-N 396.443 2.509 0 50 GFAA OC1(c2ccccn2)CCN(Cc2cnc(NCc3ccccc3)nc2)CC1 828605348 PDJGWPZVEGYSPC-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA O=C(N[C@@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1)N1CCOCC1 409580015 IZJCQOFBNPHGPC-MRXNPFEDSA-N 381.432 2.626 0 50 GFAA CCn1c(=O)c2ccccc2n(CC(=O)N[C@H](C)C(C)(C)c2ccccc2)c1=O 728002835 IQEFWCBHEQIRJM-MRXNPFEDSA-N 393.487 2.666 0 50 GFAA CCc1cc2c(C)cc(=O)oc2cc1OC(=O)[C@H]1CC12CCS(=O)(=O)CC2 193527231 SFWAANUSOBBKLG-OAHLLOKOSA-N 390.457 2.784 0 50 GFAA C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)c1nc2cccnc2s1 193958592 WVHCIUKIQRGIIO-OAHLLOKOSA-N 381.505 2.632 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cccc(C)n1 788410059 KQVVENHXUCOZPY-GFCCVEGCSA-N 398.868 2.576 0 50 GFAA CCC[C@]1(CO)CN(C(=O)C2(Nc3ccc(OC)cc3)CCCC2)CC[C@@H]1O 1529110022 IXGODAKFNBBWOI-PZJWPPBQSA-N 390.524 2.792 0 50 GFAA O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC[C@@H](O)[C@@](CC2CC2)(C(=O)O)C1 1704337715 DBIFHMXYJRUPPF-APWZRJJASA-N 376.840 2.899 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2cccs2)c1 12404428 BHKQVDUHYJMPBX-AWEZNQCLSA-N 389.502 2.784 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2c[nH]cn2)C1)N1CCN(Cc2ccccc2)CC1 12438590 KCCVBEGBDCNBSR-OAQYLSRUSA-N 395.551 2.746 0 50 GFAA O=C1N(CC2CCC2)CCC[C@@]1(O)CN1CCOc2ccc(Cl)cc2C1 12586234 CWLVMNJRBUFICX-HXUWFJFHSA-N 378.900 2.688 0 50 GFAA COc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1C(=O)NC(C)C 13678662 FXADKRRGFZJWCF-UHFFFAOYSA-N 384.404 2.912 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)NCCNC(=O)[C@@H](CC)Oc1ccccc1 14025143 SVZQXGIJKCQXMN-BGYRXZFFSA-N 384.476 2.934 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2)CCCN(C(=O)c2cc(C)n(C)n2)C1 14957875 PVXLWTSPUQPJAH-OAQYLSRUSA-N 387.455 2.896 0 50 GFAA Cc1nnsc1C(=O)N1CCC(=O)N(Cc2ccccc2C(F)(F)F)CC1 14999225 VREJBSDVEJPKJD-UHFFFAOYSA-N 398.410 2.740 0 50 GFAA CSCCNCc1ccccc1OC[C@H](O)CN1CCc2ccccc2C1 15076080 LHYAZBKRVRFDKS-OAQYLSRUSA-N 386.561 2.937 0 50 GFAA O=C(c1cccc(I)c1)N1CCN(c2ccccn2)CC1 18220264 LPWUKMLDKRMBCW-UHFFFAOYSA-N 393.228 2.649 0 50 GFAA CCCOc1ccc(S(=O)(=O)NCCCN2CCOCC2)c2ccccc12 19619408 ABWNKYVGNKIEEL-UHFFFAOYSA-N 392.521 2.629 0 50 GFAA O=C(CCc1nnc(Cc2ccc(-c3ccccc3)cc2)o1)N[C@@H]1CCOC1=O 19770664 SYNUQYBZESZVAQ-GOSISDBHSA-N 391.427 2.692 0 50 GFAA O=C(NC1CCCC1)[C@@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2)C1 19860665 MSSOWNXQYBUBDE-OAHLLOKOSA-N 384.929 2.941 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1nc(C2CC2)n2ccccc12 1857527434 JQYFULJDTBHYCA-PBHICJAKSA-N 392.463 2.659 0 50 GFAA C[C@H](N)c1nc(-c2ccccc2)nn1CC(=O)NCCc1c[nH]c2ccccc12 1857681262 GBNRLVZFILVYGU-HNNXBMFYSA-N 388.475 2.805 0 50 GFAA O=C(O)CN1CCC2(CC1)OCCc1sc(C(=O)N[C@H]3C=CCCC3)cc12 1857683790 YDJBXWHYYNCNGW-AWEZNQCLSA-N 390.505 2.535 0 50 GFAA CC(C)CNC(=O)c1cc2c(s1)CCOC21CCN(c2cnccn2)CC1 1857703403 LAUBRVBSCCCPAS-UHFFFAOYSA-N 386.521 2.992 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)CCc2cc(Cl)no2)[C@H]1c1ccccc1 1857712208 MSFMVFHNDXQSJC-LPHOPBHVSA-N 377.872 2.791 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)N(C)Cc3[nH]c4ccccc4c3C)CC2=O)s1 1857741269 LAGKCZMTENNULQ-ZDUSSCGKSA-N 383.477 2.648 0 50 GFAA CC[C@@H](Cc1ccccc1Br)C(=O)N1CCO[C@H](CC(=O)O)C1 237036898 UTPWMNXUGZXPQE-GXTWGEPZSA-N 384.270 2.720 0 50 GFAA CC1(C)CN(C(=O)CCCc2cnn[nH]2)[C@H]1c1nccn1Cc1ccccc1 952894181 XCEDFTMUIVLJBK-IBGZPJMESA-N 378.480 2.982 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)c2cc(F)ccc2N2CCN(C)CC2)CC1 952845581 XGFQQHFCEIXPKO-UHFFFAOYSA-N 385.487 2.629 0 50 GFAA N[C@@]1(c2ccccc2)CCN(C(=O)c2ncn3cc(Br)sc23)C1 1875393664 JTZNRYNPQUTDOT-INIZCTEOSA-N 391.294 2.858 0 50 GFAA Cc1nc2ccccc2c(C)c1C(=O)N1CCOC2(CCS(=N)(=O)CC2)C1 1875395331 AWZLKZYCOAQMOB-UHFFFAOYSA-N 387.505 2.903 0 50 GFAA CC(C)(C)O[C@H]1C[C@H](NC(=O)N=c2nc(C3(C)CC3)[nH]s2)C12CCOCC2 1875396513 KINZGWKQOGMYEC-STQMWFEESA-N 394.541 2.886 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)CC1 1875369565 WAROUBXDAIDVGP-UHFFFAOYSA-N 390.430 2.811 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccccc1Oc1ccncc1 1875400495 BNFTZURYMUOIER-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCCCC1 3635557 PTEAZVSMJLAEEN-KRWDZBQOSA-N 390.530 2.876 0 50 GFAA COC(=O)[C@@]12COC[C@@H]1CN(C(=O)Cc1coc3cc(C)c(Cl)c(C)c13)C2 2100556202 IJJCYNOOXVPDTG-XOBRGWDASA-N 391.851 2.894 0 50 GFAA NC(=O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1CC[C@@H](O)CCc1ccccc1 204562828 UXOWZBKFWHSZFZ-NFVOFSAMSA-N 389.536 2.720 0 50 GFAA C[C@H](OC(=O)c1cccc(N2CCCC2)c1)C(=O)N1CC(=O)Nc2ccccc21 850247208 WROUPNKMIJBZNH-HNNXBMFYSA-N 393.443 2.817 0 50 GFAA COC(=O)c1cc(=NC(=O)c2c(-n3c(C)ccc3C)sc(C)c2C)[nH]n1C 2325818875 BMAXLHWLMDHZOB-UHFFFAOYSA-N 386.477 2.967 0 50 GFAA O=C(Nc1ccc(Cl)cc1I)N1CCC[C@H]1CO 136468718 SJOSQDSFCYLMGW-VIFPVBQESA-N 380.613 2.933 0 50 GFAA O=C(NCCN1CCOCC1)C1CCN(Cc2cccc3ccccc23)CC1 10381474 ABROTOWGMITUGT-UHFFFAOYSA-N 381.520 2.500 0 50 GFAA COc1ccccc1C(=O)Nc1cccc(NC(=O)c2cnc(N)nc2C)c1 55404337 BBDZFTRMKBEWLL-UHFFFAOYSA-N 377.404 2.880 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)/C=C/c3cccs3)C2)CC1 55060789 STUGXWHSIKXXRK-WAVCKPEOSA-N 377.510 2.526 0 50 GFAA Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)[C@H]1CCCN1S(C)(=O)=O 246713526 SNNOXTFWVRZQBB-CRAIPNDOSA-N 379.526 2.736 0 50 GFAA CC(C)Oc1cc(C(N)=O)ccc1NC(=O)N1CCC(c2ccnn2C)CC1 421149319 DKCVEKJSTSMUPG-UHFFFAOYSA-N 385.468 2.718 0 50 GFAA CCc1ncc(C(=O)N2CCCn3nc(-c4nc5ccccc5[nH]4)cc3C2)cn1 67847103 MNOZDYFOJLOVPZ-UHFFFAOYSA-N 387.447 2.825 0 50 GFAA CC(=O)Nc1ccc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 8974780 UCAHNTPZWVWTRP-UHFFFAOYSA-N 389.458 2.911 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3cc(F)cc(F)c3)CC2)nc(C)n1 67601985 TUNYKSRZADRWMI-UHFFFAOYSA-N 376.411 2.849 0 50 GFAA CC(C)Cn1c(CN2CCCN(c3ccccc3)CC2)cnc1S(C)(=O)=O 64002431 PVUVMDFJPCJWHO-UHFFFAOYSA-N 390.553 2.655 0 50 GFAA COc1nc2c(cc1CN(C)Cc1noc3c1CCCC3)C(=O)N(C(C)C)C2 215803714 WGDFJBVAJUNGQA-UHFFFAOYSA-N 384.480 2.953 0 50 GFAA CCCn1c(CNC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)nc2ccccc21 328617897 DEFPRRJZIFWLEE-KSFYIVLOSA-N 394.523 2.797 0 50 GFAA COc1ccc(-n2cc([C@H](C)NS(=O)(=O)NCc3ccccc3)cn2)cc1 71419135 GFQFAFFMRWVTPO-HNNXBMFYSA-N 386.477 2.566 0 50 GFAA COc1cccc(Cl)c1CC(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1 154074938 IAQCRTXTBZHIDL-AWEZNQCLSA-N 375.856 2.889 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)c4cccc(Cl)c4)CC3)ncn2)n1 72116001 POFYPRHXUVWZSK-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1 71711973 LEJBYDGIGJKMMI-HXUWFJFHSA-N 385.552 2.994 0 50 GFAA CCn1cc([C@H]2CS(=O)(=O)CCN2Cc2cccc3c2OC(C)(C)C3)cn1 377839783 MGXDCSJHSJFQGD-GOSISDBHSA-N 389.521 2.588 0 50 GFAA NC(=O)CC[C@@H]1CCCN(C(=O)c2c[nH]nc2-c2cccc(OC(F)F)c2)C1 173006470 UROSLTGYQLJNPK-LBPRGKRZSA-N 392.406 2.796 0 50 GFAA O=C(Cc1csc(NC(=O)c2cccs2)n1)N[C@H]1c2ccccc2C[C@H]1O 131027537 FHVATDKXBKYHFH-PBHICJAKSA-N 399.497 2.774 0 50 GFAA O=C1OCCN1c1cccc2c1CCN(C[C@H](O)COc1ccc(F)cc1)C2 174057183 AOJIRJGWJSBILR-KRWDZBQOSA-N 386.423 2.580 0 50 GFAA COc1ccc(-n2cc(CNC(=O)N[C@@H]3CCOc4c(C)cccc43)nn2)cc1 241470627 NWQXYZWPOPTTJX-LJQANCHMSA-N 393.447 2.907 0 50 GFAA CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)N[C@@H]2CCCC[C@H]2C)C1=O 242048190 VTNGLMQBTUROSU-SOIKWTOOSA-N 387.480 2.547 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3nnc(CC(C)C)s3)n2)cc1 44891767 VQIPTKJXLWWPGA-UHFFFAOYSA-N 399.476 2.608 0 50 GFAA O=C(NCCCN1CCC[C@@H](O)C1)Nc1ccccc1OCc1ccccn1 96150350 VIKYFSLWEZOLIK-GOSISDBHSA-N 384.480 2.629 0 50 GFAA Cc1ncncc1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3ccccc3)C2)C1 95528810 IWUAFTKVGFXPHX-HSZRJFAPSA-N 392.503 2.873 0 50 GFAA CCOc1ccc(CN2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)cc1 230198304 QLYMVCZFOYPABE-HSZRJFAPSA-N 385.552 2.994 0 50 GFAA CCc1nc(-c2ccc(C(=O)N3CCOCC3)cc2)n(-c2cccc(C)n2)n1 97492385 SIUNHTFXCVFJEA-UHFFFAOYSA-N 377.448 2.673 0 50 GFAA COCc1cccc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)n1 95512413 MJXYBUIYKSFFEW-GOSISDBHSA-N 391.475 2.888 0 50 GFAA CCC[C@H](NC(=O)Nc1cc(NS(C)(=O)=O)ccc1F)c1nccn1C 97805496 RXKBIFWMFABITL-ZDUSSCGKSA-N 383.449 2.594 0 50 GFAA O=C(NCC(=O)N1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1)c1cccs1 181324135 DCLQQEYHSREZBO-HNNXBMFYSA-N 395.488 2.669 0 50 GFAA O=C(O)C1CCN(C(=O)c2cccc(-n3cc(Br)cn3)c2)CC1 299748024 FWFHBBWJKOHNRJ-UHFFFAOYSA-N 378.226 2.572 0 50 GFAA O=C(O)C[C@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1ccccc1 299750071 MPAFTLQPLOIQLY-INIZCTEOSA-N 387.823 2.815 0 50 GFAA Cc1nccn1CC1(CNC(=O)N2CCC[C@H](OCc3ccccn3)C2)CC1 534651698 RVTDGBVHYQILOJ-IBGZPJMESA-N 383.496 2.758 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)C(=O)Nc1cc(C(=O)OC)ccc1OC 299774627 HNYNJUOBYDUUDY-QGZVFWFLSA-N 388.420 2.775 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@H]2CCOC[C@@H]2Oc2cccc(F)c2)n(C)n1 1565528603 ZUCZYAKCAYKSTP-HKUYNNGSSA-N 375.444 2.724 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1cnc(C)cn1)CC2 275863445 ZLJDNGZNCHIHON-SFHVURJKSA-N 384.505 2.890 0 50 GFAA CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](O)c1ccc(Cl)cc1 772704477 KYJYPLLNCANXTE-OALUTQOASA-N 399.878 2.718 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)c2cc(N(C)C)nc3ccccc23)C1 779844618 FLDKCSYNIZCKIJ-CXAGYDPISA-N 381.436 2.594 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43CO)[C@]1(O)CC[C@H]2C1=CC(=O)OC1 1848443834 CDMVQQAHEQVSMF-VNMNMMPESA-N 390.520 2.577 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4c[nH]nc43)C2)ccc1N1CCOCC1 1775978807 PFIGENRDVGWYQI-JOCHJYFZSA-N 380.492 2.675 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)CCCn3cncn3)C[C@@]2(CCc2ccccc2)C1 1772819166 GGPUAGZHXRXONI-FYYLOGMGSA-N 395.551 2.862 0 50 GFAA Cc1ncoc1C(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12440018 VBLADCQZYRDRJM-HXUWFJFHSA-N 389.402 2.916 0 50 GFAA CN(C)S(=O)(=O)NCc1nc(NCCCc2ccccc2)c2ccccc2n1 14974474 FZRNPXZQRNOUFU-UHFFFAOYSA-N 399.520 2.571 0 50 GFAA CCCn1cc(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccc(F)cc2)c(C)n1 15067532 BINVZAJPPFFAHR-VQTJNVASSA-N 386.471 2.988 0 50 GFAA CCOC(=O)N1CCN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1 19891637 RLYKATPCJKUCGG-HXUWFJFHSA-N 384.476 2.867 0 50 GFAA CCn1nc(C(=O)N2CCN(c3ccc(C)cc3)C(=O)C2)c2c1[C@H](C)O[C@H](C)C2 1857528466 IBBCBSUFIFJJNL-CVEARBPZSA-N 396.491 2.723 0 50 GFAA Cc1cc(C)n(-c2ccc(F)cc2CN2C[C@H](C(=O)O)C3(CCOCC3)C2)n1 1857695933 FLJKEQRGJFYWAA-GOSISDBHSA-N 387.455 2.941 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4ccncc4C)C[C@]34CC[C@H]2O4)n1 1875248676 FWXTVSJRJWFQIY-VTAPXXACSA-N 378.476 2.507 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N(C)Cc2ncc[nH]2)CC[C@H]1NC(=O)c1ccccc1 1875243976 GVNMHJLUDGGXRG-IPMKNSEASA-N 398.507 2.762 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N2C[C@H]3CCC[C@H]3C2)C[C@H]1NC(=O)c1cc[nH]c1 1875251116 NAHGNCUQDVNBRZ-LFAQGZIKSA-N 387.524 2.967 0 50 GFAA COCC1CCN(C(=O)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)CC1 112437461 LUFRJTPTFPSQDM-QZTJIDSGSA-N 389.540 2.864 0 50 GFAA C[C@@H](NC(=O)C(=O)Nc1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)nc1 874341381 BDIMIQXHYKMAKA-SECBINFHSA-N 379.342 2.584 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1cc(Cl)ccc1C(=O)[C@@H]1CCOC1)C1CC1 952832856 AUYVRNAJZBKVOY-WBMJQRKESA-N 387.885 2.726 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)C=C1CCNCC1)CC2 952893774 JIRNWGQQENLPES-IBGZPJMESA-N 387.549 2.788 0 50 GFAA C[C@H]1CCC[C@@H](C)N(C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)C1 1875350721 YIVPWAHLMJNPKY-QWHCGFSZSA-N 381.436 2.739 0 50 GFAA CN(Cc1ccnc2ccccc12)C(=O)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1 1875396823 DMMZRQCZJKSNPX-HXUWFJFHSA-N 388.427 2.913 0 50 GFAA Cc1noc(Cl)c1CC(=O)N1CCn2c(C)nc(C3CCN(C)CC3)c2C1 1875394390 HKORKOVLXJUBGL-UHFFFAOYSA-N 391.903 2.535 0 50 GFAA COCn1ncc(C)c1CN[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875398667 AXZNVBVUJQBZCX-FBBABVLZSA-N 395.507 2.588 0 50 GFAA CC(C)NC(=O)Nc1ccc(C(=O)N[C@@H]2c3cccc(O)c3C[C@@H]2C(=O)O)cc1 2325820990 GNIIMSGFFQRDIB-FUHWJXTLSA-N 397.431 2.650 0 50 GFAA N[C@H]1CCc2nc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cn2C1 2325855887 SKDHTGOYXNXUFU-HNNXBMFYSA-N 375.432 2.661 0 50 GFAA O=C(Nc1ccc(F)c(-c2cn(C3CCOCC3)nn2)c1)c1ccnc(O)c1 2325866609 RKCYJTZLDMIULB-UHFFFAOYSA-N 383.383 2.789 0 50 GFAA CCc1nc(C(=O)O)c(NC(=O)C[C@@H](NC(C)=O)c2ccc(F)cc2F)s1 2325874138 BZFFBMOXLJPVDL-GFCCVEGCSA-N 397.403 2.888 0 50 GFAA COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC(=O)c2ccccc2)c(OC)c1 956314 IJVPRROYGNQAKN-GOSISDBHSA-N 396.399 2.715 0 50 GFAA Cn1nc2c(c1C(=O)N1CCCN(c3nc4ccccc4o3)CC1)CCCC2 2356136817 KZMBSBWUUJSTQT-UHFFFAOYSA-N 379.464 2.793 0 50 GFAA O=C(C1CCOCC1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1ccccc1 2356159394 YNMFTFVSTJGJLX-MLNNCEHLSA-N 396.531 2.884 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356163900 WOHCGSNLNOIXFK-QFIPXVFZSA-N 396.491 2.803 0 50 GFAA COc1cccc(CN2CCC[C@]23CCCNC3=O)c1OCCCn1ccnc1 2356165947 RIRDHVUXLQRGCV-QFIPXVFZSA-N 398.507 2.605 0 50 GFAA Cc1ccn2cc(CNC(=O)c3ccccc3S[C@H]3CC(O)=NC3=O)nc2c1 20118901 WENSMIULJDZZOI-INIZCTEOSA-N 394.456 2.920 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2ccccc2CN2CCOCC2)cc1 64573223 NDPLSWSLXNUQNW-UHFFFAOYSA-N 392.546 2.719 0 50 GFAA COc1ccc(OC[C@H](O)CN(C)C)c(CNCCc2cccc(Cl)c2)c1 20208216 WKAPELPKSZDRKN-LJQANCHMSA-N 392.927 2.982 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)O[C@H](C)c2sc3ncnn3c2C)cc1 1405017 VTWBTQAYISBOSG-LLVKDONJSA-N 380.451 2.584 0 50 GFAA Cc1cc([C@H](C)NC(=O)NCCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc(C)c1F 121182338 WCNQIDZVEFKFLJ-FTAMUGHTSA-N 399.466 2.610 0 50 GFAA Cn1cc(C(=O)NCC2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)CC2)cn1 171385567 IDGGAQZSSDUHLR-UHFFFAOYSA-N 398.551 2.995 0 50 GFAA CCOC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc(Br)cc32)N2CCC[C@@H]12 15022908 OROIOIPZEJZPSI-HYSWKAIVSA-N 379.254 2.644 0 50 GFAA COc1cccc(Cn2nccc2NC(=O)N2CCN3CCCC[C@H]3C2)c1OC 158707875 DQVLWNBZYFWXNT-KRWDZBQOSA-N 399.495 2.651 0 50 GFAA CCOc1ccc2cc(C(=O)N(C)[C@H]3CCN(C4CCN(C)CC4)C3)[nH]c2c1 377638210 YTFSYWUXXRSCRD-SFHVURJKSA-N 384.524 2.807 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3cc(C)n[nH]3)C2)cc1OC 72170243 PRSUHTKLIZARLS-KRWDZBQOSA-N 386.496 2.514 0 50 GFAA O=C(NCC1CCN(C(=O)c2ccccc2)CC1)[C@@H]1COc2ccccc2C1 172552688 NXUPLYORSSPKDF-FQEVSTJZSA-N 378.472 2.906 0 50 GFAA C[C@H]1CCN(C(=O)NCc2nnc3ccccn23)CCN1Cc1ccccc1 174726317 PITGRFBXMJNAGY-KRWDZBQOSA-N 378.480 2.535 0 50 GFAA CCc1cccc2c(C(C)=O)cn(CC(=O)N3CCC(c4nc[nH]n4)CC3)c12 426711962 BSQITJGJMSXJHC-UHFFFAOYSA-N 379.464 2.931 0 50 GFAA O=C(Nc1ccccc1OC[C@@H]1CCCO1)N1CCN(c2ccccn2)CC1 95506447 BBHDQBPRUOUCJI-KRWDZBQOSA-N 382.464 2.994 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCC[C@@H](c2ccncn2)C1 426494308 NTNYMKDFCSDWGK-MRXNPFEDSA-N 378.436 2.651 0 50 GFAA Cc1nc2c(c(N3CCC(N4CCOC4=O)CC3)n1)Cc1ccccc1OC2 95521242 BRNPGBYANYAHLC-UHFFFAOYSA-N 380.448 2.689 0 50 GFAA COc1ccccc1-c1cc(CNC(=O)C2CCN(C3CCOCC3)CC2)on1 426652135 WSNCYWJEYAFKNL-UHFFFAOYSA-N 399.491 2.857 0 50 GFAA CCCN(Cc1nccn1C)C(=O)c1cnn2c(C(F)(F)F)cc(C)nc12 426640323 ASRJATOVVMISLP-UHFFFAOYSA-N 380.374 2.842 0 50 GFAA O=C(c1cc(F)ccc1F)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95510017 YWGZNHKZNHMHGD-SMDDNHRTSA-N 377.416 2.685 0 50 GFAA COC1CCN(Cc2cccc(OC[C@H](O)CN3CCCCCC3)c2)CC1 95517684 WBQQPSNMCKBAMC-HXUWFJFHSA-N 376.541 2.913 0 50 GFAA CCN(C(=O)Nc1ccccc1CN1CCCCC1)[C@H]1CCS(=O)(=O)C1 95516512 LEKNASRAYCAHLJ-KRWDZBQOSA-N 379.526 2.713 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@H]1C2)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 245237942 LUZDIWKBUUVMDS-VJANTYMQSA-N 376.522 2.533 0 50 GFAA O=C(O)CN(C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)C1CCOCC1 299750008 MJVTXIDMEZMDCM-KGLIPLIRSA-N 387.354 2.781 0 50 GFAA Cc1cccc(OC2CN(C(=O)N[C@@H]3CCCN(C(=O)c4ccco4)C3)C2)c1 584901739 LKRFMSKOKYDUBS-MRXNPFEDSA-N 383.448 2.665 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)c2nc(C(C)C)cs2)cc1 670459257 KNZGMSXFUGEUHZ-UHFFFAOYSA-N 381.523 2.673 0 50 GFAA CN1CC[C@H](C(=O)N[C@@H]2C[C@@]3(CCNC3)Oc3ccccc32)c2ccccc21 1342237956 YIQGYEHNMMSYKY-GEQKSPFYSA-N 377.488 2.982 0 50 GFAA Cc1nn(-c2ccccc2)cc1CNC[C@H](c1ccccn1)N1CCOCC1 952969635 AIXAYNJLEJPUJJ-JOCHJYFZSA-N 377.492 2.739 0 50 GFAA C[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2cccc(F)c2O1 185984442 LZNFAUXNHIWOMM-CQSZACIVSA-N 397.450 2.622 0 50 GFAA COC(=O)c1cc(Br)c(S(=O)(=O)Nc2ccc(F)cn2)s1 170609256 ILEWISCNTHLEBU-UHFFFAOYSA-N 395.231 2.632 0 50 GFAA CN1CCN(Cc2ccc(C(=O)N3CCCN(c4ccccc4)CC3)cc2)CC1 193663230 UDILONXATZPFHK-UHFFFAOYSA-N 392.547 2.787 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccnc2)C(=O)c2cc(F)c(F)cc2Cl)N1 1506422139 OSSNGAKYIWLTHB-LBPRGKRZSA-N 379.794 2.934 0 50 GFAA Cc1cc(C)cc(N2CCC(N3CCCN(C(=O)c4cnccn4)CC3)CC2)c1 1775982138 QSUWRCMOGHWHRM-UHFFFAOYSA-N 393.535 2.910 0 50 GFAA CC[C@H](C)[C@H](NC(=O)c1cc(COc2cncc(Cl)c2)on1)C(=O)OC 11933951 JLYQPRKFVCOVCX-BONVTDFDSA-N 381.816 2.620 0 50 GFAA CSc1ccccc1N1C(=O)CN(C(=O)Cc2ccc3c(c2)OCO3)C[C@H]1C 12097141 TUDRPIMYXAMRNK-CQSZACIVSA-N 398.484 2.944 0 50 GFAA Cc1ccccc1CC(=O)N1CCC(N2CCC[C@@H](C(=O)NC3CC3)C2)CC1 15069309 DHSCFKALVGEVRJ-LJQANCHMSA-N 383.536 2.519 0 50 GFAA COc1ccc(CN2CCN(Cc3cc(C(C)C)[nH]n3)C[C@@H]2CCO)cc1C 19741526 UMUZSCISSZNPAK-FQEVSTJZSA-N 386.540 2.919 0 50 GFAA CC[C@](C)(CO)C(=O)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1857527919 GMTPDHBGHWLALT-UQZYDQHUSA-N 394.537 2.586 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc(OC(F)(F)F)cc1 1857676164 DBRVCRAZTOLOKL-GLQYFDAESA-N 379.400 2.899 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3CCNC(=O)c3ccc(F)cc3)c2n1 1857685765 SJRIQOJHWHCYPB-UHFFFAOYSA-N 378.411 2.779 0 50 GFAA Cc1nc(C)c(C)c(N2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)n1 1857737715 ZOYUEOFTNOQGBL-JZJXAQOMSA-N 386.540 2.938 0 50 GFAA Cc1ccc2c(c1)CCCN2C(=O)CN1C(=O)[C@@]2(CCNC2)c2ccccc21 1875247156 YBEMGGAVRBTISD-HSZRJFAPSA-N 375.472 2.552 0 50 GFAA CCOc1ccc(S(=O)(=O)N[C@@H]2CCN(C(=O)CC)C2)c2ccccc12 133213470 NUBRZCRMSWBBSV-CQSZACIVSA-N 376.478 2.528 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc1 921149669 YNUVRWNZSXFUKA-UHFFFAOYSA-N 388.427 2.706 0 50 GFAA CN(C)C(=O)C1CCC(C(=O)Nc2[nH]nc3c2c(-c2ccccc2)nn3C)CC1 827963123 YWHTZKJYHNYRBZ-UHFFFAOYSA-N 394.479 2.797 0 50 GFAA O=C(c1noc2c1CCc1ccccc1-2)N1CCC[C@@H](c2nnc3n2CCC3)C1 932170220 DFSUTFGJAIRUEH-OAHLLOKOSA-N 389.459 2.998 0 50 GFAA COc1ccccc1[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c(C)c2)CCO1 870114488 AFTJZNGFHSXVFG-FQEVSTJZSA-N 378.432 2.798 0 50 GFAA O=C(Nc1ncc(C[C@@H]2COCCO2)s1)[C@@H]1C[C@H]1c1ccncc1Cl 1875295807 REDXTDFKNYFFFC-DDTOSNHZSA-N 379.869 2.892 0 50 GFAA CC(=O)N(CC(=O)O)[C@H]1CCCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1 1875279355 USQJJGSTWZIBOE-HNNXBMFYSA-N 381.860 2.968 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnc(C2CC2)o1 1875403033 PDYKZSQIIJQRML-ZTFGCOKTSA-N 392.459 2.985 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)cc1 801324 FSUKCLQTJMASRG-QGZVFWFLSA-N 378.425 2.626 0 50 GFAA O=C(N=c1[nH]nc(C2CCCCC2)s1)N1CCC(Oc2cnccn2)CC1 2325743385 XYFNLYDEXPOHCJ-UHFFFAOYSA-N 388.497 2.873 0 50 GFAA O=C1NCC2(CC2)C(=O)N1C[C@@H]1CCN(c2cccc(Br)c2)C1 2325770385 KXTAQDFOTNRFHH-GFCCVEGCSA-N 378.270 2.607 0 50 GFAA O=C(C[C@H]1CN(Cc2ncc[nH]2)C2(CCC2)CO1)N1CC=C(C(F)(F)F)CC1 2325785156 GCYWUNRHXKQOTH-HNNXBMFYSA-N 398.429 2.644 0 50 GFAA CN=c1[nH]cnc2cc(C(=O)N[C@H]3CN(Cc4ccccc4)C(C)(C)C3)ccc12 2325856454 QCZKMPJAAGBXFI-GOSISDBHSA-N 389.503 2.876 0 50 GFAA CNC(=O)CN(c1ccc(C)c(C)c1)S(=O)(=O)c1cc(C)ccc1OC 1071878 UXCKVKQDBIXUCZ-UHFFFAOYSA-N 376.478 2.562 0 50 GFAA O=C(N[C@@H](O)C(Cl)(Cl)Cl)c1cccc(I)c1 3122222 UDACDWUYMLWHPQ-QMMMGPOBSA-N 394.423 2.710 0 50 GFAA COC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@@H]1c1cc(OC)ccc1OC 4838487 NGGCGAILKBDQRN-LJQANCHMSA-N 392.415 2.895 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc3c(c2)C[C@@H](C)N3C(C)=O)c(OC)c1 6878171 XAADMHOPZKSBNM-GFCCVEGCSA-N 390.461 2.802 0 50 GFAA COc1ccc(-n2c(SCC(=O)Nc3ccccc3C)nc(O)cc2=O)cc1 8576567 SSIIXTAPDAXINL-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA Cc1cc(NC(=O)NC[C@@H](N)c2ccccc2)ccc1-n1nnnc1C(C)C 415464793 NIBKHPPZPHSOFB-QGZVFWFLSA-N 379.468 2.916 0 50 GFAA COCc1cc(CN2CCN(Cc3ccccc3)[C@@H](CCO)C2)ccc1OC 20539539 LDSBFQHPRFKDCU-QFIPXVFZSA-N 384.520 2.910 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)cc(-n2ccnc2)n1 65364401 IBTSRPUMUWSIGX-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA O=C(Nc1ccc(Cl)cc1)N1CCN(c2ccc(-n3cccn3)nn2)CC1 65362218 ZWNQZCRBVMKQIV-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)cc(-n2ccnc2)n1 65362025 IVWCOTCGZCYERR-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA Cc1cc(Cl)ccc1-n1nc(CC(C)C)nc1Cc1c(C)[nH]c(=O)[nH]c1=O 67982931 GUXFBBVOOZOZRW-UHFFFAOYSA-N 387.871 2.703 0 50 GFAA COc1cc(CN2Cc3nc(N)nc(-c4ccccc4)c3C2)cc2c1OCO2 65384854 RIZBAESKMCLOEB-UHFFFAOYSA-N 376.416 2.979 0 50 GFAA CCCc1ccc2oc(C(=O)N3CCN(CC(=O)NC(C)C)CC3)c(C)c2c1 36379387 LLEAAXFZDDIDIU-UHFFFAOYSA-N 385.508 2.976 0 50 GFAA CCOc1nc(C)ccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 252482098 CXXJZRUAQOQKEN-LJQANCHMSA-N 381.476 2.752 0 50 GFAA C[C@@H]1[C@H](C(=O)NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 242167628 WYDGKHCOZBRDDA-KBAYOESNSA-N 376.497 2.742 0 50 GFAA O=C(c1cccnc1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72128833 SUCUKFMCKNCUJP-IOMROCGXSA-N 377.444 2.513 0 50 GFAA CCc1ccc(CN2CCc3nc(NC)nc(C(=O)N4CCCC4)c3C2)cc1 72161162 RSAJWQQGFCRSEW-UHFFFAOYSA-N 379.508 2.875 0 50 GFAA O=C(CCC(=O)N1CCCO[C@H](CN2CCCCC2)C1)c1ccc(F)cc1 216434696 YKVZSDRTFOMMTA-LJQANCHMSA-N 376.472 2.892 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CCC[C@H](c4ncc[nH]4)C3)cc2n1 216483019 WIBMGMBMTMJAAG-NSHDSACASA-N 378.358 2.799 0 50 GFAA Cc1cc(C)n(-c2ccc(=O)n(CC(=O)Nc3cc(Cl)cc(Cl)c3)n2)n1 40284235 ADRWIKHANKOPLK-UHFFFAOYSA-N 392.246 2.991 0 50 GFAA CO[C@H](CNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C(C)(C)C 174645392 MZLHLIFZSHPYSG-GOSISDBHSA-N 375.513 2.960 0 50 GFAA CCc1oc2c(Cl)cc(NC(=O)N3CCNC(=O)[C@H]3CCO)cc2c1C 426374444 WUXYKARRCSQXKE-CQSZACIVSA-N 379.844 2.672 0 50 GFAA CCCN(Cc1nccn1C)C(=O)NCCc1nc(C)cc(C(F)(F)F)n1 426359354 ARKCNIDJBMFGTM-UHFFFAOYSA-N 384.406 2.702 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1 177645129 IXADWUYMYDUPBG-LJQANCHMSA-N 386.540 2.589 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1CC[C@H](N2CCOCC2)[C@H](CCC(=O)O)C1 95376527 UJVBQFSSEBUOAO-AEFFLSMTSA-N 392.496 2.739 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)NCCc1nc2ccccc2s1 91656154 YBBLSVARJTUEBG-UHFFFAOYSA-N 378.457 2.824 0 50 GFAA CSCCN(C)C(=O)c1cccc(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@@H]2C3)c1 97773058 BZWYZVIJVNJEIL-JJRVBVJISA-N 382.551 2.589 0 50 GFAA O=C(c1nc(O)nc2ccccc12)N1CCC(c2nccn2CC2CC2)CC1 95511537 URBFEXOXAFQRFO-UHFFFAOYSA-N 377.448 2.962 0 50 GFAA Cn1cc([C@H]2CN(S(=O)(=O)Cc3c(Cl)cccc3Cl)CCO2)cn1 267531296 KXLKSKYJVOVYBD-OAHLLOKOSA-N 390.292 2.630 0 50 GFAA O=C(c1cnc(-c2cccnc2)nc1)N1CCC(OCc2ccccn2)CC1 95362047 NKHASTVFEZUKAJ-UHFFFAOYSA-N 375.432 2.755 0 50 GFAA CC(=O)N[C@H](CC(=O)N1[C@H](C(=O)O)C[C@H]2CCCC[C@H]21)c1c(F)cccc1F 299753066 WRRCIMHBXJEQAH-YYQUZTFQSA-N 394.418 2.776 0 50 GFAA O=C(c1ccc2cccc(Cl)c2n1)N1CC[C@@H](O)[C@](CC2CC2)(C(=O)O)C1 1940193488 BVNBTFJSDICRGO-OXQOHEQNSA-N 388.851 2.966 0 50 GFAA CC(C)CCN1C(=O)C2(CCN(C(=O)[C@H]3CCOC3)CC2)Nc2ccccc21 55073699 ONIVZWYEPPSZDM-KRWDZBQOSA-N 385.508 2.889 0 50 GFAA Nc1nccc(C2CCN(C(=O)Nc3cccc(N4CCCC4=O)c3)CC2)n1 299776596 DJOROQSFPSHWMZ-UHFFFAOYSA-N 380.452 2.597 0 50 GFAA O=C(CSc1ccccc1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccn1 1565527341 OAVRYMHGQUYMOG-AEFFLSMTSA-N 381.501 2.823 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)Nc1nnc([C@@H]2CCCO2)s1 1467168967 JMRZTMUCVYYCEI-LBPRGKRZSA-N 395.872 2.595 0 50 GFAA CN(C)c1cc(CNC(=O)c2nc(C3CC3)ncc2Br)ccn1 170613533 DKFCNLNVDZJSSS-UHFFFAOYSA-N 376.258 2.508 0 50 GFAA CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1 195460277 FHCCNHRAVVSLSR-PKOBYXMFSA-N 399.535 2.692 0 50 GFAA CC(C)n1ncc(C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)c1N 757911432 BVGGGRKKXBHYSJ-QGZVFWFLSA-N 391.903 2.503 0 50 GFAA O=c1cc(CN2CCC[C@@H](c3nc4ccccc4o3)C2)nc2c(O)cccn12 1506406802 JIBCNGJQSRTWGE-CQSZACIVSA-N 376.416 2.921 0 50 GFAA CC[C@H](C(=O)Nc1c(N2CCCC2)nn(C)c1C)N1Cc2ccccc2C1=O 1506415251 WXACPZIAGAYXRP-QGZVFWFLSA-N 381.480 2.702 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)CCn3cccn3)C2)c1 11880026 OFZOEFDGDYUPAO-SFHVURJKSA-N 398.507 2.617 0 50 GFAA COCCN(Cc1ccc(OC)c(OC[C@H](O)CN2CCCCC2)c1)C(C)C 12588964 XEYGDVLJNNNRMY-HXUWFJFHSA-N 394.556 2.778 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cccc(OCCO)c2)C1)c1ccc(F)cc1 12592766 YCKNYKIZUQJVON-SFHVURJKSA-N 386.467 2.839 0 50 GFAA O=C(c1c[nH]cn1)N1CC(=O)N(C2CCCCC2)C[C@@H](OCc2ccccc2)C1 14543169 JZOBMTFPBWSWBT-IBGZPJMESA-N 396.491 2.612 0 50 GFAA CCc1ccccc1N1C[C@@H](c2nnc(NC(=O)[C@H]3CCCO3)s2)CC1=O 16626076 NUGYZFQAWNKKRT-DZGCQCFKSA-N 386.477 2.739 0 50 GFAA COc1ccc(N2C(=O)C[C@H](N(C)CCc3ccc(OC)c(OC)c3)C2=O)cc1 18250422 VGWPKJGHJBPYFU-SFHVURJKSA-N 398.459 2.519 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCSCC2)n1CCCc1ccccc1 19222985 KKOIBWHLEUPVJG-UHFFFAOYSA-N 393.578 2.858 0 50 GFAA Cc1cccc(CC(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 169779715 WIXWSEBITINUDU-UHFFFAOYSA-N 376.460 2.818 0 50 GFAA COC(=O)c1cccc(CN2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1 1857687890 KMMAWSUHNUXAAA-JOCHJYFZSA-N 380.444 2.723 0 50 GFAA O=C(O)[C@H]1CN(CCc2ccccc2)CC12CCN(Cc1ccccn1)CC2 1857692548 KBOLLTRDVPKZQP-OAQYLSRUSA-N 379.504 2.923 0 50 GFAA CN(Cc1nccn1Cc1ccccc1)C[C@@]1(O)CCCN(c2ccncc2)C1 1857715820 JUQNVOROIPVWQL-QHCPKHFHSA-N 391.519 2.790 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)N1CC(c2ccncc2)C1 1857725273 ZJRNULWCEJCMEQ-OAHLLOKOSA-N 377.448 2.850 0 50 GFAA COC1(C(=O)NCc2cnc(C)cn2)CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1 1857727035 JPJHZRADLJJGRS-ICSRJNTNSA-N 398.551 2.875 0 50 GFAA CC(C)C[C@@H]1C[C@H](NC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)CCO1 230222759 JNPHRNZIVASKAZ-AQNXPRMDSA-N 378.488 2.909 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@@H]1c1ccc(Cl)cc1 13562845 SNYBQIIVGREIAE-JEWRLFTDSA-N 382.840 2.506 0 50 GFAA in-vitro Cc1c(NC(=O)c2cccc(OCC(N)=O)c2)cnn1-c1cccc(Cl)c1 151959557 PBOYYXASQLMHQX-UHFFFAOYSA-N 384.823 2.951 0 50 GFAA FC(F)(F)[C@]1(c2nc(C3CC3)no2)CCN(Cc2nc3c(s2)CNCC3)C1 952891121 AGVWJNQSATVHEC-MRXNPFEDSA-N 399.442 2.755 0 50 GFAA CC(=O)N1CCC[C@H](CNC(=O)N[C@H](Cc2ccccc2)Cc2cccnc2)C1 1875288943 MECMNZBJYDYRCL-FGZHOGPDSA-N 394.519 2.793 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3ccc(-c4cnco4)cc3)CC1)O2 1875394779 WMPRBDVGYZXWES-INIZCTEOSA-N 394.431 2.566 0 50 GFAA Cc1occ(C(F)(F)F)c1CC(=O)N1CC[C@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401082 FCSKHBWYPISIJX-YGRLFVJLSA-N 384.358 2.973 0 50 GFAA FC(F)C[C@H]1CN(c2ccnc(-c3cncc(Br)c3)n2)CCN1 2325800224 YJHPXZDPUFRFBF-LBPRGKRZSA-N 384.228 2.735 0 50 GFAA O=C(COc1ccc(Br)cc1Br)NC[C@H]1CCCO1 622218 PXUXHMBUWFRXSZ-SNVBAGLBSA-N 393.075 2.886 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccccc1C(=O)N1CCCCC1 999311 YXXOMQCXBSODJH-UHFFFAOYSA-N 391.427 2.547 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3ccc4ncnn4c3)C2=O)cc1 2356144530 BWFBGDPNTPWKHB-QFIPXVFZSA-N 389.459 2.840 0 50 GFAA O=C(O)CN(C1CCCCC1)S(=O)(=O)c1ccc(Br)cc1 4680569 PADWQPLEIDPROO-UHFFFAOYSA-N 376.272 2.857 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)N1CCC[C@@H](Oc2ncccc2F)C1 225607900 XUPYHMATMIXQDW-OAHLLOKOSA-N 381.407 2.717 0 50 GFAA Cc1ncc(CN2CCC[C@@H](C(=O)Nc3cccc(-n4cccn4)c3)C2)cn1 23192975 NXUXUOFSNBMWGR-GOSISDBHSA-N 376.464 2.821 0 50 GFAA CN(Cc1nc(-c2ccc3c(c2)OCO3)no1)C[C@@H]1COc2ccccc2O1 55166153 WFDWZUDETMIYGL-CQSZACIVSA-N 381.388 2.737 0 50 GFAA CCN1CCN(CC(=O)Nc2scc(-c3ccccc3)c2C(=O)OC)CC1 20608808 DHCXGKHUMFVSID-UHFFFAOYSA-N 387.505 2.778 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 27640248 LYXKJZCRLQWIIN-UVWIFGOJSA-N 388.460 2.750 0 50 GFAA in-vitro CCOC(=O)CCNC(=O)N1CCN(Cc2ccc(C(C)(C)C)cc2)CC1 13328246 OIHCTDNTEKORRY-UHFFFAOYSA-N 375.513 2.765 0 50 GFAA Cc1nc(C2CCNCC2)cc(N2CCc3[nH]cnc3[C@H]2c2cccnc2)n1 67821518 OAEBWFFSGCPSSC-OAQYLSRUSA-N 375.480 2.522 0 50 GFAA COc1ccccc1C(=O)[C@H]1CCCN(C(=O)CCN2CCCCCC2=O)C1 72169291 PREZBVVGWFTEEC-KRWDZBQOSA-N 386.492 2.909 0 50 GFAA COCc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1 241653357 PULYCYWHMYGRSL-INIZCTEOSA-N 394.518 2.995 0 50 GFAA Fc1ccc([C@@H](CNC(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)N2CCOCC2)cc1 242273574 YEABGOAQHOLJOV-IAAVTCLWSA-N 377.529 2.852 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCC(C(=O)O)(c2ccccc2)CC1 237503932 PVAIIHHRGSNRBM-HNNXBMFYSA-N 383.492 2.861 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)[C@H]2CCC[C@H](O)C2)CC1 219588309 CFUCLIHEHRYLLY-WMZOPIPTSA-N 380.916 2.723 0 50 GFAA COCc1noc(CNC(=O)c2ccc3c(c2)nc(C)n3-c2ccccc2)n1 223612265 TVTWWLGORJEHSY-UHFFFAOYSA-N 377.404 2.793 0 50 GFAA Cc1occc1C(=O)Nc1nc(CC(=O)N2CCOc3ccncc32)cs1 174909758 SJLORCBXGPYOPD-UHFFFAOYSA-N 384.417 2.660 0 50 GFAA CNC(=O)c1ccc(OC)c(-c2ccc(C(=O)NC3CCN(C)CC3)cc2)c1 426550031 NXRDRVXVXULZFR-UHFFFAOYSA-N 381.476 2.546 0 50 GFAA CCCn1ncc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)c1C 91680667 ANENBRRFHXDFSW-UHFFFAOYSA-N 384.528 2.620 0 50 GFAA Cc1c(C(=O)N[C@@H](Cn2ccnc2)c2ccccc2)sc2[nH]cnc(=O)c12 426550378 HGCNFSBFNZWQSW-AWEZNQCLSA-N 379.445 2.661 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)N(C)Cc2nccn2Cc2ccccc2)n1 426697554 OGDHFIFFPMJTOA-QGZVFWFLSA-N 380.496 2.975 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)cc1 95373947 KGCRAHRPMHPOLN-QHCPKHFHSA-N 381.520 2.879 0 50 GFAA Cn1cnnc1-c1ccc(NC(=O)NC2CCN(Cc3ccco3)CC2)cc1 95507849 WMFPQRGNNOMSTM-UHFFFAOYSA-N 380.452 2.861 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1 91304471 QGOFCMWSRQMUGS-KRWDZBQOSA-N 386.492 2.724 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)[C@H]1Cc3ccccc3S1)CC2 92028811 YKNIUYGMXSNTIG-GOSISDBHSA-N 382.533 2.822 0 50 GFAA COCC(=O)Nc1cccc(NC(=O)N2CCCC[C@@H]2CCn2cccn2)c1 96130316 UROAILLWIUHULL-GOSISDBHSA-N 385.468 2.945 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)c1ccc(CN2CCCC2)o1 97756393 CEKWVRHPUVBSLD-UHFFFAOYSA-N 377.554 2.965 0 50 GFAA CC[C@H](C)[C@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)Nc1cccc(OC)c1 252346756 AALVAOSULXSDMX-RVHYNSKXSA-N 395.503 2.879 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1nc(N2CCCC2)ncc1Cl 299753943 ZYCIBRWLEDWYJE-BNOWGMLFSA-N 378.860 2.588 0 50 GFAA O=C1c2c(-c3nc(-c4ccccc4)no3)nnn2CCN1Cc1cccc(F)c1 263618365 SPKDCVAFQBOUJA-UHFFFAOYSA-N 390.378 2.790 0 50 GFAA COc1cc(C)c(-c2nc(NC(=O)CCNS(C)(=O)=O)sc2C)cc1C 1940196469 NRNRJDOFUCSZQB-UHFFFAOYSA-N 397.522 2.622 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3ccc(-n4ccnc4)cc3)C2)n(C)n1 825286207 VLZAHGJAOAGMNQ-IBGZPJMESA-N 392.507 2.556 0 50 GFAA COc1ccc2cc(CN3C[C@H](C(=O)O)[C@@H](c4ccccn4)C3)c(O)nc2c1 1073317729 KLMAIZLMUCQSHL-IRXDYDNUSA-N 379.416 2.644 0 50 GFAA CO[C@H]1C[C@H](c2nc(C)no2)N(S(=O)(=O)c2ccc(C(C)(C)C)s2)C1 189190684 BRBMMGBZJMZRMU-NWDGAFQWSA-N 385.511 2.888 0 50 GFAA CC(C)Nc1ncc(CN2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)cn1 1616083639 YSXXCWMYMBENHF-RXVVDRJESA-N 377.492 2.881 0 50 GFAA Cc1nccn1-c1ccccc1CNC1CCN(C(=O)c2cccnc2)CC1 1506420599 MDDBRLLSLSEEEV-UHFFFAOYSA-N 375.476 2.970 0 50 GFAA CCCCn1ncc(C)c1NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O 1506397098 YRQSDIBYQQBHBK-UHFFFAOYSA-N 378.498 2.705 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N[C@@H]1CCCN(C(=O)c2cccs2)C1 1506400280 BOKOGKFKGBETTC-CQSZACIVSA-N 386.521 2.704 0 50 GFAA COCCN1C(=O)[C@@H]2CC[C@H]1CN(Cc1nc(-c3cccs3)oc1C)C2 221967074 NIROUPFDNKYAHV-CABCVRRESA-N 375.494 2.781 0 50 GFAA O=C(c1cc[nH]c1)N1C[C@@H]2CN(Cc3cnc[nH]3)C[C@]2(CCc2ccccc2)C1 1772814718 PKCHJJKTNCSCCR-NZQKXSOJSA-N 389.503 2.945 0 50 GFAA C[C@H]1C(=O)N2CCC[C@H]2CN1Cc1ccccc1CS(=O)(=O)c1ccccc1 1772701395 FMBYTKLWNLLHKB-PXNSSMCTSA-N 398.528 2.856 0 50 GFAA COc1cc2c(cc1CN1CCCN(C(=O)c3c(C)ncnc3C)CC1)CCC2 1775981591 MHLSXKJYWHZZLN-UHFFFAOYSA-N 394.519 2.939 0 50 GFAA CC1CCN(C(=O)COc2ccccc2CN2C[C@H]3CCCN3C(=O)[C@H]2C)CC1 1772709062 GSVCYFKREWTXDM-UYAOXDASSA-N 399.535 2.519 0 50 GFAA CC(=O)NCC[C@H]1CCCCN1C(=O)c1cn(Cc2ccccc2Cl)nn1 11814974 JNEISBXLLYJUED-MRXNPFEDSA-N 389.887 2.501 0 50 GFAA CN(C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1)C(C1CC1)C1CC1 12194145 NFNNRBHRMPJJCT-IBGZPJMESA-N 387.568 2.746 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CNC1CCOCC1)C1CCCCC1 12301242 FQKBDVIBYLFVPS-OAQYLSRUSA-N 376.541 2.959 0 50 GFAA CN(CCCNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1)C1CCCC1 12441543 CKXLTLMUQGTBLA-GOSISDBHSA-N 389.515 2.945 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NC(=O)CCN3CCCC3=O)C2)cc1 12590942 KVMSHSGVGUKGBJ-NRFANRHFSA-N 385.552 2.978 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1ccccc1)C2 14533566 BYUABPJYFBKVMB-KRWDZBQOSA-N 384.549 2.739 0 50 GFAA CCOC(=O)CN(C)Cc1ccccc1OC[C@@H](O)CN(C)C1CCCCC1 15069025 SRLBBHOHUQMVAQ-FQEVSTJZSA-N 392.540 2.686 0 50 GFAA CN1CCN(Cc2nnc(S)n2-c2cccc(OCc3ccccc3)c2)CC1 19362374 ICEIJCXFHHZFPV-UHFFFAOYSA-N 395.532 2.882 0 50 GFAA COC(=O)[C@H]1C[C@@H](NC(=O)C2CCN(c3nc4ccc(Cl)cc4o3)CC2)C1 1857718479 VZUOGZJOJWPPHP-XBXGTLAGSA-N 391.855 2.765 0 50 GFAA O=C(c1c(O)cccc1O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857720268 MCYWPKZVZVLTFY-FPOVZHCZSA-N 382.460 2.776 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1ccccc1OC(F)F)C[C@@H]2O 1857720321 OUOWWRMPEDZHDY-WQZMEWCLSA-N 375.415 2.857 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CC[C@@]45OC[C@@H](C(C)C)N4C(=O)C[C@@H]35)oc2c1 1857731714 YDBWYWFVRUQWGF-CECAUBDESA-N 398.459 2.948 0 50 GFAA Cc1cnc(NC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCCC2)s1 3400706 QPKGRLIYJGBKJL-UHFFFAOYSA-N 394.522 2.554 0 50 GFAA in-vitro COCCCn1c(C(=O)N2CCC[C@@H](C)C2)cc2c(=O)n3cccc(C)c3nc21 5246835 CAXKPOWLJDKHPD-OAHLLOKOSA-N 396.491 2.866 0 50 GFAA COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](C(=O)O)C1 237104990 ZTOFSTFDTSNCPP-UONOGXRCSA-N 384.270 2.577 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(OCc2ccccc2)cc1)c1nnnn1C1CC1 242302122 YPQQYHXJFQCAMD-AWEZNQCLSA-N 399.476 2.627 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)CNC(=O)c3ccc(C)c(C)c3)CCO2)c1 151353310 UBIIWRLNZPDSLP-FQEVSTJZSA-N 382.460 2.642 0 50 GFAA Cn1cccc1CNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363572357 DFBXXJWECCHXFZ-IBGZPJMESA-N 377.444 2.805 0 50 GFAA Cc1oc(-c2cnn(C)c2)nc1C(=O)N1CCNC[C@@H]1c1cccc(Cl)c1 262172896 YQIQJHHGSGBLER-MRXNPFEDSA-N 385.855 2.824 0 50 GFAA C[C@H](CO)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1Br 821376682 HUSMAPOPKDILGE-MFKMUULPSA-N 387.274 2.512 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)c3ccc([S@@](C)(=N)=O)cc3)cn2)C[C@@H](C)O1 1875292226 AQMOVRHZEHQMIG-SSWHHONOSA-N 388.493 2.983 0 50 GFAA Cc1cc(F)c(CNC(=O)N2CCc3nc[nH]c3[C@H]2c2ccnn2C)c(F)c1 1875301579 NWCFIGBDLJTHBG-GOSISDBHSA-N 386.406 2.587 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CCc2c(nnn2C)C1 888093949 NWUGYKFPFYUYPZ-GQIGUUNPSA-N 383.496 2.670 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC[C@H](O)c2cccc3ccccc23)s1 1309671035 NJPIRKIRUVBCFP-HNNXBMFYSA-N 391.470 2.700 0 50 GFAA COc1ccc(NC(=O)CSc2nnc(-c3cccnc3)n2C)c(OC)c1 650931 DRABSDUDDLMCQS-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA O=C(N[C@@H]1COc2ccccc2C1)c1cc2c(s1)CCOC21CCNCC1 2356155397 FOUFOQNOJZAELK-HNNXBMFYSA-N 384.501 2.633 0 50 GFAA COC(=O)c1ccc(NC(=S)N[C@H](NC(C)=O)C(Cl)(Cl)Cl)cc1 3124856 PPKSJFOHUNOFPW-NSHDSACASA-N 398.699 2.592 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)CCN1C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 117527446 WXOYWOSCJYRYJY-DYVFJYSZSA-N 398.500 2.841 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCN(C(C)C)CC3)C2=O)cc1 20539499 RJWHCWSTVPDPFI-QHCPKHFHSA-N 387.568 2.690 0 50 GFAA CN(Cc1ccccc1Cl)Cc1cnc(S(C)(=O)=O)n1C[C@@H]1CCCO1 55060951 NZHRYRRDPKWBGT-INIZCTEOSA-N 397.928 2.751 0 50 GFAA c1ccc(CN2CCC(Nc3ncnc4sc5c(c34)CCNC5)CC2)nc1 65385108 KYKDZPTWKPPZIN-UHFFFAOYSA-N 380.521 2.809 0 50 GFAA CCN(C(=O)c1cc(COc2c(C)cccc2C)on1)[C@@H]1CCS(=O)(=O)C1 67886661 ZJEVTVUNYLQWHP-OAHLLOKOSA-N 392.477 2.520 0 50 GFAA O=C(CCc1nc(Cl)n[nH]1)N1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1 65370005 SOZJSRVITYWNEV-DLBZAZTESA-N 384.867 2.921 0 50 GFAA Cc1nnc(C(=O)N2CCc3[nH]nc(-c4cccc(C(F)(F)F)c4)c3C2)o1 23478402 MKXVHSQOXHTZJQ-UHFFFAOYSA-N 377.326 2.985 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)CC1 67613735 YDOIGLCGVFXEMV-QGZVFWFLSA-N 394.537 2.775 0 50 GFAA O[C@@H]1CN(Cc2cccn2-c2cccnc2)CC[C@H]1c1ccc2c(c1)OCO2 65404465 SSPXOQJSONEFEV-VQTJNVASSA-N 377.444 2.951 0 50 GFAA O=C(CCN1CCCS1(=O)=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 170974575 KIRWLGJUPKIKMI-GOSISDBHSA-N 375.494 2.647 0 50 GFAA Cc1nc2c(cnn2C(C)C)c(C)c1CCC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 252538922 NIYVTQHTXTYWMD-REGGBESESA-N 382.508 2.789 0 50 GFAA COc1cc(NC(=O)c2c(Br)cnn2C)c(C(C)=O)cc1OC 2761336 GJETWMUJECAHHW-UHFFFAOYSA-N 382.214 2.655 0 50 GFAA CC1(C)CC(NC(=O)c2cc3ncc(Br)cn3n2)CC(C)(C)N1 2789606 JADDOQDJNSZEAF-UHFFFAOYSA-N 380.290 2.531 0 50 GFAA Cc1nn(C)c2nc(-c3ccncc3)nc(NCc3noc(CC(C)C)n3)c12 72426726 ZHBAQXKUZWZNLU-UHFFFAOYSA-N 378.440 2.927 0 50 GFAA CCCc1cc(CN(C)C(=O)[C@@H]2CCCN(C3CCN(C(C)C)CC3)C2)n[nH]1 71761079 ZUPSHFFVLQZLTI-GOSISDBHSA-N 389.588 2.905 0 50 GFAA Cc1ccc(NC(=O)NCCNc2cc(N3CCOCC3)ncn2)c(Cl)c1 72115673 JXZNYEJHDBXJFD-UHFFFAOYSA-N 390.875 2.509 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CCOCC(F)(F)C1 365746293 JFVMFSKTAHGZRH-VIFPVBQESA-N 384.349 2.800 0 50 GFAA COc1cc(C(=O)N[C@H]2CC(C)(C)c3ccccc32)sc1S(N)(=O)=O 158219021 LDCVLQTVNJZQOY-LBPRGKRZSA-N 380.491 2.557 0 50 GFAA O=C(O)c1cc2ncc(-c3cc(NCc4cccnc4)nc4[nH]ccc34)cn2n1 72418746 NOFYGXHTQDTAAK-UHFFFAOYSA-N 385.387 2.978 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)Nc1cn(C)nc1-c1ccccn1 370585297 XOMXSOHRRRLEFY-UHFFFAOYSA-N 379.449 2.900 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](N3CCc4ccccc4C3)C2)c1 72161550 BZEPUBPLDSNMKA-FQEVSTJZSA-N 398.528 2.753 0 50 GFAA Cc1cc2cc(C(=O)NCCCN3CCN(c4ncccn4)CC3)oc2cc1C 173296658 DNLKMZFZNDKSEN-UHFFFAOYSA-N 393.491 2.782 0 50 GFAA CNCCN1C(=O)CC[C@H]2CN(Cc3cc(F)ccc3C(F)(F)F)CC[C@H]21 72424765 QHYUXJPBIAUFIA-SUMWQHHRSA-N 387.421 2.877 0 50 GFAA CS(=O)(=O)NCCc1ccc(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1 239352459 ACGFHOWQZGOSMU-YTQUADARSA-N 378.538 2.867 0 50 GFAA COc1cc(NC(=O)CN(C)Cc2c(C)nn(C)c2C)c(OC)cc1Cl 17077880 PADKTZGPYDEYNS-UHFFFAOYSA-N 380.876 2.778 0 50 GFAA Cc1ccc(-n2cc(NC(=O)N3CCCC[C@H]3CS(C)(=O)=O)cn2)c(C)c1 455250478 JXMWPEFSZUZANZ-KRWDZBQOSA-N 390.509 2.920 0 50 GFAA Cc1nc2n(n1)CCC[C@@H]2NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 177716986 CLXBWKGUZHWQHB-INIZCTEOSA-N 385.468 2.967 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)N2CCC(n3cnnc3)CC2)n1 426519252 MCAXEZDXBVMQDD-UHFFFAOYSA-N 380.452 2.823 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)CSc3ccccc3)C2)CCC1=O 91663795 LWUPLLWJNKUBDN-HXUWFJFHSA-N 376.522 2.656 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CC[C@@H](N3CCCC3)C2)c(Cl)cc1Cl 238199015 TVUWNJPQTAJUMP-SNVBAGLBSA-N 393.292 2.550 0 50 GFAA COCC(=O)N1CCCN(C(=O)NC(c2ccccc2)c2ccccc2)CC1 426479785 TUGQXHBEVFBNMN-UHFFFAOYSA-N 381.476 2.666 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)cc1O 95389419 VKHXJLIMQSGHGE-MAUKXSAKSA-N 380.444 2.778 0 50 GFAA CN1C[C@H](C(=O)N2CCC(c3nccn3CC3CC3)CC2)Oc2ccccc21 95530746 AMUJOKVRJWIWKG-HXUWFJFHSA-N 380.492 2.897 0 50 GFAA O=C1N(CCO)CCC[C@]12CCN(c1nc(-c3ccc(F)cc3)cs1)C2 92022796 CJZBBKXDSGKDEH-LJQANCHMSA-N 375.469 2.760 0 50 GFAA O=C(Nc1cccc(-n2cnnc2)c1)N1CCC[C@H](OCc2ccccn2)C1 97743045 YZOKZBDSGACDNK-IBGZPJMESA-N 378.436 2.875 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)c1ccc(=O)n(C)c1 95517538 KZKPKIKUHXXREH-GOSISDBHSA-N 385.483 2.551 0 50 GFAA Cc1cc(C(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)c2ccc(F)cc2n1 97831209 TVPYFGYPMTUTFX-HXUWFJFHSA-N 377.419 2.866 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)Cn3cnc4ccsc4c3=O)C2)c1 95367453 NGSIYCYTNNKHER-OAHLLOKOSA-N 397.456 2.562 0 50 GFAA O=C(Nc1nc2ccccn2n1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 184323290 BPDSLIFZGVBUQW-GFCCVEGCSA-N 388.378 2.731 0 50 GFAA CN(Cc1cc(C2CC2)on1)C(=O)NCc1nncn1CCc1ccccc1 534654996 NXMIFLLUOATZAM-UHFFFAOYSA-N 380.452 2.728 0 50 GFAA Cc1nc(-c2ccc(S(=O)(=O)NCc3noc(C4CC4)n3)s2)cs1 535709736 UJRKOFVWEXEIJK-UHFFFAOYSA-N 382.492 2.919 0 50 GFAA CCCC(=O)Nc1cccc(NC(=O)N2CCC(O)(CN3CCCC3)CC2)c1 299789881 AHEXYPCKJFLLGP-UHFFFAOYSA-N 388.512 2.880 0 50 GFAA O=C(NC[C@@H](c1ccccn1)N1CCOCC1)c1c[nH]nc1C1CCCCC1 828138365 DLJNBCRYVDFPRC-IBGZPJMESA-N 383.496 2.656 0 50 GFAA Cc1ccc(NC(=O)CCNC(=O)CN2CCOc3ccccc3C2)c(C)c1 827836761 DHMFZNGEPVLFQX-UHFFFAOYSA-N 381.476 2.643 0 50 GFAA CS(=O)(=O)CCC(=O)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1 827913511 RBWOQBGPOBPSGA-UHFFFAOYSA-N 379.400 2.510 0 50 GFAA Cc1ccccc1NC(=O)CCN1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 1565529524 LWGLXXOLULMMIO-MJGOQNOKSA-N 382.460 2.903 0 50 GFAA COC[C@H]1[C@@H](NS(=O)(=O)c2ccc(Cl)c(C)c2Cl)[C@H]2CCO[C@H]21 1565526079 JEQCWKIAXMBGNQ-KTJYFRGRSA-N 380.293 2.630 0 50 GFAA C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(N(C)CC(=O)O)CC1 186625412 ICRQGULBDPEYIG-HNNXBMFYSA-N 376.497 2.759 0 50 GFAA O=C(NC[C@H]1CCCN(c2nc3ccccc3s2)C1)c1cc2ncccn2n1 1506401066 ZMAYXQZPQACAMX-CQSZACIVSA-N 392.488 2.985 0 50 GFAA Cc1noc([C@H](C)N(C)S(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n1 1506419333 AJJXWRLIAGMHNW-VIFPVBQESA-N 381.483 2.828 0 50 GFAA CN1CCN(CC2CCN([C@@H](C(=O)O)c3cc4ccccc4s3)CC2)CC1 1529099228 USMDPHVCDMRSCZ-HXUWFJFHSA-N 387.549 2.986 0 50 GFAA Cc1[nH]nc(CCC(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)c1C 1704300656 TYJMCTDRRKSXBG-UTKZUKDTSA-N 378.476 2.569 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)CC2)c(C)o1 1772706006 UQGANKQJJVVREJ-GOSISDBHSA-N 395.459 2.697 0 50 GFAA COc1cccc(CN2C[C@H]3CN(C(=O)Nc4ccccc4C)C[C@]3(CO)C2)c1 1772816573 VTXKEJKZFYDPOF-CVDCTZTESA-N 395.503 2.962 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCCN(C(=O)[C@@H](C)Oc3ccccc3)CC2)n1 1772809690 CLVJXDZUHMXRBG-MRXNPFEDSA-N 383.448 2.594 0 50 GFAA CCCC[C@H]1CN(CCNC(=O)c2cnn3cccnc23)Cc2ccccc2O1 11783647 GRYSOFUAWHVXFQ-SFHVURJKSA-N 393.491 2.913 0 50 GFAA COc1ccc(CCc2nnc(CCC(=O)NCCCOC(C)C)o2)cc1 12072589 QZWXEVDSPZYCHW-UHFFFAOYSA-N 375.469 2.727 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)N1CCC[C@@H](Nc2ccc(F)cc2)C1 12594486 OQFQMCCPTNFYDS-QGZVFWFLSA-N 382.439 2.962 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(C)[C@H](C)c2ccncn2)n[nH]1 15064262 XZSOXVASQSYFCS-CYBMUJFWSA-N 375.436 2.739 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc4c(s3)CCCC4)C[C@@H]2CCO)o1 19218785 USUOBKNVSFJLFV-INIZCTEOSA-N 375.538 2.992 0 50 GFAA C/C=C/CCCC(=O)N1CCC[C@]2(C1)CN(c1ncc(F)cn1)CC[C@H]2O 1857694071 ZMWURECYAVCCDA-YBNRNPCLSA-N 376.476 2.542 0 50 GFAA COc1ccccc1-c1ccc(C(=O)N2CC[C@@]34OCCCN3C(=O)C[C@@H]24)cc1 1857719430 MXHBXQANFHGDFF-OFNKIYASSA-N 392.455 2.926 0 50 GFAA Cc1ncnc(C)c1C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857721094 YRRGJAMLDFJKIX-OKZBNKHCSA-N 386.883 2.691 0 50 GFAA CC[C@@]1(C(=O)N2CCC(F)CC2)C[C@@H]2CC[C@H]1N2Cc1nccn1CCOC 1857735359 AGZKXDILJFPDIL-WAOWUJCRSA-N 392.519 2.623 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCn2ccnc2-c2cccc3ccnn23)cc1 1857739075 CECNFQNFUBNXRI-UHFFFAOYSA-N 395.488 2.875 0 50 GFAA CC1(C)CN(S(=O)(=O)c2cnc[nH]2)C[C@H](c2cccc(C(F)(F)F)c2)O1 432280867 AOOXYRIABYVDHS-CYBMUJFWSA-N 389.399 2.969 0 50 GFAA O=C(NC1CC1)c1cccc(OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c1 462680141 JGPVQOMBQRUHQU-HXUWFJFHSA-N 398.434 2.697 0 50 GFAA O[C@@H](COc1ccc(-c2ccccc2)cc1)CN1CCOC2(CCOCC2)C1 135636400 DWNIXLIRYYCVPM-OAQYLSRUSA-N 383.488 2.975 0 50 GFAA O=C(NC[C@@H]1C[C@@H](CO)CO1)[C@]1(Cc2ccccc2)CCc2ccccc2C1 1875299622 QAFDZURJQMMOTC-APTRMMRNSA-N 379.500 2.918 0 50 GFAA C[C@@H](O)c1cn(Cc2ccc(C(=O)N[C@H](Cc3ccccc3)C3CC3)o2)nn1 1875317593 DTKKENSILILUKG-RDTXWAMCSA-N 380.448 2.724 0 50 GFAA O=C(NCC12CCC(CC1)NC2=O)c1ccn(-c2ccccc2C(F)(F)F)n1 1875312815 BMVLPJGUQGTEHV-UHFFFAOYSA-N 392.381 2.680 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)c2ccn(-c3cc(F)cc(F)c3)n2)cc1 1875328229 HAVFZYVNBYZGBD-UHFFFAOYSA-N 377.372 2.578 0 50 GFAA O=S(=O)(c1ccc(F)cc1)c1nc(-c2ccco2)oc1N1CCOCC1 4785362 ATIHPLXFSLYOFH-UHFFFAOYSA-N 378.381 2.743 0 50 GFAA COc1ccc(Cc2nc([C@H]3CC[C@@H](N)CC3)n(-c3ccnn3C)n2)cc1OC 2100543526 UBCHDZZFZLTROC-IYBDPMFKSA-N 396.495 2.594 0 50 GFAA COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1ccc([C@H]2CCCC(=O)N2)cc1 2325780613 AUNUMYCGFDWJLX-RTBURBONSA-N 381.428 2.969 0 50 GFAA CCc1onc(C)c1CN1C[C@@H](NC(=O)c2cc3cccn3cn2)C(C)(C)C1 2325793591 AETJHAVAPMNQSZ-LJQANCHMSA-N 381.480 2.834 0 50 GFAA COc1cccc([C@@H](C)CC(=O)N2CCN(c3ccc(C(=O)O)cn3)CC2)c1 911171764 KZCYVNAQHNGBCH-HNNXBMFYSA-N 383.448 2.631 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@H]1CCCN1C1CCOCC1 245666445 BJQDXBQYWUPSBC-AUUYWEPGSA-N 395.906 2.817 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(C)cc2C)S(C)(=O)=O)c(OC)c1 647747 GHAOGLUULINCNZ-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(C3C4CC5CC(C4)CC3C5)CC2)cc1 860157 TYSAYJUMHQYUDB-UHFFFAOYSA-N 390.549 2.826 0 50 GFAA C[C@H]1CN(C(=O)c2ccc(-c3cncc(N)n3)cc2)CCN1c1ccc(F)cn1 2356144858 PEKMFSHYXHELPY-AWEZNQCLSA-N 392.438 2.611 0 50 GFAA COc1ccccc1C(=O)Nc1ccc(-c2nnc(SCC(=O)O)n2C)cc1 4327882 RXZSZCZZJMVJDB-UHFFFAOYSA-N 398.444 2.920 0 50 GFAA COc1ccc([C@@H]2N(C(C)=O)CCCN2S(=O)(=O)c2ccc(C)cc2)cc1 4778665 IGLAAPAYJOHPDN-HXUWFJFHSA-N 388.489 2.945 0 50 GFAA O=C(O)Cn1cc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)c2ccccc21 4845643 DBMSDVRICLWZII-RQZCQDPDSA-N 393.374 2.958 0 50 GFAA COC(=O)c1ccc(NC(=O)Nc2c(C)n(-c3ccccc3)c(=O)n2C)cc1 4858208 UUJQWILIGPMSAA-UHFFFAOYSA-N 380.404 2.915 0 50 GFAA CCN(CC1CCOCC1)C(=O)Nc1cc(C(=O)NC2CC2)ccc1OC 102534612 CMEQUYNQJYVAFK-UHFFFAOYSA-N 375.469 2.868 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CC[C@H](N(C)C)C1 23158564 QBCMJADMQMACOA-IBGZPJMESA-N 391.519 2.742 0 50 GFAA O=C(Nc1nccs1)c1cccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 101419039 DWVDQHLNFXGIOB-AZHAFVHUSA-N 383.429 2.857 0 50 GFAA Cn1c(-c2cc3n(n2)CCCN(C(=O)CCCCCN)C3)nc2ccccc21 65430083 LENDGOQXUZAFLC-UHFFFAOYSA-N 380.496 2.688 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC(CO)(CCOc3ccccc3)CC2)nn1 67966101 CPBWVWVPSYMOAS-UHFFFAOYSA-N 393.491 2.925 0 50 GFAA O=C(c1cc(COc2cccc(F)c2)[nH]n1)N1CCN[C@H](c2ccccc2)C1 67603601 UMDWDLUCKMPYGU-FQEVSTJZSA-N 380.423 2.915 0 50 GFAA O=C([C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccn1)N1CCC(n2ccnc2)CC1 252512735 VECUVATUDUFWTH-UHOSZYNNSA-N 380.496 2.674 0 50 GFAA O=C(CCC(=O)N1CCC(c2ccccc2)=N1)Nc1nc2c(s1)COCC2 171019602 FTKCFHVPNWVOFR-UHFFFAOYSA-N 384.461 2.571 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)N(C)Cc1cccnc1Cl 72417945 PNYDDUWNIOZTLC-QGZVFWFLSA-N 378.948 2.890 0 50 GFAA Cc1cccc(CN2CCN(Cc3ccc(-n4cccn4)cc3)C[C@H]2CCO)n1 36385663 ZXIUAOQLCBGGPM-HSZRJFAPSA-N 391.519 2.645 0 50 GFAA COc1ccc(S(=O)(=O)N2CCO[C@@H]3CCCC[C@H]32)cc1Br 230059614 VXWYQHUUQIJULQ-UKRRQHHQSA-N 390.299 2.790 0 50 GFAA COc1cc(C(=O)N[C@H](c2ccccc2C)C(C)C)sc1S(N)(=O)=O 151428380 ZMKVHLJOUZERKI-HNNXBMFYSA-N 382.507 2.840 0 50 GFAA CN(c1cccnn1)C1CCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)CC1 152932614 ASKNNQVRYMSQGS-KRWDZBQOSA-N 394.441 3.000 0 50 GFAA Cn1cc([C@@H](NC(=O)N2CC(O)(c3ccc(F)cc3)C2)c2ccccc2)cn1 365791001 AWDRAXFXLDFCKR-IBGZPJMESA-N 380.423 2.562 0 50 GFAA Cc1nc(C(C)C)cc(N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)n1 71750126 IBUWBXUWCQQWLI-KRWDZBQOSA-N 385.556 2.868 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NC[C@H]3CC=CCC3)cc12 14536676 YFDFUWKITVMKBP-ZDUSSCGKSA-N 386.452 2.713 0 50 GFAA CN1C(=O)[C@](CCC(=O)NC(C)(C)CO)(Cc2ccccc2)c2ccccc21 71762303 HTLUWQCGUUVLON-HSZRJFAPSA-N 380.488 2.811 0 50 GFAA Cc1ncc(C(=O)N2CCCN(Cc3noc(C4CC4)n3)CC2)c(C(C)C)n1 172330744 XLQHWJUUBOJHLF-UHFFFAOYSA-N 384.484 2.517 0 50 GFAA Cc1ccncc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 72145935 UJRPAMFIGYHLAM-AWEZNQCLSA-N 377.366 2.940 0 50 GFAA COc1cc(SC)c(OC)cc1CN1CCC(N2CCC[C@H](O)C2)CC1 72431115 JRHRMQCCHVRKEJ-KRWDZBQOSA-N 380.554 2.847 0 50 GFAA C[C@H](C(=O)NC1CCN(Cc2ccccc2)CC1)N(C)C[C@@H]1CCCC[C@H]1O 241588045 OZERHNRGFYBTHG-KAGYGMCKSA-N 387.568 2.639 0 50 GFAA NC(=O)C1CCN(c2ccc(-c3nc(CCc4ccccc4)no3)cn2)CC1 19837240 GVXUDNQOYMHGQL-UHFFFAOYSA-N 377.448 2.619 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H](C)n3ccnc3C)n1)CCN(C(=O)C1CC1)C2 20295515 GWVBSMMITUXUOL-ZDUSSCGKSA-N 392.463 2.849 0 50 GFAA O=C1CCCN1CC[C@@H]1CCCCN1C(=O)c1ccccc1N1CCOCC1 82139205 XNDQWHDDHFIYED-SFHVURJKSA-N 385.508 2.530 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCO[C@H](Cn2cccn2)C1 221371012 QOJSXNZGUNHYBZ-SFHVURJKSA-N 380.448 2.707 0 50 GFAA Cc1ccc(NC(=O)N[C@@H]2C=CS(=O)(=O)C2)cc1NC(=O)C1CCCC1 97655361 FWUTWURSVNOPAU-OAHLLOKOSA-N 377.466 2.556 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@H](CNC(=O)c3ccc4c(c3)OCO4)C2)[nH]1 95508717 WOZRJIIMBCYXFM-CQSZACIVSA-N 383.448 2.588 0 50 GFAA Cc1ncncc1C(=O)N1CCC(Oc2ccccc2C(=O)N2CCCC2)CC1 95502417 QBJQOCDABOOHFR-UHFFFAOYSA-N 394.475 2.705 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCc3sc(Cl)cc32)cs1 292125751 PDJDKTYTYAGTJY-VIFPVBQESA-N 376.912 2.918 0 50 GFAA CN(Cc1noc(-c2ccccc2)n1)C(=O)[C@@H]1CC(=O)Nc2ccc(F)cc21 91289358 VTCGJMOJDUIRLR-OAHLLOKOSA-N 380.379 2.960 0 50 GFAA CCOc1cc(Cl)c(CN2C[C@@H]3CN(C)C[C@]3(C(=O)O)C2)cc1OCC 96152187 CGVYUOATFSXIIE-LIRRHRJNSA-N 382.888 2.586 0 50 GFAA CN1CCC(N2CCC3(CC2)CC(=O)N(Cc2cc(F)cc(F)c2)C3)CC1 91665553 YVOXIZOEGDTMRW-UHFFFAOYSA-N 377.479 2.874 0 50 GFAA COc1ccc(NC(=O)NC2CCN(C(=O)N3CCCC3)CC2)c(OC)c1 97743036 VRWBWCDGYSBUGQ-UHFFFAOYSA-N 376.457 2.506 0 50 GFAA CN1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 95502212 ROGIQFKMJXPLSA-JOCHJYFZSA-N 391.515 2.986 0 50 GFAA CCCn1ncc(CN2C[C@@H]3c4ccc(OC)cc4OC[C@]3(C(=O)O)C2)c1C 95500324 HTOCCFZHSNUQKN-WIYYLYMNSA-N 385.464 2.673 0 50 GFAA O=C(c1ccc(Cl)cc1)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@@H]2C=Cc3ccccc3N21 247798910 DVIXXRORQNKBTF-FJIDUMEYSA-N 378.815 2.696 0 50 GFAA CN(C)c1ccnc(-c2ccc(C(=O)N[C@H](c3nccn3C)C3CC3)cc2)n1 534666256 COWANFRGSJBXTA-SFHVURJKSA-N 376.464 2.824 0 50 GFAA O=C(O)[C@@H]1CCCN1C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 299746281 WIPJXFYFGXUTSK-ZDUSSCGKSA-N 386.408 2.824 0 50 GFAA NC(=O)[C@H]1CC[C@H]2OCCN(C(=O)Cc3ccc(-c4ccccc4)cc3)[C@@H]2C1 1940195694 ZMNVIGKBDXZFDY-PWRODBHTSA-N 378.472 2.778 0 50 GFAA Cc1nn(CC(N)=O)c(C)c1-c1cccc(C(=O)N2CCc3ccccc3C2)c1 299802387 ZBRZRBDDTYLWJH-UHFFFAOYSA-N 388.471 2.851 0 50 GFAA Cc1csc(CN2CCC(CNC(=O)c3ccccc3-n3cncn3)CC2)n1 825258219 CSHJEECWPCGGGR-UHFFFAOYSA-N 396.520 2.674 0 50 GFAA CCCN1C[C@@H](NC(=O)c2ccccc2N(C)C(=O)c2cccs2)CC1=O 822919217 SXHYSOLRJUVNHI-AWEZNQCLSA-N 385.489 2.765 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC[C@H](CNC(=O)c2cc(C)on2)C1 823560252 FYJARWCOKPNJOI-CYBMUJFWSA-N 379.892 2.574 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)c1ccc(N3CCN(C)CC3)cc1)OCCO2 952861066 BYOHENVOPLIHJA-UHFFFAOYSA-N 395.459 2.665 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)Cn2ccc(=O)c3ccccc32)cc1C 952977117 OTGKDLIZKQOYNB-UHFFFAOYSA-N 379.416 2.534 0 50 GFAA O=C1O[C@H]2CN(Cc3ccc4ccccc4c3)C[C@H]2N1CCCN1CCOCC1 1565526274 RUCXKEVZLNYBIT-YADHBBJMSA-N 395.503 2.567 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2ccccc2CS(=O)(=O)c2ccccc2)C1 269265207 KJUUJYQYCMBTSP-IAGOWNOFSA-N 386.517 2.860 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc1 277210613 YYLQCWODTFWAOV-LJQANCHMSA-N 383.492 2.542 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)C(=O)CN1C[C@@H](c2ccccc2)CC1=O 1506404095 VGZWXCRRJIVWRG-FQEVSTJZSA-N 388.471 2.847 0 50 GFAA Nc1nc(CN2C[C@H](O)[C@H](Cc3ccncc3)C2)nc2sc3c(c12)CCCC3 1704299266 PVJGNTLXXXXOSM-ZBFHGGJFSA-N 395.532 2.583 0 50 GFAA Cc1cnccc1-n1nc(-c2ccccc2)nc1[C@@H]1CCCN(C(=O)CO)CC1 1772804173 IHKIWMTVUPRXCW-GOSISDBHSA-N 391.475 2.726 0 50 GFAA Cc1ccsc1CN1CCC(N2CCC(C(=O)N3CCOCC3)CC2)CC1 11813495 TVNQOAHPNAZJAI-UHFFFAOYSA-N 391.581 2.592 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)/C=C/c3c[nH]cn3)C2)cc1OC 11820274 KYMVZISEWJBRNJ-QRBZPYHOSA-N 398.507 2.606 0 50 GFAA CCOC(=O)[C@@]1(Cc2cccc(OC)c2)CCCN(C(=O)CCc2cn[nH]c2)C1 11933652 WJDIIBPEHZDZFA-JOCHJYFZSA-N 399.491 2.766 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N(C)Cc3c(C)nn(C)c3C)n[nH]2)c1 11936241 YVRMTGWFLRSTTI-UHFFFAOYSA-N 395.463 2.814 0 50 GFAA CCOC(=O)c1nn(CC2CC2)c2c1CN(Cc1ccc(NC(C)=O)cc1)CC2 14537889 JGAGZKGCTVLWNU-UHFFFAOYSA-N 396.491 2.987 0 50 GFAA COc1ccccc1CN1C[C@@H]2C[C@@H](c3cn(C)nc3C)N3CCC[C@@]23C1=O 14960175 HFVCTXWECNVTPA-JLMWRMLUSA-N 380.492 2.675 0 50 GFAA CSc1nnc(CN(C)Cc2ccc(NC(C)=O)cc2)n1C[C@@H]1CCCO1 14975911 JMALLEDYSVOZGH-KRWDZBQOSA-N 389.525 2.769 0 50 GFAA CCc1nnc(NC(=O)CSc2nc(-c3ccc(OC)cc3)n[nH]2)s1 17029311 BWDOCQXKSOBRJV-UHFFFAOYSA-N 376.467 2.625 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2cccn2)C[C@@H]1O)c1ccc(F)c(COCC2CC2)c1 1857532754 QNVFKPHGGPCYFP-XPGWFJOJSA-N 387.455 2.518 0 50 GFAA N=c1nc(N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)c2c([nH]1)CCC2 1857668113 CNOPEOGPWRVWTQ-VQIMIIECSA-N 380.492 2.629 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCCc3ccncc3)sc12 1857686623 DZEXHGSJCGEIFZ-UHFFFAOYSA-N 385.533 2.999 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCC3CCOCC3)cc12 1857689818 LYEXSPPCWUDJPN-UHFFFAOYSA-N 378.538 2.788 0 50 GFAA COc1ccc(N2CCN(c3nccc(-c4ccc(C)nc4C)n3)CC2)cn1 1857691688 WOFGYPCIYGGDPQ-UHFFFAOYSA-N 376.464 2.886 0 50 GFAA O=C1C[C@H]2N(Cc3ccc4c(c3)OCO4)CC[C@]23OC[C@@H](c2ccccc2)N13 1857728968 HOBALIYBQUULGS-WEYGHZABSA-N 378.428 2.690 0 50 GFAA COc1c(Br)cccc1CN[C@H]1CCN(CC(F)(F)F)C1=O 237296239 VUWFVAKZENIDJE-NSHDSACASA-N 381.192 2.711 0 50 GFAA O=C(O)c1cccc(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)c1 261729357 HBDRALWWDGWYDV-UHFFFAOYSA-N 380.444 2.738 0 50 GFAA COC(=O)Cc1c(C(=O)N2CCC3(CCCN(C)C3)CC2)[nH]c2ccccc12 1875330514 RNCXSFSBBQWWTD-UHFFFAOYSA-N 383.492 2.831 0 50 GFAA CC(C)(C)c1cc(CN2C(=O)CC[C@H](n3cc4c(O)cccc4n3)C2=O)no1 1875358683 FLRKUXMOKLTPSF-HNNXBMFYSA-N 382.420 2.918 0 50 GFAA COc1ccc2[nH]c(CC(=O)N3CCn4cc(C(F)(F)F)nc4C3)cc2c1 1875321994 FAKHYEJPWSIPDA-UHFFFAOYSA-N 378.354 2.977 0 50 GFAA O=C(N[C@H]1c2ccccc2CC[C@H]1N1CCCC1)c1cnc2sccn2c1=O 892266240 DSJJDRZGPKNLTB-MSOLQXFVSA-N 394.500 2.638 0 50 GFAA CC(C)c1ocnc1C(=O)N(C)CC[C@H](NC(=O)[C@@H]1CCCCO1)C(C)C 1775997218 YDSNNSNKGKVZCS-HOTGVXAUSA-N 379.501 2.970 0 50 GFAA COc1ccc(N2CCC[C@H](NC(=O)[C@@H](C)n3ccc(C4CC4)n3)C2=O)cc1 2325791088 RBSBVHUAYDMACT-KUHUBIRLSA-N 382.464 2.642 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)NC[C@H](O)c3cc(F)c(F)c(F)c3)c2n1 856400342 VESHUKYWOORQPP-AWEZNQCLSA-N 378.354 2.535 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1)[C@H]1CCCO1 1054151 PTUYNCICYHCMET-LJQANCHMSA-N 386.473 2.551 0 50 GFAA O=C(N[C@]1(C(F)(F)F)NC(=O)N(c2ccccc2F)C1=O)C1CCCCC1 4858578 FGPFGJGWMKJMCW-INIZCTEOSA-N 387.333 2.837 0 50 GFAA O=C(Nc1cc(N2CCNC2=O)ccc1F)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 410782007 FOPDINMJXBJYCJ-YIYPIFLZSA-N 387.333 2.650 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1)N1CCCC[C@@H]1CCc1ccc(O)cc1 55414782 KGERZEQZZJOHNL-GOSISDBHSA-N 377.448 2.995 0 50 GFAA Cc1nc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)[nH]c(=O)c1CCC(C)C 9330007 CTDOGRHQIGHCHF-UHFFFAOYSA-N 398.507 2.718 0 50 GFAA O=C(Nc1ccccc1)N1CCC(n2ccnc2-c2cc3n(n2)CCNC3)CC1 72480889 WFPQYDIHXOOITL-UHFFFAOYSA-N 391.479 2.719 0 50 GFAA O=C1N[C@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccncc1 67773443 GUOKMDODIZTSKC-JOCHJYFZSA-N 378.476 2.505 0 50 GFAA Cc1ccc(CNC(=O)N2CCOC3(CCC3)C2)c(-n2cc(Cl)cn2)n1 252571662 YGROGYAEDAGMGM-UHFFFAOYSA-N 375.860 2.694 0 50 GFAA Cc1ccc(-n2c(-c3ccccc3)c(C)n3c4c(=O)n(C)c(=O)n(C)c4nc23)cc1 1430537 VLJJCKWBWHQART-UHFFFAOYSA-N 399.454 2.959 0 50 GFAA COc1ccc(CNCc2ccsc2)c(OC[C@H](O)CN2CCCC2)c1 12195994 ITNOXOQDYAZKJQ-GOSISDBHSA-N 376.522 2.882 0 50 GFAA O=C(CN1CC[C@@H]2CCOC(=O)[C@H]21)Nc1ccccc1C(=O)Nc1ccccc1 230190870 PZCMPPNSIRKJQT-QRWLVFNGSA-N 393.443 2.515 0 50 GFAA O=S(=O)(c1cc(Cl)cc2c1OCC2)N1C[C@H](c2ccsc2)[C@@H](CO)C1 328615721 YXHARBWHWOJXQX-UKRRQHHQSA-N 399.921 2.733 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 262448047 VXGLIGHAQZCKTI-KRWDZBQOSA-N 399.834 2.521 0 50 GFAA C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCN(C2CCOCC2)C1=O 331502651 BGWVZCYKNLAFJO-GUYCJALGSA-N 398.425 2.780 0 50 GFAA Cc1ccc(Nc2ccc(N3CCN(C(=O)Cc4ccccc4)CC3)nn2)nc1 72433992 LCRBBDXUAQHYOJ-UHFFFAOYSA-N 388.475 2.815 0 50 GFAA CN(Cc1nnc[nH]1)C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 172618275 MSBOEVOLXZKNRG-GFCCVEGCSA-N 396.278 2.622 0 50 GFAA COCc1nc([C@@H]2COCCN2C(=O)c2csc(-c3ccccc3)n2)no1 378596609 JLFSSQSCNHJARN-AWEZNQCLSA-N 386.433 2.553 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(c3ncccc3C(=O)O)C2)cc1OC 72480345 BWAGFRUBFVOJEP-KRWDZBQOSA-N 399.491 2.940 0 50 GFAA Cc1nc(NCC(=O)N2CCC(Cc3ccccc3)CC2)c2cnn(C)c2n1 175162389 KZHNAEFSDOGTMF-UHFFFAOYSA-N 378.480 2.565 0 50 GFAA COc1cccc(CNC(=O)N2CCN(Cc3cccc(C)c3)C(=O)[C@H]2C)c1 426707150 GEBFMIOOIKWGEV-QGZVFWFLSA-N 381.476 2.946 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@@H](C)CN(C)C)csc3C2)nc1 426582718 BSJLGDSSSQKZAB-HNNXBMFYSA-N 386.565 2.944 0 50 GFAA COc1cccc(N2CCN(CC(=O)N[C@@H](C)c3ccc(C)cc3)CC2=O)c1 91845450 DZEOADWCIGPQTG-KRWDZBQOSA-N 381.476 2.530 0 50 GFAA Nc1cc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)ccn1 95373337 PMZWHVZCXRCXHW-UHFFFAOYSA-N 392.503 2.751 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(O)(c3cccnc3)CC2)cc1Cl 95383785 PTKYCRXYQNLBMX-QGZVFWFLSA-N 376.840 2.853 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91807759 QEDWLNXBGGPBDO-JOCHJYFZSA-N 380.492 2.806 0 50 GFAA O=C(NCc1cccc(F)c1)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 247728605 FVRBVTDNYZSZKG-QAQDUYKDSA-N 383.423 2.875 0 50 GFAA COc1ccc(-n2cc(O)c(C(=O)N3CCC[C@@H](n4cc(C)cn4)C3)n2)cc1 180759329 CFPLLXNPYQRRSW-MRXNPFEDSA-N 381.436 2.569 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N[C@@H](c1ccccn1)[C@H]1C[C@@H](O)C1 244716144 LJFQIZQCJLEGND-BTJLNZGRSA-N 382.869 2.534 0 50 GFAA CC[C@H](Cc1cccc(Br)c1)C(=O)N1CCO[C@H](CC(=O)O)C1 299753725 ZDMILKFNYBDYTC-UKRRQHHQSA-N 384.270 2.720 0 50 GFAA Cc1cc(-c2cccc(C(=O)NCC3CCOCC3)c2)cnc1-n1cnnc1 534581130 JFAVDDDBASMLJO-UHFFFAOYSA-N 377.448 2.794 0 50 GFAA COc1ccc(-c2cc3c(=O)n(C[C@@H](O)c4cccc(OC)c4)ccn3n2)cc1 263616246 HTFQEIZXZYRFOQ-OAQYLSRUSA-N 391.427 2.914 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)Cc2ccc3c(c2)OCO3)C1)c1cccs1 827928410 SHNRXOULSBFHSC-OAHLLOKOSA-N 386.473 2.688 0 50 GFAA Cc1cccc(CN2CCN(C(=O)NC[C@@H](C)c3nc(C)cs3)CC2=O)c1 584885247 KUTMPMCUOLOMFD-OAHLLOKOSA-N 386.521 2.917 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(-c2nnn(C)n2)cc1 952981308 HLIUDBHCWDBZBK-UHFFFAOYSA-N 390.447 2.674 0 50 GFAA CN(Cc1ccco1)C(=O)CCn1cnc2ccc(Br)cc2c1=O 170635948 QCPYNJLUKUEEIA-UHFFFAOYSA-N 390.237 2.801 0 50 GFAA CC1CCN([C@@H](CNC(=O)Cn2c(=O)[nH]c3ccccc32)c2cccs2)CC1 195628455 RMKJAKCJGROXMB-SFHVURJKSA-N 398.532 2.981 0 50 GFAA O=C(Cc1cccnc1)NC[C@@H]1CCCN(Cc2cccc(-n3cccn3)c2)C1 1506423893 YNZJXPYKQKHZEA-NRFANRHFSA-N 389.503 2.838 0 50 GFAA COc1cccc(OCc2cc(C(=O)N[C@H](C)c3c(C)nn(C)c3C)n[nH]2)c1 11935061 CTYBYBPVXBIZDJ-GFCCVEGCSA-N 383.452 2.839 0 50 GFAA O=C(CSc1ccncc1)N[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1 12307737 CCLISLAVMOMHKL-CQSZACIVSA-N 375.881 2.744 0 50 GFAA COc1cccc(C(=O)N2CCN(c3nncc(-c4ccccc4)n3)CC2)c1 12429997 OQKFFNBXQPUSSH-UHFFFAOYSA-N 375.432 2.510 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)N1CCC[C@H](Nc2ccccc2)C1 12449259 IYJOWWOUZMKEMD-SFHVURJKSA-N 376.460 2.890 0 50 GFAA Cc1c([C@H](C)NC(=O)CCn2cnnn2)cnn1-c1cccc2ccccc12 12585198 PIYKMFSVJWVODS-AWEZNQCLSA-N 375.436 2.588 0 50 GFAA C[C@H](CCN1CCC(n2cc(C(=O)N3CCOCC3)nn2)CC1)c1ccccc1 14994849 BODZKKMCGPBGMS-GOSISDBHSA-N 397.523 2.581 0 50 GFAA COc1ccccc1NC(=O)CSc1nc(O)cc(=O)n1-c1ccc(C)cc1 16662141 GLQGCIUEYXZSTG-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)[C@H](C)CCc1ccccc1F)CCO2 1857527936 JBXAIXOSBUUATF-XQYQJIMDSA-N 396.528 2.884 0 50 GFAA O=C(CO)N[C@H]1CCC[C@@H](CNC(=O)c2cc(C(F)(F)F)ccc2Cl)C1 1857682485 QQCOHJIGJHAECX-PWSUYJOCSA-N 392.805 2.756 0 50 GFAA Cc1cc(CN2C(=O)C[C@H]3[C@@H]2CCN3C(=O)CCCCc2cccnc2)ccn1 1857686788 HTQQUBCNQZKSRS-SFTDATJTSA-N 392.503 2.900 0 50 GFAA Cc1nccnc1N1CCC(C2CCN(Cc3cccn(C)c3=O)CC2)CC1 1857710150 JUINSDMFIISDNP-UHFFFAOYSA-N 381.524 2.612 0 50 GFAA CN(CCc1ncon1)C(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857712773 SHPXACACSSRSLW-GFCCVEGCSA-N 389.843 2.782 0 50 GFAA COC(=O)c1cnc(C(=O)N2C[C@H](C(C)(C)C)O[C@H](c3ccccc3)C2)cn1 1857714427 ABAOKCGUCYRYME-ZWKOTPCHSA-N 383.448 2.892 0 50 GFAA Cc1cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccc(F)cc4)[C@H]4CC[C@]3(C2)O4)on1 1857715519 VPFVEDOXSUWXEQ-QEUVDIPISA-N 385.439 2.532 0 50 GFAA COc1cccc(F)c1CN1C[C@@H]2[C@H](CNC(=O)C3(C)CC3)[C@H]3CC[C@]2(C1)O3 1857723799 XKRMYGULLKKWND-LCFVAKEKSA-N 388.483 2.730 0 50 GFAA CC(C)(C)[C@H]1CN(c2cc(N3CCOCC3)[nH]c(=N)n2)C[C@@H](c2ccccc2)O1 1875248028 VHVCZHHKVVQWKE-ZWKOTPCHSA-N 397.523 2.718 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCC(N)CC3)cc2Br)no1 408519246 DVUQVZLTXZIGKT-UHFFFAOYSA-N 394.269 2.888 0 50 GFAA Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cc(-n2cccn2)ccn1 126283331 OKYXDFPNROEQQK-UHFFFAOYSA-N 377.448 2.660 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N(C)Cc2ccc(C(=O)O)cc2)cc1 237040322 DWRFTNUKFHFVIS-IBGZPJMESA-N 380.444 2.843 0 50 GFAA CCn1nc(C(=O)NCc2ccc(OC)cc2)c2c1CCN(C(=O)C(C)(C)C)C2 14542561 IDBLIOLNXWNAKN-UHFFFAOYSA-N 398.507 2.772 0 50 GFAA C[C@@]1(C2CCN(Cc3ccc(CN4CCCCC4)s3)CC2)NC(=O)NC1=O 23191578 DNSLEKPDKWDQJE-FQEVSTJZSA-N 390.553 2.544 0 50 GFAA CCC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C)c(Cl)cc2C)C[C@@H]1O 1704309163 NHNSMFWZZXRDHG-RDJZCZTQSA-N 389.901 2.583 0 50 GFAA C[C@@H]1CCNC(=O)[C@@H]1CN1CCC(=O)N(CCc2cc3ccccc3s2)C1=O 1875299043 WPYABGMXTGKGJQ-RHSMWYFYSA-N 399.516 2.870 0 50 GFAA Cc1ccn(CC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2cnc3ccsc3c2)n1 1875334013 UVMSSKLERIHMLJ-HZPDHXFCSA-N 397.504 2.659 0 50 GFAA CC(C)C[C@](C)(CNc1ncnn2cccc12)NC(=O)C[C@@H]1CC=CCN1C 1875327953 QUZTZFPEBDBFLI-LAUBAEHRSA-N 384.528 2.713 0 50 GFAA O=S(=O)(c1ccc(F)c2occc12)N1C[C@H](Cn2cnnc2)C2(CCC2)C1 1875404417 ICRVHUNKOMSEDU-ZDUSSCGKSA-N 390.440 2.654 0 50 GFAA Cc1ccc(CCC(=O)N2CCCCC[C@@H](NC(=O)c3ccnn3C)C2)s1 1775991144 HQEVUBAOSQGGMG-MRXNPFEDSA-N 388.537 2.924 0 50 GFAA CS(=O)(=O)c1ccc(F)c(OC[C@H]2CN(Cc3ccccc3)CCO2)c1 1775989828 SMIXQFXBWKPTCV-MRXNPFEDSA-N 379.453 2.509 0 50 GFAA CCn1c(N(C)[C@@H]2C[C@@H]3C[C@H](N(C)C)C[C@@H]3C2)nc2cc(C(=O)OC)cnc21 2100557000 LTXBGVMORYZREJ-MDBPOYHNSA-N 385.512 2.793 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@H](C(=O)OCc2ncn(-c3ccccc3)n2)CC1=O 2325731311 DPYUHLOLZPWEDS-FUHWJXTLSA-N 390.443 2.920 0 50 GFAA Cc1nc(-c2ccc(CNC(=O)N3CC4(CCCNC4=O)C3)s2)cs1 2325787316 SERPWKOUKUSJHB-UHFFFAOYSA-N 376.507 2.602 0 50 GFAA Cc1c(C(=O)N[C@]2(CF)CCNC2)sc2nc(Cc3ccccc3)nc(N)c12 2325795177 MBVSXSLLTUAKPY-FQEVSTJZSA-N 399.495 2.604 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSc1nnnn1C1CCCCC1 2421846 CJHKMXYUYCYVEF-UHFFFAOYSA-N 375.454 2.696 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3sc4[nH]cnc(=O)c4c3C)C1)CC2 2356153901 ZDKSEOZJWDGYDO-HXUWFJFHSA-N 395.488 2.512 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nnnn2-c2ccc(C)cc2)cc1 2890037 JESOOWQRFNXORM-UHFFFAOYSA-N 397.460 2.878 0 50 GFAA CC(C)CNC(=O)c1ccccc1NC(=O)c1ccccc1NS(C)(=O)=O 6213394 CVGWXURHMJJHBZ-UHFFFAOYSA-N 389.477 2.696 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cc1OC 245800360 ZEUKYTQWCHRUKZ-DZGCQCFKSA-N 399.495 2.906 0 50 GFAA Cc1n[nH]c(C)c1Cc1nnc(SCC(=O)O)n1-c1ccc(F)cc1F 67805612 QFZIUZZYBGBJLF-UHFFFAOYSA-N 379.392 2.653 0 50 GFAA Cc1cccn2c(NC(=O)N3C[C@@H](CO)OC[C@@H]3C)c(-c3ccccc3)nc12 119110035 UFLCKBYGIPAFPE-RDJZCZTQSA-N 380.448 2.923 0 50 GFAA CCCS(=O)(=O)CCN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1 328604825 LGEBRZSCUIMPCJ-YLJYHZDGSA-N 389.521 2.915 0 50 GFAA Cc1cc(C)c(NC(=O)c2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c(C)n1 65385915 ABAKFIAEPBSPHR-IBGZPJMESA-N 380.492 2.956 0 50 GFAA COCCN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CCOC1 470583011 MHDMQKHFXNRPQS-AWEZNQCLSA-N 394.269 2.717 0 50 GFAA COc1cc(NC(=O)c2ccc(N3CCNC3=O)cc2)cc(-n2cccn2)c1 471519935 AXRQCQCXFYFNGS-UHFFFAOYSA-N 377.404 2.663 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 2809388 DOLNZHMTHIGWGW-CABCVRRESA-N 390.484 2.795 0 50 GFAA O=C(O)[C@H]1CC2(CCNCC2)CN1C(=O)CSCc1ccccc1Cl 72159325 ZXVDXIJIYNCGCL-OAHLLOKOSA-N 382.913 2.629 0 50 GFAA O=C(Nc1cccc(Oc2ccccc2)c1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252536072 HOEKOBCQHGDROR-INIZCTEOSA-N 376.416 2.814 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)N1CCC(c2nc3ccccc3[nH]2)CC1 30819277 QZTJWYIYUJWNAS-UHFFFAOYSA-N 388.427 2.565 0 50 GFAA COCCS(=O)(=O)c1ccc(NC(=O)C(=O)c2ccc(Cl)s2)cc1 428723204 JNXYINQDBLRXOK-UHFFFAOYSA-N 387.866 2.643 0 50 GFAA CC(C)NC(=O)CCNC(=O)N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1 363113349 CTSBLUVYTZLJQK-QFIPXVFZSA-N 386.540 2.599 0 50 GFAA Cc1cc2n(n1)[C@@H](C(F)(F)F)CCN2C(=O)c1cccc(-n2cccn2)n1 485488189 IHGVSMJVLMQAAI-CYBMUJFWSA-N 376.342 2.926 0 50 GFAA Cn1ccnc1-c1csc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)n1 125710575 IGVYDJMJIMMURG-INIZCTEOSA-N 395.488 2.716 0 50 GFAA NC(=O)c1ccc(N2CCC(C(=O)Nc3ccc4ncccc4c3)CC2)nc1 374000747 HPEKQFHZZZFQGV-UHFFFAOYSA-N 375.432 2.584 0 50 GFAA Cc1ccc(NC(=O)N2C[C@H](C(F)(F)F)OC(C)(C)C2)cc1S(C)(=O)=O 455018940 FVHAKAHVMHMAOT-CYBMUJFWSA-N 394.415 2.972 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3CCOc4ccc(Cl)cc43)CC2)n1 172682777 ULQYVSCSNPNTNR-UHFFFAOYSA-N 388.855 2.781 0 50 GFAA O=C(CN1CC[C@@H](CN2CCCCC2)C1)Nc1ccccc1N1CCCC1=O 173882233 VFMSVKTVPZHUCD-SFHVURJKSA-N 384.524 2.560 0 50 GFAA CN(CC(=O)N1CCC[C@H](Cc2nc3ccccc3[nH]2)C1)Cc1ccncc1 82097923 FOUMVZNGOCULLD-GOSISDBHSA-N 377.492 2.871 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N1CCC(OC[C@H]2CCCCO2)CC1 175050069 KNRGJXSWRWEVQF-MRXNPFEDSA-N 389.452 2.839 0 50 GFAA OCC[C@@H]1CN(Cc2cccn2-c2ccccn2)CCN1Cc1ccccc1 20388297 FTUFDPAZTCYKCP-OAQYLSRUSA-N 376.504 2.941 0 50 GFAA O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)[C@@H]1CCCN(CC(F)(F)F)C1 177433083 MQSQVDCJPFAJJB-CHWSQXEVSA-N 390.837 2.704 0 50 GFAA CCCCCCc1ccc(NC(=O)N2C[C@H](O)[C@@H](N3CCOCC3)C2)cc1 97370563 YWPCEBWBTYEETQ-PMACEKPBSA-N 375.513 2.719 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95528964 GOBKMJSCUAGQHV-GOEBONIOSA-N 380.473 2.888 0 50 GFAA COc1cc2c(cc1OC)CN([C@H](C(=O)O)c1ccc3c(c1)OCCO3)CC2 95387918 SJZIAMIDNONNBX-FQEVSTJZSA-N 385.416 2.659 0 50 GFAA Nc1cc(=O)nc(SCC(=O)Nc2ccc(F)cc2)n1CCc1ccccc1 97962247 RMKXKJBQFWHNDW-UHFFFAOYSA-N 398.463 2.938 0 50 GFAA O=C(c1ccc(CSc2ncn[nH]2)o1)N1C[C@@H]2CC[C@H](C1)N(CC1CC1)C2 95524672 DJPRGBBSFSZGEM-HUUCEWRRSA-N 387.509 2.636 0 50 GFAA COc1ccc(CNC(=O)c2cc(C)ccc2N2CCCC2=O)cc1C(=O)O 299742261 AXBNKUPQESSPTK-UHFFFAOYSA-N 382.416 2.759 0 50 GFAA O=C(C[C@@H](Cn1cccc1)c1ccc(Cl)cc1)NC[C@@H]1CCS(=O)(=O)C1 263586961 AFHVIUQCIYXSAS-RDJZCZTQSA-N 394.924 2.866 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC[C@@H](c3cccnc3)N3CCOCC3)n[nH]2)cc1 825180625 OIPSEUBCOBYCKN-NRFANRHFSA-N 391.475 2.583 0 50 GFAA Cc1cc2ccccc2n1CCN(C)C(=O)NC1CCN(CCN(C)C)CC1 670438297 VSVGWBUQSGTKBC-UHFFFAOYSA-N 385.556 2.617 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2csc(-c3ccccc3)n2)C1 276643928 XVXGLKCFYFCEGW-OAHLLOKOSA-N 394.504 2.529 0 50 GFAA O=C(CN1CCc2cc(Cl)ccc2C1)N1CCC(C(=O)N2CCCC2)CC1 192240038 XEFFEMSJPUDYAE-UHFFFAOYSA-N 389.927 2.559 0 50 GFAA Cc1cc(O)nc(S[C@@H](C)C(=O)N2CCCN(Cc3cccs3)CC2)n1 1506403386 OIUXOWQLUVGVMX-AWEZNQCLSA-N 392.550 2.767 0 50 GFAA COc1ccc(-c2nccn2-c2ccc3c(c2)C(=O)NCC3)c(C(=O)O)c1OC 1772814337 TYKQHYBVULVPFH-UHFFFAOYSA-N 393.399 2.541 0 50 GFAA O=C(O)CC[C@]12CN(Cc3cccnc3)C[C@H]1CN(C1Cc3ccccc3C1)C2 1772711923 LPDJGMJCHVBEKG-XUZZJYLKSA-N 391.515 2.848 0 50 GFAA COc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2)c(OC)c1OC 12435605 YOXOIKPKFGIOPW-MRXNPFEDSA-N 385.464 2.502 0 50 GFAA CCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 12860228 DBVQDANUBZUVIW-CQSZACIVSA-N 383.423 2.957 0 50 GFAA COc1cc(CN2CCC(n3cc(C(=O)NC4CCCC4)nn3)CC2)ccc1O 14884468 VNSMZMWSUAWLLM-UHFFFAOYSA-N 399.495 2.502 0 50 GFAA COc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cccs4)ccn3n2)cc1 169775859 TZHDXDPVMZJOCC-UHFFFAOYSA-N 394.456 2.663 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CCCC(C)C)CC(=O)N2[C@H]1c1ccccc1 1857712326 IWNZBZGYHUGJIR-WFXMLNOXSA-N 386.492 2.786 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccncc3)C[C@]23CC[C@H]1O3)c1ccc(F)c(F)c1 1875249280 NXDILVPKAMNIJN-VXIWKAIFSA-N 385.414 2.774 0 50 GFAA C[C@H]1CN(C(=O)C(C)(C)CCC(=O)N2C[C@@H](C)OC(C)(C)C2)CC(C)(C)O1 408355206 QZOGXLUSRQICCQ-CVEARBPZSA-N 382.545 2.845 0 50 GFAA O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC[C@H]1Cn1cnc2ccccc21 901211783 HSQCAJURFXOMQM-HNNXBMFYSA-N 375.432 2.710 0 50 GFAA NC(=O)c1cccc(Cc2noc([C@H]3CCc4nnn(C5CCCC5)c4C3)n2)c1 952893780 KHEAJLHWSPNHMJ-HNNXBMFYSA-N 392.463 2.738 0 50 GFAA O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 1875256133 XKLKHEZZSAHLGF-WMLDXEAASA-N 385.399 2.923 0 50 GFAA O=C(Cc1ccccc1)NCCNC(=O)Cc1csc(Cc2ccccc2)n1 1875258177 WJHPLFLWVNBGFC-UHFFFAOYSA-N 393.512 2.752 0 50 GFAA O=C1CC[C@H](n2cc(Nc3cnc4cc(Br)ccc4n3)cn2)CN1 1875294395 GWHABVNZWGFVRD-LBPRGKRZSA-N 387.241 2.784 0 50 GFAA O=C(NCCOc1ccc(C(F)(F)F)cc1)c1ncoc1[C@H]1[C@H]2CN[C@H]1C2 1875393600 QCABEYCIDFLHDG-SWHYSGLUSA-N 381.354 2.578 0 50 GFAA O=C(N[C@H]1CCc2c[nH]nc2C1)N[C@H]1CCCc2c1cnn2Cc1ccccc1 1319170007 DRJLBNIICDJAJP-HKUYNNGSSA-N 390.491 2.889 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](N)CC(F)(F)C2)c2cnn(Cc3cccs3)c2n1 2325799814 ZGYPEJKLKHBUTJ-LBPRGKRZSA-N 391.447 2.658 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCCC[C@@H]1c1cnc(=N)[nH]c1)c1ccc(C)cc1 2325879069 GQFQCQXRPBDZFH-RTBURBONSA-N 381.480 2.519 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 110691690 HHHNKGIKVMIFDA-ZDUSSCGKSA-N 396.896 2.894 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=S)Nc2ccc3nsnc3c2)C1 1087427 QQDYVDHBSVELBC-GFCCVEGCSA-N 377.539 2.969 0 50 GFAA biogenic COCCN1CCC[C@]2(CCCN2C(=O)Cc2cccc(C(F)(F)F)c2)C1=O 2356168448 DUJPKMJITPJLMM-IBGZPJMESA-N 398.425 2.878 0 50 GFAA O=C(CNS(=O)(=O)c1ccccc1)OCC(=O)c1ccc2ccccc2c1 2811949 GXVHRYXEWVBZIF-UHFFFAOYSA-N 383.425 2.544 0 50 GFAA CCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2SCCOC)cc1 2877587 HESMAYMBJOKMTF-UHFFFAOYSA-N 394.518 2.976 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccccc2Cl)cc1C 4839856 KGMUFFJCGJECGM-GFCCVEGCSA-N 382.869 2.963 0 50 GFAA COc1ccc(Cc2nnc(S[C@H](C)C(=O)Nc3nccs3)n2C)cc1 4944050 LUOMSALYIUQCIK-LLVKDONJSA-N 389.506 2.990 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@@H](C(=O)NC23CC4CC(CC(C4)C2)C3)C1 6746858 FMOXRGOADGUXDZ-ZCYBBYNQSA-N 382.570 2.913 0 50 GFAA O=C(N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1)N1CC[C@@]2(CCOC2)C1 459087435 BNYNPKUVIHVNCX-YQVWRLOYSA-N 397.441 2.839 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2c(F)cccc2Cl)CC1 249096660 IJOVMZDPTHBCLN-MCIONIFRSA-N 382.863 2.980 0 50 GFAA COC(=O)c1cc(C(=O)N2CCN(C)c3ccccc32)n(-c2ccccc2)n1 110474241 CUZJRXMNAPRLKW-UHFFFAOYSA-N 376.416 2.756 0 50 GFAA C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1Cc1ccc2c(c1)oc(=O)n2C 225422535 NNDCAHOMLCUQCB-UONOGXRCSA-N 375.469 2.961 0 50 GFAA COc1ccccc1C1=NN(S(C)(=O)=O)[C@@H](c2cnc3ccccc3n2)C1 225507825 HWEWXJOOACMSPM-GOSISDBHSA-N 382.445 2.749 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@]1(O)CNCc1cnc2c(c1)CCC2 67688569 WPUFAWHJPYSWEO-DEOSSOPVSA-N 393.531 2.646 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@@H]23)o1 248179764 XURXPNLCGDDBRJ-NIFZNCRKSA-N 380.510 2.911 0 50 GFAA Cn1c([C@@H]2CCCN2Cc2nc3ccccc3c(=O)n2C)nc2c1CCCC2 328631567 KQLTVIODLQTPSP-IBGZPJMESA-N 377.492 2.883 0 50 GFAA COc1ccc(F)c(C(=O)NC2CCN(CCc3ccncc3)CC2)c1OC 252503334 VBLRVYZAOYHEBN-UHFFFAOYSA-N 387.455 2.675 0 50 GFAA Cc1cccn2c(CN3CC[C@H](O)C3)c(C(=O)N(C)CCc3ccccc3)nc12 71754609 MNEVNLMDTYTCRQ-IBGZPJMESA-N 392.503 2.524 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@@H](CC(=O)O)c1cccs1 236588213 NGFUGRNZFWRUQL-DLBZAZTESA-N 386.473 2.916 0 50 GFAA Cn1cc(-c2nc([C@@H]3COCCN3C(=O)c3sccc3C3CC3)no2)cn1 373032223 SSANYCFAWVLUAC-AWEZNQCLSA-N 385.449 2.623 0 50 GFAA O=C(N[C@@H]1CCOC2(CCCCC2)C1)N1CCCC[C@@H]1CN1CCOCC1 157845977 NJKDMCGYPBOGEB-RTBURBONSA-N 379.545 2.765 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3cc(C)n[nH]3)C2)cc1OC 72170245 PRSUHTKLIZARLS-QGZVFWFLSA-N 386.496 2.514 0 50 GFAA C[C@H]1CN(S(=O)(=O)C2CCC(C(F)(F)F)CC2)C[C@@]2(CCCOC2)O1 333458629 UANUYKYNPRMJCH-VXGQWTEUSA-N 385.448 2.707 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)n[nH]1 130691303 ZGUICBRSTIPFJO-GFCCVEGCSA-N 397.410 2.730 0 50 GFAA CCCN1CC[C@@H](CNC(=O)N2CC(Cc3cc(OC)cc(OC)c3)C2)C1 378050772 UIIISWSCWWRKEN-INIZCTEOSA-N 375.513 2.620 0 50 GFAA CC(=O)c1cccc(CN2CC3(CCN(C(=O)C4CC4)CC3)C[C@@H]2C(=O)O)c1 72418514 VPGHGWFNTUZJMQ-LJQANCHMSA-N 384.476 2.567 0 50 GFAA C[C@@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@@H](O)c1ccc(F)cc1 173610650 CRRVETGCYCYTDU-AUUYWEPGSA-N 383.427 2.904 0 50 GFAA C[C@H](NC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OC(C)(C)C)C1)[C@H]1CCCO1 240668027 HMAOSAKWFKAAGI-BMGDILEWSA-N 387.480 2.647 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3c4ccccc4[C@@H]([C@H]4C=CC=C[C@H]43)[C@H]2C1=O)c1ccncc1 229875757 NVMBSBHKEBHUNI-PQQLZPAPSA-N 397.434 2.581 0 50 GFAA COc1ccccc1-c1ccc(CN[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1 174406881 NKWBKPZNBPNHSP-HXUWFJFHSA-N 376.460 2.991 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc(-c2cc(C(=O)N3CCCC3)ccn2)cc1 426497058 BHYZRGBNCPRPJX-IBGZPJMESA-N 379.460 2.893 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H]3CC[C@H](O)CC3)csc2C1 426701501 WUSISPFRCVNMIL-SHTZXODSSA-N 389.521 2.945 0 50 GFAA CC[C@@H]1CCCCN1CC(=O)NCc1cc2n(n1)CCCN(CC(C)C)C2 82107903 CIDFLLIAZMVLJX-LJQANCHMSA-N 375.561 2.626 0 50 GFAA CC(C)c1noc(CNC(=O)N2CCN(c3nc4ccccc4s3)CC2)n1 426487217 ADUVOAMUIPNFMA-UHFFFAOYSA-N 386.481 2.835 0 50 GFAA CCN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)Cc3ccncc3)CC2)[C@H]1O 20256658 WOWBSPCLOIXUSH-YADHBBJMSA-N 379.504 2.552 0 50 GFAA O=c1cc(COc2ccccc2)nc(-c2ccc(CN3CCC[C@@H](O)C3)cc2)[nH]1 19865363 ULIDKWPZPOYGEK-HXUWFJFHSA-N 391.471 2.973 0 50 GFAA CN(C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1)C1CCSCC1 95503548 FPIGXEJZVYEQNI-KRWDZBQOSA-N 377.510 2.955 0 50 GFAA Cc1nn(CC(=O)NCc2nc3cc(Cl)ccc3[nH]2)c(=O)c2ccccc12 91694381 XHQFQPQTTKEIGZ-UHFFFAOYSA-N 381.823 2.551 0 50 GFAA COc1cc(NC(=O)N2CCCO[C@H](CN3CCCC3)C2)c2ncccc2c1 95522694 YRDQPZUUWBUFQT-GOSISDBHSA-N 384.480 2.962 0 50 GFAA Cc1nc(CNC(=O)c2ccc3oc(-c4cccc(F)c4)nc3c2)cc(=O)[nH]1 95499688 JSIBRDVMZRDLHY-UHFFFAOYSA-N 378.363 2.956 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](CCC(=O)NCc2ccc(C)o2)C1 95496859 RRXUBHFAJQOATK-MRXNPFEDSA-N 385.464 2.940 0 50 GFAA C[C@@H](CNC(=O)c1ccc(-c2ncn(C)n2)cc1)N1CCc2sccc2C1 183037714 QQUYYHFGECKTOT-AWEZNQCLSA-N 381.505 2.720 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N[C@H](Cn2cccn2)c2ccccc2)c1 607362968 OJVKSZLVTHVZBP-QGZVFWFLSA-N 387.461 2.620 0 50 GFAA O=C(CN1CCC[C@@H]1c1nc(-c2ccncc2)no1)NCc1ccccc1F 65373937 IRXBJRNKKRGQKE-QGZVFWFLSA-N 381.411 2.724 0 50 GFAA CC[C@H](C(=O)N1C[C@@H](OC)C[C@@H]1c1nc(-c2cccnc2)c[nH]1)N(CC)CC 170682998 SAISANLBZVYLDZ-QXAKKESOSA-N 385.512 2.881 0 50 GFAA O=C(c1ccncc1)N1CCC(NCc2noc(Cc3cccs3)n2)CC1 1506420426 FZIBFAKYHPXXON-UHFFFAOYSA-N 383.477 2.511 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@H](C(=O)O)c3ccccc3)o2)c1C 1506400312 DISDNYOQPRADLV-HNNXBMFYSA-N 376.390 2.656 0 50 GFAA CNCC1CCN(S(=O)(=O)c2cc(Br)ccc2Cl)CC1 237356216 RFWCWGRKPGBPDG-UHFFFAOYSA-N 381.723 2.723 0 50 GFAA CCn1ccnc1CN(C)Cc1c(C(=O)N2CCCCC2)nc2sccn12 11936093 BUFMSMRVKFRFNX-UHFFFAOYSA-N 386.525 2.870 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)c2ccc(C)nc2)CC1 12571411 SAFZLEFKJOXZKX-FQEVSTJZSA-N 386.540 2.623 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(NCc3cnn(C)c3C)nc2)CCN1C(C)C 12716777 ADPLYPSLABGULH-LJQANCHMSA-N 384.528 2.680 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccncc2)CN(Cc2cccc(O)c2)CC1=O 14744669 FGCYUDWFLPXRME-NRFANRHFSA-N 383.492 2.673 0 50 GFAA COc1ccc(OC)c(N2C(=O)[C@@H]3C[C@H]2CN3C(=O)/C=C/c2cccc(F)c2)c1 14882803 OIPULGCPGBGUSD-GZWGRDOWSA-N 396.418 2.872 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(Cc4nccn4C)C3)C2=O)c1 15065060 GAGUULWFRLSIRL-NRFANRHFSA-N 386.471 2.583 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1nc3ccccc3s1)CC2 19229411 WSZWWCHPCZSSPA-HNNXBMFYSA-N 399.516 2.838 0 50 GFAA COc1ccccc1NC(=O)Cn1c(C)cc2nc3n(c(=O)c21)CCCCC3 169777266 LUZPLBQMXOBAPS-UHFFFAOYSA-N 380.448 2.880 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(CO)(Cc4ccccc4)CC3)n[nH]c21 1857529101 UTQAVYGFOLJYEY-CVEARBPZSA-N 383.492 2.889 0 50 GFAA CC[C@@]1(C(=O)NCc2cnn(C)c2)C[C@@H]2CC[C@H]1N2C(=O)Cc1ccc(C)cc1 1857680330 GYZJJTINCQBRCZ-MIZPHKNDSA-N 394.519 2.747 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc(Cl)cc1)CC2 1857692558 KIRHJSKFIVRUNH-KRWDZBQOSA-N 388.899 2.862 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1 1857723503 IWWCFLVHXKBMNR-VWNXMTODSA-N 392.499 2.833 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cc4c(nc3O)CCCC4)C1)CC2 1704300554 YRWGLXDIPGALSU-QFIPXVFZSA-N 378.476 2.885 0 50 GFAA NC[C@@H]1CCCC12CCN(C(=O)[C@@H](Cc1ccccc1)N1CCCOC1=O)CC2 1875277779 FWIVFQHDMXHJHV-VQTJNVASSA-N 399.535 2.808 0 50 GFAA O=C(COCc1ccco1)OCc1nnnn1-c1ccc(C(F)(F)F)cc1 1875254906 FMQRMOCGZXDDPY-UHFFFAOYSA-N 382.298 2.534 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(C(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320024 CVGXKSMQFRMRSP-NSHDSACASA-N 390.427 2.875 0 50 GFAA COc1ccc2cc(CNC(=O)N[C@@H]3C[C@@H](Cn4ccnc4)C[C@H]3O)ccc2c1 2325785148 FNMDRZMRPDHVEF-MAODMQOUSA-N 394.475 2.684 0 50 GFAA O=C(N[C@H](CO)[C@@H](O)c1cccnc1)c1cccc2[nH]c(-c3cccs3)nc12 1471065741 DHMVCGPMQTUXIV-QAPCUYQASA-N 394.456 2.511 0 50 GFAA Cc1ccccc1N1CCN(S(=O)(=O)c2ccc3oc(=O)ccc3c2)CC1 1069757 SVDXQFQBWNSTSY-UHFFFAOYSA-N 384.457 2.612 0 50 GFAA Cc1c(-c2cccs2)[nH][nH]c1=NC(=O)C1CCN(C(=O)c2ccncc2)CC1 2356136588 AHURDYUHXWJDFM-UHFFFAOYSA-N 395.488 2.754 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(c2noc(-c3ccccc3)c2C(=O)O)C1 2356141557 HEJTZLVDVUUNEC-AWEZNQCLSA-N 380.404 2.873 0 50 GFAA CN1CCC[C@]2(CCCN2Cc2ccccc2OCC(=O)N2CCCCC2)C1=O 2356148884 YNVCTCCKQHVCME-QHCPKHFHSA-N 399.535 2.665 0 50 GFAA COc1ccc(N2C(=S)N(c3ccc(F)cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 3643088 AKHWBOCJQGZDQH-IAGOWNOFSA-N 392.477 2.611 0 50 GFAA Cc1ccccc1OCC(=O)N(Cc1cccs1)[C@@H]1CCS(=O)(=O)C1 4313123 QBMMXPBKICXZMV-OAHLLOKOSA-N 379.503 2.651 0 50 GFAA O=C(O)c1ccc(NC(=S)NC(=O)c2cncc(Br)c2)cc1 4818804 LTLJSCLASHJQEJ-UHFFFAOYSA-N 380.223 2.669 0 50 GFAA COc1ccc(S(=O)(=O)NC2CCN(Cc3ccncc3)CC2)cc1Cl 55634029 ONJZAYXLHGWTDM-UHFFFAOYSA-N 395.912 2.687 0 50 GFAA CN1CCN(Cc2cccc(OC[C@@H](O)CN3CCCCCC3)c2)CC1(C)C 108274582 DXZQHWXAAKDIRU-NRFANRHFSA-N 389.584 2.828 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCC(CCO)CC3)C2=O)cc1 67856637 DOUOGBSSUAVJQB-HSZRJFAPSA-N 388.552 2.758 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c(C)c1 64799698 FWKNRZQRJDGWJR-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA CCOC(=O)[C@@]1(O)c2cc(OC)c(OC)cc2CCCN1C(=O)c1ccccc1 22589388 CMBLDPMMTYZTTO-QFIPXVFZSA-N 399.443 2.501 0 50 GFAA O=C1CC[C@@]2(C(=O)N3CC[C@@H](Oc4ccccn4)C3)Sc3ccccc3N12 330013763 AGKVPVWQJXUMKC-VLIAUNLRSA-N 381.457 2.690 0 50 GFAA CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(C(=S)NC3CC3)CC2)cc1 7680658 OJLCCJPDECVDMR-CQSZACIVSA-N 381.567 2.543 0 50 GFAA CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCC[C@H]1CCO 428792674 IOAROHGXJSVPCV-ZAAXVRCTSA-N 385.508 2.519 0 50 GFAA Cc1ccc(OC2(C(=O)NCc3cc(-c4cccnc4)no3)CCNCC2)cc1 77354024 USINCQOZWTZGMA-UHFFFAOYSA-N 392.459 2.862 0 50 GFAA O=C(O)[C@H]1CCCCN1C(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 262532176 IPNYQLWGAVICDL-GOSISDBHSA-N 387.457 2.740 0 50 GFAA C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 375603753 BRJWGNWZQOLIGO-ZHGZNUGGSA-N 381.476 2.664 0 50 GFAA O=C(O)c1cc(-c2cccc3cccnc23)cc(S(=O)(=O)N2CCOCC2)c1 72167056 AUCKJARHOVUQJI-UHFFFAOYSA-N 398.440 2.621 0 50 GFAA C[C@@H](NC(=O)N1CCCN(c2cccnn2)CC1)c1ccc(-n2cccn2)cc1 173653103 IVMASJLHFIDQMB-QGZVFWFLSA-N 391.479 2.645 0 50 GFAA COCCOC1CCN(C2CCN(c3ccc(-n4cccn4)cc3)CC2)CC1 48428326 YBXZTEYGYZQGOC-UHFFFAOYSA-N 384.524 2.969 0 50 GFAA C[C@@H](CC(=O)O)CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1 17079629 BZLMHLGLEYHFPS-CQSZACIVSA-N 390.461 2.605 0 50 GFAA CCN1C[C@@H](CNC(=O)N(Cc2ccccc2)Cc2cccc(C)n2)CC1=O 426589909 CSOVTMUTXSFBAN-LJQANCHMSA-N 380.492 2.970 0 50 GFAA COc1ccc(OC)c(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)c1 44901151 ALSHZMYGCRUPDN-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA FC(F)(F)c1ccc(-c2cnnc(N3CCN(c4cnccn4)CC3)n2)cc1 19884898 AFQLLZUIFRQLDT-UHFFFAOYSA-N 387.369 2.674 0 50 GFAA Cc1nnc(SCCNC(=O)N(C)Cc2ccc3nsnc3c2)s1 426489525 IZLCALLTSHFZCS-UHFFFAOYSA-N 380.524 2.785 0 50 GFAA CCc1nc(CN2CCC[C@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)no1 95506359 NSNYKOGHLUNLLO-HNNXBMFYSA-N 380.452 2.873 0 50 GFAA Nc1n[nH]c(C2CCN(C(=O)C[C@@H](Cc3ccccc3)c3ccco3)CC2)n1 426739804 QSLAFXNWBJSFKY-QGZVFWFLSA-N 379.464 3.103 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)c2ccccc2-c2ncc[nH]2)CC1 95516965 KICBRZLNIXOVNQ-UHFFFAOYSA-N 379.464 2.939 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)C1 290747350 OOWNFWWVLNYCHL-VQTJNVASSA-N 386.540 2.599 0 50 GFAA CC(C)c1cc(C(=O)N[C@H](C)c2ccccc2-n2cccn2)nc2ncnn12 91288877 SXHQFBCSVBSOMO-CQSZACIVSA-N 375.436 2.924 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4ccoc4C)C3)CCC2=O)cn1 92004607 SFARSJVDJRELRP-NRFANRHFSA-N 382.464 2.731 0 50 GFAA O=C(CCc1cc(Cl)no1)N1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1 91793905 RECHFLIWLYLUST-IBGZPJMESA-N 379.888 2.902 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)c1O 91782407 PKVKEBNPBNAHHE-KRWDZBQOSA-N 386.492 2.724 0 50 GFAA CN(C)C1CCN(CCNC(=O)N2CCC(COc3ccccc3)CC2)CC1 179308366 KQOWDLKEAYSBPL-UHFFFAOYSA-N 388.556 2.513 0 50 GFAA COCCN1C[C@H](CNC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1=O 252494396 NULJMNPLVQFJQN-JTQLQIEISA-N 378.778 2.584 0 50 GFAA CCc1ccc(NC(=O)N2CCc3nn(Cc4cccnc4)c(=O)cc3C2)cc1 263616290 HXKBGDIUBPLNNL-UHFFFAOYSA-N 389.459 2.839 0 50 GFAA O=C(CCc1ccccc1)N[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 575442697 JESLSQXVSJEUFE-SFHVURJKSA-N 390.480 2.728 0 50 GFAA O=C(NC1CCN(Cc2cc(F)cc(F)c2)CC1)N1CCCN2CCC[C@H]2C1 584898138 XYYFOPBIYGLVAZ-FQEVSTJZSA-N 392.494 2.809 0 50 GFAA O=C(NCCN1CCCc2ccccc21)c1ccc(CSc2nc[nH]n2)o1 670444610 IVLIHRUZMMBEMZ-UHFFFAOYSA-N 383.477 2.873 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2)c1ccc(-c2cnco2)cc1 670446603 VJAQKVALNQZOAC-XFKLWTPLSA-N 390.447 2.806 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccnc2)Cc2cnc(-c3cccs3)nc2)N1 952873909 QJDUYPJOERPQQD-KRWDZBQOSA-N 379.489 2.881 0 50 GFAA CN(CCOc1cccc(Cl)c1)C(=O)Cc1ccc(S(C)(=O)=O)cc1 952985015 ABRIUOQHHOSLAY-UHFFFAOYSA-N 381.881 2.823 0 50 GFAA CCC[C@H]1CN(C(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@@H]1NS(C)(=O)=O 216837509 DQPBCTMHDKCHJM-YJBOKZPZSA-N 377.510 2.575 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)/C=C/c2ccc3c(c2)OCO3)c1 865045 RZKKEYAAZAMXKD-XBXARRHUSA-N 383.356 2.640 0 50 GFAA O=C(c1cc[nH]n1)N1C[C@H]2CN(C(=O)C3CCC3)C[C@]2(CCc2ccccc2)C1 1772707060 QVTYWQQWZLVGFH-AUSIDOKSSA-N 392.503 2.743 0 50 GFAA CN1CCCC[C@@H]1C(=O)N1CCCN(CCCOc2ccc(F)cc2)CC1 1772706404 CHGOLHWWBISUCU-HXUWFJFHSA-N 377.504 2.613 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNC3C4CC5CC(C4)CC3C5)C2=O)c1 11839237 HCTMHOIROZSZSR-INLXCBAXSA-N 398.547 2.963 0 50 GFAA O=C(Nc1ccc(F)cc1)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12004086 FERUMGIIGWQHDT-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCC[C@@H](OC)C3)n[nH]2)c(Cl)c1 12302827 VBNZZOPOULNAJG-CQSZACIVSA-N 379.844 2.902 0 50 GFAA CSc1ncc(CN2CCC(CCC(=O)NCc3cccnc3)CC2)cn1 12304929 CEZNUMZGJRMKTN-UHFFFAOYSA-N 385.537 2.902 0 50 GFAA O[C@H](COc1ccccc1CNCCCOc1cccnc1)CN1CCCCC1 12431982 MKQCESACJKCKPN-NRFANRHFSA-N 399.535 2.866 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)Nc4ccc(F)cc4)CC3)nn2)n1 13009184 JEGSBIOGXPNGLL-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA Cc1nonc1CC(=O)N(C)CC1CCN(CCc2ccc(Cl)cc2)CC1 14949151 GMCQZBHXFSESQP-UHFFFAOYSA-N 390.915 2.987 0 50 GFAA Cc1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCC(C)CC3)c2)no1 16623102 NWMGINRKGZHIHM-UHFFFAOYSA-N 381.429 2.795 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2csnn2)C1)NCc1ccccc1F 19642596 NJGQZNJMZABYIC-ZDUSSCGKSA-N 376.457 2.626 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)c3ccc(F)cc3Cl)nn2)n1 19924106 OHNASWCBMLOPAN-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA c1ncc(CN2CCC3(CC2)OCCc2cc(O[C@H]4CCOC4)ccc23)cn1 1857680997 YYPZTRCPDVQKNK-FQEVSTJZSA-N 381.476 2.708 0 50 GFAA O=C(c1ccc(F)cc1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857688487 MOGPYYYMOMHTMY-VXKWHMMOSA-N 398.478 2.865 0 50 GFAA O=C(O)[C@@H]1CN(C/C=C/c2ccccc2)CC12CCN(Cc1cc[nH]n1)CC2 1857693992 WBAQIWQDSLKMOM-PDGUBNMISA-N 380.492 2.722 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1csc(Cc2ccccc2)n1 1857696345 WQRSJEUSNYKBMD-ZIFCJYIRSA-N 383.517 2.715 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)COCc3ccccc3)C2)cn1 1857705549 LZFNAGYAHFIPMF-WOJBJXKFSA-N 381.476 2.764 0 50 GFAA O=C(NCc1nc(-c2ccc(F)cc2)cs1)[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857734108 FAACFXCCPPVFSI-YSVLISHTSA-N 375.469 2.723 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NCCCc4cccnc4)CC3)nc2n1 1857734643 YLJSGMDAJFEMHI-UHFFFAOYSA-N 379.464 2.892 0 50 GFAA COc1cc(-c2noc(CCc3nc(=O)c4c(C)c(C)sc4[nH]3)n2)ccn1 114057792 RVEPZAPZGWKSRF-UHFFFAOYSA-N 383.433 2.840 0 50 GFAA O=C1C[C@@H](c2nc(-c3cc(OC(F)F)ccc3F)no2)CN1c1cn[nH]c1 349652245 KQWMSFFFHCBSFP-MRVPVSSYSA-N 379.298 2.721 0 50 GFAA CN(C)Cc1cnc(CN(Cc2nccs2)[C@@H]2CC23CCNCC3)s1 952887646 ULSZXNPNEHMVOY-OAHLLOKOSA-N 377.583 2.806 0 50 GFAA Cc1ccc(N2C(=O)CCC2=O)cc1NC(=O)C[C@@H](n1cccn1)C(F)(F)F 952885665 RSZZGYYQKCAYRY-CQSZACIVSA-N 394.353 2.977 0 50 GFAA CON1CCC(c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)CC1 952895291 TVLXKYUPMPHWLL-KRWDZBQOSA-N 397.401 2.916 0 50 GFAA O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 1875256131 XKLKHEZZSAHLGF-PBHICJAKSA-N 385.399 2.923 0 50 GFAA O=C(c1ccccc1NS(=O)(=O)C1CC1)N1CCC(c2ncco2)CC1 1875268743 RMTPJFPVNKDFBC-UHFFFAOYSA-N 375.450 2.599 0 50 GFAA C[C@@H](C(=O)NCC[S@](=O)c1ccccc1F)n1ccc(C(F)(F)F)n1 1875269370 GMWNJWFFSWWGBM-FORDYWAESA-N 377.363 2.526 0 50 GFAA C[C@H](NC(=O)N1CCC(S(C)(=O)=O)CC1)c1ncc(-c2ccc(F)cc2)o1 1875300527 GRBWUZQAYASLHD-LBPRGKRZSA-N 395.456 2.760 0 50 GFAA Cc1cc(-c2nc(C)c(C(=O)N3CCc4nc[nH]c(=N)c4C3)s2)ccc1F 1875310476 RAODAOVESUQVRN-UHFFFAOYSA-N 383.452 2.967 0 50 GFAA Cc1ccccc1Nc1scnc1C(=O)N1C[C@H](C)O[C@@H](CC(=O)O)C1 1875312515 NGBLJBKUCWDWTE-STQMWFEESA-N 375.450 2.899 0 50 GFAA CN(C)CCCc1nc(-c2ncn(C(C)(C)C)n2)n(Cc2ccccc2F)n1 1875324539 CGVLOUITDFYSDR-UHFFFAOYSA-N 385.491 2.973 0 50 GFAA Cc1c(N2C(=O)[C@H](c3cccc(O)c3)N(C)C2=O)nnn1Cc1ccccc1F 1875337291 WCTBGBAWJCFZEJ-KRWDZBQOSA-N 395.394 2.619 0 50 GFAA O=C(O)c1cc(F)cc2c1CCN(C(=O)Cc1ccccc1O[C@H]1CCOC1)C2 1875300722 OKPJLIYCJUQNJP-KRWDZBQOSA-N 399.418 2.819 0 50 GFAA COC[C@@H](NS(=O)(=O)C[C@H]1CCC2(CCC2)O1)c1ccc2[nH]ccc2c1 2325783955 NUTMBXJYJDJRAR-SJLPKXTDSA-N 378.494 2.877 0 50 GFAA CCc1nc(C(=O)O)c(NC(=O)C[C@H](NC(C)=O)c2ccc(F)cc2F)s1 2325874139 BZFFBMOXLJPVDL-LBPRGKRZSA-N 397.403 2.888 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nnc(Cc3ccccc3)n2C)cc1 779192 UJWBHZLZWRVLBL-UHFFFAOYSA-N 396.472 2.923 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=S)Nc2ccc3nsnc3c2)C1 1087426 QQDYVDHBSVELBC-LBPRGKRZSA-N 377.539 2.969 0 50 GFAA biogenic CCc1ccc(N(CC(=O)Nc2ccc(OC)c(OC)c2)S(C)(=O)=O)cc1 1112400 NZLITPXQEOLHPF-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA O=C(CCCCc1ccccc1)N1CCc2nc(C3CCOCC3)nn2CC1 2356164342 PHWDJPSRCQLEMJ-UHFFFAOYSA-N 382.508 2.970 0 50 GFAA O=C(N[C@H]1CC[C@H](C(=O)O)CC1)c1nn(Cc2ccccc2)c2ncccc12 2356168792 NWCZZZQKUCDKLU-WKILWMFISA-N 378.432 2.853 0 50 GFAA CN(CC(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(Cl)cc1 2810689 JRMIPYZIORZCIH-UHFFFAOYSA-N 387.288 2.930 0 50 GFAA Cc1cc(OCC(=O)N2CCOCC2)ccc1NC(=O)OCc1ccccc1 4870364 BDCVMHWYMYQDEU-UHFFFAOYSA-N 384.432 2.981 0 50 GFAA CSc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3)CC2)cc1 4973537 WRNKFTXDGMYFRJ-UHFFFAOYSA-N 391.518 2.843 0 50 GFAA CN1CCC(N2CCN(Cc3ccc(C(F)(F)F)cc3)C[C@H]2CCO)CC1 104349506 BTCZTEWQZFUVRI-LJQANCHMSA-N 385.474 2.668 0 50 GFAA O=C(CCC(=O)N1CCC[C@@H]1c1nc(-c2cccnc2)no1)NC1CCCC1 55326396 JISYPUCJQRTEIG-MRXNPFEDSA-N 383.452 2.634 0 50 GFAA COc1ccccc1CN1C(=O)O[C@@H]2CN(Cc3nc4ccccc4n3C)C[C@@H]21 20601167 KYQSVZIVMYJGHW-AZUAARDMSA-N 392.459 2.787 0 50 GFAA O=C(CCc1cn[nH]c1)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 11772983 CIGHCTRQZDQXTJ-NRFANRHFSA-N 384.455 2.523 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(Cc3ccc(-n4cccn4)cc3)C2)CC1 39551467 NDEYEEPNAVLILT-HXUWFJFHSA-N 395.551 2.639 0 50 GFAA O=C(Nc1ccc2oc(=O)ccc2c1)[C@H]1CCCN1C(=O)Cc1ccccc1 142123156 VXPBAJAJMMWYKR-GOSISDBHSA-N 376.412 2.965 0 50 GFAA CCCc1oncc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCCOC)C2)C1 77341293 TVWMXUYFQZEGNM-FQEVSTJZSA-N 377.485 2.508 0 50 GFAA CCn1cc(NC(=O)Nc2cc(F)ccc2N2CCCN(C(C)=O)CC2)cn1 363922146 MPUKODSUAMDJAZ-UHFFFAOYSA-N 388.447 2.745 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)N1CCO[C@H](C2CC2)C1 364497652 ZSHBJUWYDKNHKB-KRWDZBQOSA-N 399.447 2.548 0 50 GFAA Cn1c(C(=O)N2CC3(CCNCC3)C[C@@H]2C(=O)O)cc2c(Cl)cccc21 72147900 YIUQZDORNFURAU-MRXNPFEDSA-N 375.856 2.501 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCC[C@@H](N)C3)cc2Br)no1 158568495 ZFPUZBSAUHAMIX-CYBMUJFWSA-N 394.269 2.888 0 50 GFAA Cc1nc(-c2ccccc2NC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cs1 333407278 GISWTNGYYXCAKK-ZDUSSCGKSA-N 394.522 2.522 0 50 GFAA C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)NC1CCC2(CC1)NC(=O)NC2=O 376888448 PWHRRCZSGIUDSW-IOSWJTEDSA-N 384.480 2.520 0 50 GFAA C[C@H]1CCN(C(=O)c2ccn([C@@H]3CCCNC3)n2)CCN1Cc1ccccc1 262871932 XWAXWNFFNOEKMJ-AZUAARDMSA-N 381.524 2.544 0 50 GFAA Cc1nc2cc(C(=O)N[C@@H]3CC(=O)N(CCCc4ccccc4)C3)ccc2[nH]1 72174129 BQTWCMLZQLEUJC-GOSISDBHSA-N 376.460 2.835 0 50 GFAA CCc1noc(-c2cccc(-n3ccnc3-c3cc4n(n3)CCCNC4)c2)n1 72447641 LXEKOIPLNGPIAH-UHFFFAOYSA-N 375.436 2.842 0 50 GFAA C[C@@](O)(CNC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1)c1cccs1 172414965 TUEOSSUBMYYGBH-HXUWFJFHSA-N 390.480 2.763 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@@H]1O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 131055870 HMWNQOWDRXIDLH-FFZOFVMBSA-N 379.460 2.705 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(Cc4ncccn4)C3)C2=O)c1OC 426550391 ITKPFKQMBLEKAZ-JOCHJYFZSA-N 396.491 2.509 0 50 GFAA O=C(NCc1ccc(Cl)cc1)N1CCN(Cc2ccco2)[C@H](CCO)C1 426529293 MIMLMXMVZAEPRR-QGZVFWFLSA-N 377.872 2.711 0 50 GFAA COCc1nc(OC)c2c(C)c(C(=O)Nc3cc4n(n3)CCCC4)sc2n1 286566574 LCSBKJMXFTXSFV-UHFFFAOYSA-N 387.465 2.940 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN2CCC3(CCO3)CC2)cc1OC 95525676 VTBBQNKLUADUTL-LJQANCHMSA-N 392.540 2.532 0 50 GFAA Cc1ccccc1-c1noc([C@@H]2CCC(=O)N(CCCN3CCCC3=O)C2)n1 91475367 HUXRJFLYPGLBSO-MRXNPFEDSA-N 382.464 2.764 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)c2cccc(-c3ncc[nH]3)c2)C1 95500022 YTKMRJJYSDJNHZ-GOSISDBHSA-N 379.464 2.939 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCC(N)CC3)cc2Br)on1 299738420 AOQHTMBPLXVYGM-UHFFFAOYSA-N 394.269 2.888 0 50 GFAA O=C(c1ccc(Oc2ccccc2)o1)N1CCCN(C(=O)[C@H]2CCCO2)CC1 370115052 WMUJSHQNUCUVLZ-QGZVFWFLSA-N 384.432 2.925 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)c1cccc(NC(=O)[C@H]2CCCO2)c1 670467395 PQFSRKXTBSDMNE-LJQANCHMSA-N 382.464 2.726 0 50 GFAA Cc1c(NC(=O)CN2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)cnn1C 1565530686 VZGBVHDFDYWRDV-CTNGQTDRSA-N 378.476 2.671 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@H]1COCC[C@@H]1OCc1ccccn1 1565527050 ZEKGYCBDYWPHNS-WMZOPIPTSA-N 376.840 2.848 0 50 GFAA Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)N(CCC(=O)O)C1CCOCC1 408513330 SAVPCMGITFAVLC-SNAWJCMRSA-N 397.903 2.996 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@H]4CC(=O)N(C5CC5)C4)CC3)oc12 189156786 ULPWFALQRCTHOY-HNNXBMFYSA-N 382.464 2.789 0 50 GFAA C[C@H](NC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(N2CCCC2)c1 195356175 KOPTVWOSZKYJAR-MGPUTAFESA-N 379.460 2.734 0 50 GFAA CN(Cc1ccc2nsnc2c1)C(=O)CCS(=O)(=O)c1ccccc1 1506410311 KCHQRLZIJGVWBK-UHFFFAOYSA-N 375.475 2.514 0 50 GFAA CCn1ncc(Br)c1CNS(=O)(=O)c1ccc(Cl)cc1 2804325 MGPBWRBKZOFEGA-UHFFFAOYSA-N 378.679 2.797 0 50 GFAA CCOc1ccccc1/C=C(/NC(=O)c1ccccc1)C(=O)N1CCOCC1 1225853 OPTTZWHKNKBMIN-KNTRCKAVSA-N 380.444 2.715 0 50 GFAA COCC(=O)N1C[C@@H]2CN(c3ncccc3F)C[C@]2(CCc2ccccc2)C1 1772819359 SFPLOAQUZQURBW-GCJKJVERSA-N 383.467 2.765 0 50 GFAA O=C1CN(C2CCN(c3ccc(F)c(F)c3)CC2)C[C@H](Cc2ccccc2)N1 1772711118 FOYSHYJQQOHIOT-KRWDZBQOSA-N 385.458 2.977 0 50 GFAA CC(C)/C=C/C(=O)N1CCC(N2CCC(C(=O)NCc3cccnc3)CC2)CC1 11821528 UUCVXRRUYKVBDM-AATRIKPKSA-N 398.551 2.613 0 50 GFAA CCN(CC)CCNC(=O)c1c(CC2CCCC2)n(CCOC)c(C)cc1=O 11870357 IPYRBMUHNWIGME-UHFFFAOYSA-N 391.556 2.607 0 50 GFAA CCOC(=O)CN(C)Cc1cccc(OC[C@@H](O)CN(C)C2CCCCC2)c1 12050833 INYLTGNHHVCGIK-FQEVSTJZSA-N 392.540 2.686 0 50 GFAA O=C1CCN(Cc2cccn2-c2ccccn2)CCN1CCOc1ccccc1 12130077 SDGZYSPEOWXOMW-UHFFFAOYSA-N 390.487 2.986 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)C[C@@H]3Cc4ccccc4O3)n2)cc1 12432229 UZZWDKIPPAXQQO-KRWDZBQOSA-N 379.416 2.959 0 50 GFAA CCOC(=O)C1(Cc2cccc(F)c2)CCN(C(=O)C2CCOCC2)CC1 12455126 MULJRHQQBXQLDA-UHFFFAOYSA-N 377.456 2.967 0 50 GFAA CSc1cccc(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCN2CCCCC2)c1 12592340 VKCZZCWQUCHSBO-RBUKOAKNSA-N 375.538 2.899 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)N3CCCC[C@H]3CCO)o2)c1 14963986 BILJEHLIFIYYJO-KRWDZBQOSA-N 387.480 2.560 0 50 GFAA Cc1cccc2cc(-c3nccn3-c3cnn(CCCC(N)=O)c3)c(O)nc12 1857692661 OFSDSCJSJYCUJK-UHFFFAOYSA-N 376.420 2.564 0 50 GFAA COC[C@@H](NC(=O)C1CCN(c2nc3nc(C)ccc3o2)CC1)c1ccccn1 1857701617 RLQCPTPHEIXFPR-QGZVFWFLSA-N 395.463 2.647 0 50 GFAA Cc1nc(N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)c2c(C)noc2n1 1857721783 FZUHONZYXBNFJK-CRAIPNDOSA-N 375.432 2.823 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)nn1C 1857729714 ITVYQZIGNWAQLR-NRFANRHFSA-N 383.496 2.642 0 50 GFAA CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)c2n[nH]c3c2CCC3)CC1 126441329 CPHRMBOQEHGRPB-CQSZACIVSA-N 385.487 2.670 0 50 GFAA C[C@H]1CCCN(c2cc(C(=O)NCCNC(=O)NC3CCCCC3)ccn2)C1 332873093 PFCMYIYGXYUMQL-INIZCTEOSA-N 387.528 2.680 0 50 GFAA Cc1nc(C2CCCC2)sc1C(=O)N[C@@H]1CCC(=O)N[C@H]1c1ccnn1C 253416852 CBSQOUYSOSSLPG-CZUORRHYSA-N 387.509 2.592 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)c1cc(N2CCC[C@H](CO)C2)ncn1 266853275 SCSRHOAZDXJFEY-NSHDSACASA-N 387.431 2.797 0 50 GFAA O=C(O)c1ccn(CCCC(=O)N2CCC(CN3CCc4ccccc43)CC2)n1 911251275 WKIGTVLSXFHJKV-UHFFFAOYSA-N 396.491 2.663 0 50 GFAA O=C(COc1ccc(CO)cc1)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 924143814 YQBRHFYAGVMJBS-LEWJYISDSA-N 380.488 2.538 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1ccc(C)cc1C(=O)C(F)(F)F)[C@@H]1CCOC1 864096434 GAGPQKDVMQPVCN-BXUZGUMPSA-N 395.399 2.533 0 50 GFAA O=C([C@H]1CCN(C[C@@H]2CCCc3ccccc32)C1)N1CCc2c(O)ncnc2C1 1875261820 KGRBSTPDFGOMMD-ROUUACIJSA-N 392.503 2.509 0 50 GFAA CCOc1ncccc1S(=O)(=O)NC(=O)C1(Cc2ccc(Cl)cc2)CC1 1875313378 PTBIIWKMAXHVAD-UHFFFAOYSA-N 394.880 2.962 0 50 GFAA CC(C)C(=O)N1CC[C@@H]2[C@H](C1)NC(=O)N2C1CCN(CC2CCCCC2)CC1 888103595 OMEBDLQBMYPZCO-VQTJNVASSA-N 390.572 2.682 0 50 GFAA O=C(NCCc1ccc2ncsc2c1)N1CCC(N=c2cc[nH]cc2)CC1 2325811265 JOTKCPFKPIQIMZ-UHFFFAOYSA-N 381.505 2.942 0 50 GFAA CCN(C[C@H](C)NC(=O)[C@H]1C[C@H]1F)C(=O)Cc1cc(Br)cs1 2325822316 QDEHLJQNYOPESL-TVYUQYBPSA-N 391.306 2.764 0 50 GFAA CC[C@@H](C)NC(=O)c1ccccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 1076672 JGVWDRJCUJGSHY-CYBMUJFWSA-N 389.477 2.839 0 50 GFAA CCCCCC(=O)Nc1ccc(S(=O)(=O)Nc2nccnc2OC)cc1 2472830 MWLPDJRHQJIGOL-UHFFFAOYSA-N 378.454 2.805 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N[C@H]3C[C@H](OCc4ccccc4)C3)cn12 2356142165 HCBVQLKWMFCQLG-QWFCFKBJSA-N 394.475 2.896 0 50 GFAA CN(CC(=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccccc2)C1)Cc1ccncc1 2356163505 GOZFJWIXBFGEMC-XKCSPQBFSA-N 379.504 2.660 0 50 GFAA CN1CCC[C@@]2(CCCN2Cc2ccc(OCC(=O)NC(C)(C)C)cc2)C1=O 2356164648 BEIRDTNNSBYFNK-JOCHJYFZSA-N 387.524 2.567 0 50 GFAA CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O 4763717 GTXSTEDIVHHJQL-VNQPRFMTSA-N 396.509 2.650 0 50 GFAA Cc1ccc(S(=O)(=O)NCc2cccnc2)cc1C(=O)NC1CCCCC1 4935294 AMZBALLRAHIBLF-UHFFFAOYSA-N 387.505 2.931 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 6702869 XCBPTCWWAOZUEF-HXUWFJFHSA-N 395.484 2.704 0 50 GFAA C[C@H](NC(=O)CN1CCn2c(Br)cnc2C1)c1ccccc1Cl 225670643 QNDLJZDPCVDLHL-NSHDSACASA-N 397.704 2.992 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)CC1 20661414 DQIHUNDYXMHTSL-UHFFFAOYSA-N 398.334 2.896 0 50 GFAA CC(C)c1cc(C(=O)N2CCc3nnc(CCc4ccccc4)n3CC2)no1 67878857 WMPRRRSJAGHHNE-UHFFFAOYSA-N 379.464 2.873 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1CCc2[nH]nc(-c3cccc(F)c3)c2C1 67908436 ZDTJEJQZQJVNLV-UHFFFAOYSA-N 380.423 2.730 0 50 GFAA COc1ccc([C@H]2CC(=O)Nc3cc(NC(=O)CN(C)C)c(C)cc32)cc1O 65397864 JRHPDLBHEZANQJ-CQSZACIVSA-N 383.448 2.683 0 50 GFAA O=C(NCc1ccoc1)[C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71551777 MSMNFASLDDKPAZ-HXUWFJFHSA-N 382.508 2.667 0 50 GFAA CN(C)Cc1nnc([C@@H]2CCCN(c3ccc(-c4ccccc4)nn3)C2)n1C 72435946 YKTWKRFFPYVPRN-QGZVFWFLSA-N 377.496 2.718 0 50 GFAA CC(=O)N[C@@H](CC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1 363362374 HCSBZNDHEKDASO-GMAHTHKFSA-N 393.531 2.935 0 50 GFAA COc1cccc([C@@H](O)CNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1 363404604 NJVIENZRPPNDPT-UGKGYDQZSA-N 397.519 2.940 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(c3cnc4ccccc4n3)CC2)C1 71747174 SSHJPTRRPGXBJO-INIZCTEOSA-N 379.508 2.589 0 50 GFAA Cc1ccc(NC(=O)NC2CCN(c3nccs3)CC2)cc1S(C)(=O)=O 374173050 GQDURUJCUGHCLY-UHFFFAOYSA-N 394.522 2.646 0 50 GFAA CC1CCN(C(=O)c2ccccc2NC(=O)Cn2c(=O)[nH]c3ccccc32)CC1 155018948 CTXATIJAFAGIFF-UHFFFAOYSA-N 392.459 2.840 0 50 GFAA COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]1(C)CC1(Cl)Cl 130259387 AANOQNYJWGJELJ-INIZCTEOSA-N 387.263 2.690 0 50 GFAA O=C(N[C@H]1CCN2CCCC[C@@H]12)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 332828104 NMVIPZGSESKEJL-BBWFWOEESA-N 394.878 2.510 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)CCCc3ccccn3)cc(Cl)c2O1 127368846 FNPUZWFPPFQIMJ-GFCCVEGCSA-N 394.880 2.886 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N2CCC(N3CCC[C@H](CO)C3)CC2)c1 72439260 CYBISUOGNGLMJD-IBGZPJMESA-N 388.552 2.699 0 50 GFAA CCNC(=O)C[C@H]1CCCCN1C(=O)C1CCN(Cc2csc(C)n2)CC1 375989816 JMPVHSJUWJVREO-GOSISDBHSA-N 392.569 2.571 0 50 GFAA CCc1ccc(CN2CCN(C(=O)CCS(=O)(=O)C3CCCC3)CC2)s1 128680983 JQAMHGUNTWZVBB-UHFFFAOYSA-N 398.594 2.702 0 50 GFAA CON(C[C@@H]1CCC[C@H](C)C1)C(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 290353457 JMTODSXCTFLSNB-NWDGAFQWSA-N 381.860 2.594 0 50 GFAA CNc1nc(C)cc(-c2cccc(C(=O)NCCCc3c(C)n[nH]c3C)c2)n1 426370321 FPXBKQSAWDUWPY-UHFFFAOYSA-N 378.480 3.196 0 50 GFAA CCc1nn2c(nnc3c(=O)n(C[C@H]4CCCO4)ccc32)c1-c1ccccc1 40390846 UUTHMFCJSQFQJC-OAHLLOKOSA-N 375.432 2.848 0 50 GFAA COCc1nnc(NC(=O)c2ccccc2-n2cnc3ccccc3c2=O)s1 40283012 IUKUOBHLYCSCBJ-UHFFFAOYSA-N 393.428 2.636 0 50 GFAA Cc1nc(N)ccc1-c1ccc(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cc1 426406063 IUXATBACAATAFR-GOSISDBHSA-N 388.475 2.828 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)c2ccc(-c3cc(N(C)C)ncn3)cc2)n1 426596665 WAQLPCDVCOJPMQ-HNNXBMFYSA-N 378.480 2.841 0 50 GFAA Cc1cc(C)n2nc(CC(=O)N3CCC[C@H](COc4ccccc4C)C3)nc2n1 426620291 URFANAFNPXFIGH-SFHVURJKSA-N 393.491 2.910 0 50 GFAA O=C(NC1CCN(Cc2cccnc2)CC1)c1ccc(OCC(F)F)nc1 179526367 NOLCUSIBYPHGLG-UHFFFAOYSA-N 376.407 2.515 0 50 GFAA O=C(NC[C@@H](c1ccc(F)cc1)N1CCCC1)c1ccccc1-c1nnn[nH]1 97179408 NPEAIOKVEZCQCH-SFHVURJKSA-N 380.427 2.573 0 50 GFAA COCCCN1CC2(CCN(C(=O)Cc3ccc(F)c(F)c3F)CC2)CC1=O 95356038 FGZBNFPBPSABFT-UHFFFAOYSA-N 398.425 2.524 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2cnco2)C1)NCc1ccc(F)c(F)c1 95509757 ATRPUJXKMCEXAA-ZDUSSCGKSA-N 377.391 2.902 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNc2nccc(-c3cccnc3)n2)cc1 97425028 AFKHEWVDTKIIJJ-UHFFFAOYSA-N 383.477 2.628 0 50 GFAA COc1cccc2c1OC[C@H](CNC(=O)c1n[nH]c(N)c1-c1ccccc1)C2 95386208 WOIZIRKHQQZMOV-ZDUSSCGKSA-N 378.432 2.649 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCc2[nH]cnc2C1 96164945 ISIUSPUQJJLZMQ-UHFFFAOYSA-N 381.457 2.582 0 50 GFAA CSc1nc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2nc[nH]c2C)C3)cs1 91548674 CJPLBYSLGPHOFO-QWHCGFSZSA-N 377.539 2.633 0 50 GFAA CCN(CCO)Cc1cc(Cl)ccc1OC[C@@H](O)CN1CCCCCC1 95504991 MAXXHYQLGWVKAF-IBGZPJMESA-N 384.948 2.770 0 50 GFAA Nc1ncccc1CN1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91645694 CHHNCFXXTZXTJR-UHFFFAOYSA-N 386.446 2.957 0 50 GFAA CC(C)c1cc(C(=O)NCc2cc3n(n2)CCN(C2CCCCC2)C3)n(C)n1 91650518 FUXYRXDIBBSFQZ-UHFFFAOYSA-N 384.528 2.818 0 50 GFAA COc1ccc(CN[C@H]2CNC(=O)c3cc(-c4ccc(OC)cc4)nn32)cc1 263617288 NBKRZGBKXZPFQU-HXUWFJFHSA-N 378.432 2.599 0 50 GFAA O=C(N[C@]1(CO)CCOC1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 185273935 AYZXQCASWRUBBP-KRWDZBQOSA-N 382.338 2.774 0 50 GFAA Cn1nnc2cc(C(=O)N3CCC[C@H](c4[nH]ncc4-c4ccccc4)C3)cnc21 67725844 ALGSUKMQPMKWTC-HNNXBMFYSA-N 387.447 2.773 0 50 GFAA CCOc1ccc(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1OCC 299771338 WMQQYUUOAGBVNJ-SFHVURJKSA-N 376.497 2.857 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3Cn3cccn3)C2)no1 825307342 VBMAKMZUOAOQCH-SFHVURJKSA-N 393.491 2.870 0 50 GFAA CN(C)CCN(Cc1c(-c2ccccc2)nc2ncccn12)C[C@@H]1CCCO1 952989006 GLHSNHBCKOBZEH-IBGZPJMESA-N 379.508 2.939 0 50 GFAA CCOc1ccc(CN2C[C@H]3c4ccccc4OC[C@@]3(C(=O)O)C2)cc1CO 1565514487 BPAOJCXEMKCHOL-AVRDEDQJSA-N 383.444 2.640 0 50 GFAA CC(C)(C)OC(=O)N1CC(S(=O)(=O)c2cccc(Br)c2)C1 90550304 BUQVTVFDTYJIHX-UHFFFAOYSA-N 376.272 2.842 0 50 GFAA in-vitro CC(C)c1nnc(S)n1CCNC(=O)C1(c2ccc(F)cc2)CCOCC1 170647814 CNIKAULXOOQKIC-UHFFFAOYSA-N 392.500 2.694 0 50 GFAA Cc1nc(O)nc(O)c1CCC(=O)N(C)CCCc1cc(-c2ccccc2)no1 750859116 KIAKWQZOKNNDSJ-UHFFFAOYSA-N 396.447 2.875 0 50 GFAA COC[C@@H](NS(=O)(=O)c1ccc(-c2onc(C)c2C)o1)c1ccccn1 1506403860 WMABSGATUNRACR-CQSZACIVSA-N 377.422 2.612 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC(CCO)CC2)ccc1F 1704334215 FSQZWPNAMCREQL-UHFFFAOYSA-N 391.443 2.790 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1cc(F)cc(F)c1)CC2 12282384 DNIKGETZQKUAJW-KRWDZBQOSA-N 378.419 2.507 0 50 GFAA CCOC(=O)N1CCC(Nc2nncc(-c3ccc(OC)cc3OC)n2)CC1 12385449 YLOHKKQSEPPAPQ-UHFFFAOYSA-N 387.440 2.589 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)c2coc(Cn3cnc4ccccc43)n2)n1 12448340 LQESSMBWSUGIBN-AWEZNQCLSA-N 378.436 2.704 0 50 GFAA Clc1ccccc1Cc1noc(CN2CCCN(c3ncccn3)CC2)n1 12452934 VABUEOISHKNWFU-UHFFFAOYSA-N 384.871 2.816 0 50 GFAA O=C([C@@H]1C[C@H](COc2cccnc2)CN(Cc2ccc(O)cc2)C1)N1CCCC1 14540766 VFAUZBDTGHYWFH-VQTJNVASSA-N 395.503 2.927 0 50 GFAA COCCNC(=O)c1sc2ncnc(NCc3ccccc3OC)c2c1C 15009185 LYRPFBSSFJWZAL-UHFFFAOYSA-N 386.477 2.997 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCC(C2CCNCC2)CC1 1857666800 IPWYGGCFCSZQGL-UHFFFAOYSA-N 378.900 2.892 0 50 GFAA O=C(Cn1cccn1)N1CCCOc2cccc(c2)CC[C@H]2CCCCN2CC1 1857697093 VDILRWSJWKWPSC-OAQYLSRUSA-N 396.535 2.982 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)C3CCCCC3)CC(=O)N2[C@H]1c1ccccc1 1857718878 XYSNMKFJMHCBTB-BJLQDIEVSA-N 384.476 2.540 0 50 GFAA O=C(c1ccc2c[nH]nc2n1)N1CCC2(CC1)C[C@@H](O)C[C@H](c1ccccc1)O2 1857737974 LXMAZUXNXJWVIY-PKOBYXMFSA-N 392.459 2.845 0 50 GFAA CN1CC[C@@](C)(C(=O)N2CCC(C3CCN(Cc4cccnc4)CC3)CC2)C1 1857739529 MQLIMPOMTAKEQH-HSZRJFAPSA-N 384.568 2.874 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1cccc3c1OCO3)CC2 125913540 DJCBDYLDXMCZAO-LLVKDONJSA-N 393.365 2.954 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 267466412 NNKVBJMSUCZBSX-PKOBYXMFSA-N 383.448 2.567 0 50 GFAA O=C(c1sc(N2CCCC2)nc1Cl)N1CC[C@](CO)(C2CCOCC2)C1 1875297010 ZAGXZKAABOPIHI-SFHVURJKSA-N 399.944 2.648 0 50 GFAA O=C(NC[C@H](O)CCc1ccccc1)N[C@H]1Cc2n[nH]cc2[C@@H](C(F)(F)F)C1 1875276632 KHWTVYWLGGZDAI-FMKPAKJESA-N 396.413 2.663 0 50 GFAA C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1c[nH]nc1C(=O)NC1CC1 1875298730 LQNREMYRRGKRAV-VIFPVBQESA-N 382.342 2.727 0 50 GFAA C[C@H]1C[C@H](O)CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1 1875312021 GFLHHBILDTWDDO-NWDGAFQWSA-N 383.370 2.830 0 50 GFAA CCn1cc(Br)c(=O)c(NC(=O)N2CCN(C(C)(C)CC)CC2)c1 888102101 ATLTYTYABXWYSC-UHFFFAOYSA-N 399.333 2.969 0 50 GFAA CS(=O)(=O)c1cccc(OCc2nc(-c3cccc(-c4nc[nH]n4)c3)no2)c1 2325736118 ASIXOVANXQLJJL-UHFFFAOYSA-N 397.416 2.504 0 50 GFAA CN(C)S(=O)(=O)c1ccccc1CNC(=O)NCc1ccccc1C1CC1 2325768344 HCWHYRSMVHWSDV-UHFFFAOYSA-N 387.505 2.814 0 50 GFAA Cn1ncc(C2CC2)c1C(=O)N1CC2(CCN(C(=O)[C@]3(C)C[C@H]4CC[C@H]3C4)C2)C1 2325793995 NQNFWRNPDOBRSI-GIMINZRKSA-N 396.535 2.798 0 50 GFAA N[C@@H]1CCn2ncc(C(=O)Nc3cnc4ccc(Br)cc4c3)c2C1 2325856416 PAHRVRCXZOJESA-GFCCVEGCSA-N 386.253 2.720 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)Nc3cccc(F)c3)CC2)n1 21795088 TXYUGSQZOZYSQZ-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC[C@H](CO)C3)nc2)cc1 67982509 WUGCSEFMDNUVJP-SFHVURJKSA-N 383.492 2.662 0 50 GFAA Cc1ccccc1-c1c[nH]nc1C1CCN(C(=O)CN2CCC[C@H](O)C2)CC1 67818315 MVLWDNJNNVVXLX-SFHVURJKSA-N 382.508 2.548 0 50 GFAA O=C(NCc1cc(C(F)(F)F)ccc1F)c1cc(CN2CCOCC2)on1 20450877 NLRVMGOLDFWFGG-UHFFFAOYSA-N 387.333 2.595 0 50 GFAA CC[C@H](C)C(=O)NCc1nnc2n1CCN(Cc1cccc3cccnc13)CC2 20997501 FDZUVOREPRJHPY-INIZCTEOSA-N 392.507 2.547 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)N1CCC[C@@H](c2nnc(O)o2)C1 328591331 DNQJVYJLRAZRGM-LLVKDONJSA-N 389.362 2.567 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)Nc3cccc(F)c3C)nn2)n1 65363512 OIAUBUBZVQDZRF-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)N1CCN(Cc2cccnc2)CC1 66344477 WINHKSBYGIPHIN-LJQANCHMSA-N 397.498 2.574 0 50 GFAA COc1cc(/C=C/CN2CCN(Cc3ccccc3)[C@H](CCO)C2)ccc1O 39515701 RQRRXNZSFSKRMN-WKOQKXSESA-N 382.504 2.983 0 50 GFAA Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NCC1CCS(=O)(=O)CC1 252503352 VBXUSCYJHRELHH-OAHLLOKOSA-N 390.509 2.747 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccccc3Cl)[C@H]3CS(=O)(=O)C[C@H]32)o1 72420196 QAXPGDWVAFNTAW-RBUKOAKNSA-N 394.924 2.725 0 50 GFAA CCc1nc(CN2CCC3(CC2)CC(=O)N(Cc2cccc(OC)c2)C3)no1 77337679 KXJYXCUCHLMBOG-UHFFFAOYSA-N 384.480 2.655 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N3CCO[C@H](C(C)(C)C)C3)CC2)oc1C 363948454 RGSPPAOGBUECOE-SFHVURJKSA-N 392.544 2.960 0 50 GFAA CCc1nc(C)c(CC(=O)NCc2cc(F)cc3c(C)c(CC)[nH]c23)c(=O)[nH]1 71750928 SOCONOWIYFKYOM-UHFFFAOYSA-N 384.455 2.991 0 50 GFAA CC(C)NC(=O)N1CCC(n2cc(CN3CC[C@@H]3c3ccccc3)nn2)CC1 82039438 MFOUMSCOGXYDND-HXUWFJFHSA-N 382.512 2.980 0 50 GFAA Cn1c(CN2CCOCC2)nnc1C1CCN(C/C=C/c2ccccc2)CC1 96130652 JFUCVKQDKCDEBF-VMPITWQZSA-N 381.524 2.540 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c1 91575392 DTFKHXLUAPADGT-JOCHJYFZSA-N 382.508 2.866 0 50 GFAA Cc1noc2ncnc(N3CCC[C@H](c4nccn4Cc4cccnc4)C3)c12 91908427 WHCQBEHFQXRLIJ-INIZCTEOSA-N 375.436 2.950 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)NCCc1csc(-c3cnccn3)n1)CO2 91997120 RPVDGPFORMIAIP-AWEZNQCLSA-N 396.472 2.519 0 50 GFAA CCOCCOc1c(Cl)cccc1NC(=O)c1cn(C2CCNCC2)nn1 236939905 XDLPXZHEFIXVOM-UHFFFAOYSA-N 393.875 2.524 0 50 GFAA Cc1nc(CN2C(=O)N(CCc3ccccc3)C3(CCNCC3)C2=O)cs1 95373669 FLPHMBVTKMAXSS-UHFFFAOYSA-N 384.505 2.581 0 50 GFAA CCN1CC2(CCN(Cc3nc(COC)no3)CC2)C[C@H](c2ccccc2)C1=O 96152854 IFNLGUFKDWXYTP-GOSISDBHSA-N 398.507 2.834 0 50 GFAA CN(C)C(=O)c1ccc(CN[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)[nH]1 267627678 MVOCDSWJZXOJFX-CQSZACIVSA-N 396.413 2.984 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)N[C@H]2CC[C@H](O)CC2)CC1 244564040 CLLYGYFRSIATEE-WKILWMFISA-N 394.899 2.763 0 50 GFAA CCc1nc(C(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)nn1-c1ccccc1Cl 184530009 GKILMDDKKXPLBZ-UHFFFAOYSA-N 396.838 2.583 0 50 GFAA CCN1CCC(CNC(=O)N(Cc2ccncc2)CC(C)C)(N(C)C)CC1 534664629 IBRUWBIZTLACPJ-UHFFFAOYSA-N 375.561 2.665 0 50 GFAA Cc1ccc(-c2nc(NC(=O)C[C@H]3C(=O)N(C)C(=O)N3C)sc2C)c(C)c1 1940197766 OXMZZOKWKFFLCW-AWEZNQCLSA-N 386.477 2.956 0 50 GFAA CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)NCCc1ccc2c(c1)CCO2 190230653 FQEKJNHNYBSDFE-HKUYNNGSSA-N 384.480 2.600 0 50 GFAA C[C@H]1CCc2ccccc2N1S(=O)(=O)NC(=O)[C@@H]1CCC(=O)c2ccccc21 793141496 OEABNPSLQULDES-KBXCAEBGSA-N 398.484 2.949 0 50 GFAA COc1cc(OC)c2nc(N3CCN(c4cc(C)nc(N)n4)CC3)cc(C)c2c1 1704302478 MKHKRNXSKBRJEA-UHFFFAOYSA-N 394.479 2.568 0 50 GFAA CC(=O)N1CC[C@]2(C1)Cn1c(nnc1-c1csc(-c3ccccc3)n1)CO2 1772710138 OTGXAWYYTGRRNU-IBGZPJMESA-N 381.461 2.590 0 50 GFAA O=C(CN1C[C@H]2CNC[C@@]2(CCc2ccccc2)C1)N1CCc2ccccc21 1772804339 MYBBYXLZWSIGAQ-QPPBQGQZSA-N 375.516 2.730 0 50 GFAA O=S1(=O)CC[C@H](N(c2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)C1 5034310 WDONHTBMVAJOQW-HNNXBMFYSA-N 385.894 2.722 0 50 GFAA Cc1nccn1CCN(C)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 12316324 SHBVZPSJFGPJCT-UHFFFAOYSA-N 393.557 2.504 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)CCCCC1 12593979 FQNSFQDAFPNDCX-KRWDZBQOSA-N 375.557 2.938 0 50 GFAA Cc1ccc(F)c(CN[C@H]2C[C@H]3C(=O)N[C@@H](CC4CCCCC4)C(=O)N3C2)c1 14749027 NFTRKBIVZWFLNX-IHPCNDPISA-N 387.499 2.662 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3nc4ccccc4[nH]3)CC2)C1 15061572 PDPBXNFPOCWDAZ-INIZCTEOSA-N 381.524 2.518 0 50 GFAA O=C(NCC[C@@H]1COc2ccccc2O1)c1cn(Cc2ccc(Cl)cc2)nn1 15074712 PBKCQLFXQZEBHB-MRXNPFEDSA-N 398.850 2.940 0 50 GFAA O=C1C[C@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1CCc1ccccc1 18197279 AIXQBKIXOBZQGQ-FQEVSTJZSA-N 397.906 2.832 0 50 GFAA CCN1C[C@@H](CNC(=O)c2csc3nc(-c4ccc(F)cc4)cn23)CC1=O 19731982 ZNTORYMEWOFYMV-GFCCVEGCSA-N 386.452 2.800 0 50 GFAA COc1ccc(CN2CCC(N3C[C@@H](C)O[C@H](C)C3)CC2)c(OC)c1OC 19888862 XSGXJXLAXIQGNN-HZPDHXFCSA-N 378.513 2.786 0 50 GFAA O=C(c1ccoc1)N1CC[C@@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169778004 SUEFXFRKBUHTCA-OAHLLOKOSA-N 376.376 2.675 0 50 GFAA Cc1nc(C(=O)N(Cc2cccc(F)c2)C(C)C)nc(N2CC[C@@H](N)C2)c1C 1857529739 OVCADAVPRDIEDH-GOSISDBHSA-N 385.487 2.821 0 50 GFAA COC(=O)N1CCCC[C@@H]1C(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857674043 PDHFBXCBAMOTJL-GOSISDBHSA-N 382.464 2.625 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)COC[C@H]1CCCCO1)CC2 1857674907 CQWSHIVCOWDRJC-GOSISDBHSA-N 383.492 2.600 0 50 GFAA O=C(C1CCCC1)N1CCC[C@]2(C1)CN(c1ncc(Cl)cn1)CC[C@H]2O 1857686895 GWPKRUQSZOBVEZ-APWZRJJASA-N 378.904 2.500 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cnn(-c4ccccn4)c3C)C[C@H]12 1857696857 OKPSARAUZWLCCS-QQDKQVRDSA-N 394.475 2.649 0 50 GFAA CC[C@]1(C(=O)N2CCCCC2)C[C@H]2CC[C@@H]1N2C(=O)c1cnc2cccnn12 1857709852 VALDPKOCVVPAJO-KUDFPVQQSA-N 381.480 2.515 0 50 GFAA CCN=c1ncc(-c2nccn2[C@H]2CC(=O)N(c3ccccc3Cl)C2)c[nH]1 1857719690 RNOHBJJUQZRSEF-AWEZNQCLSA-N 382.855 2.825 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cccc(-n4cccn4)c3)C1)CC2 1857728487 DBWUONFCOPSIOS-QFIPXVFZSA-N 389.459 2.797 0 50 GFAA COCCCn1c(C(=O)N2CCCC[C@H]2C)cc2c(=O)n3ccccc3nc21 5244274 NWSPVRIEKWGIHI-OAHLLOKOSA-N 382.464 2.700 0 50 GFAA CN(Cc1ccccc1)C(=O)CCN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)O)C1 248061486 QDZSGTOANHYOLO-UXHICEINSA-N 384.451 2.974 0 50 GFAA Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N2CCC[C@@](C)(O)C2)cc1 134118548 FZMVUJVRQVVESD-JOCHJYFZSA-N 377.444 2.681 0 50 GFAA COc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)c(OC(F)F)c1 364505549 XDHBNAWADKLVTE-CQSZACIVSA-N 397.399 2.945 0 50 GFAA C[C@H](NC(=O)c1cccn1CCN1CCOCC1)c1ccc(C(F)(F)F)nc1 913807330 DJHHSWKFSJZLQH-AWEZNQCLSA-N 396.413 2.725 0 50 GFAA Clc1cncc(OC2CCN(c3cc(OC4CCOCC4)ncn3)CC2)n1 1875286993 QFPFSCQFONXBME-UHFFFAOYSA-N 391.859 2.526 0 50 GFAA CCN1CCC(N2CCC(C(=O)N3CCc4cc(O)c(C)cc4C3)CC2)CC1 1875295840 SEWCKAOGIILVFL-UHFFFAOYSA-N 385.552 2.782 0 50 GFAA O=C(CN1CCN(CC2CC2)c2ccccc21)N[C@@H](Cc1ccccc1)C(=O)O 1875258518 PJKHGSPYLFSIRM-IBGZPJMESA-N 393.487 2.535 0 50 GFAA C[C@@H]1CN(C(=O)c2cccc3c[nH]nc23)C[C@H]1NC(=O)c1coc(C2CCC2)n1 1875333906 PIMBGNUBQWUJQV-MLGOLLRUSA-N 393.447 2.709 0 50 GFAA Nc1ccnc2c1CN(c1ccnc(-c3cncc(Br)c3)n1)CC2 1875328107 YWCDIMFNOUOBLT-UHFFFAOYSA-N 383.253 2.841 0 50 GFAA C[C@@H]1CN(C(=O)COCc2ccccc2)CC[C@H]1NC(=O)Cc1ccccc1F 1875324783 BANUMZSTFGPSMR-DYESRHJHSA-N 398.478 2.938 0 50 GFAA COc1cccc(CN[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)n1 1875399158 QMECXLIHOFVRTR-NSISKUIASA-N 378.476 2.883 0 50 GFAA O=C([C@@H]1CCC[C@H](CC(F)(F)F)C1)N(CCc1nn[nH]n1)Cc1cccnc1 2325808219 GKIDLLFPAPUTRI-DZGCQCFKSA-N 396.417 2.925 0 50 GFAA O=C(NCc1cccc2c1CCNC2)Nc1ccc(=O)n(Cc2ccccc2)c1 2325858819 BWKSNNZCZCCKMU-UHFFFAOYSA-N 388.471 2.864 0 50 GFAA Cn1c(Oc2ccccc2)nc2c1c(=O)n(Cc1ccc(Cl)cc1)c(=O)n2C 1127203 OEOIKDGNIRWYHS-UHFFFAOYSA-N 396.834 2.928 0 50 GFAA COc1c(F)cccc1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356135666 ODXDFCWFCYSDFT-NRFANRHFSA-N 384.455 2.811 0 50 GFAA COc1ccc(Cn2cc(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)cn2)cc1 109209691 LFVZCUVXIWZFFJ-LJQANCHMSA-N 381.436 2.568 0 50 GFAA Cc1cc(C)n(-c2cccc(CN3CCC(n4cc([C@@H](C)O)nn4)CC3)c2)n1 23619451 VYIXJTAESIUJLZ-QGZVFWFLSA-N 380.496 2.971 0 50 GFAA COc1cccc(N2C(=O)C[C@@H](SCC(=O)Nc3ccc(F)cc3)C2=O)c1 100632990 JLCGOHYNMBMVSG-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA CN(CCC(N)=O)c1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cn1 67885016 MMMSUEDEAOIZGR-GOSISDBHSA-N 380.492 2.803 0 50 GFAA CCCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCc1ccncc1)C2 20906352 VJNBYQZNOJXZSF-GOSISDBHSA-N 381.524 2.961 0 50 GFAA C[C@@H](C(=O)N1CCC(c2[nH]ncc2-c2cccc(F)c2)CC1)N1CCCC1=O 67842956 CHADPNLBIIRKMD-AWEZNQCLSA-N 384.455 2.933 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)CC2)cn1 328655246 YFNBYISWLHOBHH-QGZVFWFLSA-N 382.512 2.715 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(NCc2ccc([S@](C)=O)cc2)n1 328621676 AQIRTEWAHVOWSL-QMALHXIISA-N 388.537 3.442 0 50 GFAA CCCN1CCN(C[C@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)CC1 67694647 OVERTRPUXAPUEI-HSZRJFAPSA-N 387.568 2.691 0 50 GFAA Cn1c(C(=O)N2CC3(CCNCC3)C[C@H]2C(=O)O)cc2c(Cl)cccc21 72147901 YIUQZDORNFURAU-INIZCTEOSA-N 375.856 2.501 0 50 GFAA CCO[C@H]1[C@H](NC(=O)CCc2cccnc2)c2ccccc2C12CCNCC2 72165713 USGDDSRLDGXHHO-YADHBBJMSA-N 379.504 2.912 0 50 GFAA CCOCCCNC(=O)c1cn(C)nc1[C@H]1CCCN(C(=O)OC(C)(C)C)C1 253392635 RWIBCXAABRILPQ-HNNXBMFYSA-N 394.516 2.691 0 50 GFAA Cn1cc(C[C@@H]2CCN(C(=O)NCc3cccc(CN4CCCC4)c3)C2)cn1 363585814 DZFGUBQTDIUPAP-FQEVSTJZSA-N 381.524 2.790 0 50 GFAA O=C(NCCc1nc2c(s1)CCCC2)N[C@@H]1CCN(c2ncccc2F)C1 130593197 AGLRMTCRAMPTPB-CYBMUJFWSA-N 389.500 2.677 0 50 GFAA Cc1noc([C@H]2COCCN2C(=O)Cc2csc(-c3cccc(F)c3)n2)n1 155368843 VWZNHXHCSQOEHO-OAHLLOKOSA-N 388.424 2.783 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3ccnc(N4CCCC4)n3)CC2)c(C)c1 72116054 AKEBQIZWFWAKBA-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCC(CO)(C[C@@H]2CCCCO2)CC1 13593518 NRUNYIORGZCADK-INIZCTEOSA-N 376.453 2.981 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCCN2CCc3sccc3C2)cc1 173761106 YDKITJYPBFOEGX-LJQANCHMSA-N 397.544 2.722 0 50 GFAA COc1cccc(NC(=O)CN(C)Cc2nc([C@H](C)OCC(C)C)no2)c1 173925522 WFTSYFFCKZDYCI-AWEZNQCLSA-N 376.457 2.882 0 50 GFAA Cc1cc(CN2CCC[C@@H]2c2ccc(C(=O)NCCc3cnc[nH]3)s2)n[nH]1 20542304 QBCLUTQZWNMNTJ-MRXNPFEDSA-N 384.509 2.812 0 50 GFAA Cc1nn(-c2ccccn2)c(C)c1CC(=O)NC[C@H]1CCCN2CCCC[C@H]12 225420515 BIYBBESDDGXOLM-UYAOXDASSA-N 381.524 2.807 0 50 GFAA biogenic COc1ccc(C(=O)N2CCC([C@@H](O)c3cccs3)CC2)cc1OCCN 426478163 UCURIKVEUGBARF-LJQANCHMSA-N 390.505 2.680 0 50 GFAA CCCOc1ccc(-c2cccc(C(=O)N(C)[C@@H](C)C(=O)NC)c2)cc1CO 426494674 SCDUDRJCCDTKHC-HNNXBMFYSA-N 384.476 2.841 0 50 GFAA Cc1cc2c(cc1NC(=O)N1CCCN(C(=O)c3ccco3)CC1)OCCO2 97217609 GJOIFVUQFAKTRC-UHFFFAOYSA-N 385.420 2.739 0 50 GFAA Cn1cncc1-c1ccc(C(=O)NC[C@@H]2CCCN(c3ncccn3)C2)cc1 426405747 PUAMNPWICJRXJR-INIZCTEOSA-N 376.464 2.524 0 50 GFAA O=C(O)CC[C@@H]1CN(Cc2ccc3ncccc3c2)CC[C@@H]1N1CCOCC1 91321835 MXTVAEQLKUBGOD-CTNGQTDRSA-N 383.492 2.622 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)[C@@H]3CCCCN3Cc3nncn3C)c2)s1 95497063 RCCXRXUMECJWFK-INIZCTEOSA-N 397.508 2.635 0 50 GFAA CC[C@@H](O)Cn1nc(-c2cccnc2)nc1-c1cn(C)c2ccccc2c1=O 95386764 YZVQEWXUVMGAGH-OAHLLOKOSA-N 375.432 2.630 0 50 GFAA Cc1ccc(CC(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)cc1 91321216 AVTSUMQJTWGYJZ-HXUWFJFHSA-N 384.520 2.948 0 50 GFAA CC(C)[C@@H](NCc1ncc(-c2ccccc2Cl)o1)C(=O)N1CCOCC1 180057718 NAUJDNRKCJRJCC-GOSISDBHSA-N 377.872 2.968 0 50 GFAA Cc1nn(C)cc1CN1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95379062 OEPQEMIAVNXKEU-VLCRHTCISA-N 380.492 2.519 0 50 GFAA CCN(Cc1noc(CC(C)C)n1)C(=O)CN1C(=O)CSc2ccccc21 95523312 SQCUISJDPJYEPT-UHFFFAOYSA-N 388.493 2.756 0 50 GFAA COCCC[C@@]1(C(=O)O)CCCN(C(=O)c2cc3c(cc2OC)CCC3)C1 92028988 DOSIOKQLAOLIGN-NRFANRHFSA-N 375.465 2.918 0 50 GFAA CNc1nnc(CC(=O)NCC2CCN(Cc3ccccc3Cl)CC2)s1 183564186 NAVNPEXBYBTCIL-UHFFFAOYSA-N 393.944 2.804 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccc(F)cc1 299750028 MLKLDDJTKXFQDJ-CQSZACIVSA-N 392.818 2.815 0 50 GFAA COc1ccc(CN2C(=O)[C@@H](CC(=O)NCCC3=CCCCC3)N=C2O)cc1 252536955 JXNSFCPUCKVEFT-GOSISDBHSA-N 385.464 2.717 0 50 GFAA CCCn1cc(S(=O)(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)cn1 670443796 KBFZOPBWCKYGSB-UHFFFAOYSA-N 381.889 2.734 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)Nc1ccc(NC(=O)CN2CCCCC2)cc1 952962872 IPLPBLNMYHQNFH-UHFFFAOYSA-N 396.491 2.679 0 50 GFAA Cc1[nH]nc(C(C)C)c1-c1ccc(C(=O)N2CC[C@H](CN(C)C)[C@@H](O)C2)cc1 1565506332 AFFJYIKLFDBEGI-MOPGFXCFSA-N 384.524 2.893 0 50 GFAA COc1cc(CCC(=O)N2CCC[C@@H]2C(=O)O)ccc1OCC(F)(F)F 269090290 SBRJCKSUWDCCLG-GFCCVEGCSA-N 375.343 2.645 0 50 GFAA Cc1ccc(N2CCC[C@@H](NS(=O)(=O)Cc3noc4ccccc34)C2=O)cc1 185851113 XIGLDMYIOVSQMF-QGZVFWFLSA-N 399.472 2.751 0 50 GFAA Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1ccc(N2CCCC2)nn1 170803722 ABBBGAPOLOLECS-UHFFFAOYSA-N 379.424 2.558 0 50 GFAA COc1ccc(C(=O)N2CCC(C(=O)N3CCn4cccc4[C@H]3C)CC2)cc1 1506406952 KXYAYPCPUMIGMW-MRXNPFEDSA-N 381.476 2.952 0 50 GFAA O=C(c1ccncc1)N1CCC(NC[C@H]2CCN(c3ccc(F)cc3)C2)CC1 1506399027 WPHGWGYJEZIEFR-QGZVFWFLSA-N 382.483 2.941 0 50 GFAA Cc1cccc(CN2C[C@H]3CN(CCOc4ccc(F)cc4)C[C@@]3(CO)C2)c1 1772807463 NVAATZAAWPJKFW-OFNKIYASSA-N 384.495 2.939 0 50 GFAA COc1cc2c(cc1OC)CN([C@@H]1CCCN(C(=O)c3ocnc3C)C1)CC2 12588782 CSSWYKPOBDPXOU-QGZVFWFLSA-N 385.464 2.663 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 12716524 NBTOPOWWIFMTEZ-QGZVFWFLSA-N 380.492 2.611 0 50 GFAA COc1ccccc1[C@@H]([C@H](O)C(=O)c1c[nH]c2ccccc12)N1CCOCC1 15017550 RBTFANDLWWTNGH-UNMCSNQZSA-N 380.444 2.794 0 50 GFAA O=S(=O)(NC[C@H]1CCCN(Cc2cccnc2)C1)c1cccc2cccnc12 15077999 FSIINLKDUCXJKG-GOSISDBHSA-N 396.516 2.820 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(-c4noc(-c5ccccn5)n4)c3CO2)cc1 169769089 AAMDDGFWWCWRDE-INIZCTEOSA-N 376.376 2.670 0 50 GFAA CCCNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)c1cnccn1 1857667998 FXCUDRPNAJYHDW-LRXVAGHRSA-N 378.476 2.609 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)CCN1CCCCCC1=O)CC2 1857679573 NHHXADNGQMIYJQ-UHFFFAOYSA-N 394.519 2.807 0 50 GFAA Cc1ccc2oc(N3CCC(c4nc(C)nn4-c4cnn(C)c4)CC3)nc2n1 1857682498 QWUZRADAHNOKRX-UHFFFAOYSA-N 378.440 2.538 0 50 GFAA CCN=c1ccnc(N2CCC[C@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)[nH]1 1857686567 BZNMWOGYMFIOGQ-NRFANRHFSA-N 382.512 2.608 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)ccn1 1857687639 XMSWMUOQSCPOOW-OAQYLSRUSA-N 380.448 2.583 0 50 GFAA O=C1C[C@H](NC(=O)c2cc3c(s2)C2(CCNCC2)OCC3)c2ccccc2N1 1857699608 VXTUYTGLIJAYHM-INIZCTEOSA-N 397.500 2.713 0 50 GFAA Cc1ncsc1CCN(C)C[C@]1(O)CCCN(C(=O)CCC(F)(F)F)C1 1857729420 ZZUYAQCEWYAHMR-MRXNPFEDSA-N 393.475 2.622 0 50 GFAA O=C(Cc1cccc(F)c1F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857733393 IXVZMRUMDNNVGY-HMFYCAOWSA-N 398.409 2.808 0 50 GFAA Cc1c(CCNC(=O)[C@H]2C[C@H](N)[C@@H](O)C2)c2ccccc2n1-c1ccccc1 1857737754 BCVBVWNOCKIGGX-BUKVSMQUSA-N 377.488 2.696 0 50 GFAA O=C(O)c1cc(S(=O)(=O)NC[C@H](c2ccco2)N2CCCC2)ccc1Cl 232752943 HXDDXYCWPGNZNB-OAHLLOKOSA-N 398.868 2.747 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@H](C)[C@@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237346568 ISRIKHAUGJGJAT-CXAGYDPISA-N 385.464 2.661 0 50 GFAA O=C(O)CCN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1)C1CCOCC1 238080210 KGTRXWLBEPKCNF-UHFFFAOYSA-N 377.828 2.622 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2cccc(-c3nnc(C)o3)c2)C1=O 163805676 JWPXAOVDWBIYCL-INIZCTEOSA-N 392.415 2.589 0 50 GFAA C[C@@H](NC(=O)C(=O)N[C@H]1C[C@H]2C=C[C@H]1CC2)c1ccc(-c2cncnc2)cc1 1875271407 FNOQEZABRPAZKR-QIJLZVCCSA-N 376.460 2.792 0 50 GFAA O=C(N[C@@H]1C(=O)NCc2ccccc21)c1ccc(Cl)cc1N1CCCC1=O 1875321011 QTRRGVFLGLCPRX-SFHVURJKSA-N 383.835 2.568 0 50 GFAA O=C1CCCCN1[C@@H]1CCCN(c2ncnc3c2cnn3-c2ccccc2F)C1 892492039 JWMBUPQSJAUDNS-OAHLLOKOSA-N 394.454 2.936 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2cnn(-c3ccccc3C)c2)C1=O 2100482742 VUSUUWXXEOXJJY-QFIPXVFZSA-N 382.508 2.784 0 50 GFAA Cc1cc(-c2nc(-c3ccccc3)nn2[C@@H]2CCS(=O)(=O)C2)nn1C(F)F 2100544998 NOMZCWCLBWOZSQ-CYBMUJFWSA-N 393.419 2.872 0 50 GFAA Cc1cc(=NC(=O)C(=O)NC2(Cc3ccc(Cl)cc3Cl)CCC2)[nH]o1 2325798732 UONJNPKMMKPBQA-UHFFFAOYSA-N 382.247 2.932 0 50 GFAA Cc1[nH]nc2c1CC[C@H](NC(=O)N[C@@H]1CN(Cc3ccccc3)C(C)(C)C1)C2 2325828446 HPZQGXBTEGBSDI-ROUUACIJSA-N 381.524 2.928 0 50 GFAA O=C(Nc1ccccc1F)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1 1118891 NSJAXBCYBWICAS-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA CC(=O)NCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1 1198772 OBIRRVNCMZECIX-UHFFFAOYSA-N 375.222 2.755 0 50 GFAA COc1cc(-c2o[nH]c(=NCCn3cc(Cl)cn3)c2C(=O)O)ccc1F 2356138601 OXVWGEGZYQTGTN-UHFFFAOYSA-N 380.763 2.571 0 50 GFAA COCCNC(=O)c1cc2nc3c(c(C(F)(F)F)n2n1)CCc1ccccc1-3 2474663 JQCVMQDNIPZPQR-UHFFFAOYSA-N 390.365 2.890 0 50 GFAA CCOc1ccc(CC(=O)N2CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C2)cc1 2356158261 GKBKFZKEIPTPIK-WIYYLYMNSA-N 377.481 2.728 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 100394896 CLGNYRFBYDAFII-STEAMIEHSA-N 398.459 2.612 0 50 GFAA C/C(=C\C(=O)N1CCOC[C@@H]1c1noc(-c2cnn(C)c2)n1)c1ccccc1F 222232887 RISATRIQTWLYCY-JZUUQJBKSA-N 397.410 2.613 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](N3CCCc4ccccc43)C2=O)cc1 101270583 HMHVFVKTNCWSGB-IBGZPJMESA-N 378.428 2.948 0 50 GFAA CSc1nc(-c2ccco2)nc(C)c1C(=O)N1CC[S@@](=O)C[C@@H](C)C1 225460939 PTPLDUYCFQSIFC-JPQMIFPKSA-N 379.507 2.608 0 50 GFAA Cn1cnc2cc(C(=O)N(Cc3ccsc3)C[C@H]3CCCO3)ccc2c1=O 55254197 QQOZKFKEUAXEGQ-MRXNPFEDSA-N 383.473 2.816 0 50 GFAA Cc1ccc2c(c1)cc(C(=O)N(Cc1cccnc1)C[C@@H]1CCC(=O)N1)n2C 102560560 NPCOBDPTCORVIB-SFHVURJKSA-N 376.460 2.803 0 50 GFAA Cc1cccc(-c2ccc(C(=O)N3CCC[C@H](Cn4cc(CN)nn4)C3)o2)c1 20599694 WZAPNLGZRVESFI-INIZCTEOSA-N 379.464 2.858 0 50 GFAA COc1ccccc1N1CCN(C[C@H](O)COc2ccc3c(c2)CCC3)CC1 20109544 DXKJLDCDDBTGGS-FQEVSTJZSA-N 382.504 2.746 0 50 GFAA Cc1c(C(=O)N2CCO[C@H](CN)C2)c(-c2ccccc2)nn1-c1ccccc1 20209613 PVUZUGGKHQCDNH-LJQANCHMSA-N 376.460 2.647 0 50 GFAA Cc1ccc(NC(=O)CN2N=N[C@@H]3C(=O)N(c4c(C)cccc4C)C(=O)[C@H]32)cc1 2787157 SPEMQPCIQJLGQZ-HKUYNNGSSA-N 391.431 2.544 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2scc3c2OCCO3)CCC(=O)N1CC1CC1 71388807 OIJPFPPLJNZTQJ-CQSZACIVSA-N 378.494 2.628 0 50 GFAA CN(CC(=O)OC[C@@H]1CC(=O)N(c2ccccc2)C1)C(=O)OCc1ccccc1 252485189 GOVXHVGWRWOPIV-GOSISDBHSA-N 396.443 2.851 0 50 GFAA CN(C)C(=O)[C@H](NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccccc1 328625380 DCBJTEQDFIEMQW-SUMWQHHRSA-N 380.414 2.883 0 50 GFAA Cc1ccc2nc(C)c(C(=O)N[C@@H]3CC(=O)N(CCc4ccccc4)C3)n2c1 72126424 LODRBHVMSVOEFC-GOSISDBHSA-N 376.460 2.525 0 50 GFAA Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(N2CCNC(=O)C2)nc1 173450214 WKWJRVXIBUHHQM-UHFFFAOYSA-N 385.493 2.693 0 50 GFAA CC(C)(C)c1ccc(C2(NC(=O)CN3CCS(=O)(=O)CC3)CCCC2)cc1 155274140 WYXUEMOMRQAWMU-UHFFFAOYSA-N 392.565 2.600 0 50 GFAA NC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1C(=O)O)c1cccc(Oc2ccccc2)c1 262718150 TVPOQCDASVAQIS-ZWKOTPCHSA-N 397.431 2.654 0 50 GFAA O=C(CCc1cccnc1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 72157459 KWNVJACHMZDKQS-MDNUFGMLSA-N 377.488 2.809 0 50 GFAA O=C1CC[C@]2(CCCN(c3ncnc4c3CCC4)C2)CN1Cc1ccncc1 72475904 COMWFGNNDPKWKS-QFIPXVFZSA-N 377.492 2.770 0 50 GFAA Cc1nc(-c2cccc(NC(=O)C(=O)NC3(c4ccccc4F)CC3)c2)n[nH]1 172314826 HDRQCLQJLSKQDO-UHFFFAOYSA-N 379.395 2.663 0 50 GFAA CCc1nc(NC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)sc1C 174351563 LOOMCYJXQXNUED-GFCCVEGCSA-N 375.498 2.956 0 50 GFAA Cc1nc(-c2ccccc2)oc1C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1 174552553 VZHHPLYLTLSQKI-KRWDZBQOSA-N 383.448 2.504 0 50 GFAA CC(C)NC(=O)CCN1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 426486539 WPHHMNKDAAQTJP-OAQYLSRUSA-N 393.478 2.694 0 50 GFAA Cc1noc(C)c1CO[C@@H]1COCC[C@H]1NC(=O)c1cc2ccccc2cn1 223185786 XRQXMEVEEWYQAP-UYAOXDASSA-N 381.432 2.944 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(OCC(N)=O)cc3)cc2)C1 426465531 XSDLPLKHSLDLRU-MRXNPFEDSA-N 382.460 2.716 0 50 GFAA O=C(Cn1nccc1[C@H]1CCCNC1)NCc1csc(Cc2ccccc2)n1 426698252 MHCQGZZAEKTRRD-KRWDZBQOSA-N 395.532 2.714 0 50 GFAA CCOc1ccccc1CCNC(=O)N1CCC(N2CCSCC2)CC1 426429092 RRJUPXAPHRWFEA-UHFFFAOYSA-N 377.554 2.851 0 50 GFAA CCOc1ccc(N([C@@H](C)C(=O)N[C@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 239425651 UXVVONRGSKLJCN-XSWJXKHESA-N 380.510 2.545 0 50 GFAA C[C@@H](Cc1ccc2c(c1)OCO2)c1cn(Cc2nnc3n2CCCCC3)nn1 91602359 RJBLGFAZKJZSQQ-AWEZNQCLSA-N 380.452 2.719 0 50 GFAA CNC[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)C1 178999489 PEWAMAGHBWDOHE-LPHOPBHVSA-N 389.499 2.679 0 50 GFAA COc1ccc(-n2ncc([C@H](C)NC(=O)CN3CCCCCC3=O)c2C)cc1 91746446 RYJCPCWLSMAYNR-HNNXBMFYSA-N 384.480 2.769 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1noc(-c3ccccc3)n1)CC2 91987354 HSZBPRPRTXVBKE-UHFFFAOYSA-N 398.507 2.978 0 50 GFAA CCn1cncc1CN1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91860418 ZNAIQZKAJILMBM-UHFFFAOYSA-N 381.524 2.745 0 50 GFAA COc1ccc(C2=NO[C@@H]3[C@H]4C[C@H]([C@@H]5C(=O)N(c6ccccc6)C(=O)[C@@H]54)[C@H]23)cc1 245255291 HCESIQRAMXQCCX-ZXFQQWAGSA-N 388.423 2.870 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3nccn4nc5c(c34)CCCC5)CC2)s1 263618825 VSGYGLBHZULCPB-UHFFFAOYSA-N 381.505 2.940 0 50 GFAA CSCc1noc(CNC(=O)Nc2ccc(N3C(=O)CC[C@@H]3C)cc2)n1 299791901 DKTMDARCXXBNAX-NSHDSACASA-N 375.454 2.770 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 827753148 XBCCTLNYIBRDAM-SFHVURJKSA-N 397.479 2.831 0 50 GFAA Cc1ccc(-c2ccc(CN3CCC(CNC(=O)[C@@H]4CCC(=O)N4)CC3)o2)cc1 828105375 IKQFRUDYCBIIDT-FQEVSTJZSA-N 395.503 2.862 0 50 GFAA C[C@@H](C(=O)Nc1ccc(CC(=O)NC2CC2)cc1)N1CCc2ccccc2C1 952963620 HMKOEIKOCIEPLJ-INIZCTEOSA-N 377.488 2.893 0 50 GFAA Cc1nc(C)c(C(=O)NCC2CCN(C(=O)Cc3c(C)noc3C)CC2)s1 952962104 AOCXEXYEEQKJQS-UHFFFAOYSA-N 390.509 2.576 0 50 GFAA O=C(CCc1ccsc1)N[C@H]1COCC[C@@H]1Oc1ccc(C(=O)O)cc1 1565527492 ZQFPPXRVTIGNES-IRXDYDNUSA-N 375.446 2.732 0 50 GFAA Cc1ccc2c(n1)OCCN2C(=O)c1occc1CS(=O)(=O)c1ccccc1 189136430 RXGPCBUSELDIAG-UHFFFAOYSA-N 398.440 2.996 0 50 GFAA COc1cccc2c1CCN(C(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1)CC2 193773719 WMFOCQSBDZICQB-SFHVURJKSA-N 387.524 2.700 0 50 GFAA Cc1cccc(=O)n1CCC(=O)N1CCCN(c2nc3ccccc3s2)CC1 1506400322 DNOFSZIZYAHTOI-UHFFFAOYSA-N 396.516 2.895 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC(c3ccnc(N)n3)CC2)c(Cl)cc1F 1506412483 DMMKUOMNQVPJTF-UHFFFAOYSA-N 384.864 2.728 0 50 GFAA O=C(c1ccc(N2CCC[C@H](COc3ccccc3F)C2)nc1)N1CCOCC1 1529191899 IOYHNOVPTQMHAL-KRWDZBQOSA-N 399.466 2.989 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN(Cc2cnn(C)c2C)CC1 11753642 JPPGWFGJOVWPJV-UHFFFAOYSA-N 398.507 2.673 0 50 GFAA COC(=O)CCCNC(=O)c1cc(COc2ccc(OC)cc2Cl)on1 12718305 ZCETWGATHLOGJW-UHFFFAOYSA-N 382.800 2.599 0 50 GFAA COC(=O)[C@@H](CCCNC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C 13438265 DWYSRIJWRASDRW-OAHLLOKOSA-N 380.441 2.759 0 50 GFAA CC(C)CNC(=O)[C@@H]1C[C@H](COc2cccnc2)CN(Cc2ccncc2)C1 14750997 WGNLPKSZDRUIKX-VQTJNVASSA-N 382.508 2.766 0 50 GFAA CCCOc1ccc2cc(S(=O)(=O)N3CCC(C(N)=O)CC3)ccc2c1 16649686 KOGNXHMRESNKQM-UHFFFAOYSA-N 376.478 2.515 0 50 GFAA CCCCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC(C(N)=O)CC1 16651169 PENCQJJXHKKYOK-UHFFFAOYSA-N 388.917 2.713 0 50 GFAA CCOC(=O)N1CCN(CCC(=O)Nc2ccc(Br)c(C)c2)CC1 19530623 DWEWFSCXMVTBNF-UHFFFAOYSA-N 398.301 2.860 0 50 GFAA O=C1c2c(-c3nc(-c4ccsc4)no3)nnn2CCN1Cc1ccccc1 169765700 SQJQSHSRDNDEOX-UHFFFAOYSA-N 378.417 2.713 0 50 GFAA Cc1ccc(N2CCC(N3CC[C@@H](O)[C@@]4(CCCNC4=O)C3)CC2)cc1Cl 1857685421 IVSZGDPBNPDBOV-TZIWHRDSSA-N 391.943 2.580 0 50 GFAA Cc1cncc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)CCC4CCCC4)C3)C2)n1 1857694306 KBQYNOWJFUPOOE-DENIHFKCSA-N 386.540 2.935 0 50 GFAA CC1(C(=O)N2CCC3(CC2)CN(Cc2ccncc2)C[C@@H]3C(=O)O)CCCC1 1857699306 LYSTVBWBGNCDND-GOSISDBHSA-N 385.508 2.787 0 50 GFAA COc1ccccc1Cc1nc([C@H]2C[C@@H](N)[C@H](O)C2)n(Cc2cccs2)n1 1857717056 VTCPNOHTHXPCSX-USXIJHARSA-N 384.505 2.553 0 50 GFAA Cc1nccc(N2C[C@@H]3[C@H](CNC(=O)c4cccc(F)c4C)[C@H]4CC[C@]3(C2)O4)n1 1857724546 HBBUEGZBFDKSCT-ODULNIPZSA-N 396.466 2.646 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857730628 XSEWKRXAKIFMOX-QFIPXVFZSA-N 378.476 2.894 0 50 GFAA COC(=O)[C@@H](NC(=O)[C@H]1CCCN(c2nc(C)c3ccc(C)cc3n2)C1)C(C)C 11977764 ZNHXJMFKUMUJMN-LPHOPBHVSA-N 398.507 2.777 0 50 GFAA COCc1ccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1 252487072 HRVVLDMFGHGWIB-KRWDZBQOSA-N 388.489 2.872 0 50 GFAA Cc1c(C(=O)N(C)[C@H]2CCSC2)nnn1-c1cccc(Br)c1 163454468 FBHCRMNKHHBWHG-ZDUSSCGKSA-N 381.299 2.916 0 50 GFAA CC(C)(C)OC(=O)N[C@H]1Cc2ccc(-c3cccc(S(N)(=O)=O)c3)cc2C1 863714111 WPINMUWWTHCEFQ-KRWDZBQOSA-N 388.489 2.993 0 50 GFAA O=C(Nc1ccc(C(F)(F)F)c(CC2COC2)c1)N1C[C@H]2COC[C@@H](C1)O2 888076750 XYYSEGJGDICTOO-GASCZTMLSA-N 386.370 2.526 0 50 GFAA CN(C(=O)[C@@H]1C[C@H]1C1CCC1)C1CCN(C(=O)c2cn(C)nc2C(F)F)CC1 1775997003 PZEKNUXCKZRXQQ-LSDHHAIUSA-N 394.466 2.857 0 50 GFAA CCOC(=O)c1cc(C(=O)N2CCC(Oc3ccc(Cl)cc3)CC2)[nH]n1 2325782192 CCDWLZYPJGBXOM-UHFFFAOYSA-N 377.828 2.923 0 50 GFAA Cc1c(C(=O)N[C@@H]2CC[C@H](NC(=O)c3cccs3)C2)c(C(F)F)nn1C 2325828966 WYTDHDSYEUCQBF-WDEREUQCSA-N 382.436 2.809 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(O)cc2)c(OC)c1 909850 KITVGDWOZLPHAA-SFHVURJKSA-N 383.404 2.676 0 50 GFAA COc1ccc(C(=O)NCc2ccccc2)cc1S(=O)(=O)N1CCCCC1 1360728 MMCGAIIJVUQTOE-UHFFFAOYSA-N 388.489 2.800 0 50 GFAA O=C(Cc1cccc(F)c1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356166225 XQNUEMSTHOERGV-WOIUINJBSA-N 388.483 2.655 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@H](C(=O)NC23CC4CC(CC(C4)C2)C3)C1 6746855 FMOXRGOADGUXDZ-AZRLCKCBSA-N 382.570 2.913 0 50 GFAA COC(=O)c1cnn(-c2ccc(C(=O)Nc3ccc(C(C)=O)cc3)cc2)c1N 8607006 RUORGQFHHLQJLF-UHFFFAOYSA-N 378.388 2.696 0 50 GFAA C[C@H](O)[C@](C)(CNC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1)Cc1ccccc1 225403344 YVQCGMVZYSTTEC-JLHGSKIFSA-N 393.491 2.647 0 50 GFAA O=C1NCCN1c1nc(CC(=O)n2cccc/c2=N\c2ccccc2)cs1 225546219 TYNKINJWCNNBDW-LTGZKZEYSA-N 379.445 2.590 0 50 GFAA CC(C)Cn1nc(C(=O)O)c2c1CCN(C(=O)Cc1ccc(O)c(Cl)c1)C2 67956246 ZSTAQEWBHCNLTA-UHFFFAOYSA-N 391.855 2.724 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C[C@@H]3CCOC(C)(C)C3)CC2)CC1 11949906 RKDNWBKGNJKMOU-HXUWFJFHSA-N 379.589 2.848 0 50 GFAA Cn1cc([C@@H]2[C@H](C(=O)N[C@H]3CCCc4occc43)CC(=O)N2C(C)(C)C)cn1 252571517 YCFFBLJUZJIMJZ-JTDSTZFVSA-N 384.480 2.895 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@H](c2nnc[nH]2)C1 252569081 VXWWGGDZCKRRML-HNNXBMFYSA-N 391.431 2.942 0 50 GFAA C[C@H](C(=O)O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 34927254 KRPGETIDKNWVIE-QMMMGPOBSA-N 382.301 2.632 0 50 GFAA COc1ccc(CNC(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)cc1 6894584 PJJHIZFRHDBSNB-HFXUHXBXSA-N 391.471 2.643 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)Nc1ccnn1C)CC2 328639899 PUDYGPHJARVKCC-INIZCTEOSA-N 387.509 2.917 0 50 GFAA Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc4[nH]nc(C(N)=O)c4c3)c12 124185815 POUDHKFEISQJKX-UHFFFAOYSA-N 378.392 2.882 0 50 GFAA Cc1cc2nc(C(=O)N(C)Cc3cnn(-c4ccc(F)cc4)c3)cc(C)n2n1 77406527 AAXDRJYWVHWFBY-UHFFFAOYSA-N 378.411 2.943 0 50 GFAA O=C1NCCN(C(=O)c2cc(C3CC3)on2)[C@@H]1c1ccc(C(F)(F)F)cc1 369760608 PYFBMXVYFQJZMT-OAHLLOKOSA-N 379.338 2.884 0 50 GFAA CCCN(C)C(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72133478 PRRBZISASFBUDM-QFIPXVFZSA-N 393.531 2.877 0 50 GFAA Cc1n[nH]c2ncc(NC(=O)c3ccccc3S(=O)(=O)N3CCCCC3)cc12 127226658 YXNGPZFJGRWODY-UHFFFAOYSA-N 399.476 2.693 0 50 GFAA O=C(CN1CCC[C@@H](C[C@H]2CCOC2)C1)Nc1cccc(C(=O)NC2CC2)c1 378395656 MBMYEEJPRYQQJC-DLBZAZTESA-N 385.508 2.656 0 50 GFAA O[C@@H](CN1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)C(F)(F)F 20218999 ZAUYCHGXFFHZGO-JTQLQIEISA-N 377.716 2.799 0 50 GFAA C[C@@H](NC(=O)CCn1cnc2ccccc2c1=O)c1nc2c(s1)CCCC2 223320727 IQXSKXCTZPESCA-CYBMUJFWSA-N 382.489 2.999 0 50 GFAA COc1ccccc1CN1CCN(C(=O)N[C@H](C)Cc2cccc(C)n2)CC1 426712786 QSLYSCBMHIZDJS-GOSISDBHSA-N 382.508 2.857 0 50 GFAA CCc1ocnc1C(=O)N1CCC[C@@H]1c1ccc(C(=O)N2CCOCC2)s1 19223616 MIHVLICHGKZXKR-CYBMUJFWSA-N 389.477 2.748 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)NCCc3nc(-c4cccnc4)no3)c2c1 426727320 DCTJZVQAEQLCTG-UHFFFAOYSA-N 375.388 2.666 0 50 GFAA Fc1ccc(-c2cnnc(NC[C@@H](c3cccnc3)N3CCOCC3)n2)cc1 19608743 CCQZKDAACAFPMG-IBGZPJMESA-N 380.427 2.558 0 50 GFAA O=C(c1ccnc(-c2cccc(C(=O)N3CC[C@@H](O)C3)c2)c1)N1CCCCC1 426673974 CTQDOJWIRWFGQC-LJQANCHMSA-N 379.460 2.582 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(c4ncccc4C(N)=O)C3)C2=O)c1 20600217 GGTCVPAEKFXNRB-QFIPXVFZSA-N 378.476 2.508 0 50 GFAA Cc1nc(O)c(C(=O)N2CCCN(C(=O)c3ccco3)CC2)c(C)c1Cl 426726705 FWWOVVYQZTZTIS-UHFFFAOYSA-N 377.828 2.639 0 50 GFAA Cc1nc(N(C)C)nc(-c2cccc(C(=O)N(C)Cc3cnn(C)c3)c2)c1C 426488421 QFWJRCGXHXQIHY-UHFFFAOYSA-N 378.480 2.832 0 50 GFAA Cc1nnc(N2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)c2ccccc12 95389083 XCUCHEJFNPRJQZ-INIZCTEOSA-N 388.479 2.696 0 50 GFAA CC(=O)c1cc(CN2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)cs1 95368904 HESBWIDBFGOUGM-MRXNPFEDSA-N 384.509 2.704 0 50 GFAA COc1cccc(N2CCN(C(=O)NC3Cc4ccccc4C3)[C@@H](C)C2=O)c1 426537721 OZMXTSUDZKKIML-HNNXBMFYSA-N 379.460 2.609 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc4occc4c3)C[C@H]2CCC(=O)O)CC1 92028911 WXERAYSYFRYLSC-UXHICEINSA-N 385.508 2.736 0 50 GFAA COc1ccc(NC(=O)N2CCN(Cc3ccoc3)[C@@H](CCO)C2)c(F)c1 96162793 BSRXEPVFMSDKTN-HNNXBMFYSA-N 377.416 2.528 0 50 GFAA CCN1CCN(C[C@H](O)COc2cccc(CN(C)CC(C)(C)C)c2)CC1 95512464 GQXFXYWZOTVPLY-FQEVSTJZSA-N 377.573 2.542 0 50 GFAA Cc1nnnn1-c1cccc(C(=O)N2CCC[C@H](c3nccn3C(C)C)C2)c1 95522119 QJMQUVXORVXSOI-KRWDZBQOSA-N 379.468 2.768 0 50 GFAA CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@H]2C[C@H]1/C(=C\OC)C(=O)OC 584578792 DAXYUDFNWXHGBE-QINKYPPPSA-N 384.476 2.700 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)Nc3ncn(C4CCCCC4)n3)CC2)CCO1 184550204 OAFVUZLLXVQDNL-HNNXBMFYSA-N 376.505 2.500 0 50 GFAA CCOc1ccccc1CN(C)C(=O)NCC1(N2CCN(C)CC2)CCCC1 534589116 GXTSRTDLJKOYIF-UHFFFAOYSA-N 388.556 2.787 0 50 GFAA Cc1cccc(OCCCCC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)c1 275558459 FNPYDEMYGDKUPY-GOSISDBHSA-N 397.523 2.649 0 50 GFAA CN(C)CCn1c(=O)oc2ccc(NC(=O)[C@H]3CCCc4cccnc43)cc21 194180556 FLUUCZORFAUVFA-INIZCTEOSA-N 380.448 2.610 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1C[C@H](Cc2ccc3ccccc3n2)[C@@H](O)C1 1616070929 HCFLEEBQRBPYOE-AVRDEDQJSA-N 392.503 2.580 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@H]32)n1 1529167684 MBVPNWHWUDUJPP-LRXVAGHRSA-N 380.492 2.835 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2ccc3nc(O)oc3c2)C[C@H](C2CC2)O1 1529150905 BBJZZVCPZKPOLP-CXAGYDPISA-N 380.466 2.892 0 50 GFAA CC(C)Oc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N[C@H](C)C(=O)O)cc1 2106095 ISVVUANIJIHQHR-JPVKTXQWSA-N 396.443 2.834 0 50 GFAA biogenic CCOCC(=O)N1C[C@H]2CN(c3ccnc(C)n3)C[C@]2(CCc2ccccc2)C1 1772815405 LGKXTDNTDSZHPO-NFBKMPQASA-N 394.519 2.719 0 50 GFAA CCOc1ccc(C(=O)N2C[C@@H]3CN(C(=O)c4cc[nH]c4)CC[C@@H]32)cc1OCC 1775982083 HICTZFBNZOUIGT-ROUUACIJSA-N 397.475 2.799 0 50 GFAA NC(=O)c1cncc(-c2cccc3c2O[C@@H](CNC(=O)[C@H]2CC=CCC2)C3)c1 11975849 IADRQNVMYYYNGS-KBXCAEBGSA-N 377.444 2.624 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@H](CNC(=O)[C@@H]2CCCCN2C)C3)n1 12048832 ASWPVLVKKWZZPD-KXBFYZLASA-N 398.482 2.804 0 50 GFAA CO[C@H](C(=O)NC[C@@H]1Cc2cc(-c3cnccn3)ccc2O1)c1ccccc1 12052657 JMMXOPQJNVNWPQ-RXVVDRJESA-N 375.428 2.951 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cc(COc2ccc3c(c2)CCCC3)on1 12092582 IRMNZNMIYKGZRT-INIZCTEOSA-N 390.505 2.976 0 50 GFAA Cc1cc(C(=O)Nc2sc3c(c2C(=O)N2CCOCC2)CCCC3)no1 13329051 NCYFHTPIELIAGK-UHFFFAOYSA-N 375.450 2.648 0 50 GFAA Cc1ccc(C)c(CN2CCN3C(=O)[C@H](CC4CCCCC4)NC(=O)[C@H]3C2)c1 14530694 XAEMABDROPCKER-LEWJYISDSA-N 383.536 2.785 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@H](NCc1ccccc1)C2 14743729 FVGMDPRSJZGYPE-IBGZPJMESA-N 389.503 2.875 0 50 GFAA Cc1c(CC(=O)NC[C@@H]2COCCO2)c2c(n1CC(C)C)CC(C)(C)CC2=O 15063546 IUXDMOPYNCRQLW-MRXNPFEDSA-N 390.524 2.682 0 50 GFAA CC(=O)c1ccc(N2CCC(n3cc([C@@H](O)c4ccccc4)nn3)CC2)nc1 19148025 VGVGYBDODCYRMJ-NRFANRHFSA-N 377.448 2.799 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857672097 JKCSSIXQJKGUMB-JOCHJYFZSA-N 389.459 2.703 0 50 GFAA COc1ccc2[nH]c(=O)c(-c3nccn3CCCN3CCCC[C@H]3CO)cc2c1 1857691262 CMRMLBLMDSYPFS-KRWDZBQOSA-N 396.491 2.637 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3ccccc3C)CC(=O)N2[C@H]1c1ccccc1 1857726729 APUCIHDEKKNXJF-ONTIZHBOSA-N 378.472 2.942 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCc1nc2ncccc2o1 1857730932 DAEPJLDNGOXEFY-CYBMUJFWSA-N 392.419 2.682 0 50 GFAA Cc1cc(N[C@H](c2ccc(Br)cc2)[C@H](C)CO)n2ncnc2n1 225607074 XUAJAYXQAGTHLR-BMIGLBTASA-N 376.258 2.977 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2)c1)c1ccco1 125144848 FZLJXMBBBXLCDB-LJQANCHMSA-N 389.411 2.845 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N2CC[C@@H](N)C[C@@H]2C)cc1Cl 237199495 OHLPVXQOQYASSV-DTWKUNHWSA-N 397.722 2.611 0 50 GFAA Nc1ncc(C(=O)N2C[C@H]3CC[C@@H](C2)N(CC2CC2)C3)c(-c2ccccc2)n1 247651329 NHHVWKSVKDAAAS-WMZOPIPTSA-N 377.492 2.672 0 50 GFAA CC(C)(NC(=O)c1cccc(Cl)c1)c1noc([C@H]2CCCc3nn[nH]c32)n1 952894634 OVJQYKRXCFKIIZ-LBPRGKRZSA-N 386.843 2.974 0 50 GFAA O=C(NCc1ccnc(N2CCC[C@@H](O)C2)c1)c1c[nH]nc1-c1ccccc1F 1875261706 SAGRZSHVTRJFEA-OAHLLOKOSA-N 395.438 2.502 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CN(Cc3cccc(C(C)C)n3)S(C)(=O)=O)O2)n1 886068635 FBOFZWUBOGPWJP-WBVHZDCISA-N 394.497 2.578 0 50 GFAA CCC(CC)C(=O)N1CCC(O)(CNc2nc(C(F)(F)F)ns2)CC1 1775991699 MGFQUIBWTIEHBX-UHFFFAOYSA-N 380.436 2.759 0 50 GFAA Cn1cc(C(=O)N2CCN3C(=O)OC[C@H]3C2)c2nc(-c3ccccc3)ccc21 2325779840 IYAPEBDBWUBWAL-OAHLLOKOSA-N 376.416 2.517 0 50 GFAA CC[C@H](CC1CCCC1)C(=O)NCC1(C)CCN(C(=O)CN(C)C(C)=O)CC1 2325794114 QWZUHUWQKLVSRY-LJQANCHMSA-N 393.572 2.816 0 50 GFAA COc1cccc2c1C1(CCN(Cc3noc([C@H]4CCCO4)n3)CC1)OCC2 2356145662 HGWUPKQAECORLC-QGZVFWFLSA-N 385.464 2.994 0 50 GFAA O=C(Cn1cnc2ccc(Br)cc2c1=O)Nc1cccc(F)c1 2532639 GLEWLRWDKURXCQ-UHFFFAOYSA-N 376.185 2.937 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccccc3F)n2)cc1OC 4968228 PJFJTSKXMAFJNM-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSc2nnc(-c3ccccc3O)n2C)cc1 4986177 LKPNQAHKEJJSQL-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA NC(=O)CCn1cc(CNCc2nncn2C2CCCCC2)c2ccccc21 55384284 QMDVGIOJMDCVCS-UHFFFAOYSA-N 380.496 2.903 0 50 GFAA Cc1cccc(OCC(=O)N2CCN(Cc3cnc([C@@H](C)O)s3)CC2)c1C 225638081 OMNAJEJXYXPNCT-MRXNPFEDSA-N 389.521 2.536 0 50 GFAA CCn1c([C@@H]2CCCN(C(=O)c3sc(C(C)C)nc3C)C2)nn(C)c1=O 67841464 OIIIOIPMSANJLH-CYBMUJFWSA-N 377.514 2.510 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 1460412 BGZONIBVLOVGMX-CABCVRRESA-N 388.468 2.571 0 50 GFAA Cc1ccc(NC(=O)NCCNc2cc(N3CCOCC3)ncn2)cc1Cl 72442396 HPIBHTAKIGEHCX-UHFFFAOYSA-N 390.875 2.509 0 50 GFAA CCCn1nnnc1CN1CCC2(CC1)C[C@H]2N(Cc1ccsc1)C(C)=O 328627276 FZUOOPKNKXZMIH-QGZVFWFLSA-N 388.541 2.548 0 50 GFAA O=C(CCNC(=O)c1ccc2ccccc2c1)NCc1ccc(-n2ccnc2)nc1 363372166 KTNXGCWNUNAFGZ-UHFFFAOYSA-N 399.454 2.857 0 50 GFAA C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1cccc(NC(=O)CCn2ccnc2)c1 124106640 FVPXGRYXNVLIIZ-CRAIPNDOSA-N 396.447 2.747 0 50 GFAA C[C@H](C(=O)N1CCc2sccc2C1)N1CCc2c(nnn2-c2ccccc2)C1 366602351 NDNWYOZINKWWBH-OAHLLOKOSA-N 393.516 2.660 0 50 GFAA O=C(O)c1cc(-c2cccc3cnccc23)cc(S(=O)(=O)N2CCOCC2)c1 71747201 KZFCLDPZZIBHBP-UHFFFAOYSA-N 398.440 2.621 0 50 GFAA CC[C@@H](C)[C@H](NC)C(=O)N1CCc2c(nc(-c3ccccc3)nc2N(C)C)C1 71388597 LNZGEQLJWSFOAX-BEFAXECRSA-N 381.524 2.728 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NC(=O)N1Cc2ccccc2C2(CCC2)C1 376381141 JUDITCXUPYBBIB-KRWDZBQOSA-N 381.480 2.907 0 50 GFAA Cc1ccc(-c2cncc(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)c2)cc1 130092550 KWBONXHTQDSIND-MRXNPFEDSA-N 377.366 2.950 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 237492595 LNDIEROBRWMQJU-SCRDCRAPSA-N 384.307 2.932 0 50 GFAA O=C1N[C@@H](CC(=O)N2CCc3[nH]nc(-c4ccc(F)cc4)c3C2)c2ccccc21 48212338 NVDHEUYILACENX-IBGZPJMESA-N 390.418 2.975 0 50 GFAA CC(C)(C)N1C(=O)NC(=O)[C@@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C1=O 229889770 WDFXRWOELWJQGT-LIRRHRJNSA-N 375.856 2.728 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)N[C@H]1CCN(c2ccccn2)C1 241338611 MCJONUYYCSPWQZ-NSHDSACASA-N 381.358 2.904 0 50 GFAA CNC(=O)C1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)CC1 287168311 JHDYFGUNLWOJBB-WFAGLZIHSA-N 385.508 2.505 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CCC[C@H](Cn2cc(C3CC3)nn2)C1 48139935 NEGIKFSNPAQNRG-AWEZNQCLSA-N 378.432 2.814 0 50 GFAA CN1CCN(C[C@H]2CCCN(C(=O)c3ccc(-c4ccncc4)cc3)C2)CC1 426386850 DNMPOPAEDGECOA-LJQANCHMSA-N 378.520 2.848 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)c2ccc(-c3cncc(N)c3)cc2)CC1 426360154 LPPCQJFUTWGDNG-UHFFFAOYSA-N 387.487 2.992 0 50 GFAA CNC(=O)c1ccnc(N2CC[C@]3(CCCN(CCc4ccccc4)C3)C2)c1 426563101 BSDKPFCXJVDQCC-QHCPKHFHSA-N 378.520 2.976 0 50 GFAA CCn1ccc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)n1 95392340 RNBKIQUDVAHVGW-UHFFFAOYSA-N 394.519 2.991 0 50 GFAA Cc1ccc(-c2ncnn2Cc2ccc3c(c2)OCO3)cc1N1CCNC1=O 97694620 YBOCUCQCFTXEAH-UHFFFAOYSA-N 377.404 2.560 0 50 GFAA CN(C)CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Cc1ccc3ccccc3c1)CC2 92077248 DRNPBRGWWAESIT-YADHBBJMSA-N 396.531 2.703 0 50 GFAA CCCCn1ccnc1[C@H]1CCCN(C(=O)c2cnc3ccccn3c2=O)C1 95506303 HKUXKUQYZMBXCD-INIZCTEOSA-N 379.464 2.711 0 50 GFAA CCn1ccc(C(=O)N2CCc3ccc(NC(=O)c4ccccn4)cc3C2)n1 95516428 FLYUIRUDWAHIGS-UHFFFAOYSA-N 375.432 2.749 0 50 GFAA Cc1cc(C(=O)N[C@H]2C[C@H](c3nnc(Cn4ccnc4)n3C)C2)ccc1Cl 252548775 QKPJJMITWXKQSQ-SHTZXODSSA-N 384.871 2.698 0 50 GFAA CN(CCCN1c2ccccc2CCc2ccccc21)Cc1nc(C(N)=O)no1 252494409 NURZAKGXRVNMQG-UHFFFAOYSA-N 391.475 2.927 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)Cc2csc(COc3ccc(Cl)cc3)n2)C1 299743926 QAOSUEOZFRFMND-LLVKDONJSA-N 380.853 2.851 0 50 GFAA COc1ccc(CCN(Cc2ccc(C)cc2)C(=O)NCC(=O)N(C)C)cc1 534634731 PWYAODBECRQWPX-UHFFFAOYSA-N 383.492 2.846 0 50 GFAA CCO[C@H]1COC[C@@H]1NC(=O)Nc1c(C)cnn1Cc1cccc(Cl)c1 299757475 HVRWUAADHLBKKY-HOTGVXAUSA-N 378.860 2.819 0 50 GFAA COc1cccc(CN(CCN(C)C)C(=O)c2ccnc(OCC(F)F)c2)c1 170611650 ZAORKFMIIORJEW-UHFFFAOYSA-N 393.434 2.938 0 50 GFAA CC(C)OC(=O)N1CCC(OC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)CC1 170626312 IDEUKOOLPRWQRM-HNNXBMFYSA-N 378.400 2.804 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3O)[nH]n2)C1 1506404513 VAZGSZYASURRNA-AWEZNQCLSA-N 376.416 2.912 0 50 GFAA CCc1oc(C(=O)N(CCN(C)C)Cc2[nH]cnc2C)cc1CN1CCCC1 1704335658 DEECFHYAEUFGQF-UHFFFAOYSA-N 387.528 2.673 0 50 GFAA O=C(c1ccc(NCCCN2CCCc3ccccc32)nc1)N1CCOCC1 1704336990 PDPRHQGOIGUXDP-UHFFFAOYSA-N 380.492 2.809 0 50 GFAA CC(C)c1nc2ccccc2n1CC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1 1704279967 AOZRHLIWQHHQBU-IEBWSBKVSA-N 378.476 2.929 0 50 GFAA CCn1ccnc1CN(C)C(=O)c1cc(Cn2c(C)nc3ccccc32)[nH]n1 12305859 YUUWUYNNNQSCMT-UHFFFAOYSA-N 377.452 2.605 0 50 GFAA Cc1nonc1[C@@H]1CCCN1C(=O)c1coc(Cn2cnc3ccccc32)n1 12434945 OFPRJAZCXUTESP-INIZCTEOSA-N 378.392 2.741 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CCN(C(C)C)[C@@H](C)C3)nc2)on1 12705065 WZGOPCCYQFZWKE-INIZCTEOSA-N 385.512 2.871 0 50 GFAA COCC[C@@H]1CN(c2nccc(-c3cnn(-c4ccccc4C)c3)n2)CCO1 19145899 BQVLWKHKSHLSJV-GOSISDBHSA-N 379.464 2.879 0 50 GFAA CCn1ncc(NC(=O)c2ccc([C@@H]3CCCN3C(=O)CSC)s2)n1 19794353 PAASIUIIOKKINT-NSHDSACASA-N 379.511 2.638 0 50 GFAA Cc1ccc([C@H]2NC(=O)N(CC(=O)Nc3ccccc3)C3=C2C(=O)OC3)cc1 169757946 XCWCGUHTSZVHPF-LJQANCHMSA-N 377.400 2.511 0 50 GFAA Cc1cccnc1CN1CC[C@@H](O)[C@]2(CCCN(C(=O)c3occc3C)C2)C1 1857693220 NKMAIHXNBUOWQQ-DENIHFKCSA-N 383.492 2.781 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCC(O)(C(F)(F)F)CC2)ncn1 328628833 HPMOADCQDLVBFL-CZUORRHYSA-N 388.434 2.986 0 50 GFAA CCN(CC)C(=O)c1ccc(C(=O)N2CC[C@](CO)(c3ccccc3)C2)cc1 462962691 BBKALVVNKARDGU-QHCPKHFHSA-N 380.488 2.945 0 50 GFAA CCN1CCc2nc(-c3cccc(CN(C)C[C@H]4CCCO4)c3)nc(O)c2C1 253527041 RCCRWWZHXVTITC-GOSISDBHSA-N 382.508 2.838 0 50 GFAA COc1ccc(CCNC(=O)N2CC[C@@H](c3nccn3C)C2)cc1OC(F)F 372886401 XTIDGLSMJSXHBY-CQSZACIVSA-N 394.422 2.772 0 50 GFAA CS(=O)(=O)N1CC[C@@H](COC(=O)Cc2csc3ccc(Cl)cc23)C1 801293326 KEVMUSVIGDDLQK-LLVKDONJSA-N 387.910 2.922 0 50 GFAA Cc1c(C(=O)N[C@@]2(CO)CCC(C)(C)C2)nnn1-c1cccc2cnccc12 1875278453 AKBWOMRXRFDJQG-NRFANRHFSA-N 379.464 2.795 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3cncc(-c4ccoc4)c3)CC1)O2 1875394635 PZVMEUPPGYKLEN-KRWDZBQOSA-N 394.431 2.566 0 50 GFAA Cc1ccc(N2CCC(NC(=O)N3CC(C)(C)[C@@H]3c3nccn3C)CC2)nc1 886088717 PJJSHJDYRJNMHT-SFHVURJKSA-N 382.512 2.885 0 50 GFAA COC(=O)c1ccc2c(=O)sc(N3CCN(c4ccc(F)cc4)CC3)nc2c1 4710017 ZZSNEDDXGMAXIU-UHFFFAOYSA-N 399.447 2.909 0 50 GFAA O=C(CCC[C@@H]1NC[C@@H]2CNC[C@H]1C2)NCCc1cccc(C(F)(F)F)c1 2100482717 STOBJZBDRBTZKT-JZXOWHBKSA-N 383.458 2.732 0 50 GFAA CN(Cc1nc2c(n1C)CCCC2)C(=O)NC[C@@H]1CC(=O)Nc2ccccc21 2325776143 SRUYPWFVAUEOBT-AWEZNQCLSA-N 381.480 2.566 0 50 GFAA Cc1nc2c([nH]1)C[C@H](NC(=O)Cc1c(C)nn(-c3ccccc3F)c1C)CC2 2325781502 XSRJCTIGXHHYFL-OAHLLOKOSA-N 381.455 2.876 0 50 GFAA O=C(C[C@@H]1CN(C(=O)Cc2ccoc2)C2(CCC2)CO1)N1CC=CCC2(CC2)C1 2325785351 RBFJLTVVFJIXDS-LJQANCHMSA-N 398.503 2.931 0 50 GFAA CO[C@]1(CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)C[C@H](C(=O)O)C1 2325788781 CYICSKPYTURUPL-JCKZUZKGSA-N 387.354 2.685 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(O)nc3c2CCCN3)cc1 2325827030 SMJMYWNDIBMWHY-INIZCTEOSA-N 398.488 2.608 0 50 GFAA COc1ccc(N(CC(=O)NC2CC2)S(=O)(=O)c2ccccc2)cc1Cl 879058 LFIDMOMGTCTFBO-UHFFFAOYSA-N 394.880 2.823 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)Cc2ccccc2F)cc1 1162073 QPLDXVXXIUFLCQ-UHFFFAOYSA-N 376.453 2.604 0 50 GFAA COC[C@H](N=c1[nH]oc(-c2ccc(F)c(OC)c2)c1C(=O)O)c1ccccn1 2356135720 QNIOSBWGYBFWLF-AWEZNQCLSA-N 387.367 2.804 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@]23CCCN(Cc2ccccn2)C3=O)cs1 2356149819 WNFSAIIEFDFEQH-FQEVSTJZSA-N 384.505 2.573 0 50 GFAA CCc1ccccc1N1CCN(S(=O)(=O)c2ccc(F)c(OC)c2)CC1 2857641 VOZUEFWDKRKKKT-UHFFFAOYSA-N 378.469 2.908 0 50 GFAA O=C(C(=O)N1CCOCC1)c1cn(CCOc2ccccc2)c2ccccc12 2877368 MKHOMPOGBOKQGD-UHFFFAOYSA-N 378.428 2.762 0 50 GFAA Cc1cc(S(=O)(=O)NCc2ccccc2)ccc1OCC(=O)NC(C)(C)C 2877383 SRWNLIFYFWQKFR-UHFFFAOYSA-N 390.505 2.767 0 50 GFAA C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CSc2nnc[nH]2)cc1 225435017 LBIACVSTYFQZCR-LBPRGKRZSA-N 391.497 2.740 0 50 GFAA Cc1nc(/C=C/C(=O)NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@H](C)O3)cs1 115921276 KVPMXAQQNLIKNL-NWALNABHSA-N 398.893 2.947 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)C1 59739999 ZATGTJXEZYGKPU-MRXNPFEDSA-N 375.488 2.759 0 50 GFAA O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)N[C@H]1CCSc2ccc(Cl)cc21 247745107 QNEGFKYDVXHOJW-NFAWXSAZSA-N 390.892 2.944 0 50 GFAA CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](c3ccccc3)C(C)C)ccc2[nH]1 472570940 QXHCERMTGKPFBB-IBGZPJMESA-N 392.459 2.980 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)NCC3(c4cccc(F)c4F)CCCC3)C2)CN1 280035023 NNZWNWMEDBTTNV-IBGZPJMESA-N 377.435 2.698 0 50 GFAA COc1ccc(C(=O)CCC(=O)NC[C@H]2CC(=O)N(C)c3ccccc32)cc1 216418412 CVZNXEZXQYAHOK-MRXNPFEDSA-N 380.444 2.925 0 50 GFAA C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(N)=O)c1ncc(-c2ccccc2)o1 363152392 VPOULRRWIVREHP-PBHICJAKSA-N 378.432 2.798 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCCCCN)CCC(=O)N1Cc1ccc(F)cc1 72121856 ANLJPKKVDRFLNQ-IBGZPJMESA-N 377.504 2.930 0 50 GFAA C[C@H]1CN(C(=O)c2ccc(CNCc3cnc4ccccn34)cc2)C[C@@H](C)O1 237762580 ZUASCHWZXLNWRL-CALCHBBNSA-N 378.476 2.874 0 50 GFAA CC(C)c1nnc(CCC(=O)N2CCC(O)(Cc3ccccc3F)CC2)o1 373341060 MREAZYUKEBCVGQ-UHFFFAOYSA-N 375.444 2.861 0 50 GFAA CCC[C@H](C(=O)N1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1)n1cccc1 71765292 BDUHOPDNINBXMC-GOSISDBHSA-N 377.448 2.560 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@@H](N4CCOCC4)C3)cc2F)n1 173837190 ADGGQJDLODNVLI-QGZVFWFLSA-N 387.459 2.567 0 50 GFAA O=C1[C@@H](N2CCCN(c3nccs3)CC2)CCN1c1c(F)cccc1F 176923247 RPQXGNVUCRWVDW-HNNXBMFYSA-N 378.448 2.739 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CCn3c(C4CCCC4)nnc3[C@@H]2C)c(O)n1 289061948 MEEZBSLSDOFANK-AWEZNQCLSA-N 384.484 2.940 0 50 GFAA Cc1cc(C)c(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(F)cc2)C3)c(=O)[nH]1 95353444 HCZKOKJCSKMQIU-PKOBYXMFSA-N 383.467 2.867 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)[C@@H](O)Cc2ccccc2)C3)c1 96132091 SRUDAFYXLBQLIJ-FQEVSTJZSA-N 377.444 2.574 0 50 GFAA CCCc1cncnc1N1CCC(NCCSc2nnc(C)s2)CC1 95496577 CLZYETBYJXTCDH-UHFFFAOYSA-N 378.571 2.940 0 50 GFAA CCN1CC2(CCC1=O)CCN(CCOc1c(OC)cccc1OC)CC2 91380832 GSTQBLCVJBBBMM-UHFFFAOYSA-N 376.497 2.807 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(Cc1nc(-c3ccccc3Cl)no1)C2 95374298 NJWWAUHJRAKURV-LSDHHAIUSA-N 376.888 2.933 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)N1CCC2(CC1)OCCc1ccsc12 542773899 DWGSQJSTOIWCQL-UHFFFAOYSA-N 395.484 2.549 0 50 GFAA COCc1cc(CN2CCN(Cc3ccsc3)[C@H](CCO)C2)ccc1OC 38149382 WWHHXFYDQMUALG-HXUWFJFHSA-N 390.549 2.972 0 50 GFAA Cc1cc(C)nc(-c2cccc(C(=O)N3CCC4(CC3)OCCC[C@@H]4O)c2)n1 299793568 GXLUIHCMEDAPQY-IBGZPJMESA-N 381.476 2.907 0 50 GFAA NC(=O)[C@H]1CCCN(CCCNC(=O)c2ccc(-c3ccccc3F)cc2)C1 670467431 BRGPWLOWMHTLMI-SFHVURJKSA-N 383.467 2.810 0 50 GFAA CCCN1CCC[C@@H](NS(=O)(=O)c2cc(-c3ccno3)ccc2OC)C1 670469273 LWAWKCFIANADPL-OAHLLOKOSA-N 379.482 2.503 0 50 GFAA Cc1nccn1CC(=O)N1CCC[C@@H](CNC(=O)CCCc2cccs2)C1 952969537 DJHKRNJEZLMDBY-KRWDZBQOSA-N 388.537 2.631 0 50 GFAA O=C(Nc1ccc2scnc2c1)c1ccc(OCC(=O)N2CCOCC2)cc1 952970475 ANHNKRMGGOTKSY-UHFFFAOYSA-N 397.456 2.786 0 50 GFAA Cn1c(CCNC(=O)c2cccc(C(F)(F)F)n2)nnc1-c1ccccc1 1466770731 SGMJLLXWWQQGKU-UHFFFAOYSA-N 375.354 2.868 0 50 GFAA O=C(CN1CCN(c2cccnn2)CC1)NCC1(c2ccccc2)CCCCC1 170648971 IMNSKECPHKXRLC-UHFFFAOYSA-N 393.535 2.617 0 50 GFAA CN(CC(=O)N1CCC(N2CCc3ccccc3C2)CC1)Cc1ccncc1 1506412957 QCWBDDLOPUQMDX-UHFFFAOYSA-N 378.520 2.563 0 50 GFAA O=S(=O)(CCN1CCC[C@H]1c1nc(-c2ccncc2)no1)c1ccccc1 1529182025 SRVWZHFJGULJNV-KRWDZBQOSA-N 384.461 2.742 0 50 GFAA O=C(COc1ccc(F)cc1F)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1529181842 QDVQBKXYOUKEOB-FOIQADDNSA-N 398.409 2.954 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)[C@H]1CCCO1 11814311 PEJRHUJEIUVODX-LEWJYISDSA-N 386.536 2.928 0 50 GFAA Cc1noc(C)c1CCCNC(=O)[C@H]1CCC(=O)N(CCc2ccccc2)C1 11814421 MWZMUFWKWKCLEA-IBGZPJMESA-N 383.492 2.822 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccnn1C 11818095 JRQCIYQSOJHOBU-IBGZPJMESA-N 384.524 2.846 0 50 GFAA O=C1NCCN(Cc2ccccc2)[C@H]1CC(=O)N1CCC(c2ccccc2)CC1 11874641 QRTGJJASECSDGE-QFIPXVFZSA-N 391.515 2.783 0 50 GFAA O=C1C[C@H](C(=O)NCc2ccccc2)Cc2nc(NC(=O)C3CCC3)sc21 12040960 TUQQKUYZTYMCHL-CQSZACIVSA-N 383.473 2.943 0 50 GFAA CN(C)[C@H]1CCN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)C1 12594043 VHSPHHBISFMVBT-QHCPKHFHSA-N 391.559 2.861 0 50 GFAA O=C(NCCCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12597192 HPCXLOISERVSPB-OAQYLSRUSA-N 397.563 2.848 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4ccc(C)c(C)c4)CC3)nn2)n1 169777456 ZNNMEIHQJDQESK-UHFFFAOYSA-N 380.452 2.985 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)Cc3cn4ccsc4n3)CC2)O1 1857696631 JVFIJZAUXFARAB-HZPDHXFCSA-N 391.537 2.886 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2cccc(O)n2)CC1 1857736154 XSXJRYDMCWDMTP-UHFFFAOYSA-N 382.464 2.701 0 50 GFAA COCc1ccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 240444238 FWUYTWLUXNZCRT-OAHLLOKOSA-N 394.518 2.934 0 50 GFAA O=C(c1ccccc1OC(F)F)N1CCN(c2ncc3c(n2)CCCC3)CC1 840240952 OVBPDDBSHRRSEF-UHFFFAOYSA-N 388.418 2.919 0 50 GFAA CC(C)C[C@@](C)(CNc1ncnn2cccc12)NC(=O)C[C@H]1CC=CCN1C 1875327954 QUZTZFPEBDBFLI-UTKZUKDTSA-N 384.528 2.713 0 50 GFAA CC(C)Cc1ccc2c(N)c(C(=O)N3CC[C@@H]([C@@H]4CNC(=O)C4)C3)sc2n1 1875313466 RJIUSSLIEFYQTC-OLZOCXBDSA-N 386.521 2.675 0 50 GFAA CC(C)c1noc([C@@H](C)N2CCN(C(=O)C3CC3)C3(CCOCC3)CC2)n1 1775962746 BNWHRLBYOCOUHR-OAHLLOKOSA-N 376.501 2.748 0 50 GFAA CN(Cc1c(Cl)cnn1C)S(=O)(=O)c1ccc(Br)cc1 20602489 PYIYDTKQXXDRJT-UHFFFAOYSA-N 378.679 2.657 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC4(CC3)C[C@@H](N)CO4)ncnc21 2100545274 MKBJSVGMBUBDOP-MRXNPFEDSA-N 386.544 2.912 0 50 GFAA COc1ccc2cc(CNC(=O)N[C@@H]3C[C@H](Cn4ccnc4)C[C@H]3O)ccc2c1 2325785149 FNMDRZMRPDHVEF-ZLGUVYLKSA-N 394.475 2.684 0 50 GFAA Cc1noc(C)c1C(=O)N1C[C@@H](CC(=O)NC2C3(CC3)C23CC3)OCC12CCC2 2325785225 KVCQEEHFJBVDDE-OAHLLOKOSA-N 399.491 2.504 0 50 GFAA COc1ccc(C(=O)NC(=S)NC(C)(C)C)cc1I 675681 WIRNNBDJRMLEHK-UHFFFAOYSA-N 392.262 2.703 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2cnn(-c3ccccc3F)c2)C1=O 2356136434 URBLYQWCODEBAH-NRFANRHFSA-N 386.471 2.615 0 50 GFAA O=C(CN(c1ccccc1)S(=O)(=O)c1ccc(F)cc1)NCc1ccccn1 4839780 YQAVMFJNTFJMSI-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA CCOc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)N(CC)CC)c(Cl)cc1O 4867099 RZIQTBQXYVUKTQ-INIZCTEOSA-N 381.860 2.941 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1cccc(F)c1F)NCCCC1CCCC1 55108606 LEOOBHXUEJMJHW-SFHVURJKSA-N 393.478 2.742 0 50 GFAA CCN1C(=O)COc2cc3c(cc21)NC(=O)C[C@@H]3c1cccc2nsnc12 65507334 MCDMPIMHTLPBEY-LLVKDONJSA-N 380.429 2.911 0 50 GFAA CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@@H](c3ccccc3)C(C)C)ccc2[nH]1 472570941 QXHCERMTGKPFBB-LJQANCHMSA-N 392.459 2.980 0 50 GFAA O=C(NCc1ccc(S(=O)(=O)CCO)cc1)Nc1cccc(-n2cccc2)c1 252485027 GMRGSLRQJKXEGA-UHFFFAOYSA-N 399.472 2.565 0 50 GFAA Cc1nc(C)c(C(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2nccs2)nc1C 329941692 VFBWKERXIIBRPN-GJZGRUSLSA-N 377.489 2.543 0 50 GFAA Cn1c(=O)c2sccc2n2c(CN3CC[C@H](Cc4ccc(F)cc4)C3)nnc12 121333030 NXBXTPQXYKVBFJ-CQSZACIVSA-N 397.479 2.846 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)c1C(=O)OC(C)C 6184389 STINFIHLUWESGO-QWRGUYRKSA-N 396.465 2.550 0 50 GFAA C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)c1ccc(CS(C)(=O)=O)o1 363350558 ZWXQQCWFAKBBDX-MRXNPFEDSA-N 390.505 2.561 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccccc3)C2)cc1 172062297 VLNBPRITKJJWDH-KRWDZBQOSA-N 387.505 2.558 0 50 GFAA O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccc2nccn2c1 172107841 XWRCVVAFPMGZNE-HXUWFJFHSA-N 378.476 2.510 0 50 GFAA O=[S@](Cc1cccc(-n2cccn2)c1)Cc1nc(O)cc(C(F)(F)F)n1 371869475 HSPZMLTXJRZAGY-AREMUKBSSA-N 382.367 2.836 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@@H](C)CCC(=O)O)c2)cc1 262126999 JTUSOZRNUROIGG-AWEZNQCLSA-N 390.461 2.779 0 50 GFAA O=C(Cn1ncc2ccccc21)N1CCN(c2nc3ccccc3s2)CC1 72480975 KXFDCGZSKOJAKO-UHFFFAOYSA-N 377.473 2.995 0 50 GFAA Cn1cccc1[C@H]1CCCCN1C(=O)CNC(=O)N1CCc2ccccc2C1 174395019 KUOHAYUJYFAWMV-HXUWFJFHSA-N 380.492 2.847 0 50 GFAA COCCc1noc(CNc2cc(Cl)ccc2N2CCC(CO)CC2)n1 178009106 FANIAMIMAHOKPT-UHFFFAOYSA-N 380.876 2.733 0 50 GFAA CN1CCC[C@@H]2CN(C(=O)NC3CCN(Cc4ccc(F)cc4)CC3)CC[C@@H]21 137124283 DFUHJMZNFFDIBM-NQIIRXRSSA-N 388.531 2.916 0 50 GFAA CS(=O)(=O)Nc1ccc(F)c(NC(=O)NCCSC(F)(F)F)c1 426488547 VKYMXCSXOUWLFY-UHFFFAOYSA-N 375.369 2.572 0 50 GFAA CCN1C[C@@H](CNC(=O)c2ccc(-c3cccc(C(=O)OC)c3)cc2)CC1=O 426657077 XHPFHJHWTHPWOB-OAHLLOKOSA-N 380.444 2.738 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(S(=O)(=O)N3CCCC3)CC2)C1 96151288 NXYZIXKVKUHZDY-HXUWFJFHSA-N 391.581 2.919 0 50 GFAA CCN1CCC[C@@](C)(C(=O)N2CCC(c3nccn3CCCN(C)C)CC2)C1 95377378 FZLUSMXBGULTIF-JOCHJYFZSA-N 389.588 2.663 0 50 GFAA O=C(NCCC[C@@H]1CCOC1)N1CCC(c2nnc3n2CCCCC3)CC1 426730303 DFBZKJDSYLGWKA-MRXNPFEDSA-N 375.517 2.710 0 50 GFAA CCCc1ccc(CN2CC[C@@]3(O)CCN(C(=O)N4CCCC4)C[C@H]3C2)o1 95352195 PAGMECZHVADGKG-DYESRHJHSA-N 375.513 2.707 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3CCCO[C@H](Cn4cccn4)C3)n[nH]2)cc1 426382865 CNEFRPZEXVJMDR-SFHVURJKSA-N 379.464 2.767 0 50 GFAA CC(C)O[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91871619 BGTDTORJFKIBMH-SFHVURJKSA-N 387.524 2.669 0 50 GFAA O=C(C[C@@H]1CCCS(=O)(=O)C1)N[C@H](c1ccccc1)c1ccc2[nH]cnc2c1 292941958 BGHTYEKADXAVDB-YCRPNKLZSA-N 397.500 2.983 0 50 GFAA COc1cc(C(=O)N2CCC(c3nccn3Cc3cccnc3)CC2)ccn1 91706612 TUXHFLISIDEKOU-UHFFFAOYSA-N 377.448 2.750 0 50 GFAA CCc1nc(CN2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)cs1 230181346 OOVGUAKWNFSNQL-HXUWFJFHSA-N 376.570 2.614 0 50 GFAA O=C(NC[C@H](c1cccnc1)N1CCCCC1)c1cc(=O)[nH]c2ccccc12 97610120 MWFHXWMIZGKGNY-HXUWFJFHSA-N 376.460 2.880 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)NCCCc1nc2ccccc2o1 92108003 IGAOLUBHNADLEB-UHFFFAOYSA-N 376.416 2.746 0 50 GFAA CCN(C(C)=O)c1nc(CN2CCNC(=O)[C@@H]2c2ccc(F)cc2C)cs1 184753871 GWFHTLOPPXGIMJ-KRWDZBQOSA-N 390.484 2.637 0 50 GFAA CC(C)CCN1CCC(N2C[C@H](COc3ccc(F)cc3)OCC2=O)CC1 299771030 YLMWADRMNLMDBC-HXUWFJFHSA-N 378.488 2.942 0 50 GFAA COCCn1c(=O)c(CNCc2ccc3c(c2)OCO3)cc2ccc(F)cc21 299784220 WNBCUYACCCUPFE-UHFFFAOYSA-N 384.407 2.806 0 50 GFAA COCCN1C[C@@H](C(=O)Nc2cccc(NC(=O)C3CCCC3)c2C)CC1=O 952860845 URNGAZBKBXXCOQ-INIZCTEOSA-N 387.480 2.557 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2cccc(COc3ccccc3C(N)=O)c2)C1 408519261 LTYMWWLMUQOUNN-CRAIPNDOSA-N 381.476 2.564 0 50 GFAA O=C(CCC(=O)N1C[C@@H]2COc3ccccc3C[C@]2(CO)C1)c1ccccc1 1565513894 GMJRPBRPKZGPTM-AUSIDOKSSA-N 379.456 2.722 0 50 GFAA Cc1cc2cc(C(=O)N3C[C@@H]4CC[C@H]3CN(C(=O)c3cnccn3)C4)ccc2o1 1565514292 UZYHQZQPBLPUPC-QAPCUYQASA-N 390.443 2.908 0 50 GFAA O=C(O)C1CCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)CC1 268907623 DOUGEMKEMWPWRO-UHFFFAOYSA-N 387.457 2.597 0 50 GFAA O=C1C[C@]2(CCN(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)C2)CN1 279191721 WKXGYLBQKXDNMO-OAQYLSRUSA-N 378.432 2.683 0 50 GFAA CC(C)Nc1ncc(CN2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)cn1 1529142948 YYSZYDFJKISIEO-NQIIRXRSSA-N 377.492 2.881 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@H](O)[C@H](Cc4ccncc4)C3)cc2c1 1704280460 UGGFSAPISRVDAE-UTKZUKDTSA-N 379.460 2.770 0 50 GFAA Cc1ccc2nc(C3CCN(C(=O)c4cc(N5CCOCC5)no4)CC3)[nH]c2c1 1772819330 JDOJSULIBJYMGP-UHFFFAOYSA-N 395.463 2.716 0 50 GFAA CC(=O)Oc1c(C)cc(/C=c2/sc3nc(-c4ccccc4)nn3c2=O)cc1C 2533483 HLNJTEPHXGUGRW-GZTJUZNOSA-N 391.452 2.908 0 50 GFAA Nc1cc(=O)[nH]c(SCC(=O)N(Cc2ccccc2)Cc2ccccc2)n1 11902862 YWFGVBHQMMBUKF-UHFFFAOYSA-N 380.473 2.673 0 50 GFAA O=C(c1ccc2c3c(cccc13)CC2)[C@@H]1CCCN(C(=O)CN2CCCC2=O)C1 12025324 LHJPCWSIVKLFCD-GOSISDBHSA-N 390.483 2.982 0 50 GFAA O=C(CCc1nnc(CCC2CCCCC2)o1)NCc1cn2cccnc2n1 12209380 XFPJLTOBZIJPLW-UHFFFAOYSA-N 382.468 2.874 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)NCCc2cnn(-c3ccccc3)c2)nn1 12747178 GTGRNWRSULCHOX-UHFFFAOYSA-N 386.459 2.793 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4ccc5[nH]ccc5c4)CC3)nn2)n1 169780287 PADRMONULCZOQC-UHFFFAOYSA-N 377.408 2.595 0 50 GFAA COc1cccc(C(=O)NCc2nnc3c(-c4nc(C(C)C)no4)cccn23)c1 169780445 ZYOMNEPMSYAZEO-UHFFFAOYSA-N 392.419 2.841 0 50 GFAA COc1cccc(OCc2nc(-c3ccn4nccc4c3)n(CCCO)n2)c1 1857680610 PZHVZOWCOXMHRI-UHFFFAOYSA-N 379.420 2.563 0 50 GFAA COc1cccc(-c2ncc(-c3nccn3C[C@H]3CN(C)C(=O)CO3)s2)c1 1857689670 UWVSGTBWOGCNEU-OAHLLOKOSA-N 384.461 2.539 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857696476 CEZIDGNHORSLIN-FQEVSTJZSA-N 385.489 2.728 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C(=O)c2ccc(F)cc2C)CC1 328648393 UKXIKGCVELPDPR-LJQANCHMSA-N 384.455 2.968 0 50 GFAA COC[C@@H]1CN(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)CCO1 266390086 OJXLJOCJIJLISY-SFHVURJKSA-N 387.411 2.957 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCc2c(ncn2C2CCC2)C1 1875274671 QNGOCJNTEQKIRC-GOSISDBHSA-N 396.491 2.850 0 50 GFAA C=CC(=O)NCC(=O)N[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 1875301623 NENYSLLQENABGO-HXUWFJFHSA-N 386.835 2.619 0 50 GFAA C=CC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(c2ccccc2OC)CC1 1875371000 KZLPCBYUDAJRSP-WIYYLYMNSA-N 376.456 2.811 0 50 GFAA CN(C[C@H](O)COCc1ccc2c(c1)OCO2)C(=O)Nc1cc(F)cc(F)c1 888093364 YDLWSZGUXUIKTJ-INIZCTEOSA-N 394.374 2.735 0 50 GFAA CC(C)CSc1nnc(NC(=O)c2ccc3c(=O)n(C)cnc3c2)s1 2100536825 ADFKMXOSEUOOMZ-UHFFFAOYSA-N 375.479 2.785 0 50 GFAA CCC(C)(CC)C(=O)N1CC2(C[C@@H](NC(=O)c3c(C)noc3C)c3nccn32)C1 2332237881 PSDGPAUWCAFCHE-OAHLLOKOSA-N 399.495 2.727 0 50 GFAA CCC(=O)Nc1ncc2c(n1)C[C@H](c1cc(OC)c(OC)c(OC)c1)CC2=O 795693 FBGAPVSIGRYAQI-NSHDSACASA-N 385.420 2.764 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N(C)[C@H]1C[C@H]2CC(=O)N(C)C[C@H]2C1 2356163557 IQBQGVQMJCSCCY-KSZLIROESA-N 381.476 2.908 0 50 GFAA CCN(CC(=O)Nc1cccc(C(C)=O)c1)S(=O)(=O)c1ccc(F)cc1 2884176 ARJSNVHSDZTZKI-UHFFFAOYSA-N 378.425 2.678 0 50 GFAA O=C(c1ccccc1Br)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 4866942 WATSJNQAQPQMFM-LBPRGKRZSA-N 398.278 2.872 0 50 GFAA COC(=O)c1ccc([C@H]2CC(=O)Nc3c2c(C)nn3-c2nc(C)cc(C)n2)cc1 8654628 OQVNPEFCRUTPFA-MRXNPFEDSA-N 391.431 2.848 0 50 GFAA C[C@](O)(CNC(=O)[C@@H](C1CC1)N1CCCC1)c1ccccc1Br 225623062 YIUUSSPKVBATOI-AEFFLSMTSA-N 381.314 2.647 0 50 GFAA CCCNC(=O)c1ccc(NC(=O)NCCC(=O)N2CCCC2)cc1Cl 54475964 AWIUHKJUNPEXGV-UHFFFAOYSA-N 380.876 2.614 0 50 GFAA OCC[C@@H]1CN(C2CSCCSC2)CCN1Cc1ccc(F)c(F)c1 23479026 JAMNZPRJHHIYTB-OAHLLOKOSA-N 388.549 2.682 0 50 GFAA CC(=O)[C@@H](NC(=O)CN1C[C@H](C)Oc2ccc(Br)cc21)C(C)C 252540522 PJXSJBRMTQLPBJ-GTNSWQLSSA-N 383.286 2.766 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3cnc(NCC)nc3)CC2)OC1=O 72427235 HJXHZMMNUBZDLY-CQSZACIVSA-N 375.473 2.524 0 50 GFAA CN1CCC[C@@H](CNS(=O)(=O)CCC2CCOCC2)[C@H]1c1cccs1 330305390 QPOOLSYIYJCYQB-WMZOPIPTSA-N 386.583 2.867 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3cnc(NC)nc3)CC2)OC1=O 77323811 XGCLWVXDMCVLSP-UHFFFAOYSA-N 375.473 2.526 0 50 GFAA COc1ccc(NC(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)c2cccnc12 333043623 AXBZGZKYGMPFBS-IBGZPJMESA-N 389.477 2.676 0 50 GFAA C[C@@H](NC(=O)c1cnn(C)c1Cc1ccccc1)c1ccc(NC(N)=O)cc1 445215049 ZEZVIFCOWZHQPA-CQSZACIVSA-N 377.448 2.993 0 50 GFAA Cc1sc(C(C)(C)NC(=O)[C@@H]2CC[C@H](C(N)=O)O2)nc1-c1ccccc1F 452759922 USWYWVTXORHMGS-KGLIPLIRSA-N 391.468 2.642 0 50 GFAA C[C@@H](N)[C@H]1CCCN(C(=O)c2ccccc2CS(=O)(=O)c2ccccc2)C1 237355626 KJUUJYQYCMBTSP-SJORKVTESA-N 386.517 2.860 0 50 GFAA Cc1oc(CNC(=O)[C@@H]2CCCN2c2ncnc3sccc23)cc1C(=O)O 262902293 BPETVBPCOOJHRK-AWEZNQCLSA-N 386.433 2.576 0 50 GFAA CC[C@@H]1CN(C(=O)CCc2c(C)n[nH]c2C)CCC(=O)N1Cc1ccccc1 71747480 AKLKWQUQSVYJJY-LJQANCHMSA-N 382.508 2.999 0 50 GFAA COc1ccc(NC(=O)N2CCCC[C@H]2CS(C)(=O)=O)c2cccnc12 454610088 LPTUAHRDNJYPBH-ZDUSSCGKSA-N 377.466 2.674 0 50 GFAA Cc1ccccc1C(=O)NCC(=O)N(Cc1ccccc1)C1CCN(C)CC1 175703356 JMVATCFMEHYFEH-UHFFFAOYSA-N 379.504 2.848 0 50 GFAA CC(C)N(C)C(=O)CN1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426519358 WOHIIFJUXBEAJG-OAQYLSRUSA-N 393.478 2.646 0 50 GFAA CN(C)[C@@H](C(=O)N1CCC(CCN2CCCC2=O)CC1)c1cccc(F)c1 95366128 BJBVEUJMKKXISW-HXUWFJFHSA-N 375.488 2.680 0 50 GFAA CC1(C)CN(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)C[C@@H](C(F)(F)F)O1 293312755 LOXLJHVSTMFPMU-LBPRGKRZSA-N 395.403 2.632 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)c3cc(=O)n(-c4ccccc4)[nH]3)C2)cc1 95381115 NZRGZVZUEJQTOY-KRWDZBQOSA-N 391.427 2.884 0 50 GFAA Cc1csc(S(=O)(=O)N2CCC[C@@]3(CCC(=O)N(CC4CC4)C3)C2)c1 91876846 DEGXIEZAXQJPFS-SFHVURJKSA-N 382.551 2.860 0 50 GFAA Cc1cc(N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)nc(-c2cccnc2)n1 299715131 WVUTUABPVZWQEO-OALUTQOASA-N 380.540 2.842 0 50 GFAA CN1C(=O)COc2cc(NC(=O)N3CCCC[C@H]3CCn3cccn3)ccc21 534587365 HFALLHJMAWNEOW-INIZCTEOSA-N 383.452 2.715 0 50 GFAA COc1ccc(CCCNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2C)cc1 1940196164 PEGZBDXWZXIVKE-YADHBBJMSA-N 396.487 2.651 0 50 GFAA O=C([C@H]1C[C@@H](c2ccccc2)N2CCC[C@H]12)N1CCCN(c2ncccn2)CC1 299758849 QXUBMKDNHADMBS-HBMCJLEFSA-N 391.519 2.741 0 50 GFAA CC[C@H]1CN(CC(=O)NCC[C@@H]2CCCN2C)Cc2ccc(Cl)cc2O1 299771516 PXHRDUSIZPMQND-ROUUACIJSA-N 379.932 2.914 0 50 GFAA Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)NCCNC(=O)c1cccnc1 584891702 TVGYGOLRCPVWQE-KRWDZBQOSA-N 382.464 2.721 0 50 GFAA COc1ccc(CN2CCN(c3ncnc(C)c3C)CC2)cc1Cn1cccn1 952968316 BWLQZUJECPQQPO-UHFFFAOYSA-N 392.507 2.669 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)Nc1cccc(C(=O)O)c1 170591086 GRISLFRRHSNLSK-UHFFFAOYSA-N 385.825 2.864 0 50 GFAA C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 192566450 HBVPHAXSOXGVAQ-MGPUTAFESA-N 398.434 2.729 0 50 GFAA O=C(Nc1ccc2c[nH]nc2c1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 729837358 CBMXDAUNTBUIEW-UHFFFAOYSA-N 392.387 2.534 0 50 GFAA Cc1ccc(N2CCC(N3C[C@@H](O)[C@H](Cc4cnccn4)C3)CC2)cc1Cl 1529161797 QGTPRVZFWJKNRR-IIBYNOLFSA-N 386.927 2.943 0 50 GFAA COc1cc(OC)cc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccccc2OC)c1 5482454 DWDYFJSJEAIZJS-IBGZPJMESA-N 397.431 2.979 0 50 GFAA O=C(c1cn(CCN2CCCCC2)nn1)N1CCC2(C=Cc3ccccc32)CC1 12053848 DKAVTNCPWUNYBJ-UHFFFAOYSA-N 391.519 2.965 0 50 GFAA O=C(CCc1ccccc1)N1CCC[C@H](CNS(=O)(=O)c2cccs2)C1 12229073 MNTGZCQFGFMYAQ-QGZVFWFLSA-N 392.546 2.898 0 50 GFAA O=C(c1cn([C@H]2CCCN(Cc3ccc(F)cc3F)C2)nn1)N1CCCC1 12452729 CGVWWXQJHFODHK-INIZCTEOSA-N 375.423 2.629 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCc4cnn(C)c4)C3)C2)c1 12591021 BSIFLRKZGYZVQE-HSZRJFAPSA-N 396.535 2.876 0 50 GFAA CC1CCN(CCCNS(=O)(=O)Cc2ccc(Br)cc2)CC1 13673619 ZDEXFGRZRDNCQB-UHFFFAOYSA-N 389.359 2.991 0 50 GFAA COc1ccc(C(=O)Cn2c(C)cc(=O)n3c4ccccc4nc23)cc1OC 13720418 SHMXIXNJSHJLRM-UHFFFAOYSA-N 377.400 2.858 0 50 GFAA CS(=O)(=O)c1ccc(-c2cccc3c2O[C@@H](CNC(=O)CC2CC2)C3)cc1 15068712 AMDMMEGIUJSVMA-QGZVFWFLSA-N 385.485 2.977 0 50 GFAA CC(=O)Oc1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)cc1 19782284 KJFKDKDBXYVKOY-MRXNPFEDSA-N 385.397 2.734 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cc(C(F)(F)F)ccn2)C[C@H]1C(=O)O 169725705 FPLJVICBTFQPEZ-NSHDSACASA-N 375.347 2.611 0 50 GFAA O=C(CN1C(=O)N[C@@H](c2ccc(Cl)cc2)C2=C1COC2=O)Nc1ccccc1 169757860 DTXUZDYVBQCDCM-SFHVURJKSA-N 397.818 2.856 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)NCc3ccc(C(F)(F)F)cc3)CC2=O)s1 1857713101 DSVNTVVTOXUBIA-LLVKDONJSA-N 384.383 2.535 0 50 GFAA Cc1ccc(-c2cc3c(s2)C2(CCN(C(=O)[C@H]4CCOC4)CC2)OCC3)nn1 1857720134 GEHMZWNEOBGODS-INIZCTEOSA-N 399.516 2.940 0 50 GFAA CCCCc1ccc(S(=O)(=O)N2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)cc1 1875251602 YZAOWAFBHIGPGY-DOIPELPJSA-N 392.565 2.759 0 50 GFAA O=C1NCCN1C1CCN(Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)CC1 127564747 BPQKJYMSZAMHIB-SFHVURJKSA-N 393.915 2.887 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H]2CC[C@H](C1)CN2C(=O)CCC(=O)c1ccccc1 248009005 FQLVRZLAKZYQNB-MJGOQNOKSA-N 380.492 2.804 0 50 GFAA O=C(C[C@@H]1CCCO1)N1CCC(N(C(=O)C(F)(F)F)c2cccnc2)CC1 864096398 CPOMOBRUQLMZNE-HNNXBMFYSA-N 385.386 2.537 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NC[C@@H]3C[C@H](CO)CO3)cc12 1875298478 BXICFMRCDNZBHP-DOMZBBRYSA-N 389.452 2.662 0 50 GFAA NS(=O)(=O)c1cc(F)c(Cl)cc1N1CC[C@@H](O)[C@H](C2CCCC2)C1 1875395066 JIWCWUKWKWDKKB-XHDPSFHLSA-N 376.881 2.504 0 50 GFAA CN(Cc1cc2ccccc2o1)C(=O)c1ccc(Cn2cc(CO)nn2)cc1 1875330279 WCGVCJYYPDIMIP-UHFFFAOYSA-N 376.416 2.837 0 50 GFAA Cc1c(-c2ccccc2)n(-c2ccccc2)c2nc3c(c(=O)n(C)c(=O)n3C)n12 4624324 LCKQKMJQELWICF-UHFFFAOYSA-N 385.427 2.651 0 50 GFAA Cc1cc(N2C(=O)C[C@@H](N3CCC(c4nc5ccccc5o4)CC3)C2=O)no1 4718029 OYUUDAFCLPJLGL-OAHLLOKOSA-N 380.404 2.636 0 50 GFAA N[C@H]1CCN(C(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)CCC1(F)F 2325778627 GYULALOBAKWTRV-LBPRGKRZSA-N 377.222 2.769 0 50 GFAA COC(=O)c1coc(C2CN(C(=O)CO[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)C2)n1 2325811019 XTPQJVBVEUWBPZ-YSVLISHTSA-N 378.469 2.864 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)cc1 1464862805 OHJDXHXVCWKXPZ-UHFFFAOYSA-N 395.434 2.939 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 954854 BQKYWSXVCNEDBO-UHFFFAOYSA-N 388.445 2.510 0 50 GFAA CCc1cccc(C)c1NC(=O)CN(c1cccc(OC)c1)S(C)(=O)=O 1145788 GKLLOQCSYVZNRF-UHFFFAOYSA-N 376.478 2.971 0 50 GFAA Cc1nn[nH]c1C(=O)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1[C@H]2Cc1cccc(F)c1 2356158523 NKYXVHBGEGKMJZ-UMGGQSCQSA-N 397.498 2.810 0 50 GFAA COc1ccc(C(=O)N(Cc2sccc2C)[C@@H]2CCS(=O)(=O)C2)cc1 4858174 BRCOEANZRYNGKR-OAHLLOKOSA-N 379.503 2.895 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccccc1C(F)(F)F 100627027 DDYHBIRITVNHTG-GREKMHCPSA-N 378.350 2.841 0 50 GFAA Cc1ccc2oc(N3CCN(C(=O)c4cn(-c5ccccc5)nn4)CC3)nc2c1 112263899 IIVWQXSJAAGUHI-UHFFFAOYSA-N 388.431 2.679 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1)N1CCCC[C@H]1CCc1ccc(O)cc1 55414780 KGERZEQZZJOHNL-SFHVURJKSA-N 377.448 2.995 0 50 GFAA CO[C@@H]1CCCN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)C1 20536657 XXZZEWLZSHSHMD-HXUWFJFHSA-N 397.523 2.836 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)CC1 67602044 QQYZWNOAGJFLCR-KRWDZBQOSA-N 394.537 2.775 0 50 GFAA CN(Cc1ccccn1)Cc1ccccc1-c1nc([C@H]2CCOC2)cc(=O)[nH]1 32573234 HTMCPHVVFLSBSS-KRWDZBQOSA-N 376.460 2.968 0 50 GFAA CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)sc3c2)cc1 1425561 GENRDUWTDSSNNF-UHFFFAOYSA-N 378.431 2.567 0 50 GFAA Cn1cc(I)c(C(=O)NC23CC4CC(CC(C4)C2)C3)n1 4652464 JQWGTKFQZOUPKI-UHFFFAOYSA-N 385.249 2.723 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccn2)CC1 328623311 BWNQFLMDSJLIMI-INIZCTEOSA-N 383.448 2.885 0 50 GFAA O=S(=O)(c1ccc(Br)cc1)N1C=CC(C(F)(F)F)=NCC1 5768991 SRACTDDFRLXRBS-UHFFFAOYSA-N 383.189 2.970 0 50 GFAA O=C(c1ccc(=O)[nH]c1)N1CC[C@@H]2[C@@H](CCC(=O)N2CCC2=CCCCC2)C1 72433449 FZQCBXHNHMFFRL-RBUKOAKNSA-N 383.492 2.719 0 50 GFAA COc1ccsc1S(=O)(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 328619965 GOPGAWKOZHMQAP-VIFPVBQESA-N 395.428 2.513 0 50 GFAA CC(C)CCN1CC2(CCN(C(=O)CC[C@H]3CCCN(C)C3)CC2)OC1=O 77340982 JNGUMHAQZUMZCF-GOSISDBHSA-N 379.545 2.968 0 50 GFAA Cc1noc(C)c1CO[C@H]1CCOC[C@H]1NC(=O)c1csc(C(C)C)n1 219633145 UPAZTGASRHJYAJ-ZBFHGGJFSA-N 379.482 2.975 0 50 GFAA Cc1cc(CS(=O)(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)on1 330000093 VXJFEUNLTUYWOA-GFCCVEGCSA-N 390.292 2.988 0 50 GFAA NC1(c2noc([C@H]3CC(=O)N(Cc4cccc(C(F)(F)F)c4)C3)n2)CCC1 261644553 DNEUTHFWHITPPO-LBPRGKRZSA-N 380.370 2.942 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CN(C(=O)[C@H](N)Cc2ccccc2)CC3)c1 215234758 FTOCXCKTVKQWNG-GOSISDBHSA-N 376.460 2.540 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@H](c3cccs3)C2)n(-c2ccccc2)n1 237981391 WHDQKEDZAYWWKZ-INIZCTEOSA-N 383.429 2.846 0 50 GFAA O=S(=O)(c1ccccc1Cl)N1CCN(Cc2ccncc2Cl)CC1 173465519 GEVGCWJNHMVJBJ-UHFFFAOYSA-N 386.304 2.895 0 50 GFAA CC(C)(C)c1cc(CNC(=O)N2CCC[C@@]3(C2)C(=O)Nc2ccccc23)[nH]n1 426491565 RBWBRGILMSBWFA-NRFANRHFSA-N 381.480 2.903 0 50 GFAA COc1nccnc1-c1ccc(C(=O)N2CCC[C@@H](c3ccncn3)C2)cc1 426489310 CTRNRBLXZJWDKR-QGZVFWFLSA-N 375.432 2.962 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)c1cccc(-c2cnc(N)cn2)c1)C1CC1 426517536 GATWFOJCLWGVBD-UHFFFAOYSA-N 376.464 2.881 0 50 GFAA CC(C)c1nc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)no1 95359055 KLCUMEVWXSRUAD-KFKAGJAMSA-N 382.464 2.988 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)N1CC[C@H](Cc2cccc(CO)c2)C1 91997229 DJPJYPSETIHDGC-GOSISDBHSA-N 378.472 2.616 0 50 GFAA Cc1nnnn1-c1ccc(NC(=O)NCc2cccc(N3CCCC3)c2)cc1 96137767 DKFNIYNDSHWWOF-UHFFFAOYSA-N 377.452 2.893 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cccc(Cn3cccn3)c1)C2 91444490 HDEPIBRSSVKQCA-KRWDZBQOSA-N 377.444 2.921 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(C(=O)Nc1ccc(F)cc1)CC2 91943132 QTLWHDNAXJDMEC-UHFFFAOYSA-N 376.476 2.624 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CN[C@H]2CC[C@H](O)CC2)cc1 244659838 HJTZNDZNKBAPTP-DNVJHFABSA-N 398.547 2.951 0 50 GFAA O=C(NCCN1CCCOCC1)N1CCC(c2c[nH]c3ccc(F)cc23)CC1 297122988 PCLIFCOJHXGVPX-UHFFFAOYSA-N 388.487 2.918 0 50 GFAA Cc1cccc(NC(=O)N2CCc3nn(Cc4cccnc4)c(=O)cc3C2)c1 263616949 LIDUYZPGZMTQJQ-UHFFFAOYSA-N 375.432 2.585 0 50 GFAA Cc1cc(CC(=O)NC[C@@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)on1 827861469 HDNNUZAFOIWYSV-HNNXBMFYSA-N 383.452 2.537 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@H](OCc2cccnc2)C1 827927095 XLVVYEHDLLOPDQ-INIZCTEOSA-N 382.420 2.865 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2F)C1)c1ccc2c(c1)ncn2CCO 670439271 XMZNPAIBSVCXBX-SFHVURJKSA-N 396.466 2.562 0 50 GFAA CN(Cc1cc(-c2cccnc2)no1)C(=O)C(C)(C)NC(=O)c1cccs1 952984664 QISDYSSHHWEGLU-UHFFFAOYSA-N 384.461 2.965 0 50 GFAA CC(=O)N1CCc2c(ncn(CCOc3ccc(Cl)cc3Cl)c2=O)C1 275702805 XUVBTQLIKNHKSJ-UHFFFAOYSA-N 382.247 2.534 0 50 GFAA CC(C)[C@H](CC(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276496861 PEEXBKYXVIASEW-MOPGFXCFSA-N 381.524 2.921 0 50 GFAA COc1cccc([C@H]2CCCN2C(=O)CN(C)S(=O)(=O)c2cccs2)c1 170626386 LGNVIDZQAROLND-MRXNPFEDSA-N 394.518 2.741 0 50 GFAA CCC(=O)N1CC[C@H](C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)C1 190803163 DHJHNKKWVORYSF-SFHVURJKSA-N 386.540 2.722 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1nccc(N2CCC(O)CC2)n1 1529198647 JQBGKWBQKVHQPC-UHFFFAOYSA-N 396.470 2.991 0 50 GFAA COc1ccccc1-c1c(C)nn(C)c1NC(=O)CN(C)Cc1ccncc1 1529174532 VKDKPPOGNYLLSJ-UHFFFAOYSA-N 379.464 2.870 0 50 GFAA O=C(c1ccc(Cl)c(F)c1)N1CC[C@H]2[C@H](CCC(=O)N2CCCCO)C1 216317899 UEIGEWQVURHOLA-PBHICJAKSA-N 382.863 2.705 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1F 1704313281 IDSKUKJYQNVOAP-CYBMUJFWSA-N 391.443 2.788 0 50 GFAA CC(=O)N1C[C@@H]2CN(c3ncnc4[nH]ccc34)C[C@]2(CCc2ccccc2)C1 1772813194 VEHVKKFFUKTZPW-GCJKJVERSA-N 375.476 2.875 0 50 GFAA COc1ccc(OC[C@@H](O)CN(C)C)c(CNCCc2ccccc2Cl)c1 11813410 SRXZUCSSPCSJQR-SFHVURJKSA-N 392.927 2.982 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(NC(=S)NC(=O)C2CCCCC2)c1 12138822 SPXUBSVJBSQGAQ-QGZVFWFLSA-N 389.521 2.989 0 50 GFAA Cc1cc(C(=O)N2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)n[nH]1 12434078 UCGDEDMIHCTTGO-HXUWFJFHSA-N 388.418 2.651 0 50 GFAA COc1ccc(NC(=O)CCC2CCN(C(=O)c3c[nH]cn3)CC2)c(OC)c1 12437416 GLCKFIWLTJZGMH-UHFFFAOYSA-N 386.452 2.698 0 50 GFAA CCn1c(SCC(=O)Nc2cccc(C(=O)OC)c2)nnc1-c1ccncc1 14152530 AOTTYDFCSPRJLR-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA COc1ccccc1CN[C@H]1CCc2c(c(C(=O)N(C)C)nn2CC(C)C)C1 14753089 IMLCOJHFKSEGTE-KRWDZBQOSA-N 384.524 2.897 0 50 GFAA O=C(/C=C/c1ccccc1F)N1CCC(=O)N(CCOc2ccccc2)CC1 14956754 OGQAWJBFPTYRQS-ZHACJKMWSA-N 382.435 2.979 0 50 GFAA OCC[C@@H]1CN(Cc2nc3ccc(F)cc3[nH]2)CCN1Cc1ccc(F)cc1 19771456 PWLSCZPSRXKSEP-GOSISDBHSA-N 386.446 2.910 0 50 GFAA COc1ccccc1C(=O)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779730 AQEVBQMGVAJWRI-UHFFFAOYSA-N 378.432 2.589 0 50 GFAA CC(C)c1ccc(Cl)c(S(=O)(=O)N[C@H]2C[C@@H](Cn3cccn3)C[C@@H]2O)c1 1857531522 LZPQMGYRUJHUCQ-COXVUDFISA-N 397.928 2.778 0 50 GFAA O=C(NC1CC1)c1cc2c(s1)C1(CCN(C(=O)c3ccncc3)CC1)OCC2 1857706550 KWSIGLYBVACLML-UHFFFAOYSA-N 397.500 2.740 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857720528 YFPKOBUIMMPJBP-QFIPXVFZSA-N 389.459 2.828 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N(CCC(=O)O)C[C@H]1CCCO1 237662200 VYKCSEMREUBBPK-CYBMUJFWSA-N 378.450 2.736 0 50 GFAA O=C(O)[C@H]1CCCCN1C(=O)c1cn(-c2ccc(Br)cc2)cn1 238055860 WLUXZVWLIYFQAN-CQSZACIVSA-N 378.226 2.714 0 50 GFAA COc1ccc(OC)c(COC[C@H](O)CN2C(C)(C)CC(O)CC2(C)C)c1 12384389 AYBGXBXUZIHJMM-QGZVFWFLSA-N 381.513 2.595 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 136157137 SVXQUEFEPFQFEX-LLVKDONJSA-N 378.226 2.572 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N[C@@H](CO)[C@H](O)C1CCCCC1 913047655 AOZJSFSZTCVOCX-MAUKXSAKSA-N 378.494 2.672 0 50 GFAA O=C(CN[C@H](CO)[C@H]1CCc2ccccc21)NCCc1nc2ccccc2s1 1875281512 FEPMONJFHAHUQH-PKOBYXMFSA-N 395.528 2.636 0 50 GFAA O=C1CCc2cc(S(=O)(=O)N3CCc4c(F)ccc(F)c4C3)ccc2N1 1319134645 OUXVXFIHJTXHQK-UHFFFAOYSA-N 378.400 2.597 0 50 GFAA CCCN1C(=O)[C@@H]2ON(c3ccccc3)[C@@H](c3ccc(O)c(OC)c3)[C@H]2C1=O 244741898 NYPLHDDUBFFRLX-CEXWTWQISA-N 382.416 2.657 0 50 GFAA COc1ccccc1[C@H](O)C(=O)N[C@@H](C)[C@H](O)c1ccc(Br)cc1 2325762357 XRYMIIFZPRUIER-GOPGUHFVSA-N 394.265 2.729 0 50 GFAA CCc1[nH]c(-c2ccccc2)cc1C(=O)N1C[C@@H](C(=O)O)Cc2c1cnn2C 2325803219 YNBZPGPLWVPWLH-AWEZNQCLSA-N 378.432 2.881 0 50 GFAA COc1ccccc1NC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 807688 DWRNMPOJOXPJAH-LLVKDONJSA-N 384.461 2.625 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Nc2ccc(OC)c(Cl)c2)C1=O 2356149894 DOAKUCAIJBYDNN-IBGZPJMESA-N 395.887 2.984 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(Cc2cnn(-c3ccccc3)c2)CC[C@@H]1O 2356152342 ZTZLDUKSEFYMRQ-GOTSBHOMSA-N 395.478 2.799 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)o1 2356167925 JAZPSWGHUXSLGT-HSZRJFAPSA-N 394.471 2.788 0 50 GFAA Cc1ccc(NC(=O)[C@H](C)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)c1 221892128 UGKOHVPSRFHPLJ-IRXDYDNUSA-N 391.512 2.856 0 50 GFAA Cc1cc2[nH]cc(C(=O)N3CCCC[C@H]3CCc3cccc(O)c3)c(=O)n2n1 102815617 HPSVDUOWFVKLSY-INIZCTEOSA-N 380.448 2.664 0 50 GFAA COc1cccc2ccc(-c3cnn(CC(=O)Nc4cc(C)nn4C)c3)nc12 55200015 SWMNYCLXDZISFJ-UHFFFAOYSA-N 376.420 2.788 0 50 GFAA Cn1ccnc1SCCNC1CCN(c2cccc(-n3cccn3)c2)CC1 23429746 ANVQFJKYJXBYPW-UHFFFAOYSA-N 382.537 2.957 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CC[C@@](C)(O)[C@@H](Cc3ccccc3)C2)c1C 67754371 CGNSJINGJGAXAY-SIKLNZKXSA-N 383.492 2.545 0 50 GFAA CS(=O)(=O)N(CC(=O)N[C@H]1C[C@H]2CC[C@H]1C2)c1cccc(C(F)(F)F)c1 101531064 DCYFPVDEBRJURE-HUBLWGQQSA-N 390.427 2.776 0 50 GFAA O=c1oc2ccccc2n1CCN1CCC[C@@H]1c1nc(-c2ccncc2)no1 67847733 PKXVOLCVDLAUQV-MRXNPFEDSA-N 377.404 2.877 0 50 GFAA COc1ccc(CN2CCN(c3ncccc3Cl)C[C@@H]2CCO)c(F)c1 72453855 OLFDFEDIZZZTPY-HNNXBMFYSA-N 379.863 2.956 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C(=O)Cc2ccccc2F)CC1 328636523 OBEJTPWOHQWAII-IBGZPJMESA-N 384.455 2.588 0 50 GFAA Cc1ncc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 71754390 IOIAGGJMZRGRAD-LJQANCHMSA-N 384.455 2.823 0 50 GFAA COc1cccc([C@H](O)CNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1 363404603 NJVIENZRPPNDPT-SIKLNZKXSA-N 397.519 2.940 0 50 GFAA COc1cccc(C(=O)c2ccc(C(=O)N[C@H]3CCc4nnc(C)n4C3)cc2)c1 363999585 NZXWQBKSPQRLMZ-SFHVURJKSA-N 390.443 2.571 0 50 GFAA C[C@@H]1C[C@H](N2CCOCC2)CN1C(=O)NCc1cccc(-c2cccnc2)c1 376492229 QXLJHQXHGUNHBR-UTKZUKDTSA-N 380.492 2.753 0 50 GFAA CC(C)c1nn(C)c(N2CCOCC2)c1CNc1ccc(N2CCCC2=O)cn1 158930287 GNZJEQMMNVIFMI-UHFFFAOYSA-N 398.511 2.514 0 50 GFAA COC1(CC(=O)NCc2ccc(CNC(=O)CC3(OC)CCC3)cc2)CCC1 241969524 UWZVLQDFZLVDFY-UHFFFAOYSA-N 388.508 2.837 0 50 GFAA Cc1c(C(=O)O)sc2[nH]c(=S)n(NC(=O)Cc3cccs3)c(=O)c12 17077979 HBPNKDBJACRAMJ-UHFFFAOYSA-N 381.460 2.502 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N2Cc3ccccc3N(C)C[C@@H]2C)ccc1F 177015153 MBBANSVSVGWFKQ-ZDUSSCGKSA-N 391.468 2.813 0 50 GFAA CCc1nn2c(nnc3c(=O)n(CCCN(C)C)ccc32)c1-c1ccc(F)cc1 40391623 LFIJZKOJQLYBCX-UHFFFAOYSA-N 394.454 2.759 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CC[C@H](n2cc(Cl)cn2)C1 291049764 VKLPJGOUPDHRPF-GJZGRUSLSA-N 376.844 2.598 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(c2cc(N3CCCC3)cnn2)C1 95496966 ZZHUPXLDFDYBEK-SFHVURJKSA-N 383.544 2.609 0 50 GFAA O=C1[C@@H]2[C@H](C(=O)[C@H]3O[C@@H]13)[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 238856708 WXYXLXQSWBFNEH-XPLJWGBASA-N 396.868 2.984 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95507966 GHKSMHDQOGOOIM-OAHLLOKOSA-N 376.464 2.558 0 50 GFAA O=C(C1CCC1)N1CC[C@]2(O)CCN(Cc3ccc(OC(F)F)cc3)C[C@@H]2C1 95376783 XZRPKDWQXOFEGW-DYESRHJHSA-N 394.462 2.873 0 50 GFAA Cc1nnc(SCCNC(=O)c2cnc(-c3cccs3)nc2O)s1 91325398 BVEFEQQUNPMKCE-UHFFFAOYSA-N 379.492 2.593 0 50 GFAA CN(Cc1nc(-c2ccncc2)no1)C(=O)c1cccc([C@H]2CCCNC2)c1 95391691 IBFSFLUMQGEIAM-SFHVURJKSA-N 377.448 2.871 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)c2cnc(COc3ccccc3)[nH]c2=O)on1 91689927 FTMMYOCRRUKQOK-MRXNPFEDSA-N 380.404 2.623 0 50 GFAA O=C(COc1ccc(F)cc1F)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 91351093 OFXQASROJFSPER-HXUWFJFHSA-N 378.419 2.595 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)N[C@H](C)Cc2cccnc2)cc1 96138105 CRLUAOTVMGKLTM-CQSZACIVSA-N 376.482 2.523 0 50 GFAA Cn1cc(CCNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cn1 299644754 JIXCDVVPWDIYAO-GOSISDBHSA-N 380.414 2.533 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(c1ncc(Cl)cc1F)CC2 95382199 YGDUUZIXZJRKNI-UHFFFAOYSA-N 390.850 2.505 0 50 GFAA O=C(NCC1CCN(Cc2ccsc2)CC1)c1ccccc1-n1cnnc1 828184278 VRYIYVQUQVQWAG-UHFFFAOYSA-N 381.505 2.971 0 50 GFAA COc1ccc2[nH]c(CNC(=O)c3nccnc3C(=O)N3CCCCC3)cc2c1 670457443 ZLEXVCUBGUVYFS-UHFFFAOYSA-N 393.447 2.523 0 50 GFAA CC(C)c1ccc(N2CCOC3(CCN(C(=O)c4cncs4)CC3)C2)nn1 952872276 MNUYKFASAVMQDK-UHFFFAOYSA-N 387.509 2.568 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)Nc1ccc(OC)c(C(=O)N(C)C)c1 952965755 BZDANDUDFDHXAM-IBGZPJMESA-N 381.476 2.782 0 50 GFAA C[C@@H]1NC(=O)N(c2ccccc2NC(=O)c2ccc(N3CCCC3=O)cc2)C1=O 952872763 BWHPQWMVJOVLRA-ZDUSSCGKSA-N 392.415 2.510 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H](C(=O)O)C2)ccc1OCc1cscn1 268892854 ASIXWCVSZPOFRL-CYBMUJFWSA-N 376.434 2.668 0 50 GFAA COC(=O)CN1CCN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 170631857 OEOHYFHOADMDLO-UHFFFAOYSA-N 379.766 2.681 0 50 GFAA CN(C)c1cccc(COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 170640342 DKHVAUQMTGMFPZ-INIZCTEOSA-N 396.443 2.620 0 50 GFAA Oc1nncc(N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)c1Cl 742821416 SXLUSSGZTBDGOL-UHFFFAOYSA-N 380.704 2.858 0 50 GFAA CCCN1CCCN(C(=O)c2nn(-c3ccc(C)cc3F)c3c2CCC3)CC1=O 189023803 YNGRQZSZULGNSP-UHFFFAOYSA-N 398.482 2.893 0 50 GFAA O=C(NCC(=O)N1C[C@H]2CCC[C@](O)(c3ccccc3)[C@H]2C1)c1ccccc1 1704339306 IABUAZWCHWBAQQ-RFWXGWTQSA-N 378.472 2.563 0 50 GFAA CN1CC[C@@H]2CN(C(=O)Cc3ccccc3OCc3ccccc3)C[C@@H]2C1=O 1772815493 SKBRRKWMIHZLKH-UXHICEINSA-N 378.472 2.745 0 50 GFAA O=C(NC[C@@H]1Cc2cc(F)cc(-c3cncnc3)c2O1)c1cc(C2CC2)n[nH]1 11789632 XSFOCXYHOJCEBO-HNNXBMFYSA-N 379.395 2.617 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCCC[C@H]2CCn2cccn2)nn1 11951182 LQNKTEZZDVHVRL-IBGZPJMESA-N 378.480 2.916 0 50 GFAA C[C@@H](NC(=O)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)c1ccccc1 12003224 FECKUGULJWBXDF-GFCCVEGCSA-N 392.864 2.898 0 50 GFAA COCCNc1ncnc2sc(C(=O)N(C)CCc3ccccn3)c(C)c12 12152195 ZGPKGFSDWDUFTO-UHFFFAOYSA-N 385.493 2.768 0 50 GFAA CC1=C(C(N)=O)[C@H](c2ccccn2)n2nc(SCc3ccccc3)nc2N1 13123536 NOAXWDJEDYWNLM-INIZCTEOSA-N 378.461 2.740 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@H](NCCSC)C2 14754618 IRUFMPKDAGMYNN-HNNXBMFYSA-N 376.526 2.578 0 50 GFAA CCN1CCN(c2nc(C)c3c(n2)C[C@H](c2ccc(OC)cc2)CC3=O)CC1 16651014 XZFFVDHBMOYGAE-KRWDZBQOSA-N 380.492 2.848 0 50 GFAA O=S(=O)(NC[C@H](c1ccccc1)N1CCOCC1)c1ccc(Cl)cc1 19537341 SUYNYRMPDZCVQW-GOSISDBHSA-N 380.897 2.692 0 50 GFAA COc1ccc(OC)c(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c1 169780832 FKVWBIOTZCLMJD-NSHDSACASA-N 398.394 2.711 0 50 GFAA CCOC(=O)[C@@H](CC(C)C)NC(=O)c1sc(-c2ncccn2)nc1CC 1857730170 ZNQLCABVDIXTTH-CYBMUJFWSA-N 376.482 2.870 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)CCCc2ccc(Cl)cc2)CC[C@H]1O 1857732894 LVFFAXCTTFLGSN-QUCCMNQESA-N 383.916 2.661 0 50 GFAA O=C(c1ccc(Cn2cc(Cl)cn2)s1)N1CC[C@@H](c2cc(O)n[nH]2)C1 911853965 FZVIKQRYPRWMIS-SNVBAGLBSA-N 377.857 2.705 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H]3OC(=O)N(CCc4cccc(Cl)c4)[C@@H]3C2)cn1 211289954 IRWRWZVHTPMENU-MSOLQXFVSA-N 385.851 2.931 0 50 GFAA O=C(c1cn(Cc2ccccc2)nn1)N1CCC(C(=O)O)(c2ccccc2)CC1 238072978 RPMIHXFKJMZSDI-UHFFFAOYSA-N 390.443 2.585 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCO[C@H](c2ccc(Br)cc2)C1 371467401 YVACOKMTMNVXSM-HNNXBMFYSA-N 387.237 2.934 0 50 GFAA COc1cc(Br)ccc1CCCN1Cc2nc(O)nc(O)c2C1 1875299630 QCNGGOYSOKOHLJ-UHFFFAOYSA-N 380.242 2.607 0 50 GFAA COCCN(Cc1ccnn1C)C(=O)c1ccc(-c2ccccc2CN)cc1 1875287706 WKHSKKFOBFCCFU-UHFFFAOYSA-N 378.476 2.835 0 50 GFAA CC(C)C[C@H]1C[C@@H](C(=O)N=c2[nH][nH]c3ccc(Br)cc23)CC(=O)N1 1875359047 RZRAKTXFYBWJKA-PWSUYJOCSA-N 393.285 2.627 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)C(F)(F)c2ccc(C)cn2)C[C@H]1c1ccc(O)cc1 1875309114 RQMHRJRRTTWQBO-JKSUJKDBSA-N 390.386 2.603 0 50 GFAA C[C@H]1CC(=O)Nc2cc(C(=O)NCCC3CC3)ccc2N1C(=O)N1C[C@H]2C[C@H]2C1 1775964565 CKFRXCBNKKOFGO-RRQGHBQHSA-N 396.491 2.825 0 50 GFAA C=CC(=O)Nc1cc(NC(=O)c2cc(Cl)ccc2-n2cnnn2)ccc1F 136562710 ACHLIPMQPOPAMN-UHFFFAOYSA-N 386.774 2.832 0 50 GFAA COc1cccc(CCC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356144531 BWVJLDVAPYCVGH-HSZRJFAPSA-N 394.519 2.990 0 50 GFAA C[C@H](c1ccccc1)N1C(=O)c2ccc(C(=O)NC[C@@H]3CCCO3)cc2C1=O 4842586 ANZANGGBAZBILH-PBHICJAKSA-N 378.428 2.953 0 50 GFAA CC(C)c1nn2c(=O)cc(COC(=O)COc3ccccc3F)nc2s1 8605561 QKEOIWUSXVBAQJ-UHFFFAOYSA-N 377.397 2.536 0 50 GFAA Cc1ccn2c(C3CCN(CC(=O)Nc4ccc(Cl)cn4)CC3)nnc2c1 225454259 VPIZOUWRMJJXPI-UHFFFAOYSA-N 384.871 2.904 0 50 GFAA COc1ccc(NC(=O)c2nnc(CN(CCO)[C@H]3CC[C@H](C)C3)s2)cc1 225668388 DSHSBABRMKTSKS-ZFWWWQNUSA-N 390.509 2.782 0 50 GFAA COc1c(F)cc2c(=O)c(C(=O)NCc3ccccn3)cn(CCF)c2c1F 20723478 AUQYORCSAGDGDU-UHFFFAOYSA-N 391.349 2.583 0 50 GFAA NC(=O)[C@@H]1CCCN(c2nccc(-c3cnn(-c4cccc(Cl)c4)c3)n2)C1 20999893 BBDMEGVYIZMOQJ-CYBMUJFWSA-N 382.855 2.684 0 50 GFAA C[C@H]1CNC(=O)CCN1C(=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 67473364 GYKGGESCQIERSO-NSHDSACASA-N 397.353 2.623 0 50 GFAA O=C(CSc1ccccn1)NC[C@H]1Cc2c(F)ccc(-c3ncccn3)c2O1 20776402 WAFPXHYOHOTAGG-CYBMUJFWSA-N 396.447 2.890 0 50 GFAA Cc1ccc2c(c1)CN(CCNC(=O)[C@H]1COc3ccccc3C1)C[C@@H](C)O2 39355298 LMDATTPZGPLQJT-YLJYHZDGSA-N 380.488 2.945 0 50 GFAA COCc1c(Cl)cccc1NC(=O)C(=O)N1CCC(c2cnn(C)c2)CC1 129815274 GONTUBCUZQPQOU-UHFFFAOYSA-N 390.871 2.565 0 50 GFAA Cn1nccc1CNC(=O)CCn1nc(C(F)(F)F)c(Cl)c1C1CC1 2780385 ZADLASLYFMNUHS-UHFFFAOYSA-N 375.782 2.873 0 50 GFAA O=C1CC[C@]2(CCCN(Cc3ccc(C(F)(F)F)nc3)C2)CN1CCCO 77406092 LWKQNGASGFNDCX-SFHVURJKSA-N 385.430 2.687 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@H](CCc3ccc(F)cc3F)C2)n1 71755332 ZTGMSHYHINUWEK-OAHLLOKOSA-N 375.419 2.701 0 50 GFAA CN(c1ccc(NC(=O)NCCc2nnc(N)o2)cc1F)C1CCCCC1 253432050 ZPTZDXANZHBNNS-UHFFFAOYSA-N 376.436 2.924 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CC(c3ccccn3)C2)nc2cccnc21 77538272 ZZIAQUGIJLYCHV-MRXNPFEDSA-N 393.491 2.982 0 50 GFAA COc1cccc2c1CC[C@H]2NC(=O)C1CCN(C(=O)c2ccccn2)CC1 153785221 UIUBPOPZNDHERX-GOSISDBHSA-N 379.460 2.746 0 50 GFAA O=C(N[C@H]1CCOc2c1ccc(Cl)c2Cl)C1CCS(=O)(=O)CC1 364590701 QBVMJDZFPWNGNP-LBPRGKRZSA-N 378.277 2.758 0 50 GFAA CC(C)[C@H]1CN(C(=O)Cn2ccccc2=O)CCCN1Cc1ccc(F)cc1 71715143 IRYKDPCRXXRFAX-HXUWFJFHSA-N 385.483 2.747 0 50 GFAA Cc1nc(CN2CCC[C@H](N(C)C(=O)Cc3cccc(OC(C)C)c3)C2)no1 371013701 ULHIOJCUCOTQSE-SFHVURJKSA-N 386.496 2.831 0 50 GFAA O=C([C@H](c1ccccc1F)N1CCOCC1)N1CCOc2c(F)cccc2C1 447863741 NNVDPZUOJIDZIW-IBGZPJMESA-N 388.414 2.759 0 50 GFAA CC(=O)N1CCC(NC(=O)CN2CCC[C@H](c3ccc(F)cc3)CC2)CC1 378498390 TVTIDBBLBKBSRU-KRWDZBQOSA-N 375.488 2.522 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2COc3c(C)cccc3C2)cc1Cl 289641821 UXXJVCUFXBHREQ-CQSZACIVSA-N 394.880 2.889 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)cn1 95380077 PCWCJWKJLSCLDO-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA Cc1nc(CNS(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)cs1 95354893 FJAOTCNWRLITFR-UHFFFAOYSA-N 379.507 2.602 0 50 GFAA COC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1 97756735 BITYYLYXTWXLAJ-SFHVURJKSA-N 385.416 2.978 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@@H]2c3ccccc3OC[C@]2(C(=O)O)C1 95356295 YNHGIJVFBXTWGM-AUUYWEPGSA-N 375.856 2.699 0 50 GFAA COc1ccccc1-c1nnc(Cn2cc(CCCO)c(C(F)(F)F)n2)o1 180439055 HMEFKLSNFQMSHN-UHFFFAOYSA-N 382.342 2.934 0 50 GFAA COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@H]2CCCN2[C@H]3C(=O)c2ccccc2)cc1 245311325 NMGOVUSWQPVCMX-FUMNGEBKSA-N 390.439 2.530 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2)no1 296434940 KTLJJYXXMZAKNH-GOEBONIOSA-N 391.431 2.858 0 50 GFAA Cc1nccn1CCCN1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1940194841 WTFCCXJAMKPZOC-RBBKRZOGSA-N 385.508 2.742 0 50 GFAA Cc1ccccc1N1CCN(C(=O)NCc2ccc(C(=O)N(C)C)o2)[C@@H](C)C1 584901046 ZXTPWLIYOHMZDG-INIZCTEOSA-N 384.480 2.710 0 50 GFAA Cn1cccc1-c1cc(C(=O)NC[C@H](c2cccnc2)N2CCCCC2)n[nH]1 952966141 HYYKUIVURYGYSO-HXUWFJFHSA-N 378.480 2.767 0 50 GFAA CC(=O)c1ccc(C(=O)NC[C@H]2CCCN(c3cccc(C(=O)O)n3)C2)s1 1506415672 BDSGDRWGUADDNG-CYBMUJFWSA-N 387.461 2.690 0 50 GFAA CN1CCC(n2nccc2NC(=O)CCc2nc(-c3ccccc3F)no2)CC1 1506421169 FRPVBSIPUVUUCA-UHFFFAOYSA-N 398.442 2.910 0 50 GFAA CCCc1cc(C(=O)N2Cc3cnc(Cc4ccc(OC)cc4)nc3C2)n[nH]1 1506402096 UFXMUYKMVVRBPZ-UHFFFAOYSA-N 377.448 2.908 0 50 GFAA CCc1nn(C)c(NC(=O)C2CCN(C(=O)c3ccc(OC)cc3)CC2)c1C 1529178580 NZIVCHCCTBEIGA-UHFFFAOYSA-N 384.480 2.790 0 50 GFAA c1ccc([C@@H]2CN(Cc3cnc(N4CCOCC4)nc3)C[C@H](C3CC3)O2)cc1 1529168192 ZAUCQCGKWBGUAT-LEWJYISDSA-N 380.492 2.665 0 50 GFAA CCN1C[C@@H](CN(C)c2nnnn2-c2ccc(Oc3ccccc3)cc2)CC1=O 1772704788 SXNONPGKHKKWFE-MRXNPFEDSA-N 392.463 2.759 0 50 GFAA O=C(O)CC[C@]12CN(CCOc3ccccc3)C[C@H]1CN(Cc1ccccn1)C2 1772819200 QGQQDHPCYXJGSP-WMZHIEFXSA-N 395.503 2.759 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)[C@@H]1CCCN(C2CCN(C(C)C)CC2)C1 11842127 YONIVCJAGNELHR-LJQANCHMSA-N 389.588 2.580 0 50 GFAA CCN(Cc1ccccc1)C(=O)C[C@@]1(c2cccc(F)c2)CC(=O)N(C)C1=O 11997140 BXUWLKVGDYRLTK-JOCHJYFZSA-N 382.435 2.891 0 50 GFAA C[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)N1CCN(c2ncccn2)CC1 12380496 JXQIKHVUYWOHSO-GFCCVEGCSA-N 381.263 2.900 0 50 GFAA Cc1[nH]cnc1CN1CC(=O)N(CC(C)C)C[C@H](OCc2ccccc2F)C1 14742801 ZRJNUKCETAMSHN-GOSISDBHSA-N 388.487 2.743 0 50 GFAA Cn1nc(C(=O)N2CCC[C@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)ccc1=O 15063567 GOPIHVOUKXMGNU-ZDUSSCGKSA-N 393.365 2.534 0 50 GFAA COc1ncc(CN2CCC(O)(Cc3cc(-c4ccccc4)no3)CC2)cn1 19781842 BYIQRSFQJGGGKR-UHFFFAOYSA-N 380.448 2.710 0 50 GFAA Cc1ccc(C2=NOC3(CCN(C(=O)c4ccc5c(c4)OCO5)CC3)N2)cc1 169754991 XZKFULHKPFDJGL-UHFFFAOYSA-N 379.416 2.638 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N(C)Cc4nnc(C)o4)C3)nc2c1 1857673723 ZUJVGMKWJYUCFC-AWEZNQCLSA-N 399.451 2.793 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@@H]1CC13CCC3)C2 1857685254 FWTDACPNSYGDFK-ATUDVECKSA-N 392.503 2.649 0 50 GFAA COc1ccc2c(C)c(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)oc2c1OC 1857713011 RNLBQUBDOYGOLJ-WBVHZDCISA-N 396.443 2.829 0 50 GFAA CCC(=O)N1CCC[C@]2(CCc3c2nc(C(C)(C)C)[nH]c3=NCc2cc[nH]n2)C1 1857731965 VYUYXLZETWLXMR-QFIPXVFZSA-N 396.539 2.748 0 50 GFAA O=C([C@@H]1CCCO1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857733849 BLGLRASVGDUJKP-KRWDZBQOSA-N 379.460 2.835 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC[C@H](n2ncc(N3CCC3)cc2=O)C1 328602858 CZPZEQUJZONNJP-INIZCTEOSA-N 386.883 2.893 0 50 GFAA Cc1nc(C)c(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)c(C)n1 1875261111 LBQQCTDHGIJBBX-UHFFFAOYSA-N 390.846 2.793 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](NC3CCC4(CC3)CC4(F)F)C2)n1 1875397520 CSRNAFLSYHZGRP-XAUUPUKJSA-N 393.482 2.589 0 50 GFAA C[C@@H]1CCCN(c2cc(N[C@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)C1 1857797757 LRONAABOSXWKCB-ZBFHGGJFSA-N 379.464 2.597 0 50 GFAA Cc1nc2ncnn2c(N(C)CCN(C(=O)[C@H]2CCCC23CC3)C(C)C)c1C 2325793855 KBDDFPAEKRBCSY-QGZVFWFLSA-N 384.528 2.995 0 50 GFAA O=C(N[C@@H]1C[C@H](NC(=O)c2ccc(C(F)F)o2)C12CCC2)C1=CCOCC1 2325794992 ZCKKRACGJJSEHY-CABCVRRESA-N 380.391 2.721 0 50 GFAA O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 794194 WKLJTSBXAWSUKP-IAGOWNOFSA-N 394.493 2.691 0 50 GFAA O=S(=O)(NCc1cccs1)c1ccc(I)cc1 1067972 WOMVNAARFVEYSC-UHFFFAOYSA-N 379.244 2.831 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)Nc1ccccc1 1119138 XIYXPFIMEQXFHA-NSHDSACASA-N 383.267 2.755 0 50 GFAA COc1ccccc1CNC(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O 1172089 RDAIDDCIUXMXNE-UHFFFAOYSA-N 390.505 2.901 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCC[C@@]12CCCN(C1CC1)C2=O 2356166842 BQNNFACESSQWSS-JOCHJYFZSA-N 394.475 2.815 0 50 GFAA CC1=C(C(=O)OC(C)C)[C@@H](c2cccc(Br)c2)n2nnnc2N1 2883319 YSRGMAKDQJLTTQ-CYBMUJFWSA-N 378.230 2.676 0 50 GFAA COc1cc([C@@H]2C3=C(COC3=O)Oc3cc4c(cc32)OCO4)cc(OC)c1OC 3053378 DWWALFYNQWNXFV-SFHVURJKSA-N 398.367 2.776 0 50 GFAA CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cccnc3)CC2)cc1 8421687 CFLVUFKJZUZLJE-MRXNPFEDSA-N 387.505 2.742 0 50 GFAA O=C1[C@@H](N2CCCN(c3cccnn3)CC2)CCN1c1ccc(Cl)c(F)c1 245929688 YGNKRGNDAWJNAW-KRWDZBQOSA-N 389.862 2.587 0 50 GFAA CC(C)OC(=O)[C@H]1[C@@H]2C(=O)N(c3ccccc3Br)C[C@@]23C=C[C@H]1O3 100833617 GOUMLHLYFWBNID-ADAWSYLGSA-N 392.249 2.687 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3cn(C)c4ccccc34)CC2)c1 29111488 BKUCSFGPUFFLCE-UHFFFAOYSA-N 377.444 2.785 0 50 GFAA CCN1C(=O)COc2cc3c(cc21)NC(=O)C[C@H]3c1cccc2nsnc12 65507332 MCDMPIMHTLPBEY-NSHDSACASA-N 380.429 2.911 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@@H](NCC(F)(F)F)C2 20706764 KIJVGRHAQICIHG-CYBMUJFWSA-N 384.402 2.777 0 50 GFAA C[C@H](CNC(=O)N[C@H]1c2ccccc2C[C@H]1O)c1nc(-c2ccccc2)no1 119802153 DEJNTPSVVNYGMA-XWIAVFTESA-N 378.432 2.798 0 50 GFAA CN(C[C@@H](O)c1ccccc1)C(=O)c1coc(Cn2cnc3ccccc32)n1 11938280 MNMMVURVBWCJGB-LJQANCHMSA-N 376.416 2.878 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN(c2cccc(Cl)c2)CC1 363442656 RQJLWRXIKFUNBP-UHFFFAOYSA-N 396.882 2.953 0 50 GFAA O=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1ccc(C(=O)O)nc1 485709762 SNMNRTMBWJKUHU-UHFFFAOYSA-N 387.351 2.833 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)CCn3ccnc3C)CC2)OC1=O 77319566 ACELJRXVMNQLMJ-UHFFFAOYSA-N 376.501 2.831 0 50 GFAA CN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)C[C@@H](O)COc1ccccc1 328634360 MQYOQIMFXCIGFB-LSDHHAIUSA-N 383.414 2.836 0 50 GFAA c1ccc([C@@H](Cn2ccnc2-c2ccc3c(c2)OCCO3)N2CCOCC2)nc1 71754778 DOYXVPNQAXRRSR-LJQANCHMSA-N 392.459 2.790 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1C 373140180 MDWVHQCPRANTJL-SJORKVTESA-N 380.510 2.781 0 50 GFAA Cn1ncc(C(=O)NCCc2nc3ccc(F)cc3[nH]2)c1Cc1ccccc1 445007043 IJXUYJFRSRRGBJ-UHFFFAOYSA-N 377.423 2.999 0 50 GFAA Cc1ccccc1C1(CN[C@@H]2CCCN(c3cnn(C)c3)C2=O)CCOCC1 173996719 AKAOLQWMUYDZQI-HXUWFJFHSA-N 382.508 2.562 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CC[C@H](N3CCCC3)C2)c(Cl)cc1Cl 238199298 TVUWNJPQTAJUMP-JTQLQIEISA-N 393.292 2.550 0 50 GFAA Cc1cccc(C(=O)N2C[C@H](C)C[C@@H](C(=O)O)C2)c1NC(=O)c1ccncc1 263398179 ZQKNDBZILDACMC-CZUORRHYSA-N 381.432 2.825 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c(C(=O)OC)c1C 17080797 OZSUIVWESWOGIQ-GHMZBOCLSA-N 395.433 2.625 0 50 GFAA Cc1ccc(-c2noc(CCC(=O)N3CCC(F)(F)[C@@H](CO)C3)n2)cc1F 291186422 JAMGOQKVOSBQRX-CYBMUJFWSA-N 383.370 2.593 0 50 GFAA Cc1nc(CCNC(=O)N2CCC[C@H]2c2nc(C(C)C)no2)nc2c1CCC2 426386935 QXJBMXFYSAKQJE-INIZCTEOSA-N 384.484 2.869 0 50 GFAA OCc1ccc(CN2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)o1 95373996 RAWUFKQVKLUPTO-VLCRHTCISA-N 382.460 2.563 0 50 GFAA CC(C)c1noc(CCNC(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)n1 91656647 KVAQAIULWXKFBN-INIZCTEOSA-N 376.501 2.671 0 50 GFAA Cn1cnnc1-c1ccc(NC(=O)N2CCC(N3CCSCC3)CC2)cc1 95520605 IZPGRKNGOXPSTB-UHFFFAOYSA-N 386.525 2.527 0 50 GFAA CN(C)C(=O)N1CCC[C@H](CCC(=O)N2CCN(Cc3ccccc3)CC2)C1 95528010 IMMXWGQHGJBFGL-HXUWFJFHSA-N 386.540 2.505 0 50 GFAA Cc1oc2c(c1C(=O)N1CC[C@@]3(CCCN(CC4CC4)C3=O)C1)C(=O)CCC2 91877258 PWCYNHFNDFHVNR-QFIPXVFZSA-N 384.476 2.972 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Nc3ccc(C(C)=O)cc3)C2)CCC1=O 91873263 JPGBHZYBQAGJBY-OAQYLSRUSA-N 387.480 2.772 0 50 GFAA CC(C)c1ccc(N2C[C@@H](C(=O)NCc3ncc4c(n3)CCC4)CC2=O)cc1 92065762 PGZRYWPFWVTRLG-KRWDZBQOSA-N 378.476 2.758 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(CCOCc1ccccc1)CC2 95499919 GBNVMWQCTHCXDT-UHFFFAOYSA-N 394.519 2.712 0 50 GFAA Cc1cc(N2CCC(N[C@H](C)c3ncnn3C)CC2)nc(-c2ccccc2)n1 96153773 ZDMSSUYNJGJSNR-MRXNPFEDSA-N 377.496 2.900 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(CN3CC=C(c4ccc(F)cc4)CC3)n2C)C1 244594224 DIRKPKXWKMEEHV-UAPYVXQJSA-N 383.471 2.626 0 50 GFAA CN1CCCN(Cc2ccc(C(=O)N[C@H]3CCCc4ccccc43)c(O)n2)CC1 253532612 MPTBHHMKPDEWBA-NRFANRHFSA-N 394.519 2.732 0 50 GFAA Cc1cccc(F)c1S(=O)(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F 184873429 SZNDCMTXVZEIAJ-OAHLLOKOSA-N 377.359 2.863 0 50 GFAA Cc1ccc(-c2cc3n(n2)[C@@H](NCc2ccc4c(c2)OCO4)CNC3=O)cc1 263617291 NBOPKQLLHCEQRO-HXUWFJFHSA-N 376.416 2.619 0 50 GFAA Cc1nn(C)c(C)c1-c1ccnc(NC2CCN(Cc3cccnc3)CC2)n1 48170807 KCIFRHGXMOVACK-UHFFFAOYSA-N 377.496 2.965 0 50 GFAA COc1cc(C)ccc1S(=O)(=O)N1CCC[C@@H](OCc2ccccn2)C1 952977684 OPASRDLPSAYRHX-QGZVFWFLSA-N 376.478 2.769 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)n1 952963931 AQPPMYJWPSJYAZ-CYBMUJFWSA-N 379.386 2.845 0 50 GFAA CCCOc1ccc(CNC(=O)N2CCN(c3cc(C4CC4)n[nH]3)CC2)cn1 186613664 RBXYTUXNNZYJQS-UHFFFAOYSA-N 384.484 2.503 0 50 GFAA CCC(CC)(CNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1)C(=O)O 170066863 FJVIJUGSNNCVNH-HOCLYGCPSA-N 380.872 2.867 0 50 GFAA CCOc1c(Cl)cc(CNc2cc(COC)nc3ncnn23)cc1OC 194100887 WBIJZFNQHBPILR-UHFFFAOYSA-N 377.832 2.944 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3nnc4ccccn34)CC1)OCC2 1704329324 QRVADASGGBWIPR-UHFFFAOYSA-N 380.448 2.815 0 50 GFAA Cc1ccc(-c2ccccc2CN2C[C@H]3CN(Cc4cnc[nH]4)C[C@]3(CO)C2)o1 1772805692 PMHKNQXNMHZHBF-CVDCTZTESA-N 392.503 2.904 0 50 GFAA CCCn1cc(C(=O)N2CCCN(c3nccc(C(F)(F)F)n3)CC2)c(C)n1 1772804725 RVTSLUODXWLLTO-UHFFFAOYSA-N 396.417 2.763 0 50 GFAA O=C1c2ccccc2C(=O)N1CCS(=O)(=O)c1ccc(Br)cc1 11148549 YVXSNFUEZAIWHT-UHFFFAOYSA-N 394.246 2.519 0 50 GFAA CC(=O)NCCC(=O)NC[C@H]1Cc2cc(-c3ccccc3C(C)=O)ccc2O1 12002049 VRBOOIPUPKOLMC-GOSISDBHSA-N 380.444 2.502 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)NCc2cnn(C)c2)no1 12751133 ZQSBJENKAQHQDH-UHFFFAOYSA-N 376.800 2.579 0 50 GFAA CCc1ocnc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 14974235 NREFGJDFYGFLGC-GFCCVEGCSA-N 381.354 2.787 0 50 GFAA CC(C)N1C[C@H](n2cnnn2)C[C@H]1C(=O)NC(c1ccccc1)c1ccccc1 14980908 WDPIXSMICCCART-UXHICEINSA-N 390.491 2.603 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)cc1 19863007 JINXIVDKQJHFGO-MRXNPFEDSA-N 399.424 2.986 0 50 GFAA COC1(C(=O)NC2CCC2)CCN(C(=O)c2conc2-c2ccccc2)CC1 1857668375 WLYOEOUJFMQEDV-UHFFFAOYSA-N 383.448 2.632 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)N3Cc4cnc(C)cc4C3)CC2=O)cc1Cl 1857674495 KUAJJSPZUAEMJT-AWEZNQCLSA-N 385.851 2.947 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2cscn2)CC[C@@H]1Nc1ncccn1 1857684899 JNWHHWCIAYBKMS-BPUTZDHNSA-N 375.498 2.625 0 50 GFAA COc1c(C)cc(C)cc1CN1C[C@@H]2[C@H](CNC(=O)C3CC3)[C@H]3CC[C@]2(C1)O3 1857721176 CQUFTBFVMYXWCT-DZCCDHAISA-N 384.520 2.818 0 50 GFAA C[C@@H]1C[C@@H](N)CCN1C(=O)CCC[S@@](=O)c1ccc(Br)cc1 237469535 PSWDBAMFNDVVNK-UZRORNOBSA-N 387.343 2.675 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCN(c3cccc(Cl)c3)CC2)CC[C@H]1N 1875243379 FBYIYNHQPVSOEL-KFKAGJAMSA-N 379.932 2.911 0 50 GFAA CC(=O)Nc1ccc(CN2C[C@H](c3ccc4c(c3)OCO4)[C@@H](C(=O)O)C2)cc1 247916958 GACDBHFVAZXPKZ-MSOLQXFVSA-N 382.416 2.674 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@H]1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 771641587 NDODEXJAYZQLFX-SFHVURJKSA-N 390.499 2.759 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CNCCn2ccnc2)cc1 20859830 XGMSYXSTRBEUCO-JOCHJYFZSA-N 394.519 2.545 0 50 GFAA CCn1nc(C)c(S(=O)(=O)N(C)C2CCN(Cc3ccccc3)CC2)c1C 266185204 PTEROARCRTUFHT-UHFFFAOYSA-N 390.553 2.805 0 50 GFAA CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)[C@H](F)C(F)(F)F)CC1 816527998 IIMCJNQQCAKASP-AWEZNQCLSA-N 379.329 2.723 0 50 GFAA Cc1cc2c[nH]nc2cc1NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1 1875293637 XIFKIQKJEHPZNX-GOSISDBHSA-N 384.461 2.663 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CCO[C@](C)(C(F)F)C2)cc1 888101801 HNXSNRZWLNQFFX-IBGZPJMESA-N 383.439 2.985 0 50 GFAA O=C(O)[C@H](C[C@H]1CCSC1)NCc1nc(C(F)(F)F)n2c1CCCC2 2325789689 GBPRJVGUWJFHQO-MNOVXSKESA-N 377.432 2.924 0 50 GFAA CN(C(=O)[C@@H]1CC2(CC2)CO1)[C@@H]1CCN(C(=O)c2ccc(C(C)(C)C)cn2)C1 2325827735 OUTGAHMVVKNZOA-AEFFLSMTSA-N 385.508 2.621 0 50 GFAA CC(C)[C@H](O)c1cn(-c2cccc(CNC(=O)c3ccc4c(c3)CCO4)c2)nn1 2325869710 YOTPDCZUEDEGFL-NRFANRHFSA-N 392.459 2.822 0 50 GFAA CCOC(=O)CN1C(=O)[C@@](O)(CC(=O)c2ccc(C)cc2C)c2ccccc21 780151 ZMKSFOWJCZLVOI-JOCHJYFZSA-N 381.428 2.674 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1 893089 GQENGUZWNAAEAP-UHFFFAOYSA-N 388.851 2.955 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Br)cc1 994036 NFGVLNFHAGTNRM-UHFFFAOYSA-N 397.250 2.526 0 50 GFAA CCc1cc2c(C)cc(=O)oc2cc1OCC(=O)NCCCCCC(=O)O 2097792 LHAGUWAPZDDHDN-UHFFFAOYSA-N 375.421 2.804 0 50 GFAA biogenic Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cc(-c4cnn(C)c4C)on3)C1)CC2 2356155026 URVISMYUJLMGGJ-NRFANRHFSA-N 392.463 2.602 0 50 GFAA COc1cc(Cl)c(C)cc1NC(=O)CN(C)S(=O)(=O)c1ccccc1 2866894 OUSVBHSELFBSPJ-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA COc1ccc(OC)c(C2=NO[C@@H](C(=O)N3CCN(c4ccccc4)CC3)C2)c1 4904422 GLPQVDFPYBWRMB-OAQYLSRUSA-N 395.459 2.546 0 50 GFAA COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)c2cccc(C)c2OC)c1 6700807 SHVFSONFLQXILF-UHFFFAOYSA-N 397.475 2.794 0 50 GFAA CC(C)C(=O)N1CCC(N2CCC[C@]3(CCN(C(=O)c4ccco4)C3)C2)CC1 67696629 TYXBRERPPPUPIP-QFIPXVFZSA-N 387.524 2.855 0 50 GFAA CCc1noc2ncc(C(=O)N[C@@H](C)CN3CCN(c4ccccc4)CC3)cc12 119589418 UURHISBHOVQAFL-INIZCTEOSA-N 393.491 2.726 0 50 GFAA COC(=O)[C@@H](C)NC(=O)Cc1c(C)c2cc3c(C)c(C)oc3c(C)c2oc1=O 211402190 RTPNYQBQJSFFJD-GFCCVEGCSA-N 385.416 2.993 0 50 GFAA CCN(CCN1CCCCCC1)C(=O)C[C@H](NC(C)=O)c1ccc(OC)cc1 253420057 KNPXUEXYCCVCOO-NRFANRHFSA-N 389.540 2.987 0 50 GFAA Cc1ccc(Sc2cc(N3CCC[C@@]4(CN(C)C(=O)O4)C3)nc(N)n2)cc1 72479266 ARDMQOBWWXBNED-LJQANCHMSA-N 385.493 2.939 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1CCCN(c2ccccc2)C1 363220369 ZGFNVTIIBXHTNH-SFHVURJKSA-N 376.464 2.736 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(C(=O)N3C[C@H](C)O[C@H](CC)C3)o2)C[C@H](C)O1 124423947 IYDWRCRGYLXHTF-CAOSSQGBSA-N 378.469 2.559 0 50 GFAA CCc1ccc([C@H]2CNCCN2C(=O)c2csc(-c3cnn(C)c3)n2)cc1 261707179 DIGINHDELVFNQY-GOSISDBHSA-N 381.505 2.893 0 50 GFAA C[C@@H]1CN(S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)[C@@H]1c1ccccc1 451285366 QTRXTOLKRYRSAV-KDOFPFPSSA-N 379.503 2.613 0 50 GFAA CC(C)c1cccc(O[C@H](C(=O)NCCc2nc(=O)o[nH]2)c2ccccc2)c1 447633235 WNRSESDQUJQJJA-IBGZPJMESA-N 381.432 2.965 0 50 GFAA O=C(NCCc1cnccn1)N1CCC(c2nc(-c3ccccc3)no2)CC1 378503624 OBTYQXPULPPFRP-UHFFFAOYSA-N 378.436 2.658 0 50 GFAA O=C1COc2cc(C(=O)N[C@]3(Cc4ccc(Cl)cc4)CCOC3)ccc2N1 282271212 XJWQSPXSYSJADS-FQEVSTJZSA-N 386.835 2.803 0 50 GFAA CC(C)c1cc(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)nn1C 174348588 MCWJPYXHAARUCS-NRFANRHFSA-N 384.524 2.719 0 50 GFAA Cc1cccc(OCC(=O)N[C@@H]2CCOC[C@H]2OCc2cscn2)c1C 222236682 UMRSUSKQVPTFRY-SJLPKXTDSA-N 376.478 2.629 0 50 GFAA COc1ccc2c(C)c(C(=O)NC(C)(C)c3nnc(N)s3)oc2c1OC 426479107 PCNPSUHUBKSGJD-UHFFFAOYSA-N 376.438 2.857 0 50 GFAA COCc1cc(CN2CCN(Cc3ccsc3)[C@@H](CCO)C2)ccc1OC 20451270 WWHHXFYDQMUALG-FQEVSTJZSA-N 390.549 2.972 0 50 GFAA Nc1cc(-c2ccc(C(=O)N3CCCC[C@@H]3CCn3cccn3)cc2)ncn1 426606776 RDNMNTHWVXUBQJ-GOSISDBHSA-N 376.464 3.007 0 50 GFAA CO[C@@]12CC[C@H](OCCO)C[C@@H]1N(Cc1c(C)cc(C)c(CO)c1C)CC2 426395162 JYBGYISDFPSIDA-YUXAGFNASA-N 377.525 2.625 0 50 GFAA Cc1cc(-n2nc(-c3ccncc3)nc2C[C@@H]2CN(C(C)C)CCO2)ccn1 97551353 FMYUZNZANZEGRR-LJQANCHMSA-N 378.480 2.684 0 50 GFAA Cc1ncc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)c(C)n1 95378156 CTQHAPICVQAOIF-FXAWDEMLSA-N 376.504 2.797 0 50 GFAA C[C@@H](CC(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1)n1ccnc1 92020629 ZWCRPCSWQKCZTK-SFHVURJKSA-N 395.507 2.661 0 50 GFAA CN(C(=O)CN1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1)C1CCCCC1 91518576 GYEVYALCYYBJHH-QFIPXVFZSA-N 375.557 2.892 0 50 GFAA COc1cncc([C@H](NC(=O)c2cc(O)nc3ccccc23)[C@H]2C[C@H](O)C2)c1 253535178 GLOWASVPCGYIQD-WVSMJXTDSA-N 379.416 2.586 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)c3ccc(CS(=O)(=O)C(F)F)cc3)c2c1C 182642877 JIAOJPWKTXPOBZ-UHFFFAOYSA-N 394.403 2.964 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)N3CCC[C@@H](Cn4ccnc4)C3)n2)cc1 534676096 GJKXTONJXNMDCD-INIZCTEOSA-N 380.452 2.863 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)c2cc(F)c(OC)c(F)c2)c1C 824424326 JHKIQOSWEJKYEZ-UHFFFAOYSA-N 378.375 2.910 0 50 GFAA COc1ccc([C@@H](CC(=O)O)NC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)cc1OC 268948296 RDTDHBPDGSFUHU-UZLBHIALSA-N 399.443 2.956 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 186647552 IJOVMZDPTHBCLN-HZSPNIEDSA-N 382.863 2.980 0 50 GFAA CCOc1cnc(C(=O)N(Cc2ccc(O)cc2)C[C@@H]2CCCN2CC)cn1 187247628 ZLHZRBBIACOMPO-KRWDZBQOSA-N 384.480 2.708 0 50 GFAA Cc1cc(S(=O)(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)sc1Cl 188142027 QGJXLXBIRWTMHF-NSHDSACASA-N 397.909 2.787 0 50 GFAA O=C(c1cncc(NC[C@@H](c2cccnc2)N2CCCCC2)n1)N1CCCC1 1704337928 IJKUTMWGHHTDCZ-IBGZPJMESA-N 380.496 2.747 0 50 GFAA O=C(c1ccc(NCc2cc(-c3cccc(F)c3)no2)nc1)N1CCOCC1 1704346957 DAPDCNHKPBYARJ-UHFFFAOYSA-N 382.395 2.960 0 50 GFAA COc1ccc(OCC(=O)Nc2ccc(I)cn2)cc1 6703093 SDROLOKXFAZQDI-UHFFFAOYSA-N 384.173 2.712 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(CCc2ccccc2)C1 1772811170 QSVBPKSYJANCLK-KNQAVFIVSA-N 399.560 2.991 0 50 GFAA CC(=O)N1C[C@@H]2CN(C(=O)Cc3c(C)noc3C)C[C@]2(CCc2ccccc2)C1 1772708732 JAECZNAZIBSJOB-OFNKIYASSA-N 395.503 2.774 0 50 GFAA Cc1cc(CNC(=O)CCN2Cc3cc(Cl)ccc3O[C@@H](C)C2)nn1C 11868177 KGSSKESZMAYEHV-AWEZNQCLSA-N 376.888 2.671 0 50 GFAA COc1cc(C)c(CN2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)cc1C 12191420 YUCNMOSVIKTFPS-UHFFFAOYSA-N 383.496 2.633 0 50 GFAA O=C(c1cc(COc2cccc(C(F)(F)F)c2)[nH]n1)N1CCN2CCC[C@H]2C1 12304946 ZTVNBNKTCLQYGV-HNNXBMFYSA-N 394.397 2.928 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)NCc2ccncc2C)o1 12320851 YVGHXNSBXQHVOL-UHFFFAOYSA-N 380.448 2.816 0 50 GFAA Cc1nc[nH]c1CN1CC(=O)N(C2CCCCC2)C[C@H](OCc2ccccn2)C1 14534954 LTWUWBHOKXWVHC-HXUWFJFHSA-N 397.523 2.675 0 50 GFAA CN(C[C@@H]1Cc2ccccc2O1)C(=O)CC[C@]1(Cc2ccco2)CCC(=O)N1 14989275 RFHKRNSSBWLFIX-AVRDEDQJSA-N 382.460 2.713 0 50 GFAA CCC(=O)N[C@H](c1nnc2n1CCN(C(=O)CC1=CCCCC1)CC2)C(C)C 15000404 UXIAXANGSDANMQ-FQEVSTJZSA-N 387.528 2.777 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1n[nH]c2ccccc12 15063927 FRMMBWRLTRGIKF-UHFFFAOYSA-N 386.459 2.962 0 50 GFAA C[C@H]1CCCN([C@H]2CCC(=O)N(CCS(=O)(=O)c3ccccc3)CC2)C1 19798659 GXNVZKPVOVQABJ-ROUUACIJSA-N 378.538 2.573 0 50 GFAA CC(C)n1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)N=c1ccn(-c2ncccc2F)[nH]1 1857527964 MOFASGGQQFGHTI-FIKMYACPSA-N 394.454 2.912 0 50 GFAA O=C(c1ccc2nn[nH]c2c1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857712808 UGKZTGGRSHBVFA-SFTDATJTSA-N 391.475 2.636 0 50 GFAA CCC(=O)N1CCC[C@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NC(C)C)C1 1875246890 GLEAHTPWRUFAPO-QFIPXVFZSA-N 379.508 2.997 0 50 GFAA O=C(CN1CCOC2(CCOCC2)C1)N[C@H](Cc1ccccc1)c1ccccc1 135605878 SGDVMWZPHCOPIA-JOCHJYFZSA-N 394.515 2.968 0 50 GFAA CC(C)c1nc([C@@H]2COCCN2C(=O)c2ccc(-n3cccc3)cc2O)no1 1875283109 GKXHWPQLKWKDMP-INIZCTEOSA-N 382.420 2.903 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCCC[C@@H]3[C@@H](C)NC(=O)c3cocn3)n[nH]2)o1 1875342113 YFQSJCTVNJNEFA-CXAGYDPISA-N 397.435 2.779 0 50 GFAA Cc1ccc([C@H](C)N[C@H]2CCN(c3cc(O)nc(O)n3)C2)cc1Br 1875400396 YMQFBGKLTYXDBN-AAEUAGOBSA-N 393.285 2.888 0 50 GFAA O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@H]1CS(=O)(=O)Cc2ccccc21 888092847 KNPMITSBSKRZSM-HNNXBMFYSA-N 399.390 2.756 0 50 GFAA Cc1c(NC(=O)c2cncc(Br)c2)c(=O)n(-c2ccccc2)n1C 682237 UXLHVFRDMPBKKQ-UHFFFAOYSA-N 387.237 2.894 0 50 GFAA O=C(N1CCN(c2ncnc3ccsc23)CC1)C1(c2ccc(O)nc2)CCC1 2325805339 BNFAXSOEEIWLLP-UHFFFAOYSA-N 395.488 2.562 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ccccc2F)CC[C@@H]1NC(=O)NCC 2356150299 WCMKHSVLYKFJKV-WBAXXEDZSA-N 379.476 2.725 0 50 GFAA COc1cc(-c2o[nH]c(=N[C@H](C)Cn3nc(C)cc3C)c2C(=O)O)ccc1F 2356163238 TVLIYCMUVAZDCF-LLVKDONJSA-N 388.399 2.923 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ccncc2)CC[C@@H]1Nc1cc(C)ncn1 2356166123 PDAOPSYAYGHUKX-FHWLQOOXSA-N 383.496 2.872 0 50 GFAA COC(=O)c1ccc(C)c(NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)c1 2993143 LTJCQUJJUOADTJ-AWEZNQCLSA-N 390.461 2.575 0 50 GFAA CCOc1ccccc1[C@@](N)(C(=O)NCCN1CCC[C@@H](C)C1)C(F)(F)F 221896740 DDXAFYPESUOTGV-RDTXWAMCSA-N 387.446 2.650 0 50 GFAA C[C@]12C(=O)N(c3ccc(I)cc3)C(=O)[C@H]1[C@H]1C=C[C@H]2C1 100809917 RFKPHBPWISGQRV-RRUOHSGJSA-N 379.197 2.993 0 50 GFAA CN(Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1)C[C@@H]1CCCCO1 55153712 ZVVXHFQPJSGBGD-SFHVURJKSA-N 383.558 2.868 0 50 GFAA CCCNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 248027241 WLMPPYHRXPUOIQ-DPDCMNJDSA-N 376.840 2.941 0 50 GFAA COc1ccc(NC(=O)NCCNc2cc(N3CCCC3)nc(C)n2)c(C)c1 67622432 BBJGKMABFSUWMP-UHFFFAOYSA-N 384.484 2.936 0 50 GFAA CN1CCN(Cc2nnc(S)n2-c2ccc(OCc3ccccc3)cc2)CC1 22590853 BMECUTRAIIGEBM-UHFFFAOYSA-N 395.532 2.882 0 50 GFAA O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCCN(C(=O)C2CC2)CC1 123109699 OSIVZRBSFHXAFY-UHFFFAOYSA-N 387.377 2.998 0 50 GFAA C[C@H]1CN(C[C@H]2CCCN2S(=O)(=O)C2=Cc3ccccc3CC2)C[C@@H](C)O1 229656595 DJZWGVVBQSVULJ-FUHIMQAGSA-N 390.549 2.877 0 50 GFAA NC(=O)c1cnc(NC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 363369991 YEBIDWKAOUPSOL-MRXNPFEDSA-N 398.410 2.635 0 50 GFAA CC(=O)N[C@@H](CC(=O)NCc1ccc(-n2ccnc2)nc1)c1ccc(Cl)cc1 363430963 KKCIUVALWDIBTI-SFHVURJKSA-N 397.866 2.804 0 50 GFAA O=C(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(-n2cnnc2)c1 215357459 UKTFZMLQHDHTIQ-MRXNPFEDSA-N 376.338 2.750 0 50 GFAA Cc1noc([C@@]2(O)CCN(S(=O)(=O)c3csc4ccc(Cl)cc34)C2)n1 328613808 UEQDZUVAPVMBQU-OAHLLOKOSA-N 399.881 2.528 0 50 GFAA CN(C[C@@H]1CCc2nccn2C1)S(=O)(=O)c1sccc1Br 328638484 WLNVZLUENUCRMH-JTQLQIEISA-N 390.328 2.590 0 50 GFAA CCN(CC(=O)O)C1CCN(S(=O)(=O)/C=C/c2ccccc2Cl)CC1 328605616 OELSEBHUABDBIV-FMIVXFBMSA-N 386.901 2.511 0 50 GFAA O=S(=O)(c1ccc2c(c1)CCCO2)N1CCC(Nc2nccs2)CC1 375313848 HTRRVBZPDZGTGU-UHFFFAOYSA-N 379.507 2.733 0 50 GFAA O=C1N[C@@H](CCC(=O)N2CCN(c3ccccc3)CC2)C(O)=Nc2ccccc21 32093932 SPTBQXFOZSLTGB-IBGZPJMESA-N 392.459 2.516 0 50 GFAA CCc1ccc([C@H]2CNCCN2C(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1 261627479 DNELHWPYPBWRNC-HXUWFJFHSA-N 380.492 2.600 0 50 GFAA Cc1c(C(=O)N(C)Cc2cccc(OC(F)(F)F)c2)nnn1C1CCNCC1 237121221 GVSBHDHYAHLDCO-UHFFFAOYSA-N 397.401 2.682 0 50 GFAA O=C(Nc1nnc(C(F)(F)F)s1)NC1CCN(Cc2ccncc2)CC1 193521955 HUZWFUBUAQKNIJ-UHFFFAOYSA-N 386.403 2.738 0 50 GFAA Cc1nc([C@@H]2CCOC2)cc(N2CCCN(C3Cc4ccccc4C3)CC2)n1 426383138 NFVKSWHHMAWGJW-HXUWFJFHSA-N 378.520 2.968 0 50 GFAA CCC(=O)NCc1cc2n(n1)CCN(C(=O)c1ccc(N3CCCCC3)cc1)C2 426614999 CANGYCSAGNIXOO-UHFFFAOYSA-N 395.507 2.556 0 50 GFAA CS(=O)(=O)CCNC(=O)c1csc(-c2ccc(C(F)(F)F)cc2)n1 97773253 IWGBOVACFBLVKZ-UHFFFAOYSA-N 378.397 2.603 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cnc(-c3ccccn3)nc1)C2 92107015 SCBOAQGQDOQDJA-AWEZNQCLSA-N 376.416 2.528 0 50 GFAA CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)C(=O)OCc1ccccc1 147753604 FQWBPPZWWQDSGU-HOCLYGCPSA-N 378.469 2.784 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(C(=O)CSc1nc3ccc(C)cc3[nH]1)C2 95353497 ZSLRTNIWIXMSFO-HZPDHXFCSA-N 388.537 2.533 0 50 GFAA CN(C)c1cc2c(cc1NC(=O)N1CC[C@@H]1c1cccs1)n(C)c(=O)n2C 96152668 GQXFKIDJDHILQB-CYBMUJFWSA-N 385.493 2.983 0 50 GFAA Cc1cccnc1[C@@H](C)Nc1ncc(C(C)(C)C(=O)O)c(N2CCOCC2)n1 96163120 LMJZVSZMRUVXLE-CQSZACIVSA-N 385.468 2.552 0 50 GFAA O=C1CC2(CCN(C(=O)NCc3ccc(Oc4ccccc4)nc3)CC2)CN1 267639308 AJPVMDKCYQMALD-UHFFFAOYSA-N 380.448 2.686 0 50 GFAA CNC(=O)c1cccc(CNC(=O)N2CCC[C@H](C(=O)c3cccs3)C2)c1 584901950 XKQNOFGGJJPNIL-INIZCTEOSA-N 385.489 2.912 0 50 GFAA COc1cc2c(cc1OC)[C@H](NC(=O)[C@H](C)n1cnc3ccccc3c1=O)CC2 888105477 BUFFYWYYCSRTHZ-SCLBCKFNSA-N 393.443 2.778 0 50 GFAA CCN(Cc1ccccc1OCCN1CCN(C)CC1)C[C@@H]1CCCCO1 952972439 OXMNNFFJWLCCQH-NRFANRHFSA-N 375.557 2.704 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@H]1C[C@@H]1C(=O)O)CC2 268880529 DEFHSJCLNQXTIX-SUNYJGFJSA-N 387.457 2.960 0 50 GFAA CSCc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccn2)C3)o1 1565529014 FXNIKSJSVZWYHX-CABCVRRESA-N 385.489 2.914 0 50 GFAA O=S(=O)(Cc1cc(F)cc2c1OCOC2)c1nc(CCC2CCCC2)n[nH]1 170623211 LDENPHPZKQLRRP-UHFFFAOYSA-N 395.456 2.907 0 50 GFAA Cc1ccc(F)c(-c2cc(NC(=O)c3ccc(CS(N)(=O)=O)cc3)[nH]n2)c1 190111861 SCEMTOFPNSAHLD-UHFFFAOYSA-N 388.424 2.565 0 50 GFAA C[C@@H](C(=O)Nc1ccc(NC(=O)Cc2ccc(Cl)cn2)cc1)n1cncn1 785842155 JFFDELJBSPLTJN-LBPRGKRZSA-N 384.827 2.707 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](C(=O)c3ccccn3)C2)cnn1-c1ccccn1 1506405666 KTKDMPXWTSFIQV-INIZCTEOSA-N 375.432 2.706 0 50 GFAA Nc1nc2c(c(C(=O)N3CCC(c4nc5ccc(F)cc5[nH]4)CC3)n1)CCCC2 1506401024 HSFOTBFJQHKHJY-UHFFFAOYSA-N 394.454 2.973 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCC([C@@H](O)c3ccccn3)CC2)CC1 1506398071 JHUDOGYHISESMU-OAQYLSRUSA-N 380.492 2.527 0 50 GFAA CCc1ccccc1C(=O)N1CCO[C@H](CO)[C@H]1c1ccc(OC)c(OC)c1 1529182248 ZBNQZMMYLJZHDA-NHCUHLMSSA-N 385.460 2.841 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cccc(F)c2OC)cc1OC 1529168428 DAGQXPHOKLZUAJ-WOJBJXKFSA-N 391.439 2.786 0 50 GFAA Cc1cccc2nc(CNC(=O)[C@H]3CCC(=O)N(Cc4ccccc4F)C3)cn12 12300514 ZTNRZXNHENMZLL-KRWDZBQOSA-N 394.450 2.837 0 50 GFAA CCOC(=O)C[C@@H]1CCCCN1C(=O)c1cn(C/C=C/c2ccccc2)nn1 12433059 YXRUELACASYCLG-MZEUMTGBSA-N 382.464 2.939 0 50 GFAA COC(=O)[C@@H](NC(=O)c1coc(Cn2cnc3ccccc32)n1)c1ccccc1 12449375 KNZZOHBCPXVBQI-IBGZPJMESA-N 390.399 2.717 0 50 GFAA COCCN(Cc1ccc(OC)c(OC[C@H](O)CN(C)C(C)C)c1)C(C)C 15072978 PYQGHCJZOARWHN-LJQANCHMSA-N 382.545 2.632 0 50 GFAA Cc1nc(C(=O)N(C)Cc2cccc(F)c2)nc(N2CC[C@@H](N(C)C)C2)c1C 1857528655 CWVGETFGIVEGNS-GOSISDBHSA-N 385.487 2.645 0 50 GFAA CC(C)Cn1cncc1CNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857695388 HWDIZLKOAYYGDY-MRXNPFEDSA-N 396.495 2.998 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857698415 QJSFYVHJKQWMOB-UHFFFAOYSA-N 384.443 2.898 0 50 GFAA CCc1cnc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4ccccc4)C3)C2)nc1 1857703551 MSUQCICXAVWMMH-KNQAVFIVSA-N 380.492 2.533 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1nc3c(s1)CCCC3)C2)c1cccc(O)n1 1857703703 WYWONBAJKAVPER-IKDJWVMYSA-N 398.532 2.763 0 50 GFAA O=C1C[C@H]([C@H]2CCCCN2C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1 132616434 UVBAAFHZFZTPTH-DLBZAZTESA-N 380.448 2.745 0 50 GFAA O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1C[C@@H](CO)[C@H](C2CC2)C1 1875296905 UOYPAYNZMAAXQB-ZFWWWQNUSA-N 390.281 2.930 0 50 GFAA CC1(C)CCCN1C(=O)C(=O)N1CCN(C(=O)c2cc3ccccc3s2)CC1 1875265903 RLLLKFCKCXBPKH-UHFFFAOYSA-N 399.516 2.587 0 50 GFAA COC(=O)[C@H](NS(=O)(=O)c1ccc2c(c1)Cc1ccccc1-2)C(F)(F)F 1875333269 LPYBYGIMUIZVGM-HNNXBMFYSA-N 385.363 2.640 0 50 GFAA Cc1ncc(C(F)(F)F)cc1C(=O)N=[S@]1(=O)CCC[C@]2(CCCN2)C1 1875393382 MAEFTDUCWAJMET-BZQUYTCOSA-N 375.416 2.933 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc(N3CCOC[C@@H]3C)c(Cl)c2)CC1 1875366270 IYEKCQSIZQRVAN-AWEZNQCLSA-N 391.899 2.928 0 50 GFAA CN(C(=O)Cc1ccc(F)c(F)c1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)C1 1875316774 GCVNPRBRAJJNHK-IYYNEKPFSA-N 388.458 2.859 0 50 GFAA COc1cc(C)cnc1C(=O)N[C@H]1CC[C@@H](CNC(=O)c2coc(C3CC3)n2)C1 1875333625 FAGURRYVMPXENA-HIFRSBDPSA-N 398.463 2.593 0 50 GFAA CCC[C@@H](C)N(C)C(=O)[C@@H](Cc1cn(-c2cncc(C(=O)O)c2)nn1)C1CC1 1875326153 CJZPOMFOKPIZGN-ACJLOTCBSA-N 385.468 2.576 0 50 GFAA COCCn1nc(C(=O)NCc2ccc(OC)cc2F)c2c1[C@H](C)O[C@H](C)C2 1875403169 QHAJZVAYYHNOSL-OLZOCXBDSA-N 391.443 2.629 0 50 GFAA O=C(Nc1ccc2ncsc2c1)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@@H]3C2)C1 888102291 PAFPWZRFHWKHRO-FVQBIDKESA-N 399.520 2.646 0 50 GFAA O=C1CO[C@H](C(=O)NCCc2c[nH]c3ccccc23)[C@@H](c2ccccc2Cl)N1 2100544629 CAECNEXGULLWSO-UXHICEINSA-N 397.862 2.736 0 50 GFAA NCc1cncc(C(=O)N2CCC(c3nn(-c4ccccc4)cc3F)CC2)c1 2325793224 LNPHBGSFZQCDBT-UHFFFAOYSA-N 379.439 2.885 0 50 GFAA Cn1ccnc1CNc1ccc(C(=O)N2CCNC[C@H]2c2ccc(F)cc2)cc1 2325813184 UMQFXYVNLVELCG-FQEVSTJZSA-N 393.466 2.958 0 50 GFAA NC(=O)c1ccccc1Oc1ncccc1C(=O)Nc1nccn1CC(F)F 2325855670 KOMBQLMJXQRVMY-UHFFFAOYSA-N 387.346 2.687 0 50 GFAA COc1ccc(N(CC(=O)N(C)C)S(=O)(=O)c2ccc(C)cc2)cc1Cl 816880 SVXXFUGPJPFKJI-UHFFFAOYSA-N 396.896 2.941 0 50 GFAA Cc1ccc(N([C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)cc1 2890573 LDPFYHRTAQMWLU-ZDUSSCGKSA-N 376.434 2.517 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c1 4976104 AWSLXCPMJCFVSM-INIZCTEOSA-N 383.423 2.814 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCCC[C@H]3CN3CCOCC3)cc2)n1 110959187 SMJVJQLGMZBMOF-QFIPXVFZSA-N 396.535 2.875 0 50 GFAA COc1ccc2ncc(-c3cnn(CC(=O)Nc4cc(C)nn4C)c3)cc2c1 23340214 TWVPYGOZFWIVET-UHFFFAOYSA-N 376.420 2.788 0 50 GFAA O=S1(=O)C=C[C@H](NCc2ccc(-c3ccn(CCCC(F)(F)F)n3)o2)C1 20168642 GJZXECBJYAYETH-LBPRGKRZSA-N 389.399 2.886 0 50 GFAA Cc1cc(C)n([C@H](C)C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)n1 139396133 RKJNXOWFAJQLPM-GOSISDBHSA-N 382.508 2.801 0 50 GFAA Cc1nc2c(cnn2C(C)C)c(C)c1CCC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 252538923 NIYVTQHTXTYWMD-XFRWPIEPSA-N 382.508 2.789 0 50 GFAA Cc1ccn([C@H](C)C(=O)Nn2c(C)nc3sc4c(c3c2=O)CC[C@H](C)C4)n1 2778074 NNVRSXKIALPPSB-CMPLNLGQSA-N 385.493 2.727 0 50 GFAA COCc1ccc(C(=O)N2CCOC[C@H]2CC(=O)Nc2cc(F)ccc2F)o1 72426529 GEYMIAFEGSAIHU-CYBMUJFWSA-N 394.374 2.574 0 50 GFAA COc1ccc(F)c(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCC3)c2)c1 71775934 IYQBHBAFRORKLM-UHFFFAOYSA-N 379.409 2.984 0 50 GFAA c1cc2c(cc1CN1CCC[C@H](c3n[nH]cc3CN3CCOCC3)C1)CCO2 328632520 LJTFCYXPSQBKQS-IBGZPJMESA-N 382.508 2.556 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)Cc2cc(Cl)ccc2F)cn1 328629327 ORCXFEQYWMDENC-JKSUJKDBSA-N 387.864 2.645 0 50 GFAA CC(C)Oc1ccc2ccccc2c1CNC(=O)N1CCS(=O)(=O)C[C@H]1C 241776821 RSZIHHHZLQLCLQ-OAHLLOKOSA-N 390.505 2.956 0 50 GFAA Cc1nc(CN2CCN(C(=O)Nc3nc4c(s3)CCCCCC4)CC2)n[nH]1 333042219 AOGMEKOWQRBTEK-UHFFFAOYSA-N 389.529 2.578 0 50 GFAA c1ccc(CN2CCC[C@]3(CCCN(Cc4cc5n(n4)CCNC5)C3)C2)cc1 72162710 KEBGPFUBILNBDR-QHCPKHFHSA-N 379.552 2.865 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 370798293 LNDIEROBRWMQJU-OUCADQQQSA-N 384.307 2.932 0 50 GFAA Cc1ccc(-c2cncc(C(=O)N3CCCC[C@H]3CNC(=O)CCN)c2)cc1 262777843 KZTKFRHQRJBHNF-FQEVSTJZSA-N 380.492 2.517 0 50 GFAA Cc1nc2ccccc2n1CCNC(=O)N1CCC(OC[C@@H]2CCCO2)CC1 378039562 FIRLIHGRYRMIKR-SFHVURJKSA-N 386.496 2.714 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc4ccccc4o3)CC2)C1 71315695 JSHKLMVZHCMRNV-IBGZPJMESA-N 399.535 2.872 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3csc(S(C)(=O)=O)c3)c2)n1C 378340843 REXPAYPSOAJMBG-UHFFFAOYSA-N 376.463 2.508 0 50 GFAA Cc1ccc(C[C@H](C)NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)s1 282296733 WWPASODGKFTCJR-AWEZNQCLSA-N 399.582 2.587 0 50 GFAA CN1C(=O)[C@@](CCC(=O)N2CCC(O)CC2)(Cc2ccccc2)c2ccccc21 71745401 IMRGKRBXNVFDIQ-DEOSSOPVSA-N 392.499 2.907 0 50 GFAA Cc1c([C@H](C)NS(=O)(=O)CC2CCOCC2)cnn1-c1ccc(F)cc1 173011813 XAUVTEODSXYIFG-ZDUSSCGKSA-N 381.473 2.727 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H](N(C)CC(=O)O)CC2)C12CCCCC2 263207555 IHSGQJYHVXSOHT-KZNAEPCWSA-N 395.544 2.695 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)NCc2nc3c(s2)CCCC3)cc1 220564675 JVKLWMMSEASOSL-UHFFFAOYSA-N 379.507 2.714 0 50 GFAA c1ccc(-c2noc(CN3CCN([C@@H]4CCc5ccccc5C4)CC3)n2)nc1 19790860 XMIURZWQSZYFIH-LJQANCHMSA-N 375.476 2.807 0 50 GFAA CC[C@H](C(=O)NC[C@@H](C)Cn1cccn1)n1nc(C(F)(F)F)c2c1CCC2 20607691 HCIHGYDTZFOJCB-TZMCWYRMSA-N 383.418 2.991 0 50 GFAA CC(C)c1nccn1CCCNC(=O)N(C)Cc1nc(-c2ccccn2)no1 426604247 GULHUOJPUIHWBJ-UHFFFAOYSA-N 383.456 2.683 0 50 GFAA CCOC(=O)[C@H](C)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95503129 UIJBSUXGEAPMSV-AWEZNQCLSA-N 380.435 2.731 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccc(O)cn3)C2)CN1CCc1ccccc1 95512342 URUPXMCVNQBIJS-HSZRJFAPSA-N 393.487 2.875 0 50 GFAA CCc1ccccc1[C@H](C(=O)O)N1CCN(Cc2ccc(OC)cc2)C(=O)C1 95521581 SOQCQCZVYVMKLJ-OAQYLSRUSA-N 382.460 2.728 0 50 GFAA CC(C)CS(=O)(=O)N1CCC(N[C@H](C)c2ccc3c(c2)OCCCO3)CC1 180020084 VJUHSPCSCNIBKT-MRXNPFEDSA-N 396.553 2.949 0 50 GFAA O=C1COc2ccc(C(=O)N[C@@H]3CCN(c4ccc(F)c(Cl)c4)C3)cc2N1 180347485 QMQZNFLCBJNCGJ-GFCCVEGCSA-N 389.814 2.819 0 50 GFAA CS(=O)(=O)c1nc(C(F)(F)F)nn1-c1ncc(C(F)(F)F)cc1Cl 261494850 MDPYGVRMENUKPE-UHFFFAOYSA-N 394.684 2.757 0 50 GFAA CCOc1ccc(CN2CCN(Cc3[nH]c(CC)nc3C)C[C@H]2CCO)cc1 55154516 LZKIVVARCNDLHL-LJQANCHMSA-N 386.540 2.748 0 50 GFAA O=C(N=c1cc[nH]cc1)c1ccc(CNC(=O)c2ncoc2[C@H]2CCCO2)cc1 1339298060 SGRFGSJYVCGJMI-QGZVFWFLSA-N 392.415 2.525 0 50 GFAA O=C(N1CC[C@H](Nc2ncccn2)[C@@H](O)C1)C1(c2ccc(Cl)cc2)CCC1 1565510288 LYWLKBGMLORWDI-IRXDYDNUSA-N 386.883 2.626 0 50 GFAA c1sc(C2CC2)nc1CN1CCC[C@H](c2[nH]ncc2CN2CCOCC2)C1 275537960 MKFNQEUKEREGGL-INIZCTEOSA-N 387.553 2.955 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NC[C@H]3CCN(CC(F)(F)F)C3)c2O1 192622174 NZKSFXBSOAFUSL-GFCCVEGCSA-N 392.443 2.563 0 50 GFAA Cc1nccn1C[C@@H](C)CNC(=O)[C@@H]1Cc2cc(Br)ccc2O1 194140926 YJWPDJBGXURLKJ-ZBEGNZNMSA-N 378.270 2.710 0 50 GFAA Cc1cccc(NC(=O)CC(=O)NCCc2csc(-c3ncccn3)n2)c1 1506426452 OTZZUYKUSORTPL-UHFFFAOYSA-N 381.461 2.596 0 50 GFAA CCOc1cc(CN2CCN(CC(F)(F)F)CC2)ccc1OCCN(C)C 1506403906 WULFRUDQCVHQBH-UHFFFAOYSA-N 389.462 2.706 0 50 GFAA CN1CCOC2(CCN(Cc3cccc(OCCCn4ccnc4)c3)CC2)C1 1772810077 IPJVAYLSAFUZMY-UHFFFAOYSA-N 384.524 2.649 0 50 GFAA COc1ncccc1C(=O)NC[C@H]1Cc2cccc(-c3nc(C)cnc3C)c2O1 11969798 LPDCMWDNIXKLPH-MRXNPFEDSA-N 390.443 2.898 0 50 GFAA Cc1cc(Cl)ccc1C(=O)[C@H]1CCCN(C(=O)C2=NN(C)C(=O)CC2)C1 12194456 MEFHFFHWDBKTIA-ZDUSSCGKSA-N 375.856 2.678 0 50 GFAA O=C(CCNC(=O)N1CCc2c([nH]c3ccccc23)C1)NCc1ccccc1 12297029 IZOYVCVPWIEAPG-UHFFFAOYSA-N 376.460 2.942 0 50 GFAA biogenic COc1ccc(NC(=O)CCC2CCN(C(=O)[C@@H]3CCCO3)CC2)c(OC)c1 12438902 NARZDSOBKSCJGT-SFHVURJKSA-N 390.480 2.840 0 50 GFAA O=C1NCCN(Cc2ccc3ccccc3c2)[C@@H]1CC(=O)N1CCCCCC1 12459657 YURGXFUAMNRRGS-OAQYLSRUSA-N 379.504 2.933 0 50 GFAA C[C@@H](NC(=O)CCc1ccccc1)c1nnc2n1CCN(Cc1ccco1)CC2 14987150 SLMOEJIZVPFBGG-QGZVFWFLSA-N 393.491 2.739 0 50 GFAA CCOC(=O)CNC(=O)/C(=C\c1ccccc1)NC(=O)/C=C/c1ccccc1 4545247 VCANPGAKPQTOMT-MNOJGGAQSA-N 378.428 2.536 0 50 GFAA Cc1cc(CNC(=O)[C@]23COC[C@H]2CN(C/C=C/c2ccccc2)C3)ccn1 1857684896 JJSQTJLKZWQIJS-QFWWGHIWSA-N 377.488 2.668 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857696477 CEZIDGNHORSLIN-HXUWFJFHSA-N 385.489 2.728 0 50 GFAA CO[C@H]1C[C@@H](c2nc(COc3ccc(F)cc3)nn2-c2ccccn2)CC[C@@H]1N 1857721411 NPQCESUCCAWFLQ-WBAXXEDZSA-N 397.454 2.990 0 50 GFAA CCc1nccc(-c2nccn2-c2ccc(N3CCN(C(C)=O)CC3)cc2)n1 1857729482 CKSUQAZZFBYQMN-UHFFFAOYSA-N 376.464 2.560 0 50 GFAA O=C(CCc1ccccc1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857730490 UHAVCNWCNIIXSD-VIZSFHNOSA-N 376.456 2.920 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCC[C@@H]3C3CCOCC3)ccc2N1 329475601 NUELOBYPIORPRG-GOSISDBHSA-N 378.494 2.541 0 50 GFAA O=C1CCCN1Cc1ccc(C(=O)N2CC[C@@]3(C2)C(=O)Nc2ccccc23)cc1 363941679 ZEJNVLQPGJNXOL-QHCPKHFHSA-N 389.455 2.545 0 50 GFAA O=C(NCCn1cnc2ccccc21)[C@@H](c1ccccc1)N1CCCCC1=O 263958676 IZLVXUASWRIVEC-OAQYLSRUSA-N 376.460 2.906 0 50 GFAA O=C1O[C@H](C(=O)Nc2nc(-c3ccc4ccccc4n3)n[nH]2)Cc2ccccc21 820139261 AMPUKRMSQPTCOX-KRWDZBQOSA-N 385.383 2.740 0 50 GFAA CO[C@H]1C[C@@H](CN(C)C)N(c2cc(N3CCCc4sccc4C3)ncn2)C1 864705308 YGAISKDUNKPOEL-IRXDYDNUSA-N 387.553 2.646 0 50 GFAA C[C@H](Oc1ccc(Br)cc1Cl)c1noc(Cn2cnnn2)n1 1875286197 NZBGMQDKALIGJR-ZETCQYMHSA-N 385.609 2.660 0 50 GFAA O=C(N[C@@H]1CCNC1)c1ccc(N2CCc3c(cccc3C(F)(F)F)C2)nc1 1875319122 ZRGHMTHQNCJDCH-OAHLLOKOSA-N 390.409 2.755 0 50 GFAA CC(C)Cc1ccc2c(N)c(C(=O)N3CC[C@@H]([C@H]4CNC(=O)C4)C3)sc2n1 1875313465 RJIUSSLIEFYQTC-CHWSQXEVSA-N 386.521 2.675 0 50 GFAA Cc1nc(O)nc(O)c1CCC(=O)N(C)Cc1ccc(-c2cccnc2)c(F)c1 2325826009 LLMLOLXZCNUZFG-UHFFFAOYSA-N 396.422 2.989 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(SCc1ccc(F)cc1)n2Cc1ccccc1 637331 ZPMIXSGPYGPHHZ-UHFFFAOYSA-N 396.447 2.903 0 50 GFAA CCOC(=O)c1c(NC(=S)NC(=O)c2ccn(C)n2)sc2c1CCCC2 694720 RNQIIWCUNBLMKQ-UHFFFAOYSA-N 392.506 2.664 0 50 GFAA C=CC(=O)N[C@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 2577141 PQSKRDCYDLWOAX-LLVKDONJSA-N 396.683 2.670 0 50 GFAA COc1ccccc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 2885094 NCEUKOMGCYKYPO-AWEZNQCLSA-N 392.452 2.874 0 50 GFAA CCCOc1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br 8714707 RJUHGEGYFFWDBE-NSHDSACASA-N 378.288 2.695 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@@H](C)c2cccc(OC)c2)n1CCOC 55254307 QSPPCKBXVMZWIQ-HNNXBMFYSA-N 395.525 2.525 0 50 GFAA Cc1cc2ncn(Cc3cc(C(=O)N[C@@H](C)c4cnn(C)c4)n[nH]3)c2cc1C 67955092 VQERGWKIYQPWCM-AWEZNQCLSA-N 377.452 2.649 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@@H]1c1ccc(OC(F)(F)F)cc1 120932727 JPAAYWNQQPKMPV-ZIAGYGMSSA-N 386.351 2.589 0 50 GFAA C[C@H](Cc1cc(C(=O)N2CCN(c3cnccn3)CC2)on1)c1ccccc1 12036418 IESKGMUZPVXOOA-MRXNPFEDSA-N 377.448 2.773 0 50 GFAA Nc1ccc(S(=O)(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)cc1 32593947 VAKFMDADGIIYDO-UHFFFAOYSA-N 384.461 2.887 0 50 GFAA Nc1nccnc1C(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl 124735373 HVDVYJPVWCPNLP-ZDUSSCGKSA-N 394.262 2.999 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328615960 BFTGYMPEVZNTRN-OAHLLOKOSA-N 377.448 2.852 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N[C@@H]1CCN(Cc2ccccc2)C1=O 363120209 PASZCIPZFQKOJN-HXUWFJFHSA-N 389.459 2.854 0 50 GFAA Cc1ccccc1C(=O)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71750672 VVQBRGXFDOIRTH-IBGZPJMESA-N 383.536 2.934 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N3CCC(O)(CN4CCCC4)CC3)cc2)n1 77535996 LOXHQEHYMGHYQE-UHFFFAOYSA-N 382.508 2.552 0 50 GFAA CN(C(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1)c1cnn(C)c1 153990306 HRAOLDMUSOYFCE-UHFFFAOYSA-N 394.397 2.954 0 50 GFAA C[C@@H](NC(=O)Cn1c(-c2ccco2)nn(-c2ccc(Cl)cc2)c1=O)C1CC1 77522513 UGQXFNXOKMFRJF-GFCCVEGCSA-N 386.839 2.862 0 50 GFAA O=S(=O)(c1cnc[nH]1)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 372229591 XIBOCNNYYSFRAR-CQSZACIVSA-N 393.513 2.874 0 50 GFAA CC(=O)N1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CCCCC2)[C@H](O)C1 426493074 VDTXTZZVXUVXIX-QZTJIDSGSA-N 378.900 2.640 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCN2CCC[C@@H]2C1 426716160 SEITXRLXZVYFFR-GOSISDBHSA-N 384.501 2.581 0 50 GFAA CN1CCN(Cc2cccc(OC[C@H](O)CN3CCCCCC3)c2)CC1(C)C 95528044 DXZQHWXAAKDIRU-OAQYLSRUSA-N 389.584 2.828 0 50 GFAA C[C@H](O)c1cccc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 95353191 RZQUFMFMTFWOGU-SFHVURJKSA-N 394.519 2.982 0 50 GFAA COc1cc(CNC[C@@H](O)CN2CCCC2)ccc1OCc1ccc(F)cc1 237227688 KIYBYMRKUVZQRB-HXUWFJFHSA-N 388.483 2.960 0 50 GFAA O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@H]1CCn1cccn1 426612762 ZZSNMVYXUWWQSG-KRWDZBQOSA-N 379.468 2.823 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4ccccn4)C3)C2)cn1 95499247 HEFAURHPMPVILE-QHCPKHFHSA-N 392.503 2.873 0 50 GFAA Cc1nccn1CCC1CCN(C(=O)c2cnc(-c3ccccn3)nc2O)CC1 91665609 RUWSCLQKDOGQBX-UHFFFAOYSA-N 392.463 2.692 0 50 GFAA CCNC(=O)c1ccnc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)c1 95501403 HOGVMQMUTKHTRN-IBGZPJMESA-N 390.491 2.855 0 50 GFAA O=C(Nc1ccccc1CCc1ccccn1)N[C@H]1COC[C@@H]1N1CCCC1 96141385 XYWQNNKWMBBENU-SFTDATJTSA-N 380.492 2.852 0 50 GFAA O=C(Cc1ccccc1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 91746998 POPIDSBONOEYQU-UHFFFAOYSA-N 392.503 2.655 0 50 GFAA Cc1cc(N2CCC(NCCc3ccnn3C)CC2)nc(-c2ccccc2)n1 96180365 KYGNWXKQFVQUOP-UHFFFAOYSA-N 376.508 2.987 0 50 GFAA Cc1ccccc1COC1CN(C(=O)CN2C[C@@H](c3ccccc3)CC2=O)C1 95529204 VDSPKUPBDLYGMB-FQEVSTJZSA-N 378.472 2.739 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C(=O)N1c1ccc(I)cc1 243915062 BMJVLFNSTCZFLG-CTTWBBHYSA-N 391.208 2.849 0 50 GFAA CCc1noc(C)c1CNC(=O)N[C@H]1C[C@H](C)S(=O)(=O)c2sccc21 298053303 SUOMFLBJHIAEGP-XPTSAGLGSA-N 383.495 2.713 0 50 GFAA O=C(NCc1cccnc1)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263615276 BOAITYJWOIIWBG-UHFFFAOYSA-N 387.439 2.933 0 50 GFAA COc1ccccc1Cn1ccn2nc(-c3ccc(F)cc3)c(CO)c2c1=O 263619612 ZOIDLHLIFABNDP-UHFFFAOYSA-N 379.391 2.851 0 50 GFAA COC(=O)c1cn([C@H](c2nc3ccccc3n2C)C(C)C)cc2c(=O)[nH]nc1-2 263587466 HDJPSHAAVFWUIF-KRWDZBQOSA-N 379.420 2.595 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)c2csc(-c3ncccn3)n2)CC1 952868547 BYVHCHOHKUZGAS-UHFFFAOYSA-N 380.477 2.656 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 170638300 SNQODTZDJFBIFN-QWHCGFSZSA-N 386.351 2.589 0 50 GFAA C[C@@](O)(CNC(=O)C(=O)Nc1ccc(Oc2ccncc2)cc1)c1cccs1 740522463 JZZROCFIPACSBH-HXUWFJFHSA-N 397.456 2.898 0 50 GFAA CCCC[C@@H]1CN(c2cc(C(=O)N3CCN(C)CC3)ccn2)C[C@H](C2CC2)O1 1529186575 IITGTTHUNXEBPE-WOJBJXKFSA-N 386.540 2.643 0 50 GFAA c1ccc(CC[C@]23CN(Cc4ncc[nH]4)C[C@H]2CN(C2CCOCC2)C3)cc1 1772804222 JLOOBSNRFYNVIB-NZQKXSOJSA-N 380.536 2.955 0 50 GFAA CC[C@H](C(=O)NCc1ccc(F)cc1)n1nc(C)n2c(cc3occc32)c1=O 5149796 XYLZASQNTACKRY-OAHLLOKOSA-N 382.395 2.957 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)c2[nH]nc4c2C[C@@H](C)CC4)C3)no1 19146005 CCIOALUVMFNPEX-NSHDSACASA-N 392.463 2.795 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N3Cc4cnc(C)cc4C3)CC2=O)cc1Cl 1857674496 KUAJJSPZUAEMJT-CQSZACIVSA-N 385.851 2.947 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NC2CCC2)CC[C@@H]1NS(=O)(=O)c1ccccc1 1857686093 HPWOOVWNGHADHZ-SNRMKQJTSA-N 394.537 2.598 0 50 GFAA COc1cccc2c1OCC(CN1CCO[C@@]3(CCN(c4nccs4)C3)C1)=C2 1857693431 WOBLOWLFPLOGQC-NRFANRHFSA-N 399.516 2.909 0 50 GFAA NC(=O)c1cc(N2CCN(CCOc3ccccc3)CC2)nc2ccccc12 1148209264 MFWYDHQXIZHDDI-UHFFFAOYSA-N 376.460 2.535 0 50 GFAA O[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1NCc1cccc2c1OCCCO2 1875399405 BGTIYLSFBXULHR-KBRIMQKVSA-N 377.872 2.627 0 50 GFAA C=CC(=O)NC[C@@H](NC(=O)Cc1c(C)nn(C)c1C)c1ccc2ccccc2c1 1875386832 ZWNIOSFJMJIMSS-OAQYLSRUSA-N 390.487 2.892 0 50 GFAA CCCn1c(=O)nc(O)c2c(-c3nc(C(F)(F)F)no3)cc(C3CC3)nc21 1875328370 OEBZXBWBYIFOCP-UHFFFAOYSA-N 381.314 2.853 0 50 GFAA CCn1ccc(CC(=O)N2CC3(CCOCC3)[C@H]2c2cnn(C(C)(C)C)c2)n1 888101107 CIGNPWYOQFZVFO-LJQANCHMSA-N 385.512 2.777 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CCN[C@H](c4cn[nH]c4)C3)cc2F)n1 2325803539 NBODCOHYAMIYGI-KRWDZBQOSA-N 383.431 2.530 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC2=NC[C@@H]3CC[C@H](C)CN23)cc1 2325863704 ULYWITCEURDXOG-BQFCYCMXSA-N 392.569 2.838 0 50 GFAA Cc1ccc(N(C(=O)COc2ccc(F)cc2)[C@H]2C=CS(=O)(=O)C2)cc1 1217470 VRNDGBLYKSFISI-KRWDZBQOSA-N 375.421 2.857 0 50 GFAA CCN1CCN(c2ncc3c(n2)C[C@@H](c2ccc(OC)c(OC)c2)CC3=O)CC1 2362120 LLMZGDUAKVPUOZ-MRXNPFEDSA-N 396.491 2.548 0 50 GFAA C[C@@]1(O)CCOC2(CCN(c3nc(-c4ccccc4)nc4c3CCC4)CC2)[C@H]1O 2356156115 RVDZJCVXSWACMJ-FCHUYYIVSA-N 395.503 2.504 0 50 GFAA Cc1cccc(C(C)C)c1NC(=O)C(=O)[C@@H]1C(=O)N(c2ccccc2)N=C1N 100721946 FZYNHJHLTGBGJP-INIZCTEOSA-N 378.432 2.561 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1cccc(C(F)(F)F)c1 101608028 YGMQTFAWIBFVRZ-DPDCMNJDSA-N 378.350 2.841 0 50 GFAA CCn1cc(CN2CCC3(CC2)c2ccccc2[C@@H](N2CCCC2)[C@@H]3O)cn1 20205533 YYVVDMDDKVQGSB-YADHBBJMSA-N 380.536 2.948 0 50 GFAA O=C1C[C@@H](c2cnc(NCc3ccccc3)nc2)c2c(nc3ccccn23)CN1 65507698 IWRJKJXHZOYQFB-KRWDZBQOSA-N 384.443 2.888 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccc(C)c(C)c3)CC2)cc(-n2cccn2)n1 67621495 JGHNCIDFWRCPMW-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CN1CCNC(=O)C12CCN(Cc1ccccc1OCc1ccccc1)CC2 67559645 KQAUJZDTQAQCDD-UHFFFAOYSA-N 379.504 2.662 0 50 GFAA Cc1nnc(SCC(=O)N2Cc3nc(N)nc(-c4ccccc4)c3C2)s1 67840421 MVSUSSGWEKIMSA-UHFFFAOYSA-N 384.490 2.520 0 50 GFAA O=C(O)Cc1nn(Cc2ccc(Br)cc2F)c(=O)c2ccccc12 538211 LKBFFDOJUKLQNY-UHFFFAOYSA-N 391.196 2.974 0 50 GFAA biogenic,investigational CCO[C@@H](C)c1noc(CN2CCCC[C@@H]2c2ccc(C(=O)NC)n2C)n1 328623673 CBKPTMCBBFHTDV-DZGCQCFKSA-N 375.473 2.592 0 50 GFAA CCN1CCC[C@@H](CN(C)C(=O)CC[C@H]2CC[C@H](C)O2)[C@@H]1c1cnn(C)c1 328632136 RQCIMJXSOIDBNZ-MHYXUVESSA-N 376.545 2.999 0 50 GFAA CNS(=O)(=O)c1cccc(CNC(=O)[C@@H](C)Cc2cncc3ccccc23)c1 239782453 CORWXWWFNSDERG-HNNXBMFYSA-N 397.500 2.638 0 50 GFAA Cc1ncc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c(=O)[nH]1 71439350 LLWJZCZPVJSIJC-LJQANCHMSA-N 386.471 2.590 0 50 GFAA CCc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCc3c[nH]cn3)C2)cs1 72436229 JSEPJGVJIKYIAX-KBXCAEBGSA-N 386.521 2.729 0 50 GFAA CC(C)[C@@H]1CN(c2nccc(N(C)C)n2)CCC(=O)N1Cc1ccc(F)cc1 71714607 MJLDDMAMRUSGPU-SFHVURJKSA-N 385.487 2.945 0 50 GFAA O=C(NCc1cccc(F)c1)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 72437444 YSNOXPJLNGGYKD-AWEZNQCLSA-N 382.482 2.604 0 50 GFAA O=C(c1cc(-c2ccc(Cl)cc2)[nH]n1)N1CCCO[C@H](Cn2cccn2)C1 426399383 JMWSLJUTMXJMOI-INIZCTEOSA-N 385.855 2.858 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)[C@H]2CCCN(Cc3ccco3)C2)CC1 95352502 XBGBZSHRVNQEFO-IBGZPJMESA-N 382.508 2.934 0 50 GFAA CSCC[C@@H](NC(=O)Cc1c(-c2ccc(Cl)cc2)n[nH]c1C)C(=O)O 334160299 AMRDJKIBUFTLAZ-CQSZACIVSA-N 381.885 2.904 0 50 GFAA CCN1CCCC[C@@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91694289 VSSHIAFCGUCHJE-HXUWFJFHSA-N 398.551 2.687 0 50 GFAA CCN1CC2(CCN(C(=O)c3cnn(C)c3)CC2)C[C@H](c2ccccc2)C1=O 91746573 FAVHVERYSMUFGS-LJQANCHMSA-N 380.492 2.679 0 50 GFAA Cc1ccc(-c2cc(C(=O)N[C@H]3CN(C(=O)N(C)C)C[C@@H]3C3CC3)[nH]n2)s1 95387843 JNSRNUHGJDERNN-CJNGLKHVSA-N 387.509 2.568 0 50 GFAA Cc1nc(CC(C)C)cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)C2CCC2)C3)n1 95382606 LVNCOBRGOZTJNA-QFBILLFUSA-N 384.524 2.847 0 50 GFAA Cc1nccc(N2CCN(C[C@@H](O)Cc3ccccc3C(F)(F)F)CC2)n1 183783606 MLUIZZYVFAFQNQ-INIZCTEOSA-N 380.414 2.529 0 50 GFAA C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]3CC[C@@]4(OCO[C@]45COCO5)[C@@H]3CC(=O)[C@H]12 257347631 NJDQZPLIXBEZLQ-SSJIOAAMSA-N 390.476 2.831 0 50 GFAA Cc1noc([C@H](C)NC(=O)N2CCC(C(=O)NC3CCCCCC3)CC2)n1 584886000 OJSQMRPYKBDUDW-ZDUSSCGKSA-N 377.489 2.700 0 50 GFAA Cc1nc(C)c(C(=O)NCC2CCN(C(=O)c3n[nH]c4ccccc34)CC2)s1 952964810 DOLRWTYYCMNYKL-UHFFFAOYSA-N 397.504 2.918 0 50 GFAA COc1ccc(C(=O)Nc2ccc(I)cn2)cc1OC 16527096 SPCODUWYZAJDOQ-UHFFFAOYSA-N 384.173 2.956 0 50 GFAA CCCc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2c(C)noc2C)C3)n(C)n1 1565517119 SVRHPBVBEKDBPO-AEFFLSMTSA-N 385.512 2.714 0 50 GFAA O=C1C[C@@H](c2ccccc2)N(C(=O)c2ccn(-c3ccc(F)cc3F)n2)CCN1 185191789 LQWXMBLWYMXLOR-IBGZPJMESA-N 396.397 2.854 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1 170596460 VEJUXPDCSVLEGA-STQMWFEESA-N 380.297 2.975 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2cc(F)ccc2Br)CC1 186639807 HIMLMXJAYCPIMU-UHFFFAOYSA-N 387.249 2.599 0 50 GFAA C[C@@H](O)c1ccc(CNC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 186707346 KUTYCBUVYIBGPK-WZONZLPQSA-N 397.519 2.518 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N2CCN(CCOc3ccccc3)CC2)c1C 1506416790 MCWVIVHNCHTXKS-UHFFFAOYSA-N 395.503 2.855 0 50 GFAA O=C(c1ccncc1)N1CCC(NCCc2noc(-c3ccccc3)n2)CC1 1506421425 HYCIBYGLCUBGCX-UHFFFAOYSA-N 377.448 2.569 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2cncn2Cc2ccccc2)CC[C@@H]1O 1529175000 ZTKHOTOSIQOJQF-BJKOFHAPSA-N 391.515 2.719 0 50 GFAA CN1CC[C@]2(C(=O)NCc3ccccn3)CCCN(C(=O)CC3=CCCC3)[C@H]2C1 1775978555 FBEFYLSIPKHALM-NZQKXSOJSA-N 396.535 2.511 0 50 GFAA CSc1nnc(CNS(=O)(=O)c2cccs2)n1-c1ccccc1C 11913048 FWQKFAYPSUGBHA-UHFFFAOYSA-N 380.520 2.838 0 50 GFAA CC(C)=CCC[C@H](C)CN1CCc2nnc(CCNC(=O)C3CCC3)n2CC1 14992394 FZEDGXWASLWUAP-SFHVURJKSA-N 387.572 2.978 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCC1(Cn2cccn2)CC1 1857709348 SDNGGFOFYSTYQH-INIZCTEOSA-N 394.479 2.622 0 50 GFAA COc1cccc(C)c1C(=O)N1C[C@@H]2[C@H](CNC(=O)CC3CC3)[C@H]3CC[C@]2(C1)O3 1857723673 QIKUVWPQOWLNSR-PMECCGAFSA-N 398.503 2.540 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CC[C@@H](CN)C2)[C@@H]1c1ccccc1OC 252656395 DABVYYFAZJAKIN-MDKPJZGXSA-N 387.524 2.582 0 50 GFAA Cc1nn(-c2nccs2)cc1-c1ccc(CN2C(=O)CC[C@H]2C(=O)O)cc1 901080981 WDXYHJZLFYJWGW-INIZCTEOSA-N 382.445 2.880 0 50 GFAA O=C([C@@H](Sc1ccc(F)cc1)c1ccccc1)N1CCS(=O)(=O)CCO1 1289826950 CHMRQEPVQVBQNS-KRWDZBQOSA-N 395.477 2.848 0 50 GFAA CCC(CC)(C(=O)O)C(=O)N1CCC2(CC1)C[C@H]2N(C)Cc1nccs1 952887464 PEOPMCPZXFJRES-CQSZACIVSA-N 379.526 2.847 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@]1(CN[C@H]1CCS(=O)(=O)C1)c1ccccc1 1875340049 JIKMSFJYLJWGJQ-PXNSSMCTSA-N 394.537 2.690 0 50 GFAA Cc1nc(C[C@@H]2CCNC2)sc1C(=O)N1CCCCC[C@@H]1c1ncon1 1875315304 ORHFPFMQBZYVQE-UONOGXRCSA-N 375.498 2.744 0 50 GFAA O=S(=O)(c1ccc(F)c2occc12)N1C[C@@H](Cn2cnnc2)C2(CCC2)C1 1875404416 ICRVHUNKOMSEDU-CYBMUJFWSA-N 390.440 2.654 0 50 GFAA O=S(=O)(c1ccc(F)c2cnccc12)N1CCOC[C@@H]1CC1CCOCC1 1875404278 CGSSWPBHYOEMLW-HNNXBMFYSA-N 394.468 2.580 0 50 GFAA Cc1ncccc1Cc1noc([C@H]2CC(=O)N(C3CC3)[C@@H]2c2cnn(C)c2C)n1 888101622 IZFFFFFOQBIDDS-JXFKEZNVSA-N 392.463 2.625 0 50 GFAA C[C@H](c1ccccc1)N1C[C@@H](C(=O)OCc2ncn(-c3ccccc3)n2)CC1=O 2325731310 DPYUHLOLZPWEDS-AEFFLSMTSA-N 390.443 2.920 0 50 GFAA O=C([C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)N1CCC[C@@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 2325826689 JSMMIBWSEBKMQS-ONROHVEWSA-N 380.532 2.630 0 50 GFAA Cn1cnnc1S[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1 797123 YJSLERVIOOTPTK-ZIAGYGMSSA-N 386.930 2.850 0 50 GFAA COc1ccccc1NC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 807687 DWRNMPOJOXPJAH-NSHDSACASA-N 384.461 2.625 0 50 GFAA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2OC)C1 810998 PWRVWZIZWQJOMT-SNVBAGLBSA-N 396.292 2.966 0 50 GFAA CCc1ccccc1N1C[C@@H](C(=O)N2CCN(c3ccccc3)CC2)CC1=O 7609221 OJTZJDMQERFRMD-IBGZPJMESA-N 377.488 2.951 0 50 GFAA O=C(c1cccc(F)c1)N1CC[C@H]2[C@H](CCCN2C(=O)c2n[nH]c3c2CCC3)C1 20451933 NSZRXLVIUMBJCZ-BEFAXECRSA-N 396.466 2.804 0 50 GFAA CCOc1ccc2[nH]c(=O)c(CN3CCC(O)(c4cccnc4)CC3)cc2c1 67785482 ULACMWLVMUDWEY-UHFFFAOYSA-N 379.460 2.805 0 50 GFAA CN(C)c1cccc([C@@H]2CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)c1 117821738 VQPOXIHZEZYUET-SFHVURJKSA-N 378.476 2.770 0 50 GFAA Cc1nc(C)c2c(n1)O[C@@H](CN1CCc3[nH]nc(-c4ccccc4F)c3C1)C2 67817174 BMVGYBURIZDDJQ-CQSZACIVSA-N 379.439 2.984 0 50 GFAA COc1cc2c(cc1[C@H]1CC(=O)NCc3nc4cc(C)ccn4c31)OCCO2 65395135 CNVSXEUGTGRQND-CQSZACIVSA-N 379.416 2.574 0 50 GFAA C[C@@H](NC(=O)c1cccs1)C(=O)N1CCC[C@@H]1CN1CCc2ccccc21 140395617 XLZYGPLMODREGA-NVXWUHKLSA-N 383.517 2.920 0 50 GFAA C[C@H](C(=O)N1CCCCC1)N(c1cccc(C(F)(F)F)c1)S(C)(=O)=O 65364734 JDGQQHMPAVXXSZ-GFCCVEGCSA-N 378.416 2.872 0 50 GFAA CC[C@@H]1CN(C(=O)C2(C)CCN(Cc3ccccc3)CC2)CCN1C[C@H](C)O 251673198 MGUHGJAJHICLCJ-PZJWPPBQSA-N 387.568 2.592 0 50 GFAA CCN1CCC[C@H]1CNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 230040075 VJAKJFFLNZNFKV-RDJZCZTQSA-N 397.441 2.654 0 50 GFAA Cc1cccc2c(N3CCC[C@H](c4n[nH]cc4CN4CCOCC4)C3)ncnc12 328631274 QTDDXCYLMCHEEU-KRWDZBQOSA-N 392.507 2.878 0 50 GFAA COc1cc(CNC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)cc2c1OCO2 328626605 FFWXNDVIZMSWSA-NSHDSACASA-N 383.370 2.991 0 50 GFAA COc1nc2c(cc1CNC(=O)CCc1cccnc1)C(=O)N(C1CCCC1)C2 71388836 HYVQYPJOFKFWHW-UHFFFAOYSA-N 394.475 2.633 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCCNc2ccccc2)C1 72152191 NDXQYMCLNUCVLB-UHFFFAOYSA-N 388.475 2.967 0 50 GFAA Cc1noc([C@@H]2COCCN2C(=O)Cc2csc(-c3cccc(F)c3)n2)n1 155368727 VWZNHXHCSQOEHO-HNNXBMFYSA-N 388.424 2.783 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)cc(OC)c1 36385603 GFROITFONXIPGT-OAQYLSRUSA-N 384.520 2.815 0 50 GFAA C[C@H](O)c1ncc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)s1 367369808 IAMJPGTYGZQTLI-HNNXBMFYSA-N 381.505 2.976 0 50 GFAA Cc1cc([C@@H](C)NC(=O)N2CCC(N3CCCS3(=O)=O)CC2)c(C)s1 334028164 IZHHWYHLPSEDCT-CYBMUJFWSA-N 385.555 2.635 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(N2CCNC2=O)ccc1Cl 262424821 QXLMQWGUWWIXKB-XZJROXQQSA-N 391.855 2.728 0 50 GFAA COCCn1nc(C)c(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c1C 176563214 HYZJHIYWSCOGGX-SFHVURJKSA-N 384.480 2.637 0 50 GFAA Cc1ccc([C@](C)(O)CNC(=O)C2CCN(c3nc4ccccc4o3)CC2)o1 176749607 UGYGHIPNICBXFJ-OAQYLSRUSA-N 383.448 2.970 0 50 GFAA CN1CCN(S(=O)(=O)N2CCCC(c3ccccc3)(c3ccccc3)C2)CC1 92046748 LSGMTRJWUWDLPF-UHFFFAOYSA-N 399.560 2.561 0 50 GFAA COc1ccc2c(c1)OC[C@]1(C(=O)O)CN(CCC(F)(F)C(F)F)C[C@H]21 95366735 DEFGJISLFPGCGS-MLGOLLRUSA-N 377.334 2.848 0 50 GFAA O=C1CC2(CCN(C(=O)c3cnn4ccccc34)CC2)CN1Cc1ccccc1 95505053 LTFTUSOQMIQGGX-UHFFFAOYSA-N 388.471 2.989 0 50 GFAA O=C(Cc1ccc(O)cc1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95361649 FSMSWXOBOFKQBA-MDNUFGMLSA-N 378.472 2.729 0 50 GFAA CCOC(=O)N1CCC(N2C[C@@H](N(C)C)[C@H](c3ccc(OC)cc3)C2)CC1 95526202 QQVAPGXLQFGWTC-VQTJNVASSA-N 375.513 2.646 0 50 GFAA O=C(c1cc(Cn2cccn2)on1)N1CCC[C@@H]1c1cccc2c1OCCO2 292163186 FSJJPPZOBWVQEH-QGZVFWFLSA-N 380.404 2.668 0 50 GFAA COC(=O)c1ccc(OC)c(NC(=O)NC[C@@H](c2ccc(C)o2)N(C)C)c1 96132597 KFPKMFOLXGMHAZ-HNNXBMFYSA-N 375.425 2.808 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC(c2nccn2Cc2cccnc2)CC1 95528953 GGOOUSZWDULNNS-UHFFFAOYSA-N 376.464 2.558 0 50 GFAA COc1cccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)c1C 91644469 ZEZPPGSCVYYCCK-FUHWJXTLSA-N 379.460 2.775 0 50 GFAA CC(C)c1noc([C@H]2CCCN(C(=O)Nc3ccc4c(c3)OCC(=O)N4)C2)n1 96149737 SYCMATLFQNPVGU-LBPRGKRZSA-N 385.424 2.935 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Nc1cc(Cl)ccc1Cl 239248021 XWOIEBCMEHRJBZ-GQYKBVJTSA-N 391.254 2.985 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 95505984 YONQZWGSKMZMKZ-IOMROCGXSA-N 391.450 2.799 0 50 GFAA CCc1nnc(CN(CC)C(=O)Nc2ccc(CC(=O)N3CCCC3)cc2)o1 96150166 DQJHZCSLCJEAKL-UHFFFAOYSA-N 385.468 2.851 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)CN(C)CCOC)CC2)C1 96166262 QIPFDWVGBQXHJO-NRFANRHFSA-N 387.568 2.683 0 50 GFAA O=C1N[C@H](CC(=O)N2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 97179442 PLHWTZZBHSVMHJ-VHTFYLNKSA-N 375.472 2.719 0 50 GFAA N[C@@H](Cc1ccccc1)C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2 95509292 WVXAOTKVFVTNQD-NRFANRHFSA-N 391.515 2.598 0 50 GFAA Cc1ccc(-c2nc(C[C@@H]3CCS(=O)(=O)C3)n(-c3cccc(F)c3)n2)o1 96136771 PNACMCOHBKUDSR-ZDUSSCGKSA-N 375.425 2.952 0 50 GFAA C[C@@H]1Oc2ccccc2N(CCC(=O)N(C)Cc2ccc(C(=O)O)cc2)C1=O 298425305 LWLJHEJLETVKLI-AWEZNQCLSA-N 382.416 2.547 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(C(=O)O)[C@H]3CC[C@@]21C 254381487 RIUISGYIXPQHGQ-WLLUSHMASA-N 392.492 2.669 0 50 GFAA Cc1cc(C)nc(-c2ccc(C(=O)N3CCC(NS(C)(=O)=O)CC3)cc2)c1 534661228 HZKKKAWQEYTRSO-UHFFFAOYSA-N 387.505 2.519 0 50 GFAA Cc1cc2cc(NC(=O)C3CCN([C@@H]4CCS(=O)(=O)C4)CC3)ccc2o1 827758418 ZXPKPBWAZDFGAJ-QGZVFWFLSA-N 376.478 2.579 0 50 GFAA O=C(NCc1ccc2c(c1)CCCO2)N1CCCN(C(=O)c2ccco2)CC1 584892827 JBIRZNUMAPMKBM-UHFFFAOYSA-N 383.448 2.662 0 50 GFAA CCn1c(C)ccc(C(=O)Nc2cc(NC(=O)COC)ccc2Cl)c1=O 952980840 SQRKLLZZJDOPOX-UHFFFAOYSA-N 377.828 2.667 0 50 GFAA O=C(CN1Cc2ccccc2C1)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 952860696 RYJIAKSCCYLQMP-UHFFFAOYSA-N 377.448 2.823 0 50 GFAA O=C(c1ccco1)N1CCC[C@@H](NS(=O)(=O)Cc2cccc(Cl)c2)C1 885939132 SZLQWRUIGBFYGJ-OAHLLOKOSA-N 382.869 2.657 0 50 GFAA NC(=O)Nc1ccc(-c2noc([C@H]3CCCN(C(=O)N4CCCC4)C3)n2)cc1 273667314 GAZPBTMDZGRHTL-AWEZNQCLSA-N 384.440 2.622 0 50 GFAA O=C(Cn1c(=O)cnc2ccccc21)N1CCO[C@@H](c2cccc(Cl)c2)C1 186209930 WEMROIALLNBAKX-GOSISDBHSA-N 383.835 2.650 0 50 GFAA CC(C)c1ccc(/C=C/C(=O)N[C@@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 170591863 RKKOTKLEDHZQIX-QEMYPZFLSA-N 377.506 2.676 0 50 GFAA CN(C(=O)CN1CCc2ccccc2C1=O)C1CCN(Cc2ccccc2)CC1 279112359 UYGVQRPCYXIJPG-UHFFFAOYSA-N 391.515 2.808 0 50 GFAA Nc1cc(CN2CCN(Cc3nc(-c4ccc(Cl)cc4)no3)CC2)ccn1 191396794 BMVKFMRYWJPYBT-UHFFFAOYSA-N 384.871 2.685 0 50 GFAA CCCNc1ncc(CN2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)cn1 1615734720 FTOBCCCNNGQLOY-RXVVDRJESA-N 377.492 2.882 0 50 GFAA Cc1ncsc1CN1CCC(=O)N(Cc2noc(-c3ccccc3)n2)CC1 1506424981 AHYFXVAERNAVHD-UHFFFAOYSA-N 383.477 2.736 0 50 GFAA CC[C@@]12C[C@H]1CN(C(=O)C1CCN(C(=O)c3cc(OC)cc(OC)c3)CC1)C2 1772819088 PNZAZYCMVKTKPZ-JTSKRJEESA-N 386.492 2.815 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C3CCC(C)CC3)CC2)cc1 5042952 RAGOPRDTJUVMRQ-UHFFFAOYSA-N 379.526 2.530 0 50 GFAA COc1cc(CN2CCSCC2)ccc1OC[C@@H](O)CN1CCCCCC1 11840259 VXAATRFYUQQHJD-IBGZPJMESA-N 394.581 2.860 0 50 GFAA COc1ccccc1CCNS(=O)(=O)c1ccc(N2CCCCC2=O)cc1 12002252 QTHXYKOSTLRRAW-UHFFFAOYSA-N 388.489 2.733 0 50 GFAA CC(=O)[C@H]1CCCN(C(=O)c2cn(Cc3cccc(C(F)(F)F)c3)nn2)C1 12205193 KVIPIBMITNYPQJ-AWEZNQCLSA-N 380.370 2.786 0 50 GFAA O=C(NCCCOc1cccnc1)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1 12448872 SVDAYAHOUMTGFR-QGZVFWFLSA-N 385.439 2.545 0 50 GFAA Cc1ccc(C)c(N([C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)c1 13679249 AAOIXASKWOEWCH-AWEZNQCLSA-N 390.461 2.825 0 50 GFAA O[C@H](COc1ccccc1CNCc1ccc(F)cc1)CN1CCSCC1 14964634 XUDHROAHIBHLNI-FQEVSTJZSA-N 390.524 2.904 0 50 GFAA Cc1ccnc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)c1 16649968 OWKPYLSAYWNJKS-UHFFFAOYSA-N 377.441 2.956 0 50 GFAA CCS(=O)(=O)N1C[C@@H](C(=O)N2CCCc3ccccc32)Oc2ccccc21 16651807 GGTYHBNESJUDIB-IBGZPJMESA-N 386.473 2.583 0 50 GFAA C[C@H]1CN2C[C@H](NC(=O)c3ccccc3OC(F)(F)C(F)F)C[C@H]2CO1 1857717478 VBVUUORJMGJTII-TUAOUCFPSA-N 376.350 2.515 0 50 GFAA CCn1cnnc1CN(C)Cc1ccc(-c2nc(CC(C)C)cc(=O)[nH]2)cc1 104740371 HLFFFTNTBNTCCR-UHFFFAOYSA-N 380.496 2.879 0 50 GFAA Cc1ccc(OCc2nc(CC(=O)N[C@H](CO)c3ccccn3)cs2)cc1 908485939 NFLDBMNDQNUXJT-GOSISDBHSA-N 383.473 2.818 0 50 GFAA Oc1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cn1 952895914 XVNQIEUQQVEHQF-MRXNPFEDSA-N 377.326 2.943 0 50 GFAA O=C([C@H]1CC[C@@](O)(c2ccccc2)C1)N1CCN(c2cc(C3CC3)[nH]n2)CC1 1875271632 KZWIZOLCKRSNMR-JTSKRJEESA-N 380.492 2.624 0 50 GFAA COC(=O)c1cc(O)cc(C(=O)N(C)Cc2cc(Br)cn2C)c1 1875265039 HWGHOAZDHVKYGU-UHFFFAOYSA-N 381.226 2.552 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCN(c2c(C)cccc2Cl)CC1)C1CCCC1 1875259497 JWTRAFJTAWRLEB-SFHVURJKSA-N 377.916 2.992 0 50 GFAA O=C(N[C@@H]1C[C@H]1[C@@H]1CCCNC1)c1nccnc1-c1nc2ccccc2s1 1875293025 ZXSDOVPCDPPVFT-VNHYZAJKSA-N 379.489 2.871 0 50 GFAA Cn1c(-c2cc(-c3ccc4c(c3)OCCO4)on2)nnc1N1CC[C@@](C)(F)C1 1875280609 ABIQQTKNRMYMAX-LJQANCHMSA-N 385.399 2.847 0 50 GFAA COc1ccc(CN2CCC[C@H]([C@H](C)NC(=O)Cn3cc(Cl)cn3)C2)cc1 1875307063 JLGYNAQJNZLHNM-RDJZCZTQSA-N 390.915 2.962 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 328593347 XBRMXZBXHYPKKQ-PMPSAXMXSA-N 382.501 2.966 0 50 GFAA COc1ccc(-n2nnnc2SCC(=O)Nc2ccc(F)c(F)c2)cc1 680550 MUYOREWCKKWGOM-UHFFFAOYSA-N 377.376 2.680 0 50 GFAA Cc1nc(-c2ccccc2)c(NC(=O)[C@H]2CC(=O)N(Cc3cccnc3)C2)n1C 2100483456 VVHYANSBNCZZFB-SFHVURJKSA-N 389.459 2.778 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)N3CCc4ccccc4CC3)CC2=O)s1 2100543698 XIKGUWVQKMHUKN-MRXNPFEDSA-N 384.505 2.642 0 50 GFAA CCOC(=O)c1ccccc1N1C(=O)C[C@H](Sc2ccccc2C(=O)O)C1=O 19863010 XBIPEYVODPDJRT-INIZCTEOSA-N 399.424 2.986 0 50 GFAA COc1cc(/C=C/C(=O)N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)ccc1OC(C)C 2325785594 FQWOPJBMCDECEB-YJVIXKLDSA-N 399.491 2.648 0 50 GFAA O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1)NC[C@H]1CCCO1 802397 IQJRCDNFDJZQPC-MRXNPFEDSA-N 395.484 2.773 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccccc1C(=O)NCc1cccnc1 854575 XNIYSHQJTDBDFK-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA Cc1ncccc1Oc1ncnc(N(C)[C@H]2C[C@H]3CC(=O)N(C)C[C@H]3C2)c1C 2356158562 PBSFOVZYMAKORN-BBWFWOEESA-N 381.480 2.974 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(OC(C)=O)cc2)cc1 2827497 RRINGDXSDZFKJV-UHFFFAOYSA-N 390.461 2.943 0 50 GFAA CN1CCN(NC(=O)c2cc(-c3cccnc3)nc3ccc(Cl)cc23)CC1 2867607 LEBSEIOROVZISS-UHFFFAOYSA-N 381.867 2.842 0 50 GFAA COC(=O)c1cnn(-c2ccc(C(=O)Nc3cccc(C(C)=O)c3)cc2)c1N 8607015 QWCDTDFUHNASGV-UHFFFAOYSA-N 378.388 2.696 0 50 GFAA CCC(C)(C)NC(=O)[C@@H](C)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 109797257 MTCZKZSSASVZSD-QGZVFWFLSA-N 381.524 2.959 0 50 GFAA O=C(CN1CCCCCC1)N1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 55060646 WEGJEFVOMZCWRZ-JOCHJYFZSA-N 384.568 2.676 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)N1CCc2nc[nH]c2[C@@H]1c1cccnc1 55226149 ZBIIXAXEGIGHAL-KRWDZBQOSA-N 395.488 2.549 0 50 GFAA Cn1c(=O)n(CCc2ccccc2)c(=O)c2c1nc1oc(-c3ccccc3)cn12 9789639 WJKZIPMKPZLBHG-UHFFFAOYSA-N 386.411 2.851 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN3CCC(C)(C)CC3)C2=O)c1 67642448 QRNQUGCTFRXXHQ-OAQYLSRUSA-N 378.488 2.810 0 50 GFAA Cc1nn(C)cc1CN(C)C[C@@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67872809 IKPPFPGELDFUCT-QHCPKHFHSA-N 398.551 2.837 0 50 GFAA C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1)C2=O 229717783 XENLBVNYQMIUMU-ZFRZLUBXSA-N 389.418 2.724 0 50 GFAA C[C@H](OC(=O)CCNC(=O)Nc1ccccc1)C(=O)N1[C@H](C)CCC[C@H]1C 252444502 ODOHMMNLBCUYKJ-OAGGEKHMSA-N 375.469 2.919 0 50 GFAA Cc1ccc(-n2cccn2)cc1NC(=O)NCCc1nnc2n1CCCCC2 252487248 HTNYDJZUQRIUPG-UHFFFAOYSA-N 379.468 2.863 0 50 GFAA Cc1c(CC(=O)N[C@H](C(N)=O)C(C)C)c2c(n1CC(C)C)CC(C)(C)CC2=O 39461505 HPPDBOBGVXYLSA-FQEVSTJZSA-N 389.540 2.776 0 50 GFAA O=C1NC[C@]2(CCCN(Cc3c(-c4ccccc4)nc4ncccn34)CC2)O1 72149723 QUVWNLIKLHCYDN-OAQYLSRUSA-N 377.448 2.861 0 50 GFAA Cc1cc2n(n1)[C@@H](C(F)(F)F)CCN2C(=O)c1ncn(-c2ccccc2)n1 485475931 GKRGVTKPAGQOJG-CYBMUJFWSA-N 376.342 2.926 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N(C)[C@H]2CCN(c3ccccc3F)C2=O)c1 127190622 BLTCHMNABJWJHR-IBGZPJMESA-N 397.450 2.843 0 50 GFAA CC(C)Oc1cccc([C@H](O)CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)c1 172083925 WBGKYIJJBXDWMQ-LEWJYISDSA-N 396.487 2.928 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)NCCc2c[nH]c3ccccc23)CC1 426395158 JGTHWIAVWNSLAM-UHFFFAOYSA-N 377.492 2.941 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)OCc1ccccc1Cl 239432999 XBUIVWSKYHUACM-PAUSBUDFSA-N 385.847 2.826 0 50 GFAA O=C1[C@H]2CC[C@H](CN(CCOc3ccc(F)cc3)C2)N1Cc1cscn1 95523128 RAVZUTFOTKFJHO-WMLDXEAASA-N 375.469 2.784 0 50 GFAA CC(C)=CCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2 95366274 HQDMRJODUIDCNZ-ZWKOTPCHSA-N 384.476 2.764 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CC[C@H](n2cc(Cl)cn2)C1 291049773 VKLPJGOUPDHRPF-LSDHHAIUSA-N 376.844 2.598 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)c2cnc(C)nc2)CC1 95501682 CSYDZUUDTDIFDM-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA O=C1CCCCN1Cc1nc(-c2ccncc2)nn1-c1ccc2c(c1)OCO2 95508651 COJVYJXXWKCHDP-UHFFFAOYSA-N 377.404 2.571 0 50 GFAA CCc1c(NC(=O)N2CCN(c3cccnn3)CC2)cnn1-c1cccc(C)c1 242339214 ZGAOEZIMCAFDRU-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA O=C(CCc1nc(-c2cccs2)no1)N[C@@H]1CCN(Cc2ccccc2)C1=O 299370111 DQHXIEIMPXECOZ-OAHLLOKOSA-N 396.472 2.648 0 50 GFAA O=C(c1cccc(-c2cccc(-c3ccno3)c2)c1)N1CCN(CCO)CC1 534589129 PDUMKQIYFZODJH-UHFFFAOYSA-N 377.444 2.759 0 50 GFAA Cc1ccc(CN2CCN(Cc3cnn(-c4ccc(F)cc4)c3)C[C@H]2CCO)o1 36385750 YRKXFTRGRQQKEJ-OAQYLSRUSA-N 398.482 2.982 0 50 GFAA O=C(CCc1nc(-c2ccccc2F)no1)NCc1nc(-c2ccccn2)no1 828032047 LFDFEXUSVJLHOB-UHFFFAOYSA-N 394.366 2.570 0 50 GFAA Cc1sc2nc(CCNC(=O)c3ccccc3-n3cncn3)nc(O)c2c1C 670460721 MHPLHBHMFZZGCZ-UHFFFAOYSA-N 394.460 2.567 0 50 GFAA O=C(O)c1cc2cc(Br)cnc2n1S(=O)(=O)c1ccccc1 66054290 PJYCZUYUVLBGRU-UHFFFAOYSA-N 381.207 2.734 0 50 GFAA in-vitro CN(C)[C@H](C(=O)N1CCC(c2nnc3ccccn23)CC1)c1ccc(F)cc1 952984405 UVVCLDRMNMTWRN-IBGZPJMESA-N 381.455 2.877 0 50 GFAA COCCn1cncc1CN1CCC[C@H](CNC(=O)c2cc3ccccc3[nH]2)C1 952868867 BHWDHYZCLZJQNY-QGZVFWFLSA-N 395.507 2.653 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 269027540 KXUPFQWKUYQDET-HXUWFJFHSA-N 387.457 2.597 0 50 GFAA COc1cc(CCC(=O)N2CC[C@@H](C(=O)O)C2)ccc1OCC(F)(F)F 269201708 RKSGBEIZSBFFDE-GFCCVEGCSA-N 375.343 2.502 0 50 GFAA C[C@H]1CN(CC(C)(C)O)CCN1C(=O)NCc1ccccc1N1CCCCC1 186602641 JMFZUPZFHJZHGB-SFHVURJKSA-N 388.556 2.664 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)[C@H](C)NC(=O)CC(C)(C)C)CC2)oc1C 189443948 FSHGLRSOSZAIKP-HNNXBMFYSA-N 392.544 2.561 0 50 GFAA O=c1/c(=C/c2cccnc2)sc2nc(-c3ccc(Br)cc3)nn12 1135714 CEPOPXCADDSITC-JYRVWZFOSA-N 385.246 2.523 0 50 GFAA CN1CC[C@]2(C(=O)NC3(C)CCC3)CCCN(C(=O)c3ccsc3)[C@H]2C1 1775983457 YBKRUAXKTWHBRM-OXJNMPFZSA-N 375.538 2.733 0 50 GFAA O=C(Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1C(=O)Nc2ccccc2[S@]1=O 5739305 PTUIGLJFYKYTGB-PWECECGKSA-N 397.239 2.630 0 50 GFAA Cc1cc(NC(=O)CCS(=O)(=O)c2ccccc2)ccc1N1CCCC1=O 11742428 HJWKFJICOOUQRB-UHFFFAOYSA-N 386.473 2.924 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@@H](C(=O)N3CCc4ccccc4C3)C2)CC1 11933857 AFEIQTWCTYKYAN-OAQYLSRUSA-N 395.547 2.684 0 50 GFAA COc1ccccc1C(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)noc2C)C1 12005314 KIWFPMPFZBQAGS-AWEZNQCLSA-N 378.450 2.584 0 50 GFAA O=C(CCC1CCN(C(=O)c2csnn2)CC1)N1CCc2ccccc2C1 12020329 XMWQTULOECEKTL-UHFFFAOYSA-N 384.505 2.755 0 50 GFAA Cc1ccn(CCC(=O)NC[C@H]2Cc3cc(F)cc(-c4cccnc4)c3O2)n1 12079596 WKKDENFYADUCDQ-GOSISDBHSA-N 380.423 2.903 0 50 GFAA CCN(c1ccc(C(=O)Nc2ccc(NC(C)=O)cc2)cc1)S(C)(=O)=O 13676717 WYRUFAOCNJJHAY-UHFFFAOYSA-N 375.450 2.683 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(SC)cc3)CC2)cc1 19789536 SSDWMAVNSLACMI-UHFFFAOYSA-N 392.546 2.924 0 50 GFAA COc1ccc(/C=C/C(=O)NCCNC(=O)/C=C/c2ccc(OC)cc2)cc1 2821362 HYHPRHFDLOFIOR-FNCQTZNRSA-N 380.444 2.663 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cn3ccsc3n2)N1Cc1ccccc1F 1857686717 DGIODFNLLXOIFH-HOTGVXAUSA-N 384.436 2.551 0 50 GFAA Cc1cc(CC(=O)N2CCC3(CCc4c(O)nc(C(C)(C)C)nc43)CC2)on1 1857737399 KRVAJITWXSNNKK-UHFFFAOYSA-N 384.480 2.825 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)cc1 408513209 RYRDFQSNXJQOJO-SFHVURJKSA-N 387.457 2.522 0 50 GFAA C[C@@H](CCc1ccccc1)CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1 242389619 ZYVGZRSBFPSYKF-KRWDZBQOSA-N 389.517 2.728 0 50 GFAA CC(C)[C@@H](CNC(=O)Nc1nnc(-c2ccsc2)s1)N1CCN(C)CC1 131520815 OXOKVXSKIYPZGJ-CQSZACIVSA-N 394.570 2.660 0 50 GFAA Cc1sc2ccc(Cl)cc2c1S(=O)(=O)N1CCCN(CCO)CC1 158726826 MQFNIKYTFLMZJL-UHFFFAOYSA-N 388.942 2.552 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CC[C@@H](C(=O)O)[C@@H](C)C2)cc1 952884226 LMBMSIGWQUCLTL-WMLDXEAASA-N 375.469 2.672 0 50 GFAA CS(=O)(=O)[C@@H]1CCCCCN(C(=O)c2cc(Cl)nc(N3CCCC3)c2)C1 1875298381 YXHKNQBLSOSHBO-OAHLLOKOSA-N 399.944 2.765 0 50 GFAA COc1cccc(NC(=O)c2cn3c4c(c(F)c(F)cc4c2=O)OC[C@@H]3C)n1 1875327071 XYPRPVAVLFGIED-VIFPVBQESA-N 387.342 2.889 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)CCCn1cnc2ccccc21 1875401673 OMDXTOYTQJGULN-BEFAXECRSA-N 394.479 2.650 0 50 GFAA Cc1cc(=NC(O)=C2C=C(c3ccccc3)N=N2)n([C@H]2CCS(=O)(=O)C2)[nH]1 2083582268 VGEYAFDIBLNVPJ-AWEZNQCLSA-N 385.449 2.619 0 50 GFAA CCOC(=O)c1ccc(NC(=S)N2CCC[C@H]2C(=O)N2CCCC2)cc1 1069233 NQVRQVWAWQKZNA-INIZCTEOSA-N 375.494 2.647 0 50 GFAA Cc1cc(S(N)(=O)=O)sc1C(=O)Nc1ccc2c(c1)[C@H](O)CC2(C)C 2325745253 MHHPJRUKDYPUMY-CYBMUJFWSA-N 380.491 2.671 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c1C(=O)N1CCN(C)[C@@H](Cc2ccccc2)C1 2325773529 QRBOWTIXQPLZEZ-IBGZPJMESA-N 375.476 2.779 0 50 GFAA Cn1nnc2c1CC[C@@H](NCc1cc3c(Br)cc(F)cc3[nH]1)C2 922223950 DQGSFQWNRVKMIM-SNVBAGLBSA-N 378.249 2.845 0 50 GFAA Cc1nn(C)cc1C1=NO[C@@H](C(=O)N[C@H](C)c2ccc(Br)cc2)C1 929351684 QXSOXHYNELCKJE-QLJPJBMISA-N 391.269 2.861 0 50 GFAA Cc1ncccc1C(=O)N[C@H]1CC2(CN(C(=O)C(C)(C)C(C)C)C2)n2ccnc21 2332237970 SIEOHJLYEGTFAY-KRWDZBQOSA-N 395.507 2.681 0 50 GFAA CC(=O)N[C@H](NC(=S)Nc1ccc(C(=O)O)cc1)C(Cl)(Cl)Cl 939610 VZCJBBLUDCCECI-SNVBAGLBSA-N 384.672 2.504 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C4CCN(CCc5ccccc5)CC4)C[C@@H]13)O2 2356151698 UQYGUNSCRMJQSI-SBFWRKJZSA-N 383.580 2.735 0 50 GFAA FC(F)(F)c1nc(N2CCc3nc(C4CC4)nn3CC2)nc2c1CCCC2 2356169305 YSRWTSLDVBYVSO-UHFFFAOYSA-N 378.402 2.906 0 50 GFAA O=C(/C=C/c1cccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1)NCc1ccco1 100938939 BYZGCFBUMIPGGX-VHIOUPEESA-N 388.423 2.921 0 50 GFAA CCc1cc2c(CN[C@H](C)c3nnnn3-c3ccccc3)cc(=O)oc2cc1O 115603906 GRERPZCYOHASKM-CYBMUJFWSA-N 391.431 2.888 0 50 GFAA CCNc1cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)nc(C)n1 67612156 JOGLOBLCRDVQLM-UHFFFAOYSA-N 377.851 2.972 0 50 GFAA O=C(Nc1ccccc1)c1cc2n(n1)CCN(C(=O)CCc1cccnc1)C2 65493832 OGFBISPEXVJGAY-UHFFFAOYSA-N 375.432 2.505 0 50 GFAA O=C(O)c1ccccc1CN1CCC(c2n[nH]c(=O)n2Cc2ccccc2)CC1 67955756 DKVCXYQYXSDGFV-UHFFFAOYSA-N 392.459 2.698 0 50 GFAA COc1cccc(C[C@]2(CO)CCCN(c3ccc(-c4nccn4C)nn3)C2)c1 67834320 VVIGCLVXWGXQED-JOCHJYFZSA-N 393.491 2.707 0 50 GFAA CN1CCC(N(C)C(=O)c2coc(COc3cccc4cnccc34)n2)CC1 67754663 OOZLMRNBPYMCLW-UHFFFAOYSA-N 380.448 2.968 0 50 GFAA O=S(=O)(N[C@H]1CCN(c2ncccc2Cl)C1)c1cnc2ccccc2c1 252483236 DXWGKFPYNVKSEQ-AWEZNQCLSA-N 388.880 2.840 0 50 GFAA CCn1ncc(CNC(=O)[C@@]2(C)CC2(Br)Br)c1C 2091253 JEHAFAMBLFGMDN-LLVKDONJSA-N 379.096 2.724 0 50 GFAA CN(C[C@H]1CCc2nccn2C1)S(=O)(=O)c1ccccc1OC(F)(F)F 328629882 PGQDAVWPMWYKSD-GFCCVEGCSA-N 389.399 2.665 0 50 GFAA C[C@H](Cn1ncc2ccccc2c1=O)NS(=O)(=O)c1ccc2c(c1)CCCC2 120926562 ISIPLQOKNLRBKV-OAHLLOKOSA-N 397.500 2.642 0 50 GFAA CC[C@H](NC(=O)COCc1nc2cc(F)ccc2[nH]1)c1cn2cccnc2n1 219353820 VUFFLSJNQYUWTA-ZDUSSCGKSA-N 382.399 2.529 0 50 GFAA CCn1c([C@H]2OCC[C@H]2c2ccccc2)nn(Cc2nnc(C)n2C2CC2)c1=O 328632994 LRVQJGPVWKDZNT-HKUYNNGSSA-N 394.479 2.593 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@H](Nc3ccc(OC)cc3)C2)c(=O)n1C 72144437 COBMDDQISYXCAS-KRWDZBQOSA-N 383.492 2.981 0 50 GFAA CC(C)(C)c1ccc(C(=O)[C@H]2CCCN(C(=O)CCCn3cnnn3)C2)cc1 72169707 PCXZEMPOOPKCGF-KRWDZBQOSA-N 383.496 2.872 0 50 GFAA Cc1ccccc1NC(=O)N1CCO[C@H](C(=O)N2CCc3ccccc3C2)C1 72407050 OKXXMCVWSAROBY-FQEVSTJZSA-N 379.460 2.813 0 50 GFAA O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cn(Cc2cccc(F)c2)nn1 130181318 YBEQHRCNVPCXPE-HXUWFJFHSA-N 393.466 2.860 0 50 GFAA Cc1ccc(C2=NN(C(=O)CN3CCCC[C@H]3C(N)=O)[C@H](c3ccco3)C2)cc1 242302183 YQECAZIRRDZSKJ-OALUTQOASA-N 394.475 2.606 0 50 GFAA Cc1ccc(C[C@@H](CO)NC(=O)c2cnn(C)c2Cc2ccccc2)cc1C 457311401 ZBKIEGNOVFNNFH-FQEVSTJZSA-N 377.488 2.961 0 50 GFAA CC(=O)N1CCC(CNC(=O)N(C)Cc2cc(-c3cccs3)n[nH]2)CC1 426407546 MPNSNYYLJRGJLT-UHFFFAOYSA-N 375.498 2.538 0 50 GFAA CC(C)Cc1nnc(NC(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)s1 44903746 KOWAEIMIPSCRJC-UHFFFAOYSA-N 387.440 2.738 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@@H](C(=O)N4CCOCC4)C3)CC2)s1 82120212 BPLZQLQZRKWEGL-GOSISDBHSA-N 391.581 2.592 0 50 GFAA CCOc1ccccc1CCNC(=O)N1CCC[C@@H](C(=O)c2nccn2C)C1 426661382 UHODRJLZTIQMLT-QGZVFWFLSA-N 384.480 2.666 0 50 GFAA O=C(CCn1c(CO)nc2ccccc21)NC[C@@H]1CCOc2ccccc2C1 97766569 LABDZNAPOUXHJS-MRXNPFEDSA-N 379.460 2.676 0 50 GFAA CCc1n[nH]c2c1CN(C(=O)Nc1ccc(CCC(=O)NC3CC3)cc1)CC2 96163238 XHDILICBPBOXQS-UHFFFAOYSA-N 381.480 2.774 0 50 GFAA OCC1CCN(C[C@@H]2CN(Cc3cccc(-c4ccco4)c3)C[C@@H]2CO)CC1 91656038 LXGUOVWMOFXYKI-FGZHOGPDSA-N 384.520 2.691 0 50 GFAA O=C(Nc1ccc(-c2cscn2)cc1)[C@H]1CCCN(CCn2cnnc2)C1 95498511 RXXVEHVSDIVVII-INIZCTEOSA-N 382.493 2.752 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(NCc3cnn(CC)c3)nc2)CCN1C(C)C 91477008 NUNIBDRLQNTCDF-IBGZPJMESA-N 384.528 2.855 0 50 GFAA CC(C)OCCCN1C(=O)c2ccccc2[C@@H]1NCC(=O)NCc1ccccc1 334163587 YAAQGVCZXYTJDQ-JOCHJYFZSA-N 395.503 2.862 0 50 GFAA Cc1nc(CN2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)sc1C 96164349 UNLWQOXQZMEBSY-UHFFFAOYSA-N 385.541 2.821 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1 253413092 SZXNKSQSULNMRW-FDFHNCONSA-N 397.563 2.801 0 50 GFAA biogenic C[S@](=O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 79670160 CEHRSUBRZOGRSW-DNOBIOAJSA-N 387.457 2.747 0 50 GFAA biogenic Cn1cccc1-c1nnc2ccc(C(=O)NCc3cc(-c4ccccn4)no3)cn12 1940197956 DNYWMYUUERYKNA-UHFFFAOYSA-N 399.414 2.715 0 50 GFAA O=C(NCCCc1nnc2ccccn12)Nc1cccc(N2CCCC2=O)c1 299790065 KPLUMNGCZGLUEK-UHFFFAOYSA-N 378.436 2.610 0 50 GFAA O=C(c1nnc(O)c2ccccc12)N1CCN([C@H]2CCc3ccccc3C2)CC1 828210170 VWRWITSACQCTOI-SFHVURJKSA-N 388.471 2.651 0 50 GFAA O=C(c1nnc(O)c2ccccc12)N1CCN(C2C3CC4CC(C3)CC2C4)CC1 828210101 PRHLYXGQYUAEJL-UHFFFAOYSA-N 392.503 2.918 0 50 GFAA O=C(N[C@H](Cn1cccn1)c1ccccc1)C1CCN(C2CCOCC2)CC1 670460785 DLXGNEAAQXMJIQ-OAQYLSRUSA-N 382.508 2.632 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2cn(CC(F)(F)F)nc2C)C1 268622270 BSQLSBSWQLHGMN-ZDUSSCGKSA-N 382.386 2.771 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCC1CC1)c1cc(-n2cccn2)ccc1Cl 1565505701 FPOKFAHZPVHDCY-ROUUACIJSA-N 375.856 2.840 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OC(C)C)c(Cl)c3)C(=O)[C@H]2C1 277948509 CJEMQBWHXRPTRT-BXUZGUMPSA-N 380.828 2.847 0 50 GFAA Cc1ncccc1C(=O)NCCc1csc(NC(=O)c2cccnc2C)n1 170615889 ANVZLWWNZWBWAJ-UHFFFAOYSA-N 381.461 2.775 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)Cc3ccc(F)c(Cl)c3)CCO2)cn1 189226886 GFFZDAXKPBUROY-MRXNPFEDSA-N 387.864 2.599 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)n1 1616073189 MICVGZLDMDBPNZ-RXVVDRJESA-N 378.476 2.500 0 50 GFAA O=C(c1cnccn1)N1CCC(N2CCC3(CC2)OCCc2sccc23)CC1 1704302882 DXUHGZSGHPOSMQ-UHFFFAOYSA-N 398.532 2.707 0 50 GFAA O[C@@H]1CN(c2cc(C(F)(F)F)nc(N3CCCC3)n2)C[C@H]1Cc1ccccn1 1704300095 YHXGXZUYQSAAOU-UKRRQHHQSA-N 393.413 2.530 0 50 GFAA CCCc1nc(N2CCCN(C(=O)c3ccccc3-n3cccn3)CC2)no1 1772811373 TZFYDAYYFAFLLP-UHFFFAOYSA-N 380.452 2.560 0 50 GFAA O=C(c1ccno1)N1CC[C@H]2[C@@H](C1)CN2C(=O)CCc1nc2ccccc2s1 1775978713 BYDNOUDKNHDZQW-ZFWWWQNUSA-N 396.472 2.590 0 50 GFAA O=C(CCn1cnnn1)N1CCC[C@@H](CCc2cccc(C(F)(F)F)c2)C1 11771681 SXMARKRBCFOFBQ-HNNXBMFYSA-N 381.402 2.953 0 50 GFAA CC(C)c1ccc(N[C@@H]2CCCN(C(=O)CN3C(=O)CSC3=O)C2)cc1 11938272 UNSBEPFNJQMFQA-MRXNPFEDSA-N 375.494 2.908 0 50 GFAA Cc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3cnn4cccnc34)C2)o1 12744054 YBVDXEZREJCMGK-MRXNPFEDSA-N 395.463 2.580 0 50 GFAA O=C(Nc1ccccc1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 12844633 JIBPUVPMFJLRIV-UHFFFAOYSA-N 390.369 2.998 0 50 GFAA O=C(CC[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc(C(F)(F)F)nc1 206257189 GSIHGFYHTUHSOR-ZDUSSCGKSA-N 392.337 2.570 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCCN(Cc4ccc(F)cc4)CC3)n[nH]c21 1857528536 AHGHXOQWXCKKEG-CABCVRRESA-N 386.471 2.919 0 50 GFAA COc1ccccc1CNC(=O)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857697146 XMLOVQNLEGQWOM-AWEZNQCLSA-N 381.457 2.974 0 50 GFAA O=C(c1cncc(N2CCc3[nH]nc(-c4ccccc4)c3CC2)n1)N1CCCC1 1857699866 BGPMJGCWYHDPGB-UHFFFAOYSA-N 388.475 2.708 0 50 GFAA Cc1cccc(N2CCC(N3C[C@@H](COc4ccc(F)cc4)OCC3=O)CC2)n1 1857713771 NCWFLPSVNYMYEO-FQEVSTJZSA-N 399.466 2.804 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CC3CCC3)C[C@]23CC[C@H]1O3)c1cc(F)cc(F)c1 1857714030 IYCHELVUJBUYMJ-QEUVDIPISA-N 376.447 2.974 0 50 GFAA Cc1nc(CNC(=O)C[C@@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)n[nH]1 1857714276 OMTNYSAGRZJQFW-LBPRGKRZSA-N 388.859 2.831 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3nc4c(s3)CCCC4)C[C@]23CC[C@H]1O3 1857724082 LHJFKKIAJXPYDN-XGNBGGDFSA-N 375.538 2.528 0 50 GFAA O=C(N[C@@H](C(=O)O)c1ccccc1)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 238023105 BAVVXCOFWGUXKC-YLJYHZDGSA-N 398.434 2.549 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)N(Cc2ccccc2)C[C@@H](O)c2ccccc2)C1 806972698 HMCQDHMZXRYDMW-NHCUHLMSSA-N 395.503 2.943 0 50 GFAA CN(C(=O)Cn1cc2ccccc2n1)C1CC(N=c2nc(C(C)(C)C)[nH]s2)C1 1875333563 BPVGSGOIOKAQMG-UHFFFAOYSA-N 398.536 2.709 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)NC[C@@H](O)c3ccnn3C)cc12 886260866 IXZPOCVNYUQGII-QGZVFWFLSA-N 395.488 2.651 0 50 GFAA c1ccc2c(c1)[nH]c1ncnc(N3CCC(c4ncc5c(n4)CCNC5)CC3)c12 2325792949 XRVUXBMUBJCPGM-UHFFFAOYSA-N 385.475 2.931 0 50 GFAA C[C@H](c1ccccc1)N1C[C@@H](C(=O)N2CCOC[C@@H]2CC(F)(F)F)CC1=O 2325819566 JHFPMCBUZCEMKR-KBMXLJTQSA-N 384.398 2.776 0 50 GFAA C=CC(=O)NCCC(=O)N1CC2(CCOCC2)c2ccc(Br)cc21 869899892 AORLROLJTGIKBV-UHFFFAOYSA-N 393.281 2.536 0 50 GFAA CC(=O)c1cccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)c1 1138470 DFFIBEGBGKRGAB-UHFFFAOYSA-N 380.853 2.947 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N3CCC(N4CCOC4=O)CC3)cc2)c1C 2356138929 SWATUQHHCRONEU-UHFFFAOYSA-N 380.448 2.817 0 50 GFAA COC(=O)C1CCN(C(=O)[C@H](C)NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 6701043 QPWJGCJBZHTGGI-HIGJEIRPSA-N 390.524 2.509 0 50 GFAA COc1ccccc1C(=O)Nc1ccccc1C(=O)NCCCn1ccnc1 10313208 MBIXAEBPZGAPTM-UHFFFAOYSA-N 378.432 2.964 0 50 GFAA O=C(NS(=O)(=O)c1cccc2nsnc12)c1ccc(Br)cc1 225494707 XCMFBPKBUFZSOO-UHFFFAOYSA-N 398.263 2.573 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@H]2CCO)cc1C 104525362 BNTWVIJGTVSQLZ-GOSISDBHSA-N 375.538 2.837 0 50 GFAA COc1ccc(CN2CCN(CC=C(C)C)[C@@H](CCO)C2)cc1Cn1cccn1 20782781 GYORVKNPBVBPPT-QFIPXVFZSA-N 398.551 2.775 0 50 GFAA COc1cccc(OC)c1CN1CCN(Cc2ccc(F)cc2)[C@@H](CCO)C1 22926131 MPHSOXDOPBOFID-IBGZPJMESA-N 388.483 2.912 0 50 GFAA O=C1CC[C@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)CN1CC1CCCCC1 20820906 DJTNUBFJIHLBND-IBGZPJMESA-N 399.535 2.860 0 50 GFAA O=C(C(=O)N1CCc2[nH]nc(-c3ccc4c(c3)OCO4)c2C1)c1ccccc1 20599086 CGKOZHXBUOGGHI-UHFFFAOYSA-N 375.384 2.573 0 50 GFAA C[C@@H](CN(C)C(=O)C(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)C(=O)O 422754723 GCMGHYOISDPUTP-HNNXBMFYSA-N 386.423 2.534 0 50 GFAA Cc1ccc(CN(C)C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)nc1 252480854 CFGDXKSJCDXVPE-UHFFFAOYSA-N 382.464 2.835 0 50 GFAA CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1ccc3c(c1)CCN3S(C)(=O)=O)C2 229699534 ZKCGGGXFWXCBER-KNBMTAEXSA-N 376.522 2.953 0 50 GFAA CC(C)c1nnc([C@H]2CN(S(=O)(=O)C3=Cc4ccccc4CC3)CCO2)o1 328625920 LDGKLXNYEQGLTH-QGZVFWFLSA-N 389.477 2.883 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2cnc(N3CCCC3)s2)C1)N1CCOCC1 12478900 XIWFSLPUQWRHQN-KRWDZBQOSA-N 392.569 2.594 0 50 GFAA Cn1nc(NC(=O)c2nc3ccccc3[nH]2)c2c(N3CCOC3=O)cccc21 72430920 OFDZVLDDEVBBRL-UHFFFAOYSA-N 376.376 2.659 0 50 GFAA CC(C)c1nc(C2CCN(C(=O)[C@H]3CN(C)C(=O)c4ccccc43)CC2)no1 366439424 NJUATBGXIASOAX-KRWDZBQOSA-N 382.464 2.768 0 50 GFAA COc1cc(C(=O)N[C@H]2CCc3[nH]ncc3C2)ccc1OCc1cscn1 172033647 HOMHTEZPDBGGLQ-AWEZNQCLSA-N 384.461 2.741 0 50 GFAA Cc1c(F)cccc1NC(=O)C[C@@H]1COCCN1C(=O)Cc1cccs1 72475062 HYTLZZRHWZPZSH-CQSZACIVSA-N 376.453 2.994 0 50 GFAA CC(C)[C@H]1CN(c2nccc(N(C)C)n2)CCC(=O)N1Cc1ccc(F)cc1 71714608 MJLDDMAMRUSGPU-GOSISDBHSA-N 385.487 2.945 0 50 GFAA CNC(=O)Cn1cnc(NC(=O)C2(c3cccc(Cl)c3)CCCCC2)n1 172670525 KTOMEMGUMBNOCH-UHFFFAOYSA-N 375.860 2.518 0 50 GFAA Cc1cc(CN2CCOC[C@@H]2c2ncnn2C)cc(C)c1OCc1ccccn1 284364993 NGQSFQGYJWZSNW-HXUWFJFHSA-N 393.491 2.979 0 50 GFAA Cn1cc(SCC(=O)N2CCC[C@H](CS(C)(=O)=O)C2)c2ccccc21 426500297 OUYUMSMGAXRSKC-AWEZNQCLSA-N 380.535 2.554 0 50 GFAA O=C1CCc2cc(OCCCC(=O)N3CCO[C@@H](c4ccco4)C3)ccc2N1 176741129 UTOKXILKUPWBCE-LJQANCHMSA-N 384.432 2.923 0 50 GFAA CCc1ccccc1OCCN(C)C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1 426435024 VCGMMGIRLCCQCU-INIZCTEOSA-N 375.513 2.916 0 50 GFAA Cc1nc(C)c(CCC(=O)Nc2c(-c3ccco3)nc3ccccn23)c(=O)[nH]1 177627666 JSSHAJDVAHPCAZ-UHFFFAOYSA-N 377.404 2.866 0 50 GFAA CC(C)n1cnnc1CN(C)C(=O)NCCc1nccc(-c2ccccc2)n1 426421355 XCMNUNVCZSANJJ-UHFFFAOYSA-N 379.468 2.700 0 50 GFAA Cc1nc(CCNC(=O)N(C)Cc2c(C)nc3ccccn23)nc2c1CCC2 426689336 WEMFZMBCGGCZAF-UHFFFAOYSA-N 378.480 2.614 0 50 GFAA CCc1cc(CN2CCC3(CCN(CCCSC)CC3)[C@H](CO)C2)n[nH]1 97657147 QTIBLYVKJYMKIL-KRWDZBQOSA-N 380.602 2.622 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccc(O)cc3)C2)CN1Cc1ccncc1 92028222 OBJRSMLAXHURRL-QFIPXVFZSA-N 379.460 2.832 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)CSC(C)C)C3)CCC2=O)cn1 91645844 ULHAVYZHXJPLHQ-FQEVSTJZSA-N 390.553 2.658 0 50 GFAA COC(=O)C1=C(C(=O)OC)[C@@H](c2ccc(Cl)cc2)c2sc(=O)[nH]c2S1 95004880 KKRMXMIVAMHZQX-SECBINFHSA-N 397.861 2.928 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(c3nc4ccccc4o3)CC2)n1C 96136613 QGGJSNPPFPIFLM-UHFFFAOYSA-N 377.452 2.894 0 50 GFAA COc1cc(NC2CCN(CCn3c(=O)oc4cccnc43)CC2)cc(OC)c1 180601718 FXUZVEFYLKBPTA-UHFFFAOYSA-N 398.463 2.583 0 50 GFAA O=C(c1cccs1)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@H]2C=Cc3cc(Cl)ccc3N12 245256588 RRKMLLGXBGFJBG-BVUBDWEXSA-N 384.844 2.757 0 50 GFAA CN1C(=O)N=C2[C@H]1[C@H](c1ccc3c(c1)OCO3)CC(=O)N2c1ccc(F)cc1 253471123 MDBDCOKNMZIGQV-KBXCAEBGSA-N 381.363 2.907 0 50 GFAA C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cnc3c(cnn3C)c2O)cc1 181814635 PIUQWPHYNFOTKN-CYBMUJFWSA-N 393.447 2.941 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H]2C[C@@H](c3cc(O)nc(C4CC4)n3)C2)c(C)s1 253535111 CZUYFDODOYXWQA-BETUJISGSA-N 379.507 2.962 0 50 GFAA CCOc1ccc(C[C@@H](CNC(=O)c2ncoc2[C@H]2CCCO2)C(=O)O)cc1 299753727 ZDQFHPQUBRKIPF-GOEBONIOSA-N 388.420 2.598 0 50 GFAA O=S1(=O)CC[C@H]2CN(Cc3cn(-c4ccccc4)nc3-c3ccncc3)C[C@H]21 377697627 OHCBZULXZRSSBC-FXAWDEMLSA-N 394.500 2.553 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3ccnc4ccccc34)cn12 1940198449 VIIAFKXHSBKYNN-IBGZPJMESA-N 375.432 2.897 0 50 GFAA Cn1nc(C(=O)N2CCC([C@H]3C[C@H](N)CCO3)CC2)cc1-c1ccc(F)cc1 1343670394 AOUWWFZETPNJLL-YLJYHZDGSA-N 386.471 2.585 0 50 GFAA CN(Cc1ccc([S@](C)=O)cc1)C(=O)N[C@@H]1COc2c(F)cc(F)cc2C1 1351563582 KONMKHPIFOBNHN-QZXCRCNTSA-N 394.443 2.847 0 50 GFAA CC(C)(C(=O)N1CCN(c2nc(N)ns2)CC1)c1cccc(C(F)(F)F)c1 267911009 ZRUJGACFANLAQB-UHFFFAOYSA-N 399.442 2.766 0 50 GFAA COCC(=O)N1CC[C@@]2(O)CCN(Cc3c(C)sc4ccccc34)C[C@H]2C1 1565505663 AQVRCCALJFTHTK-KKSFZXQISA-N 388.533 2.641 0 50 GFAA Cc1c(-c2cc(CN[C@@H](CN3CCCC3=O)c3ccccc3)on2)cnn1C 184717188 HVZYGRRNWRXRSY-FQEVSTJZSA-N 379.464 2.837 0 50 GFAA CCc1c(C(=O)N2C[C@@H]3CCC[C@H](C2)C3O)nnn1-c1ccc(OC(C)C)cc1 169994259 MSTDAKLFYZUHDF-GWTOYCKXSA-N 398.507 2.850 0 50 GFAA CCCN(c1cc(C(F)(F)F)n[nH]1)S(=O)(=O)c1cccc(C(=O)OC)c1 170596540 DHJWOHITIVAWDK-UHFFFAOYSA-N 391.371 2.820 0 50 GFAA Cc1ccc(CN2CC[C@H](NS(=O)(=O)c3ccc4c(c3)CCC4)C2=O)cc1 190603673 KIWAZCFLEUHVSD-FQEVSTJZSA-N 384.501 2.563 0 50 GFAA COc1ccc(CCN(Cc2ccncc2)C(=O)c2cccc(N)n2)cc1OC 1506419793 XGLWWHVKFGMUDE-UHFFFAOYSA-N 392.459 2.961 0 50 GFAA O=C(c1cccc(F)c1F)N1CCCN(Cc2nc(C(F)(F)F)no2)CC1 1772702914 JKVSFOKRXFYAJL-UHFFFAOYSA-N 390.312 2.715 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2Cc3cc(Cl)cc(-c4ncccn4)c3O2)nn1C 11978678 SNSQHTBQWMGLBC-AWEZNQCLSA-N 383.839 2.572 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)C2CCOCC2)CC1 12072833 FQEFBXKSCMLSDN-UHFFFAOYSA-N 389.492 2.836 0 50 GFAA Cc1ncsc1CCCNC(=O)[C@H]1CCC(=O)N(CCc2ccccc2)C1 12300162 HWEWJJAMKSQSGE-SFHVURJKSA-N 385.533 2.982 0 50 GFAA O=C(Nc1ccnn1C1CCN(Cc2ccon2)CC1)c1ccc2c(c1)OCO2 12453805 BTAPCVGYPYCBPI-UHFFFAOYSA-N 395.419 2.689 0 50 GFAA Cc1c(CN2CC(=O)N(C(C)C)C[C@H](OCc3ccc(F)cc3)C2)cnn1C 14731558 KOWYZEKAUVMUOC-HXUWFJFHSA-N 388.487 2.506 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)n1 14954166 PSOQYFGYOTYXLP-SFHVURJKSA-N 386.471 2.584 0 50 GFAA COCCN1CCC(CN(Cc2cccc3c2OCO3)C[C@@H]2CCCO2)CC1 14954513 IOWUBNBXBCDSBP-FQEVSTJZSA-N 390.524 2.755 0 50 GFAA CCOc1cc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)ccc1OC 19532087 WAWDEBHVHFVXQH-UHFFFAOYSA-N 390.505 2.600 0 50 GFAA Cc1noc(-c2cccn3c(CNC(=O)c4ccc(F)c(Cl)c4)nnc23)n1 169776332 MHIJYEAMEULSLH-UHFFFAOYSA-N 386.774 2.810 0 50 GFAA CC[C@@]1(C(=O)NCc2cnc(C)cn2)C[C@@H]2CC[C@H]1N2C(=O)Cc1ccccc1 1857673700 RSLRTUBLAZQJAV-MIZPHKNDSA-N 392.503 2.804 0 50 GFAA Cn1nc(C(=O)N2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)c2ccccc2c1=O 1857717990 JPWHCVLDHMQZBS-VQTJNVASSA-N 389.455 2.926 0 50 GFAA Cn1cc(C(=O)N2CC[C@@H](O)[C@@](CO)(Cc3ccccc3)C2)c2ccccc21 1857722989 SMNALAATKNXPIE-GGAORHGYSA-N 378.472 2.607 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cc4c(nc3O)CCCC4)C[C@H]12 1857723550 KQKHNRJKPCBROD-CJCBUOBESA-N 384.476 2.739 0 50 GFAA CCn1nc(CC(N)=O)nc1[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857738397 GISDFYWTGOCNQU-NSHDSACASA-N 388.859 2.504 0 50 GFAA C[C@@H]1C[C@@H](N)CCN1C(=O)CCC[S@](=O)c1ccc(Br)cc1 408519185 PSWDBAMFNDVVNK-BWFKNJDFSA-N 387.343 2.675 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cccc(N3CCCC3=O)c2)C[C@@H]1c1ccccc1 219418172 QJTNACQIHVKZBU-MOPGFXCFSA-N 378.428 2.754 0 50 GFAA C[C@H](c1nnnn1C1CC1)N1CCO[C@@H](c2cccc(Br)c2)C1 248836936 KCTJIHDMCDYKOH-IAQYHMDHSA-N 378.274 2.905 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@@]3(C)CCO[C@@H]3C3CC3)nn2C)cc1OC 935367406 SHTWHCKHURMOPS-CTNGQTDRSA-N 385.464 2.792 0 50 GFAA O=C(NC[C@@H]1CCCO1)C1CCN(C(=O)c2cccn2Cc2ccccc2)CC1 1875254814 AZWPNENSEBPOOS-FQEVSTJZSA-N 395.503 2.684 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(Cc3ccccc3)[C@H](C)C2)ccc1C(=O)O 396373272 OATGCISNYOXHGR-MRXNPFEDSA-N 388.489 2.588 0 50 GFAA CCC(=O)N[C@](Nc1ccc(OC(F)(F)F)cc1)(C(=O)OC)C(F)(F)F 2190753 UCIHCGBFAWQQHO-GFCCVEGCSA-N 388.264 2.955 0 50 GFAA O=C(c1cccc(N=c2nn[nH][nH]2)c1)N1CCC(Oc2ccc(Cl)cc2)CC1 2325782212 DLPNCZONIOZKOF-UHFFFAOYSA-N 398.854 2.702 0 50 GFAA CCOc1ccccc1C(=O)Nc1ccsc1C(=O)N1CC2(CCC(=O)N2)C1 2325783086 XOXUMYUGGYDANE-UHFFFAOYSA-N 399.472 2.504 0 50 GFAA COC(=O)c1cnc(CC2CCN(Cc3nc4ccncc4n3C)CC2)s1 2325809182 MDGVOWUGLBYEBQ-UHFFFAOYSA-N 385.493 2.666 0 50 GFAA CCNS(=O)(=O)c1ccc(NC(=O)Cc2ccc(Br)cc2)cc1 1061646 VLGGLLILBPMTSY-UHFFFAOYSA-N 397.294 2.929 0 50 GFAA CCNC(=O)C[C@@H]1C(=O)N(c2ccc(F)cc2)C(=O)N1Cc1cccs1 1070197 NTXQTDPUOHLHOZ-OAHLLOKOSA-N 375.425 2.751 0 50 GFAA CC(C)n1nccc1-c1nc(-c2ccc(C(N)=O)cc2)nn1C1CCN(C)CC1 2356162448 CILNUTWDUKCPCY-UHFFFAOYSA-N 393.495 2.755 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NCc1ccccn1 4999594 JOCWNUGVRHMGJH-UHFFFAOYSA-N 387.505 2.885 0 50 GFAA COc1ccc(Cl)cc1N([C@@H](C)C(=O)N1CCC[C@@H](C)C1)S(C)(=O)=O 10541643 PRYJNAMQTUHASP-OLZOCXBDSA-N 388.917 2.762 0 50 GFAA COC(=O)C[C@@H]1CC(=O)[C@H]2C(=O)c3c(OC)ccc(Br)c3[C@H]2C1 55529251 KIBDKRPJUGKECL-QQXLSSBLSA-N 381.222 2.896 0 50 GFAA OCC[C@H]1CN(C2CSCCSC2)CCN1Cc1ccc(F)c(F)c1 23479028 JAMNZPRJHHIYTB-HNNXBMFYSA-N 388.549 2.682 0 50 GFAA O=C(c1ccc2ccccc2c1)N1CCN(c2cc(-n3cccn3)ncn2)CC1 67620760 RRSDBIFHQFDBIT-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA Cc1c(CS(C)(=O)=O)cccc1NC(=O)c1ccnc(OCC(F)F)c1 135039765 GTKXLOONBGHBGY-UHFFFAOYSA-N 384.404 2.831 0 50 GFAA CC(C)Cc1nc([C@@H]2CC(=O)N(Cc3ccccn3)C2)n(-c2ccccn2)n1 65371929 XKCLIFFZVMMHPL-MRXNPFEDSA-N 376.464 2.772 0 50 GFAA O=C(NCCCN1CCc2ccccc2C1)c1ccc(N2CCOCC2)cc1 63928768 JTKJCJFAMUTESI-UHFFFAOYSA-N 379.504 2.701 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)c1 67603458 SSDHJUHCGBDDKT-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1cc(C(=O)N2N=C(C3CC3)C[C@]2(O)C(F)(F)F)cc(OC)c1OC 1011982 YKBOURJNDBIUSA-INIZCTEOSA-N 388.342 2.575 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@H](CCc3ccc(F)cc3F)C2)c(=O)[nH]1 71764525 FILSLEINAXSKMG-CQSZACIVSA-N 375.419 2.770 0 50 GFAA Cn1c(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)nc2ccccc21 39478839 NETGRIBIMBJIIZ-LJQANCHMSA-N 382.483 2.781 0 50 GFAA CS(=O)(=O)Cc1ccc(NC(=O)N2CCC(c3ccn[nH]3)CC2)cc1F 150914828 ULELACAUSOYPHR-UHFFFAOYSA-N 380.445 2.505 0 50 GFAA CO[C@@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccc3ccccc3c2O)C1 363092953 RBGUDKRZGXJLJA-VQIMIIECSA-N 382.460 2.787 0 50 GFAA C[C@H]1CCCN(C(=O)C2CCN(C(=O)N[C@@H]3CCN(c4ccccc4)C3)CC2)C1 363392379 HGLYOWFXRQGLAR-AZUAARDMSA-N 398.551 2.945 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)NCCc3nc(C(F)(F)F)cs3)C2)n1 174264443 AHKLQBANOJZWPI-JTQLQIEISA-N 389.403 2.985 0 50 GFAA CNS(=O)(=O)c1cccc2c1CCN(Cc1cc(F)cc3cccnc13)C2 375282111 YEFLQIJIKDGKBF-UHFFFAOYSA-N 385.464 2.840 0 50 GFAA COCCN1CC[C@H]2N(Cc3ccccc3SC)CCC[C@]2(C(=O)O)C1 72409720 BOFHNHOMPXPIFD-QUCCMNQESA-N 378.538 2.796 0 50 GFAA NS(=O)(=O)c1ccc(-n2ccnc2-c2cc3c(cc2Cl)OCO3)cc1 71775513 YRHKKGOAXQLBTG-UHFFFAOYSA-N 377.809 2.569 0 50 GFAA Cc1c(CN2C[C@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cnn1C 72153860 FUCVHXNZMPVBGX-STZQEDGTSA-N 380.492 2.519 0 50 GFAA Cn1cnc2cc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)ccc2c1=O 216410060 USXXHTIZXMGOHR-UHFFFAOYSA-N 390.487 2.500 0 50 GFAA O=C(c1nccc2ccccc12)N1CCOC[C@H]1c1ncn(CC(F)(F)F)n1 368606970 XUQCHVTXOORMML-AWEZNQCLSA-N 391.353 2.602 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCCc2ccc(C(=O)O)cc2)cc1 237734120 MPJFBAQFOXWSBG-IBGZPJMESA-N 380.444 2.543 0 50 GFAA CCOCCCN1CC[C@H](N2C(=O)[C@@H]3C[C@@H]4CCCC[C@H]4N3C2=O)[C@H](C)C1 239653912 BLOVERYUVJTGPE-SPOLIRPYSA-N 377.529 2.719 0 50 GFAA Cc1noc(-c2ccc(-c3cccc(C(=O)N4CC[C@H]5CNC[C@H]54)c3)nc2)n1 426387796 CUJNLODNOWWCLP-QFBILLFUSA-N 375.432 2.541 0 50 GFAA CO[C@@]12CC[C@@H](O)C[C@@H]1N(Cc1ccccc1OCCCn1ccnc1)CC2 426634329 RBXYSMZCWVSKNT-BAGYTPMASA-N 385.508 2.857 0 50 GFAA Cc1onc(-c2ccccc2)c1C(=O)N1CCC[C@H](c2ccnn2CC(=O)O)C1 426441759 LBNDIDKVPBXMOK-INIZCTEOSA-N 394.431 2.951 0 50 GFAA CCC[C@H]1C=CCN1C(=O)c1ccc(OC2CCN(C(=O)COC)CC2)cc1 95530230 OJFGOQGVGNRIIB-SFHVURJKSA-N 386.492 2.884 0 50 GFAA COc1cc(N2CCC[C@]3(CCC(=O)N(CCc4ccccc4)C3)C2)ncn1 91872716 TUOGHLMEYJCHJZ-QFIPXVFZSA-N 380.492 2.937 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cccc([C@H]4CCCNC4)c3)CC2=O)c1 95382358 XIJYWSPVMWEYSQ-QFIPXVFZSA-N 391.515 2.947 0 50 GFAA Cc1cccc(C)c1NC(=O)CNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1 299188416 BHBPPPUEBPIYCM-LJQANCHMSA-N 393.487 2.592 0 50 GFAA COc1ccccc1C1(CNC(=O)Cn2cnc3ccccc3c2=O)CCC1 183309731 NRSDDQRSSKIBHZ-UHFFFAOYSA-N 377.444 2.643 0 50 GFAA CN1C[C@@H](CN(C)C(=O)NCc2ccccc2OCc2ccccc2)CC1=O 584891327 PHWJDVMLZIPVCI-SFHVURJKSA-N 381.476 2.885 0 50 GFAA O=S(=O)(c1ccc(F)c(F)c1F)N1CCC[C@@H](OCc2ccccn2)C1 952964782 DLFJOWXNKLLHBN-CYBMUJFWSA-N 386.395 2.869 0 50 GFAA CC(=O)NC[C@@H]1CCn2ncc(C(=O)Nc3cc(F)ccc3NC(C)C)c2C1 277097970 DVIBJBDAOPMEFI-CQSZACIVSA-N 387.459 2.793 0 50 GFAA O=C([C@H]1CCCN1Cc1ccccc1)N1CCN(c2cc(C3CC3)n[nH]2)CC1 189964064 HLUKHMDCNSZWGL-HXUWFJFHSA-N 379.508 2.600 0 50 GFAA COc1ccc(-c2cc(C(=O)O[C@H]3CC(=O)N(C)C3)nn2-c2ccccc2)cc1 764731139 IXUMOIMVUOGMHG-SFHVURJKSA-N 391.427 2.935 0 50 GFAA CN(C[C@H]1Cc2ccccc2CN1C)C(=O)c1[nH]nc(N)c1-c1ccccc1 1506401520 SLWJFJUYCMVDGO-GOSISDBHSA-N 375.476 2.788 0 50 GFAA O=C([C@@H](Cc1cnc[nH]1)n1cccc1)N1CCCN(Cc2ccc(F)cc2)CC1 1506420971 RJRYNNWYZCUQFM-OAQYLSRUSA-N 395.482 2.869 0 50 GFAA O=C(c1cncc(N[C@@H](CCn2cncn2)c2ccccc2)n1)N1CCCC1 1529110076 KWRGVLKUHCQNTP-KRWDZBQOSA-N 377.452 2.548 0 50 GFAA CCCC(=O)N1CCC(N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)CC1 1529151953 HYGZDHDMROHMLU-XMSQKQJNSA-N 381.520 2.861 0 50 GFAA O[C@H]1CCCN(c2ccnc(NC3CCN(Cc4ccc(F)cc4)CC3)n2)C1 1704297861 DVRXZYVCFLHKNH-IBGZPJMESA-N 385.487 2.653 0 50 GFAA COc1cc(-c2onc(N3[C@H]4CC[C@@H]3CCN(C)C4)c2C(=O)O)ccc1F 1704302909 DFBRSHCBXZKUHN-OLZOCXBDSA-N 375.400 2.860 0 50 GFAA COCCCn1c(CN(C)[C@@H]2CCCc3ccccc32)cnc1S(C)(=O)=O 11936709 PIDXBECXLSIELJ-LJQANCHMSA-N 391.537 2.833 0 50 GFAA Cc1ccc(CN2CCC3(CC[C@@H](CNC(=O)c4ccn(C)n4)O3)CC2)cc1 11973760 QRSPHNCGAUHDNV-IBGZPJMESA-N 382.508 2.672 0 50 GFAA O=C(COc1ccccc1)NC[C@H]1CCC2(CCN(Cc3ccncc3)CC2)O1 12041862 JULQILOLZHJWRJ-OAQYLSRUSA-N 395.503 2.790 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)NC[C@H](C)O)c1 12195272 NDQJYHVCTCKVCX-HNNXBMFYSA-N 376.497 2.592 0 50 GFAA COc1ccccc1OCC(=O)NC[C@@H]1CCCN(C2CCSCC2)C1 12708222 LGPGZKCIWBWOQH-INIZCTEOSA-N 378.538 2.798 0 50 GFAA CN1CCC2(CC1)C(=O)N(Cc1ccccn1)C(=O)N2CCc1ccccc1 14733339 COAKBFSGNYPNAR-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NC(=O)CN3CCCCC3=O)C2)cc1 15064217 ZSJRSHLHFRBFBQ-OAQYLSRUSA-N 385.552 2.978 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)Nc2nc(C)cs2)c1 16606487 CPYSMKZSQTVYMG-UHFFFAOYSA-N 383.495 2.743 0 50 GFAA O=C(Nc1nnc(C2CC2)s1)c1cc(S(=O)(=O)N2CCCC2)cs1 16625061 JVMBRGUUIPQLCT-UHFFFAOYSA-N 384.508 2.514 0 50 GFAA Cc1noc(-c2cccn3c(CNC(=O)Cc4ccc(Cl)cc4)nnc23)n1 169776130 VKLNECYTWLGJQM-UHFFFAOYSA-N 382.811 2.600 0 50 GFAA COc1cccc(OCc2nc(-c3cccnc3N(C)C)n([C@@H]3CCOC3)n2)c1 1857679224 YYJYXBJKXYZEPD-OAHLLOKOSA-N 395.463 2.955 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1C[C@@H]2CC[C@H](C1)[C@H]2NC(=O)c1ccno1 1857693738 KPAGUBPXUBNFBY-USGNIVHTSA-N 392.459 2.674 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(Cc1cc(=O)n3ccsc3n1)CC2 1857695337 FHXKKACTBMLJGR-UHFFFAOYSA-N 391.500 2.757 0 50 GFAA C[C@H](O)C1CCN(C(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1 118731363 GOVWWNRARWOAMJ-DZGCQCFKSA-N 385.430 2.936 0 50 GFAA CS(=O)(=O)N[C@H]1CCCN(C(=O)CCCc2csc3ccccc23)C1 119845327 ZIOVQMDXZQQMBC-HNNXBMFYSA-N 380.535 2.764 0 50 GFAA O=C(O)c1csc(CNC(=O)C2(c3ccccc3Cl)CCOCC2)n1 124384208 HTBKOOTZHNWTNV-UHFFFAOYSA-N 380.853 2.859 0 50 GFAA Cc1nn(-c2nccs2)cc1-c1ccc(CN2C(=O)CC[C@@H]2C(=O)O)cc1 901080983 WDXYHJZLFYJWGW-MRXNPFEDSA-N 382.445 2.880 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C3CCN(C(=O)C4CCC4)CC3)C1)CC2 1704302678 BSAYEAHDSJMCLN-QHCPKHFHSA-N 397.567 2.614 0 50 GFAA Cc1ccc(C(=O)N(C)[C@H](C)CCNC(=O)c2cccc3nc[nH]c23)c(N)c1 1875349563 BQHZOFWBNVLOHE-CQSZACIVSA-N 379.464 2.734 0 50 GFAA O=C(NCc1ncccc1C(F)(F)F)N1CCN(c2ccccc2)C(=O)C1 1875334744 CEVBUGADYUJZHR-UHFFFAOYSA-N 378.354 2.659 0 50 GFAA O=C(CCC[C@@H]1NC[C@@H]2CNC[C@H]1C2)N[C@@H]1CCC[C@H]1OCc1ccccc1 2100557698 ZYTOVZOYSVQRRG-MLBCHFTJSA-N 385.552 2.608 0 50 GFAA CCOc1ccc(S(=O)(=O)N(C(C)=O)c2ccc(OC(C)=O)cc2)cc1 1128619 AUPQFJWSHBNRHU-UHFFFAOYSA-N 377.418 2.752 0 50 GFAA C[C@@H]1NCC[C@H]1C(=O)N(Cc1ccccc1)Cc1nc(O)c2sccc2n1 2325738418 SYOXXLVYTSYLQH-DZGCQCFKSA-N 382.489 2.924 0 50 GFAA O=C1O[C@@H](C(=O)N2C[C@H](CO)c3ccccc32)Cc2cc(C(F)(F)F)ccc21 2325784845 NTTJORSLOZDBCH-SJKOYZFVSA-N 391.345 2.910 0 50 GFAA O=C(NCc1nnc(C2CNC2)s1)c1cc2ccc(OC(F)(F)F)cc2[nH]1 2325813133 OSRQVIGDZXEYMM-UHFFFAOYSA-N 397.382 2.535 0 50 GFAA CCOC(=O)COc1ccc2c(C)cc(=O)oc2c1I 1182960 REDCDWOBXUZIJQ-UHFFFAOYSA-N 388.157 2.648 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1=O 2356162560 FEBKBIVASHXTRO-GOSISDBHSA-N 384.398 2.949 0 50 GFAA Cc1cc(Cl)cc(Br)c1OCCNCCN1CCOCC1 20482453 FMFSRQNVNTUGEZ-UHFFFAOYSA-N 377.710 2.712 0 50 GFAA CCN(CCN1CCCCCC1)C(=O)c1cc(NC(C)=O)cc(NC(C)=O)c1 55358251 IFBKHCZUJIARQS-UHFFFAOYSA-N 388.512 2.942 0 50 GFAA CCCNC(=O)N1CCc2c(cnc(C)c2-c2noc(C3CCOCC3)n2)C1 23312103 KVCNTTNWKUVDHA-UHFFFAOYSA-N 385.468 2.812 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)cc1Cl 65364815 VMTIULJQSOUVPG-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2c(C)nn(C(F)F)c2C)c1 2804164 VLPAXMVTXDCZOL-VIFPVBQESA-N 389.424 2.952 0 50 GFAA O=C(OC[C@H]1CCCN2CCCC[C@H]12)c1cc2ncc(Br)cn2n1 4502043 JHZKYSMXDNEOKP-IUODEOHRSA-N 393.285 2.913 0 50 GFAA COc1cccc(CN2CCC[C@@H](Nc3cncc(C(=O)N4CCCC4)n3)C2)c1 72426967 OXEYTYPABQZKQW-GOSISDBHSA-N 395.507 2.798 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccccc3-n3cncn3)C2)CN1CC1CC1 77377343 MMQHDIUFLZSDFE-QFIPXVFZSA-N 393.491 2.522 0 50 GFAA CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@@H](N3CCCC3)CC2)C1 127385763 RBGVSGVIZLAKOT-VQTJNVASSA-N 392.588 2.931 0 50 GFAA CCc1ccccc1C(=O)N1CCC2(CC1)C[C@@H](C(=O)O)N(C(=O)C1CC1)C2 72423837 DLSCOXRRIWAQGL-SFHVURJKSA-N 384.476 2.567 0 50 GFAA c1cncc(CN2CCCN(c3cc(-c4ccncc4)nc4ccnn34)CC2)c1 72417839 NUWOEEJYIWNCLU-UHFFFAOYSA-N 385.475 2.899 0 50 GFAA CC(C)CNC(=O)C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72138946 YKGUAHXKGTVPSL-NRFANRHFSA-N 379.504 2.816 0 50 GFAA CN1CCN(c2ccc(CNC(=O)N3CC[C@H](Cc4ccccc4)C3)cn2)CC1 174846357 SIPWPCZRIOWTLN-HXUWFJFHSA-N 393.535 2.608 0 50 GFAA O=C(CNC(=O)c1ccc(C2CCC2)cc1)Nc1ccc(-n2cncn2)cc1 240551453 GTWGWAATYGBOGS-UHFFFAOYSA-N 375.432 2.903 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCC4(c5ccc(F)cc5)CCOCC4)[C@H]1[C@H]3C2 287235925 QVTATTUQASVVQN-SBCNTATESA-N 388.483 2.939 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@@H]1CCCN(C(=O)CCc2ccccc2)C1 426571329 ADINDMVUIHIUBE-LJQANCHMSA-N 381.524 2.750 0 50 GFAA C[C@H]1CCCN1C(=O)c1cccc(-c2ccc3ncnc(NCCO)c3c2)c1 426409427 PDCNGFFDNTUVJA-HNNXBMFYSA-N 376.460 3.326 0 50 GFAA O=C(Nc1ccc(CN2CCOCC2)cc1)N1CCN[C@H](c2ccccc2)C1 96141383 SWMKKMVMMXBDMO-NRFANRHFSA-N 380.492 2.697 0 50 GFAA COc1ccccc1-c1cc(C(=O)N(Cc2cocn2)Cc2cocn2)[nH]n1 97679722 ZIGOFGYFGCBNHZ-UHFFFAOYSA-N 379.376 2.904 0 50 GFAA O=C(CN1CCN(Cc2cccc(F)c2)CC1)Nc1cccc2nsnc12 22752327 PBXAFWIDSILMMA-UHFFFAOYSA-N 385.468 2.587 0 50 GFAA CCOCCC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91635773 KWCWONQUPUBZCB-UHFFFAOYSA-N 380.435 2.733 0 50 GFAA Cc1ccc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc1N1CCNC1=O 92099219 WQMKDBISIIDCEX-HXUWFJFHSA-N 378.476 2.654 0 50 GFAA COc1cc(Cl)c(C)cc1NC(=O)N1CCN(CC2CC2)[C@@H](CCO)C1 96132236 MMOFPIQEQXJEHI-HNNXBMFYSA-N 381.904 2.968 0 50 GFAA CCc1noc(CN(CC)C(=O)Nc2cc(Cl)ccc2-n2cncn2)n1 96165957 QGOWSYQYAHRBMD-UHFFFAOYSA-N 375.820 2.920 0 50 GFAA O=C(CCN1CCN(c2ccc(Cl)cn2)CC1)NCc1ccccc1F 244716210 LKOFJOGVKYTWFR-UHFFFAOYSA-N 376.863 2.703 0 50 GFAA COc1ccc(CNC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1C(=O)O 299744992 QOEPSAPWIAZRBS-UHFFFAOYSA-N 387.407 2.897 0 50 GFAA COc1ccccc1-n1cc([C@H](C)NC(=O)N(C)CCn2ccnc2C)cn1 534645478 UBKNHTQJECZSLI-HNNXBMFYSA-N 382.468 2.788 0 50 GFAA NC(=O)c1ccc(NC(=O)c2cc3n(n2)C[C@H](c2ccc(F)cc2)OC3)cc1 263615426 CINCDPBOPJCYNF-GOSISDBHSA-N 380.379 2.645 0 50 GFAA CO[C@@]12CC[C@@H](NC(C)=O)C[C@@H]1N(C(=O)c1cc(-c3ccccc3)on1)CC2 584884942 YLLLXROVVGKUGY-LKUPVBHCSA-N 383.448 2.630 0 50 GFAA NCc1nc2c(s1)CCN(C(=O)[C@@H]1CCn3c(cnc3C3CCCCC3)C1)C2 1333712122 UCPFSWYKSKLPCT-OAHLLOKOSA-N 399.564 2.993 0 50 GFAA COc1ccc(CN2CCCN(C(=O)c3ccco3)CC2)cc1Cn1cccn1 952968101 ASPCHVPQFSVBLX-UHFFFAOYSA-N 394.475 2.881 0 50 GFAA CN1C(=O)N(C)C2(CCN(C(=O)c3cccc(-c4cccc(F)c4)c3)CC2)C1=O 952980232 JUJZGJRYECQYPN-UHFFFAOYSA-N 395.434 2.991 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)CCn2c(=O)oc3ccc(C)cc32)c1 952967188 ASMUCIJKCKKWSC-UHFFFAOYSA-N 397.431 2.825 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](N(C)c3ccc(C(F)(F)F)nn3)C2=O)c1 271035053 DNWICFVBEWMPBO-CQSZACIVSA-N 396.369 2.754 0 50 GFAA CNc1ncnc2c1cnn2Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 194432338 GDZXKUDGIIABSF-UHFFFAOYSA-N 375.314 2.985 0 50 GFAA CC[C@@H](NC(=O)c1nnc(O)c2ccccc12)c1ccc(S(C)(=O)=O)cc1 1506427715 MNWAIEQGKKGDFL-MRXNPFEDSA-N 385.445 2.620 0 50 GFAA c1cncc(-c2nnc(CN3CCC(c4nnc5n4CCCCC5)CC3)o2)c1 1506397104 YWDOJLYYYCZERB-UHFFFAOYSA-N 379.468 2.829 0 50 GFAA COc1ccc(OC)c([C@@H]2CCN(C(=O)CSc3nnc(C)s3)C2)c1 1506429496 STXQDIYIFDVAFF-GFCCVEGCSA-N 379.507 2.972 0 50 GFAA O=C(c1ccnc(N2CC[C@](C(=O)O)(c3ccccc3)C2)c1)N1CCCCC1 1704304836 OKPSOCZYTHYLSA-JOCHJYFZSA-N 379.460 2.940 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)Cc3cnc4c(C)cccn34)C1)CC2 1704343669 MNFKPSMWJSTXHC-QFIPXVFZSA-N 375.476 2.790 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)C[C@@H]3CCCOC3)CC1)OCC2 1704299249 PEGPMOJPWOQNEX-INIZCTEOSA-N 389.492 2.911 0 50 GFAA CCOc1ccc(N2C(=S)N(c3ccccc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 5027898 TUBWQPMBYMSHSZ-ZWKOTPCHSA-N 388.514 2.862 0 50 GFAA CO[C@H](C(=O)Nc1ccnn1C1CCN(Cc2cc[nH]n2)CC1)c1ccccc1 11819654 FZWKNMYYXXROHT-FQEVSTJZSA-N 394.479 2.770 0 50 GFAA CCCNC(=O)N1CC[C@@]2(CCCN(Cc3cccc(OC)c3OC)C2=O)C1 12030862 ZOLIQCCWHTWMGY-NRFANRHFSA-N 389.496 2.638 0 50 GFAA COc1ccc(N([C@H](C)C(=O)N[C@H](C)c2ccccc2)S(C)(=O)=O)cc1 12383828 RZTDLPNHAIPQMA-HUUCEWRRSA-N 376.478 2.727 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)Cn3ccc(C)n3)C2)cc1 12597816 IDHPHGXAHXORBX-HXUWFJFHSA-N 384.524 2.613 0 50 GFAA COc1cc(C(=O)NCCC2=CCCCC2)c(N(C)S(C)(=O)=O)cc1OC 13582523 ZGEGSFYXIKMJAC-UHFFFAOYSA-N 396.509 2.720 0 50 GFAA Cc1nc2c(c(=NCCO)[nH]1)CCC21CCN(Cc2c(C)cccc2C)CC1 1857683042 QOKNXWIPHKHBAG-UHFFFAOYSA-N 380.536 2.708 0 50 GFAA Cn1cnc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1 2392287 SLWOFHRSEVVUHM-FQEVSTJZSA-N 391.427 2.955 0 50 GFAA in-vitro CC(=O)N[C@H](CC(=O)N1CCC(C(=O)O)(c2ccccc2)CC1)c1ccccc1 236720091 MDSBZMRMYHPBGQ-HXUWFJFHSA-N 394.471 2.899 0 50 GFAA NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CCN(c2ccccc2F)C1 378132765 WXEFSQURADWXMQ-RHSMWYFYSA-N 389.858 2.518 0 50 GFAA O=C1CC[C@H](Nc2cc(N3CCCCCC3)nc(-c3ccccc3)n2)C(=O)N1 1857797740 IMZSGQUPLSBJLM-INIZCTEOSA-N 379.464 2.741 0 50 GFAA CCOC(=O)N1CCN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1 19891640 RLYKATPCJKUCGG-FQEVSTJZSA-N 384.476 2.867 0 50 GFAA CN(C)CC1(C(=O)N[C@@]2(C)CCN(C[C@@H]3[C@@H](c4ccccc4)C3(F)F)C2)CC1 2325794276 WQCXYBFVCDZXPC-GGPKGHCWSA-N 391.506 2.958 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1cccc(Br)c1)Cc1ccccc1 686576 UPDUBWVPPWAMRR-UHFFFAOYSA-N 397.294 2.849 0 50 GFAA CCc1ccccc1NC(=O)CN(c1ccc(OC)c(OC)c1)S(C)(=O)=O 821510 FCYSFTOVNCHZDP-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA COC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccc(OC)c(Cl)c1 4869349 NPZZOWXLEVGTSA-UHFFFAOYSA-N 375.874 2.845 0 50 GFAA O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc(Cl)nc(N2CCCC2)c1 112580037 QJVYZDMLZPLDSJ-HNNXBMFYSA-N 375.860 2.963 0 50 GFAA O=C(NC[C@@H](O)c1ccccc1Cl)c1ccc(CSc2ncn[nH]2)o1 55569082 CIQQNLVIQPKYMR-CYBMUJFWSA-N 378.841 2.807 0 50 GFAA CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)Nc1ccc(-n2ccnc2C)nc1 134616233 VVHUSWTUAYLMFR-KDOFPFPSSA-N 384.484 2.734 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3nsnc3c2)CCN1Cc1ccccc1F 23374375 HRJTVCYIBDJLHQ-QGZVFWFLSA-N 386.496 2.899 0 50 GFAA O=C(C[C@H]1CNCCO1)N1CCC(c2cc(-c3ccccc3Cl)[nH]n2)CC1 67757195 WLMLPWVFXKZNQO-HNNXBMFYSA-N 388.899 2.815 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@@H](CNC(=O)[C@@H]2CCCCN2C)C3)n1 39461429 ASWPVLVKKWZZPD-BEFAXECRSA-N 398.482 2.804 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@@]1(O)CCc2ccccc21 123596395 CNKFSIQMHBBEKQ-NRFANRHFSA-N 380.423 2.645 0 50 GFAA C[C@@H](Cn1ncc2ccccc2c1=O)NS(=O)(=O)c1ccc2c(c1)CCCC2 120926385 ISIPLQOKNLRBKV-HNNXBMFYSA-N 397.500 2.642 0 50 GFAA CCn1ccnc1CN(C(=O)[C@H]1COc2ccccc21)[C@H]1CC12CCNCC2 328642110 QVTRJOJZGQITIH-HKUYNNGSSA-N 380.492 2.550 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(NC(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)c1C 483421704 VFGBHPZTFZXBDJ-GOEBONIOSA-N 379.526 2.797 0 50 GFAA CC[C@@H]1CN(C(=O)c2nn(C)c3c2CCCC3)CCC(=O)N1Cc1ccccc1 71751028 AUTSJWHWRUWJNS-GOSISDBHSA-N 394.519 2.952 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)c3cnn4c3CCCC4)CC2)cs1 127417342 PAKQRABUCSMLTA-UHFFFAOYSA-N 387.553 2.880 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCc2nncn2C)CCCN1Cc1ccc(F)cc1 72142211 USUVDKJATKANHI-LJQANCHMSA-N 387.503 2.646 0 50 GFAA COc1ccc2[nH]c(=O)c(CN3CCN(Cc4ncccc4C)CC3)cc2c1 72151279 PFKRGZBZMYSGEC-UHFFFAOYSA-N 378.476 2.558 0 50 GFAA COc1ccc(OC)c(-c2nc(CN3CCC4(CC3)CNC(=O)O4)c(C)o2)c1 71498502 HTALYOPPEAWSRT-UHFFFAOYSA-N 387.436 2.742 0 50 GFAA O=C(Cc1ccccc1OC(F)F)N[C@H]1CCS(=O)(=O)c2ccccc21 172373748 WACQLWRQUJRMIM-AWEZNQCLSA-N 381.400 2.865 0 50 GFAA OC[C@@H](O)c1cc2n(n1)CCN(Cc1ccccc1OCc1ccccc1)C2 221273739 FQZYGRMMVWGQMI-OAQYLSRUSA-N 379.460 2.504 0 50 GFAA CNc1nnc(CC(=O)N(Cc2ccc(OC)cc2OC)CC2CCC2)s1 283658129 ULDVHGRSVCKQNQ-UHFFFAOYSA-N 390.509 2.968 0 50 GFAA O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCc2sccc2C1 175135516 APQXAWUQQGQWGG-UHFFFAOYSA-N 385.533 2.973 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N[C@@H](C)c2nncn2C2CCCC2)c1 426535640 GKSVPJQLHFJNOE-AWEZNQCLSA-N 384.484 2.955 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3c[nH]nc3-c3ccc(F)cc3)C2)no1 426477606 RZLWMIPIOITCFN-CQSZACIVSA-N 384.415 2.996 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)[C@@H]2CCCN(C(=O)N(C)C)C2)CC1 95517233 GXFVFTNVNGSWGY-GOSISDBHSA-N 389.544 2.783 0 50 GFAA O=C(O)C[C@H](NC(=O)c1cc(N2CCCC2=O)ccc1F)c1cccs1 237997044 MSRKRWXONAVFTD-AWEZNQCLSA-N 376.409 2.960 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)NCCc1nc(C(=O)O)cs1 426594838 LHKXFRCYUYEOPL-UHFFFAOYSA-N 380.495 2.561 0 50 GFAA CCN1CC2(CCN(C(=O)c3cnccn3)CC2)C[C@H](c2ccccc2)C1=O 91893617 HMPGBVDGQJGIHL-GOSISDBHSA-N 378.476 2.735 0 50 GFAA Cc1c(CC(=O)N[C@@H]2CCOC2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 95522130 CNJASXLYNNSOES-QGZVFWFLSA-N 384.451 2.951 0 50 GFAA Cc1[nH]cnc1CN1C[C@@H]2CC[C@H](C1)N(C(=O)Cc1c[nH]c3ccccc13)C2 95362200 CTXRDBPSGMJGGU-FUHWJXTLSA-N 377.492 2.865 0 50 GFAA CNC(=O)[C@@H]1CN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CCO1 184082412 FCRJYWDSDYFPIN-HNNXBMFYSA-N 390.896 2.663 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccs2)cc1C(=O)O 299747197 CITYIHWEEQOJSU-BBRMVZONSA-N 376.434 2.526 0 50 GFAA CSCC[C@H](C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)n1cccc1 263587951 NHOUAUBAADDHED-QGZVFWFLSA-N 393.534 2.961 0 50 GFAA O=C(CCC(=O)N1CCC(Oc2cccc(Cl)c2)CC1)Nc1nncs1 828084674 BCOIEHODRINZOB-UHFFFAOYSA-N 394.884 2.980 0 50 GFAA Cc1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccncc3)C2)ccc1N1CCCC1=O 952987756 LFMBBQINCYELBP-KRWDZBQOSA-N 392.459 2.504 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2ccc(-c3ccccc3F)o2)C1 275558512 FOLHBXZLNZQWBA-AWEZNQCLSA-N 395.438 2.804 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2ccc3ccc(Cl)cc3n2)C1 275755078 RFLTUKDGVHZXJG-HNNXBMFYSA-N 396.882 2.607 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(-c4csc(C)n4)cc3)C(=O)[C@@H]2C1 278177765 VEWSIUZLBNCCIN-CJNGLKHVSA-N 385.445 2.839 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)NC3CCN(CC(F)(F)F)CC3)cn2)n1 195144029 KZLUKYMYIDMALA-UHFFFAOYSA-N 381.402 2.641 0 50 GFAA COc1ccc(-n2ccnc2CN2CC[C@H](N3CCCCCC3)[C@@H](O)C2)cc1 1615633406 IOHPCRFFQRSYKU-SFTDATJTSA-N 384.524 2.692 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1C[C@H](Cc2ccnc3ccccc23)[C@@H](O)C1 1616076420 NOHWCVIWGZIBEN-AVRDEDQJSA-N 392.503 2.580 0 50 GFAA Cc1nn(C(C)C)c(C)c1-c1nc([C@@H]2CCCN(C)C2)nn1-c1cnn(C)c1 1772819218 QQALIYBHXJINTD-MRXNPFEDSA-N 382.516 2.871 0 50 GFAA CC1=C(CN2C[C@H]3CN(c4cc(C)nc(N)n4)C[C@]3(CO)C2)C(C)(C)CCC1 1772810258 FKAVZCJLALYXRT-JTSKRJEESA-N 385.556 2.624 0 50 GFAA COc1ccc(CC(=O)N2CC[C@H]3[C@H](CCCN3C(=O)c3ccco3)C2)cc1 11872181 ZJRPYQUMVDYXEE-MJGOQNOKSA-N 382.460 2.984 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N2CCCC[C@@H]2CCO)o1 11873479 KOWYROUBWSDHNV-QGZVFWFLSA-N 387.480 2.560 0 50 GFAA O=C(CCC1CCN(Cc2nc(-c3ccccc3)no2)CC1)N1CCOCC1 12074240 LEJXHZJFYZIJDS-UHFFFAOYSA-N 384.480 2.588 0 50 GFAA O=C1CCCN1CCC(=O)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1 12112262 WCUPFYRSUUOBDA-QFIPXVFZSA-N 387.499 2.653 0 50 GFAA Cc1c(C(=O)NCCOC(C)C)sc2ncnc(NC[C@@H]3CCCO3)c12 12278401 KIAMMKBWNZUWDW-ZDUSSCGKSA-N 378.498 2.745 0 50 GFAA CN(C[C@H](O)COc1ccccc1CNC1CCOCC1)C1CCCCC1 12301245 FQKBDVIBYLFVPS-NRFANRHFSA-N 376.541 2.959 0 50 GFAA COC(=O)CCCNC(=O)c1cc(COc2ccc3sc(C)nc3c2)on1 12373314 VXQXOCXFQQFZQZ-UHFFFAOYSA-N 389.433 2.855 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@@H]1c1cccc(Cl)c1 13590343 QRUWDFCYKJYGTR-JEWRLFTDSA-N 382.840 2.506 0 50 GFAA CCN1CCC(N2CC(=O)N(Cc3ccccc3)C[C@@H](OCC3CC3)C2)CC1 14536784 KEQNJQMHFXYEGN-QFIPXVFZSA-N 385.552 2.610 0 50 GFAA CCCn1ncc(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccc(F)cc2)c1C 19790947 BBRWLWYPWXJVGW-VQTJNVASSA-N 386.471 2.988 0 50 GFAA CCOc1ccccc1C(=O)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772234 TYTYTMQPYGFTPZ-UHFFFAOYSA-N 380.370 2.857 0 50 GFAA COc1ccc(F)c(CN2CC[C@@]3(C2)Cn2c(nnc2-c2cccnc2)CO3)c1 1857684534 RTAKARUJDILUEA-OAQYLSRUSA-N 395.438 2.663 0 50 GFAA O=C(NCC1CC1)c1cc2c(s1)CCOC21CCN(Cc2cc[nH]n2)CC1 1857693067 GVHRELCVIYIDTG-UHFFFAOYSA-N 386.521 2.675 0 50 GFAA CC(=O)N1CCC2(CC1)OCCc1cc(C(=O)N[C@@H](C)C(F)(F)F)sc12 1857694321 KXYJKRRSYFXQRV-JTQLQIEISA-N 390.427 2.839 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3CCOCC3)C[C@]23CC[C@H]1O3)C1CCCCCC1 1857721545 UYWGMBRQSPGHDL-GPQLQYNLSA-N 376.541 2.731 0 50 GFAA COc1ccccc1C1CCN(C(=O)[C@@H]2CC(=O)N(c3nccs3)C2)CC1 1857725278 ZLQJZUQODLJWMS-OAHLLOKOSA-N 385.489 2.911 0 50 GFAA O=C(COc1ccccc1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857734301 HXUYXAZUYKATOA-QFIPXVFZSA-N 379.460 2.945 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(CCCOc3ccc(F)cc3)C[C@]23CC[C@H]1O3 1857736650 VCUKGISWQPVCRY-QEUVDIPISA-N 376.472 2.600 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2ccc(N3CC(=O)NC3=O)cc2)C[C@H](C2CC2)O1 1875250029 SALFSUBCRBENGM-QZTJIDSGSA-N 385.464 2.553 0 50 GFAA Cc1c2c(cc(=O)n1Cc1ccccc1)N/[N+](=c1/[nH]c3ccccc3s1)C2=O 213025652 HGYSMOSMQOQULD-UHFFFAOYSA-O 389.460 2.701 0 50 GFAA COc1ccc([C@@H]2CCCN2C(=O)NCC2CCN(C(C)=O)CC2)cc1OC 264424955 OWINWSZMUCWGDV-SFHVURJKSA-N 389.496 2.809 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3ccc4c(c3)OCCO4)CC2)oc1C 264787488 TUTNRXCVFHQYRH-UHFFFAOYSA-N 385.464 2.705 0 50 GFAA O=C(Nc1n[nH]cc1S(=O)(=O)c1ccc(Cl)cc1)[C@H]1C[C@@H]1C(F)F 906063529 UCFGNLYMBKXISO-UWVGGRQHSA-N 375.784 2.736 0 50 GFAA Cc1cnc2n1CC[C@H](NC(=O)N(C)[C@@H](c1ccc(F)cc1)c1ncccn1)C2 1875329463 XBGMHFHOIBLUDK-HKUYNNGSSA-N 394.454 2.866 0 50 GFAA Cc1cc(CCNC(=O)N2CCOc3cccc(Br)c3C2)on1 888093944 MXIABYODCFJPSB-UHFFFAOYSA-N 380.242 2.892 0 50 GFAA COc1ccc([C@H]2C[C@@H](C)N(C(=O)Cn3cnc4ccc(F)cc4c3=O)C2)cc1 2325734431 RFKHBTNHOVORHF-ZBFHGGJFSA-N 395.434 2.949 0 50 GFAA CN(C[C@@H]1CC12CCN(c1ccc3nnc(-c4ccccn4)n3n1)CC2)C1CC1 2325764524 XYYVZISLCMYPLR-INIZCTEOSA-N 389.507 2.887 0 50 GFAA CCc1ccc(N2CCN(S(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1 807548 JQCMSJPNLWRHLU-UHFFFAOYSA-N 390.505 2.777 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)Nc1ccccc1SC 1079678 WOISVJKOMFMYDH-UHFFFAOYSA-N 394.518 2.985 0 50 GFAA COc1ccc2c(C)c(C(=O)N3C[C@H]4[C@@H](CN(C)C)[C@@H]5CC[C@@]4(C3)O5)oc2c1 2356170917 UHZYZHJXUUFCDB-MSQSPTIYSA-N 384.476 2.931 0 50 GFAA O=C(Nc1nccs1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 3549626 CCLDHFRWGIBKDR-UHFFFAOYSA-N 385.898 2.836 0 50 GFAA CCOc1cc(-c2noc(CCCC(=O)NC[C@@H]3CCCO3)n2)ccc1OC 4868162 DKZYBZBRSFHANI-HNNXBMFYSA-N 389.452 2.762 0 50 GFAA C[C@@H](NC(=O)OCc1ccccc1)C(=O)NC1CC(C)(C)N(O)C(C)(C)C1 6201759 UKPRRKDPBNNIMT-CQSZACIVSA-N 377.485 2.828 0 50 GFAA CSc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 6731492 ZPLXIQWOILNTCY-UHFFFAOYSA-N 392.502 2.682 0 50 GFAA COc1cc(NC(=O)CN2CCN(c3ccccn3)CC2)c(OC)cc1Cl 6741449 ODHVFNSWGKQKED-UHFFFAOYSA-N 390.871 2.513 0 50 GFAA O=C(C1=CCCC1)N1CCC[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 20600962 RGTNSUSSUQCWMH-HXUWFJFHSA-N 397.519 2.634 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NC[C@@](C)(O)c1ccccc1 114546599 BUGHHVZGBHMNDN-WMZHIEFXSA-N 396.487 2.714 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N[C@@H]3c4ccccc4C[C@H]3O)cc2)C[C@@H](C)O1 246151413 HKFZYLMENPVBJR-AHWCRGGASA-N 380.488 2.684 0 50 GFAA Cc1nnsc1CNC(=O)c1coc(COc2cccc3cccnc23)n1 67641494 XZEYTLVNLIGVTA-UHFFFAOYSA-N 381.417 2.892 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CC(=O)N(c3ccccc3)C2)cc1Cl 62091931 WSAVXSPOHZEIER-ZDUSSCGKSA-N 394.880 2.680 0 50 GFAA Cc1ccccc1-n1nc(-c2ccccc2)nc1[C@H]1CCCN(CC(N)=O)C1 63882190 GVKMJNXCPJPHPD-SFHVURJKSA-N 375.476 2.907 0 50 GFAA O=S(=O)(N[C@@H]1CCN(c2ncccc2Cl)C1)c1cnc2ccccc2c1 252483237 DXWGKFPYNVKSEQ-CQSZACIVSA-N 388.880 2.840 0 50 GFAA Cn1cc(CN2CCNC(=O)[C@H]2CCO)c(-c2ccc(C3CCCCC3)cc2)n1 72475655 WUIBAEPEKVREIR-OAQYLSRUSA-N 396.535 2.818 0 50 GFAA C[C@H](Cc1ccc(O)cc1)N(C)C(=O)c1cccc(N2CCCS2(=O)=O)c1 120066029 KSVYBFUJKWJTQO-OAHLLOKOSA-N 388.489 2.635 0 50 GFAA Cc1cc(=O)n(CC(=O)N2CCCC[C@H]2c2nc3cc(F)ccc3[nH]2)nc1C 218955577 QMHIBYWGXHBBGI-KRWDZBQOSA-N 383.427 2.629 0 50 GFAA CC(C)=CCO[C@@H]1COCC[C@H]1NC(=O)C1CCN(Cc2ccco2)CC1 219945300 KFDUGFMIEQDZON-WOJBJXKFSA-N 376.497 2.748 0 50 GFAA CN1C(=O)[C@](CC(=O)NCc2ccncn2)(Cc2ccccc2)c2ccccc21 71754067 AXDDGWOBRMDEIU-QHCPKHFHSA-N 386.455 2.640 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)C1 363210295 GUFKVQCFDDJPBW-SJLPKXTDSA-N 399.495 2.719 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)Nc1cnn(C[C@@H]2CCCO2)c1 363739779 POFXJKBPVILKRJ-HNNXBMFYSA-N 396.455 2.941 0 50 GFAA CC(=O)N1Cc2ccc(NS(=O)(=O)c3ccc(C(=O)O)cc3Cl)cc2C1 363730170 WPASZBJVAGPRIP-UHFFFAOYSA-N 394.836 2.701 0 50 GFAA CC(=O)N[C@@H](CC(C)C)C(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1 378631196 INBVSRYBNTWUEA-SFHVURJKSA-N 384.480 2.993 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC(c2nc(C)no2)CC1)c1ccc(F)cc1F 172791411 BJFWAEWRIHVQDM-QGZVFWFLSA-N 392.406 2.630 0 50 GFAA CN(Cc1ccccc1NC(=O)N1CC[C@H]2[C@@H](C1)NC(=O)N2C)c1ccccc1 284598992 AFIVMGVQQGAECX-UXHICEINSA-N 393.491 2.953 0 50 GFAA COc1ccc(NC(=O)CC[C@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)c(C)c1 95506376 RXJAOIKYVSJDCL-MRXNPFEDSA-N 384.480 2.927 0 50 GFAA Cc1nc(CCNC(=O)[C@@H]2CC(=O)Nc3ccc(F)cc32)nc2c1CCCC2 91504560 KZPJNWFFLHAQJU-MRXNPFEDSA-N 382.439 2.588 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(C(=O)CCS(=O)(=O)c2ccc(C)cc2)C1 95506901 IDEKFKJLSQEPHG-QGZVFWFLSA-N 389.521 2.781 0 50 GFAA CC(C)S(=O)(=O)N1CCC(Oc2ccc(C(=O)N3CCCC3)cc2)CC1 95513074 GGVYGXYQHMJXSX-UHFFFAOYSA-N 380.510 2.504 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@H](O)c3cccc(Cl)c3)CC2)CC1=O 91624907 CEUBCHUTRLJMIR-GOSISDBHSA-N 378.900 2.871 0 50 GFAA COc1cccc2c1O[C@@]1(C)[C@H](C(=O)N(C)C)[C@H]2NC(=S)N1c1ccccc1 242495106 FUUSMPUTMAGTMS-FIKGOQFSSA-N 397.500 2.944 0 50 GFAA C[C@H](NC(=O)N1CCOCC2(CCOCC2)C1)c1ccc(-n2cccn2)cc1 181878131 SDEQRPXARFIZQW-KRWDZBQOSA-N 384.480 2.772 0 50 GFAA Nc1nc(CCC(=O)N[C@H](c2cnc3ccccc3c2)[C@H]2C[C@@H](O)C2)cs1 252532853 FIKIINQCSWYJSE-CRFBAAHOSA-N 382.489 2.835 0 50 GFAA CCCc1nc(C(=O)Nc2ncccc2NC(C)=O)nn1-c1ccccc1F 182858762 CFDJHZXUEALCQO-UHFFFAOYSA-N 382.399 2.965 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 257199299 YPVITGAHYZKTAX-PWRODBHTSA-N 383.536 2.758 0 50 GFAA biogenic CC[C@@H](NC(=O)c1cccc(-c2cnn(CC(=O)NC)c2)c1)c1nccs1 534593129 HZVRRRMYTIQMRK-MRXNPFEDSA-N 383.477 2.634 0 50 GFAA COc1ccc(-c2nn3ccn(Cc4ccc(F)c(F)c4)c(=O)c3c2CO)cc1 263619458 YSYNMWDAXKERCF-UHFFFAOYSA-N 397.381 2.990 0 50 GFAA COCCN1CCC[C@@]2(CCN(Cc3cc(OC)c(OC)c(OC)c3)C2)C1 55061193 XRBOMLVWCZASAU-OAQYLSRUSA-N 378.513 2.647 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)CN1CCN(c3ccccc3F)CC1)OCO2 55087885 VCRMWVMTMVWSGM-UHFFFAOYSA-N 399.422 2.518 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)NCc2nc(C3CC3)no2)cc1Cl 729854076 URWYPAXXYUCTHI-UHFFFAOYSA-N 378.237 2.741 0 50 GFAA CCn1c(C)cc(C)c(C(=O)Nc2cc(C)ccc2NC(=O)CN(C)C)c1=O 823580544 RDYOJQQVJPZOMQ-UHFFFAOYSA-N 384.480 2.546 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)NCCN=c2cc[nH]cc2C)n1 827816084 YXTPVEDHDJWAOX-UHFFFAOYSA-N 379.464 2.721 0 50 GFAA COC[C@H]1[C@@H](NS(=O)(=O)c2cccc3cccc(Cl)c23)[C@H]2CCO[C@H]21 1074572972 SVAUFKHWHKRLBM-XLQHLMKVSA-N 381.881 2.821 0 50 GFAA CCC1=NO[C@H](Cn2cnc3sc(C(=O)N(CC)CC)c(C)c3c2=O)C1 670452321 KWYIWHORJJSWTC-ZDUSSCGKSA-N 376.482 2.803 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)Nc2c(-c3cnn(C)c3)nc3ccccn23)C1 268127445 KFWQOTSQDHHOJR-INIZCTEOSA-N 381.484 2.683 0 50 GFAA O=C(Cc1ccc(F)cc1F)N1C[C@@H]2CN(C3CCCCC3)C[C@]2(C(=O)O)C1 1565515144 LIYOVCUNUYSWPO-BTYIYWSLSA-N 392.446 2.685 0 50 GFAA CN1C(=O)N[C@]2(CCN(C(=O)Nc3cc(F)ccc3Oc3ccccc3)C2)C1=O 269615931 QLQZKPQIOJNCRP-FQEVSTJZSA-N 398.394 2.776 0 50 GFAA CCC[C@]1(COC)CCCN1C(=O)c1cnn(CC(=O)NC2CCCCC2)c1 192748761 KEKIRTOGOLSQTK-OAQYLSRUSA-N 390.528 2.753 0 50 GFAA O=C(C[C@@H](c1ccccc1)N1CCOC1=O)N=c1cc[nH]cc1Br 765182643 NQDJMOLPFCKXGE-HNNXBMFYSA-N 390.237 2.788 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1CN1CCN(CCO)[C@@H](C)C1 779215808 ZNFAMJXVVSQGFQ-ZDUSSCGKSA-N 383.323 2.986 0 50 GFAA CCc1c(C)nn(C)c1NC(=O)CCC(=O)c1cc(OC)c(OC)cc1OC 1529191721 DCRKZKVNXAPIFN-UHFFFAOYSA-N 389.452 2.918 0 50 GFAA Cc1ccc(C(=O)N2CCCN(Cc3c(F)cccc3Cl)CC2)c(=O)n1C 1529167396 IDVMKUPFFGASRR-UHFFFAOYSA-N 391.874 2.834 0 50 GFAA CCN(CC)CC1(NC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)CC1 1704309972 UPPIAZMHFGNYQQ-UHFFFAOYSA-N 398.507 2.782 0 50 GFAA Cc1ccc(CNC(=O)CC[C@H]2CCCN(S(=O)(=O)CC(F)(F)F)C2)o1 11816387 QYLMYTFXUHKVHO-CYBMUJFWSA-N 396.431 2.589 0 50 GFAA COc1ccc(-n2c(CNC(=O)c3csc(C)n3)nnc2SC)cc1 11996263 RROGOEUSYANSEA-UHFFFAOYSA-N 375.479 2.693 0 50 GFAA O=C1CC[C@@H](C(=O)N2CCC(Cn3cccn3)CC2)CN1CC1CCCCC1 12429778 IDLIOPMVUYUDHM-HXUWFJFHSA-N 386.540 2.941 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@@H](CNC(=O)c3ccco3)C2)c(C)s1 12437697 UNBFMQQSBCGCFQ-AWEZNQCLSA-N 382.507 2.789 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)CCc2cnn(C)c2)CC1 12459511 PNUQGKOZAHZNSZ-UHFFFAOYSA-N 398.551 2.774 0 50 GFAA COc1cc(NC(=O)CCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c(OC)cc1Cl 13688910 DDSKZNRHZAQHLF-VXGBXAGGSA-N 392.839 2.637 0 50 GFAA O=C(Nc1nncs1)[C@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 13944776 QUFHMDVRGVEQPY-NSHDSACASA-N 389.868 2.703 0 50 GFAA COC(=O)c1ccc(CNc2nncc(-c3c(OC)cccc3OC)n2)cc1 14981659 IUWZCEPZJUDOGM-UHFFFAOYSA-N 380.404 2.955 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3C)cc2CN(C)C[C@H](O)CO)cc1F 14961644 UCRHJBXKMUFLGP-SFHVURJKSA-N 399.466 2.780 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@]2(CCCN(CCc3ccccc3)C2=O)C1 15063270 SBKXNUYROXIHSW-HSZRJFAPSA-N 377.488 2.708 0 50 GFAA Cc1ccccc1CC(=O)NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12 169776302 RCHVCMKTGVCYDW-UHFFFAOYSA-N 388.431 2.824 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1nc(C2CC2)n2ccccc12 1857527437 JQYFULJDTBHYCA-YOEHRIQHSA-N 392.463 2.659 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857671440 RYSLIDGQWYVNNZ-UHFFFAOYSA-N 376.460 2.991 0 50 GFAA CCCc1nnc(N2C[C@H](C(=O)NCc3ccc(Cl)cc3)CC2=O)s1 1857697230 LCUIQALZDGKAKH-GFCCVEGCSA-N 378.885 2.813 0 50 GFAA N[C@H](Cc1ccccc1)c1nc(CC2CC2)nn1CC(=O)NC1CCCCC1 1857704977 NDFXFKQYCWMLMO-LJQANCHMSA-N 381.524 2.922 0 50 GFAA NCC1CCN(C(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CC1 1857730361 NVMHOJAAEZBXPP-CQSZACIVSA-N 376.888 2.895 0 50 GFAA O=C(Nc1ccn(CCc2ccncc2)n1)[C@@H]1CCO[C@H](c2ccccc2)O1 847413880 CNUVLJWKRXVFIN-RXVVDRJESA-N 378.432 2.964 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H]2CN(c3ccccc3)C[C@H]2C1 1875266959 IXAPQWBPEILXII-IRFCIJBXSA-N 393.487 2.549 0 50 GFAA C[C@]1(F)CCCCN(C(=O)N[C@H](C(=O)N2CCOCC2)c2ccccc2)C1 1875265854 PSGOHWAZLQFIBU-PXNSSMCTSA-N 377.460 2.510 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)[C@H]2C(=O)NC[C@H]12 1875304144 BJWLSWNRJIDYTI-HFBAOOFYSA-N 388.468 2.861 0 50 GFAA CN(C)C[C@H]1C[C@@H](O)CN1c1cc(N2CCC(=Cc3ccccc3)CC2)ncn1 1875398239 IHXQSDQZADGLAR-NHCUHLMSSA-N 393.535 2.662 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc1OC1CCCC1 1875400452 AKRIGRCZHOPJNN-ATZDWAIDSA-N 399.491 2.783 0 50 GFAA Cc1nc(C(=O)N2CC(Cc3ccccc3)C2)nc(N2CC[C@@H](N(C)C)C2)c1C 1875403752 ALHKQCMIVKKDJW-HXUWFJFHSA-N 393.535 2.548 0 50 GFAA CN(Cc1nn(C)cc1Br)C(=O)[C@@H]1[C@@H](c2ccncc2)C1(C)C 1875404784 UUVGLAVMRBOITN-CABCVRRESA-N 377.286 2.976 0 50 GFAA NCc1cccc(-c2cccc(C(=O)N3CCC[C@H](Cn4ccnn4)C3)c2)c1 2325778685 JXTGKNSDQWNINC-SFHVURJKSA-N 375.476 2.956 0 50 GFAA Brc1cnc(CN2CCN(c3ccc(-n4ccnc4)cc3)CC2)cn1 2325892937 URHBJZOMYRPNGT-UHFFFAOYSA-N 399.296 2.747 0 50 GFAA COc1ccc(NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)c(OC)c1 972677 ICFGVIOMZPWBFB-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CCc1nnc(SCC(=O)Nc2ccccc2I)o1 6359401 VVZQHALWWHLISE-UHFFFAOYSA-N 389.218 2.967 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@H]2CC(=O)N(c3ccccc3C)C2)CC1 7450929 KKNNPYLQNUFCDM-SFHVURJKSA-N 393.487 2.705 0 50 GFAA COc1cc(CN2CCN(Cc3ccccc3C)[C@H](CCO)C2)cc2c1OCO2 104555298 NQFVLZGHMFHKNR-HXUWFJFHSA-N 398.503 2.801 0 50 GFAA CCOC(=O)CN(C)c1ccc(-c2nc(Cc3ccc(OC)cc3)no2)cn1 20534150 DVRDMDZEMPFREX-UHFFFAOYSA-N 382.420 2.730 0 50 GFAA Cn1ccc(C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)n1 67885431 PBKORASPBNOQAE-UHFFFAOYSA-N 376.395 2.941 0 50 GFAA CN1CCCn2nc(C(=O)N3CCC[C@@H]3c3nc(-c4ccccc4)no3)cc2C1 65526812 JHOMXSCUIFQHPU-GOSISDBHSA-N 392.463 2.746 0 50 GFAA CCNC(=O)c1c(NC(=O)CSc2ncccn2)sc2c1CCCC2 65382249 FMFDUUPEMOCJJC-UHFFFAOYSA-N 376.507 2.897 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 67603466 GVLNCDRTQIJYPW-QUCCMNQESA-N 386.517 2.872 0 50 GFAA CN(C)C[C@@]1(O)CCCN(S(=O)(=O)c2ccc(-c3ccccc3)cc2)CC1 72161901 NAIXTNDEMJVVIO-OAQYLSRUSA-N 388.533 2.821 0 50 GFAA CC(=O)Nc1ccccc1NC(=O)CN[C@@H](C)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 216293157 IGFMYNLJZJHLMB-KRJAUBJISA-N 385.508 2.893 0 50 GFAA O=C(c1ccc2n[nH]cc2c1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328627372 MSXKDHLAGUZPBW-QGZVFWFLSA-N 377.448 2.852 0 50 GFAA CN1CCC(N(C)c2ccccc2CNc2ccc3[nH]nc(C(N)=O)c3c2)CC1 125348295 AEXWXSSNUMOQPB-UHFFFAOYSA-N 392.507 2.804 0 50 GFAA C[C@H]1Oc2c(cccc2C(=O)NC2CCN(Cc3ccccc3)CC2)NC1=O 363571584 PZFYSYZHOHYPCD-OAHLLOKOSA-N 379.460 2.800 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)[C@H]3COCCO3)cc2C(F)(F)F)C[C@@H](C)O1 242302390 YSEZLZFSBGFKMJ-BFQNTYOBSA-N 388.386 2.673 0 50 GFAA Cn1ccnc1[C@@H](O)c1cc2n(n1)CCN(Cc1ccc(F)c(Cl)c1)C2 219586931 QKBPGAHIPNFGEQ-KRWDZBQOSA-N 375.835 2.507 0 50 GFAA O=S(=O)(C[C@@H]1CCCO1)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 172368277 LAKHGLQAUCWJPN-NSHDSACASA-N 377.344 2.676 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4cccc(F)c4C)CC3)nn2)n1 72446813 AMRLTJUGMFFZRQ-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)/C=C/c1ccccc1Cl 129391839 VCOHPXVVXSQRDB-QSYFUGGGSA-N 382.873 2.503 0 50 GFAA CN1CCN(C(=O)Nc2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O)CC1 20387166 AVYNWKRLTHDQBK-UHFFFAOYSA-N 395.290 2.983 0 50 GFAA CC(=O)c1cccc(NC(=O)CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)c1 174602906 HWYDNELTIVFGAK-SFHVURJKSA-N 394.475 2.882 0 50 GFAA COc1ncccc1C(=O)N1CCC(Cn2cc(-c3ccccc3)nn2)CC1 48501678 VHMNBFXCPAHJDC-UHFFFAOYSA-N 377.448 2.901 0 50 GFAA COc1ccc(-c2noc(CN3C(=O)COc4ccc(F)cc43)n2)cc1OC 220960255 CEVAKGMTHQKKGD-UHFFFAOYSA-N 385.351 2.819 0 50 GFAA COc1ccccc1CN1CCCn2nc(CCC(=O)N3CCCC3)cc2C1 91645005 KGJTZYOWFJDSCI-UHFFFAOYSA-N 382.508 2.853 0 50 GFAA C[C@@H](CC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)n1ccnc1 91621283 JXWNEEUPKGDVEX-SFHVURJKSA-N 395.507 2.661 0 50 GFAA CN1C[C@H](NC(=O)CCc2ccc(-c3ccc(Cl)cc3)[nH]2)C[C@H]1C(=O)O 426428934 KQEURKUJETYUJY-WBVHZDCISA-N 375.856 2.541 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cc1 91321775 FNKSQRSQOBKMNY-JOCHJYFZSA-N 380.492 2.806 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)NCc2ccno2)CC1 95509810 PWANSOJWKVTBDG-UHFFFAOYSA-N 377.828 2.648 0 50 GFAA O=C(Cc1c(F)cccc1Cl)N1CCN(Cc2ccccc2)C[C@H](O)C1 95520089 HTMXHKKQHCSWOM-INIZCTEOSA-N 376.859 2.727 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)c(C)n1 91950931 MSIFGUVIMZGCMF-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA CCc1nc(C)sc1CNC(=O)Nc1cc(NS(C)(=O)=O)ccc1F 97243725 KWZVTWMANSNRSX-UHFFFAOYSA-N 386.474 2.846 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccc(O)cn3)C2)CN1CCc1ccccc1 95512343 URUPXMCVNQBIJS-QHCPKHFHSA-N 393.487 2.875 0 50 GFAA CCCc1nnsc1C(=O)N1CCC[C@@H](CNC(=O)c2cccs2)C1 95508388 GGZDHQWMDFIPIH-LBPRGKRZSA-N 378.523 2.834 0 50 GFAA O=C(NCC1(CO)CCOCC1)Nc1ccc(C(=O)OC2CCCC2)cc1 96137747 UEGVBWDEZKEPHN-UHFFFAOYSA-N 376.453 2.697 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccc(OC(F)F)cc2)[C@H]2C[C@@H](O)C2)cn1 244691785 JJIXGSYUQLIWBN-VBQJREDUSA-N 378.375 2.934 0 50 GFAA CC(C)[C@@H](NC(=O)N(C)Cc1cnn(-c2ccc(F)cc2)c1)c1ncnn1C 534657525 UVVQLOJBBXEEFX-QGZVFWFLSA-N 385.447 2.679 0 50 GFAA CCc1cc(-c2cccc(C(=O)NCc3nc(CCOC)no3)c2)nc(C)n1 299800570 UEBCLHBPGJVQGO-UHFFFAOYSA-N 381.436 2.516 0 50 GFAA CCn1cc(-c2cccc(C(=O)NC3CCN(C[C@@H]4CCCO4)CC3)c2)cn1 299802210 YCVNKGONBHIHKH-NRFANRHFSA-N 382.508 2.943 0 50 GFAA Cc1cc(CN2CCC3(CC2)CN(c2cnc4ccccc4n2)CCO3)on1 825296992 CSLDXNGHSYFLCG-UHFFFAOYSA-N 379.464 2.798 0 50 GFAA Cn1ccnc1CN(CCO)C(=O)c1cccc(-c2ccc3c(c2)OCC3)c1 584888501 PAGGTLQJTNTZNU-UHFFFAOYSA-N 377.444 2.657 0 50 GFAA CC(C)c1noc([C@@H](C)NS(=O)(=O)c2ccc3c(c2)NC(=O)CCS3)n1 670439128 SQEIELPHTJMJSZ-SNVBAGLBSA-N 396.494 2.667 0 50 GFAA Cc1cc2nc(O)[nH]c2c(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)c1C 952971586 TYAPAXSKGDNHOI-UHFFFAOYSA-N 394.431 2.610 0 50 GFAA CC(=O)Nc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(C)C3)C2)c(Cl)c1 952984155 LPRDYHANMUDHFQ-IBGZPJMESA-N 377.872 2.773 0 50 GFAA Cc1nc(C)n(CCCNC(=O)[C@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)n1 952860055 AZCPQIRZOKLBTK-SFHVURJKSA-N 383.496 2.578 0 50 GFAA Cc1cc(NCc2nc(-c3ccccc3Cl)no2)nc(N2CCOCC2)n1 952873183 WQVBBCWZRGGKAZ-UHFFFAOYSA-N 386.843 2.937 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)N[C@H]1CCc2[nH]ncc2C1 167439541 KAWOHHXXYJJOTI-INIZCTEOSA-N 394.406 2.953 0 50 GFAA CN(CC(F)(F)F)C(=O)CN1[C@H](C(=O)OC(C)(C)C)C[C@@H]2CCCC[C@@H]21 170599735 RQQUCQUINQLJHJ-IHRRRGAJSA-N 378.435 2.982 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCN(CC(F)(F)F)CC1 1506416763 FILWIIJZEGOWJZ-UHFFFAOYSA-N 377.794 2.684 0 50 GFAA CN1CC[C@]2(C(=O)NCc3ccccn3)CCCN(C(=O)CC3CCCC3)[C@H]2C1 1772809372 VHJWOUJRQXWPBJ-NZQKXSOJSA-N 398.551 2.591 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)N2CCCC[C@H]2c2cccc(OC)c2)nn1 11772163 KBVVBQOTRGQFEP-IBGZPJMESA-N 399.495 2.523 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4cc(C)n(C)n4)C3)C2)c1 11839638 KQZCRFFOXNXROP-QFIPXVFZSA-N 382.508 2.865 0 50 GFAA Cc1nc([C@@H](C)NC(=O)Cn2cc(NC(=O)COc3ccccc3)cn2)cs1 12040854 PICSMTKRSIGOPE-CYBMUJFWSA-N 399.476 2.543 0 50 GFAA O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1 16294363 QADZZZIOWJHBAT-KGLIPLIRSA-N 394.855 2.642 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc4nsnc4c3)C[C@@H]2CCO)c1 19757205 HQIHRGCOJNMVAW-SFHVURJKSA-N 398.532 2.769 0 50 GFAA COc1cc(C(=S)N2CCN(CCO)CC2)ccc1OCc1ccccc1 19842610 UDFNHJBZZBJPKI-UHFFFAOYSA-N 386.517 2.560 0 50 GFAA O=C(c1ccccc1)N1CCC(C(=O)N2CCN(Cc3ccccc3)CC2)CC1 19850034 OYGWIGWOOIBTQH-UHFFFAOYSA-N 391.515 2.883 0 50 GFAA Cc1cc(OCC(=O)N[C@H](c2nc(-c3nnc[nH]3)no2)C(C)C)ccc1Cl 154329610 KRYYMNNTZADBBO-AWEZNQCLSA-N 390.831 2.709 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1F 1857732983 PNEBJRNQOFFFDQ-KPLVRAHFSA-N 396.418 2.749 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccc3ccccc3c2)[C@H]1c1cnn(C)c1 1857740640 RVOWYIRNXXZDCX-SFTDATJTSA-N 378.476 2.717 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1cccc3c1OCO3)CC2 125913701 DJCBDYLDXMCZAO-NSHDSACASA-N 393.365 2.954 0 50 GFAA O=C(Cc1cc(C(F)(F)F)ccn1)N[C@H]1C[C@H](S(=O)(=O)c2ccccc2)C1 871400816 YUVQAULAJRYORP-KOMQPUFPSA-N 398.406 2.764 0 50 GFAA Cc1csc(N2CCC[C@@H](C(=O)N3C[C@H]4C[C@H]3C[C@@]4(O)C(F)(F)F)C2)n1 1875392124 BXKSSDCHWDZOOW-FOCJUVANSA-N 389.443 2.582 0 50 GFAA O=C(Cc1ccc(Cl)c2cccnc12)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875402965 NSQUJEMTVRCHGH-MORSLUCNSA-N 384.867 2.583 0 50 GFAA CCO[C@H]1CCN(C(=S)Nc2cc(S(=O)(=O)N(CC)CC)ccc2C)C1 899592002 TVSRBFBMDOEXBE-HNNXBMFYSA-N 399.582 2.833 0 50 GFAA Cc1nc(N[C@@H]2C[C@H](Cn3cc(Cl)cn3)C[C@H]2O)cc(=O)n1-c1ccccc1 2325785516 BXVMJINKKFOMJS-BMGDILEWSA-N 399.882 2.642 0 50 GFAA C[C@H](c1ccccc1)N1C[C@H](C(=O)N2CCOC[C@@H]2CC(F)(F)F)CC1=O 2325819564 JHFPMCBUZCEMKR-BMFZPTHFSA-N 384.398 2.776 0 50 GFAA CCc1cc(C)c(C(=O)N[C@@H]2CC3(CN(C(=O)[C@H]4CC4(C)C)C3)n3ccnc32)o1 2332237735 JOZVYJZXQRDKJX-HZPDHXFCSA-N 396.491 2.805 0 50 GFAA Cc1c(CN2CCSCC2)cccc1NC(=O)c1ccc2[nH]c(=O)n(C)c2c1 119824406 NRWMJTMTHJQGTI-UHFFFAOYSA-N 396.516 2.976 0 50 GFAA COC(=O)c1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccc2)cc1 1018650 IYWFOEKDBIBINB-KRWDZBQOSA-N 381.457 2.905 0 50 GFAA Cc1ccccc1Oc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccccc1 1133310 FKBGASRJBGIBBR-UHFFFAOYSA-N 376.416 2.583 0 50 GFAA biogenic COc1ccc(CNC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)cc1 1171545 GHBPNUHSSQGSCM-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA Cn1cccc(CN2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)c1=O 2356153128 SSKBJYRGCCVCFI-HSZRJFAPSA-N 379.504 2.585 0 50 GFAA Cc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N2CCC[C@H]2C(=O)O)cc1 2830210 BJRKXELMVXGPIO-BSKAQADGSA-N 378.428 2.842 0 50 GFAA COc1ccccc1CN(C(=O)[C@@H](Cc1ccccc1)n1cnnn1)C1CC1 55386488 FSVQFYFUGNKXAX-LJQANCHMSA-N 377.448 2.657 0 50 GFAA COc1cccc(-n2nnc(C(=O)Nc3ccc4oc(=O)ccc4c3)c2C)c1 9970579 LQUOAOBODBGPIK-UHFFFAOYSA-N 376.372 2.943 0 50 GFAA COc1ccccc1NC(=O)N1CCN(c2cc(N3CCCC3)nc(C)n2)CC1 21795106 ZCLAIKOUSKZHRQ-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA C[C@H](CN1CCCC1)C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67934476 ODFVABDVZUIFDL-CQSZACIVSA-N 383.448 2.687 0 50 GFAA COc1ccc(-c2ncc(CN3CCN(C4CCCC4)[C@H](CCO)C3)cn2)cc1 39387766 FZCUAIFMUVDLOT-OAQYLSRUSA-N 396.535 2.963 0 50 GFAA Cn1ccnc1C[C@H]1CCCN(C(=O)c2cc(N3CCCC3=O)ccc2F)C1 119333833 OACXGGHGEXUIKT-OAHLLOKOSA-N 384.455 2.781 0 50 GFAA Cn1c([C@@H]2CCCN2CC(=O)N2CCO[C@H]3CCCC[C@H]32)nc2c1CCCC2 328621658 APUSNIQJYFUNBK-AABGKKOBSA-N 386.540 2.606 0 50 GFAA CC1=NN(C(=O)c2ccccc2I)[C@@](O)(C(F)(F)F)C1 6849489 WIYJCYKEUMEJRC-NSHDSACASA-N 398.122 2.764 0 50 GFAA O=C(c1cccc(-n2cncn2)c1)N1CCC(C(=O)N2CCCCCC2)CC1 172188646 ZSXGNHLDLKPPBP-UHFFFAOYSA-N 381.480 2.522 0 50 GFAA COCC1(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCC1 72158075 SIDZJWINSXDLTC-AWEZNQCLSA-N 384.398 2.739 0 50 GFAA Cc1cnn(Cc2cc(C(=O)NCC(C)(C)c3ccc4c(c3)OCCO4)no2)c1 124656022 ZWUTWNKMMXRTEO-UHFFFAOYSA-N 396.447 2.707 0 50 GFAA CCCCC(=O)N1CCC(N2CCC[C@@H](C(=O)NCc3cccnc3)C2)CC1 71746003 WFTCGEDGYXGQOL-LJQANCHMSA-N 386.540 2.591 0 50 GFAA Cn1nccc1[C@H]1[C@H](C(=O)Nc2ccc3[nH]ccc3c2)CCC(=O)N1C1CC1 367932421 LDLWRHXCTWKLKW-OXQOHEQNSA-N 377.448 2.982 0 50 GFAA C/C(=C\C(=O)N1CCC[C@H]1c1nc(C(=O)NC2CC2)no1)c1ccc(F)cc1 372778084 ZZXWJIBZIGCOGO-PCUGXKRQSA-N 384.411 2.868 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)c2ccc3c(c2)NC(=O)CCN3C)CC1 172692753 CBNKGNGJUXOEQK-UHFFFAOYSA-N 392.503 2.731 0 50 GFAA Cn1ncc(C(=O)NCCNc2nc3ccccc3s2)c1Cc1ccccc1 444863821 YVICMIDBLYNMGJ-UHFFFAOYSA-N 391.500 3.463 0 50 GFAA Cn1ccnc1[C@@H]1CCCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1 444802792 ONYZSUPPUMNELA-OAHLLOKOSA-N 389.463 2.634 0 50 GFAA CCCCN(C)S(=O)(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1 240551644 GVCMCHHZDJLEDC-IAGOWNOFSA-N 394.493 2.713 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)NCc1nc(-c2ccccc2)n[nH]1 426402186 YGWVRPYQOYBOBJ-UHFFFAOYSA-N 379.468 2.805 0 50 GFAA O=C(CCN1CC[C@]2(CCCN(CCC3CCCCC3)C2=O)C1)NC1CC1 426668505 XBZNEBIAYBVIMA-JOCHJYFZSA-N 375.557 2.940 0 50 GFAA COc1ccc(C2(C(=O)NCCc3nc(C)cc(O)n3)CCCC2)cc1OC 426550971 BKVOYZQYYVLIAR-UHFFFAOYSA-N 385.464 2.679 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](NC(=O)c2cc(C)oc2C)CN1C1CCCC1 96153224 FWKSBHPDKPHGOG-APWZRJJASA-N 375.513 2.880 0 50 GFAA Cc1cc(CNC(=O)Nc2cc(C(=O)N3CCOCC3)ccc2Cl)ccn1 96165363 SLFVTMBZXWUUOO-UHFFFAOYSA-N 388.855 2.838 0 50 GFAA CCOc1ccc(/C=C2\SC(=O)N(CN3CCOCC3)C2=O)cc1OCC 334162686 FLCSXMFTHUUGAS-ATVHPVEESA-N 392.477 2.810 0 50 GFAA CN(C)c1ccc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)cn1 91663590 DVQSPCLSWDNBLS-UHFFFAOYSA-N 393.535 2.947 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@H]1CCCN(CCCn2cnnn2)C1 95508704 KAMPFEZJOBNDDK-KRWDZBQOSA-N 380.452 2.674 0 50 GFAA CCOCCC(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91848982 GNBGQWAIQKZYOR-UHFFFAOYSA-N 380.435 2.733 0 50 GFAA COc1cc(CN(C)Cc2cccnc2)ccc1OC[C@@H](O)CN1CCCC1 95529997 CIVQLGMWMSDFJT-FQEVSTJZSA-N 385.508 2.558 0 50 GFAA O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)NCCn1ccc2ccc(F)cc21 252551740 UGIAEQIPAGULHI-QGZVFWFLSA-N 394.406 2.687 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)N[C@H]1CC(=O)N(c2ccc(F)cc2)C1 252483899 FKVDIIBMALYXSD-AWEZNQCLSA-N 398.394 2.713 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)[C@@H]2CCCN2c2nc(C)c3ccccc3n2)C1 299784733 HLUUTIVYPMHBQQ-LPHOPBHVSA-N 396.491 2.709 0 50 GFAA O=C(NCc1nc(-c2ccccc2Cl)no1)N1CCC[C@@]2(CCNC2)C1 827933722 CDVZSWCMCCUFAP-SFHVURJKSA-N 375.860 2.675 0 50 GFAA Cc1ccc([C@H](C(=O)NCCn2nc(-c3ccccc3)ccc2=O)N(C)C)cc1 823649038 VDVHLNGQWMDJGR-JOCHJYFZSA-N 390.487 2.638 0 50 GFAA O=C(NC1CCN(C(=O)N2CCCCC2)CC1)c1ccc(CN2CCCC2)o1 952869230 YQVPMECKGFDFDT-UHFFFAOYSA-N 388.512 2.676 0 50 GFAA COc1cccc2c1ccn2CC(=O)N1C[C@@H]2C[C@@H](C1)[C@@H]1CCCC(=O)N1C2 888088276 DZPHADAIXNUVQX-BQFCYCMXSA-N 381.476 2.509 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 1565509539 NYNAFUHECUDEMA-WBVHZDCISA-N 385.489 2.537 0 50 GFAA Cc1ccc(C(C)C)c(OCC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)c1 276654124 YILOWDZIIAHLPK-QGZVFWFLSA-N 397.523 2.602 0 50 GFAA O=C(NC[C@]1(O)CCOC1)Nc1ccnn1Cc1ccc(Cl)cc1Cl 189448976 JJURIACUVZOZCJ-MRXNPFEDSA-N 385.251 2.511 0 50 GFAA O=C(COCc1nc2ccc(F)cc2[nH]1)N1CCC[C@H](OCc2ccccn2)C1 1506424185 HMTKODSHXFXNBX-KRWDZBQOSA-N 398.438 2.821 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(-c4cccc(Cl)c4)o3)C[C@@H]2O)CC1 207494942 PXEMTEUHJBCMJE-PMACEKPBSA-N 389.927 2.783 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)CCC3CCCC3)CC2)C1 15067314 ATKHAMDDYTVNBQ-GOSISDBHSA-N 375.557 2.938 0 50 GFAA O=C(NCc1cnc2ccccn12)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 15068199 SRNBTCUKIXKADY-QGZVFWFLSA-N 394.450 2.571 0 50 GFAA O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NCc1cccnc1 16647603 CWFZGTXRRDTOBL-UHFFFAOYSA-N 387.505 2.505 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3cccc(C)c3)CC2)cc(OC)c1OC 19235018 LTXPFWVDWUYKGW-UHFFFAOYSA-N 384.476 2.979 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCc1ccccc1F)CCCCC3 169778376 LKMBKXJDVJVJOM-UHFFFAOYSA-N 382.439 2.688 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cccc4cc[nH]c34)C1)CC2 1857698368 NTALFCPGJQLQLI-QFIPXVFZSA-N 391.475 2.850 0 50 GFAA CC(C)Cc1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)no1 1857713403 HMSVZJDOIZBFHL-KNKQGSTJSA-N 395.459 2.788 0 50 GFAA CNC(=O)C(C)(C)NC(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857723952 DVWATXUECSNAAM-GFCCVEGCSA-N 392.887 2.729 0 50 GFAA CC1(C)CN(Cc2cnn([C@]3(C)CCS(=O)(=O)C3)c2)CC[C@@H]1C(F)(F)F 408349895 VUTWXYKQKCVGMH-GOEBONIOSA-N 393.475 2.827 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cn(-c3ccc(Br)cc3)cn2)C1 238080436 ZWBMTTZYPZKESY-NSHDSACASA-N 378.226 2.572 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)[C@H]1CCCN(C2CCC2)C1 248403343 ONXPFXXHNZWQNQ-RCZSKKKRSA-N 397.563 2.989 0 50 GFAA CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)c2cnn(-c3ccccc3)c2)c1 154124484 ADOYKEVWLOWPOQ-UHFFFAOYSA-N 388.424 2.514 0 50 GFAA O=C(OC1CCS(=O)(=O)CC1)c1nc(-c2ccccc2)n(-c2ccccc2)n1 835704413 MVJAUMAWVJUWIO-UHFFFAOYSA-N 397.456 2.668 0 50 GFAA c1cn2c(-c3noc([C@@H]4CCc5nnn(C6CCCC6)c5C4)n3)cnc2cn1 952892131 CCIWUVZVESLZNI-GFCCVEGCSA-N 376.424 2.758 0 50 GFAA N=c1[nH]c(=N)[nH]c(=N[C@@H](Cc2ccc(F)cc2)c2cc(Cl)cc(Cl)c2)[nH]1 1875303282 KTJYYCJGJKIMIJ-AWEZNQCLSA-N 393.253 2.960 0 50 GFAA CC(C)OCc1ccc(C(=O)N[C@H]2CCN(c3cnnc(O)c3Cl)C2)cc1 891006373 RIEPYCLCEHJBSS-HNNXBMFYSA-N 390.871 2.769 0 50 GFAA COc1ccc([C@H]2C(C(N)=S)=C(N)Oc3c2c(=O)oc2ccccc32)cc1 626065 GVPMMSQBEUIDEA-CQSZACIVSA-N 380.425 2.782 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccccc3F)CC2)c(C)cc1C 789065 QZMAZICGXMHSKO-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA CCc1ccc(OCC(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 813646 SPCGTHAOCCPILB-UHFFFAOYSA-N 381.476 2.935 0 50 GFAA CC(C)(C)c1ccc(C(=O)NCCCNC2=NS(=O)(=O)c3ccccc32)cc1 2852094 DYVOWZHDAQRWJH-UHFFFAOYSA-N 399.516 2.843 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N(c1ccc(F)cc1)[C@H]1C=CS(=O)(=O)C1 4035864 REVNDIPZASWKHG-HNNXBMFYSA-N 375.377 2.512 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)NCCCOC2CCOCC2)C1 225433565 ZTVPWGLAFORBHW-INIZCTEOSA-N 399.532 2.613 0 50 GFAA O=C(Nc1cccc(Nc2ccccc2)c1)C1=CC=CN2CCS(=O)(=O)N=C12 114127230 CSIAVSIBLQTHJP-UHFFFAOYSA-N 394.456 2.866 0 50 GFAA Cc1cccc2c(CC(=O)N(Cc3cccnc3)[C@H]3CCS(=O)(=O)C3)c[nH]c12 133878015 UJOABVOONVGSGB-SFHVURJKSA-N 397.500 2.630 0 50 GFAA CC(=O)N1CCc2cc(C(=O)NC[C@H](O)c3ccc(OC(C)C)cc3)ccc21 116463096 GUEOECVAPFXBPQ-NRFANRHFSA-N 382.460 2.846 0 50 GFAA CCN1CCN(C2(C(=O)NCCc3ccccc3)Cc3ccccc3C2)CC1 23374155 RUWQQDKTZGSWNU-UHFFFAOYSA-N 377.532 2.520 0 50 GFAA CCCn1nc(C)c2c1NC(=O)C[C@H]2c1ccc(OC)c(Cn2cncn2)c1 65404438 RUBASNUFSVXZOF-INIZCTEOSA-N 380.452 2.724 0 50 GFAA NC(=O)[C@H]1Cc2ccccc2CN1Cc1cnc2c(-c3ccccc3)cnn2c1 67446682 XSCJCRKXGVRAGM-OAQYLSRUSA-N 383.455 2.809 0 50 GFAA CCc1cn[nH]c1[C@@H]1CCCN(C(=O)CCn2c(=O)oc3ccc(C)cc32)C1 67884590 CJRUKKLDXVGDBB-MRXNPFEDSA-N 382.464 2.985 0 50 GFAA O=C1CCCc2occ(C(=O)N3CCc4c(nc(-c5ccccc5)[nH]c4=O)C3)c21 72128352 CLIBQJOEBHHSDF-UHFFFAOYSA-N 389.411 2.747 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC[C@@]2(CCC(=O)N(C3CC3)C2)C1 77390170 POVRHCIFZFYTHY-OAQYLSRUSA-N 382.464 2.532 0 50 GFAA Cc1ccccc1CNC(=O)C[C@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71479402 KHDDYPLDODBYJN-SFHVURJKSA-N 381.476 2.601 0 50 GFAA COc1ccc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCC3)c2)c(OC)c1 72149004 FWUFMXWOYUVEBN-UHFFFAOYSA-N 391.445 2.854 0 50 GFAA COC1(C(=O)NC2CCN(c3cccc(C(F)(F)F)c3)CC2)CCOCC1 375046111 HCHDKKCUJZVLPA-UHFFFAOYSA-N 386.414 2.986 0 50 GFAA COCc1ncsc1C(=O)N1CCOC[C@H]1c1nc(-c2ccccc2)no1 284556976 DUIQKEWVVUHKFZ-AWEZNQCLSA-N 386.433 2.553 0 50 GFAA CN1Cc2ccccc2C[C@@H]1CNc1nc(-c2ccncc2)nc2c1cnn2C 72418892 WLBZRUWFJYVVOD-GOSISDBHSA-N 385.475 2.894 0 50 GFAA CC(C)CCN1C[C@@]2(CCCN(C(=O)CCc3cc(O)no3)C2)CCC1=O 77539094 SFIIJMQFDVLFSB-FQEVSTJZSA-N 377.485 2.590 0 50 GFAA COCCNC(=O)c1nn(CCC(C)C)c2c1CN(Cc1ccc(C)o1)CC2 14742867 POVGYGCTABUTRM-UHFFFAOYSA-N 388.512 2.765 0 50 GFAA CCCN1CCC(CC(=O)N[C@@H]2CCOC[C@H]2Oc2cccc(F)c2)CC1 220009816 AOKRZAJYWGOKBF-WOJBJXKFSA-N 378.488 2.990 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)c(C)n1 17081525 OSADYWOVOAARJC-UHFFFAOYSA-N 398.488 2.942 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2ccccc2-c2ncc[nH]2)CC1=O 82106660 SOIRNIGFBLMHTM-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA Cc1ccc(C(=O)NCc2ccc3c(c2)OCCCO3)cc1N1CCNC1=O 91326386 ZVSTYEKHSBPXFX-UHFFFAOYSA-N 381.432 2.616 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)NC[C@@H]1COc2ccccc2C1 96131495 DEZIUUBKXNTAMM-OAHLLOKOSA-N 378.432 2.822 0 50 GFAA CCCc1nc(CN(CC)C(=O)c2cnc(-c3ccc(C)cc3)[nH]c2=O)no1 91416636 SNXKVJNTAHMYPI-UHFFFAOYSA-N 381.436 2.743 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)s1 95375262 DTAXTHZESJQUCQ-CQSZACIVSA-N 384.509 2.704 0 50 GFAA COCCN(Cc1cccnc1)C(=O)Nc1ccc2c(c1)O[C@@H](C)C(=O)N2C 96163403 OHRGPXAGJBVMEZ-AWEZNQCLSA-N 384.436 2.506 0 50 GFAA COC(=O)/C=C1/CC[C@@H]2[C@H](C(=O)C[C@H]3[C@](C)(C(=O)OC)[C@@H](O)CC[C@]23C)[C@@H]1C 257347280 CFNLOOTYKUBPGV-HTOISWFJSA-N 392.492 2.677 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)[C@H]3COc4ccccc4C3)s2)n1 1940196574 TTYROLDGDKNUAA-OAHLLOKOSA-N 383.477 2.784 0 50 GFAA CN1C[C@]2(CCCN(C(=O)Nc3cnn(Cc4ccccc4F)c3)C2)OC1=O 299761971 CNAYGDHOYUQHCT-IBGZPJMESA-N 387.415 2.519 0 50 GFAA CC1=C(c2ccccc2)[C@@H]1C(=O)NCC1CCN(C(=O)c2cncc(O)c2)CC1 827688893 DTSXXFPTNYLNAW-OAQYLSRUSA-N 391.471 2.859 0 50 GFAA CN1CCO[C@@H](CNC(=O)c2cccc(-c3ccc4c(O)nccc4c3)c2)C1 584893344 XMNBINZIXBFMHU-IBGZPJMESA-N 377.444 2.668 0 50 GFAA O=C(NCCc1nc(-c2ccccn2)no1)[C@@H]1CCCCN1Cc1ccccc1 670453398 MMQINACGXLXLGF-IBGZPJMESA-N 391.475 2.845 0 50 GFAA CN(c1ccc(C(=O)Nc2cccc(CN3CCCC3)c2)cc1)S(C)(=O)=O 952983200 IVJQLKTWJVMOBP-UHFFFAOYSA-N 387.505 2.931 0 50 GFAA CCn1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(OC)cc2)C3)c(C)n1 1565511496 QAGFKPIRGJCHOX-MOPGFXCFSA-N 382.508 2.957 0 50 GFAA Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1cccc2ocnc12 170610449 FTLVBWVXQGGGEE-UHFFFAOYSA-N 388.449 2.593 0 50 GFAA CCCN1CCCN(C(=O)c2nn(-c3ccccc3F)c3c2CCC3)CC1=O 188164349 MYNHLRQIMKRZLD-UHFFFAOYSA-N 384.455 2.585 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N[C@H]1CCCNC1 1704310815 UECQBAWXOTUNBE-AWEZNQCLSA-N 378.860 2.535 0 50 GFAA CN(Cc1ccccc1)C(=O)[C@H](NC(=S)N[C@H]1CCCC[C@@H]1N)C(C)(C)C 214976683 CNEVMNSDRMDKFO-BZSNNMDCSA-N 390.597 2.794 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3C(=O)N1CCC2(CC1)CN(C)C(=O)CO2 1775978979 DGTGFLXSVOFKEH-KRWDZBQOSA-N 395.503 2.746 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)C3(c4ccccc4)CC3)CC2)C1 12027796 KYELNGSKJIEBPL-GOSISDBHSA-N 395.547 2.700 0 50 GFAA CC1=C(C(=O)N(C)CC2CCN(CCc3ccccc3F)CC2)OCCO1 12205075 SIDZWQUUPJFKCB-UHFFFAOYSA-N 376.472 2.817 0 50 GFAA CC[C@@H](O)CNC(=O)c1cc(OC)ccc1OC1CCN(C2CCCC2)CC1 12612435 OCMLPOWKTLTZKQ-QGZVFWFLSA-N 390.524 2.982 0 50 GFAA O=C(NCCc1ccccc1)C1CCN(C2CCN(C3CCOCC3)CC2)CC1 14980033 ARSIEXCYLPDCDM-UHFFFAOYSA-N 399.579 2.701 0 50 GFAA O=C1c2cccc(N3CCN(C4CCCC4)CC3)c2C(=O)N1C[C@@H]1CCCO1 15000922 OTERZWCLUZOQHT-KRWDZBQOSA-N 383.492 2.526 0 50 GFAA O=C(NCc1nccs1)c1cccc(S(=O)(=O)N2CCCCCC2)c1 169312022 TVVLPVMZDZQLIX-UHFFFAOYSA-N 379.507 2.638 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccccc4C)c2=O)CCCCC3)no1 169774606 PGHVQWUQWSMDHE-UHFFFAOYSA-N 380.448 2.706 0 50 GFAA NC(=O)[C@H]1CCCN(CCCn2ccnc2-c2ccc3cccc(F)c3n2)C1 1857684196 CNUKAILEDJGLDQ-INIZCTEOSA-N 381.455 2.825 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NCCc4noc(C(C)C)n4)CC3)nc2n1 1857720713 GNSXOWRZENVPHT-UHFFFAOYSA-N 398.467 2.613 0 50 GFAA CCc1nc(N2C[C@@H]3[C@H](CNC(=O)c4ccco4)[C@H]4CC[C@]3(C2)O4)ccc1C 1875250735 CKTHVBNFCCYTHV-FIQUECFISA-N 381.476 2.959 0 50 GFAA Cc1ccc(-n2nccc2NC(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)nn1 123783807 PQRTZIMAZKRRMR-UHFFFAOYSA-N 392.463 2.999 0 50 GFAA C[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 237400946 YOGPDOJTFVMEGR-YGRLFVJLSA-N 387.263 2.968 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2)C[C@H](C)O1 237628323 ZHJKUYHYTRQXDN-HOTGVXAUSA-N 382.460 2.924 0 50 GFAA O=C(NC1CC1)[C@@H](O)C1CCN(CCOc2ccc(Cl)cc2Cl)CC1 253433194 TUGWBQFNDKSGGJ-KRWDZBQOSA-N 387.307 2.724 0 50 GFAA O=c1cc(-c2ccc(O)cc2)nc(-c2ccc(CN3CCC[C@H]3CO)cc2)[nH]1 20149500 CZZLSLBBLODSNN-SFHVURJKSA-N 377.444 2.766 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2ccc(CCC(=O)O)cc2)c2cccc(F)c2O1 478267686 NTXYBEIVDHMCGN-GFCCVEGCSA-N 379.409 2.819 0 50 GFAA O=S1(=O)CCCN1[C@@H]1CCCN(Cc2ccc(OC(F)F)c(Cl)c2)C1 369314383 NCBUNHZVJWTXHW-CYBMUJFWSA-N 394.871 2.941 0 50 GFAA C[C@@]1(C(=O)NCc2cnc3n2CCCC3)CCCN(C(=O)c2ccccc2)C1 375305349 ZTXWLEWYPDKNPD-JOCHJYFZSA-N 380.492 2.778 0 50 GFAA O=C(N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21)C1(n2cc(Br)cn2)CC1 826574784 DXHOWKAIZXEULM-RRFJBIMHSA-N 376.229 2.728 0 50 GFAA Cc1ccc(Cn2nc(C)c(CCC(=O)N3C[C@@H]4CCC(=O)N[C@H]4C3)c2C)cc1 1875295932 AUPCCDRLESGIHX-FPOVZHCZSA-N 394.519 2.526 0 50 GFAA COCCn1nc2c(c1C(=O)N(C)Cc1cccc(F)c1)C[C@H](C)O[C@@H]2C 1875314557 FSEUPHPFDQNILJ-UONOGXRCSA-N 375.444 2.963 0 50 GFAA CCn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)COc3ccc(C)cc3C)CC1)O2 1875394408 IBXWLABFCAXELS-KRWDZBQOSA-N 399.491 2.776 0 50 GFAA C=CC(=O)NCCC[C@H]1[C@H](C)CCCN1C(=O)Cc1ccc2c(cnn2C)c1 1875386270 MCIXONNVEBNHKD-APWZRJJASA-N 382.508 2.825 0 50 GFAA Cn1ncc(C(=O)N[C@@H]2CC(C)(C)CCc3ccccc32)c1S(C)(=O)=O 885679326 MXQJBCCVBKJUFE-MRXNPFEDSA-N 375.494 2.657 0 50 GFAA C[C@H](CNC(=O)C[C@@H]1CN(CC2C3(CC3)C23CC3)C2(CCC2)CO1)c1cnc[nH]1 2325785289 OLLLIFDFSATKKZ-IAGOWNOFSA-N 398.551 2.833 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1cnc(-c2ccccc2Cl)nc1 2325786143 FXUOVZXIXOVSJK-MORSLUCNSA-N 397.866 2.563 0 50 GFAA CC(C)(C)OC(=O)N1CCOC[C@H]1CC(=O)Oc1ccc2c(c1)C(=O)CCN2 2325872082 HGKUZOWFDVOVGC-CYBMUJFWSA-N 390.436 2.616 0 50 GFAA CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 880983112 SLNYVOMHKLYRGE-QGZVFWFLSA-N 399.472 2.954 0 50 GFAA CCOC(=O)c1c(N)sc2c1C[C@@H]1C(=O)N(C3CCCCC3)C(=O)[C@H]1C2 759454 IVTNTJZTVUXIDR-RYUDHWBXSA-N 376.478 2.540 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 892674 LIESTRPWACVPAF-UHFFFAOYSA-N 382.488 2.809 0 50 GFAA COc1cccc(C(=O)Nc2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1 1124755 DHBQJGIEQQVMGI-INIZCTEOSA-N 380.400 2.723 0 50 GFAA O=C([C@H]1CCCO1)N1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)CC1 1139338 XTLMEYCVKCLWGM-CQSZACIVSA-N 387.427 2.725 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2cnn(-c3ccccc3F)c2)C1=O 2356136435 URBLYQWCODEBAH-OAQYLSRUSA-N 386.471 2.615 0 50 GFAA O=C(C1c2ccccc2Oc2ccccc21)N1CCN(C(=O)[C@H]2CCCO2)CC1 4803645 LZAWCHTZGPBPGM-HXUWFJFHSA-N 392.455 2.774 0 50 GFAA O=C(CSc1ncn(-c2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1 4842197 GNHHYJSKRCKANP-UHFFFAOYSA-N 395.488 2.835 0 50 GFAA Cc1ccc(C(=O)NCc2cccnc2)cc1S(=O)(=O)N1CCCCCC1 6698092 OMFQDPRXMVTRGL-UHFFFAOYSA-N 387.505 2.885 0 50 GFAA CCNC(=O)c1c(NC(=O)[C@@H](C)Cn2nc(C)nc2C)sc2c1CCCC2 55414230 GCCMMPSSYVIHIF-NSHDSACASA-N 389.525 2.860 0 50 GFAA OCC[C@H]1CN(Cc2ccc3nsnc3c2)CCN1Cc1ccccc1F 23374378 HRJTVCYIBDJLHQ-KRWDZBQOSA-N 386.496 2.899 0 50 GFAA Cc1ccccc1CN(CCN(C)C)C(=O)C1CCN(c2ncccn2)CC1 55211240 DMABXVPQRKUSPX-UHFFFAOYSA-N 381.524 2.592 0 50 GFAA O=S(=O)(NCc1ccccc1CN1CCOCC1)c1ccc(Cl)cc1 23330622 BVDARKFHTFZKNQ-UHFFFAOYSA-N 380.897 2.651 0 50 GFAA O=C(c1ccccn1)N1CCC2(CC1)c1ccccc1[C@@H](N1CCCC1)[C@@H]2O 20910474 DLLGGDFUUOUJBM-RTWAWAEBSA-N 377.488 2.767 0 50 GFAA COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1csc(CC(=O)OC(C)C)n1 252470065 XUPGOTOJGGVQEP-BMFZPTHFSA-N 380.510 2.943 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1CCc2ccc(NC(=O)[C@H]3CCCO3)cc2C1 12204460 YWSGNNPDKKZMFE-HXUWFJFHSA-N 396.491 2.662 0 50 GFAA Cc1nc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)cs1 120711839 KTNOJQJIPFNSJB-HNNXBMFYSA-N 383.395 2.713 0 50 GFAA Cc1oc2nc(CN3CCC[C@H](c4nnc5ccccn45)C3)nc(N)c2c1C 153984441 XJRAWOCMCGGZPH-AWEZNQCLSA-N 377.452 2.844 0 50 GFAA C1CN(c2nnc(CC34CC5CC(CC(C5)C3)C4)n2C[C@H]2CCOC2)CCO1 328809279 DWYGPOBQGZZPEI-GSQFEDNKSA-N 386.540 2.910 0 50 GFAA CNC(=O)c1cn2cc(-c3ccc(OC)cc3F)n(CC=C(C)C)c(=O)c2n1 72457372 YYVBHWCCCUIQEQ-UHFFFAOYSA-N 384.411 2.637 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@]3(CC2)CN(C)C(=O)O3)c(-c2ccccc2)n1 72146557 IGMXKNLFTZIACV-NRFANRHFSA-N 380.448 2.899 0 50 GFAA CN(C1CCN(CCn2cccn2)CC1)[C@@H]1CCCN(c2ccccc2F)C1=O 157051352 CAVWZJKFROLMME-OAQYLSRUSA-N 399.514 2.614 0 50 GFAA CCCCN1C(=O)c2ccc(C(=O)N3CCC([C@H]4CCOC4)CC3)cc2C1=O 371776837 CGWXXZUMSMPCQJ-KRWDZBQOSA-N 384.476 2.971 0 50 GFAA O=C(CCCn1cccn1)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72145859 TYYBSGVLENTEEK-LJQANCHMSA-N 376.460 2.734 0 50 GFAA CCc1nn2c(nnc3c(=O)n(C[C@@H]4CCCO4)ccc32)c1-c1ccc(F)cc1 40391822 RZXBMONXRLYAKD-HNNXBMFYSA-N 393.422 2.987 0 50 GFAA CN(CC(=O)O)C[C@@H]1CN(C(=O)Nc2ccccc2-c2ccccc2)CCO1 263462501 FCSPJLCGSIISJC-QGZVFWFLSA-N 383.448 2.603 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 43831805 SFUQWKHNZKFFIW-QGZVFWFLSA-N 387.505 2.795 0 50 GFAA CCc1ncc(CN2CCC(c3nnc(CN4CCCC4)n3CC)CC2)cn1 82109712 ARIMQBICVVWKOV-UHFFFAOYSA-N 383.544 2.626 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)c2)cn1 426551303 NXZNQNYJGUFDDU-UHFFFAOYSA-N 379.460 2.842 0 50 GFAA O=C(N[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCN(c2nnc(C(F)(F)F)s2)CC1 426574842 HPXPNHAPBLKUME-OUAUKWLOSA-N 375.420 2.577 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCN(C)C)C3)C2)cc1F 82125841 QFEAQSHVBRWYBA-OAQYLSRUSA-N 375.488 2.541 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)N2CCC[C@H](Cn3ccnc3)C2)n1 426383311 PCGYDQYXISACCB-CYBMUJFWSA-N 382.390 2.622 0 50 GFAA O[C@H](COc1cccc(CN2CCCCCCCC2)c1)CN1CCOCC1 95521675 MTZCMVMCKRXYGS-NRFANRHFSA-N 376.541 2.915 0 50 GFAA COc1ccc(C(C)(C)NC(=O)N2CCC[C@H](CCC(N)=O)C2)cc1OC 426648185 SFVPQIKTJGGWSO-CQSZACIVSA-N 377.485 2.626 0 50 GFAA COc1ccc(CN(C)C2CCSCC2)c(OC[C@H](O)CN2CCCC2)c1 95525842 NVRIWTPWTWOBOB-LJQANCHMSA-N 394.581 2.858 0 50 GFAA COc1cc2c(cc1NC(=O)N1CCC[C@H]1c1cc(C)on1)n(C)c(=O)n2C 96133164 ZRGOMNFUKBUKHV-AWEZNQCLSA-N 385.424 2.551 0 50 GFAA CC(C)c1noc(CN2CCC[C@@]3(CCC(=O)N(Cc4ccccn4)C3)C2)n1 91780792 UYABWNWYYXHZBF-OAQYLSRUSA-N 383.496 2.993 0 50 GFAA C[C@H]1CCN2c3cc(Cl)ccc3CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]2C1 247817210 DTOPSWXMIXQGOS-XHDPSFHLSA-N 375.856 2.538 0 50 GFAA COC(=O)c1cn([C@@H](c2ccccc2)c2nc3ccccc3[nH]2)cc2c(=O)[nH]nc1-2 263587425 GUFKPOBGGJDDKM-IBGZPJMESA-N 399.410 2.977 0 50 GFAA O=C(Nc1ccnn1C[C@H]1CC=CCC1)NC1CCN(c2cnccn2)CC1 299802158 XRCIDAGYLZEUGR-INIZCTEOSA-N 381.484 2.820 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@@H]1CCCN(Cc2cccs2)C1 827836860 NGKOIKVHXQYFKU-GOSISDBHSA-N 385.533 2.723 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NCC1(C)CCN(C)CC1 272525585 IKYADQQADPFQRW-GOSISDBHSA-N 387.524 2.538 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NC[C@@H](O)c1ccccc1 192770853 ZEJNRRSWNVLZRV-RTBURBONSA-N 382.460 2.540 0 50 GFAA C[C@H]1CN(C(=O)c2nn(-c3ccc(F)cc3)ccc2=O)c2ccc(F)cc2O1 741965764 HHINWMGTDGRQHU-LBPRGKRZSA-N 383.354 2.938 0 50 GFAA Cc1cc(N2CCC(CNC(=O)CCCc3ccc(F)cc3)CC2)nc(N)n1 1506405579 ALYGWHAOOVNOMO-UHFFFAOYSA-N 385.487 2.862 0 50 GFAA CN(Cc1cccc2cccnc12)C(=O)c1ccccc1N1CCC(=O)NC1=O 1506420430 GFDXUUYVEHCFIN-UHFFFAOYSA-N 388.427 2.953 0 50 GFAA CN[C@@H](CC(C)C)C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704305508 RIOCSCODUQKRRQ-SFHVURJKSA-N 390.524 2.728 0 50 GFAA Cc1c(Cl)cccc1NC(=O)C[C@@H]1Cn2nc(-c3ccncc3)nc2NC1=O 1848442474 WYIRHSCXHFQBGL-CYBMUJFWSA-N 396.838 2.899 0 50 GFAA Cc1ccc(-c2nc([C@H]3CC(=O)N(C4CCCC4)C3)n(-c3cnn(C)c3)n2)o1 1772811700 XRFFXQCVYRJKMR-AWEZNQCLSA-N 380.452 2.828 0 50 GFAA c1ccc(CC[C@]23CNC[C@@H]2CN(c2ccc(CN4CCOCC4)cn2)C3)cc1 1772712298 NKGUVJVUKXZVPY-ISKFKSNPSA-N 392.547 2.572 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)NC[C@@H](C)O)c1 12195267 NDQJYHVCTCKVCX-OAHLLOKOSA-N 376.497 2.592 0 50 GFAA CC(C)Cn1c(CN2CCCCCC2)cnc1S(=O)(=O)C[C@@H]1CCCO1 12316125 CJVWULRMRXHKCU-SFHVURJKSA-N 383.558 2.868 0 50 GFAA O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc2oc(CCc3ccccc3)nc2c1 12437604 KJROOUOYIPHBED-MRXNPFEDSA-N 384.457 2.530 0 50 GFAA O[C@@H](COc1ccc(CNCCCOc2cccnc2)cc1)CN1CCCCC1 12448858 CKEMZUYTFHROKZ-OAQYLSRUSA-N 399.535 2.866 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(-c4nc(-c5cccnc5)no4)c3CO2)cc1 169758339 QBIZGCAURJKOSF-INIZCTEOSA-N 376.376 2.670 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)N1C[C@@H]2CCOC[C@]2(CO)C1 1857669185 PYBVSRNVKPEKFV-NZQKXSOJSA-N 381.472 2.666 0 50 GFAA CC[C@@]1(C(=O)NCc2ccnc(C)c2)C[C@@H]2CC[C@H]1N2C(=O)C1CCOCC1 1857697283 NIQLHAPPOQZVLP-NNMXDRDESA-N 385.508 2.593 0 50 GFAA Nc1cnc(-c2cc3c(s2)C2(CCN(c4cnccn4)CC2)OCC3)cn1 1857716072 VFSJHWVYFGYZAA-UHFFFAOYSA-N 380.477 2.646 0 50 GFAA O=C(NC1(CO)CC=CC1)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857731536 UQXSDDPCLPCFMP-CYBMUJFWSA-N 375.856 2.895 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1 12299008 RETMDSQCZRYGBR-OAQYLSRUSA-N 375.488 2.668 0 50 GFAA Cc1cnccc1N1CCN(Cc2ccc(-c3nc(C)c(F)c(=O)[nH]3)cc2)CC1 23380091 KMHQBLZTXZCWCQ-UHFFFAOYSA-N 393.466 2.910 0 50 GFAA CC(=O)NCC(=O)O[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 835542271 GYCLGOJUIVWEKF-SJORKVTESA-N 376.453 2.807 0 50 GFAA CC(C)C[C@@H](CNC(=O)N(C)C[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1 1875295044 CLLGIXQJNHMXON-RBUKOAKNSA-N 380.554 2.968 0 50 GFAA C[C@H]1C[C@@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)CC(=O)N1 1875270418 JPXAYQHEUGFARX-DTWKUNHWSA-N 382.233 2.714 0 50 GFAA COC(=O)c1ccc2c(c1)CC[C@H](NC(=O)OC(C)(C)C)CN2C(=O)C(F)F 1875339437 JRHTZOCDSOBRTA-ZDUSSCGKSA-N 398.406 2.911 0 50 GFAA COc1cc(-c2cc(=NC(=O)C[C@H](C)n3ccnc3C)[nH][nH]2)cc(OC)c1OC 2100480252 BGCISJLLDXXCAQ-LBPRGKRZSA-N 399.451 2.619 0 50 GFAA COc1ccc(OC)c(NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)cc2)c1 909922 RXBVWTVLVGVMMP-SFHVURJKSA-N 399.472 2.841 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(CC(=O)N1CCCC1)c1ccccc1 1062003 JMCAJXMTPKPBRM-UHFFFAOYSA-N 388.489 2.821 0 50 GFAA O=C(CNC(=S)NC(=O)c1ccccc1Br)c1ccccc1 1794640 HEPTVPLZGLYIDF-UHFFFAOYSA-N 377.263 2.936 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2c(C)nn3c(C)cc(C)nc23)C1=O 2356164318 OGWLOZURSHHUQX-OAQYLSRUSA-N 383.496 2.662 0 50 GFAA COc1cc(CNCc2cccs2)cc(Br)c1OCC(N)=O 4843282 QCTPUAKLLMZNPT-UHFFFAOYSA-N 385.283 2.673 0 50 GFAA COC(=O)c1ccc(Nc2nc(N3CCN(C)CC3)c3ccccc3n2)cc1 6368185 QPADYMJPMQKMRJ-UHFFFAOYSA-N 377.448 2.912 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)NS(=O)(=O)Cc1c(F)cccc1F 132909940 JWJGBXMXCMULKH-KRWDZBQOSA-N 381.400 2.615 0 50 GFAA Cc1nc([C@@H]2CCCCN2C(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n[nH]1 225502126 VTXKIOLYRRHIQX-MOPGFXCFSA-N 395.507 2.648 0 50 GFAA Cc1ccc(-c2nn(-c3cccc(F)c3)cc2CN2CCN(CCO)CC2)o1 22912051 ZXMFJHUQXRFANC-UHFFFAOYSA-N 384.455 2.690 0 50 GFAA O=C(NCC[C@H]1C(=O)Nc2ccccc21)Nc1cccc(OCC(F)F)n1 133966080 KVSMLLJOPFAACY-GFCCVEGCSA-N 376.363 2.973 0 50 GFAA COc1ccccc1NC(=O)CCc1nnc2ccc(-n3nc(C)cc3C)nn12 67630298 SPTXWAMJASNJFI-UHFFFAOYSA-N 391.435 2.507 0 50 GFAA O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)[C@H]1CCc2cn[nH]c2C1 134316528 AAZOLZAEBRUKNP-PGRDOPGGSA-N 391.471 2.943 0 50 GFAA COc1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)C[C@@H]2CCO)c1 20452625 RQHGXDGSRUBMOO-SFHVURJKSA-N 380.492 2.640 0 50 GFAA COc1c(C)cnc(CN2CCC(N(C)C(=O)CC3(O)CCCC3)CC2)c1C 118886984 DWTSBRNCCDPUSF-UHFFFAOYSA-N 389.540 2.825 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)CC1 280111738 ULMYJECOYFJOSA-MRXNPFEDSA-N 385.516 2.522 0 50 GFAA C[C@H]1CCCCN1C1CN(C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)C1 67640923 NVBWEDCPEJYHCS-HNNXBMFYSA-N 378.480 2.507 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)C2CCOCC2)CC1 12299366 YBTUOQHYJSTPSN-UHFFFAOYSA-N 394.519 2.759 0 50 GFAA O[C@H](c1cccs1)C1CCN(c2nc3nonc3nc2N2CCCC2)CC1 12709788 LNKFMARBUFYUQZ-AWEZNQCLSA-N 386.481 2.625 0 50 GFAA CCN1CCC[C@H]1CN(CCN(C)C)C(=O)c1cc(C2CC2)nc2onc(C)c12 125569537 QXOSPTKDXAFPDM-KRWDZBQOSA-N 399.539 2.897 0 50 GFAA COc1ccc(-c2cncc(C(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)c2)cc1 130094288 WCSPIONMASORFT-INIZCTEOSA-N 393.365 2.650 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)Nc2cccnc2N2CCOCC2)o1 157959042 ALHSEZMGYDSCCQ-KRWDZBQOSA-N 386.452 2.679 0 50 GFAA CCC(=O)N1CCOC[C@@]2(CN(Cc3ccccc3-c3ccco3)CCO2)C1 72130870 UIDANMCFTJHWQP-JOCHJYFZSA-N 384.476 2.786 0 50 GFAA O=C(NC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(-n2cnnc2)c1 215357414 UKTFZMLQHDHTIQ-INIZCTEOSA-N 376.338 2.750 0 50 GFAA OC1CCN(Cc2ccc3c(c2)CN(Cc2ccc4c(c2)CCO4)CCO3)CC1 14964933 SDOSSHYHYQLADM-UHFFFAOYSA-N 394.515 2.973 0 50 GFAA CN(C)CCn1ccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)n1 173930051 CPMQOVNQCGNNEG-OAHLLOKOSA-N 382.468 2.997 0 50 GFAA CCc1ccc([C@@H](COC)NC(=O)NC2CCN(Cc3ccncc3)CC2)o1 173486210 DXZHHSNPPOCHQO-LJQANCHMSA-N 386.496 2.888 0 50 GFAA Cn1cccc1[C@@H]1CCCCN1C(=O)CNC(=O)N1CCc2ccccc2C1 174395004 KUOHAYUJYFAWMV-FQEVSTJZSA-N 380.492 2.847 0 50 GFAA CC(C)c1nnc([C@H]2CN(C(=O)Nc3ccc4ccn(C)c(=O)c4c3)CCO2)o1 284886509 NKCCEKGLQAHQCW-MRXNPFEDSA-N 397.435 2.650 0 50 GFAA CN1CCC(N(Cc2ccccc2)C(=O)c2ccc3c(c2)OCC(=O)N3)CC1 175022522 VRNYXAJIPRVULF-UHFFFAOYSA-N 379.460 2.754 0 50 GFAA COc1cc(OC)nc(-c2cccc(C(=O)N(C)[C@@H](C)c3ccncn3)c2)n1 426575090 WTONCSIHQHQGAS-ZDUSSCGKSA-N 379.420 2.784 0 50 GFAA CC(C)c1nc(CN(C)C(=O)NCCc2nc(-c3cccnc3)n[nH]2)cs1 426620325 ZZERVOPCYCMWFL-UHFFFAOYSA-N 385.497 2.831 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1cc(F)ccc1OC)CC2 95524819 GRZFGAORFUCITN-UHFFFAOYSA-N 386.471 2.843 0 50 GFAA Cc1ccc(NC(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)cc1C 91594418 FGLOLHCDMIUUPF-MJGOQNOKSA-N 389.496 2.723 0 50 GFAA Cc1ccc(CN2CCN(Cc3cc(=O)c4cc(F)ccc4[nH]3)CC2=O)cc1 91381573 VKPCRAPGRSQBGG-UHFFFAOYSA-N 379.435 2.820 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCN2CCC[C@H]2C1 426716162 SEITXRLXZVYFFR-SFHVURJKSA-N 384.501 2.581 0 50 GFAA C[C@@H]1CCN(C(=O)C2=CC(c3ccco3)=NS(=O)(=O)N2C)[C@H]2CCCC[C@H]21 230119035 RERZDHKTOIPMBG-YCPHGPKFSA-N 391.493 2.570 0 50 GFAA COc1ccc([C@H](CC(=O)NC2CCS(=O)(=O)CC2)c2ccccc2)cc1 95520004 KDYJKHMEAALINM-HXUWFJFHSA-N 387.501 2.911 0 50 GFAA CCN(Cc1noc(C)n1)C(=O)Nc1cc(N2CCOCC2)ccc1Cl 96148840 MUBKNFKJIFKLEI-UHFFFAOYSA-N 379.848 2.922 0 50 GFAA CC[C@H](C)N(Cc1ccncc1)C(=O)Nc1cc(OC)cc(-n2cnnn2)c1 96159633 RJTKUOPDEAJWPF-AWEZNQCLSA-N 381.440 2.899 0 50 GFAA CC(C)N1CCN(Cc2cccc(OC[C@@H](O)CN3CCCCCC3)c2)CC1 95520564 FZGRMCXUOJLEAI-QFIPXVFZSA-N 389.584 2.828 0 50 GFAA COc1cncc([C@H](NC(=O)c2ccccc2-n2cccn2)[C@H]2C[C@H](O)C2)c1 244874677 XFMRNCPMBLADPW-AKCHCHLHSA-N 378.432 2.518 0 50 GFAA NC(=O)C[C@H](c1ccc(F)c(F)c1)c1oc(CN2CCCCC2)cc(=O)c1O 252495922 PDLUZRKTLCCIMZ-CQSZACIVSA-N 392.402 2.617 0 50 GFAA CCNC(=O)c1ccc(C)c(NC(=O)NC[C@H](CO)Cc2ccsc2)c1 299802517 YFYOYHTVCDTXJJ-OAHLLOKOSA-N 375.494 2.779 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)NC1CCN(Cc2cccs2)CC1 823724775 FTHBSRXBAUSMTJ-UHFFFAOYSA-N 379.551 2.679 0 50 GFAA CCCn1cc(S(=O)(=O)N(Cc2cccc(C)c2)C[C@H]2CCCO2)cn1 823033016 HNJDMRGYFROWMJ-GOSISDBHSA-N 377.510 2.971 0 50 GFAA CCc1ccc(S(=O)(=O)N2CCC[C@H](CNC(=O)c3cscn3)C2)s1 952978038 RWBGJSJIMVKGIR-GFCCVEGCSA-N 399.563 2.598 0 50 GFAA COC[C@H](c1ccccn1)N(C)S(=O)(=O)c1ccc(-c2cc(C)no2)o1 952989919 IXKADTLUFXARKA-CQSZACIVSA-N 377.422 2.646 0 50 GFAA CC[C@@H](C(=O)Nc1ccccc1CCC(=O)NC)N1Cc2ccccc2C1=O 952963824 KYNFIXGDAYDERF-IBGZPJMESA-N 379.460 2.738 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccc2)C3)cc1O 1565530056 VKHXJLIMQSGHGE-QAPCUYQASA-N 380.444 2.778 0 50 GFAA Cc1cc(C)cc(OCc2noc(CN3CCN(c4cc(C)[nH]n4)CC3)n2)c1 187231854 QUYOMTCPKDXTKZ-UHFFFAOYSA-N 382.468 2.619 0 50 GFAA CCc1c(C(=O)N[C@H]2COc3ccccc3C2=O)cnn1-c1ccccc1OC 187720571 KHRITQRXGXLSAT-INIZCTEOSA-N 391.427 2.817 0 50 GFAA C[C@H](NC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1ccc(OC(F)(F)F)cc1 191404578 MDCMBYYRVXSRSV-NILFDRSVSA-N 398.381 2.938 0 50 GFAA CC[C@H](CNc1noc(-c2ccc(F)c(OC)c2)c1C(=O)O)N1CCOCC1 1704312471 CLHOTJGHIOGVNS-CYBMUJFWSA-N 393.415 2.710 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2C)CCCN(C(=O)CCC(=O)OC)C1 11934106 IPPFMAQPFLSQBQ-OAQYLSRUSA-N 375.465 2.663 0 50 GFAA C[C@@H](NC(=O)c1ccco1)c1nnc2n1CCN(Cc1ccc(F)cc1)CC2 11977649 ISOPQPQXCOYADN-CQSZACIVSA-N 383.427 2.560 0 50 GFAA COc1ccc(-c2cccc3c2O[C@@H](CNC(=O)Cc2cccs2)C3)nn1 12149247 DLLIYXCGMZBDPN-CQSZACIVSA-N 381.457 2.876 0 50 GFAA Cc1noc(-c2cn([C@H]3CCN(C(=O)c4cc(F)ccc4Cl)C3)nn2)n1 169777917 NGDYIOQVHSWYJB-NSHDSACASA-N 376.779 2.516 0 50 GFAA CC(C)CS(=O)(=O)N[C@H]1CCC[C@@H](CNC(=O)c2cc(Cl)cn2C)C1 1857678607 PIJJZUWDTYNVEN-HIFRSBDPSA-N 389.949 2.543 0 50 GFAA CNc1ncccc1C(=O)N1CCC2(CC1)OCCc1cc(C(=O)O)sc12 1857682621 XNWKTUVAZFIECN-UHFFFAOYSA-N 387.461 2.587 0 50 GFAA COc1c(F)cccc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857709356 SMBRRCSTRJQUCV-HMFYCAOWSA-N 396.418 2.749 0 50 GFAA Cc1cc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)nc(C)n1 1857711267 QUBBAMLGEWECJP-JENIJYKNSA-N 386.883 2.691 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NCc3cccc(Cl)c3C)CC2=O)s1 1857721159 CEAFITYKEUNZQE-LBPRGKRZSA-N 378.885 2.732 0 50 GFAA CC(C)S(=O)(=O)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1[C@H](C)CCc1ccc(O)cc1 1857731583 KNRWTRLBGPCVDO-GRARQNNCSA-N 392.565 2.846 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)CCc2ccc(Cl)cc2)[C@H]1c1cnn(C)c1 1857739408 RZKOCPOGRRWULT-ICSRJNTNSA-N 390.915 2.536 0 50 GFAA COc1cc(CN2CC[C@@]34OCCCN3C(=O)C[C@@H]24)ccc1OCC=C(C)C 1857741068 AZPOTYGWLHGTIO-IRLDBZIGSA-N 386.492 2.963 0 50 GFAA CC(=O)NCCc1ccc(S(=O)(=O)N2CCC(c3ccccc3)CC2)cc1 1058350 KUKMIJTYSFLTQJ-UHFFFAOYSA-N 386.517 2.934 0 50 GFAA CO[C@H]1C[C@H](c2nc(C3CC3)no2)N(S(=O)(=O)c2cc(C)c(C)s2)C1 328638804 WLQRFFWPCUXKJJ-QWHCGFSZSA-N 383.495 2.776 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)CN2S(=O)(=O)c1cccs1 252003256 NGGBCMKQOMTUQX-CABCVRRESA-N 381.523 2.638 0 50 GFAA CCc1c(NC(=O)N2CCN(c3cnccn3)CC2)cnn1-c1cccc(C)c1 252492299 MHNZYAGGEWTKSA-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA O=C1C[C@H]2C[C@@H]1[C@H](C(=O)NS(=O)(=O)Cc1cc(Cl)cc(Cl)c1)C2 873582790 VMOSXKZGPKNBPA-ZEGGKSINSA-N 376.261 2.555 0 50 GFAA CN1[C@](C)(CNc2nc(-c3ccccn3)nc3sccc23)CCS1(=O)=O 1875295414 XKUCDFOLKDBGPF-KRWDZBQOSA-N 389.506 2.589 0 50 GFAA O=C(Nc1cc2c(O)ncnc2cc1F)c1cnnn1-c1ccccc1Cl 1875259585 LOQBZAQXVBPMHG-UHFFFAOYSA-N 384.758 2.961 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)NCc1cc(COC)cs1 1875395656 HVTNGXBRCVRTPH-ZAAXVRCTSA-N 389.521 2.722 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@H]2C[C@]23CCOc2ccccc23)c(F)c1 1875371243 UWCYLLUSZOBBNN-JPYJTQIMSA-N 394.446 2.985 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C 328593345 XBRMXZBXHYPKKQ-JYJNAYRXSA-N 382.501 2.966 0 50 GFAA CCOc1ccc(CN2CCC3(CCc4c(O)nc(C)nc43)CC2)cc1CO 2100540335 IITQXKOIAHOFKX-UHFFFAOYSA-N 383.492 2.862 0 50 GFAA O=C(c1cccc2cccnc12)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 2100557404 RHJUVJFTOFORHL-AUSIDOKSSA-N 390.439 2.755 0 50 GFAA CC(C)(CN1CCC(=O)N(C[C@@]23CCC[C@H]2C3(F)F)C1=O)C(=O)N1CCCC1 2325783674 SPCQTPFDXPCALF-KUHUBIRLSA-N 397.466 2.725 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2cccc3ccc(Cl)cc23)nn1C 2325819156 WWPNZZISGVHQDF-UHFFFAOYSA-N 379.825 2.814 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1[C@H](C(=O)O)Cc3c([nH]c4ccccc34)[C@H]21 754219 NNRWDPOHSYYGEI-KSSFIOAISA-N 378.384 2.740 0 50 GFAA biogenic,in-vitro COc1ccc2c(C)c(C(=O)N(C)[C@@H]3C[C@@H]4CNC(=O)C[C@@H]4C3)oc2c1OC 2356164166 HSTWNAPBUFKWRG-MJBXVCDLSA-N 386.448 2.745 0 50 GFAA Cc1ccc(Cn2ncc3c(N4CCN(c5ccccn5)CC4)ncnc32)cc1 6759658 SMCJWHJELPSOIO-UHFFFAOYSA-N 385.475 2.905 0 50 GFAA COc1cccc(NS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CCS3)c1 6779014 KEXACDMYXIREGI-UHFFFAOYSA-N 378.475 2.955 0 50 GFAA CCN(Cc1noc(CC(C)C)n1)C(=O)C(C)(C)NC(=O)c1cccs1 55099780 DYIPJEIVKGBUFR-UHFFFAOYSA-N 378.498 2.887 0 50 GFAA CCOc1ccccc1CCNC(=O)CC(=O)Nc1cc(OC)ccc1OC 55393201 MFULKOUVGVOMQH-UHFFFAOYSA-N 386.448 2.790 0 50 GFAA O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)[C@@H]1CCc2cn[nH]c2C1 134316502 AAZOLZAEBRUKNP-GCJKJVERSA-N 391.471 2.943 0 50 GFAA COc1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)ccc1O 23375463 GCXCTHVLHYMLQL-KRWDZBQOSA-N 392.446 2.748 0 50 GFAA c1cc(N2CCC(NCCn3nnc4ccccc43)CC2)cc(-n2cccn2)c1 20233920 ADYDBWPMAZTXJZ-UHFFFAOYSA-N 387.491 2.876 0 50 GFAA CC[C@@H]1CN(C(=O)CN2CCC[C@@H]2[C@H]2CCCN2Cc2ccccc2)CCO1 251859392 SPLJZHGLYWNQBJ-YPAWHYETSA-N 385.552 2.753 0 50 GFAA O=S(=O)(NCCc1ccc2c(c1)CCO2)c1ccc(OCC(F)F)cc1 252550156 SBNVHZPNSCXXOX-UHFFFAOYSA-N 383.416 2.786 0 50 GFAA CO[C@@H]1CCCN(C(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)C1 171121037 CHTKAZHKXQVWKJ-GOSISDBHSA-N 377.444 2.945 0 50 GFAA O=C([C@@H]1COc2ccccc2O1)N(CCCn1ccnc1)Cc1ccncc1 216021573 KBTWXQPZEHAYHR-FQEVSTJZSA-N 378.432 2.537 0 50 GFAA CCc1nnc(CNS(=O)(=O)C2=Cc3ccc(OC(F)F)cc3CC2)o1 253419573 PTIFPEBUNZQPRU-UHFFFAOYSA-N 385.392 2.640 0 50 GFAA COc1cc(F)c(CN2CCC([C@H](C)N3CCN(C)CC3)CC2)cc1OC 77302882 QRIKKCVMCLIRJL-INIZCTEOSA-N 379.520 2.691 0 50 GFAA C[C@H](NC(=O)CC1CCCCC1)C(=O)NC1CCN(Cc2ccccn2)CC1 153874377 NBENJIZEHDUKCO-KRWDZBQOSA-N 386.540 2.637 0 50 GFAA CCN1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)C[C@H]1c1ncc[nH]1 328630210 PPKORBCPSPXBSI-LBPRGKRZSA-N 389.308 2.784 0 50 GFAA Cc1csc(=O)n1CCC(=O)N1CCC[C@H](Cn2cnc3ccccc32)C1 364973198 GPYOQYQHWOFMKO-INIZCTEOSA-N 384.505 2.897 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2COc3ccc(C(=O)N(C)C)cc3N2C)c1O 71614470 YCTPZZFNBSAEAI-OAHLLOKOSA-N 383.448 2.628 0 50 GFAA O=C(Nc1cccc(-c2ncco2)c1)N1CC[C@H](Nc2ccc3nccn3n2)C1 434553944 ASFOBYILKZKEAN-INIZCTEOSA-N 389.419 3.103 0 50 GFAA CC(=O)NCCCC(=O)N1CCCN(Cc2ccc(F)cc2)[C@H](C(C)C)C1 72129280 HSJCLOFLPUNDNE-FQEVSTJZSA-N 377.504 2.801 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N2CCN(Cc3ccccc3)C(=O)C2)c1 72474114 CTOQECGYJXITCD-UHFFFAOYSA-N 380.488 2.875 0 50 GFAA O=C(NCc1csc(-c2cnccn2)n1)C1CCN(Cc2ccco2)CC1 220185429 SJLWZIYCCVVCEI-UHFFFAOYSA-N 383.477 2.722 0 50 GFAA O=C(NCCCN1CCC[C@@H](O)C1)c1ccc(-c2ccc3c(c2)OCO3)cc1 426668359 NKMUBLJQJARHAT-LJQANCHMSA-N 382.460 2.659 0 50 GFAA Cc1nc(CC2CCN(C(=O)N[C@H](CN3CCCC3)C(C)(C)C)CC2)no1 426489873 FWJUWQNCZTXGDT-QGZVFWFLSA-N 377.533 2.853 0 50 GFAA Cc1noc(C)c1[C@@H]1CCCN1C(=O)NCc1ccc2c(c1)n(C)c(=O)n2C 426546257 UWASQWYMGNFQRY-INIZCTEOSA-N 383.452 2.529 0 50 GFAA Cn1ccnc1[C@H](O)C1CCN(C(=O)Nc2cccc(-c3c[nH]cn3)c2)CC1 97499487 HLEOURKKVKBHII-GOSISDBHSA-N 380.452 2.788 0 50 GFAA CC(C)c1nc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)no1 91585933 GMHLJAYPLIGUEM-UHFFFAOYSA-N 383.496 2.993 0 50 GFAA O[C@@H](COc1ccccc1CN1CCC(F)(F)CC1)CN1CCSCC1 95524469 MUWGKYOPHUWJNL-QGZVFWFLSA-N 386.508 2.706 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1nc3ccccc3n1C)CC2 95525984 POGYJFVNLNVETI-UHFFFAOYSA-N 392.507 2.582 0 50 GFAA Cn1ncnc1[C@@H](NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)C1CC1 95360188 PFGKNGVUYSLGKU-INIZCTEOSA-N 380.418 2.939 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N(Cc1cocn1)Cc1cocn1 97759280 OMMCKUFQVPZZPC-UHFFFAOYSA-N 379.376 2.874 0 50 GFAA CN(Cc1ccccc1)c1ncc2c(n1)CC(C)(C)C[C@@H]2NC(=O)c1ncn[nH]1 91876671 AUKOYJRBXWKTPV-INIZCTEOSA-N 391.479 2.675 0 50 GFAA CN1C(=O)C[C@@H](C(=O)O)C12CCN(Cc1ccc(OC3CCCC3)cc1)CC2 95363275 WAQQSKCWIUWAMV-IBGZPJMESA-N 386.492 2.906 0 50 GFAA O=C(NC[C@@H](c1cccnc1)N1CCCCC1)c1cnc(-c2ccncc2)nc1 95354051 ZDQMQPKPTFPLCZ-FQEVSTJZSA-N 388.475 2.891 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)Cc3ccc(S(=O)(=O)C(C)C)cc3)C2)n1 180526942 DANSYKLMNVBKOZ-INIZCTEOSA-N 391.493 2.509 0 50 GFAA O=C(N[C@H]1C[C@@H](c2nnc(CO)n2C2CC2)C1)c1c[nH]nc1C1CCCCC1 244716018 LGXDBCQWQLKMFQ-OKILXGFUSA-N 384.484 2.552 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCCCc4ccccc4)c3CO2)cc1 263618307 SELKNAKJNUTZDC-FQEVSTJZSA-N 392.459 2.921 0 50 GFAA O=C(CC[C@]1(Cc2ccco2)CCC(=O)N1)NCc1nc2c(s1)CCCC2 299770481 SRSRLPCFROISKF-HXUWFJFHSA-N 387.505 2.903 0 50 GFAA CN1CCC(n2cc(NC(=O)NCc3cnc(O)c4ccccc34)cn2)CC1 923625414 JUIWVGOAQCDXJI-UHFFFAOYSA-N 380.452 2.725 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)CCS(=O)(=O)c1ccccc1 952983427 DWNVCUHKNDKXOV-UHFFFAOYSA-N 385.445 2.559 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)CC2CCC(C(F)(F)F)CC2)C1 275734156 PPVDXMFRSAACFX-NRXISQOPSA-N 399.461 2.850 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(C(=O)Cc3cc(OC)c(OC)c(OC)c3)C[C@@H]21 1704343821 ZVWKVRWQHNSUSZ-VWKPWSFCSA-N 377.481 2.655 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3nccc(N(C)C)n3)CC1)OCC2 1704311939 FZBZHQRCLJBOOD-UHFFFAOYSA-N 384.480 2.628 0 50 GFAA CCOC(=O)C[C@H]1CCCCN1C(=O)c1cc(Cn2ccnc2C(C)C)[nH]n1 11664141 TXFFADJGWRCTBC-MRXNPFEDSA-N 387.484 2.726 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@H]1CCOC(C)(C)C1 12076714 SQSALKFAGIHLDT-KRWDZBQOSA-N 382.508 2.977 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(C)n3)C2)cc1 12320565 WWINMTGXBYQKLR-KRWDZBQOSA-N 389.521 2.589 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)C3CCC3)CC2)C1 12594867 BYHKGHQKCKVHFU-NRFANRHFSA-N 397.563 2.848 0 50 GFAA O=C(CSc1ncccn1)N[C@@H]1CCCN(c2nc3ccccc3s2)C1 12708158 CLMPOQIBUUWRIZ-CYBMUJFWSA-N 385.518 2.964 0 50 GFAA CC[C@H](C)N1CCC2(CC1)C(=O)N(CCOC)C(=O)N2CCc1ccccc1 14534356 HZRYDFZEDRKTIF-SFHVURJKSA-N 387.524 2.773 0 50 GFAA CCOc1ccc(OCCSc2nc3ccccc3n2C[C@@H](O)CO)cc1 15659817 JJQQUASAUVTLCV-OAHLLOKOSA-N 388.489 2.959 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cs2)no1 16649300 UGHGJNDRVDQJPX-PHIMTYICSA-N 383.495 2.963 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)c2[nH]nc4c2C[C@H](C)CC4)C3)no1 19146002 CCIOALUVMFNPEX-LLVKDONJSA-N 392.463 2.795 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCCN(Cc2cccs2)CC1 19741542 YBTPDIOXSNXZJU-UHFFFAOYSA-N 399.495 2.875 0 50 GFAA CN1CCN(C(=O)/C(=C/c2ccc(Cl)cc2)NC(=O)c2ccccc2)CC1 19782149 CZNRMLFUROBSKK-CYVLTUHYSA-N 383.879 2.885 0 50 GFAA Cc1ccc(-c2nnc(CCC(=O)NCc3ccccc3-n3cncn3)o2)s1 19792331 XXXDLSSGCDNYGE-UHFFFAOYSA-N 394.460 2.936 0 50 GFAA O=C(CCC(F)(F)F)N1CC[C@]2(C1)CN(c1ncc3c(n1)CCCC3)CCO2 1857681521 MHVCRDWMSOQHHX-SFHVURJKSA-N 398.429 2.506 0 50 GFAA CNc1nccnc1N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1857713020 SETYURJNLIIUOL-UHFFFAOYSA-N 389.463 2.560 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2cnn(C)c2)c1 1857722003 BSLYXIZRFNQEIC-ROUUACIJSA-N 376.888 2.526 0 50 GFAA Cn1cc(C[C@H]2CCN(C(=O)CNC(=O)c3ccc(C(C)(C)C)cc3)C2)cn1 363591475 YSMVBBHHARPKHV-MRXNPFEDSA-N 382.508 2.539 0 50 GFAA COc1cccc(NC(=O)c2ccccc2NC(=O)c2nnn(C(C)(C)C)n2)c1 824983622 LIOMSOYOXZSYSZ-UHFFFAOYSA-N 394.435 2.941 0 50 GFAA Cc1cnc(-c2noc([C@@H]3CCCN(CC(=O)Nc4ccccc4)C3)n2)nc1 1875260327 AAWQJQGHGUUGJB-OAHLLOKOSA-N 378.436 2.653 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ncccc1Oc1ccccc1 1875401429 XYIKHZQMTLOPSE-CGTJXYLNSA-N 378.432 2.640 0 50 GFAA Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)NC[C@@]1(C)CCOC2(CCC2)C1 894652149 GPBSOYSHNRVKDC-IBGZPJMESA-N 377.485 2.845 0 50 GFAA COc1ccc([C@H](O)C(=O)N2CCCN(c3nc4ccccc4o3)CC2)cc1 2100542608 AQAYJXOUSANRSI-IBGZPJMESA-N 381.432 2.609 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3nc4ccccc4n3CC)C2)CC1 22853455 VAAFKTPINUFENW-GOSISDBHSA-N 399.539 2.795 0 50 GFAA C[C@H]1[C@H](C)[C@@H](C(=O)O)[C@H]1C(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 2325815735 MSNJXCPBLOZQLZ-KUDNYVPYSA-N 399.413 2.788 0 50 GFAA C[C@H]1NCCn2c(C(=O)N=c3[nH]nc(Cc4cccc(Cl)c4)s3)ccc21 2325856324 KYSWFLNTJLQKSW-LLVKDONJSA-N 387.896 2.922 0 50 GFAA CC[C@@]1(C(=O)O)C[C@H](C(=O)NCc2cccnc2)[C@H](c2ccc(F)cc2)N1C 67982747 ZNCDKXQMZRXLEP-WFXMLNOXSA-N 385.439 2.763 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2Br)cc1 797245 MDEBFGFCGFZBGZ-UHFFFAOYSA-N 386.223 2.957 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)[C@H]4C[C@@H](O)C4)C3)[C@@H]3CCCCN23)c1 2356142661 BLFNKPZQZHTLBE-SZAWYWIZSA-N 398.547 2.710 0 50 GFAA CCCCn1nc(C2CCOCC2)nc1[C@H]1OCC(=O)N[C@@H]1c1ccccc1 2356146238 XULUEJSADXUYRW-MOPGFXCFSA-N 384.480 2.901 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C(=O)c4ccc(-c5ccccc5)nc4O)C[C@@H]13)O2 2356152829 BURAJJUDVQSWFH-YNQURBJZSA-N 393.487 2.635 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2N2CCN(C(C)=O)CC2)cc1OC 6703751 KRAHUZKWUOXCFY-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2CCCC2(F)F)cc1Br 414334869 NVCMNCPYDJQRPR-QMMMGPOBSA-N 398.225 2.861 0 50 GFAA CC[C@H](C(=O)Nc1cccc(NS(C)(=O)=O)c1)N(C)Cc1ccccc1 225799555 RSMKTDQTOGFYNZ-GOSISDBHSA-N 375.494 2.907 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1cccc(I)c1)[C@H]1C=C[C@H]2C12CC2 101376630 GVCLEJYIORRMRZ-AAVRWANBSA-N 391.208 2.993 0 50 GFAA COc1ccc(-c2nc(CN3CCN(CCO)CC3)c(C)o2)c2ccccc12 67975696 BXZAPBALBRBBHO-UHFFFAOYSA-N 381.476 2.922 0 50 GFAA CS(=O)(=O)c1ccc(-n2nc(C3CC3)nc2Cc2ccc3c(c2)OCO3)cc1 65490905 YECFDRRGHBKGSQ-UHFFFAOYSA-N 397.456 2.868 0 50 GFAA CN(Cc1ccc2ccccc2n1)C(=O)c1ccc(N2CCC(O)CC2)nc1 20119482 HBFMCYYJPYQHPT-UHFFFAOYSA-N 376.460 2.863 0 50 GFAA COC(=O)[C@]1(N(Cc2ccccc2)C(=O)Cc2ccc(F)c(F)c2)CCOC1 328595514 XANZROOIFNLTFG-NRFANRHFSA-N 389.398 2.868 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)c4ccc[n+]([O-])c4)C3)C2)c1 12458388 GLELZTAYEFDHQN-JOCHJYFZSA-N 399.466 2.596 0 50 GFAA FC(F)(F)c1cn2c(n1)CC[C@H](CNc1ncncc1Br)C2 328615634 AYZWEAMMWXYWRJ-MRVPVSSYSA-N 376.180 3.129 0 50 GFAA Cc1cc2nc(C)c(CCC(=O)N[C@H](C[S@@](C)=O)c3ccccc3)c(C)n2n1 174317228 WWCHRWAGILMWDA-WHLCRQNOSA-N 398.532 2.823 0 50 GFAA COc1ncc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 71754796 UJMUOZLDVQNUFC-LJQANCHMSA-N 386.471 2.997 0 50 GFAA O=C(c1cnc(O)c(Br)c1)N1CCNC[C@@H]1c1ccccc1Cl 262061430 VXHPQMPOKJLRGK-CQSZACIVSA-N 396.672 2.990 0 50 GFAA O=C(c1cccc(F)c1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71575179 HFJBOYKCRFYXJM-GOSISDBHSA-N 387.499 2.765 0 50 GFAA O=c1[nH]nc([C@H]2CCCN(c3ncnc4sccc34)C2)n1-c1ccccc1 71416299 IPXDTMPXOPCJFE-ZDUSSCGKSA-N 378.461 2.949 0 50 GFAA O=C1CN(c2cc(Cl)c3cc[nH]c3n2)CCN1Cc1ccc2c(c1)OCO2 72408259 JEGRZASLTHXTKO-UHFFFAOYSA-N 384.823 2.794 0 50 GFAA CCc1nc(CN2CCC[C@@H](NC(=O)[C@H](C)Cc3ccc(OC)cc3)C2)no1 378275175 UNKHPZDEFZEQTN-NVXWUHKLSA-N 386.496 2.600 0 50 GFAA O=C(CN1CCC[C@H](C[C@@H]2CCOC2)C1)Nc1cccc(C(=O)NC2CC2)c1 378395659 MBMYEEJPRYQQJC-SJORKVTESA-N 385.508 2.656 0 50 GFAA CN(Cc1ccccc1)C(=O)[C@@H](NC(=S)N[C@@H]1CCCC[C@H]1N)C(C)(C)C 43763896 CNEVMNSDRMDKFO-KZNAEPCWSA-N 390.597 2.794 0 50 GFAA Nc1nccc(N2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n1 95524206 NNDIIOSQGVZEBC-UHFFFAOYSA-N 381.480 2.733 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)Nc2ccc3c(c2)CC(=O)N3)s1 96159827 CABPVKDIEBWBPL-CQSZACIVSA-N 384.461 2.971 0 50 GFAA CCCCn1nc(C)cc1NC(=O)N(Cc1cccnc1)C[C@@H]1CCC(=O)N1 95506108 CRUBPYYBZHHQCV-KRWDZBQOSA-N 384.484 2.699 0 50 GFAA COc1cncc([C@@H](NC(=O)CCc2nc3cc(F)ccc3[nH]2)[C@H]2C[C@@H](O)C2)c1 244874324 WZLHCCQNHVHKQW-HUTJROTASA-N 398.438 2.667 0 50 GFAA Cc1cccc2nc(CN(C)CCC(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)[nH]c12 244734762 NLKYHBAZGQFQJW-UHFFFAOYSA-N 378.436 2.502 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263616681 KAKGYSFHISLPHN-UHFFFAOYSA-N 384.439 2.971 0 50 GFAA COc1cccc(N2CCN(C(=O)NC3(Cc4ccccc4)CC3)CC2=O)c1 584885029 CEOBFJVVKRWSRI-UHFFFAOYSA-N 379.460 2.829 0 50 GFAA Cc1nc(N)nc(-c2cccc(C(=O)NCCCc3cnn(C)c3)c2)c1Cl 584900849 QLGBBYZLXCRKJQ-UHFFFAOYSA-N 384.871 2.784 0 50 GFAA O=C(CCNC(=O)[C@@H]1CCCN(Cc2ccco2)C1)Nc1cc(F)ccc1F 952982368 OVHZYBKJECANIA-CQSZACIVSA-N 391.418 2.915 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)Cn2cnc3ccsc3c2=O)cc1 952873079 FXNGTEXQJYRMRB-GFCCVEGCSA-N 382.445 2.612 0 50 GFAA Cc1cc(C)c(CNc2ncccc2S(=O)(=O)N2CCCCC2)c(O)n1 301494630 AEFTZAPRGVMYIW-UHFFFAOYSA-N 376.482 2.586 0 50 GFAA Cc1cc(CNC(=O)N2CC[C@@H](C)[C@@H](O)C2)ccc1I 408236124 NFFFYKJGXACQTH-YGRLFVJLSA-N 388.249 2.512 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 275560977 FRWILZCBJBDCLP-GFCCVEGCSA-N 380.279 2.712 0 50 GFAA CN(C)C(=O)[C@@H]1CCCN(C(=O)C2=Cc3cc(Br)ccc3OC2)C1 170599188 KBSCPHCCXDMVJS-GFCCVEGCSA-N 393.281 2.552 0 50 GFAA O=C(Nc1cccc2ocnc12)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 170610450 XZBGUPBXAGFIFN-GFCCVEGCSA-N 379.372 2.591 0 50 GFAA CC(C)(O)CN(C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1)C1CC1 188444250 MRHRDUPMRJBNBP-UHFFFAOYSA-N 390.509 2.900 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1 1529102108 WCNXMOHDZSAJTF-IEBWSBKVSA-N 378.476 2.758 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1 5007156 UNYRIFXSDNXVEU-UHFFFAOYSA-N 399.560 2.658 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)N[C@@H]1CCCN(c2ncccn2)C1 11814132 NLKFDDWPOVLEAY-MRXNPFEDSA-N 379.489 2.928 0 50 GFAA CCn1ccnc1CN(C)Cc1cnc(S(=O)(=O)C(C)C)n1CCC(C)C 11820206 LHVAYBHOOALZMO-UHFFFAOYSA-N 395.573 2.960 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)c3snnc3C)C2)cc1 14950585 PCGROZMGWXREOX-KRWDZBQOSA-N 388.537 2.882 0 50 GFAA CO[C@H](c1ccccc1)c1nnc(CCC(=O)N(CCO)Cc2ccccc2)o1 15066304 MGNTWIHJCFFSMS-OAQYLSRUSA-N 395.459 2.759 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)/C=C/c2ccncc2)CC1 15066930 GCTWSSZXZLRQNU-PVHVJQTOSA-N 398.551 2.714 0 50 GFAA Cn1c(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)nc2ccccc21 15077791 LGPXABUTNNOYMZ-QGZVFWFLSA-N 395.551 2.528 0 50 GFAA O=C1CCCN1c1ccc(CN[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 18093878 ZKDRQHHNBNOWSM-GOSISDBHSA-N 397.862 2.889 0 50 GFAA O=C(c1ccc([C@H]2CCCN2C(=O)c2ccncc2F)s1)N1CCOCC1 19114209 DJROVYIAXQMNRA-OAHLLOKOSA-N 389.452 2.732 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CC[C@H](N(C)C)C3)nc2)cc1 19300426 CUBHOPPSAFTPKA-IBGZPJMESA-N 382.508 2.593 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)Cc4ccc(Cl)cc4)CC3)nn2)n1 169777374 SYHNDRHJEABTDK-UHFFFAOYSA-N 386.843 2.696 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N[C@@H]4c5ccccc5C[C@@H]4O)CC3)nc2n1 1857712043 PLKHZSLSURHVGQ-PKOBYXMFSA-N 392.459 2.522 0 50 GFAA Cc1nccc(N2C[C@@H]3[C@H](CNC(=O)c4sccc4C)[C@H]4CC[C@]3(C2)O4)n1 1857721763 FAGZGMDRWSFSHP-QCBUCWTNSA-N 384.505 2.569 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)cc(C)n1 1857721947 NUNUDIWNEYXDBV-SFTDATJTSA-N 397.523 2.500 0 50 GFAA Cc1cc(C)c(CNC[C@H]2CCn3ncc(C(=O)N4CCOCC4)c3C2)c(C)c1 328608590 ZXELVNSGJKBJQZ-IBGZPJMESA-N 396.535 2.633 0 50 GFAA Cc1c(C(=O)N2CC[C@H](N)C[C@@H]2C)cnn1-c1cccc(Br)c1 237529096 JHEZJMHQFSVDED-FZMZJTMJSA-N 377.286 2.895 0 50 GFAA COC(=O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 135068560 RULINAWEYRMHHQ-GOSISDBHSA-N 383.400 2.932 0 50 GFAA in-vitro COCCc1cc(NC(=O)N[C@@H](c2ccc(OC)c(F)c2)C(F)F)n(C)n1 252499084 RVHDDBAVHBAXPL-HNNXBMFYSA-N 386.374 2.885 0 50 GFAA O=C(OCc1cccc2c1CCOC2)[C@H]1CCCN(C(=O)c2ccncc2)C1 869500164 BJCMENPVTQNQBX-KRWDZBQOSA-N 380.444 2.750 0 50 GFAA CCCN(CCN1CCN(CC)CC1)C(=O)c1cccc(NC(=O)C2CC2)c1 952846298 XACXKXBCGLWEDU-UHFFFAOYSA-N 386.540 2.525 0 50 GFAA COc1cc2nc(CN3CCc4c(ccnc4Cl)C3)nc(O)c2cc1OC 1875281799 XKOKXTWDQPONKL-UHFFFAOYSA-N 386.839 2.959 0 50 GFAA CC(C)[C@H](C(=O)NC[C@@H]1C[C@@H](CC(N)=O)CO1)c1cccc(C(F)(F)F)c1 1875310625 WDVFTRMMUTZTQU-NUTKFTJISA-N 386.414 2.842 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3cccc(NC(C)=O)c3C2)cc1 1875373760 NXUNCTRZCBLENE-UHFFFAOYSA-N 377.444 2.992 0 50 GFAA Cc1csc(-c2cccc(C(=O)N3C[C@H]4C[C@H]3[C@@H]4c3ocnc3C(N)=O)c2)n1 1875394470 JRZMBNIERJVDFC-QLFBSQMISA-N 394.456 2.834 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@]3(NC(=O)CC4(C)CCCC4)CCC[C@H]23)n1 1775990047 CCFXZCJMIRKOQU-HTAPYJJXSA-N 399.539 2.766 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2100473583 HEIXAQRHFZDJRT-HSZRJFAPSA-N 393.487 2.904 0 50 GFAA Cc1c(C(=O)N[C@@H]2CCC[C@@H](CN3CCC(O)CC3)C2)[nH]c2c1C(=O)CCC2 2100473612 LUAIPOFLRDATJR-HZPDHXFCSA-N 387.524 2.587 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc3nnc([C@H](O)C(C)C)n3c2)cc1 2100534338 DDXKAYMJZNIMIT-LJQANCHMSA-N 382.464 2.790 0 50 GFAA COC[C@]1(CN2C(=O)CCN(CCc3cccc4cc[nH]c34)C2=O)CCCCO1 2325779883 NAFZNWWKPMSYRL-JOCHJYFZSA-N 399.491 2.950 0 50 GFAA O=C([C@H]1CCc2nncn2CC1)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1 2325791025 KFGMJXKMZUPNCL-AWEZNQCLSA-N 396.882 2.859 0 50 GFAA CC(C)(C(N)=O)N1CCN(Cc2nc3cccc(F)c3n2-c2ccccc2)CC1 2325859937 QHPYBMYJYBHHOC-UHFFFAOYSA-N 395.482 2.546 0 50 GFAA COc1cc(NC(=O)NC[C@H]2Cc3ccccc3CN2)cc(-n2cccn2)c1 2325860038 VQCIXMRNZICGRV-GOSISDBHSA-N 377.448 2.717 0 50 GFAA CCC(CC)(CC)C(=O)N[C@H]1CC2(CN(C(=O)c3conc3C)C2)n2ccnc21 2332237644 FWOBFJJMXBWIGH-INIZCTEOSA-N 399.495 2.808 0 50 GFAA CS(=O)(=O)N1CCN(c2ccccc2NC(=O)c2cc3ccccc3o2)CC1 624219 OSFSNZKUXZLCAP-UHFFFAOYSA-N 399.472 2.767 0 50 GFAA CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)c1ccc(Cl)cc1 1076014 MZMGLJUIUCKCBB-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC4(CC3)OCCc3ccsc34)ccc2c1=O 2356139036 KRRXEKXWJDYYPI-UHFFFAOYSA-N 395.484 2.699 0 50 GFAA c1ccc2c(c1)ncn2Cc1nnc2sc(-c3ccc4c(c3)OCO4)nn12 2433756 SUJZOJZVJMWSMI-UHFFFAOYSA-N 376.401 2.980 0 50 GFAA CC(C)(C)c1nnc(SCC(=O)Nc2ccc(Br)cc2)n1N 2508679 BDOABZHJXPPRHU-UHFFFAOYSA-N 384.303 2.783 0 50 GFAA O=C(COc1ccc(F)cc1)N(CC1=CCS(=O)(=O)C1)c1ccccc1 2725728 JDIHVMOAYXPATR-UHFFFAOYSA-N 375.421 2.593 0 50 GFAA O=C(NCCc1cccnc1)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 110229575 LHSCFFWIEKGLPS-HXUWFJFHSA-N 389.455 2.904 0 50 GFAA c1cnc(-c2noc(Cn3ccnc3-c3ccc(-c4cc[nH]n4)s3)n2)nc1 77285890 ZVZLHDZUCUFECK-UHFFFAOYSA-N 376.405 2.890 0 50 GFAA CCc1ncc2c(n1)CN(C(=O)[C@@H](c1ccccc1)N1CCCCC1=O)CC2 119089503 BLNQKGJIGVMOQX-OAQYLSRUSA-N 378.476 2.678 0 50 GFAA Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1 252499632 SDCJVFIJOSIAFU-UHFFFAOYSA-N 385.464 2.835 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)N1CCC[C@H](Nc2ccc(F)c(F)c2)C1 11813189 OKGZPVNTNFDEGM-AWEZNQCLSA-N 399.397 2.664 0 50 GFAA CCOC(=O)N1CCC(N2CCN(CC3CCCCC3)[C@H](CCO)C2)CC1 39445001 MAXSBCXMDXNYPL-HXUWFJFHSA-N 381.561 2.556 0 50 GFAA C[C@H](NC(=O)CN1CCSC[C@H]1C(=O)OC(C)(C)C)c1ccc(F)cc1 253370488 RKEFOGGRFSFQAZ-BBRMVZONSA-N 382.501 2.762 0 50 GFAA CN1C(=O)[C@@](CC(=O)N(C)C2CCNCC2)(Cc2ccccc2)c2ccccc21 71774412 AHTSDOAIEBDHHW-XMMPIXPASA-N 391.515 2.744 0 50 GFAA O=C(NCCN1CCC(c2ccccc2)CC1)c1ccc(-n2cnnc2)cc1 216165570 YCGVRXWRZYRRAV-UHFFFAOYSA-N 375.476 2.877 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)cc1 72115645 RSTXZRCDDAVDEI-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA COc1cccc(CN2CCC[C@H](Nc3cncc(C(=O)N4CCCC4)n3)C2)c1 72426966 OXEYTYPABQZKQW-SFHVURJKSA-N 395.507 2.798 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)c4ccc(C)c(C)c4)CC3)ncn2)n1 72437620 SNBHFXONNXPBQN-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA Cn1nc(NC(=O)COCc2ccccc2)c2c(N3CCOCC3)cccc21 72428179 QPFITNHSCWNSEM-UHFFFAOYSA-N 380.448 2.565 0 50 GFAA O=C(c1c[nH]nc1-c1cccc(OC(F)F)c1)N1CCN2CCCC[C@H]2C1 173889087 DJRWPWGNBPBYDK-AWEZNQCLSA-N 376.407 2.988 0 50 GFAA CCc1cc(N2CCC(NC(=O)N(C)Cc3ccccc3OC)CC2)ncn1 175476136 HHPJDBGRNWTYLJ-UHFFFAOYSA-N 383.496 2.858 0 50 GFAA CNC(=O)OC[C@@H]1CCCCN1C(=O)c1ccc(-n2cnc3ccccc32)nc1 288845546 AWUMLXUJGFCKPU-INIZCTEOSA-N 393.447 2.771 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1c(F)cccc1Cl 177580533 WULNGONZVLMMFD-JTQLQIEISA-N 382.844 2.805 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@@H](C)CN(C)C)csc2C1 426489657 PABKTEHQPOCSPZ-LBPRGKRZSA-N 376.526 2.591 0 50 GFAA CC(=O)c1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)s1 95361427 DRJXWMNADIKNLB-GOEBONIOSA-N 383.473 2.723 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccn(C)n3)CC2)C[C@H](c2ccccc2)C1=O 92036944 CSJRXAORILEQLU-GOSISDBHSA-N 380.492 2.679 0 50 GFAA O=C1COc2ccc(C(=O)N[C@H]3CCN(c4ccc(F)c(Cl)c4)C3)cc2N1 180347501 QMQZNFLCBJNCGJ-LBPRGKRZSA-N 389.814 2.819 0 50 GFAA C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N(CC(=O)O)C1CCOCC1 299747314 CONPHDRJSLLPSL-SNVBAGLBSA-N 376.236 2.853 0 50 GFAA O=c1c2c(CO)c(-c3ccccc3)nn2ccn1Cc1nc(-c2ccccc2)no1 263617658 OWQNQKHGNRJRPT-UHFFFAOYSA-N 399.410 2.754 0 50 GFAA CC[C@@H]1CN(CC(=O)NCC[C@H]2CCCN2C)Cc2ccc(Cl)cc2O1 299771515 PXHRDUSIZPMQND-QZTJIDSGSA-N 379.932 2.914 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@@H](C)CNC(=O)CCN2CCCCCC2=O)n1 952990724 WMZYQUJDVDTHGV-ZDUSSCGKSA-N 388.434 2.755 0 50 GFAA Ic1cc(I)c2c(n1)CCCO2 66054252 TXCMSZYABRJNDO-UHFFFAOYSA-N 386.958 2.616 0 50 GFAA in-vitro CC[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2C(=O)N2c3ccccc3C[C@@H]2C)C[C@H]1O 408022366 WMFYLLHAPSGPDC-JZYLZAGLSA-N 384.520 3.000 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC(Cn3ccnn3)CC2)ncn1 275709862 NZCPMOLXIXNEHX-PXNSSMCTSA-N 385.516 2.600 0 50 GFAA COc1ccc([C@H](NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C(F)F)cc1F 170605719 VKANFAAWWXUFMP-BBRMVZONSA-N 384.398 2.905 0 50 GFAA O=C([C@H](Cc1cnc[nH]1)n1cccc1)N1CCCN(Cc2ccc(F)cc2)CC1 1506420969 RJRYNNWYZCUQFM-NRFANRHFSA-N 395.482 2.869 0 50 GFAA Cc1c(S(=O)(=O)N2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@H]32)cnn1C 1506406742 OJNFSNYZKOJUBA-NLWGTHIKSA-N 389.521 2.570 0 50 GFAA CN(C)C(=O)c1cncc(N2CCCN(c3nc4ccccc4s3)CC2)n1 1506399052 JTCWODMBIWEILW-UHFFFAOYSA-N 382.493 2.505 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3scnc3C)C[C@@]2(CCc2ccccc2)C1 1772811177 QSVBPKSYJANCLK-UGKGYDQZSA-N 399.560 2.991 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCC3(CCN(Cc4ccsc4)CC3)O2)n(C)n1 12002971 HMFHPVZEPSVDOX-QGZVFWFLSA-N 388.537 2.734 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccn2)cc1 12303050 LFUOKHWUDLHDMM-HXUWFJFHSA-N 389.459 2.748 0 50 GFAA O=C(CCC1CCN(C(=O)c2ccc3c(c2)OCO3)CC1)NCc1cccnc1 12448210 NLAWDGZAOQTKRX-UHFFFAOYSA-N 395.459 2.759 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12717159 MEJBAYUXHPMTHD-KRWDZBQOSA-N 398.434 2.652 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@H]1CCCN(CCc2ccccc2F)C1 14981183 NWHPPDLWPNBJOT-QGZVFWFLSA-N 378.488 2.882 0 50 GFAA Cc1cccc2nc(C(=O)N3CCN4C(=O)OC[C@]4(Cc4ccccc4)C3)cn12 1857671617 LNPNGYDFRQWCJI-QFIPXVFZSA-N 390.443 2.532 0 50 GFAA CC(=O)N[C@@H](CC(C)C)C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857701472 QRIYUPZBIJKXNG-IBGZPJMESA-N 382.508 2.565 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC(O)(C(F)(F)F)CC2)ncn1 328628832 HPMOADCQDLVBFL-CJNGLKHVSA-N 388.434 2.986 0 50 GFAA FC(F)COCCN1CC[C@](c2nc(-c3ccccn3)no2)(C(F)(F)F)C1 952891153 BHYBWRPQLAYTBZ-HNNXBMFYSA-N 392.328 2.919 0 50 GFAA O=C(NC[C@H](O)CCc1ccccc1)N[C@@H]1Cc2n[nH]cc2[C@@H](C(F)(F)F)C1 1875276634 KHWTVYWLGGZDAI-LZWOXQAQSA-N 396.413 2.663 0 50 GFAA O=C(O)[C@@H](CC1CC(F)(F)C1)NC(=O)[C@@H](c1ccccc1)N1CCCCC1=O 1875305556 FDFQTRXQFWGSAN-NVXWUHKLSA-N 394.418 2.745 0 50 GFAA CCS(=O)(=O)c1cccc(CNC(=O)N2CCOc3cc(F)ccc3C2)c1 888099913 CMAIWGYCPPLIJZ-UHFFFAOYSA-N 392.452 2.724 0 50 GFAA CCc1nc(C)c(C(=O)N[C@]23CCC[C@H]2CN(C(=O)c2ccc(C)n2C)C3)o1 1775996923 NJNSHPCKHPWZRK-BTYIYWSLSA-N 384.480 2.617 0 50 GFAA O=C(c1cccnc1O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100540040 AOFPOLHFWVLRCP-QFIPXVFZSA-N 379.460 2.627 0 50 GFAA NC1CCN(C(=O)c2ccc(-c3ccc(Cn4cccn4)c(F)c3)nc2)CC1 2325796795 MLKAFMDVRRYFKO-UHFFFAOYSA-N 379.439 2.696 0 50 GFAA C[C@H](Cc1ccc2c(c1)OCCO2)NC(=O)[C@H]1CCc2nnc(C(C)(C)C)n2C1 2325807557 CDWZFZBIXXVUHS-ZBFHGGJFSA-N 398.507 2.657 0 50 GFAA CCc1ccccc1Oc1ccc(Cl)cc1CNC[C@@H](O)CNC(N)=O 2325861093 FOZOUIQLFFHDTF-MRXNPFEDSA-N 377.872 2.814 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)Cc2cc(Br)ccc2F)CC1 2325884157 ZAWFAGQJCZETBF-UHFFFAOYSA-N 383.261 2.971 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)CCCN1C(=O)c2ccccc2C1=O 846629 AHHKELGCYSKECE-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA COc1ccc(NC(=O)C[C@H]2C(=O)N(C)C(=S)N2CCc2ccccc2)cc1 1185143 LJHPZZGRGZLJAI-SFHVURJKSA-N 397.500 2.694 0 50 GFAA COc1ccccc1C1=NO[C@H](C(=O)Nc2ccc(Br)cn2)C1 20601976 XWIIWGFWRHFSME-AWEZNQCLSA-N 376.210 2.984 0 50 GFAA CCC(=O)c1ccc(OCC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1 6287852 RWOLOVLSTKEKJD-UHFFFAOYSA-N 376.359 2.691 0 50 GFAA COC(=O)CCc1nc(CSc2nc(C3CC3)n(-c3ccccc3)n2)no1 110135546 DKJDBKHDHMNLEU-UHFFFAOYSA-N 385.449 2.926 0 50 GFAA CC[C@H](CO)N(Cc1ccccc1C)C(=O)Cn1cnc2ccccc2c1=O 55341654 FZHDPUQFTLJKNI-GOSISDBHSA-N 379.460 2.505 0 50 GFAA O=C(CN1CCN(c2cccc(Cl)c2)CC1)Nc1ccc2c(c1)OCCO2 52537388 LOVPRGAMWARQBD-UHFFFAOYSA-N 387.867 2.872 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)[C@@H]2C[C@@H]2c2cccnc2)c1 133959687 MRRBWDZMAUFKGK-ZIAGYGMSSA-N 378.837 2.546 0 50 GFAA Cc1nn(C)c(Cl)c1CN1CCN(c2nnc(C(F)(F)F)s2)CC1 65525982 VRPRICDRDAXTIE-UHFFFAOYSA-N 380.827 2.574 0 50 GFAA O=C(O)CCN1CCC(n2nccc2NC(=O)c2ccccc2Cl)CC1 67643204 HYZPWYGCCFRZPH-UHFFFAOYSA-N 376.844 2.900 0 50 GFAA COc1ccccc1C(=O)Nc1ccc(NC(=O)CN2CCOCC2)c(C)c1 20725683 DTYKFHHJFLPOPC-UHFFFAOYSA-N 383.448 2.527 0 50 GFAA CN(C)c1cnc(-c2noc([C@@H]3CCC(=O)N(C)[C@H]3c3ccccc3)n2)cn1 350541855 BKOOHMOXZIBIFM-KDOFPFPSSA-N 378.436 2.670 0 50 GFAA O=C(NO[C@H]1CCCCO1)c1nn(Cc2ccccc2)c(=O)c2ccccc12 120232228 OTXNQEYIEJOCFM-SFHVURJKSA-N 379.416 2.633 0 50 GFAA Cc1c(NC(=S)NC(=O)Cc2ccccc2)c(=O)n(-c2ccccc2)n1C 2570207 QBGSQOPWAUNIAF-UHFFFAOYSA-N 380.473 2.540 0 50 GFAA CON1C(=O)[C@H]2[C@H](C1=O)[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 216048835 MIUSIGVYOUEARI-MJGDXUOZSA-N 399.872 2.995 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(Cc3csc(CC)n3)CC2)cn1 151548648 PRQDYICWXZFOSF-UHFFFAOYSA-N 375.498 2.849 0 50 GFAA CC1(C)Cc2cccc(OCC(=O)N[C@H]3CCN(c4ncccc4F)C3)c2O1 153390141 VRCKRQPRIWBTCU-HNNXBMFYSA-N 385.439 2.708 0 50 GFAA CCOc1ccccc1CN1CCNC(=O)[C@@H]1CC(=O)N1CCCCCCC1 14949485 VBPSOVWRNPGWGM-IBGZPJMESA-N 387.524 2.569 0 50 GFAA CSc1ccccc1CN1CCC[C@](O)(CNC(=O)N2CCCC2)CC1 72137049 IEDSZPGWOMDJHR-HXUWFJFHSA-N 377.554 2.931 0 50 GFAA COc1cc(CNC(=O)c2cccc(CS(C)(=O)=O)c2)c2ccccc2n1 172766404 ZCYRBPVWQBWSQG-UHFFFAOYSA-N 384.457 2.718 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc(NC(=O)OCC(F)(F)F)cc2)C2(CCC2)N1 282618544 FIOJXMOLOVIODL-CYBMUJFWSA-N 399.369 2.729 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccn(-c2ccccc2F)n1 130070631 AAZJNMFSJMSSCU-LJQANCHMSA-N 392.434 2.932 0 50 GFAA Cn1ccnc1[C@@H](O)c1cc2n(n1)CCN(Cc1ccc(F)cc1Cl)C2 221357285 WKIMOSRVUNAAEY-KRWDZBQOSA-N 375.835 2.507 0 50 GFAA C[C@H](N1CCN(C(=O)NCc2ccccc2-n2ccnc2)CC1)C(F)(F)F 175980027 HAJJLTUTLNPBNU-AWEZNQCLSA-N 381.402 2.650 0 50 GFAA CN1CCN(CC2CCN(C(=O)NCCc3ccccc3Cl)CC2)CC1 192162680 PDOXLSRXBLBIRE-UHFFFAOYSA-N 378.948 2.552 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N1CCCCCC1 239173612 OHDRKYIAFNMZNY-ALGQRKQJSA-N 392.499 2.807 0 50 GFAA O=C(NCc1nnc2ccc(C(F)(F)F)cn12)N1C[C@H]2CSC[C@@H](C2)C1 911819400 DAEYVJQXDCUQSJ-QWRGUYRKSA-N 385.415 2.643 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)Nc3c4c(nn3C)CCC4)cn2)c1 95496867 ZGHNHHCJEFUKMF-UHFFFAOYSA-N 380.452 2.767 0 50 GFAA Cc1ccn2c(F)c(C(=O)N3CC[C@@]4(CCCN(CC5CC5)C4=O)C3)nc2c1 91644685 BWKLDAHVKJSSQE-NRFANRHFSA-N 384.455 2.647 0 50 GFAA CSc1cccc(NC(=O)N2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)c1 91830403 URQFRJRLZOMKHP-LJQANCHMSA-N 376.526 2.569 0 50 GFAA O=C1C[C@@H](CNC(=O)N2CCC[C@H]2c2ccncc2)CN1Cc1ccccc1 179304234 AIMYLUDYWKDEGE-ICSRJNTNSA-N 378.476 2.977 0 50 GFAA Cc1ccccc1[C@]1(O)CCN(C(=O)NCCc2nc3ccccc3n2C)C1 426360031 XYLQMIIPXXKRMR-QFIPXVFZSA-N 378.476 2.727 0 50 GFAA C[C@@H](c1ccc(F)cc1)N1CC[C@@H](N2CCn3c(nnc3C(F)(F)F)C2)C1=O 293048326 KIPSDLLURLFZOI-SMDDNHRTSA-N 397.376 2.614 0 50 GFAA COc1cc(C(=O)N2CCC[C@H](c3nccn3Cc3ccccn3)C2)ccn1 95500182 UKQQUQWHQIRRMG-KRWDZBQOSA-N 377.448 2.750 0 50 GFAA CCc1cccc(CC)c1NC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31 239433122 XFZPBVOYCCNMOD-BUJXUYPKSA-N 378.472 2.803 0 50 GFAA COCCNC(=O)[C@@H]1C[C@@H](NCC2CCCCC2)CN1C1Cc2ccccc2C1 23362953 DOVDURPTRILEDU-GGAORHGYSA-N 399.579 2.529 0 50 GFAA C[C@H](NS(C)(=O)=O)c1nc(Cc2cccs2)nn1Cc1ccccc1 96139050 RFKYYDIIPXFEBR-ZDUSSCGKSA-N 376.507 2.589 0 50 GFAA Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N1CCCC[C@@H]1CN 299738640 DLGOIUIPCGGRMP-OAHLLOKOSA-N 395.429 2.785 0 50 GFAA Cn1nc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1OC(F)F 184351494 PHPLKTGSASLMCG-UHFFFAOYSA-N 393.419 2.594 0 50 GFAA COc1ccc(-c2noc(CNC(=O)N3CCC(F)(F)CC3)n2)cc1OC 534653794 FRHSOFPIFHJBCJ-UHFFFAOYSA-N 382.367 2.695 0 50 GFAA CN(CC(=O)NC1CCN(Cc2ccccc2Cl)CC1)Cc1cccnc1 952982853 RHMLBGXVZPFSII-UHFFFAOYSA-N 386.927 2.948 0 50 GFAA Cc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1cnc2ccccn2c1=O 952967469 LMUKIOZOTQLRAN-SFHVURJKSA-N 377.444 2.824 0 50 GFAA OC[C@H]1C[C@@H](CN2CCOCC2)CN(Cc2ccc(-c3ccccc3F)o2)C1 1565531263 WTJNPRGURYCFOF-ROUUACIJSA-N 388.483 2.848 0 50 GFAA COCn1nc(C)c(S(=O)(=O)N(C)Cc2ccc(OC(F)F)cc2)c1C 170596401 YYOCXNVIRNCARO-UHFFFAOYSA-N 389.424 2.526 0 50 GFAA CC(C)(C)OC(=O)N1CCN(CCCNc2nnc(-c3ccon3)s2)CC1 170603412 IWMLGXCMGZNIKC-UHFFFAOYSA-N 394.501 2.548 0 50 GFAA NC(=O)N1CCCN(C(=O)CC23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)CC1 170617339 JZHQROIXPHDKHG-JDPPGYRCSA-N 398.345 2.723 0 50 GFAA C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN(c2cc(C3CC3)n[nH]2)CC1 189681886 UVCAZVACYZGLDV-HNNXBMFYSA-N 385.487 2.768 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NCCc3nnc(-c4ccccc4)o3)c2O1 192641178 XXEVUUNSALQUHV-UHFFFAOYSA-N 399.472 2.971 0 50 GFAA C[C@@H](NC(=O)c1cn2ccccc2n1)c1cc(F)ccc1N1CCC(O)CC1 748073151 VQYXIMQLGLSSDR-CQSZACIVSA-N 382.439 2.926 0 50 GFAA Cc1ccc(OCCN(C)c2nccc(N3CCC[C@H](O)C3)n2)c(Cl)c1 1529174767 XWNBDZUEXXBSSG-HNNXBMFYSA-N 376.888 2.915 0 50 GFAA Cc1ccccc1OCC(=O)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529173625 ZPCPIBJOOFXWKI-NQIIRXRSSA-N 376.456 2.984 0 50 GFAA CCn1cc(C(=O)N2CCN(c3ccccc3)CC2)c(=O)c2ccc(C)nc21 12322370 ZEMBHHOCMUVAOB-UHFFFAOYSA-N 376.460 2.687 0 50 GFAA O=C(NCCCOc1cccnc1)[C@H]1CCC(=O)N(Cc2ccccc2F)C1 12448871 SVDAYAHOUMTGFR-KRWDZBQOSA-N 385.439 2.545 0 50 GFAA CCOC(=O)C1CCN(C(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)CC1 12596300 FITZRBIBDFKXJI-GOSISDBHSA-N 378.513 2.607 0 50 GFAA COCCc1noc(CN(C)C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)n1 152631382 WGCACVLETMKMQO-UHFFFAOYSA-N 375.816 2.574 0 50 GFAA Cn1nc(C2CC2)cc1C(=O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857696757 BJFUCFJWADRJNS-QFIPXVFZSA-N 393.491 2.791 0 50 GFAA CN1CCC[C@]2(CO)CCN(c3cc(Sc4cccs4)nc(N)n3)C[C@@H]12 1704309606 YIQFPHVLVMWCNQ-FZKQIMNGSA-N 391.566 2.555 0 50 GFAA CNC(=O)C1(NC(=O)c2nc3ccccc3cc2Br)CCCC1 808346433 ZTVIHQAMABLOQW-UHFFFAOYSA-N 376.254 2.786 0 50 GFAA CCC(CC)(CO)CNC(=O)Nc1ccc(C(=O)OC[C@@H]2CCCN2)cc1 841279430 LKYBWVGZLUYIMX-KRWDZBQOSA-N 377.485 2.516 0 50 GFAA CCn1ncc(C(=O)N2CCC(=O)N(C)c3ccccc32)c1Br 820135894 XBMBWQVHHHLFRB-UHFFFAOYSA-N 377.242 2.679 0 50 GFAA Cn1ncc(CNC(=O)N[C@H]2CCCCc3cc(Br)ccc32)n1 852337150 YDZAVQCEHOPCCX-HNNXBMFYSA-N 378.274 2.845 0 50 GFAA NC[C@H]1CCCC12CCN(C(=O)[C@H](Cc1ccccc1)N1CCCOC1=O)CC2 1875277778 FWIVFQHDMXHJHV-UXHICEINSA-N 399.535 2.808 0 50 GFAA C[C@@H](c1nc(-c2cccc(S(C)(=O)=O)c2)nn1CC(C)(C)CO)C1CC1 1875330996 KWBPNTSOOGDQEN-CYBMUJFWSA-N 377.510 2.881 0 50 GFAA CCOc1cc(C(=O)N2C[C@H]3C[C@H]2[C@H]3c2ocnc2C(=O)N(C)C)ccc1C 1875394580 NWRWOXMLSLWJIF-VYDXJSESSA-N 383.448 2.712 0 50 GFAA Cc1ccc(C(=O)N[C@H]2[C@@H]3CN([C@@H]4CCN(c5ccc(Cl)cc5)C4=O)C[C@@H]32)o1 1875325515 NXAFMENGIRAGCP-NTDBWNAOSA-N 399.878 2.707 0 50 GFAA O=C(N[C@H]1[C@@H]2CN(C(=O)[C@H]3CCN(c4ccccc4)C3)C[C@@H]21)c1ccc(F)cc1 1875325558 OZVABSSPTZMMET-VRXWPRPYSA-N 393.462 2.539 0 50 GFAA Cc1oc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc1COc1ccccc1 1875402887 NHFYWTZQIQHISY-NSISKUIASA-N 395.459 2.933 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccc(N)c3)n2C)cc1 1183354 GGERSNJDFSPKEO-UHFFFAOYSA-N 397.460 2.582 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)c2nc3ncccc3[nH]2)CC1 2356134979 KZWLYINHNPFGOC-UHFFFAOYSA-N 378.432 2.671 0 50 GFAA COCCN1C(=O)N(c2cccc(C)c2)C(=O)[C@@H]1CC(=O)Nc1ccc(F)cc1 2891141 YHDDLOUMCRPKFH-SFHVURJKSA-N 399.422 2.947 0 50 GFAA O=C(c1cc(Cc2ccccc2)ccc1O)N1CCO[C@H](Cn2cccn2)C1 111650090 YKKNEXYAEAMDNU-IBGZPJMESA-N 377.444 2.721 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N2CCC[C@@H](CN3CCCC3)C2)[nH]n1 20204512 UNOUQKWCPKZVCO-KRWDZBQOSA-N 384.528 2.726 0 50 GFAA Cc1ccc(NCCNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)nn1 65363171 SQDZASJYOTXVEA-UHFFFAOYSA-N 384.461 2.968 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)c2ccccc2-c2ncn[nH]2)s1 23582117 NCTIIMCPHWMOIY-CQSZACIVSA-N 381.461 2.870 0 50 GFAA COc1cccc(NC(=O)CN2CCC[C@H](Cc3nnc4ccccn34)C2)c1 252527420 CNMHDVPVQAWWHS-MRXNPFEDSA-N 379.464 2.631 0 50 GFAA NC(=O)c1cc(C(=O)N2C[C@H]3CCC[C@@]3(c3nc(-c4ccccc4)no3)C2)co1 328605200 MJTCDGXXMJWNEL-QVKFZJNVSA-N 392.415 2.622 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)[C@@H]2CC(Cc3cccc(F)c3)=NO2)C1 11787860 NZKWDACZBCHERY-LPHOPBHVSA-N 389.471 2.620 0 50 GFAA CC(=O)c1cccc(O[C@@H](C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1 152200756 BFKISVJREFQPSX-UWJYYQICSA-N 394.471 2.964 0 50 GFAA Cc1c(CC(=O)N2CCC[C@@H](O)C2)c2c(n1Cc1ccccc1)CCCC2=O 39445425 KJJKUTCTUWDCSL-GOSISDBHSA-N 380.488 2.890 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)N1CCC(C(=O)N2CCC[C@@H]2CO)CC1 154037488 XDUBTUWFLRGIHB-MRXNPFEDSA-N 384.398 2.541 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)c2ncn(-c3ccccc3)n2)C1 154047266 OGJNGXHTXXYHBP-INIZCTEOSA-N 377.448 2.532 0 50 GFAA C[C@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCc3ccccc32)CCN1 155105823 LLCHWQRAHMNVBZ-INIZCTEOSA-N 395.528 2.802 0 50 GFAA COc1ccc(NC(=O)Cn2ncc(N3CCCC3)c(Cl)c2=O)cc1Cl 72115531 BYSGFSOPBXFANO-UHFFFAOYSA-N 397.262 2.798 0 50 GFAA COC(=O)c1ccc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)cc1 36385654 HUTXIKDFPYKCCC-JOCHJYFZSA-N 382.504 2.585 0 50 GFAA CCOCC(=O)Nc1nn(-c2ccc(F)cc2)c2cccc(N3CCOCC3)c12 77439823 HPUWCITYMVRXQH-UHFFFAOYSA-N 398.438 2.976 0 50 GFAA O=C(O)CCN(C(=O)c1ccc(N2CCCCCC2)nc1)C1CCOCC1 370734279 CNQRXPFBILQAKG-UHFFFAOYSA-N 375.469 2.558 0 50 GFAA Cc1cc(N2CCC(N(C)C(=O)CCc3ccc(C(=O)O)cc3)CC2)nc(C)n1 237288127 ZBRZGSXMENIBHE-UHFFFAOYSA-N 396.491 2.852 0 50 GFAA C[C@@H]1CCO[C@@H]1C(=O)NC[C@]1(C)C[C@H](NC(=O)[C@@H]2OCC[C@H]2C)CC(C)(C)C1 241644384 PQHRHACFUFRSPA-NVKOURDFSA-N 394.556 2.654 0 50 GFAA CC(C)N(C)C(=O)CN1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426519357 WOHIIFJUXBEAJG-NRFANRHFSA-N 393.478 2.646 0 50 GFAA COCCn1cncc1CNC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)no1 426477307 AIUWLOBPTNXNOK-KRWDZBQOSA-N 396.451 2.626 0 50 GFAA Cc1cc(O)c2cccc(C(=O)N3CCC([C@H](O)c4nccn4C)CC3)c2n1 426478155 SBGOBWUKISWVIE-IBGZPJMESA-N 380.448 2.568 0 50 GFAA CCOCCOc1ccccc1C(=O)N1CCN(c2ccc(C)cc2)C(=O)C1 82139207 TUSNEYDLVMGXOU-UHFFFAOYSA-N 382.460 2.899 0 50 GFAA O=C(NCCCN1CCC[C@@H](O)C1)N1CCC(Cc2ccccc2F)CC1 426427921 IXWGRKWHVVBPLI-LJQANCHMSA-N 377.504 2.637 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2ncc(F)cc2F)C1 95508806 LKTKCOGCWNASIQ-AWEZNQCLSA-N 377.439 2.528 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1onc2c1CCCC2 426632845 HKMIZGIDVSNPQM-UHFFFAOYSA-N 383.496 2.828 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)NCc1ccccc1-n1ccnc1)CC(=O)N2 91974048 AEQJPDJWBTUKFS-QGZVFWFLSA-N 376.416 2.623 0 50 GFAA Cc1cc(C)nc(N2CCN(C(=O)c3ccc([C@H]4CCCNC4)cc3)CC2)n1 95352413 FYFXZTVDZWJBPF-FQEVSTJZSA-N 379.508 2.523 0 50 GFAA CCOc1ccc(CN2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)cc1Cl 91859177 WJKUVWKKOIDQCA-FQEVSTJZSA-N 379.932 2.867 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccn(-c2ccc(F)cc2)n1 299743335 KIDJATWPCHPJHE-IBGZPJMESA-N 379.391 2.592 0 50 GFAA CSc1ccc2c(C)cc(-n3nc(CC(N)=O)nc3C3CCOCC3)nc2c1 1940193412 ZTVGAZBAXBEVBU-UHFFFAOYSA-N 397.504 2.768 0 50 GFAA COCCCN1C(=O)N(Cc2ccc3ccccc3c2)C(=O)C12CCNCC2 299788385 OWDOJFYBROAZNR-UHFFFAOYSA-N 381.476 2.763 0 50 GFAA Cc1cc(-c2cccc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)c2)cn2ccnc12 584891877 BMKBYIVQKMQTEF-SFHVURJKSA-N 383.473 2.569 0 50 GFAA COC(=O)c1cc(NC(=O)[C@H]2CCOc3c(F)cccc32)cc(C(=O)OC)c1 1350595685 DMHCVRBUEOVARR-HNNXBMFYSA-N 387.363 2.904 0 50 GFAA O=C(O)[C@H]1CN(Cc2cn(-c3ccccc3)nc2-c2cccs2)CC[C@H]1O 1529153089 PVHBVLCOXPMFAJ-DLBZAZTESA-N 383.473 2.868 0 50 GFAA CN(CCCOc1ccccc1Cl)Cc1cnc(N2CCOCC2)nc1 952967530 JYZZQKPTWQTDDK-UHFFFAOYSA-N 376.888 2.868 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)[C@H](c2ccccc2)C1 273709814 LBGPLUCVSGFXQV-KRWDZBQOSA-N 394.880 2.716 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1cn(-c2cccc(Cl)c2)nn1 188464076 PTAXSTJDFIZDOI-UHFFFAOYSA-N 396.882 2.710 0 50 GFAA O=C(c1cccc(-c2cccc(F)c2)c1)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1529146005 SZYXNAVMJUWUBJ-WIYYLYMNSA-N 377.419 2.958 0 50 GFAA CCC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)C[C@H]1O 1772701521 QSUMJUIXWCPJPD-APWZRJJASA-N 383.510 2.611 0 50 GFAA CCCNC(=O)N1C[C@@H]2CN(Cc3ncc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772810642 NONSMIYTOLYTCV-UGKGYDQZSA-N 381.524 2.896 0 50 GFAA Cc1cc(OCc2cc(C(=O)N[C@H]3CCCCNC3=O)no2)cc(C)c1Cl 12458358 FZIOYBOQBVUKMQ-HNNXBMFYSA-N 391.855 2.922 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@H](CNC(=O)c3cccnc3)C2)c(C)s1 12714226 GDZXSFKCRDAFFN-OAHLLOKOSA-N 393.534 2.591 0 50 GFAA O=C(NC[C@H]1CCCO1)[C@@H]1C[C@H](CN2CCCC2)CN(CCc2ccccc2)C1 14748960 NNKNPPJVZBFWQP-DNVJHFABSA-N 399.579 2.558 0 50 GFAA CC(C)OCCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14749750 AWNGQBBBALNJIV-LJQANCHMSA-N 398.551 2.954 0 50 GFAA CCCCCOc1cc(C)c(C)cc1S(=O)(=O)N1CCC(C(N)=O)CC1 16648610 FUZVIJGKOJMITE-UHFFFAOYSA-N 382.526 2.758 0 50 GFAA O=C(c1cc(-c2ccccc2O)[nH]n1)N1CC[C@@](O)(Cc2ccc(F)cc2)C1 1857527616 WCXGBOSREZEJPV-OAQYLSRUSA-N 381.407 2.741 0 50 GFAA CC(C)N=c1[nH]c(-c2ccccc2)nc2c1CCC21CCN([C@H](C)C(N)=O)CC1 1857687103 KSHVFIPRSLBIIR-MRXNPFEDSA-N 393.535 2.539 0 50 GFAA CC1(C(=O)NC[C@H]2[C@H]3CN(CCOCc4ccccc4)C[C@]34CC[C@H]2O4)CC1 1857716641 OCHGQFZYNCKADR-DZCCDHAISA-N 384.520 2.599 0 50 GFAA OCCOc1ccccc1CN1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857733783 YFZYQJSSNGJFFF-QHCPKHFHSA-N 395.503 2.911 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)C[C@H](C(C)C)O1 1875251101 WTCRBACVGKZMRF-RDTXWAMCSA-N 396.509 2.622 0 50 GFAA COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)c1 127459900 OAVSRJBAHKCWEJ-KRWDZBQOSA-N 385.512 2.675 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2ccc(F)cc2)c(=O)c(C(=O)NC(C)C)c1 14977529 PZGNZXBNHDLGSG-UHFFFAOYSA-N 387.455 2.712 0 50 GFAA O=C(CC(=O)N1CCC2(CCN(Cc3ccccc3)C2)CC1)NCC(F)(F)F 378605541 KAEPWYCACIRKFC-UHFFFAOYSA-N 397.441 2.570 0 50 GFAA COc1ccc(-c2ccnc(C3CCN(C(=O)[C@@]4(F)CCNC4)CC3)n2)cc1 952895059 RHNKCIJJCVHQJL-OAQYLSRUSA-N 384.455 2.560 0 50 GFAA O=C(N=c1ccn(-c2ncccc2Cl)[nH]1)N[C@H]1CCO[C@H](c2ccncc2)C1 1875265762 ZHPYKQKISAHQAC-HOCLYGCPSA-N 398.854 2.779 0 50 GFAA O=C(N[C@@H](CO)C(=O)O)c1cccc(-c2ccc(CN3CCCCC3)cc2)c1 1875281311 DBVTWIHBCIYCHN-FQEVSTJZSA-N 382.460 2.515 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(Cc4ccccc4F)CC3)n[nH]c21 1875394895 ABXZFOJOKRBCSV-KGLIPLIRSA-N 387.455 2.781 0 50 GFAA COc1cnc2ncnc(NCCCN3CCN(c4cccc(C)c4)CC3)c2c1 1875334906 JUTYHTOBRFZGJI-UHFFFAOYSA-N 392.507 2.966 0 50 GFAA COc1ccc(C(=O)C[C@@]2(O)C(=O)N(C)c3ccc(Br)cc32)cc1 1023595 XQZPZQVYZYAMID-SFHVURJKSA-N 390.233 2.895 0 50 GFAA O=C(c1ccc2nn[nH]c2c1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2100540785 PKYLTZDMAKLEGZ-QFIPXVFZSA-N 389.459 2.755 0 50 GFAA CCOC(=O)Cc1ccccc1CCOC(=O)c1ccc2c(c1)OCC(=O)N2 2325737716 MODUYNSVYGQBRK-UHFFFAOYSA-N 383.400 2.523 0 50 GFAA CC(C)c1nocc1C(=O)N1CC2(C[C@H](NC(=O)CC3(C)CC3)c3nccn32)C1 2332237614 DSHLLABEDZWVGI-HNNXBMFYSA-N 397.479 2.597 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc(NC(=O)c2ccco2)cc1 692802 VTCGPGCUDXXILW-UHFFFAOYSA-N 389.367 2.767 0 50 GFAA O=C(c1ccccc1)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 899698 ZAYSNYQBNZHABZ-UHFFFAOYSA-N 380.469 2.987 0 50 GFAA O=C(NCCCc1nn[nH]n1)c1ccc(-c2cnc3cccc(F)c3c2)cc1 2356138242 JULQYKCLPCYGDH-UHFFFAOYSA-N 376.395 2.917 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2)CC1 6702017 NCDDRAFMFSXOFI-ROUUACIJSA-N 382.460 2.592 0 50 GFAA CN(CCCNC(=O)CCC(=O)N1CCOc2ccccc21)Cc1ccccc1 6798508 HGYSFJKEQBBTJN-UHFFFAOYSA-N 395.503 2.831 0 50 GFAA CCC(=O)N(CCc1ccccc1)[C@H]1CC(=O)N(c2ccc(OC)cc2)C1=O 102785679 IHAUSTNZNZWKLF-IBGZPJMESA-N 380.444 2.808 0 50 GFAA COC(C)(C)CS(=O)(=O)Nc1cc(Br)c(C)c(C(=O)O)c1 414383605 NOYXHMJRAODIFS-UHFFFAOYSA-N 380.260 2.622 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnn(CC)c3C)C[C@@H]2CCO)cc1 20994284 WKMKKECVIGGMJO-NRFANRHFSA-N 386.540 2.679 0 50 GFAA Cc1c(CNCCc2nc3ccc(F)cc3[nH]2)c2ccccc2n1CC(N)=O 55370357 DOYFTUDDNWPMSF-UHFFFAOYSA-N 379.439 2.783 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3cccc4c3oc3ccccc34)C[C@H]2O)CC1 20600579 KETKVKNVIVEBNR-NHCUHLMSSA-N 379.504 2.769 0 50 GFAA CC(C)N1CC[C@@H](C(=O)N2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)C1 67856836 BAVLIQZJEXNGRV-OAHLLOKOSA-N 383.448 2.685 0 50 GFAA O=C(NC1CCOCC1)[C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 71771316 VHFKCNTXALTGBQ-HXUWFJFHSA-N 385.552 2.658 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 374950278 GZXRVRXBCGTWBL-MRXNPFEDSA-N 393.402 2.927 0 50 GFAA CCn1cc(CN2CCC[C@@H](CNC(=O)c3cccc(OC)c3OC)C2)cn1 39430505 TVUOHUFFLPFWEW-INIZCTEOSA-N 386.496 2.562 0 50 GFAA O=C(Cn1nc(-c2ccco2)ccc1=O)N1CCN(c2ccc(Cl)cc2)CC1 38790783 YZQVDJFUMOVMQL-UHFFFAOYSA-N 398.850 2.506 0 50 GFAA COc1ccc(C(=O)CCC(=O)NC[C@@H]2CC(=O)N(C)c3ccccc32)cc1 216418375 CVZNXEZXQYAHOK-INIZCTEOSA-N 380.444 2.925 0 50 GFAA O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCNC[C@@H]1c1cccnc1 261890667 ZPYHJEVPFKLRKU-PZJWPPBQSA-N 382.483 2.606 0 50 GFAA CCn1nc(C)c(-c2cc(C(=O)OC)n3ncc(Br)c3n2)c1C 13645585 ZXKKJYPVLDFGAO-UHFFFAOYSA-N 378.230 2.779 0 50 GFAA O=C([C@@H](F)C(F)(F)F)N1CCC(O)(c2scnc2Br)CC1 378140022 XREPOISJVAVFQV-ZCFIWIBFSA-N 391.184 2.616 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCCc2ccc(C)o2)C1 77387264 DZHGOWJXANPUBH-UHFFFAOYSA-N 377.448 2.999 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)C1 158613905 GUFKVQCFDDJPBW-WMZOPIPTSA-N 399.495 2.719 0 50 GFAA Cc1onc(-c2ccccc2)c1C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1 173280451 NPBUBKAZVJXUNS-IBGZPJMESA-N 382.508 2.892 0 50 GFAA O=C(CCC(=O)N1CCN(c2ccccn2)CC1)Nc1ccc2cc[nH]c2c1 40287159 JLKFWVSQRGOOSP-UHFFFAOYSA-N 377.448 2.630 0 50 GFAA Cc1ccccc1N1CCN(C(=O)Cc2nc3cc(Cl)ccc3[nH]2)CC1=O 82120140 QXBWUIFPMDXCCW-UHFFFAOYSA-N 382.851 2.943 0 50 GFAA O=C(NCCN1CCC(c2ccccc2)CC1)NC[C@H](O)c1cccc(O)c1 426407483 FHJJXXVLXFVNTC-NRFANRHFSA-N 383.492 2.604 0 50 GFAA O=C(c1ccc(Cn2cc(Cl)cn2)s1)N1CC[C@H](c2cc(O)n[nH]2)C1 911853964 FZVIKQRYPRWMIS-JTQLQIEISA-N 377.857 2.705 0 50 GFAA CC(C)c1nnc(CCC(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)o1 290539548 HDFRJMMEPCHZIJ-FQEVSTJZSA-N 375.444 2.718 0 50 GFAA CC[C@@]1(CNC(=O)c2cnc3scc(C)n3c2=O)OCCc2ccccc21 291178983 BQRQHGKQWSDDFB-FQEVSTJZSA-N 383.473 2.672 0 50 GFAA CCN1CCc2nc3ccccc3c(C(=O)NCC3(OC)CCOCC3)c2C1 178788516 OEEYDGWVXWIHTM-UHFFFAOYSA-N 383.492 2.538 0 50 GFAA CC(C)[C@@H](O)C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95500583 BWQZZPCNHWEZTG-GOSISDBHSA-N 378.900 2.698 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 95525535 XEQTYNUCZMJNPW-QFIPXVFZSA-N 396.491 2.774 0 50 GFAA CN1CCC[C@@H]1CN1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91780301 NCUBJEKBBWIOFE-QGZVFWFLSA-N 377.479 2.874 0 50 GFAA Cn1nnc2cc(C(=O)N3CCC[C@@H](n4ccc(C(F)(F)F)n4)C3)ccc21 182865028 DVMAGBMCBPEMHG-GFCCVEGCSA-N 378.358 2.661 0 50 GFAA COc1cc2c(cc1CNC(=O)N1CCN(Cc3ccccn3)CC1)CCC2 534631042 KYKLKRPABALVBW-UHFFFAOYSA-N 380.492 2.606 0 50 GFAA C[C@@H]1CN(C(=O)c2nn(-c3ccc(F)cc3)ccc2=O)c2ccc(F)cc2O1 741965758 HHINWMGTDGRQHU-GFCCVEGCSA-N 383.354 2.938 0 50 GFAA CN(CCCC1CCCC1)C(=O)[C@H]1OCC(=O)N(C2CC2)[C@@H]1c1cccnc1 1529133807 JILDSPYHQCBFTB-RTWAWAEBSA-N 385.508 2.941 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N[C@H]2CCN[C@H](C)C2)cc1 1704326134 YCCWHKGXEPTMBI-ZBFHGGJFSA-N 384.480 2.821 0 50 GFAA O=C(c1ccc(COc2ccccc2)cc1)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772712042 GKPTYWHCWMZNFT-GCJKJVERSA-N 381.428 2.829 0 50 GFAA O=C(Nc1ccccc1C(=O)N[C@H](Cc1ccccc1)C(=O)O)c1ccco1 5074144 UCRLHEGXDVZBKA-QGZVFWFLSA-N 378.384 2.958 0 50 GFAA O=C(CSc1nc(-c2ccccc2)n[nH]1)N1CCN(c2ccccc2)CC1 5557235 HQARLKVIOFQCDV-UHFFFAOYSA-N 379.489 2.913 0 50 GFAA CC1CCN(C(=O)[C@@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)CC1 12056841 JKFNQRJNBXGGAX-ZDUSSCGKSA-N 375.494 2.885 0 50 GFAA COc1cccc(N2C(=O)CN(C(=O)c3ccc(-n4cccn4)cc3)C[C@H]2C)c1 12203395 NMAUUJKYGYMAGY-MRXNPFEDSA-N 390.443 2.758 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@@H](NCc1ccccn1)CC2 14538672 HRYWLDWBDFRXHZ-SFHVURJKSA-N 389.503 2.734 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)c1cc(COc2ccc(C(C)=O)cc2)on1 15063912 ILHHEZWBWRPSPM-UHFFFAOYSA-N 382.420 2.852 0 50 GFAA O=C(NCc1cnc2ccccc2c1)c1ccc(CN2CCCCC2)[nH]c1=O 15069842 PGYOZHMUQNRGKZ-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA O=C(C[C@H]1NC(=O)c2ccccc2NC1=O)Nc1nc(-c2cccs2)cs1 169772639 BLONSEGVQOKGLC-GFCCVEGCSA-N 398.469 2.951 0 50 GFAA COC(=O)C[C@@H](c1ccc2ncccc2c1)c1c(O)n2ccccc2nc1=O 205961611 SOFZZLPLJSUYGA-HNNXBMFYSA-N 375.384 2.643 0 50 GFAA COc1cccc(CN2C[C@@H]3CC[C@H](C2)[C@@H]3NC(=O)c2c(C)ncnc2C)c1 1857689781 XVLACAKATOTAHN-WGMWDUQUSA-N 380.492 2.742 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCC(c2cc[nH]c(=N)n2)CC1 1857698079 VXJQQDHYMWEPLC-UHFFFAOYSA-N 380.427 2.747 0 50 GFAA CC(C)c1nnc([C@@H]2CN(S(=O)(=O)C[C@H](C)c3ccccc3)CCO2)o1 328626325 LOFROOKBNOLEMB-HOCLYGCPSA-N 379.482 2.700 0 50 GFAA COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 363138263 RKXMAYJEPFYJJF-MRXNPFEDSA-N 399.491 2.661 0 50 GFAA Cc1noc(C)c1CN1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1 265032987 LGGDXPXNJHIAQK-UHFFFAOYSA-N 392.463 2.656 0 50 GFAA CC(=O)CCC(=O)N1CCC(n2ncc3c2CN(C(=O)OC(C)(C)C)C3)CC1 819731230 RKWNHOLRVQSFKO-UHFFFAOYSA-N 390.484 2.667 0 50 GFAA CCc1c(C(=O)N2C[C@@H](F)[C@H](CO)C2)cnn1-c1ccc(C(F)(F)F)cc1 1875295611 LCMRKNKCUJBOHR-XHDPSFHLSA-N 385.361 2.856 0 50 GFAA N[C@@H]1CCO[C@H](C(=O)N2C[C@H](c3ccccc3)O[C@@H](c3ccc(F)cc3)C2)C1 1875276955 PWQSXBADQCMPAK-PLACYPQZSA-N 384.451 2.973 0 50 GFAA Cc1csc(C(=O)NC[C@@]2(O)CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)c1 1875305693 YOAGFFKVCZDIOB-KNQAVFIVSA-N 398.528 2.944 0 50 GFAA CO[C@H](C(=O)N=[S@](C)(=O)c1ccnn1C)c1ccccc1C(F)(F)F 1875312203 WUAVLWIJCGKGSF-ZJWNCGCPSA-N 375.372 2.810 0 50 GFAA CCOC(=O)c1cc(S(=O)(=O)N[C@H]2CCC(C)(C)c3ccccc32)n[nH]1 1875349196 PXZDTZYPTSPMJQ-AWEZNQCLSA-N 377.466 2.677 0 50 GFAA CS[C@@H](C)Cn1c(CN2CCCC2=O)nnc1N(C)C1Cc2ccccc2C1 1316387912 STMYNUOQVRBDSO-HNNXBMFYSA-N 399.564 2.756 0 50 GFAA CCOC(=O)c1ccc(NC(=S)N2CCC[C@H](C(=O)N3CCCC3)C2)cc1 1443898 WKGYWACDJDKDEH-INIZCTEOSA-N 389.521 2.895 0 50 GFAA CN(C(=O)[C@H]1OCC(=O)N[C@@H]1c1ccccc1Cl)C1Cc2ccccc2C1 2100554883 FWELDDFNYCLMTI-UXHICEINSA-N 384.863 2.522 0 50 GFAA CN(C(=O)Cc1cccc2c1CCNC2)[C@H](c1ccc(F)cc1)c1ncc[nH]1 2325795936 GNABTTNBXDIEMC-OAQYLSRUSA-N 378.451 2.985 0 50 GFAA COC(=O)c1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCc2ccccc2)cc1 1160140 GQKWTLXBJGVDQW-GOSISDBHSA-N 380.400 2.845 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)Nc1nnc(-c2sc(C)nc2C)o1 2356139205 OARJRYBPCKSSHZ-NSHDSACASA-N 399.432 2.883 0 50 GFAA O=C(Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1C(=O)Nc2ccccc2[S@]1=O 6864726 PTUIGLJFYKYTGB-SXBQZSJRSA-N 397.239 2.630 0 50 GFAA O=C(CCc1ccccc1)Nc1cccc(NC(=O)CN2CCC(O)CC2)c1 55393180 KWTYUEQOBNLKEF-UHFFFAOYSA-N 381.476 2.653 0 50 GFAA CCc1nc(NC(=O)c2ccc([C@@H]3CCCN3C(=O)CSC)s2)nn1C 20232870 IANROEYUTZUREK-NSHDSACASA-N 393.538 2.718 0 50 GFAA Cc1cc(N2CCN(C(=O)c3ccccc3F)CC2)nc(N2CCCCC2)n1 64799772 XHYLGTCFKRNTTP-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CC(n4cccn4)C3)n[nH]2)c(Cl)c1 67833535 DODBIYGFBBPYQE-UHFFFAOYSA-N 387.827 2.544 0 50 GFAA O=C(NCCN1CCCCC1)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252493152 NALPKYWRYPDVCT-UHFFFAOYSA-N 394.541 2.515 0 50 GFAA CCOC(=O)c1sc(NC(=O)COc2ccc(F)cc2F)c(C(N)=O)c1C 2752161 BHNSZHAHSXRJGW-UHFFFAOYSA-N 398.387 2.628 0 50 GFAA C[C@@H]1CN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)CCN1C 72171232 GGNCPIPLLDZMTL-HXUWFJFHSA-N 391.559 2.861 0 50 GFAA Cc1ccc2nc(N3CCC[C@H](O)C3)c(CN(C)CCc3cn[nH]c3)cc2c1 72433604 ZVFXNYLISFFJJZ-FQEVSTJZSA-N 379.508 2.902 0 50 GFAA O=C(C[C@@H]1COCCN1C(=O)CC1CCCCC1)Nc1ccc2c(c1)OCO2 72435023 PWNMCPLHMUVIIA-QGZVFWFLSA-N 388.464 2.942 0 50 GFAA COCCN1C[C@@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)CC1=O 122537639 PALOAPQWESEEII-HNNXBMFYSA-N 378.432 2.663 0 50 GFAA CCOc1cc(C(=O)N[C@H]2CCO[C@@H](CC(C)C)C2)ccc1OCC(=O)O 262717518 DCEOEAMITNOPSK-HOTGVXAUSA-N 379.453 2.872 0 50 GFAA Cc1nc2ccc(NC(=O)[C@@H](C(C)C)S(=O)(=O)C3CCCCC3)cn2n1 333914787 YRSWATNFCPRPBM-QGZVFWFLSA-N 378.498 2.748 0 50 GFAA Cc1cc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)c(C)o1 82107750 KEQOEOMSROQNMG-SFHVURJKSA-N 387.524 2.835 0 50 GFAA CC(C)c1nc(C(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)nn1-c1ccccc1F 174541434 NHGQRJGAYLRDGS-ZDUSSCGKSA-N 387.459 2.659 0 50 GFAA CC(C)(C)OC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)N1CCS(=O)CC1 242389368 ZWPGGXZDHLZHSR-MRXNPFEDSA-N 394.537 2.870 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CC[C@@]2(CCCN(CC3CCC3)C2)C1 426493882 AUVRXYQMDUAWLA-JOCHJYFZSA-N 383.492 2.709 0 50 GFAA Cc1ncncc1C(=O)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95375734 IFTRLBKAPALTEL-NSISKUIASA-N 384.430 2.766 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCN(Cc2ccccn2)CC1 95381867 QKXMSFUGYYMVIF-GOSISDBHSA-N 375.856 2.687 0 50 GFAA CN(C)C(=O)N1CCC(Oc2ccc(C(=O)NCc3ccccn3)cc2)CC1 95516441 CUGQMUMIYVWZJU-UHFFFAOYSA-N 382.464 2.536 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)cc1O 91493849 SNYDSFHMINAIBO-SFHVURJKSA-N 386.492 2.724 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCc1nc(C)c3c(n1)CCCC3)C2 95358536 PQUNLQVJPNABTG-MRXNPFEDSA-N 381.476 2.582 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C[C@H](O)[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 252427036 SHIBSTMRCDJXLN-WDIWWZPHSA-N 390.520 2.575 0 50 GFAA biogenic,in-vitro O=c1c2ccccc2ncn1C[C@H]1CC[C@H](C(=O)NCCc2ccncc2)CC1 252517342 GGNVFDSTTKEOPY-WGSAOQKQSA-N 390.487 2.957 0 50 GFAA Cc1sc(NC(=O)[C@@H]2C[C@@H](O)CN2)nc1-c1ccc(Br)cc1 299749829 LUYSZFIBHIOCGD-NEPJUHHUSA-N 382.283 2.542 0 50 GFAA CCCCc1nc(CN2CCC(CNC(=O)[C@H]3CCOC3)CC2)c(Cl)[nH]1 822886070 BYSUKLBFEMHRLQ-HNNXBMFYSA-N 382.936 2.770 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)NC[C@@H](O)CN1CCCCCC1 952975799 XHUACJPLBVQNPO-OAHLLOKOSA-N 381.904 2.655 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@H](c1ccccc1)N1CCCN(C=O)CC1 273003117 UWZCBQUAIQJOQG-NRFANRHFSA-N 381.476 2.848 0 50 GFAA CCc1cnc(CNC(=O)c2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)o1 170598399 ZESBKCIGCJHLQF-UHFFFAOYSA-N 391.493 2.588 0 50 GFAA CCCOc1nc(C)ccc1C(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 188752914 VKYWTISWGFLMBF-INIZCTEOSA-N 384.480 2.729 0 50 GFAA COc1cc(C2=N/C(=C\c3ccc4c(c3)OCO4)C(=O)O2)cc(OC)c1OC 5019922 MREISZAYJLGSHS-MLPAPPSSSA-N 383.356 2.786 0 50 GFAA O=C(c1cccc(OCCc2ccccc2)c1)N1C[C@@H]2COCC[C@]2(CO)C1 1772712163 IUOVZKDQOQJMHB-NFBKMPQASA-N 381.472 2.779 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCN4CCC[C@H]4C3)no2)c(Cl)c1 12019858 AFBNWSFPSKVYLZ-ZDUSSCGKSA-N 391.855 2.836 0 50 GFAA CCc1ccccc1N1C[C@@H](c2nnc(NC(=O)[C@@H]3CCCO3)s2)CC1=O 16626071 NUGYZFQAWNKKRT-ZFWWWQNUSA-N 386.477 2.739 0 50 GFAA COc1cc(CN2CCN(CC3CCCCC3)[C@@H](CCO)C2)cc2c1OCO2 19731151 YKIVTSZVDXGOOG-IBGZPJMESA-N 390.524 2.873 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@@H](c4ccccc4)N4CCCN4[C@@]3(C)C2=O)cc1 19172093 HADLUEXZIMKMLH-NNMXDRDESA-N 377.444 2.621 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@@H]1O)c1ncncc1Cl 1857531344 LPPJCLHAGLOMAD-COXVUDFISA-N 397.866 2.563 0 50 GFAA Cc1ccc(C(C)C)c(OC(C)(C)C(=O)N2CC[C@@]34OCCN3C(=O)C[C@@H]24)c1 1857729035 RYPUWQQWDFFYLG-GCJKJVERSA-N 386.492 2.836 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2CC[C@@]34OCCN3C(=O)C[C@@H]24)c1 1857739959 AVDLMTBTVLGRSU-KNQAVFIVSA-N 378.428 2.536 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccsc3)C[C@]23CC[C@H]1O3)c1cncc(F)c1 1857741183 HHVZANDCWDLLFO-JRBPQWBISA-N 387.480 2.692 0 50 GFAA CN1CCN([C@H]2CCN(Cc3cccc4c3oc3ccccc34)C[C@@H]2O)CC1 207587583 KETKVKNVIVEBNR-SFTDATJTSA-N 379.504 2.769 0 50 GFAA c1cc(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c2cc[nH]c2c1 112505978 BYMWZUKNHQOEEV-GOSISDBHSA-N 392.507 2.553 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2)C[C@@H](C)O1 237416239 ZHJKUYHYTRQXDN-HZPDHXFCSA-N 382.460 2.924 0 50 GFAA NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)c2cc(Cl)cc(F)c2N)c1 241213424 KORCZCLSUOPCDE-INIZCTEOSA-N 390.846 2.763 0 50 GFAA O=C(c1ccccc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cn1cc2ccccc2n1 247967972 ZYLRNDXXXYMWJR-XLIONFOSSA-N 388.471 2.800 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCn2ncnc2C1)c1ccc(Cl)cc1 474843603 OVXMPSSWMVMGPB-UHFFFAOYSA-N 381.823 2.840 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)[C@]1(C)CC1(F)F 817731166 WRMMGFSKIHJZIV-OTYXRUKQSA-N 397.827 2.604 0 50 GFAA Cc1ccc2[nH]c(C(=O)NC[C@@H]3CCN(C(=O)C4(C)CCOCC4)C3)cc2c1 1875309588 CXFLBQDNJJZFOZ-INIZCTEOSA-N 383.492 2.871 0 50 GFAA COC(=O)c1cccc(O[C@H]2CCN(C(=O)c3cc4c([nH]3)CCCC4=O)C2)c1 1875310511 SOPLFZUJCTWGJO-HNNXBMFYSA-N 382.416 2.614 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1NCc1ccccc1OCc1ccccn1 1875400071 QIHHLJQVNKEFKQ-DUXKGJEZSA-N 378.476 2.786 0 50 GFAA Cc1nc(N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)c2[nH]ccc2n1 2100540842 ROEUSOIJWZWYPM-XMSQKQJNSA-N 394.475 2.931 0 50 GFAA O=C(c1csc(COc2ccccc2)n1)N1CCNC[C@H]1c1ccncc1 2325768486 KVHHGVWJLBJAFG-SFHVURJKSA-N 380.473 2.904 0 50 GFAA COc1ccc(C)cc1-n1cnc(C(=O)NC[C@H]2NCCc3ccccc32)c1 2325859973 RUDTWXWUQDWLND-GOSISDBHSA-N 376.460 2.806 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 1127468 YRPIPAOXNHLXJG-GFCCVEGCSA-N 386.470 2.703 0 50 GFAA O=C(CN1CCC[C@]12CCCN(C1CC1)C2=O)NCCc1cccc(Cl)c1 2356135885 XGVPYEQTDGZPCI-OAQYLSRUSA-N 389.927 2.618 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)Nc3cccn4nc(C)nc34)cc2n1 2356166370 VDNCKEFRVWOMGU-UHFFFAOYSA-N 375.314 2.660 0 50 GFAA O=C(CNC(=O)C1CCCCC1)OCC(=O)c1ccc(Br)cc1 3024295 LFHKKXWGNQPATR-UHFFFAOYSA-N 382.254 2.872 0 50 GFAA CCC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2OC)CC1 10323855 PVEVVVKOCFCJGG-ZDUSSCGKSA-N 386.489 2.540 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)NCc1coc(-c2ccccc2)n1 172695587 LZLFNGKPVJSKSU-UHFFFAOYSA-N 376.420 2.645 0 50 GFAA O=C(CN1CCOC2(CCOCC2)C1)NCC1(c2ccccc2)CCCCC1 135635514 DDPWIUOIBWJZKV-UHFFFAOYSA-N 386.536 2.886 0 50 GFAA Cc1ccc(NC(=O)CNCc2noc(-c3ccc4c(c3)OCO4)n2)c(C)c1 65464835 UJTXBHSHIJPDAZ-UHFFFAOYSA-N 380.404 2.810 0 50 GFAA CN1CCc2n[nH]c(C(=O)N3CC[C@@H](c4ccc5ccccc5c4)[C@H](O)C3)c2C1 67868038 BRCSLJHOTZGTHM-GHTZIAJQSA-N 390.487 2.541 0 50 GFAA CN(C)C(=O)[C@@H](NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccccc1 328625379 DCBJTEQDFIEMQW-GUYCJALGSA-N 380.414 2.883 0 50 GFAA Cc1noc(C2(NC(=O)[C@@H]3CC(=O)N(c4cccc(F)c4)C3)CCCCC2)n1 77197358 MVNMODURHOURCX-CQSZACIVSA-N 386.427 2.846 0 50 GFAA COc1ccc2c(c1)OCC[C@H]2NC(=O)NC1CCN(Cc2ccccn2)CC1 363288037 FPVJIHYKNQOUNN-HXUWFJFHSA-N 396.491 2.878 0 50 GFAA COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)NCCNC(=O)c2cccnc2)c1 363736341 GQHAQPLODRDBSK-BEFAXECRSA-N 382.464 2.613 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccn(C)n1 485695750 MIRFARBAQXQXPM-HNNXBMFYSA-N 394.353 2.581 0 50 GFAA Cc1cccc2[nH]c([C@@H]3CCCN(C(=O)c4[nH]nc5c4CN(C)CC5)C3)nc12 77406648 NSQKFQUUAMZTMW-CQSZACIVSA-N 378.480 2.602 0 50 GFAA CN1C(=O)[C@](CCC(=O)N2CCCNCC2)(Cc2ccccc2)c2ccccc21 71762734 AVPAHXAAHPBPEX-XMMPIXPASA-N 391.515 2.746 0 50 GFAA COc1ccc(-n2ccnc2CN2CCNC(=O)[C@H]2c2cccc(F)c2)cc1 215157712 RMRPMFLMRUQRPH-HXUWFJFHSA-N 380.423 2.693 0 50 GFAA Cc1[nH]nc2ncc(C(=O)N[C@H](C)c3cc(F)ccc3N3CCC(O)CC3)cc12 128339904 QMRUGBDDMGNLRB-GFCCVEGCSA-N 397.454 2.858 0 50 GFAA O=C(NCCc1nc2c(s1)CCCC2)NCc1ccc(-n2ccnc2)nc1 378330734 BJEJLVYFCONOIU-UHFFFAOYSA-N 382.493 2.645 0 50 GFAA COc1ccc(NC(=O)Cn2nc(-c3ccc(OC)cc3F)ccc2=O)cc1 49550779 CEAXYMRYBXJAFQ-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA Cn1c(O)ncc(C(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1=O 286387198 QNTUOKOIVSBCBZ-GFCCVEGCSA-N 381.354 2.525 0 50 GFAA Cc1ccc(C[C@H](CO)NC(=O)c2cnn(C)c2Cc2ccccc2)cc1C 457311402 ZBKIEGNOVFNNFH-HXUWFJFHSA-N 377.488 2.961 0 50 GFAA COc1cccc(-c2noc(CCCC(=O)N3CCC(n4cnnc4)CC3)n2)c1 426712231 VFWKFRMBJIHHGS-UHFFFAOYSA-N 396.451 2.523 0 50 GFAA COc1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cccc(C(C)=O)c2)C3)cn1 220379182 BGPWKISPDGLJNF-UHFFFAOYSA-N 376.416 2.881 0 50 GFAA CC[C@H](C(=O)Nc1c(C)noc1C)n1ccc(C(=O)Nc2c(C)noc2C)n1 20617651 ZGAXVSDAUFJRMP-CQSZACIVSA-N 386.412 2.935 0 50 GFAA Cc1cc(C(=O)N2CCN(C)[C@@]3(CCNC(=O)CC3)C2)c(-c2ccccc2)o1 95388757 KYCVUUGLOSWXNF-QFIPXVFZSA-N 381.476 2.682 0 50 GFAA CCc1ccc(S(=O)(=O)N2CC[C@@H](Cc3cccc(C(N)=O)c3)C2)s1 91486657 XOFBMQJLIZLEST-AWEZNQCLSA-N 378.519 2.663 0 50 GFAA CC(C)c1ncc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cn1 95529079 WWBCTFMQFRUEFU-UHFFFAOYSA-N 394.523 2.609 0 50 GFAA COCc1noc(CN2CCC[C@@H](CNC(=O)c3ccccc3Cl)C2)n1 95497250 NNJKTIADOVIUGF-ZDUSSCGKSA-N 378.860 2.511 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)CCCc1ccc(F)cc1 517040511 RMDFYHLVRREMFK-QGZVFWFLSA-N 393.484 2.960 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)o1 91563044 AGZNIITYXFHWDY-UHFFFAOYSA-N 383.448 2.728 0 50 GFAA CC(C)[C@@H](NC(=O)C1(n2cnnn2)CCCCC1)c1nc2ccccc2n1C 252490153 KKPQOQJYCXEQSQ-QGZVFWFLSA-N 381.484 2.733 0 50 GFAA COC(=O)/C=C1/CC[C@@H]2[C@H](C(=O)C[C@H]3[C@](C)(C(=O)OC)[C@@H](O)CC[C@]23C)[C@H]1C 257347283 CFNLOOTYKUBPGV-VRJATPJASA-N 392.492 2.677 0 50 GFAA Cc1cccc(N2CCN(CCC(=O)N3CCC(c4ccncn4)CC3)CC2)c1 299776216 LMSSVXLLBZXFPL-UHFFFAOYSA-N 393.535 2.703 0 50 GFAA CN(c1ccc(C(=O)N2CC[C@@H](c3ccc(F)cc3)C2)cc1)S(C)(=O)=O 299765056 ZTXAVIVGDPMLDO-MRXNPFEDSA-N 376.453 2.851 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)cc2)CC1 823764838 KDQWCAWVJUHHOM-MRXNPFEDSA-N 385.508 2.889 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(O)nn3)n2C[C@@H]2CCCO2)[C@@H]2CCCC[C@@H]12 1344667790 PYCNUCCPLRHEFC-WBTNSWJXSA-N 384.484 2.635 0 50 GFAA C[C@@H](O)[C@@](C)(CNC(=O)CCN1C(=O)COc2ccccc21)Cc1ccccc1 170611687 IXROESUSKBHBAA-UZUQRXQVSA-N 396.487 2.548 0 50 GFAA CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)c1 170600208 LRAMVDKHWQSYRU-RHSMWYFYSA-N 392.521 2.502 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)Cc2ccn(-c3ccccc3)n2)C1 170602536 TYODLPULEQCSKI-QGZVFWFLSA-N 384.480 2.931 0 50 GFAA Cc1cc(-n2cccn2)ccc1CN1CCCN(C(=O)CCn2cccn2)CC1 1775983992 FUUQLPOEWBPBCU-UHFFFAOYSA-N 392.507 2.502 0 50 GFAA CCCOc1ccc(S(=O)(=O)N2CCC(C(N)=O)CC2)c2ccccc12 11613782 FJQOISSYZYMYMI-UHFFFAOYSA-N 376.478 2.515 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N[C@@H](C)CCn2cccn2)o1 11813886 FZFFIEFMJMUMIS-INIZCTEOSA-N 397.479 2.588 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)CCc2cn[nH]c2)CC1 11842476 JAJGOLAYGLSKDN-UHFFFAOYSA-N 384.524 2.764 0 50 GFAA O=C(c1cn2ccsc2n1)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 11936619 IKCIHNXRVBLXTF-AWEZNQCLSA-N 384.461 2.884 0 50 GFAA COC(=O)c1ccccc1-c1cc(C)cc2c1O[C@@H](CNC(=O)[C@@H]1CCOC1)C2 12027315 DEWFFSOFJYPKAO-NVXWUHKLSA-N 395.455 2.905 0 50 GFAA CC(C)c1cc(CN2CCC[C@H](CNC(=O)c3ccc4c(c3)OCO4)C2)n[nH]1 12302942 AVQCIWMYBRXWNC-OAHLLOKOSA-N 384.480 2.904 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)/C=C/c4c[nH]cn4)C3)C2)c1 12445974 MLEXAJKTJCPWLJ-XYXUZSOXSA-N 380.492 2.946 0 50 GFAA Cn1nc(C(=O)NCc2ccccc2)c2c1CCN(Cc1ccc(O)cc1)C2 14744324 YBRQIEIUJBXKDU-UHFFFAOYSA-N 376.460 2.614 0 50 GFAA Cc1c(CN2CC(=O)N(CC(C)C)C[C@@H](OCc3ccccc3)C2)cnn1C 14745795 CVAZMCCSDBLAKJ-NRFANRHFSA-N 384.524 2.614 0 50 GFAA COc1ccc(C(=O)NCCc2ccnn2C)cc1Oc1cc(F)cc(CN)c1 1857687693 ACOZXYIHYXTXHM-UHFFFAOYSA-N 398.438 2.791 0 50 GFAA O=C(NCCO)c1cc2c(s1)C1(CCN(Cc3ccccc3)CC1)OCC2 1857707691 YMKAZNHHENDVII-UHFFFAOYSA-N 386.517 2.534 0 50 GFAA CN1CCC[C@@H]1CC(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1857720863 NYWSUHSZFQTOOC-OAHLLOKOSA-N 386.540 2.770 0 50 GFAA Cc1c(CN2CCC(C3CCN(CCc4nccn4C)CC3)CC2)cnn1C 1857724691 NCFNWGUHHIHOEW-UHFFFAOYSA-N 384.572 2.629 0 50 GFAA CCc1nccn1CCC(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857738898 CXWGPJXJJLGDJH-REWPJTCUSA-N 396.535 2.900 0 50 GFAA COc1ccccc1Nc1nnc(S[C@H](C)C(=O)NC(=O)NC2CC2)s1 139202666 DYXAQQLHOPHIBT-SECBINFHSA-N 393.494 2.759 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2C[C@H]3[C@@H](C2)OCCN3C)cc1OCC 151949860 ZPBCBBRFFJWUNH-DOTOQJQBSA-N 382.888 2.683 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1C(=O)NC[C@@]12CCC[C@@](C(=O)O)(CO1)C2 1875300969 XYEKJKHXFGTIHV-SFTDATJTSA-N 383.448 2.633 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@H]3CC(=O)N(c4nccs4)C3)cc2)c1C 2325737308 DNHKAOWIVLUOFC-AWEZNQCLSA-N 381.461 2.937 0 50 GFAA O=C1OCCN1C1CCN(Cc2ccccc2-n2nnc3ccccc32)CC1 2325757179 CMKHPZOWSCAJLC-UHFFFAOYSA-N 377.448 2.837 0 50 GFAA O=S1(=O)CC[C@H](N2CCN(C3=Nc4ccccc4Oc4ccccc43)CC2)C1 2325760025 LHNOPLBKGTXZQT-INIZCTEOSA-N 397.500 2.675 0 50 GFAA Cc1ccccc1-n1cc(C(=O)NCCc2c[nH]c3c(C(=O)O)cccc23)nn1 2325869558 UDGPJUPLGIVDQY-UHFFFAOYSA-N 389.415 2.728 0 50 GFAA O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)NCc1ccco1 780677 ASSMKQXMOSNVFU-UHFFFAOYSA-N 376.478 2.919 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1 783993 LTPQPMSMMPIRBH-UHFFFAOYSA-N 392.452 2.874 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1 1466644 PNYKJQBKDILNBU-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA COCCN1C[C@@H](CNc2noc(-c3ccc(Cl)cc3)c2C(=O)O)CC1=O 2356155901 NIMWIRXVAKMEFH-LLVKDONJSA-N 393.827 2.600 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1=O 2356164831 IOSSBBSKKQWLKT-NRFANRHFSA-N 383.448 2.585 0 50 GFAA CCN(CC(=O)Nc1ccccc1F)S(=O)(=O)c1cc(C)ccc1OC 4858078 LGSQPFAGBWSGFL-UHFFFAOYSA-N 380.441 2.792 0 50 GFAA COc1ccc(N(CC(=O)N[C@H](C)c2ccccc2)S(C)(=O)=O)cc1Cl 4995785 AZLWLCNRDXSHGL-CYBMUJFWSA-N 396.896 2.992 0 50 GFAA O=C1CN(Cc2ccccc2)C(=O)N1CCS(=O)(=O)c1ccc(Cl)cc1 225455918 CYMCSLXEFGNYHT-UHFFFAOYSA-N 392.864 2.578 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN2CCN(c3ccccc3OC)CC2)cc1 54277296 UZSOOSSYEKKGQP-UHFFFAOYSA-N 397.475 2.633 0 50 GFAA CSc1cccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c1 65362856 QSZJJSPASSCEBE-UHFFFAOYSA-N 395.492 2.738 0 50 GFAA C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)O[C@H]2CCCCC2=O)cc1 248049824 ASAIBDGUWXOSIE-KSSFIOAISA-N 379.478 2.918 0 50 GFAA CNS(=O)(=O)CCn1cnc(-c2ccccc2)c1-c1ccc(OC)cc1F 65494750 ZCISJPBDDFNPAK-UHFFFAOYSA-N 389.452 2.914 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc(C)ccc3F)CC2)C1 67805582 BODZDEFMGVLMEF-GOSISDBHSA-N 391.531 2.573 0 50 GFAA Cc1ccc(C2(CN3CCCC3)CCN(C(=O)C(=O)c3ccco3)CC2)nc1 67872681 FESLADILBCAVKE-UHFFFAOYSA-N 381.476 2.822 0 50 GFAA NS(=O)(=O)c1ccc(CNc2cc(-c3ccccc3)nc3ccnn23)cc1 72479822 BSZXXABQHPRHQD-UHFFFAOYSA-N 379.445 2.656 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@@H]1O)C1CCN(C(=O)CCc2ccccc2)CC1 131065281 YQHJDMSHJBGVKW-JTHBVZDNSA-N 392.499 2.632 0 50 GFAA O=C([C@@H](c1ccccc1F)N1CCOCC1)N1CCOc2c(F)cccc2C1 447863743 NNVDPZUOJIDZIW-LJQANCHMSA-N 388.414 2.759 0 50 GFAA O=C(N[C@H](CC(F)F)C(=O)O)c1cccc(-n2ccc(C(F)(F)F)n2)c1 262967929 JSFHJZPWJFWJDV-SNVBAGLBSA-N 377.269 2.729 0 50 GFAA O=C(c1cc(-n2cnnn2)ccc1O)N1CCC[C@H](CCc2ccccc2)C1 71775907 GMGQJQNHBZAODD-QGZVFWFLSA-N 377.448 2.853 0 50 GFAA Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 282385751 DBRJTOWSWRLWRD-AWEZNQCLSA-N 396.413 2.763 0 50 GFAA COc1c(C)cc(C(=O)[C@H]2CCCN(CC(=O)Nc3cnn(C)c3)C2)cc1C 71767747 VUEOPLKWHQUISP-INIZCTEOSA-N 384.480 2.579 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 173771055 VIIBQWLASQMVEQ-KZULUSFZSA-N 378.467 2.913 0 50 GFAA O=C(Nc1ncc(Cc2cccc(F)c2)s1)N1CC[C@H](N2CCOCC2)C1 173784650 VFQVNMYGXZXFRM-INIZCTEOSA-N 390.484 2.811 0 50 GFAA Cc1cccc([C@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCOCC2)c1 241515550 OGFIHOATNMMECE-KRWDZBQOSA-N 396.413 2.557 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)/C=C/c2cncc(C)c2)c1 132647341 IVMJBFRGNNSZMZ-ZZXKWVIFSA-N 378.837 2.764 0 50 GFAA COc1cccnc1-c1cccc(C(=O)N2CCC(c3nncn3C)CC2)c1 426473769 ZRBZUOCOPNSJRT-UHFFFAOYSA-N 377.448 2.906 0 50 GFAA CCO[C@H]1CN(Cc2ccc(OC)c(OCc3cccc(F)c3)c2)C[C@@H]1O 222596081 AFKZESBEPXOZAH-RXVVDRJESA-N 375.440 2.995 0 50 GFAA CCc1nnc(CNC(=O)Nc2cc(C(=O)N3CCCC3)ccc2Cl)o1 95496734 GWMSBNJCAPEDQS-UHFFFAOYSA-N 377.832 2.843 0 50 GFAA COc1cc(CNC[C@H](O)CN2CCCC2)ccc1OCc1ccc(F)cc1 237268097 KIYBYMRKUVZQRB-FQEVSTJZSA-N 388.483 2.960 0 50 GFAA C[C@@H]1Oc2ccc(NC(=O)NCCN3CCc4ccccc43)cc2N(C)C1=O 96152807 NCEAZAQLBKFEBD-AWEZNQCLSA-N 380.448 2.615 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CCCCN3Cc3n[nH]c(C)n3)cc2)n1 95520720 ISTGJLBCTZSVJI-IBGZPJMESA-N 393.495 2.909 0 50 GFAA Cc1cccn2c(CC(=O)N[C@H]3CCCN(Cc4cccc(O)c4)C3)cnc12 97729587 GNTIITWENONDBN-SFHVURJKSA-N 378.476 2.672 0 50 GFAA O=C(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cc(-c2ccccn2)n[nH]1 97475009 DUAMJOIAFSNICD-MRXNPFEDSA-N 376.338 2.954 0 50 GFAA Cc1ccc(NC(=O)N[C@H](C)Cc2ncccc2C)cc1NC(=O)CN(C)C 96137633 WLORNLCAFSHPIK-MRXNPFEDSA-N 383.496 2.951 0 50 GFAA CNc1cc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95362443 LHOFOQDZNJAXKU-CEWLAPEOSA-N 378.476 2.531 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cn(C)c2ccccc12 525207856 UIICHVJTNWJQCU-AWEZNQCLSA-N 386.477 2.604 0 50 GFAA Cc1ccc(NC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 36579917 VOZDARJBHSTPBA-SJORKVTESA-N 379.460 2.521 0 50 GFAA biogenic Cc1cc(C(=O)N2CCC3(CC2)CN(Cc2ccc(Cl)o2)CCO3)no1 825566739 XDECBAIBJXPKOA-UHFFFAOYSA-N 379.844 2.737 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)NCC3(N(C)C)CCCCC3)cc12 670459565 LALQDGMJRXXTQD-UHFFFAOYSA-N 377.510 2.792 0 50 GFAA Cc1ncsc1CN(Cc1ccccc1)C(=O)NC[C@@H]1CCS(=O)(=O)C1 952980358 KBOMJJISUMGROU-INIZCTEOSA-N 393.534 2.598 0 50 GFAA CNC(=O)c1cnc(/C=C/c2ccc(OCC(=O)O)c(Br)c2)s1 170643085 YJIRLFNTXUXJPM-HWKANZROSA-N 397.250 2.899 0 50 GFAA O=C(NCc1noc(-c2cccc(F)c2)n1)c1ccc(CN2CCCC2=O)cc1 170600621 MIUQGPLUPALBHY-UHFFFAOYSA-N 394.406 2.928 0 50 GFAA O=C(NC[C@@H]1CCCN(c2ncnc3[nH]ccc23)C1)c1ccc2c(c1)CCCO2 1506418887 UMYGYAZMOHQXNU-HNNXBMFYSA-N 391.475 2.929 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCC[C@]4(CCc5cnc(N)nc54)C3)cc2c1 1704315333 SLOAOMWKTXCQNX-NRFANRHFSA-N 377.448 2.669 0 50 GFAA O=C1O[C@@H]2CN(c3ncccc3C(F)(F)F)C[C@@H]2N1CCN1CCCCC1 12386575 NBSYZHUFPUUBKO-LSDHHAIUSA-N 384.402 2.596 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CCC[C@@H](CO)C2)no1 12459414 IALRMSHJFVWCHF-GFCCVEGCSA-N 380.828 2.760 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CNC[C@H](C(=O)Nc2ccc3c(c2)CCC3)C1 14751502 CMIZGYSHASDZCF-LEWJYISDSA-N 391.515 2.698 0 50 GFAA COc1ccc(CN2CCN(Cc3cccc4nonc34)C[C@@H]2CCO)cc1C 19794959 NJZVXFRVJAIBON-IBGZPJMESA-N 396.491 2.609 0 50 GFAA COC(=O)C1=C(C)[C@](C(C)=O)(C(=O)OC)NC(C)=C1c1ccccc1Cl 19817932 UBCFCNIXAJZKPF-IBGZPJMESA-N 377.824 2.665 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccccc4Cl)c2=O)CCCC3)no1 169763920 NTOXCNZBNVIPOK-UHFFFAOYSA-N 386.839 2.660 0 50 GFAA COc1cc2c(cc1-c1nccn1-c1c(N3CCCC3)nn(C)c1C)OCCO2 1857706682 NJMXRLVKKWRYRE-UHFFFAOYSA-N 395.463 2.961 0 50 GFAA Cc1ncsc1CCNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857726855 GGSZXLDOOPTTNB-CQSZACIVSA-N 385.493 2.953 0 50 GFAA CCC[C@H]1C(=O)NCCN1C(=O)c1sc(Cc2ccc(F)cc2)nc1C 123142048 OBNFQOQUFVZYRM-HNNXBMFYSA-N 375.469 2.922 0 50 GFAA CC[C@@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCC(F)(F)F)c1=O 15069672 IUXVIQCJIYSYBR-LLVKDONJSA-N 387.402 2.784 0 50 GFAA Cc1cc(CN2CC[C@H](N3CCN(CCc4ccccc4)CC3)[C@@H](O)C2)oc1C 248041400 TVJMHWOCIANSJP-ZEQRLZLVSA-N 397.563 2.692 0 50 GFAA COc1ccc(F)c(C(=O)NCCc2nc3cc(F)ccc3n2C)c1OC 252508882 XWVWXSHWXKKKDG-UHFFFAOYSA-N 375.375 2.841 0 50 GFAA CC[C@H](OC)C(=O)Nc1cc(NC(=O)[C@@H](CC)OC)nc(-c2ccccc2)n1 253630124 IYDCLUZACUBBHS-GASCZTMLSA-N 386.452 2.871 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCCN(CC(F)(F)F)CC1 363441493 KLKOJCLLWLJAQC-AWEZNQCLSA-N 377.451 2.510 0 50 GFAA O=C(Cc1noc([C@H]2CCc3nnn(C4CCCC4)c3C2)n1)N1CCCCC1 952892772 CXGMQEKLOOBWTH-AWEZNQCLSA-N 384.484 2.604 0 50 GFAA O=C(c1cccc(CS(=O)(=O)c2ccccc2)c1)N1CCNC[C@@H]1C1CCC1 1875287382 HZWZLIBSVWPEHX-OAQYLSRUSA-N 398.528 2.875 0 50 GFAA O=C(c1ccccc1)N1CC[C@@H]2[C@@H](C1)NC(=O)N2C1CCN(CC2CCC2)CC1 888103351 DQALKEGMDOSCTN-NHCUHLMSSA-N 396.535 2.559 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC(C(=O)Nc3cc(C)nc(C)n3)CC2)c1 637732756 TVXPZDYOMTUKRN-UHFFFAOYSA-N 398.463 2.602 0 50 GFAA CCCOc1cc(Cl)c(CN2CCO[C@@H](c3nnn(C)n3)C2)cc1OCC 2100473610 LFARKWGLWJHKTB-QGZVFWFLSA-N 395.891 2.625 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)c2cc3ccc(Br)cc3c(O)n2)C12CC2 2325788512 LJXRCPQWYIATMI-LBPRGKRZSA-N 391.221 2.782 0 50 GFAA Cc1ccccc1-c1cc(C(=O)NCCN(C)CCO)c2cnn(C(C)C)c2n1 1455781673 PHGSKMYGJBFFSQ-UHFFFAOYSA-N 395.507 2.642 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O 1150330 QFZQLWMUWHTMIR-CQSZACIVSA-N 390.461 2.657 0 50 GFAA CC[C@@]12COC(=O)N1CCN(C(=O)c1ccc(-c3ccncc3OC)cc1)C2 2356146667 PKJBKEFQGCZHOQ-OAQYLSRUSA-N 381.432 2.814 0 50 GFAA CCc1ccccc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(OC)c(C)c1 4867646 UIIRJGDJNGQTIY-CQSZACIVSA-N 376.478 2.872 0 50 GFAA COc1ccc(NC(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c(OC)c1 4976026 AUKFJXDNVJJBLU-HNNXBMFYSA-N 386.423 2.873 0 50 GFAA O=C(COCc1cc(-c2ccc(F)cc2)on1)N1CCN(c2ccccn2)CC1 9436287 KAGUVKKREXPKMF-UHFFFAOYSA-N 396.422 2.741 0 50 GFAA COc1ccc(CNC(=O)COCc2nc3ccc(C)cc3[nH]2)c(F)c1F 102541885 IPYWUPXJAOZXBM-UHFFFAOYSA-N 375.375 2.991 0 50 GFAA O=C(c1cn(CC2CCCCC2)nn1)N1CCN(CCOc2ccccc2)CC1 20453340 JUIWVCDEIWOWJN-UHFFFAOYSA-N 397.523 2.695 0 50 GFAA CCOc1cccc(N2C(=O)C[C@H](N3CCN(Cc4ccccc4)CC3)C2=O)c1 100560622 BNEFYPCYXTYKFX-NRFANRHFSA-N 393.487 2.535 0 50 GFAA COc1cc(C)ccc1OCc1nc(C(=O)N2CCCN3CCC[C@H]3C2)co1 67842097 DCRTVXUPIVCLQU-INIZCTEOSA-N 385.464 2.881 0 50 GFAA COc1cccc(SCC(=O)NCC2(N3CCOCC3)CCCCC2)c1 27661913 LLIAUFHXXBTBBV-UHFFFAOYSA-N 378.538 2.939 0 50 GFAA CC(C)N1CCN(c2ccc(C(=O)NCCCc3ccccn3)cn2)C[C@H]1C 39489927 WCGHVKMAWHXFRA-GOSISDBHSA-N 381.524 2.758 0 50 GFAA O=c1[nH]c(SCc2nc3ccccc3c(=O)[nH]2)nc(O)c1Cc1ccccc1 1425156 JFQSFWNRIJYFAZ-UHFFFAOYSA-N 392.440 2.595 0 50 GFAA CC(C)(C)c1nsc(N2CCC[C@H](c3n[nH]cc3CN3CCOCC3)C2)n1 328642303 YKPYIERELUGPCE-AWEZNQCLSA-N 390.557 2.775 0 50 GFAA Cc1noc(C2CCN(c3nccc(N[C@H]4CCCO[C@@H]4C(C)C)n3)CC2)n1 328652965 WREQVOQFRDZSQC-FUHWJXTLSA-N 386.500 3.168 0 50 GFAA O=c1cc(N2CCOCC2)cnn1[C@@H]1CCCN(Cc2coc3ccccc23)C1 328602582 CEFYGCVITBNSPF-GOSISDBHSA-N 394.475 2.663 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccc(C)c(C)c4)CC3)ncn2)n1 72117296 RADRFWUWCGIGOS-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CCCn1c(CO)nnc1S[C@@H]1CCN([C@@H]2CCCc3ccccc32)C1=O 375114846 RTNIWMFOMUUCQP-IAGOWNOFSA-N 386.521 2.951 0 50 GFAA COc1ccc(CCn2nc(C(=O)NC3CC3)c3c2CCN(CC2CC2)C3)cc1 14741481 JDODFQRNWXXVTN-UHFFFAOYSA-N 394.519 2.795 0 50 GFAA C[C@@H](NC(=O)c1cn2cc(-c3ccc(F)cc3)n(C)c(=O)c2n1)c1ccco1 72426669 SQBOKWCUUOPFHY-GFCCVEGCSA-N 380.379 2.923 0 50 GFAA C[C@@H](CN1CC2(CCN(C(=O)c3cccnn3)CC2)OC1=O)c1ccccc1 77538297 KSGHIIHGFLIGCC-INIZCTEOSA-N 380.448 2.707 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ncnc4c3CCC4)C2)CN1CCc1ccccn1 77390682 LROLNNBWGQONHX-QHCPKHFHSA-N 391.519 2.812 0 50 GFAA O=S(=O)(NC[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc2cccnc12 15077997 FSIINLKDUCXJKG-SFHVURJKSA-N 396.516 2.820 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(Cc2ccc(OC)c(F)c2)CC1 77321854 VTRAHWPBLIHKNE-UHFFFAOYSA-N 375.492 2.887 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1cccc3cn[nH]c13)CC2 262771581 LLEODNVRFFIMDA-INIZCTEOSA-N 395.415 2.794 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)Nc2nc(C)c(C)s2)n1 49546225 CIKVLLMTROIHFZ-UHFFFAOYSA-N 388.424 2.770 0 50 GFAA Cn1cc(-c2n[nH]cc2C(=O)N2CCC(N3CCc4cc(F)ccc43)CC2)cn1 283391091 DHYKSHTWTUMYPE-UHFFFAOYSA-N 394.454 2.617 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)sc2c1CCC2 225764787 FICJFSKNWWWKGM-FCIDVOKBSA-N 386.473 2.590 0 50 GFAA CCc1ccc(-n2cnnc2)cc1NC(=O)N[C@H](CC(C)C)c1ncnn1C 426506831 PGHDNTWEGCGFAY-QGZVFWFLSA-N 382.472 2.867 0 50 GFAA CCCNC(=O)Cc1noc([C@@H]2CCCN2C(=O)c2ccccc2OCC)n1 289113063 KXKWEZQOYMCHHP-HNNXBMFYSA-N 386.452 2.514 0 50 GFAA O=C(O)CCCCCNC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1 238950645 ZFURKWNCEHRKDT-QAQDUYKDSA-N 399.491 2.964 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95525501 WXLGXIJJTZXUST-DOTOQJQBSA-N 380.473 2.888 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@H]3CCCCN3Cc3n[nH]c(C)n3)cc2)n1 95520721 ISTGJLBCTZSVJI-LJQANCHMSA-N 393.495 2.909 0 50 GFAA Cc1nnsc1C(=O)N1CCC[C@@H](CNC(=O)c2cc3ccccc3[nH]2)C1 95513397 HDONZNBUZVTSKY-ZDUSSCGKSA-N 383.477 2.610 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)c2cc3c(nc2OC)CCC3)s1 23398434 IKOPLMDYJRDRCK-OAHLLOKOSA-N 385.489 2.977 0 50 GFAA COc1ccccc1-n1cc(C(=O)NCc2nnc(-c3ccccc3)o2)cn1 91304992 PGSUHYFMCMYXBI-UHFFFAOYSA-N 375.388 2.861 0 50 GFAA Cn1ccnc1[C@H](NC(=O)Nc1cc(Cl)c2c(c1)NC(=O)CO2)C1CC1 95508042 GNVFNDOFALGPAV-CQSZACIVSA-N 375.816 2.677 0 50 GFAA CCn1c(=O)c2ccccc2n2c(CN3CCCC[C@@H]3c3ccnn3C)nnc12 298686590 ZGFUNKPGEQQNID-GOSISDBHSA-N 391.479 2.525 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@@H](C)c2nc(-c3ccc(OC)cc3)no2)cn1 534632452 BUKURJVHRAFOJG-ZDUSSCGKSA-N 384.440 2.864 0 50 GFAA Cc1ncsc1CCNC(=O)c1ccc(-c2cc(N(C)C)nc(N)n2)cc1 534639258 AKOPNJDJDNYQFU-UHFFFAOYSA-N 382.493 2.529 0 50 GFAA Cc1ccc(-n2cnnn2)cc1NC(=O)N1CCCC[C@H]1CCn1cccn1 299775515 JXJZCRYHSAQQRL-INIZCTEOSA-N 380.456 2.644 0 50 GFAA Cc1c(NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)cccc1-c1nncn1C 828070054 HOAZWLIDQWXGKI-KRWDZBQOSA-N 389.459 2.745 0 50 GFAA Cc1cncc(C(=O)NC[C@@H]2CCCN(c3ncc(F)c(N4CCCC4)n3)C2)c1 952976081 UWIGDNIHLFBBJE-INIZCTEOSA-N 398.486 2.566 0 50 GFAA O=C1C[C@@H](CNCc2cc3cc4c(cc3nc2O)OCO4)CN1C1CCCC1 952978877 TUYZQVVPYAFKTQ-ZDUSSCGKSA-N 383.448 2.550 0 50 GFAA Cc1c(C(F)(F)F)nn(C)c1NC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1 186100032 RJADISKBOKOMDE-SNVBAGLBSA-N 379.346 2.601 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N1CCCN(C(=O)[C@H]2CC23CC3)CC1 1704306902 XJKAZSSIFXNDPT-QGZVFWFLSA-N 394.519 2.850 0 50 GFAA C/C=C(\C)CN1CCc2nnc(CCNC(=O)c3ccc(C)cc3C)n2CC1 11979299 ALYLBWFGIKSBRA-FZSIALSZSA-N 381.524 2.692 0 50 GFAA CCNC(=O)c1cn(C2CCCC2)cc(C(=O)NCc2ccc(OC)cc2)c1=O 12510264 PFKYGPXEWOKXPU-UHFFFAOYSA-N 397.475 2.652 0 50 GFAA Cc1c(CC(=O)N2CCOCC2)c2c(n1CCc1ccccc1)CCCC2=O 12761397 QYVYCEFLNQBGNY-UHFFFAOYSA-N 380.488 2.960 0 50 GFAA Cc1ccc(C(=O)N2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)cc1 15065619 JMLSCIFKKJDTPP-KRWDZBQOSA-N 382.464 2.644 0 50 GFAA COc1ccc(-c2nc3c(=O)n(C)c(O)nc3n2CCc2ccccc2)cc1 18270702 REWRHLBPIPJDIY-UHFFFAOYSA-N 376.416 2.754 0 50 GFAA biogenic Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)CN(C)Cc2cccnc2)C1 19594886 DXAWWOSEVGFSAG-QHCPKHFHSA-N 381.520 2.666 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCc3ccc4c(c3)OCO4)C1)CC2 1857730678 YRGJAXNQUYMZJK-QFIPXVFZSA-N 395.459 2.659 0 50 GFAA Cc1ccccc1[C@H](CC(=O)O)NC(=O)CCN1C(=O)CCc2ccccc21 237646189 DSCMNFAKJMLGAB-SFHVURJKSA-N 380.444 2.997 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(Cc3ccc(OCCO)cc3)C2)N1Cc1ccccc1 247732861 IMRUWVUCGRIUCE-RTWAWAEBSA-N 380.488 2.681 0 50 GFAA O=C(c1ccncc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cn1ccc2ccccc21 247806417 BKMRLROKSYFRLY-XLIONFOSSA-N 388.471 2.800 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 266656541 BIFLMRMSSTVVRH-KRWDZBQOSA-N 387.480 2.570 0 50 GFAA CNC[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)C1 911633556 HNYAFNWQHFTKGY-LAUBAEHRSA-N 377.488 2.842 0 50 GFAA O=C(Cc1cc2ccccc2nc1O)N[C@@H](CCSC(F)(F)F)C(=O)O 1875277159 ASUVUUDEFOZOAR-LBPRGKRZSA-N 388.367 2.695 0 50 GFAA CCN(CC)CCOc1cc(NC(=O)c2ccn3cnnc3c2)ccc1OC 1875321346 FIJNWYSKIYAQBY-UHFFFAOYSA-N 383.452 2.711 0 50 GFAA O=S1(=O)CC[C@]2(C(F)(F)F)CN(c3ncc(Oc4ccccc4)cn3)C[C@@H]21 1875392329 VYKYRXCKPFJUKE-HOCLYGCPSA-N 399.394 2.825 0 50 GFAA CC(=O)N1CCC2(CC1)CC(=O)c1ccc(OC[C@H]3C[N@]3CC3CC3)cc1O2 1875381615 BDXCQIMAJUUFTI-OSPHWJPCSA-N 384.476 2.506 0 50 GFAA Cc1ccc(OCCNC(=O)Nc2cccc(OCCN3CCOCC3)c2)cc1 1875319573 IITMZMZWKZFIOM-UHFFFAOYSA-N 399.491 2.907 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)NCC1(c2ccccn2)CCC1 1875400650 HYBKEJPRBDPFBS-DOTOQJQBSA-N 396.495 2.520 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3C[C@@H]4CCOC[C@]4(CO)C3)ncnc21 2100540058 BGWVJMLMZTVNKP-HRAATJIYSA-N 387.528 2.660 0 50 GFAA Cn1cc(CNC(=O)Cc2cccc3c2CCNC3)c(-c2cccc(F)c2)n1 2325769122 IPBCOKBXRCLOBZ-UHFFFAOYSA-N 378.451 2.731 0 50 GFAA C[C@H](Cc1ccc2c(c1)OCCO2)NC(=O)[C@@H]1CCc2nnc(C(C)(C)C)n2C1 2325807556 CDWZFZBIXXVUHS-GDBMZVCRSA-N 398.507 2.657 0 50 GFAA C[C@@H]1Cn2nc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cc2CN1 2325855510 DEVGXFQNUHUEIB-CQSZACIVSA-N 375.432 2.879 0 50 GFAA CC1(CC(=O)N2CC3(C[C@H](NC(=O)c4ccoc4C4CC4)c4nccn43)C2)CC1 2332237737 JSQFSPQRBQBPNZ-INIZCTEOSA-N 394.475 2.956 0 50 GFAA COc1cc(CN2CCC(C(=O)N3CCCCC3)CC2)cc(OC)c1OC 1179423 GSVGRDKIAOKUHO-UHFFFAOYSA-N 376.497 2.937 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)cc(Br)c1O 1189086 WPCQNIVROPBAHX-CYBMUJFWSA-N 399.241 2.743 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2ccccc2N2CCOCC2)C1=O 2356149379 XCZYBGIIONIZQN-JOCHJYFZSA-N 385.508 2.529 0 50 GFAA C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CC(C)(C)N(O)C(C)(C)C1 2519706 UKPRRKDPBNNIMT-AWEZNQCLSA-N 377.485 2.828 0 50 GFAA CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2cccc(C(C)=O)c2)cc1 2855866 VZPOYSJPHRSLRP-UHFFFAOYSA-N 390.461 2.595 0 50 GFAA CCOC(=O)/C=C/C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 2986982 NLESWSYNIKXHSZ-VAWYXSNFSA-N 392.408 2.684 0 50 GFAA COc1ccc(CNC(=O)C(=O)Nc2c(F)cc(F)cc2Br)cc1 4839642 ISJBSEHEZWDQMV-UHFFFAOYSA-N 399.191 2.991 0 50 GFAA Cc1ccccc1N1C[C@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)CC1=O 7450852 OHOMGHVCOGIWCG-QGZVFWFLSA-N 381.451 2.836 0 50 GFAA COc1ccccc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 10755541 NZBQVTCGYHVXEH-CYBMUJFWSA-N 380.491 2.796 0 50 GFAA CC(C)C[C@@H]1COCCN1C(=O)c1ccc(OCC(=O)N2CCCCC2)cc1 55343852 HJMPCYRHGNWDAQ-LJQANCHMSA-N 388.508 2.965 0 50 GFAA Cc1c(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)oc2c1C(=O)CCC2 20059404 LZYOABRAKHCEGC-UHFFFAOYSA-N 396.443 2.794 0 50 GFAA CCOC(=O)c1c[nH]c(NC(=O)N2CCC(C(C)=O)(c3ccccc3)CC2)n1 23430502 OBEIYJKAXHDYAC-UHFFFAOYSA-N 384.436 2.741 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCc2[nH]nc(-c3ccc4c(c3)OCO4)c2C1 67641536 WQEHPLAACUSESI-UHFFFAOYSA-N 379.420 2.680 0 50 GFAA Cc1cc(NC(=O)c2cnn(-c3ccccc3)n2)cc(N2CCN(C)CC2)c1 252507319 WGYQZMAEJOVEOK-UHFFFAOYSA-N 376.464 2.580 0 50 GFAA Cc1csc(NC(=O)[C@@H]2CCCN(C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)C2)n1 252513916 AVINFTYNRVNRDH-TUVASFSCSA-N 392.525 2.625 0 50 GFAA COCCCOc1cccc(CNC(=O)C(=O)Nc2ccc3[nH]ccc3c2)c1 120158259 CFCZWTZUWUEJPM-UHFFFAOYSA-N 381.432 2.838 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2[nH]c(CC)nc2C)C[C@H]1CCO 76863349 SLDHKSVEPHPATE-LJQANCHMSA-N 386.540 2.748 0 50 GFAA C[C@@H](CN1CC2(CCN(C(=O)c3cnn(C)c3)CC2)OC1=O)c1ccccc1 77421630 SZDKTWATRCAXOQ-INIZCTEOSA-N 382.464 2.651 0 50 GFAA CCOc1cc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)ccc1O 39557704 CQDDIGWEODWRDE-HXUWFJFHSA-N 388.483 2.999 0 50 GFAA Cc1cccc(CN(C)c2ncc(S(C)(=O)=O)c([C@@H]3CCCNC3)n2)c1C 72430608 UPBAHMDJDITHHI-MRXNPFEDSA-N 388.537 2.600 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N[C@H]2CCCN(C)C2)nc1 71315345 LGKHENYHOBODTH-SFHVURJKSA-N 384.528 2.728 0 50 GFAA CN1CCC[C@@H](CNC(=O)NCCc2nccn2C)[C@H]1c1cccc(Cl)c1 154382100 RSWZEBYISJFEJH-QFBILLFUSA-N 389.931 2.998 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(-c2ncn[nH]2)c1 125099177 WURVUENGGWJBGW-GOSISDBHSA-N 375.476 2.766 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1)[C@@H](O)c1cccc(F)c1 363720334 GWBJPWYLRRSKPQ-SOVGHPHASA-N 390.480 2.659 0 50 GFAA O=C1CCCc2nc(O)c(C(=O)N3CCNC[C@H]3c3cccc(Cl)c3)cc21 262070795 SKEBQLKMJUPLDL-KRWDZBQOSA-N 385.851 2.746 0 50 GFAA Cc1noc(C)c1CC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1 262703501 CSBGHKPIRPFOOI-KRWDZBQOSA-N 385.420 2.552 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)c2ccc(NC(=O)[C@H]3C[C@@H]3C)cc2)CC1 378148924 KTEGLMCTYASSDQ-GUYCJALGSA-N 397.479 2.618 0 50 GFAA C[C@@H](N1CCN(C(=O)C2CCN(C(=O)c3ccccc3)CC2)CC1)C(F)(F)F 177131259 ZDNACUKAJCHXAZ-OAHLLOKOSA-N 397.441 2.634 0 50 GFAA COc1ccc(NC(=O)CCC2CCN(C(=O)c3cc[nH]n3)CC2)c(OC)c1 95498299 VSYZWPATTQIMIF-UHFFFAOYSA-N 386.452 2.698 0 50 GFAA COc1ccc(-n2cccn2)c(-c2cn(Cc3nnc4n3CCCCC4)nn2)c1 91807719 KMQLUBRPYFYVOK-UHFFFAOYSA-N 390.451 2.506 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)c2cc(=O)[nH]c3ccccc23)n1 91426884 NQYBHMJLRWNZLQ-UHFFFAOYSA-N 376.338 2.618 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)Cc2csc(C(C)=O)c2)CC1 95530258 PVIVZQLLQOPVOD-UHFFFAOYSA-N 375.494 2.742 0 50 GFAA COc1cc(SC)c(OC)cc1CN1C[C@H](CO)[C@H](CN2CCCC2)C1 91426268 SGCYENUMSQPNKE-IAGOWNOFSA-N 380.554 2.562 0 50 GFAA O=C1NCCN1Cc1ccccc1NCc1nc(COc2ccc(F)cc2)no1 184449917 ZLECSQZWHKIWKC-UHFFFAOYSA-N 397.410 2.925 0 50 GFAA CCc1noc(-c2ccc(NC(=O)N3CCN(CCSC)CC3)cc2)n1 299791645 HEDSETONEUJKOO-UHFFFAOYSA-N 375.498 2.812 0 50 GFAA COCCn1cnnc1[C@H](C)NC(=O)c1cccc(N2Cc3ccccc3C2)c1 824466048 DJCAIYIWIQOESO-INIZCTEOSA-N 391.475 2.936 0 50 GFAA O=C(c1cn2ccccc2n1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 275403507 BESCKIDJVVKKJM-MRXNPFEDSA-N 377.448 2.623 0 50 GFAA O=C(O)[C@H]1CC=CC[C@H]1C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O 170002857 JCTZNKLXPAFATB-IPYPFGDCSA-N 376.840 2.619 0 50 GFAA Cc1nc(C)c(C(=O)CSc2nnc(N3CCOCC3)n2-c2ccccc2)o1 170673121 WJWSTUPHDFZIGT-UHFFFAOYSA-N 399.476 2.684 0 50 GFAA CCCCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)C1(C)C 170652257 XDQKDQDJIDTESQ-MSOLQXFVSA-N 386.496 2.920 0 50 GFAA CC(C)c1[nH]ncc1C(=O)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 193554451 NKYDHCHXOFBNIR-UHFFFAOYSA-N 376.464 2.953 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3c(C)noc3C)C[C@]2(CCc2ccccc2)C1 1772705147 WYKYZFBFJQXKCI-NZQKXSOJSA-N 397.519 2.831 0 50 GFAA CC(=O)NCc1nc(COc2ccc(C(C)(C)C)cc2)nn1-c1ccnn1C 1772806290 BHWDFJKANQQHAL-UHFFFAOYSA-N 382.468 2.513 0 50 GFAA CCCCn1nnc(NC(=S)NC(=O)CC23CC4CC(CC(C4)C2)C3)n1 5027988 AFQSEKABIPSUTH-UHFFFAOYSA-N 376.530 2.893 0 50 GFAA COc1ccc(C)cc1NC(=O)c1cccc(N2C(=O)[C@H](C)CS2(=O)=O)c1 12003967 SSPQWTJHLRHYGL-CYBMUJFWSA-N 388.445 2.568 0 50 GFAA CCn1nc(C(=O)N2CCN(C)CC2)c2c1CC[C@@H](NCCC1=CCCCC1)C2 14752218 QRLOEEKRWZVLQA-LJQANCHMSA-N 399.583 2.628 0 50 GFAA COC[C@@H](C)Nc1ncnc2sc(C(=O)N(C)Cc3ccon3)c(C)c12 15003619 PPIHKVNXBUISED-SNVBAGLBSA-N 375.454 2.707 0 50 GFAA CCCCNC(=O)CCn1ccc2cc(S(=O)(=O)N3CCCC3)ccc21 15936722 DLWHZVTWOZIMSH-UHFFFAOYSA-N 377.510 2.732 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](N3CCc4ccccc4C3)C2=O)cc1 18137612 JGALKUZYIZHNOB-IBGZPJMESA-N 378.428 2.554 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CC[C@@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778242 RIEGFISLAQJHOV-GFCCVEGCSA-N 386.362 2.571 0 50 GFAA Cn1cncc1[C@@H]1C[C@H]1C(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O 909262159 RBPWOLHSEUVORE-GUDVDZBRSA-N 377.444 2.737 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](C)CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 1875288987 OJFKZAUDSLGGFZ-ZYHUDNBSSA-N 375.366 2.758 0 50 GFAA CC1=C(C(=O)NS(=O)(=O)c2csc(-c3ccccc3)n2)SCCO1 1875317166 QEGJAYHMORLIPF-UHFFFAOYSA-N 382.488 2.610 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CCC[C@]2(C[C@H]2C(=O)O)C1 1875304802 VNLYPOWHWFWNCS-SVKFGRERSA-N 387.402 2.879 0 50 GFAA Cc1ccncc1CC(=O)Nc1cc(S(=O)(=O)NC2CC2)c(Cl)cc1F 888102441 ZGCLOOIMBAMKMI-UHFFFAOYSA-N 397.859 2.804 0 50 GFAA CCn1cnc(C(=O)N[C@@]2(C)CCN(C(=O)c3c(C(F)(F)F)coc3C)C2)c1 2325794070 PQLKXWLMYWNHQS-KRWDZBQOSA-N 398.385 2.858 0 50 GFAA CCc1ccc(N([C@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2ccccc2)cc1 1077577 KXAKABIBRZJVRC-KRWDZBQOSA-N 377.487 2.755 0 50 GFAA O=C(Cc1ccccc1)NCC(=O)OCC(=O)c1ccc(Br)cc1 1858325 WCTAGMXZUXAOHP-UHFFFAOYSA-N 390.233 2.534 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3C[C@@H]4OCCN(C)[C@H]4C3)cc2)c2sccc2n1 2356169945 NEAOHCJBAVEHAU-ROUUACIJSA-N 394.500 2.822 0 50 GFAA CCOc1ccc(N(CC(=O)N[C@H](C)c2ccccc2)S(C)(=O)=O)cc1 4851539 HJPLQKYSCIREOW-OAHLLOKOSA-N 376.478 2.729 0 50 GFAA CCS(=O)(=O)c1ccc(C(=O)NCCN2CC=C(C(C)(C)C)CC2)cc1 225402127 PEXDTCFGNPVGPF-UHFFFAOYSA-N 378.538 2.888 0 50 GFAA O=C(NCCc1csc(-c2cccnc2)n1)c1ccc(-n2cnnc2)cc1 65380813 DQVXEJDTKJVOHH-UHFFFAOYSA-N 376.445 2.758 0 50 GFAA O=C(Nc1cc(-c2nn[nH]n2)ccc1F)c1c(C(F)(F)F)nc2ccccn12 1436650201 UROXTCMWAHDJBN-UHFFFAOYSA-N 391.288 2.925 0 50 GFAA C[C@@H](Cc1ccsc1)NS(=O)(=O)c1cccc(C(=O)N2CCCC2)c1 63185958 ZJFLDNSLFLCHPR-AWEZNQCLSA-N 378.519 2.894 0 50 GFAA O=C1N[C@@H](C(=O)NCc2cccnc2Oc2cccc(C(F)(F)F)c2)CO1 67967248 JZGCJBNCKKDDTK-CYBMUJFWSA-N 381.310 2.617 0 50 GFAA CCC(C)(C)c1ccc(CNC(=O)Nc2nc(CS(C)(=O)=O)no2)cc1 120487477 LSRCGCZLGKBGBU-UHFFFAOYSA-N 380.470 2.624 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3ccc4[nH]nnc4c3)CC2)OC1=O 77299669 IVNVTROGBXEYLD-UHFFFAOYSA-N 385.468 2.965 0 50 GFAA O=C(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cn(-c2ccccc2)nn1 72120959 ANTXWGVDBYQCKK-MRXNPFEDSA-N 376.338 2.750 0 50 GFAA CC(=O)N[C@@H](CC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccccc1 150753965 MVYAUTPCARLIJU-APWZRJJASA-N 387.430 2.927 0 50 GFAA O=C1NC(=O)[C@H](Cc2ccc(OC(=O)CCCc3c[nH]c4ccccc34)cc2)N1 155156960 SWEOSIFSPDGCNW-IBGZPJMESA-N 391.427 2.847 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCn2nc([C@H](O)c3ccccc3)cc2C1 219902354 SCLBEHXLUHQQKS-LJQANCHMSA-N 385.899 2.930 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccc(F)cc4F)CC3)nn2)n1 72437806 PTUKVYBHOBBOPY-UHFFFAOYSA-N 399.405 2.603 0 50 GFAA Cc1sc2nc(Cc3noc([C@@H]4OC[C@H]5COCC[C@H]54)n3)nc(O)c2c1C 377774324 GVVWMEBNTZGNBA-UEKVPHQBSA-N 388.449 2.712 0 50 GFAA CC(C)c1ccc(C(=O)N2CCc3[nH]c(-c4cccc(CO)c4)nc3C2)c(=O)[nH]1 223138853 RGSCKCPOELBHOV-UHFFFAOYSA-N 392.459 2.579 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)cn1 91656342 RNYYRWUHFDSUBO-GOSISDBHSA-N 385.508 2.722 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@H](CCC(=O)N(C)C3CCN(C)CC3)C2)[nH]1 95526590 NGPGXGGZYPUZDS-QGZVFWFLSA-N 388.556 2.762 0 50 GFAA O=C(O)c1ccc(CNC(=O)N2CCC([C@H](O)Cc3ccccc3)CC2)cc1 426701593 KLLCZZIFNGBRTB-HXUWFJFHSA-N 382.460 2.910 0 50 GFAA CCNc1ncc(C(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)cn1 95528759 YSJDYYFMJZLNHW-CQSZACIVSA-N 397.508 2.630 0 50 GFAA Cc1nn(C(C)C)c(C)c1-c1cc(C(=O)N[C@@H](CO)Cc2ccccc2)[nH]n1 230215714 DEANLEAVWXKETI-QGZVFWFLSA-N 381.480 2.804 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)CCN3CCCC3=O)CC2)C1 96139769 JTFMVICTLSKERQ-FQEVSTJZSA-N 383.536 2.727 0 50 GFAA CNC[C@@H]1CCN(C(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)C1 299740446 ZYDYUYZSGJYJBA-AWEZNQCLSA-N 395.429 2.513 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC[C@@H](c2nnc3ccccn23)C1 363449620 LQJYIONGTOZTGS-QGZVFWFLSA-N 391.475 2.586 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3c(C)[nH]c4c3C(=O)CCC4)cc2C1 299786407 KGHIFNSJMIFOCB-UHFFFAOYSA-N 383.496 2.584 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2CCN(C(=O)Nc3cncc(F)c3)CC2)n1 299773070 CQQUDJMGENXTRH-UHFFFAOYSA-N 384.337 2.692 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1F)[C@@H]1CC(=O)N(Cc2cccnc2)C1 827696402 KTGWUWSTEOCSEO-CQSZACIVSA-N 395.356 2.904 0 50 GFAA Cc1ccc(NC(=O)CN(C)C)c(NC(=O)Cn2c(C)nc3ccccc32)c1 952868492 QGXSDRUHMFVICO-UHFFFAOYSA-N 379.464 2.792 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(C(=O)c1cc(-n3cccn3)ccc1Cl)C2 1565514335 BNDQMZAJDXDRNL-RDJZCZTQSA-N 388.899 2.709 0 50 GFAA NC(=O)C1CCN(c2ncccc2CNC(=O)c2cccc3ccsc23)CC1 274353140 PQTUKXJNAXXEBK-UHFFFAOYSA-N 394.500 2.928 0 50 GFAA CCOc1ccnc(N2CCCN(C(=O)N[C@@H]3C[C@H]3c3ccc(F)cc3)CC2)n1 195233232 DBDDHQIDASXCCF-ZWKOTPCHSA-N 399.470 2.792 0 50 GFAA COc1ccc(NC(C)(C)C(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1 1506398504 QTTWDZNFYYOTDH-UHFFFAOYSA-N 385.464 2.900 0 50 GFAA C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1ccc2c(c1)ncn2CCO 1506401487 SAPRZMXCNRRODK-CQSZACIVSA-N 381.432 2.633 0 50 GFAA COc1ccc(CNC(=O)C2CCN([C@@H](C)Cn3nc(C)cc3C)CC2)cc1 1506395950 KJBDRPXKJKGWQQ-SFHVURJKSA-N 384.524 2.925 0 50 GFAA CC(C)Cc1ccc(C(=O)NCC2CCN(CCN3CCCC3=O)CC2)cc1 1506407524 SMJXGBDGNMEKRP-UHFFFAOYSA-N 385.552 2.949 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@](C)(CO)C2)ccc1F 1704331305 QVCAHNHOLSIIEO-FQEVSTJZSA-N 391.443 2.790 0 50 GFAA C[C@H](O)c1nc2cc(-n3ccnc3-c3ccc(S(C)(=O)=O)cc3)ccc2n1C 1772818617 VKFOQRFRGOBGKW-ZDUSSCGKSA-N 396.472 2.883 0 50 GFAA CN1CCC(N2C[C@@H]3CN(Cc4cc[nH]n4)C[C@]3(CCc3ccccc3)C2)CC1 1772817612 GLHMFZCYLCIZCH-XUZZJYLKSA-N 393.579 2.871 0 50 GFAA COC(=O)c1ccccc1C(=O)N1CCC[C@H](CNC(=O)c2ccc(F)cc2)C1 11709966 AZIWMCUUDHSEQC-OAHLLOKOSA-N 398.434 2.895 0 50 GFAA COc1cccc(CNC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)c1 12056837 IUEAEISEOPMNBV-UHFFFAOYSA-N 382.372 2.921 0 50 GFAA Cc1cc(C)cc(C(=O)NCCn2cc(C(=O)N(C)Cc3ccccc3)nn2)c1 12456710 TUHPCQSVRKAOBZ-UHFFFAOYSA-N 391.475 2.597 0 50 GFAA O=C(CCC(F)(F)F)N[C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 12465581 YYDAJLNVWWQKGH-AWEZNQCLSA-N 386.418 2.521 0 50 GFAA CCn1ncc(CN(C)S(=O)(=O)c2ccc(Br)s2)c1C 14226827 GTVOVLJTAFMIQH-UHFFFAOYSA-N 378.317 2.856 0 50 GFAA CCOCCCN[C@H]1CCc2c(c(C(=O)NC)nn2CC2CCCCC2)C1 14754689 FMKPOIIFSWGJEC-KRWDZBQOSA-N 376.545 2.697 0 50 GFAA Cc1cccnc1CN(C)c1ccc(C(=O)NCc2noc(C(C)C)n2)cn1 19300783 VUAITFAKMWKCLD-UHFFFAOYSA-N 380.452 2.858 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCC(n2cc(-c3nc(C4CC4)no3)nn2)CC1 169777433 WYZVOKIMVCCRGU-UHFFFAOYSA-N 396.426 2.751 0 50 GFAA O=S(=O)(c1cccc2cccc(Cl)c12)N1C[C@@H]2CCOC[C@]2(CO)C1 1857668901 JJKNLVGTXHKCKP-KBXCAEBGSA-N 381.881 2.513 0 50 GFAA C[C@H]1CN(Cc2ccc(Sc3nncn3C)o2)CCN1c1ccc(F)cn1 1857680910 QXACDLKPWOHIPW-ZDUSSCGKSA-N 388.472 2.804 0 50 GFAA CCOC(=O)N1CCC(N2C(=O)C[C@H]3[C@@H]2CCN3CCCc2ccccc2)CC1 1857686245 NDIVFWMJQUKOJL-SFTDATJTSA-N 399.535 2.915 0 50 GFAA Cc1ccc2cc(CN3CC[C@@]45OC[C@@H](C(C)C)N4C(=O)C[C@@H]35)c(O)nc2c1 1857721002 UTRIMTJCHMMDFK-JQVVWYNYSA-N 381.476 2.807 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N[C@@H](CO)c4ccccc4)CC3)nc2n1 1857734895 XKQUPQBIRPYENK-KRWDZBQOSA-N 380.448 2.597 0 50 GFAA COc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4ccc(C)cn4)C[C@]34CC[C@H]2O4)c1 1875244060 KSTYEUNWPVIKRZ-DZCCDHAISA-N 393.487 2.812 0 50 GFAA O=C(c1ccnc2ccccc12)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210264894 FSPQVDPOPYBTEI-BEFAXECRSA-N 376.412 2.954 0 50 GFAA O=C(NCC1CCN(CCO)CC1)N[C@@H]1CCCc2cc(OC(F)F)ccc21 111845488 RFNLCKFLGNEGDQ-GOSISDBHSA-N 397.466 2.669 0 50 GFAA Cc1nc(SCC(=O)Nc2c(Cl)cccc2Cl)[nH]c(=O)c1CCO 11905758 ZWBBESHPWRIARA-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA Cc1n[nH]cc1-c1nnc(NC(=O)N2Cc3ccccc3N(C)C[C@@H]2C)s1 372511523 FOAJNGWWSWRUTH-NSHDSACASA-N 383.481 3.109 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)NC[C@H]1CCN(CCc2ccccc2)C1 264257348 CGJSEHZOPLXQLV-HXUWFJFHSA-N 389.499 2.794 0 50 GFAA O=C(Nc1ccc(-n2ncc3c(O)ncnc32)cc1)[C@H](O)c1ccc(Cl)cc1 813410650 VEURVMLHIRFJMC-MRXNPFEDSA-N 395.806 2.847 0 50 GFAA Cc1cccn2cc(COc3ccc(C(=O)NCC[C@@H]4CCC(=O)N4)cc3)nc12 952845378 FTJBUVIWDRCHGW-KRWDZBQOSA-N 392.459 2.620 0 50 GFAA O=C(O)[C@@H](c1ccc(Cl)c(F)c1)N1CCC2(CCS(=O)(=O)CC2)C1 1875304546 NITFWIMOFKUFKB-CQSZACIVSA-N 375.849 2.506 0 50 GFAA CC(C)n1cnc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2cnc3ccccn23)c1 1875333952 QSURFFNDIRKDMO-HZPDHXFCSA-N 394.479 2.583 0 50 GFAA O=C(Cc1ccc(F)cn1)N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875402382 FAHZVBYESHCEPD-CDHQVMDDSA-N 394.450 2.583 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2ccccc2)C[C@H]1NC(=O)c1c[nH]nc1C 2100545080 GQIRBUKDZNUTKK-DFQSSKMNSA-N 398.507 2.728 0 50 GFAA CN1CCN(C(=O)c2ccc(SCc3nc4ccccc4[nH]3)cc2)[C@@H](CO)C1 2325763072 YIWXBPRHJGLETP-MRXNPFEDSA-N 396.516 2.604 0 50 GFAA O=C(CCCc1ccccc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 917575 HYZYVJBMDBZCHD-UHFFFAOYSA-N 388.489 2.669 0 50 GFAA O=C(c1c(O)cccc1O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356139863 KHXAVXATODOUDI-QFIPXVFZSA-N 380.444 2.895 0 50 GFAA COC(=O)CN1C(=O)CN=C(c2ccccc2)c2cc(Br)ccc21 2290958 OJDZBRGNPHXJPR-UHFFFAOYSA-N 387.233 2.806 0 50 GFAA O=C(Cc1cccnc1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356148036 DQIHDHOZOXWTLP-QHCPKHFHSA-N 377.488 2.850 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3ccccc3-n3ccnc3)cn12 2356163475 FKVPYCVIVZNKLK-LJQANCHMSA-N 390.447 2.534 0 50 GFAA CC(=O)NCCc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1 2998353 FQWIHMVQBXHGJT-UHFFFAOYSA-N 380.897 2.540 0 50 GFAA Cc1ccc2nc(CN3CCC[C@]34CCCN([C@H]3CC[C@H](O)CC3)C4=O)cn2c1 2356164369 QKRWJHIZEZNCHN-TXTKFYIRSA-N 396.535 2.903 0 50 GFAA COc1ccc(Cc2nc3c4c(C)c(C)n(CCN(C)C)c4ncn3n2)cc1 6760227 XSVZADULYSSSPO-UHFFFAOYSA-N 378.480 2.857 0 50 GFAA C[C@H]1C(=O)N(CC(=O)O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21 8535372 XUUDFDJLYWUDFH-AWEZNQCLSA-N 394.427 2.553 0 50 GFAA Cc1cc(N2CCN(CCO)CC2)n2nc(C)c(-c3ccc(Cl)cc3)c2n1 20502600 XDTPTQAVSIQDNC-UHFFFAOYSA-N 385.899 2.781 0 50 GFAA Cc1cc(C)cc(OC[C@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)c1 225835930 PPDZXALOIAMBNK-VGOFRKELSA-N 381.428 2.864 0 50 GFAA CC(=O)CN1CCC2(CC1)c1ccccc1[C@@H](n1cnc3ccccc31)[C@@H]2O 20117849 POJGFHIZRRISRI-YADHBBJMSA-N 375.472 2.923 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1)c1cc(CN2CCC[C@@H](O)C2)on1 12595949 MPNBVSAIIQAZFX-CQSZACIVSA-N 383.370 2.580 0 50 GFAA COc1cccc(CN2CCN(Cc3ccccc3F)[C@H](CCO)C2)c1OC 39394587 AGZFTFLZHJEWAH-LJQANCHMSA-N 388.483 2.912 0 50 GFAA O=C(c1ccc(-c2cccc(O)c2)nc1)N1CCCN(c2ncccn2)CC1 67714110 FDKATKHITFLMAA-UHFFFAOYSA-N 375.432 2.597 0 50 GFAA C[C@@H]1[C@@H](NC(=O)NC(=O)CN2CCC(=O)Nc3cc(F)ccc32)CCC[C@H]1C 252670464 KQRKLCCHPGYTMZ-IPYPFGDCSA-N 390.459 2.625 0 50 GFAA CC(C)Oc1ccc(C(=O)N[C@H]2CC(=O)N(C3Cc4ccccc4C3)C2)cc1 72172460 UCDJZDLLLNVSAR-IBGZPJMESA-N 378.472 2.972 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2cnn(C)c2C(F)(F)F)n1C 328644582 RWMNRKCRBZNJNN-CQSZACIVSA-N 383.418 2.864 0 50 GFAA COc1cccc(Cl)c1CC(=O)N1CCC[C@@H]1CC(=O)c1cnn(C)c1 154075030 IAQCRTXTBZHIDL-CQSZACIVSA-N 375.856 2.889 0 50 GFAA CC(C)COC(=O)N1CCC(C(=O)N2CCC3(C2)Oc2ccccc2O3)CC1 367969160 WLSXMVCIJBQRHI-UHFFFAOYSA-N 388.464 2.891 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c(C)c1 72117716 CELTXOLETXKWKN-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CN1CCC(N(CCc2ccccc2)S(=O)(=O)N2CCCCCC2)CC1 72129594 VSGCUKYSTOJPSM-UHFFFAOYSA-N 379.570 2.746 0 50 GFAA O=S(=O)(c1cc(F)ccc1F)N1CCN(Cc2ccncc2Cl)CC1 173461990 PADGLEDBGNRFIG-UHFFFAOYSA-N 387.839 2.520 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@@H](O)c3ccc(F)cc3)c2C)cc1 241862548 SQZZHAZRWQVDTI-LJQANCHMSA-N 382.439 2.800 0 50 GFAA CO[C@@]12CC[C@H](OCC3CC3)C[C@@H]1N(C(=O)Cn1nc(C)c(C)c1C)CC2 426563580 ZLDBYOHTBFFWNV-IRFCIJBXSA-N 375.513 2.774 0 50 GFAA C[C@@H](CN1CCOCC1)NC(=O)c1ccc(-c2cnc3ccccc3n2)cc1 426523258 VTWXRGUPKWECDV-INIZCTEOSA-N 376.460 2.747 0 50 GFAA CN(C1CCSCC1)S(=O)(=O)c1cccc(C(=O)NC2CCCC2)c1 95357913 FRKBFORXAPLART-UHFFFAOYSA-N 382.551 2.875 0 50 GFAA CCc1nc(CN2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)cs1 91289405 OOVGUAKWNFSNQL-FQEVSTJZSA-N 376.570 2.614 0 50 GFAA CCCCc1nc2cc(C(=O)N3CCN(Cc4nccn4C)CC3)ccc2o1 95498284 XSSSHHLPQDFHSU-UHFFFAOYSA-N 381.480 2.862 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95522028 GZCGMYLQCBCENQ-QGZVFWFLSA-N 387.447 2.618 0 50 GFAA CCc1ccccc1OCCN(C)C(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 95367922 QMDHOKNOOFQRFW-GOSISDBHSA-N 381.476 2.530 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cccc(-n3cccn3)c2)[C@H]2C[C@@H](O)C2)c1 244773756 PFWZVUAKETZGSZ-CVAIRZPRSA-N 378.432 2.518 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCO[C@H]4CCC[C@H]43)cc2)c(C)c1CCC(=O)O 299746646 YVXKKGSKINHTRP-UXHICEINSA-N 397.475 2.900 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1 252511250 FIYSNFKLNQPDMP-GUDVDZBRSA-N 396.535 2.803 0 50 GFAA COCCn1ccc2c(OCC(=O)NC[C@@H]3COc4ccccc4O3)cccc21 263587517 HQTDMTQTUPIFAC-MRXNPFEDSA-N 396.443 2.623 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3ccc(Cl)cc3)C[C@@H]2CCC(=O)O)CC1 299766280 HZNNRIWHQXDWFR-PKOBYXMFSA-N 379.932 2.643 0 50 GFAA O=C(NC[C@H]1CC(Cc2ccc(F)cc2)=NO1)c1cc2c(nc1O)CCCC2 299788757 WSSFUUPFPDRIGN-QGZVFWFLSA-N 383.423 2.923 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)NCc1noc([C@@H]2CCCO2)n1 584891245 AAPXGXSUBYKQTJ-LBPRGKRZSA-N 377.470 2.598 0 50 GFAA COc1ccc2c(C)c(CC(=O)NCc3cn4ccc(C)cc4n3)c(=O)oc2c1 670469165 DXCKYHYMPVNFCB-UHFFFAOYSA-N 391.427 2.925 0 50 GFAA CC(C)[C@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@@H]1NS(=O)(=O)N(C)C 1565513242 NDRJFPUVXDCPPI-CVEARBPZSA-N 393.475 2.558 0 50 GFAA CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NC[C@H]1CCCNC1 170676594 RGZDAGWJKJUUMP-AVRDEDQJSA-N 381.520 2.639 0 50 GFAA Cc1nn(C(C)(C)C)cc1C(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 188134035 XHOGSCOLLJYPHJ-JOCHJYFZSA-N 384.524 2.656 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1cc(-c2nccn2C)n[nH]1 190572924 GAHAYIVRQAYQOJ-UHFFFAOYSA-N 383.362 2.835 0 50 GFAA CN1CCN(C(=O)Cc2cccc(NC(=O)c3coc(C4CCC4)n3)c2)CC1 194547438 QXGCEZRNELYDFM-UHFFFAOYSA-N 382.464 2.511 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1 194746821 DPUSEHMNZVVRCL-IBGZPJMESA-N 399.535 2.835 0 50 GFAA Cc1ccc(N2CCC(C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)nc1 195470328 WAGWHQZJGZZAIQ-UHFFFAOYSA-N 376.464 2.885 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)CC2=CSC3=NCCCN23)C[C@@H]1O 209816358 JGBOFWGCSAEVQP-GJZGRUSLSA-N 377.535 2.773 0 50 GFAA CCc1ccc(CN(C(=O)[C@H]2OCC(=O)N[C@@H]2c2ccccc2)C2CC2)cc1 1529196077 UKUYYNUNGCNAID-YADHBBJMSA-N 378.472 2.996 0 50 GFAA Cc1nccnc1N1C[C@@H]2CN(Cc3coc(C(C)C)n3)C[C@@]2(CCC(=O)O)C1 1772804218 JLDSHNRHZBDCBP-KKSFZXQISA-N 399.495 2.700 0 50 GFAA COc1ccc([C@@H](C)NCc2c(C(=O)N3CCOCC3)nc3ccccn23)cc1 11663394 MPYYYYHEUKEAMD-MRXNPFEDSA-N 394.475 2.666 0 50 GFAA CCn1ccnc1CN1CCC[C@H](CNC(=O)c2cc(OC)cc(OC)c2)C1 11664673 XMRAMPCYEDALGP-MRXNPFEDSA-N 386.496 2.562 0 50 GFAA CCOC(=O)CCNC(=O)N(C)C[C@@H]1CCCN(CCc2ccccc2C)C1 11878234 GZHFILAUQHZWSM-IBGZPJMESA-N 389.540 2.844 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 12304582 RPOQFGZWZXFBEJ-INIZCTEOSA-N 382.416 2.903 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)NCc2cccc(C)n2)o1 12434543 MQSHMYKTEZLHHU-UHFFFAOYSA-N 380.448 2.816 0 50 GFAA CCOC(=O)c1cnn2c(C(=O)OC)cc(-c3ccc(OC(F)F)cc3)nc12 13645312 RHPXLKXFRZPVLL-UHFFFAOYSA-N 391.330 2.961 0 50 GFAA CC(C)CN1C[C@@H](C(=O)N2CCCC2)C[C@@H](C(=O)Nc2ccc(F)cc2)C1 14752875 YVOIIGWYDLJALS-SJORKVTESA-N 375.488 2.981 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)CC3CCCCC3)CC2)C1 14950123 AYQLAOWBYJBDCY-SFHVURJKSA-N 375.557 2.938 0 50 GFAA O=C(NC1CCCCCC1)[C@@H]1C[C@@H](n2cnnn2)CN1CCCc1ccccc1 14996416 PSALFHXPUIMHMA-RTWAWAEBSA-N 396.539 2.760 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 19533471 WIXMQYGUYSUFSZ-HXUWFJFHSA-N 379.460 2.539 0 50 GFAA CCOc1ccc([C@@H]2NC(=O)N(Cc3c(C)noc3C)C3=C2C(=O)OC3)cc1 169760850 DGHUTKWYSWHXAF-SFHVURJKSA-N 383.404 2.768 0 50 GFAA COc1ccc(CNC(=O)c2ccc3c(c2)N(C)[C@@H]2CCCN2C3=O)c(OC)c1 169765957 KBOJRKZDYWFHCK-FQEVSTJZSA-N 395.459 2.646 0 50 GFAA Cc1cncc(CC(=O)N[C@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@@H]2O)c1 1857527547 KENHPSMZKGPIBL-JBACZVJFSA-N 390.487 2.752 0 50 GFAA CC(=O)N1CCC(N2CCC[C@@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)CC1 1857709141 HQNWWLDPSPOECQ-JOCHJYFZSA-N 386.540 2.770 0 50 GFAA C[C@H](C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1)N1CCCC1 1857716300 GHJUSKJIIWGJTC-OAHLLOKOSA-N 386.540 2.770 0 50 GFAA Cc1ccc(NC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1N1CCOC1=O 266960817 YYVNREUJZIHQDP-UHFFFAOYSA-N 395.419 2.786 0 50 GFAA CC(C)n1ncc2c(C(=O)N(C)C3CCS(=O)(=O)CC3)cc(C3CC3)nc21 1875261233 UXDZWOBXQKMYMV-UHFFFAOYSA-N 390.509 2.539 0 50 GFAA CN1CCN(Cc2cccc(CNC(=O)N3CCC[C@H]3c3ccc[nH]3)c2)CC1 1318529468 QGIWEQGXOXIYBF-NRFANRHFSA-N 381.524 2.809 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)c1c(OCc2ccccc2)c(=O)ccn1C 2100555148 MOMQYRVSNLAIDK-UHFFFAOYSA-N 394.475 2.667 0 50 GFAA CC1(C(=O)N2CCN([C@@H](COc3ccccc3)c3ccccc3)CC2)COC1 2100555639 ZTOXRJYXNMCEHU-NRFANRHFSA-N 380.488 2.987 0 50 GFAA COc1ccc([C@@H]2CCN(C(=O)CCC(=O)N3CCc4sccc4C3)C2)cn1 2325750867 FMKIBDWSLXLXQW-MRXNPFEDSA-N 399.516 2.833 0 50 GFAA N=c1ncc([C@H]2CCCCN2C(=O)c2cccc(NC(=O)NC3CC3)c2)c[nH]1 2325879260 OLWJLVPLGLFCKO-QGZVFWFLSA-N 380.452 2.540 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCc3sc(Br)cc3C2)C1 2325888418 QZLBBOCJLIYYIG-NSHDSACASA-N 383.311 2.820 0 50 GFAA COc1ccccc1[C@H]1NC(=O)NC(C)=C1C(=O)OCc1ccc2c(c1)OCO2 844458 NTLORAIHFWKAFT-LJQANCHMSA-N 396.399 2.795 0 50 GFAA COc1ccc(NC(=O)CN(c2ccccc2OC)S(C)(=O)=O)cc1Cl 1167277 YVNALCWHIUNNHS-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)Nc1nnc(-c2sc(C)nc2C)o1 2356139202 OARJRYBPCKSSHZ-LLVKDONJSA-N 399.432 2.883 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C2CCN(c3ccc(F)c(F)c3)CC2)CC[C@@H]1O 2356146254 YMYIUPGZVVDNFJ-AZUAARDMSA-N 382.451 2.871 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2CC(=O)NCCc2ccc(Cl)cc2)C1=O 2356166083 NVCYSTCUSZTKIS-OAQYLSRUSA-N 391.943 2.864 0 50 GFAA CCOCCCNS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)cc1 4814279 DCXBPJIXCOBXTA-UHFFFAOYSA-N 382.507 2.634 0 50 GFAA COc1ccc(-c2noc(CNS(=O)(=O)c3ccc(Cl)cc3)n2)cc1 4856812 TYOOKNYNUBGXDQ-UHFFFAOYSA-N 379.825 2.877 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N1CCCCCC1 100768914 OHDRKYIAFNMZNY-UQVNRYHBSA-N 392.499 2.807 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)cc1 110597742 NLHHZCUKJIZYCB-CVEARBPZSA-N 398.406 2.773 0 50 GFAA COCCC[C@H]1CCCN(C(=O)CC(=O)Nc2ccc(OC)cc2OC)C1 55168538 XHFLCEYUIQTVEW-OAHLLOKOSA-N 378.469 2.698 0 50 GFAA CC(C)C[C@H](O)C(=O)N1CCC(n2nccc2NC(=O)c2ccccc2)CC1 67805284 MQQXRXFCMRZMHM-SFHVURJKSA-N 384.480 2.706 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)CC1 280111736 ULMYJECOYFJOSA-INIZCTEOSA-N 385.516 2.522 0 50 GFAA Cc1cnc(N2CCC[C@@]3(CN=C(O)C3)C2)nc1N1CCC[C@@]2(CN=C(O)C2)C1 329805985 NOBGXZWHFGNRGZ-NHCUHLMSSA-N 398.511 2.679 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN(C)Cc3ccccc3)C2=O)c1 67723181 OWUDEYCSVAHZAN-JOCHJYFZSA-N 386.467 2.820 0 50 GFAA CCCCN1CCOC[C@H]1C(=O)NCc1cc2c(cc1OCC)C[C@H](C)O2 252552178 UQGNSAJSJZETIZ-YJBOKZPZSA-N 376.497 2.526 0 50 GFAA Cc1nn2c(CNC[C@@H]3C[C@H](F)CN3Cc3c(C)noc3C)c(C)nc2s1 330038093 ZPQSLEGXHRAQLR-GJZGRUSLSA-N 392.504 2.715 0 50 GFAA FC(F)(F)c1cn2c(n1)CC[C@@H](CNc1ncncc1Br)C2 328615637 AYZWEAMMWXYWRJ-QMMMGPOBSA-N 376.180 3.129 0 50 GFAA Cc1nc(CN2CCC(C(=O)N3CC[C@H](Oc4cccnc4)C3)CC2)cs1 123069399 BCMIKZJFTPRLIF-IBGZPJMESA-N 386.521 2.738 0 50 GFAA Cc1n[nH]c(C)c1[C@H]1COCCN1CC(=O)N1CCC(Cc2ccccc2)CC1 363106875 BEJQKNLUXOOJHF-OAQYLSRUSA-N 396.535 2.881 0 50 GFAA Cn1nnnc1-c1cccc(NC(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)c1 155698460 QFYIEKNSQKZJLO-CQSZACIVSA-N 378.219 2.856 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)c3csc(-c4cccnc4)n3)CC2)C[C@@H](C)O1 72454129 UQSFSPWZJQLGPC-GASCZTMLSA-N 386.521 2.919 0 50 GFAA Cc1c(CC(=O)N2CCC(Cc3cccnc3)CC2)nnn1-c1ccccc1 378410124 OUUMTHWVZMAEQB-UHFFFAOYSA-N 375.476 2.995 0 50 GFAA CC(C)CCn1cc([C@H](C(=O)O)N2CCC(N3CCSCC3)CC2)cn1 95381114 OJOIZSOGCOYNRZ-GOSISDBHSA-N 380.558 2.568 0 50 GFAA CCn1cc(CN(CCOC)C(=O)Nc2ccc(-c3nc(C)no3)cc2)cn1 96151058 QMVWQCQYXCDTOU-UHFFFAOYSA-N 384.440 2.942 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c1 92020326 NKPRJXLADORBQM-JOCHJYFZSA-N 380.492 2.806 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2cc(F)c(F)c(O)c2F)c2ccsc2S1(=O)=O 292053658 SXOUOOCCFXAKDB-WKEGUHRASA-N 391.392 2.908 0 50 GFAA N[C@H]1CCCN(C(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)C1 95528512 WZNDGDOYKGFJSL-IBGZPJMESA-N 394.519 2.688 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C2Cc3ccccc3C2)CC1 96151773 BASXVMRTLIYJNN-UHFFFAOYSA-N 376.508 2.890 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2noc(C(C)C)n2)CC3)cn1 92066634 OIQXYITWBCOBEL-UHFFFAOYSA-N 398.511 2.696 0 50 GFAA COCCCN1CC2(CCN(CC(=O)Nc3ccc(C)c(C)c3)CC2)CC1=O 95364708 LIGJOBJSUAPRPP-UHFFFAOYSA-N 387.524 2.593 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCC[C@@H](CNC(=O)c4cccnc4)C3)[nH]n2)o1 95497858 WIRTYYPNPPEAOH-HNNXBMFYSA-N 393.447 2.655 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C)C3)cn1 91644585 OWAGEMGLBCBZRU-IBGZPJMESA-N 378.476 2.653 0 50 GFAA CN(CC1CCN(CCc2cccc(C(F)(F)F)c2)CC1)C(=O)[C@H]1C=CCN1 95513190 RDSQBEHPQBIXQN-LJQANCHMSA-N 395.469 2.946 0 50 GFAA COCCn1c(CN(C)Cc2[nH]c3ccccc3c2C)nnc1[C@H]1C[C@@H](N)C1 244715759 LBQQXCQXKOCSKA-IYBDPMFKSA-N 382.512 2.551 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)NCc1ccc(C)cc1 253487813 QXXLHODIWNSIJU-MTNREXPMSA-N 393.531 2.857 0 50 GFAA Cc1cc(=O)c2cc(-c3cccc(C(=O)N[C@H]4CCC(=O)N(C)C4)c3)ccc2[nH]1 534657123 AMPVBIQJEPIWLG-SFHVURJKSA-N 389.455 2.854 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N[C@H](C)c2nc(-c3ccccc3C)no2)c1C 952978724 SGKMTKXWIPETTQ-CYBMUJFWSA-N 381.436 2.938 0 50 GFAA CCOc1cc(C)nc(N2CCN(c3ccnc(Cc4ccccc4)n3)CC2)n1 302185977 UUVIQAVMGRFLJT-UHFFFAOYSA-N 390.491 2.891 0 50 GFAA CC(C)COc1ccc(C(C)(C)C(=O)N2CCS(=O)(=O)C[C@@H](C)C2)cc1 191903651 IJJFALKJSUYGJH-INIZCTEOSA-N 381.538 2.892 0 50 GFAA CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H]1CCCCC(=O)N1 193941121 JPIDYELZNGJECD-INIZCTEOSA-N 385.430 2.654 0 50 GFAA C[C@@H](NC(=O)c1cnc2n1CCCC2)c1cc(F)ccc1N1CCC(O)CC1 750777518 SWYBNFSCIWQJGU-CQSZACIVSA-N 386.471 2.811 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)C1CC(F)(F)C1 788420766 WMAFSDUYEBPNBQ-VIFPVBQESA-N 397.827 2.604 0 50 GFAA CCN(CCCN1CCOCC1)S(=O)(=O)c1cc(C)c(F)cc1Cl 1506399922 FUBXGQJRPFMQCD-UHFFFAOYSA-N 378.897 2.520 0 50 GFAA COCc1nnc(NC(=O)CN(C)Cc2csc(-c3ccccc3)n2)s1 1529191898 IMCKDXHZLFKLAY-UHFFFAOYSA-N 389.506 2.879 0 50 GFAA O=C(NCc1cccc2[nH]ccc12)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1775983930 WBXVWTVBSFUFIQ-CQSZACIVSA-N 396.516 2.882 0 50 GFAA COCCN(C)Cc1cccc(OC[C@@H](O)CN2CCc3ccccc3C2)c1 11704083 PPWLMXZSUDBVLL-QFIPXVFZSA-N 384.520 2.563 0 50 GFAA Cc1c(C(=O)N2CCC[C@H]2CO)sc2ncnc(NCc3ccccn3)c12 12079917 FAGHIZCIYZVZLM-AWEZNQCLSA-N 383.477 2.604 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc(NC(=S)NC(=O)C2CCCCC2)cc1 12138798 YJWFSLDEHOTZRM-QGZVFWFLSA-N 389.521 2.989 0 50 GFAA O=C1NCCN(Cc2ccccc2C(F)(F)F)[C@H]1CC(=O)N1CCCCCC1 15063626 GAFZPQVOZCIZKA-KRWDZBQOSA-N 397.441 2.799 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)C2CCOCC2)C1)NCc1ccccc1F 15073680 IDHVQWXJGYJIOG-INIZCTEOSA-N 376.472 2.887 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2ccncc2)cc1C(=O)N1CCCC1 16650937 RIPDZBFRKNEYGY-UHFFFAOYSA-N 391.518 2.518 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCc4cscn4)CC3=O)sc2c1 1857668138 WWINFEYGNCRESM-LBPRGKRZSA-N 386.502 2.773 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)cs1 1857735909 DCQBFWKGQPTAAS-FQEVSTJZSA-N 384.505 2.874 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N2CCC(Oc3ccccn3)CC2)n[nH]1 333380023 ASUKPUXDQUTZSP-UHFFFAOYSA-N 380.452 2.506 0 50 GFAA CC(C)[C@@H](CNC(=O)NCc1cccc(S(N)(=O)=O)c1)Cc1ccccc1 241144877 JTVSJEHGTXSCME-GOSISDBHSA-N 389.521 2.648 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H](C3=CC(=O)OC3)[C@@H](O)C[C@@]12O 253530238 PVAMXWLZJKTXFW-UIHIFSCKSA-N 390.520 2.575 0 50 GFAA biogenic CN(C)CCn1nnc2c1C[C@@H](c1nc(C34CC5CC(CC(C5)C3)C4)no1)CC2 952895573 WUNHCMBMMVWVJB-ATFGOMPUSA-N 396.539 2.963 0 50 GFAA O=C(NCCc1ccc(N2CCC2)nc1)N1CCC2(CC1)CC(C1CC1)=NO2 1875397351 WZKKAKCMCSCUGP-UHFFFAOYSA-N 383.496 2.565 0 50 GFAA C[C@H]1C[C@@H](C(=O)N2CCOC3(CCS(=O)(=Nc4ccccc4)CC3)C2)CO1 1875395763 LIHJTGUKBHRYDC-VFMLLSAASA-N 392.521 2.603 0 50 GFAA CCc1c(-c2nc(Cn3cncn3)nn2[C@H](C)C(C)C)nnn1-c1ccccc1 1875349448 XIAHRSUZROCMGK-OAHLLOKOSA-N 391.483 2.945 0 50 GFAA Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N[C@@H]3C[C@H]4CNC[C@@H]3C4)c12 1875301331 FUFIAWPJPCUIQB-QILLFSRXSA-N 375.476 2.672 0 50 GFAA O=C(NC12CCC(C(=O)O)(CC1)CC2)[C@H]1CC(=O)N(C2CCCCCC2)C1 1875304927 ZPKAXJILPKJDAR-VUZGARFFSA-N 376.497 2.852 0 50 GFAA Cc1ccc2c(c1)C[C@@H](C(=O)Nc1cccc([C@@H]3CCCC(=O)N3)c1)S2(=O)=O 1875392623 KWFSIZJFBGNZMF-HKUYNNGSSA-N 398.484 2.673 0 50 GFAA O=c1c2cnc3nc(-c4ccc(Cl)cc4)nn3c2ccn1C[C@H]1CCCO1 15106544 NAJCXIHOPSWDFN-CQSZACIVSA-N 381.823 2.939 0 50 GFAA CCc1nocc1C(=O)N1CC[C@H]([C@H](C)Nc2ncc(Br)cn2)C1 2325841287 MWTUZBHRWCZVPU-QWRGUYRKSA-N 394.273 2.752 0 50 GFAA NC(=O)[C@H](CC(=O)N[C@H](CO)c1cccc(O)c1)c1ccc(Cl)cc1Cl 2325851143 QEAGIDJZUQKMHI-GDBMZVCRSA-N 397.258 2.508 0 50 GFAA O=C(N[C@@H](CO)[C@H](O)c1cccnc1)c1cccc2[nH]c(-c3cccs3)nc12 1471065738 DHMVCGPMQTUXIV-MAUKXSAKSA-N 394.456 2.511 0 50 GFAA Fc1cc(F)cc(N2CCC[C@@H](Nc3cc(N4CCOCC4)ncn3)C2)c1 2332239244 ACKKKOUAGAQSGT-MRXNPFEDSA-N 375.423 2.672 0 50 GFAA CCOc1ccc(C2C(C(=O)OC)=CN(C)C=C2C(=O)OC)cc1OCC 1074932 IPZNIKQXZLQRSC-UHFFFAOYSA-N 375.421 2.627 0 50 GFAA O=C1C[C@H](C(=O)N2[C@H]3CCC[C@@H]2C[C@H](O)C3)CN1c1nc2ccccc2s1 2356147877 VHPUWZKOZNPZSG-BYNSBNAKSA-N 385.489 2.554 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)CCOc3ccccc3)C1)CC2 2356154019 FCPCXATXZIFFGO-JOCHJYFZSA-N 380.492 2.818 0 50 GFAA CCc1ccccc1-n1cc(C(=O)Nc2ccc(N3CCOCC3)nc2C)nn1 412200011 PBYWBJRLDVYHHZ-UHFFFAOYSA-N 392.463 2.622 0 50 GFAA COc1cc(F)ccc1N1CCN(C(=O)c2cnn(-c3ccccn3)c2C)CC1 115126503 OGNUZQCPHMRJHC-UHFFFAOYSA-N 395.438 2.686 0 50 GFAA Cc1cccc(CN2CCN(Cc3ccc(O)c(Cl)c3)C[C@H]2CCO)n1 104383939 ZLVUAVNLUMZKME-GOSISDBHSA-N 375.900 2.818 0 50 GFAA CN(C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1)C1CCCCC1 55042047 ZCBVTMKIQDBSMZ-SFHVURJKSA-N 395.906 2.961 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1Cc1ccccc1F 107100342 FISKBNHOSSBUQU-LJQANCHMSA-N 386.467 2.666 0 50 GFAA Cc1n[nH]c(C)c1CCNCc1ccccc1OC[C@H](O)CN1CCCCC1 20452998 OOMQAIFMYUIRTQ-HXUWFJFHSA-N 386.540 2.584 0 50 GFAA COc1cc(N2CCN(C(=O)[C@@H](C)Oc3cccc4ccccc34)CC2)ncn1 469801725 SIXUFXFEZMEGCD-MRXNPFEDSA-N 392.459 2.755 0 50 GFAA CCc1nnc([C@@H]2CN(S(=O)(=O)/C=C/c3ccc(Cl)cc3)CCO2)o1 328632766 SDGSRXPLZDCFBW-RNVIBTMRSA-N 383.857 2.659 0 50 GFAA Cc1ccc(NC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)cc1Cl 252494533 NXXWJSJYSSLKFU-UHFFFAOYSA-N 382.869 2.736 0 50 GFAA C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1S(=O)(=O)N1CCC[C@@H](C)C1 229823728 ANOGRMAOSNIZQI-PMPSAXMXSA-N 389.562 2.731 0 50 GFAA S=C(NCCCn1cc(Br)cn1)Nc1ccc2c(c1)OCCO2 6402631 URHXMTAZWUYNCV-UHFFFAOYSA-N 397.298 2.794 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1ccc3c(c1)OCO3)CC2 120815608 HDHTYUJJUVWHGW-LBPRGKRZSA-N 393.365 2.954 0 50 GFAA COc1ccc(F)cc1C(=O)[C@H]1CCCN(C(=O)CCN2CCCCO2)C1 12594299 VCJLGHJRDRKMHO-HNNXBMFYSA-N 378.444 2.673 0 50 GFAA O=C(C[C@H]1CCCO1)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 238215575 GAAUVGANZHICQS-IUODEOHRSA-N 395.253 2.611 0 50 GFAA O=C(CN[C@@H]1CCc2ccccc2OC1)Nc1nc(CN2CCCC2)cs1 366977081 RGGLICXIHPPUJF-MRXNPFEDSA-N 386.521 2.661 0 50 GFAA CC(C)NC(=O)c1cc(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)ccn1 72168320 AQGGRMSWYHTSFM-UHFFFAOYSA-N 379.464 2.704 0 50 GFAA CSc1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)cn1 39508641 URKUOOXSVIUQCE-MRXNPFEDSA-N 394.491 2.546 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@H](C(=O)N3Cc4ccccc4C3)C2)CC1 71747792 JKEJCBSJPXSZKK-FQEVSTJZSA-N 381.520 2.642 0 50 GFAA COc1cc(-c2nc(C)cnc2C)cc2c1OCCN(C(=O)[C@@H]1CCCO1)C2 15002768 NDVZGAMFDCKQGG-KRWDZBQOSA-N 383.448 2.669 0 50 GFAA O=C(Cn1ncc2ccccc21)N1CCC(n2cc(-c3ccccn3)nn2)CC1 48379543 VOMGYOUMSVLPLE-UHFFFAOYSA-N 387.447 2.554 0 50 GFAA CCCNC(=O)Cc1noc([C@H]2CCCN2C(=O)c2ccccc2OCC)n1 289113064 KXKWEZQOYMCHHP-OAHLLOKOSA-N 386.452 2.514 0 50 GFAA C[C@H](Cc1cccs1)NC(=O)N1CCN(C(=O)COc2ccccc2)CC1 426706003 ZAEUQEUHTWYXPD-MRXNPFEDSA-N 387.505 2.612 0 50 GFAA CNC[C@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)C1 178999482 PEWAMAGHBWDOHE-VQIMIIECSA-N 389.499 2.679 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CCc3c(C)noc3C)[nH]c2C1 95371543 VVRANAFDVITXPQ-AWEZNQCLSA-N 380.448 2.878 0 50 GFAA CO[C@@H](CNC(=O)N1CCC(CCN2CCCC2=O)CC1)c1cccs1 426548803 PFIMCEMQNORJNW-INIZCTEOSA-N 379.526 2.870 0 50 GFAA CCSc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCO)C3)C2)s1 92065336 QVSBICWATMUYJT-SFHVURJKSA-N 382.551 2.697 0 50 GFAA Cc1ccc(SCCN(C)C(=O)[C@@H]2CC(=O)N(Cc3ccncc3)C2)cc1 97475024 MLYMNEAEPWDILU-GOSISDBHSA-N 383.517 2.989 0 50 GFAA O[C@@H]1CN(Cc2ccccc2)CCN(C2CCN(c3ccccc3F)CC2)C1 95513026 PXNAEJYLMYDWPM-OAQYLSRUSA-N 383.511 2.973 0 50 GFAA O=C1CCc2cc(NC(=O)N3CCN(Cc4ccccc4)C[C@H]3CO)ccc21 95527857 WQNZTIOFKCFALK-IBGZPJMESA-N 379.460 2.526 0 50 GFAA Cn1c(CN2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)cc2cc(F)ccc21 91620971 PTLUMMQKOOLIBG-VGSWGCGISA-N 389.515 2.613 0 50 GFAA CCN1CCN(CC(=O)N2CC[C@@]3(CCCN(CC4CCCCC4)C3)C2)CC1 23358062 YAQAYENCQOFNEI-HSZRJFAPSA-N 390.616 2.519 0 50 GFAA O=C(CN1CCCC1)N1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2 96164499 DJKCKNIYAHPUDN-OAQYLSRUSA-N 395.547 2.870 0 50 GFAA CNC(=O)Cc1ccc(NC(=O)NC[C@@H]2CCN(c3ccccc3C)C2)cc1 97610106 AHTSNASJJOVIGX-SFHVURJKSA-N 380.492 2.932 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@H]1C=Cc3cc(F)ccc3N1[C@H]2C(=O)c1ccc(Cl)cc1 247800743 FODXHQMLJQBXRZ-XMTFNYHQSA-N 396.805 2.835 0 50 GFAA O=S(=O)(N[C@H]1CCCN(c2ccccc2F)C1)c1ccc2c(c1)OCO2 183183720 UGJSJUOXICRTRY-ZDUSSCGKSA-N 378.425 2.502 0 50 GFAA O=C(O)COc1cccc(CNC(=O)c2ccccc2OC[C@@H]2CCCO2)c1 299741730 AJJUADILXJDUGU-KRWDZBQOSA-N 385.416 2.638 0 50 GFAA CCc1nc2ccccc2c(C(=O)N2CCN(c3cc(OC)ncn3)CC2)c1C 183833041 IUZLYQRADKSHLN-UHFFFAOYSA-N 391.475 2.867 0 50 GFAA CCN(Cc1ccccc1OCCN1CCN(C)CC1)C[C@H]1CCCCO1 952972443 OXMNNFFJWLCCQH-OAQYLSRUSA-N 375.557 2.704 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1ccc2ccccc2c1O 271221867 CUWWQYQWWREMHC-OAHLLOKOSA-N 399.472 2.971 0 50 GFAA CC[C@@H](NC(=O)N1CCc2n[nH]c(=O)cc2C1)c1ccccc1OC(F)F 274818798 DMLYILOSTHJBLL-CYBMUJFWSA-N 378.379 2.590 0 50 GFAA CN(C)c1ccncc1C(=O)N1CCN(Cc2nc3ccccc3s2)CC1 186350527 KKACTQPODMALEZ-UHFFFAOYSA-N 381.505 2.715 0 50 GFAA O=C(NCc1ccc(CN2CCOCC2)o1)[C@H]1C[C@H]1c1cccc(F)c1F 170595050 HBLGASAMKCYBIC-IRXDYDNUSA-N 376.403 2.810 0 50 GFAA CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NC[C@@H]1CCCNC1 170676590 RGZDAGWJKJUUMP-XMSQKQJNSA-N 381.520 2.639 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCN(CCOc3ccccc3)CC2)o1 1506400456 NBHUMQVVLLYIQF-UHFFFAOYSA-N 399.520 2.756 0 50 GFAA Cc1nc2sccn2c1C(=O)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529162136 WZAVUMFOYWKJFO-CRAIPNDOSA-N 392.484 2.928 0 50 GFAA Cc1ccc(C(=O)N2CCCN(Cc3nc4ccccc4n3C)CC2)c(C)n1 1529191856 GRWZEUVCNUHOMO-UHFFFAOYSA-N 377.492 2.933 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)c3ccc(Cl)s3)CC2)C1 11753766 UXHPIRULTVQQDA-ZDUSSCGKSA-N 395.956 2.997 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)Cc2ccncc2C)CCC1=O 11820800 LHWXFNOINQVNCZ-LJQANCHMSA-N 381.476 2.796 0 50 GFAA CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(N3CCCCC3=O)cc2)c1 11906595 XAWCXFHLSBRBDG-UHFFFAOYSA-N 387.461 2.963 0 50 GFAA Cc1nccn1CCN(C)C(=O)c1cc(COc2cncc(Cl)c2)on1 12297349 VGUWMCFKDXUUBQ-UHFFFAOYSA-N 375.816 2.579 0 50 GFAA O=C(c1cccs1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 13331668 NPYSHDQSAOTJAO-UHFFFAOYSA-N 376.912 2.610 0 50 GFAA COc1ccccc1Cn1ccc2c(cnc3nc(-c4ccncc4)nn32)c1=O 13727696 ATQWQLLVDSWZHH-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@]1(O)CNCc1cc(F)ccc1F 14971325 WMPQSVQHNBZTRW-FQEVSTJZSA-N 396.384 2.886 0 50 GFAA S=C(Nc1ccccc1)N[C@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3 19637663 WZVSEUQOHORVNL-DHHCDUQHSA-N 378.545 2.541 0 50 GFAA Cc1cc(CNc2ccc(C(=O)NCC[C@@H]3COc4ccccc4O3)cn2)no1 19840211 GZPWKKDZGXIFPF-QGZVFWFLSA-N 394.431 2.950 0 50 GFAA Cc1cccc(N2CCC(N3C[C@H](COc4ccc(F)cc4)OCC3=O)CC2)n1 1857713772 NCWFLPSVNYMYEO-HXUWFJFHSA-N 399.466 2.804 0 50 GFAA Cc1cnccc1N1C[C@@H]2[C@H](CNC(=O)c3cccnc3C)[C@H]3CC[C@]2(C1)O3 1857724594 JJSPAPMEYVFPPW-XHYAQGIWSA-N 378.476 2.507 0 50 GFAA CC(C)c1nccc(C(=O)N2CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]24)n1 1857731867 RTTZGDANYFQLQJ-SVMVAKDDSA-N 392.459 2.515 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4cc[nH]n4)C3)nc2c1 1857739891 XMTDHJKCWSWJAD-AWEZNQCLSA-N 383.452 2.525 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)s1 328617432 CTFFYOJBZZFEIA-SNVBAGLBSA-N 379.429 2.813 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)CN2C(=O)c1cn2ccsc2n1 251921504 AZQRZQULMDLFNZ-CABCVRRESA-N 385.493 2.737 0 50 GFAA COc1cc(C)cnc1C(=O)N1CCNC(=O)[C@H]1c1ccc(C(F)(F)F)cc1 489725346 CTIDGZLQBAEBDX-MRXNPFEDSA-N 393.365 2.731 0 50 GFAA CCc1nnc(NC(=O)c2c(F)ccc(S(=O)(=O)CC3CC3)c2F)s1 822686408 OUFXQJIYWJQWPL-UHFFFAOYSA-N 387.433 2.815 0 50 GFAA FC(F)COCCN1CC[C@@](c2nc(-c3ccncc3)no2)(C(F)(F)F)C1 952892942 QDIKGUXWYLXYRE-OAHLLOKOSA-N 392.328 2.919 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1CC(Nc2ccccc2)C1 874714922 GPAKGSHCCURVKW-OBFZPWGMSA-N 390.487 2.974 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N2CCC[C@@]23CCC[S@@](=N)(=O)C3)c1 1875395950 QUDGZUAMLOWHMZ-AFMDSPMNSA-N 377.510 2.594 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3ccccc3[C@@H]2C(=O)OC)cc1 1875371973 SKLNIANTXBWDED-HXUWFJFHSA-N 378.428 2.748 0 50 GFAA Cc1cc(C(=O)N[C@@](C)(C(=O)O)c2cc(F)ccc2F)c2nc(C)n(C)c2n1 1875304556 NPUTZEYLIAEWGE-LJQANCHMSA-N 388.374 2.593 0 50 GFAA Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)N[C@@H]1[C@H]2CC[C@@H]1C[C@H](CO)C2 1875321718 SJRIMCHTLAGVPA-MAMSFEPMSA-N 380.488 2.981 0 50 GFAA O=C(Cn1c(=O)cnc2ccccc21)Nc1cc(C(F)(F)F)c2cn[nH]c2c1 1303845476 ALCRXYDFIOXMRF-UHFFFAOYSA-N 387.321 2.930 0 50 GFAA COc1ccc([C@H]2CCN(C(=O)CCC(=O)N3CCc4sccc4C3)C2)cn1 2325750866 FMKIBDWSLXLXQW-INIZCTEOSA-N 399.516 2.833 0 50 GFAA CC(C)c1ccc(-c2nnc(NC(=O)c3cnc(N4CCNCC4)o3)s2)cc1 2325800985 PKFWISVCPSUMPY-UHFFFAOYSA-N 398.492 2.978 0 50 GFAA O=C(CCn1cnc2cc(F)c(F)cc21)NC[C@@H]1NCCc2sccc21 2325810549 RCGBMXMLVVMGIA-HNNXBMFYSA-N 376.432 2.769 0 50 GFAA Cc1c(C(=O)N2CCc3ccccc3[C@H]2CC(=O)O)nnn1-c1ccccc1 2325877754 ZGJQEQLAPIEOJF-GOSISDBHSA-N 376.416 2.790 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cc(C(=O)N3CCOCC3)ccc2Cl)cc1 1064345 FBUKDUYRGVGEHW-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1)NC1CCCCCCC1 12058731 VLKYZZXNZIYMOZ-IBGZPJMESA-N 375.488 2.745 0 50 GFAA CCCCn1c(CN2CCC[C@H]2CO)cnc1S(=O)(=O)CCCC(C)C 12303848 FHYBPIJNYKQCCO-KRWDZBQOSA-N 385.574 2.850 0 50 GFAA COc1ccc(CCN2C[C@@H](NCc3ccc(-n4cccn4)cc3)CC2=O)cc1 12454228 AZBNKIPIRWWEHH-FQEVSTJZSA-N 390.487 2.814 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)c2ccc(C)nc2)CC1 12571404 SAFZLEFKJOXZKX-HXUWFJFHSA-N 386.540 2.623 0 50 GFAA O=C(NC1CCC1)[C@@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 14980879 RTECLDABVRXVKC-HXUWFJFHSA-N 381.564 2.999 0 50 GFAA COc1ccc(CNC(=O)CN2Cc3cc(C)ccc3O[C@@H](C)C2)cc1OC 14991528 QXSIOJSYESBPRT-INIZCTEOSA-N 384.476 2.912 0 50 GFAA COc1ccc(N2C(=O)CN(C(=O)Cc3cscn3)CC23CCCC3)cc1 14991903 VSXLEXOXCYUVBT-UHFFFAOYSA-N 385.489 2.882 0 50 GFAA O=C(NCC1(N2CCOCC2)CCCCCC1)[C@H]1CCN(c2ccccc2)C1=O 19223967 VUEILZDRGLBRFQ-HXUWFJFHSA-N 399.535 2.581 0 50 GFAA CCN1CCN(CC(=O)Nc2sc3c(c2C(=O)OC(C)C)CCCC3)CC1 20608813 VSFZSJUUMINWGC-UHFFFAOYSA-N 393.553 2.768 0 50 GFAA CS(=O)(=O)Nc1ccc2c(c1)NC(=O)C[C@@H]2c1coc2ccccc2c1=O 65428744 CFXKSJCTNUGOSW-AWEZNQCLSA-N 384.413 2.639 0 50 GFAA Cc1c[nH]c(CN2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)c(C)c1=O 67472994 UFTHTCHDQPSBRO-UHFFFAOYSA-N 379.416 2.934 0 50 GFAA Cc1ccccc1-c1cc(O)c2c(c1)CN(C(=O)CCn1cnnc1)CCO2 67803263 NYCXEFGSUYCJAZ-UHFFFAOYSA-N 378.432 2.770 0 50 GFAA CCSCCN1CCC(N2CCC[C@H](C(=O)NCc3ccccn3)C2)CC1 71776474 PMDWLCDQCIWPIV-SFHVURJKSA-N 390.597 2.627 0 50 GFAA Cc1cc(=O)oc2cc(NC(=O)[C@@H](N)CC(=O)OCc3ccccc3)ccc12 71788407 PWZVZTVBRXAIHO-KRWDZBQOSA-N 380.400 2.501 0 50 GFAA O=C(Nc1ccc(F)cc1)[C@H]1CN(Cc2c(Cl)cncc2Cl)CCN1 72158356 FPZUWOCCTCSVDV-MRXNPFEDSA-N 383.254 2.940 0 50 GFAA CCN1CCN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CC1=O 72448596 ANOARXUYOLTYGW-UHFFFAOYSA-N 391.475 2.975 0 50 GFAA O=C1CC[C@@]2(CCCN(Cc3ccc4c(c3)OCO4)C2)CN1CCc1c[nH]cn1 91435225 FQFPKBKIJNEJPN-JOCHJYFZSA-N 396.491 2.586 0 50 GFAA O=C1CNc2ccc(C(=O)N3CCC[C@H](c4ccc(C(=O)O)cc4)C3)cc2N1 95382912 JGWRWQZYDNVTFA-INIZCTEOSA-N 379.416 2.769 0 50 GFAA CCN1CCN(C[C@@H]2CN(Cc3cccc(Cl)c3Cl)C[C@@H]2CO)CC1 95386380 STCWQCBAUMCSBH-IAGOWNOFSA-N 386.367 2.671 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95500493 ISWXYSCDYOSPSI-INIZCTEOSA-N 376.464 2.558 0 50 GFAA O=C(Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1)NC1Cc2ccccc2C1 95516627 DOJLQYNIXCBYRV-FQEVSTJZSA-N 379.460 2.884 0 50 GFAA O=C(Nc1snnc1-c1ccccc1)N1CCCO[C@H](Cn2cccn2)C1 95526885 IMYKYTAFMBEBQE-HNNXBMFYSA-N 384.465 2.725 0 50 GFAA O=C(N[C@H]1c2ccccc2C[C@H]1O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 130818894 HMWNQOWDRXIDLH-DBVUQKKJSA-N 379.460 2.705 0 50 GFAA Cc1[nH]ncc1CNC(=O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 139234437 NOXDTPMLPHYNQU-OAHLLOKOSA-N 381.263 2.946 0 50 GFAA COc1cccc2c1CC[C@@H]2NC(=O)N1CCC(OCCN2CCCC2)CC1 154758157 WSNDGSFICHFRKH-FQEVSTJZSA-N 387.524 2.969 0 50 GFAA Cc1nc(S)sc1CC(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1 155281406 FXTBXCQGEQJLTC-CABCVRRESA-N 378.519 2.634 0 50 GFAA Cn1ccnc1[C@@H](O)C1CCN(C(=O)NCc2ccnc3ccccc23)CC1 159024138 HRXKZZZOYQEXSU-IBGZPJMESA-N 379.464 2.624 0 50 GFAA O=C(NCc1nnc2c(-c3nc(C4CC4)no3)cccn12)c1cc(F)ccc1F 169776080 ZTNHNHGPRBVLMS-UHFFFAOYSA-N 396.357 2.865 0 50 GFAA O=C(Cc1ccc(F)cc1)NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12 169776297 QMNSPNBZISDETO-UHFFFAOYSA-N 392.394 2.655 0 50 GFAA Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)N[C@H](C)c1ncc[nH]1 170617836 GAXVVTFEDCZZAT-OAHLLOKOSA-N 398.488 2.688 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](c2cccc(F)c2)C1 171158773 VCPYGVXPZLCURN-NRFANRHFSA-N 398.482 2.968 0 50 GFAA C[C@H](NC(=O)c1ccn(-c2ccc(F)cc2F)n1)c1ccc2c(c1)NC(=O)CO2 185082692 XMHXFXZERLMGJW-NSHDSACASA-N 398.369 2.972 0 50 GFAA COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CC(=O)N1CCC(Cc2ccccc2)CC1 241383220 MTJZANLJPICYSM-ONTIZHBOSA-N 384.520 2.741 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)N[C@H]1CCN2CCCC[C@@H]12 252474639 IWNPOKCRHAQPAA-JVPBZIDWSA-N 378.467 2.717 0 50 GFAA CC1=C[C@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@H]4[C@@]2(O)[C@H]1O)[C@H]1[C@@H](C[C@H]3C)C1(C)C 253387921 ONMDPPVVEFWDOD-QGGFQLKMSA-N 388.504 2.614 0 50 GFAA Cc1cnc(C)c(-c2cccc(C(=O)NCC[C@H](C)N3CCN(C)CC3)c2)n1 299798971 UAOZTSQEGDDKTR-KRWDZBQOSA-N 381.524 2.516 0 50 GFAA CN(C)c1nc(N)cc(-c2cccc(C(=O)N(Cc3cccnc3)C3CC3)c2)n1 426511530 CDLPBHNMOBLUDS-UHFFFAOYSA-N 388.475 2.992 0 50 GFAA Cc1csc([C@@](O)(CC(=O)N2CCC(c3cn[nH]c3)CC2)C(F)(F)F)n1 735931369 ZRWBKPBPHZWNDS-HNNXBMFYSA-N 388.415 2.721 0 50 GFAA Cc1cc(O)nc(S[C@H](C)C(=O)NCc2nc3ccc(Cl)cc3[nH]2)n1 827647226 HJGUCIHJXDKNGK-SECBINFHSA-N 377.857 2.817 0 50 GFAA Cc1ncncc1C(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H](Nc2ncccn2)C1 888103763 XRRQNMLTWAKTTD-MJGOQNOKSA-N 392.438 2.825 0 50 GFAA CN(Cc1cc(=O)n2nc(C3CC3)sc2n1)C[C@H]1CCN(c2ccccc2)C1 1506395076 BCQRPDAYBXDGEF-OAHLLOKOSA-N 395.532 2.987 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N2CCC3(CCc4ccccc43)CC2)C1 1506403330 NWHWTRKPRYEEMR-QGZVFWFLSA-N 378.538 2.570 0 50 GFAA Cc1c(CN2CCC[C@H](CNC(=O)Cc3cn(C)c4ccccc34)C2)cnn1C 1506416126 HWFONPXQOUNLNK-GOSISDBHSA-N 393.535 2.791 0 50 GFAA COc1ccc2cc([C@H]3CN(CC(=O)Nc4cnn(C)c4C)CCO3)ccc2c1 1506421679 KQYIOOSTKUBAPO-OAQYLSRUSA-N 394.475 2.902 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3CCC4(CC3)CN(C)C(=O)CO4)c2)c1 1772816545 PJLPCXLSEQWMLJ-UHFFFAOYSA-N 394.471 2.826 0 50 GFAA Cc1ccccc1N1CCC[C@H](NC(=O)c2ccnc(N3CCCCC3)n2)C1=O 1857532499 LFCFJKMDZAWYEE-SFHVURJKSA-N 393.491 2.701 0 50 GFAA CN(C)c1ccc(CN2CCC3(CC2)OCCc2cc(C(=O)O)sc23)cn1 1857683624 YDRLEOHFMDBKQX-UHFFFAOYSA-N 387.505 2.971 0 50 GFAA CCc1ncc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)cn1 1857730980 GTNLXXXBEHPHOE-OKZBNKHCSA-N 386.883 2.637 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857731328 FAHQDSYGCLSPTN-LVCYWYKZSA-N 382.508 2.971 0 50 GFAA CC(C)c1ccc(CC(=O)N2CCC3(CCc4c(O)nc(=N)[nH]c43)CC2)cc1 1857737464 NHORBFJXMKPYRH-UHFFFAOYSA-N 380.492 2.767 0 50 GFAA CCC(=O)N1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NCc2ccncc2)C1 1875250864 NCLJRNNFBDSISQ-QHCPKHFHSA-N 391.519 2.999 0 50 GFAA COc1c(C)nc(C2CC2)[nH]c1=NCc1cc(F)cc(N2CCN(C)CC2)c1 1875341635 AMECWXFGABQIIC-UHFFFAOYSA-N 385.487 2.596 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@H](C(=O)NC2CCCCC2)C(C)C)s1 2325727415 FDPQZSFJPSCMQZ-KRWDZBQOSA-N 379.526 2.588 0 50 GFAA C[C@H](NCc1nn(C)c2ccccc12)c1ccc(N2CCCS2(=O)=O)cc1 2325735758 NVKXKNVARAPDNZ-HNNXBMFYSA-N 384.505 2.964 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccccc2F)nc1 2325785676 INRFCAHETDZUIS-BMGDILEWSA-N 396.422 2.779 0 50 GFAA CC(C)(C)CNC(=O)CN1C[C@H]2CN(C(=O)C3(C)C(C)(C)C3(C)C)C[C@H]2C1 2325794296 XKMCEFXQRDRSOY-IYBDPMFKSA-N 377.573 2.611 0 50 GFAA CN(C1=NS(=O)(=O)c2ccccc21)c1ccc(OC(=O)c2ccncc2)cc1 778612 ZHHNCLOMCPZCGN-UHFFFAOYSA-N 393.424 2.886 0 50 GFAA CCN(CC(=O)Nc1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)cc1 1059186 ATVSIVAGLKENGS-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA O=C1CCC[C@H]2[C@@H]3C[C@@H](CN(C(=O)C4(O)CCCC4)C3)[C@H](Cc3ccccc3)N12 2356140526 LTZCALBNSVVKBI-ANULTFPQSA-N 396.531 2.762 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)N3CCC[C@]4(CCc5c[nH]c(=N)nc54)C3)c2c1 2356156679 MHWFLIKEZWEQQO-QFIPXVFZSA-N 389.459 2.572 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(Br)cc1 4550730 HDRSPQOGMCPABA-ZDUSSCGKSA-N 385.283 2.983 0 50 GFAA CN1CC[C@H](CNC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 109848974 WHZMSAWQLLHOTB-WBMJQRKESA-N 384.307 2.666 0 50 GFAA COC(=O)c1ccc(C(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)cc1 10454390 HTAYJLVTUQMDBF-MRXNPFEDSA-N 382.416 2.634 0 50 GFAA CCOc1ccc2nc(NC(=O)[C@H]3CC(=O)N([C@@H](C)COC)C3)sc2c1 8245117 OWCJMHWYAIKMJO-RYUDHWBXSA-N 377.466 2.517 0 50 GFAA CCn1cc([C@@H]2C[S@](=O)CCN2c2ncnc3c2oc2ccccc23)cn1 225410425 WLFHPWTUNGNLSJ-KUNJGFBQSA-N 381.461 2.902 0 50 GFAA C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC12CCN(C(=O)OC(C)(C)C)CC2 225749757 KSTNFGYHNJSRGG-CQSZACIVSA-N 397.516 2.902 0 50 GFAA CNCCN(C)C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 416930768 LKBADNCIZIYQEJ-UHFFFAOYSA-N 377.492 2.959 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)C[C@@H]3C(=O)Nc4ccc(C)cc43)CC2)nc1 102019810 ABUUTRDQAQXHNU-KRWDZBQOSA-N 379.460 2.634 0 50 GFAA CN(Cc1ccc(C(=O)NCc2ccccn2)cc1)S(=O)(=O)c1ccccc1 65365702 OGXKQSMBGCXGKJ-UHFFFAOYSA-N 395.484 2.832 0 50 GFAA O=C1N[C@@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1nccs1 67955336 NQDNRHGYPXCYOR-NRFANRHFSA-N 398.532 2.956 0 50 GFAA Cc1cccnc1-n1nc(CCc2ccccc2)nc1CCN1CCCC1=O 65495074 NQYSBZBHSQTUSZ-UHFFFAOYSA-N 375.476 2.921 0 50 GFAA O=C(N[C@H]1CCCN(C2Cc3ccccc3C2)C1)c1cccc(-n2cnnc2)c1 12436304 ZRKUSSKSKPZHQT-FQEVSTJZSA-N 387.487 2.629 0 50 GFAA O=C1[C@@H](NC(=O)N2CCCC[C@@H]2CCc2ccccc2)CCN1C1CCOCC1 119079222 CYDGFTGUWLNCSO-CTNGQTDRSA-N 399.535 2.963 0 50 GFAA CC(=O)Nc1nc(CN2CCC(C(=O)NCc3ccc(C)cc3)CC2)cs1 475743410 HACAXWBVRVSEBY-UHFFFAOYSA-N 386.521 2.938 0 50 GFAA O=C(NC1CCS(=O)(=O)CC1)c1ccc2noc(-c3ccc(F)cc3)c2c1 120004337 AKKJIEOXTJHZAD-UHFFFAOYSA-N 388.420 2.941 0 50 GFAA CCOc1ncc(C(=O)N2CCC(C(=O)N3CCCCC3)CC2)cc1Cl 171791122 AKAMDFNWDWUJQV-UHFFFAOYSA-N 379.888 2.998 0 50 GFAA O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)[C@@H]1CSc2ccccc2O1 252494013 NIJJEEIXGAIMFK-BEFAXECRSA-N 396.468 2.784 0 50 GFAA COC(=O)NCCc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(C)cc2)s1 252504545 VKAJECPOAQFNEI-ZDUSSCGKSA-N 382.507 2.995 0 50 GFAA NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171951578 FEBVYIQSVPUSJD-OAQYLSRUSA-N 388.471 2.666 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(c3cnc4ccccc4n3)CC2)C1 71747175 SSHJPTRRPGXBJO-MRXNPFEDSA-N 379.508 2.589 0 50 GFAA COCCN(C)c1ccc(NC(=O)c2ccn(-c3c(F)cccc3F)n2)nc1 154261076 ZQUYSHVYZPZIFQ-UHFFFAOYSA-N 387.390 2.880 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)NCc1ccc(CN2CCCC2=O)cc1 125489059 OQUVJZCSUBOZCI-UHFFFAOYSA-N 378.472 2.993 0 50 GFAA C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1 363328803 QYCLUJJPWSZKLI-WQVCFCJDSA-N 398.488 2.981 0 50 GFAA CCC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1 331587979 XVMXFORROGRUAJ-YLJYHZDGSA-N 378.900 2.637 0 50 GFAA C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 332849108 RZMMRCQKFMGUDZ-YLKXZWAGSA-N 383.536 2.890 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](c3ccccc3)[C@@H]3[C@H]2C2CCN3CC2)cc1=O 72140260 BSVUFFUBVZWCCP-KSEOMHKRSA-N 377.488 2.571 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(O)cn2)CCC(=O)N1Cc1ccc(F)cc1 71589452 XGHDQHWSKGPCNZ-LJQANCHMSA-N 385.439 2.826 0 50 GFAA C[C@H](O)CN(c1ccccc1)S(=O)(=O)c1cnn(-c2ccccc2F)c1 172890015 FCZXJHUMECXDHS-AWEZNQCLSA-N 375.425 2.588 0 50 GFAA COc1ccc(OC(F)F)c(CNC(=O)c2ccnc(NC(=O)C3CC3)c2)c1 285666661 MRWXIANNULKYOH-UHFFFAOYSA-N 391.374 2.970 0 50 GFAA COc1ccc([C@H](OC)[C@H](C)NC(=O)NCc2ccc(-n3ccnc3)nc2)cc1 378383349 PUAUXNQTJDLQNC-MGPUTAFESA-N 395.463 2.851 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H]1O[C@@H](n2cc(F)c(N)nc2=O)CS1 85210709 AUTCQXVTOIJYOT-IVHFILHXSA-N 399.488 2.557 0 50 GFAA O=C(NC[C@H]1CCN(Cc2ccccc2)C1)N1CCN(c2ccccc2)C(=O)C1 426613038 ZKMISTDRZYMJFU-HXUWFJFHSA-N 392.503 2.567 0 50 GFAA NCCOc1ccc(Cl)cc1C(=O)NCc1cnn(-c2cccc(F)c2)c1 426392799 LRVDFBCPTBDHDX-UHFFFAOYSA-N 388.830 2.932 0 50 GFAA O=C(c1cccc(-c2ccc(CO)cc2)c1)N1CCCN(C(=O)C2CC2)CC1 426489679 QZDWWJSWOAXRPH-UHFFFAOYSA-N 378.472 2.930 0 50 GFAA Cc1cccc(OC2CCN(C(=O)[C@@H](c3cccnc3)N3CCOCC3)CC2)c1 95372868 FXBQMINWMSIHEE-JOCHJYFZSA-N 395.503 2.833 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2onc3c2CCCC3)C1 426503253 JFZBDELHYNJQHP-MRXNPFEDSA-N 385.512 2.721 0 50 GFAA COc1ccc(F)cc1CN1CCC[C@H](c2nnc(Cn3ccnc3)n2C)C1 95363580 RAYSUUGNZKUFOA-HNNXBMFYSA-N 384.459 2.587 0 50 GFAA O=C(CCc1cccnc1)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 92065256 ZSALEWAORSQWQD-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA COCc1nc(CN2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)no1 91965891 IYDFMCLRLCFFIF-UHFFFAOYSA-N 384.480 2.621 0 50 GFAA CCc1nccn1CCC(=O)N1C[C@H]2CC[C@@H]1CN(Cc1c(C)noc1C)C2 95379636 KMDPTGOMSRFHIJ-ZWKOTPCHSA-N 385.512 2.563 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(c1ccnc(SC)n1)C2 95361608 XZKIGTQCNQCQBX-HLIPFELVSA-N 392.569 2.542 0 50 GFAA CC1(Cn2cc(C(=O)N3CCCc4cc(OC(F)(F)F)ccc43)nn2)COC1 184010155 RQUPQJMBPUTYEY-UHFFFAOYSA-N 396.369 2.806 0 50 GFAA O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCCc1c[nH]c2ccccc12 249818615 MJTRWOSTKQZLOV-JENIJYKNSA-N 386.521 2.552 0 50 GFAA CCOc1ccc(C[C@H](CNC(=O)c2ncoc2[C@@H]2CCCO2)C(=O)O)cc1 299753729 ZDQFHPQUBRKIPF-ZBFHGGJFSA-N 388.420 2.598 0 50 GFAA O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)[C@@H]1C[C@H](O)CN1 299749642 LCSFQADFZPXQBS-OWZDWXTDSA-N 383.879 2.792 0 50 GFAA Cc1ccccc1[C@@]1(O)CCN(C(=O)c2cccc(-c3nc(C)n(C)n3)c2)C1 299782915 NRFWPAVFSOVTOL-JOCHJYFZSA-N 376.460 2.833 0 50 GFAA COCCN1C[C@@H](CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)CC1=O 299788413 PDUZPRKAMJHEHC-CQSZACIVSA-N 386.323 2.610 0 50 GFAA CC(C)C(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(C(=O)c3ccco3)C2)c1 827621892 XPHJSWRBUBCIFG-QGZVFWFLSA-N 383.448 2.909 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)N1CCN(c2nc3ccccc3o2)CC1 823118464 MQWSMRXVRVFAEL-HXUWFJFHSA-N 390.487 2.923 0 50 GFAA Cc1ccc(C)c(OCCNC(=O)N2CCCC[C@H]2CN2CCOCC2)c1 584904178 RNFUXMHOFDZTIC-IBGZPJMESA-N 375.513 2.579 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N(Cc1ccccn1)C[C@@H]1CCCO1 952981542 IDTQLCWYBIUTAD-SFHVURJKSA-N 377.444 2.604 0 50 GFAA Cc1ccc(CNc2ncnc(-n3cccn3)c2N)c(OC[C@H]2CCCO2)c1 301772131 FZLYORNTGCVNGZ-MRXNPFEDSA-N 380.452 2.723 0 50 GFAA C[C@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(S(=O)(=O)N(C)C)cn1C 408156950 FIBLZTSOCCHKMK-AWEZNQCLSA-N 389.521 2.992 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CC[C@]4(CNC(=O)C4)C3)ccc21 279046623 YNAVJABVDYFAKY-SFHVURJKSA-N 394.397 2.988 0 50 GFAA C[C@@H]1C(=O)NCCN1C(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1 170795517 LBJJHHOCMRURRF-GFCCVEGCSA-N 384.823 2.746 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)Cc3cc(Cl)ccc3F)CCO2)cn1 189231215 PVOCZBKROHYVPF-MRXNPFEDSA-N 387.864 2.599 0 50 GFAA NC(=O)c1cccc2c1CCCN2C(=O)[C@@H]1CCCN(Cc2ccccc2)C1 194944121 AVYXBMQGPNJOGH-GOSISDBHSA-N 377.488 2.977 0 50 GFAA CCn1cc(C(=O)Nc2c(N3CCCC3)nn(C)c2C)c(=O)c2ccc(C)nc21 1529147364 XOWVVZGMGOLAGM-UHFFFAOYSA-N 394.479 2.619 0 50 GFAA CNc1ncc(C(=O)N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)cn1 1704343199 UUYJCBBCDWECBM-UHFFFAOYSA-N 377.448 2.704 0 50 GFAA O=C(Nc1cccc(Cl)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 826784 QVCNRXCVJWHANH-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA Cc1cc(C(N)=O)c(N2CCCN(C(=O)[C@@H]3CCc4ccccc43)CC2)nc1C 1772814431 YUZOXJXNROICRQ-LJQANCHMSA-N 392.503 2.566 0 50 GFAA CC(C)=CCN1CCc2nnc([C@H](C)NC(=O)CCc3ccccc3)n2CC1 11841810 ONGXFJFAEBXGSY-SFHVURJKSA-N 381.524 2.912 0 50 GFAA OCC1CCN(Cc2cccc(OC[C@@H](O)CN3CCCCCC3)c2)CC1 12197663 DRVBCMDCZFMLSW-NRFANRHFSA-N 376.541 2.507 0 50 GFAA CCOC(=O)[C@@]1(CCOc2ccccc2)CCCN(C(=O)CCn2cccn2)C1 12387591 WVPJRUVOZGJPKP-JOCHJYFZSA-N 399.491 2.914 0 50 GFAA C[C@H]1CCCN(C(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)C1 13669179 RUIAOHCYNAZHHD-LBPRGKRZSA-N 378.416 2.730 0 50 GFAA CC[C@H](Oc1ccc(OC)cc1)C(=O)Nc1ccccc1C(=O)N1CCOCC1 14397560 CCEYIVNQPKQENP-FQEVSTJZSA-N 398.459 2.964 0 50 GFAA O=C(c1cccc(C(F)(F)F)c1)[C@@H]1CCCN(C(=O)CN2CCOC2=O)C1 14949976 LRNLGFMTBYVIFQ-CYBMUJFWSA-N 384.354 2.579 0 50 GFAA CC(C)CN(C)C(=O)c1cn(CC(C)C)cc(C(=O)NCc2ccco2)c1=O 14977005 SOLHJTOMEGDTFV-UHFFFAOYSA-N 387.480 2.755 0 50 GFAA CCCCNC(=O)c1sc2ncnc(NCCCN3CCOCC3)c2c1C 14992963 BBEYJADYNBZQRC-UHFFFAOYSA-N 391.541 2.664 0 50 GFAA O=C(N[C@@H]1CCCCNC1=O)c1ccccc1-c1nc(-c2ccccc2)no1 19300008 KIACJBQQOSVQIP-QGZVFWFLSA-N 376.416 2.802 0 50 GFAA O=C(Nc1nc2c(s1)CCCC2)[C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 169772725 XYEVGSVENLYAPU-NSHDSACASA-N 381.461 2.890 0 50 GFAA COc1cc(OC)c(NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1Cl 2866891 LLUJGHBBVOIQNE-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA Cc1c(CN2CCOC3(CCS(=O)(=Nc4ccccc4)CC3)C2)cnn1C 1857528000 RTYKJENNMHBCTG-UHFFFAOYSA-N 388.537 2.893 0 50 GFAA COc1ccccc1CN1CCC2(CC1)CN(C(=O)CC(C)C)C[C@@H]2C(=O)O 1857692123 PRFJYYZOXGMAFZ-GOSISDBHSA-N 388.508 2.867 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NC[C@H]3CCCOC3)cc12 1857696257 TYVXHPJCLDHYCV-OAHLLOKOSA-N 378.538 2.788 0 50 GFAA O=C(c1ccc(-c2cnco2)cc1)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857719767 TXMPPXKCULHDFA-ZVXPMLRVSA-N 390.439 2.551 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)c2cccc(Cl)c2Cl)CC[C@H]1O 1857736301 OFIRTJPAAWSSFG-PBHICJAKSA-N 376.280 2.606 0 50 GFAA NC(=O)c1cnccc1N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 302154669 MZSDKSUHOTYACJ-UHFFFAOYSA-N 379.291 2.852 0 50 GFAA COc1ccc(F)cc1CN1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 247892223 NEBRDXQVHNPDDS-DYVFJYSZSA-N 375.469 2.914 0 50 GFAA CCn1cnnc1[C@H]1CCCN(C(=O)c2cc(-c3ccc(OC)cc3)n[nH]2)C1 164800340 KDYHGXUMWYHYDL-HNNXBMFYSA-N 380.452 2.717 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704297813 CSSOKLOKPQSJMU-QFIPXVFZSA-N 389.459 2.884 0 50 GFAA Cc1cccc(CC(=O)N2C[C@H](c3cnn(C)c3)C[C@@H](C(=O)O)C2)c1Cl 868457653 ZVTGYBJDRMBQGV-HUUCEWRRSA-N 375.856 2.641 0 50 GFAA O=C(CCC(=O)c1ccc2c(c1)CCC2)N[C@@H](CCc1ccncc1)C(=O)O 1875277411 KVSUSNSBAOWCJH-IBGZPJMESA-N 380.444 2.735 0 50 GFAA COc1ccc(C)cc1CC(=O)NC1(CNC(=O)Cc2cccc(F)c2)CC1 1775996815 JKXNQGKKCGHULV-UHFFFAOYSA-N 384.451 2.693 0 50 GFAA O=C(c1cc(-c2cccs2)cnc1O)N1CCC(N2CCCNC2=O)CC1 2325773354 ONLDIEWBJPDICV-UHFFFAOYSA-N 386.477 2.536 0 50 GFAA COC(=O)c1ncsc1NC(=O)N1CCC(c2ncc(Cl)cn2)CC1 2325781961 IYPBXQYNXPCHMV-UHFFFAOYSA-N 381.845 2.785 0 50 GFAA CC[C@H](CNC(=O)c1cc(C)sc1NC(=O)C(C)(C)C)N1CCOCC1 55199464 ZWZKEAWBZNHXJH-CQSZACIVSA-N 381.542 2.882 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCCC2)Nc1nc(-c2ccncc2)cs1 61718513 BEXSCQQEEFPJGT-UHFFFAOYSA-N 381.461 2.669 0 50 GFAA Cc1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)nc(N2CCCC2)n1 67604209 BPUPOBZXHUIMKV-UHFFFAOYSA-N 387.434 2.626 0 50 GFAA CC(=O)c1cccc(NC(=O)Cn2nc(C)c(I)c2C)c1 1432675 VBNUINPMCPGZIU-UHFFFAOYSA-N 397.216 2.946 0 50 GFAA Cc1ccccc1Cn1c(Oc2ccccc2F)nc2c1c(=O)n(C)c(=O)n2C 1425462 COLYAAVAPZLKAR-UHFFFAOYSA-N 394.406 2.722 0 50 GFAA Cn1nccc1[C@H](O)c1cc2n(n1)CCN(Cc1cccc(-c3ccco3)c1)C2 219182708 QTYOEDVVZVVIAV-JOCHJYFZSA-N 389.459 2.974 0 50 GFAA C[C@@H]1CN(S(=O)(=O)N[C@H]2CCSc3ccc(Cl)cc32)C[C@@H](C)O1 229723352 BFCQCNFFTWESFD-GYSYKLTISA-N 376.931 2.821 0 50 GFAA Cc1cc(C(=O)N2CCN(C(=O)c3csc([C@@H]4CCCO4)n3)CC2)c(C)o1 122784305 YSJSWYHNCOHIBR-INIZCTEOSA-N 389.477 2.803 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)c1cc(COc2cccc(F)c2)[nH]n1 11935689 NNKNDDRNTWIEJB-UHFFFAOYSA-N 392.394 2.639 0 50 GFAA CNc1cc(N2CCC[C@H]2CNc2cc(C)nc(-c3cccnc3)n2)ncn1 171986542 XBRHTDRYFKVAQI-INIZCTEOSA-N 376.468 2.760 0 50 GFAA C[C@@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)[C@H]1CN 237445064 CKJOTKLGBKGPJD-UZLBHIALSA-N 386.517 2.860 0 50 GFAA CNS(=O)(=O)c1cc(NC(=O)Nc2cc(C3CCCC3)[nH]n2)ccc1F 486418048 JAWCEJBFFCBKBY-UHFFFAOYSA-N 381.433 2.759 0 50 GFAA Cc1cc(C)n(-c2cc(NCCNC(=O)c3sc(C)nc3C)nc(C)n2)n1 72437428 LHOCZOQOOXFVQF-UHFFFAOYSA-N 385.497 2.503 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(O)cn2)CCC(=O)N1Cc1ccc(F)cc1 71589451 XGHDQHWSKGPCNZ-IBGZPJMESA-N 385.439 2.826 0 50 GFAA CCn1ncc2cc(C(=O)N[C@H](C)C3(N4CCOCC4)CCCC3)c(C)nc21 282480176 SRJPRKBCTRBODS-MRXNPFEDSA-N 385.512 2.523 0 50 GFAA C[C@@H]1CCCCN1Cc1ccccc1CNC(=O)c1cn(C2CCNCC2)nn1 237344583 LFFUEKZUONFNRS-QGZVFWFLSA-N 396.539 2.507 0 50 GFAA C[C@H]1CN(C(=O)COc2ccccc2)[C@H](C)CN1C(=O)COc1ccccc1 16225803 DAJHWAPCPADMDS-HDICACEKSA-N 382.460 2.592 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N3CCn4nc([C@H](O)C5CC5)cc4C3)cc2)n1 222810477 RZAAPQMMQOWYPZ-OAQYLSRUSA-N 391.475 2.785 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)s1 82106200 HEMAGQVMTLKCDR-FQEVSTJZSA-N 384.505 2.892 0 50 GFAA Cn1c(CCNC(=O)N2CCC(Oc3ccncc3)CC2)nc2ccccc21 426584850 RRBZFWOPBVFTAT-UHFFFAOYSA-N 379.464 2.764 0 50 GFAA CCNC(=O)c1ccc(-c2cccc(C(=O)N[C@@H]3CN4CCC3CC4)c2)s1 426394759 XJFNAJRZKNVEBB-QGZVFWFLSA-N 383.517 2.989 0 50 GFAA CN(CCC1CCN(c2ccncc2)CC1)[C@H]1CCCN(c2cnn(C)c2)C1=O 179396112 ATGKSQRNQIFDPX-NRFANRHFSA-N 396.539 2.549 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC2(CCC(=O)N(CCCOC)C2)CC1 91974387 UWSHOPYEUFIMAV-UHFFFAOYSA-N 396.963 2.877 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1 91547942 WEBGMFLNJWFIHP-UHFFFAOYSA-N 394.519 2.735 0 50 GFAA O=C(N[C@@H]1CCNC1)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 95500944 AAWJTSAONOUKKS-OAQYLSRUSA-N 393.531 2.864 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1C[C@H]2CN(CC3CCC3)C[C@@]2(C(=O)O)C1 96152524 YXEUIIAGKWIZNP-BFUOFWGJSA-N 380.847 2.738 0 50 GFAA O=C(NCCSc1ncn[nH]1)Nc1ccc(OC[C@@H]2CCCCO2)cc1 96180002 POSITAYCYSGZFZ-HNNXBMFYSA-N 377.470 2.666 0 50 GFAA CC[C@@H](C(=O)N1CCC(c2nccn2Cc2cscn2)CC1)n1cccn1 95518544 NRSPWIIJOKRKGT-KRWDZBQOSA-N 384.509 2.942 0 50 GFAA Cc1cc(CC(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)on1 95361595 YCSBRARDJMKABP-ZLGUVYLKSA-N 387.430 2.893 0 50 GFAA CSc1nn2c(=O)cc(CN(C)Cc3cc(C(C)(C)C)n[nH]3)nc2s1 243932277 BUCZZEMSIOQCQM-UHFFFAOYSA-N 378.527 2.526 0 50 GFAA C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)CC[S@]1=O 297345430 SSOLJNUPEXOXAZ-KDCSIKNMSA-N 383.945 2.861 0 50 GFAA COC(=O)c1cn(-c2ccc(C)c(-c3ccc(CO)o3)c2)cc2c(=O)[nH]nc1-2 253402265 GFPHKOGPFDQRDH-UHFFFAOYSA-N 379.372 2.513 0 50 GFAA CCOC(=O)C1=C(CN2CCC(C)CC2)NC(=O)N[C@@H]1c1ccc(OC)cc1 55227598 WJYXEYXITCUWEX-LJQANCHMSA-N 387.480 2.598 0 50 GFAA CCn1ncnc1CN1CCC(CNC(=O)[C@H]2C(C)=C2c2ccccc2)CC1 823609756 MBDWRCUJYLNPIZ-NRFANRHFSA-N 379.508 2.730 0 50 GFAA COc1cc(C)ccc1S(=O)(=O)N1CCCN(c2ccncc2C)CC1 952968458 MVCDGIIUDRGPDA-UHFFFAOYSA-N 375.494 2.608 0 50 GFAA CC(C)[C@@H](CC(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276496865 PEEXBKYXVIASEW-RBUKOAKNSA-N 381.524 2.921 0 50 GFAA O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21 191547127 QIHSPMIBZJDZDP-RDJZCZTQSA-N 384.407 2.844 0 50 GFAA C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc(Br)c(C=O)n1C 195530499 RKXZVTBRIMPSPC-UPJWGTAASA-N 384.318 2.696 0 50 GFAA COc1nccnc1N1CCC[C@@H](CNC(=O)Cc2c(C)[nH]c3ccccc23)C1 1506403788 UJIUWJBEXHGPFZ-INIZCTEOSA-N 393.491 2.850 0 50 GFAA COc1ccccc1-c1ncc(CN2C[C@H](O)[C@H](Cc3ccncc3)C2)cn1 1529161437 JHIUFMWHDONXQT-QUCCMNQESA-N 376.460 2.583 0 50 GFAA CO[C@H]1CN(C(=O)c2cnn(Cc3ccccc3)c2)C[C@H]1Cc1cc(C)no1 1529098870 NLKLUCOITLAAIX-XLIONFOSSA-N 380.448 2.558 0 50 GFAA CC(C)[C@H](C(=O)Nc1ccc2c(c1)OCCO2)N1C(=O)c2ccccc2C1=O 839322 KFBRSEWDNVAZEZ-GOSISDBHSA-N 380.400 2.717 0 50 GFAA Nc1ccc(S(=O)(=O)Nc2nccc(/C=C/c3ccc4c(c3)OCO4)n2)cc1 5073715 IMOHLZZIJCEHFM-ORCRQEGFSA-N 396.428 2.759 0 50 GFAA COc1ccc(CN2CCC([C@H](O)CO)CC2)cc1OCc1ccccc1F 1772708629 FWEBASZUMFTGRE-HXUWFJFHSA-N 389.467 2.979 0 50 GFAA CCCn1cc(C(=O)N2C[C@@H]3CN(C(=O)CCC(F)(F)F)CC[C@@H]32)c(C)n1 1775976710 DNTBFZVTRZYVSD-ZFWWWQNUSA-N 386.418 2.617 0 50 GFAA CCCC(=O)N1C[C@H]2CN(Cc3ccccc3-n3nc(C)cc3C)C[C@@]2(CO)C1 1772709372 OZSYGOLMNNFZNH-OFNKIYASSA-N 396.535 2.542 0 50 GFAA Cc1nnc(CCC(=O)N2CC[C@]3(CCCN(Cc4ccccc4F)C3)C2)[nH]1 12718622 XBIVRRVLFBBMHT-NRFANRHFSA-N 385.487 2.700 0 50 GFAA CC[C@@H]1C(=O)N(C)CCN1c1ccc(-c2nc(-c3ccccc3F)no2)cn1 15068256 VBHNOMZRINMXKM-MRXNPFEDSA-N 381.411 2.995 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4cc5ccccc5[nH]4)nnc23)n1 169776335 QBQWFCQVIVCQQZ-UHFFFAOYSA-N 387.403 2.753 0 50 GFAA Cc1noc(-c2cn([C@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)nn2)n1 169780500 CXJPBZWXDKDYMQ-ZDUSSCGKSA-N 392.341 2.743 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2cccc(Br)c2)NC(=O)N1 4201977 AWIYWWFBNRXJEF-UKRRQHHQSA-N 395.253 2.799 0 50 GFAA O=C(C1c2ccccc2Oc2ccccc21)N1CCN(C(=O)[C@@H]2CCCO2)CC1 4803630 LZAWCHTZGPBPGM-FQEVSTJZSA-N 392.455 2.774 0 50 GFAA Cc1c(C(=O)N[C@H]2CCC[C@@H](CNC(=O)c3cnc(C4CC4)nc3)C2)ccn1C 1857681496 LKRQUCGBLKUIFT-QAPCUYQASA-N 395.507 2.720 0 50 GFAA Cc1cccc(C(C)C)c1NC(=O)CSc1nc(C)c(CCO)c(=O)[nH]1 11905752 ZPHJMBNZOLPKQD-UHFFFAOYSA-N 375.494 2.776 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2cccs2)c(=O)c(C(=O)NC(C)C)c1 14994808 VNPXIOGQFWAXDT-UHFFFAOYSA-N 375.494 2.634 0 50 GFAA Cn1nnnc1-c1ccccc1NC(=O)N1CCC2(CC1)COc1ccccc12 1875296385 UCEUHPCAGLUBKG-UHFFFAOYSA-N 390.447 2.835 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2CN(c3ccccc3)C[C@@H]2C1 1875266960 IXAPQWBPEILXII-SFHLNBCPSA-N 393.487 2.549 0 50 GFAA CN(C)c1noc(CCc2nc(Cc3cc(Br)cs3)no2)n1 1875286251 OPCJINYAWBQBRZ-UHFFFAOYSA-N 384.259 2.719 0 50 GFAA CC(C)[C@]1(O)CCN(C(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)C1 1875278546 KFSLYCXGQQSRJB-QHCPKHFHSA-N 392.455 2.716 0 50 GFAA O=C(c1cc(-c2ccccc2)on1)N1CC[C@@H]2CN(c3ncccn3)C[C@@H]2C1 1875315508 XWPRVPIEAHMESU-SJORKVTESA-N 375.432 2.730 0 50 GFAA CC(=O)N1CC(C(=O)N2CC3(CCN(CC4CC(C)(C)C4)CC3)C[C@@H]2C)C1 1875331281 CFTINFVHKKTFNE-INIZCTEOSA-N 375.557 2.604 0 50 GFAA COc1ccc(C)c(CN[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)c1Br 1875400215 UIIULKQKGRRRAD-FVQBIDKESA-N 394.313 2.892 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)N[C@@H]3[C@H]4Cc5cc(F)ccc5[C@@H]43)CC2=O)c1 888101829 PIAGIEXYRFAJGG-BLEKSLEDSA-N 395.434 2.577 0 50 GFAA COc1coc(C(=O)N2CCC(C)(CNC(=O)C(C)=C3CCC3)CC2)cc1=O 1775989138 FEQKRFPAGLENDE-UHFFFAOYSA-N 388.464 2.507 0 50 GFAA COC(=O)c1cc2c(=O)n(-c3cc(OC)c(OC)c(OC)c3)ccc2nc1C 12391706 ZJFQVNYDNNZFGH-UHFFFAOYSA-N 384.388 2.507 0 50 GFAA N[C@H](Cc1cccc(F)c1)C(=O)N1CCn2c(nnc2-c2ccc(Cl)cc2)C1 2325775090 ZNBQBQXGRDRYJT-QGZVFWFLSA-N 399.857 2.650 0 50 GFAA COC(=O)c1nc(N2CCN(c3ccc(Cl)cn3)CC2)c2sccc2n1 2325802325 ZTEWPBKCUDFEAY-UHFFFAOYSA-N 389.868 2.853 0 50 GFAA Cc1nn2cccnc2c1NC(=O)NCCN1CCc2c(Cl)cccc2C1 2325810397 IPJWSHGTSMGRDL-UHFFFAOYSA-N 384.871 2.871 0 50 GFAA CCC(=O)NC[C@@H]1CC2(CC2)CN1C(=O)Cc1cscc1Br 2325869633 WSLMMVTVIVDXFQ-LBPRGKRZSA-N 385.327 2.960 0 50 GFAA CCc1ccc(C2C(C(=O)OC)=CN(C[C@H]3CCCO3)C=C2C(=O)OC)cc1 1184470 NPSFKKFXNVWBLX-QGZVFWFLSA-N 385.460 2.941 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2ccc(OC)c(CN(CC)CC)c2)CC[C@H]1O 2356142947 OMDIKNWTACHJSE-IFMALSPDSA-N 392.540 2.975 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)C[C@H]3COc4ccccc4O3)n2)cc1 55054223 MHFDARGOHDKJKZ-INIZCTEOSA-N 395.415 2.795 0 50 GFAA CCC(C)(C)[C@@H]1CCCN1C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 133719095 VTMQZLWLZJFHQJ-SFHVURJKSA-N 393.553 2.910 0 50 GFAA CCOC(=O)c1c(N)sc2c1C[C@H]1C(=O)N(C3CCCCC3)C(=O)[C@@H]1C2 100589647 IVTNTJZTVUXIDR-VXGBXAGGSA-N 376.478 2.540 0 50 GFAA CCOc1ccccc1N1CCN(CC(=O)Nc2ccc(OC)cc2OC)CC1 55060414 KSWAPTMDHKDDNT-UHFFFAOYSA-N 399.491 2.863 0 50 GFAA Cc1cc(C)n(-c2cccc(CN3CCC(n4cc([C@H](C)O)nn4)CC3)c2)n1 23619454 VYIXJTAESIUJLZ-KRWDZBQOSA-N 380.496 2.971 0 50 GFAA COc1cccc(C[C@@]2(CO)CCCN(C(=O)c3cn4ccsc4n3)C2)c1 67974319 PRXIFGKRPBFMDV-FQEVSTJZSA-N 385.489 2.862 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(c2cc(N)ncn2)CC1 67820857 BLFVZBHQFQMXAE-UHFFFAOYSA-N 377.452 2.658 0 50 GFAA Cc1cnc(CNC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)s1 252478970 AYHWXIQCELRYNX-UHFFFAOYSA-N 394.522 2.994 0 50 GFAA Cc1nc2n(c1C(=O)N(C)C)CCN(Cc1ccc(CCC(C)(C)O)cc1)C2 72476439 DJCDZSXJUYKJJW-UHFFFAOYSA-N 384.524 2.613 0 50 GFAA O=C1CC[C@@]2(CCCN(Cc3ccc(C(F)(F)F)nc3)C2)CN1CCCO 77406093 LWKQNGASGFNDCX-GOSISDBHSA-N 385.430 2.687 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cccc3c2OCO3)C[C@H]1CCO 36385815 RKCILQMNCUQMNQ-HXUWFJFHSA-N 398.503 2.883 0 50 GFAA CC(C)c1cc(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)nn1-c1ccccn1 151376767 OXTZCQUOODKDPF-UHFFFAOYSA-N 391.431 2.998 0 50 GFAA Cn1cc(-c2nn(C)cc2C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cn1 363986614 OVVFRSPUCQTMEO-QGZVFWFLSA-N 381.436 2.631 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(c3nc(C)c(C)s3)CC2)c(F)cc1F 154954377 AOQRWVJHGLQYAW-UHFFFAOYSA-N 387.477 2.857 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@H]2[C@@H](O)CC[C@H]2C1 329765452 XAFAXMGTGXKZKV-MAZHCROVSA-N 398.463 2.978 0 50 GFAA Fc1cnccc1N1CCCn2nc(CN3CCC4(CCCO4)CC3)cc2C1 72448304 OTMJQFBSMFSTKD-UHFFFAOYSA-N 385.487 2.973 0 50 GFAA COc1cccc(CN2CCO[C@H](C(F)(F)F)C2)c1OCCn1ccnc1 71751453 LXQDBNCPPPGTCX-INIZCTEOSA-N 385.386 2.734 0 50 GFAA CC(=O)c1cccc(CN2CC3(CCN(C(=O)C4CC4)CC3)C[C@H]2C(=O)O)c1 72418515 VPGHGWFNTUZJMQ-IBGZPJMESA-N 384.476 2.567 0 50 GFAA CSc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1 72139195 NKIHSSPRZTVWAG-UHFFFAOYSA-N 377.535 2.961 0 50 GFAA Cc1nnsc1C(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 15066651 WKYAJQUSHATZPD-IBGZPJMESA-N 388.468 2.641 0 50 GFAA COc1cc(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)cc(OC)c1 44902612 DWTVLFGSHMYMMC-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccc(F)cc4F)CC3)ncn2)n1 82230424 DZOZWXKWYUVKCP-UHFFFAOYSA-N 399.405 2.603 0 50 GFAA O=C(NCCc1cccs1)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 426595022 OVRKXOUUFSNKNV-INIZCTEOSA-N 378.519 2.690 0 50 GFAA COc1cccc(Oc2ccc(NC(=O)N3CCC[C@@](O)(CO)CC3)cn2)c1 96151569 JOPCEYFUPHXJKB-FQEVSTJZSA-N 387.436 2.624 0 50 GFAA CSCc1ccc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)O)C2)o1 96179658 YLHRMMNDOMLBCA-VBKZILBWSA-N 387.457 2.921 0 50 GFAA O=C(c1cnc(COc2ccccc2)[nH]c1=O)N1CCC[C@@H]1c1ccccn1 91932729 YSMMPMXYSXQZGG-GOSISDBHSA-N 376.416 2.721 0 50 GFAA CCn1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c(C)n1 91504480 FMVRGFXDTJWIJV-UHFFFAOYSA-N 395.507 2.651 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1cccc3c1ccn3C)CC2 91745919 KIBZOGXDAPCWFL-UHFFFAOYSA-N 377.492 2.911 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCc1noc(-c3ccccc3)n1)C2 91536608 WRYIHWZIALFMTI-MRXNPFEDSA-N 379.416 2.655 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3ccc4c(c3)OCO4)C[C@H]2N(C)C)cc1 95385538 YSHSOBKGWZIVJB-RBUKOAKNSA-N 382.460 2.523 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)[C@H]1CCCN(c2ncnc3[nH]ccc23)C1 95506078 HUNVEUIRLRPXGJ-HNNXBMFYSA-N 387.447 2.999 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCc1cnn(-c2ccccc2)c1 299749102 JFZLRGIZSAYXNZ-FQEVSTJZSA-N 375.428 2.843 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CCN(c3cc(F)cc(F)c3)C2=O)cc1C(=O)O 299753057 WRLWAFDCPPFITE-HNNXBMFYSA-N 392.358 2.576 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N2CCC(c3ccncc3)CC2)OCC(=O)N1C 1940195358 ODJOGIIJXTZYNK-YADHBBJMSA-N 393.487 2.695 0 50 GFAA Cn1ccc2c(C(=O)NC34C[C@@H]5C[C@H](C3)CC(n3ncnn3)(C5)C4)cccc21 670441127 QMVOWGSFVOVRPV-XFKLWTPLSA-N 376.464 2.643 0 50 GFAA CCCN1CCC(CC(=O)N[C@H]2CCOC[C@@H]2Oc2cccc(F)c2)CC1 1565512754 AOKRZAJYWGOKBF-PMACEKPBSA-N 378.488 2.990 0 50 GFAA CCCOc1c(Br)cc(C(=O)N2CC[C@H](C(=O)O)C2)cc1OC 269216548 YJDPQJCGZHMLRV-JTQLQIEISA-N 386.242 2.793 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)Cc1n[nH]c2c1CCCC2 188933817 YFMBMRRRIRCXIJ-LJQANCHMSA-N 396.491 2.778 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)c3cc(Cl)cc(Cl)c3)CCO2)cn1 189223783 QFTGSUHOOFRPEQ-OAHLLOKOSA-N 390.292 2.972 0 50 GFAA Cc1cccc(CN(Cc2cnc3c(C(=O)O)cnn3c2)C[C@H]2CCCO2)c1 1506399464 GJYDUVVAJGVJNB-GOSISDBHSA-N 380.448 2.917 0 50 GFAA O=C(O)/C=C/C(=O)Nc1ccccc1-c1ccccc1NC(=O)/C=C/C(=O)O 754154 MJBKJMRZCXDVGX-WGDLNXRISA-N 380.356 2.512 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2ccccc2Br)NC(=O)N1 1168300 HWXFJYJURNLLQO-NHYWBVRUSA-N 395.253 2.799 0 50 GFAA COc1cccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCOc2ccccc2)c1 4113567 NVQBVXFXTSDXPR-LJQANCHMSA-N 382.416 2.945 0 50 GFAA O=C(CCc1ccccc1Cl)N1CCCN([C@@H]2CN3CCC2CC3)CC1 1772805954 RXMIXBWURGGHIN-HXUWFJFHSA-N 375.944 2.901 0 50 GFAA CN(CC1CCN(CCc2ccc(F)cc2)CC1)C(=O)CCN1CCCCO1 11661739 WCKASUVLCJBJPZ-UHFFFAOYSA-N 391.531 2.956 0 50 GFAA Cc1ccc(CN2CCC(N3CCC(C(=O)NCc4ccccn4)CC3)CC2)o1 11817197 AIQYCNHHDFCDHM-UHFFFAOYSA-N 396.535 2.976 0 50 GFAA CCCN(Cc1cnc(S(=O)(=O)CCC(C)C)n1CCOC)CC1CC1 11933812 TUVAIWQZAAXRAD-UHFFFAOYSA-N 385.574 2.971 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCC(OCc2ccccn2)CC1 11937393 FILWFCZOAZQMGE-UHFFFAOYSA-N 395.438 2.682 0 50 GFAA COC(=O)c1cc(CNC(=O)c2ccccn2)cc(NC(=O)c2ccoc2)c1 12078700 HNHHWEDMXFPEGM-UHFFFAOYSA-N 379.372 2.644 0 50 GFAA Cn1cc(CCNC(=O)c2cn(C(c3ccccc3)c3ccccc3)nn2)cn1 12092473 LNDNLFXFIGLKCE-UHFFFAOYSA-N 386.459 2.622 0 50 GFAA O=C(NCCCc1cccnc1)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12308035 HDNOVZVBMKAWFN-LJQANCHMSA-N 383.467 2.751 0 50 GFAA CCCCN1CCN(c2ccc(C(=O)NCC[C@@H]3CCCCN3C)cn2)CC1 12712699 VIZIPQPTOLUFHF-FQEVSTJZSA-N 387.572 2.608 0 50 GFAA CCc1nnc(NC(=O)[C@H]2CC(=O)N(CCc3c[nH]c4ccc(C)cc34)C2)s1 12863123 CHBDTYKULFETDZ-AWEZNQCLSA-N 397.504 2.920 0 50 GFAA CCOC(=O)Cc1csc(NC(=O)CSc2nc(SC)ns2)n1 13842497 STJGJIFUYRYWGR-UHFFFAOYSA-N 390.537 2.553 0 50 GFAA CC(C)(CO)CNC(=O)[C@@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 15065553 JGRYXYVONPGCKS-CQSZACIVSA-N 386.414 2.579 0 50 GFAA O=C1C[C@H](N2CCN(c3ccccc3Cl)CC2)C(=O)N1c1ccc(F)cc1 19349896 QSZNTMGNNWXSBG-SFHVURJKSA-N 387.842 2.933 0 50 GFAA COc1ccc(NC(=S)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19800246 BYXNPOPSBKAYPV-UHFFFAOYSA-N 385.489 2.939 0 50 GFAA C[C@H](CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 2993038 VYHDYKDBNROVOJ-MRXNPFEDSA-N 388.489 2.840 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)c1 1857681598 GWAGKJCMQKEOJO-UHFFFAOYSA-N 395.484 2.721 0 50 GFAA Cn1ccnc1CN1CCO[C@]2(CCN(CCCCOCc3ccccc3)C2)C1 1857694064 YYPRHZHIPWNUKC-QHCPKHFHSA-N 398.551 2.694 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CCN(c2ccc(F)cn2)[C@@H](C)C1 1857708516 XZGGEZLYMRAQAH-INIZCTEOSA-N 394.450 2.581 0 50 GFAA CCc1ccccc1C(=O)N1C[C@@H]2[C@H](CNC(=O)CC3CC3)[C@H]3CC[C@]2(C1)O3 1857722764 NFRGMEXWZDNEAJ-DZCCDHAISA-N 382.504 2.785 0 50 GFAA CCC[C@H](N)C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857726105 WSPCELIIGKZNLF-KRWDZBQOSA-N 380.492 2.783 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857739352 OUYCXTYWBBWYHW-ICSRJNTNSA-N 393.842 2.613 0 50 GFAA C[C@H](NC(=O)CN1CCN([C@H]2CCCN(C)C2)CC1)c1cccc2ccccc12 112638176 KXQZFKUNNGCZMB-FPOVZHCZSA-N 394.563 2.729 0 50 GFAA O=S(=O)([C@@H]1CCCN(c2ccnc3c(Cl)cccc23)C1)N1CCOCC1 329218340 RPGHOGRXTGUYQA-CQSZACIVSA-N 395.912 2.519 0 50 GFAA O=c1c2sc(-c3ccc(Cl)cc3)cc2ncn1Cc1nnc2n1CCOC2 435665099 PALPDQIQPOAJPD-UHFFFAOYSA-N 399.863 2.948 0 50 GFAA Cc1c(Cl)nc(-c2ccccn2)nc1N1CCN(C(=O)c2ccccn2)CC1 865434172 YXIFLHIEGDLXMP-UHFFFAOYSA-N 394.866 2.858 0 50 GFAA CCn1c(-c2cc3c(F)c(F)ccc3[nH]2)nnc1N1CC[C@@H]2OC(=O)O[C@@H]2C1 1875279268 KOOJKLODQQJFKW-UONOGXRCSA-N 389.362 2.839 0 50 GFAA CCCc1sc(C(=O)NS(=O)(=O)c2cc(C(=O)OC)ccn2)cc1CC 1875362214 WCBLLIXYDYUXQK-UHFFFAOYSA-N 396.490 2.563 0 50 GFAA O=C(O)[C@H]1CC[C@H]1C(=O)NC[C@@H](O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1875303895 RFHFZUBIHYABRK-GRYCIOLGSA-N 399.287 2.985 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CC2)C1)[C@H]1CCCO1 1875332832 NLPYGAHBRGCBFK-IAGOWNOFSA-N 376.884 2.658 0 50 GFAA COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1cc(Cl)nc(Cl)c1C 1875369599 XOQKTAUYIPPZMR-SNVBAGLBSA-N 383.235 2.945 0 50 GFAA COc1ccccc1[C@H](O)C(=O)N[C@H](C)[C@@H](O)c1ccc(Br)cc1 2325762359 XRYMIIFZPRUIER-LQAWEQHXSA-N 394.265 2.729 0 50 GFAA CN1CC2(CCN(C(=O)C(C)(C)c3ccc(Br)cn3)CC2)OC1=O 2325817917 DWLCIHCCJDRYCX-UHFFFAOYSA-N 396.285 2.565 0 50 GFAA C[C@@H]1Cc2ccccc2N(S(=O)(=O)c2cn(C)nc2Br)[C@@H]1C 2325829548 MNXWPZPCXMJHTC-GHMZBOCLSA-N 384.299 2.959 0 50 GFAA CCn1cc(CN2CCCN(C(=O)NCCc3cc4ccccc4[nH]3)CC2)cn1 136664729 FGIDTNZIOAOHDG-UHFFFAOYSA-N 394.523 2.844 0 50 GFAA COc1ccc(C)cc1C(=O)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356154040 GBMPQUUTUKEKBX-DENIHFKCSA-N 383.444 2.524 0 50 GFAA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)C1 10463212 CQDRMLWGEWHVDI-NSHDSACASA-N 381.372 2.549 0 50 GFAA CSC[C@H](CCO)NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 246155710 UAJLRMHKDWSKOF-GLQYFDAESA-N 376.881 2.722 0 50 GFAA Cn1ccc(C(=O)NC(=S)Nc2ccccc2C(=O)Nc2ccccc2)n1 2806798 UMKMAGWSQDBKIA-UHFFFAOYSA-N 379.445 2.799 0 50 GFAA O=C(c1cnn2cc(CCO)cnc12)N1CCC[C@@H](CCc2ccc(F)cc2)C1 71747660 ZBMIABKEIZGMPQ-KRWDZBQOSA-N 396.466 2.888 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccccc4C)CC3)nc(C)n2)n1 35597274 IVXOVTQNUPXBMX-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA COCC[C@]1(NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CCOC1 446391198 QGGYEXFVMWXFIY-KRWDZBQOSA-N 394.269 2.765 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N(CCC(=O)O)C[C@H]3CCCO3)cc2)n1 237659762 HFOLNDGPMNKHFH-LJQANCHMSA-N 385.464 2.644 0 50 GFAA CCCN(C)C[C@@H]1CCN(C(=O)c2nnn(-c3cccc4cnccc34)c2C)C1 173809942 YILBXSBKYUQHJB-KRWDZBQOSA-N 392.507 2.928 0 50 GFAA COc1ccc(C(=O)NCC(=O)NCc2cc(Cl)ccc2C)cc1OC 241161283 JZQUIMRWLZXVRC-UHFFFAOYSA-N 376.840 2.712 0 50 GFAA COc1ccc([C@H](C)N(C)C(=O)NCCCc2csc(N)n2)c(OC)c1 426685266 HZWJCQATQTYWRK-LBPRGKRZSA-N 378.498 3.078 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCC4(CC3)[C@@H](OCCN)C[C@H]4O)cc2)o1 92107851 SFDKLROAELVQAC-UXHICEINSA-N 384.476 2.586 0 50 GFAA O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1ccc2c(c1)CCCO2 426589828 USLAHHCADQIBNJ-UHFFFAOYSA-N 375.428 2.665 0 50 GFAA Cc1cc(F)ccc1C(=O)NCc1cc2n(n1)CCCN(C(=O)C1CCC1)C2 91943602 JLHGFLUXIOMKRG-UHFFFAOYSA-N 384.455 2.793 0 50 GFAA Cc1cc(C)n(-c2ccccc2NC(=O)NCCS(=O)(=O)CC(C)C)n1 95531512 JOGBAUDZJKGNSX-UHFFFAOYSA-N 378.498 2.681 0 50 GFAA COc1ccc2c(c1)OC[C@]1(C(=O)O)CN(Cc3ccc(F)c(OC)c3)C[C@H]21 95516373 LZVKMVSETIZHEW-IIBYNOLFSA-N 387.407 2.906 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95509895 PNWONJKAHQZCNK-LJQANCHMSA-N 376.460 2.981 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)C(C)C)C2)c(OC)c1 95519780 UPVZBTUTKVAZAW-MRXNPFEDSA-N 376.497 2.995 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c(C)n1 91426099 JLHZEUVYKBUBEG-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(c2ncc(C(C)C)cn2)CC1 96154061 YHRXPUAJGVQYAH-UHFFFAOYSA-N 380.500 2.840 0 50 GFAA CCN(C(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1)[C@@H](C)c1cccnc1 180740043 RNODGAMZFVYOJN-INIZCTEOSA-N 396.557 2.624 0 50 GFAA C[C@@H]1N[C@]2(C(=O)Nc3ccccc32)[C@H]2C(=O)N(c3cccc4ccccc34)C(=O)[C@@H]12 247944776 HNSNKMPSOKDMRK-JOJZMBBWSA-N 397.434 2.785 0 50 GFAA COc1ccc([C@H](NC(=O)CCc2nc3ccccc3[nH]2)[C@H]2C[C@@H](O)C2)cn1 244735120 NTDWVXKRVJJBMS-ZSDSOXJFSA-N 380.448 2.528 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cccc(-c3ccc(C(C)=O)cn3)c2)CC1 534577282 QATLJKSRJNNUSN-UHFFFAOYSA-N 381.432 2.866 0 50 GFAA COc1ccc(CC(=O)N2CCC[C@@H]3CN(C(=O)c4ccco4)CC[C@@H]32)cc1 299758683 OABJHXSKNYMADG-MJGOQNOKSA-N 382.460 2.984 0 50 GFAA O=C1N[C@H]2CC[C@@H]1CN(C(=O)c1cccc(-c3ccc4[nH]ccc(=O)c4c3)c1)C2 584895200 CHSOCCULRULNKE-MSOLQXFVSA-N 387.439 2.546 0 50 GFAA Cn1ccnc1[C@@H](NC(=O)c1ccccc1N1CCOCC1)c1ccccc1 952964632 ONKHWIXDMXPZGC-FQEVSTJZSA-N 376.460 2.776 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCC[C@@H](CNC(=O)c3ccc4c(c3)CCO4)C2)n1 952990797 IOWPACSRFPHXEL-HNNXBMFYSA-N 395.459 2.670 0 50 GFAA CCc1oc(C(=O)Nc2cc(OC)cc(-n3cnnn3)c2)cc1CN1CCCC1 952987494 LELBFFYFLYALKG-UHFFFAOYSA-N 396.451 2.674 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1cscn1)c1cc(-c2ccccc2)[nH]n1 1565511721 VNSOXNPTPUCOAQ-YJBOKZPZSA-N 384.461 2.637 0 50 GFAA COCC(=O)N1CCc2c(N[C@@H](C)C(=O)Nc3nc(C)c(C)s3)cccc21 184473181 ACDJNQXBLXCXAR-LBPRGKRZSA-N 388.493 2.735 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)N1CCC(O)(c2ccccc2)CC1 186763371 QZSKSEKWXSWPHJ-UHFFFAOYSA-N 399.457 2.954 0 50 GFAA O=C(C1CCN(c2cnccn2)CC1)N1CCC(OCc2ccccc2)CC1 193088951 STEQBYWPLADXTC-UHFFFAOYSA-N 380.492 2.901 0 50 GFAA COc1ccc(CN2CC[C@H](O)[C@H](C(=O)O)C2)cc1OCc1cccc(F)c1 1615738370 OPNNQPUDXVWJEB-MSOLQXFVSA-N 389.423 2.681 0 50 GFAA CCOC(=O)c1nn(-c2ccc(Br)cc2)c(=O)c2c(N)scc12 638947 ASJDPQDOHOTXQI-UHFFFAOYSA-N 394.250 2.969 0 50 GFAA Cc1[nH]nc(CCC(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)c1C 1704297716 FHDOEHUJEDFPTB-UTKZUKDTSA-N 378.476 2.881 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N3CCC(=O)N(CC4CC4)CC3)c2)n1 11812969 ZHAGFIAQPAQQML-UHFFFAOYSA-N 380.492 2.633 0 50 GFAA O=C1CC[C@@H](C(=O)NC[C@H]2Cc3cc(-c4ccsc4)cc(Cl)c3O2)N1 12048048 ZKXQZZIMUOQUDJ-HIFRSBDPSA-N 376.865 2.767 0 50 GFAA COc1cccc(CN2CCC[C@@H](n3cc(C(=O)NC4CCCC4)nn3)C2)c1 12125919 LIPLITSNMUDIED-GOSISDBHSA-N 383.496 2.796 0 50 GFAA COc1cc(C)ccc1OCc1nc(C(=O)N(C)Cc2cn(C)nc2C)co1 12474194 VIHOTZUHERXCMV-UHFFFAOYSA-N 384.436 2.885 0 50 GFAA CC[C@@H](C)N1CCC2(CC1)C(=O)N(C1Cc3ccccc3C1)C(=O)N2CCOC 14754971 IZYGNLHDARCIAT-QGZVFWFLSA-N 399.535 2.698 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)Nc1cccc(-c2cscn2)c1 19147607 PBWWTKAIWPRQPN-UHFFFAOYSA-N 381.461 2.606 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@@H]1c1ccc(SC)cc1 4476997 LYAQGMNUNZHKRV-VIPLHTEESA-N 394.489 2.575 0 50 GFAA CC(C)Cc1ccc(CN2C[C@@H]3CC[C@H]2CN(S(=O)(=O)N(C)C)C3)s1 247932793 GGHWRHYQBDMDMY-HOTGVXAUSA-N 385.599 2.649 0 50 GFAA COC(=O)[C@]1(CF)CCN(C(=O)c2ccn(-c3ccccc3C(F)(F)F)n2)C1 1875297140 DOUCYECHAURSSB-KRWDZBQOSA-N 399.344 2.866 0 50 GFAA COCc1cccc(S(=O)(=O)Nc2cc(C(=O)OC)cc3cccnc23)c1 1875317329 VKCNDBXNOGRBJJ-UHFFFAOYSA-N 386.429 2.969 0 50 GFAA COc1ccc(C(=O)N(C)C[C@H](C)NC(=O)c2ccc3n[nH]cc3c2)c(C)c1 1875350063 ZGWZHIVACKKPIX-AWEZNQCLSA-N 380.448 2.770 0 50 GFAA Cn1c(N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)nc2cc(Br)ccc21 1875404529 LNWFRUDKNXFZQC-DJSGYFEHSA-N 390.285 2.784 0 50 GFAA COCCCNS(=O)(=O)c1ccc(Br)c(C(F)(F)F)c1 38536944 PPPXHLZRJSLAJM-UHFFFAOYSA-N 376.194 2.783 0 50 GFAA in-vitro CCn1ncc2cc(C(=O)Nc3cccc(C4(N)CCOCC4)c3)c(C)nc21 2325769226 ZAWDCMFSNMPAFU-UHFFFAOYSA-N 379.464 2.976 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)c2cc3ccc(Br)cc3c(O)n2)C12CC2 2325788511 LJXRCPQWYIATMI-GFCCVEGCSA-N 391.221 2.782 0 50 GFAA CCn1cc(Cl)cc1C(=O)N(C)C[C@H](C)Nc1cc(OC)nc(COC)n1 2325794798 RQJCLSAMTJPBJC-LBPRGKRZSA-N 395.891 2.679 0 50 GFAA Cc1nc(O)[nH]c1C(=O)N[C@@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 1450297507 XOPTXNJGFTUBAF-YJBOKZPZSA-N 397.406 2.744 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2ccc(Cl)cc2)S(C)(=O)=O)c1 655127 RZUDJUGCPOORME-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CCc1cc(S(=O)(=O)N2CCC[C@@]23CCCN(C2CC2)C3=O)ccc1OC 2356156861 UJVBONBKZZDATN-HXUWFJFHSA-N 392.521 2.566 0 50 GFAA CCCn1c(C)cn2c3c(=O)n(CCCc4ccccc4)c(=O)n(C)c3nc12 4250971 GPSCDPIGTBWRHG-UHFFFAOYSA-N 379.464 2.501 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1ccccn1)c1ccc(Cl)cc1 7495440 LPHSPZLBVHNRIO-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA C[C@H](OC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)Nc1ccc(Cl)cn1 221998991 SVPGDYUXWAGBHO-MKIWLTPFSA-N 378.856 2.937 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3sccc3Cl)C2)CC1 59471975 CZANRUAPSCBWDO-CYBMUJFWSA-N 385.917 2.780 0 50 GFAA Cc1nc(C)c(CC(=O)N2CCC[C@H](c3[nH]ncc3-c3ccccc3)C2)c(=O)[nH]1 67817631 GTNQRJOIIYHWOJ-KRWDZBQOSA-N 391.475 2.726 0 50 GFAA Cc1cccc(-c2c[nH]nc2C2CCN(C(=O)CN3CCC[C@H](O)C3)CC2)c1 67723754 NIEMRSZXDIYIAT-IBGZPJMESA-N 382.508 2.548 0 50 GFAA Cc1nc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)cs1 120711980 KTNOJQJIPFNSJB-OAHLLOKOSA-N 383.395 2.713 0 50 GFAA CCn1cc(NC(=O)c2cc(C)n(C(F)F)n2)c(C(=O)NCc2ccco2)n1 2732871 XFICGXZYOAFBRZ-UHFFFAOYSA-N 392.366 2.578 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)C2CCN(c3cnccn3)CC2)C[C@@H](C)O1 122190265 MLONAFNTHWGOFL-IAGOWNOFSA-N 395.507 2.945 0 50 GFAA CCOC(=O)c1cc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc(C(=O)OCC)c1 4651240 MPIOXIQSKMNYNE-HOTGVXAUSA-N 389.404 2.646 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccnc2)Cc2cn[nH]c2-c2ccc(F)cc2)N1 215278551 VXJKZWXWCSEDFD-IBGZPJMESA-N 379.439 2.892 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N1CCC[C@]2(CC1)CNC(=O)O2 72148571 JRSXXIUMSZBLCA-FQEVSTJZSA-N 386.427 2.733 0 50 GFAA COc1ccc(-c2c3c(=O)n(Cc4cccnc4)ccc3nc3ncnn23)cc1 38828744 OKEVMUWIGZSKJO-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@]23CCOc2ccccc23)cc1 282539490 HXRDQPQRLSVLDM-PXNSSMCTSA-N 386.473 2.616 0 50 GFAA CCN1CCC[C@H](NC(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)C1 177100702 NUOZTNRIDOYINY-AWEZNQCLSA-N 378.519 2.795 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1c(F)cccc1Cl 177580549 WULNGONZVLMMFD-SNVBAGLBSA-N 382.844 2.805 0 50 GFAA COc1ccc(CNC(=O)N2CCC([C@@H](O)c3ccccn3)CC2)c(OC)c1 426373850 RDEARQAOSRJNMV-HXUWFJFHSA-N 385.464 2.754 0 50 GFAA CN(C)S(=O)(=O)N[C@@H]1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 91636454 IQPQNTKNIQWQNU-QGZVFWFLSA-N 376.526 2.943 0 50 GFAA O=C(c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O)N1CCCOCC1 92037432 CNPAOVOSOWDCMH-UHFFFAOYSA-N 382.247 2.530 0 50 GFAA Cc1nn(C)cc1C(=O)N1CCN(c2nc(C(C)C)cc(C(F)(F)F)n2)CC1 91468236 AWLHGJJXECHHQU-UHFFFAOYSA-N 396.417 2.623 0 50 GFAA C[C@@]1(c2ccccc2)CCCN(C(=O)c2ccc(N3CC(=O)NC3=O)cc2)C1 95500041 NNWZBEBLXYHDRT-JOCHJYFZSA-N 377.444 2.937 0 50 GFAA CCn1c(Cn2ccnc2C)nnc1C1CCN(Cc2cccc(C)n2)CC1 91860814 DLUABDZWSUDFGA-UHFFFAOYSA-N 379.512 2.934 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4ccccc4)C3)CCC2=O)cn1 91931902 JPDHJBFRERMSIC-JOCHJYFZSA-N 378.476 2.830 0 50 GFAA O=C(c1ccc(Cl)cc1)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@H]2C=Cc3cc(F)ccc3N12 247800741 FODXHQMLJQBXRZ-XDNAFOTISA-N 396.805 2.835 0 50 GFAA O=C1C[C@H](c2ccccc2)N(C(=O)C2CCN(Cc3ccccc3)CC2)CCN1 299303729 SAEMIHVWTZKKDW-JOCHJYFZSA-N 391.515 2.988 0 50 GFAA COC(=O)c1cnc(O)c([C@H](CC(N)=O)c2ccc(-c3ccccc3)o2)c1O 253624014 ZDDPBGXHVRLXCS-GFCCVEGCSA-N 382.372 2.547 0 50 GFAA biogenic CCN1CCN(C(=O)NC[C@H](c2ccccc2C)N2CCC(C)CC2)CC1=O 534667671 ZAFYUKZANZQRCG-HXUWFJFHSA-N 386.540 2.642 0 50 GFAA Cc1cc(N2CCCN(C(=O)NCc3noc(C4CCCC4)n3)CC2)ccn1 534668907 ZNBVLRWSDGJWIF-UHFFFAOYSA-N 384.484 2.853 0 50 GFAA Oc1c(I)cc(I)nc1Cl 40566597 FENUVBOVGRYYOF-UHFFFAOYSA-N 381.338 2.650 0 50 GFAA Cc1ccccc1-n1cc(-c2ccnc(NCCC3(O)CCN(C)CC3)n2)cn1 48134986 AOYVTXXSWUIBHM-UHFFFAOYSA-N 392.507 2.896 0 50 GFAA CN1CCN(c2cccc(NC(=O)N3CC(Oc4ccccc4F)C3)c2)C1=O 299792348 FIRJIPWALXECOR-UHFFFAOYSA-N 384.411 2.993 0 50 GFAA N[C@@H]1C[C@@H](C(=O)NCCc2ccccc2F)N(Cc2cccc(Cl)c2)C1 299772505 AFURNHRTFRBZJL-MJGOQNOKSA-N 375.875 2.740 0 50 GFAA O=C(Cn1ccc2ccccc21)NCC1CCN(C(=O)c2cscn2)CC1 827860883 NQTWLPUFWOJBFA-UHFFFAOYSA-N 382.489 2.766 0 50 GFAA c1cncc(Cc2nnc3n2CCN(Cc2cccc(Cn4cccn4)c2)CC3)c1 829073526 VGFLPHQJKOWPFH-UHFFFAOYSA-N 399.502 2.567 0 50 GFAA CCN1CCN(Cc2ccc(CNC(=O)c3ncoc3[C@@H]3CCCO3)cc2)CC1 1339126635 PTXLWLAHRHXXBH-IBGZPJMESA-N 398.507 2.594 0 50 GFAA O=S(=O)(c1ccc2oc(O)nc2c1)N(Cc1ccccn1)Cc1ccco1 952987141 JXAKVEYBVYUFOY-UHFFFAOYSA-N 385.401 2.913 0 50 GFAA COc1cc2c(cc1OC)CN(C1CCN(C(=O)c3ccncc3)CC1)CC2 952979714 ZJIDWLZUWDYTQK-UHFFFAOYSA-N 381.476 2.762 0 50 GFAA O=C(NCCS(=O)(=O)c1ccc(F)cc1)C1(N2CCCC2)CCCCC1 952962678 FKDWCVQUENFZOO-UHFFFAOYSA-N 382.501 2.514 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NOC[C@H]1CCOC1)OCc1ccccc1 170607696 NEGGOQDKIWGWFP-PMACEKPBSA-N 398.459 2.608 0 50 GFAA C[C@@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)n1cncn1 195410238 FGIWYWNTOGSMLH-INIZCTEOSA-N 389.459 3.000 0 50 GFAA Cc1cc(C)n(-c2cccc(CN3CC[C@@]4(C(=O)O)CCCN(C)[C@@H]4C3)c2)n1 1529155156 OYBUGYVHYNLHPW-IRLDBZIGSA-N 382.508 2.860 0 50 GFAA COc1ccc(CCC(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1OC 1529173627 ZPMUEOZUHWOZNQ-IFMALSPDSA-N 385.460 2.597 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1)c1cccc(F)c1 752777 KAWJNDFFNDNGBI-UHFFFAOYSA-N 394.406 2.736 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCOCC2)c2c1CC[C@H](NCc1ccccc1)C2 14539142 ARSPNFJMLSKTKM-IBGZPJMESA-N 396.535 2.659 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@@H](C(=O)NCC4CCOCC4)C3)nc2c1 14879439 SYTQVASBSONCKI-QGZVFWFLSA-N 398.507 2.706 0 50 GFAA COc1ccc(OC)c(NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1 940058 CEIRNSGDIHQOSL-GOSISDBHSA-N 382.416 2.963 0 50 GFAA CCOc1ccccc1NC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 6740963 IUHRDRJYGLOALC-UHFFFAOYSA-N 389.477 2.624 0 50 GFAA COc1cc(NC(C)=O)c(Cl)cc1C(=O)NCc1ccc2c(c1)OCO2 4436615 ZASMQBZGPNAALG-UHFFFAOYSA-N 376.796 2.966 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)COC[C@@H]1CCCCO1)CC2 1857674908 CQWSHIVCOWDRJC-SFHVURJKSA-N 383.492 2.600 0 50 GFAA CC(C)C[C@H](O)C(=O)N[C@H]1[C@H]2CC[C@@H]1CN(C(=O)c1cc3ccccc3o1)C2 1857686081 GYLPUGAWJWHVAM-CLWJZODNSA-N 384.476 2.807 0 50 GFAA O=C(c1ccc[nH]1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857707569 DEOCAUYNLXFZQG-NRFANRHFSA-N 375.432 2.693 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]34OCCCN3C(=O)C[C@@H]24)c2cc(Cl)ccc2n1 1857716445 MQQYPDPLCNAIIM-XLIONFOSSA-N 385.851 2.760 0 50 GFAA N=c1[nH]nc(N2CCC3(CCc4c(O)nc(-c5ccccc5)nc43)CC2)s1 1857724231 QOAYBCUENWGUDZ-UHFFFAOYSA-N 380.477 2.598 0 50 GFAA O=C(c1cc(Cl)ccc1F)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1875243078 OVYQSQWGGYETBY-MJKGWSOKSA-N 375.827 2.688 0 50 GFAA O=C(C[C@H]1CCCC[C@@H]1O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1 241776921 RTNQNFFYHXAKPA-QRQLOZEOSA-N 380.916 2.771 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CNCCc2cn[nH]c2)cc1 23153518 SRIWQDDRINLMQG-QFIPXVFZSA-N 394.519 2.614 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2oc3ccccc3c2COc2ccccc2)CCO1 485830964 UJEJUWAQPHALTR-SFHVURJKSA-N 381.384 2.937 0 50 GFAA O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 163069624 PNPVAHKEZCUACR-KRWDZBQOSA-N 391.479 2.957 0 50 GFAA COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1nnc2ccccc2n1 952846289 UZAXTVXMZPEPQI-UHFFFAOYSA-N 393.447 2.901 0 50 GFAA CN(C(=O)c1cc2cccnc2cc1F)C1CCN(CC(=O)N2CCCC2)CC1 1875270288 UTISLVKCBWOIPO-UHFFFAOYSA-N 398.482 2.533 0 50 GFAA O=C(NCC1(c2ccncc2)CCC1)C(=O)Nc1ccc(-c2csnn2)cc1 1875312845 CGZAVUFIVADJCW-UHFFFAOYSA-N 393.472 2.777 0 50 GFAA COc1ccc2nc(CN3CCN(c4ccc(C(=O)O)cc4)C[C@H]3C)[nH]c2c1 1875312502 NASYTLIMCJNOAA-CQSZACIVSA-N 380.448 2.980 0 50 GFAA Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NC1CC[C@H]2C[C@@H]2CC1 1875328382 PAMAOZBFSXBYBM-GJZGRUSLSA-N 379.526 2.508 0 50 GFAA O=C(Cc1csc(NC(=O)c2ccco2)n1)Nc1ncccc1OCCF 1875338801 MITWZXFABFJUQK-UHFFFAOYSA-N 390.396 2.913 0 50 GFAA O=C(NC[C@@H](O)Cc1ccccc1F)c1cc(Br)c2nccn2c1 1303693289 KAYFRNNSWNFVRO-ZDUSSCGKSA-N 392.228 2.569 0 50 GFAA CC(C)Oc1c(NS(=O)(=O)c2c(C3CC3)cnn2C)cccc1C(=O)O 888100823 YGEQORJPWNQCKU-UHFFFAOYSA-N 379.438 2.584 0 50 GFAA Cc1nc(C)c(CCC(=O)N2CC(C)(C)[C@@H]2c2nccn2CC2CC2)c(O)n1 888100653 ABOJXHUBRQVEPM-SFHVURJKSA-N 383.496 2.948 0 50 GFAA Cc1cccc(Cn2c(NC3CCCCC3)nc3c2c(=O)n(C)c(=O)n3C)c1 629087 DNWBPKBVPMRGAY-UHFFFAOYSA-N 381.480 2.535 0 50 GFAA biogenic Cc1nc[nH]c1CN1C[C@@H](CC(=O)N(C)[C@H](C)c2cccnc2)OCC12CCC2 2325785323 QCTWTKFKGKAHAT-IEBWSBKVSA-N 397.523 2.846 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cs1 2356145416 AZHXJXIZISDQGT-FQEVSTJZSA-N 385.537 2.747 0 50 GFAA O=C1N(C2CC2)CCC[C@@]12CCCN2S(=O)(=O)Cc1cccc(Cl)c1 2356149978 GQHUJFPOIUYWOB-GOSISDBHSA-N 382.913 2.789 0 50 GFAA O=C(NC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(C1CCCC1)C[C@@H]2O)c1ccncc1 2356159595 IPYDXQGKBDYELD-JTOYRKQZSA-N 391.515 2.831 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356169056 TYPLXGPGAQWTBO-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA O=C1Cc2cc(S(=O)(=O)NCc3ccccc3Cl)cc3c2N1CCC3 4570193 MYWLHGKWSNOBNL-UHFFFAOYSA-N 376.865 2.654 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N2CCC[C@H]2C(=O)O)cc1 6646374 RMXOJFYFBGLTHY-BSKAQADGSA-N 394.427 2.542 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@H](N3CCN(c4ccccc4F)CC3)C2)n1 55211769 KBBXRYXZAQAMFB-SFHVURJKSA-N 382.483 2.956 0 50 GFAA Cn1c(=O)n(CCCc2ccccc2)c(=O)c2c1nc1oc(C(C)(C)C)cn12 9789829 DQQLMMWUTHZSDF-UHFFFAOYSA-N 380.448 2.871 0 50 GFAA Cc1cc2c(=O)n(CC(=O)N3CCN([C@@H](C)c4ccccc4)CC3)cnc2s1 134284760 QPBVLVFUOFVNFO-INIZCTEOSA-N 396.516 2.672 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)CCC(C)(C)O)n[nH]2)c(Cl)c1 67691466 BHCDZNYSHQRTJE-UHFFFAOYSA-N 381.860 2.884 0 50 GFAA CCOC(=O)N1CCN(Cc2cc(Br)c(OC)cc2OC)CC1 23281464 AXOJIWGFONEIDY-UHFFFAOYSA-N 387.274 2.740 0 50 GFAA CN1CCC(c2c(-c3ccccc3)ncn2CCSc2nnnn2C)CC1 65381309 LCUMEGWRIXMQJU-UHFFFAOYSA-N 383.525 2.675 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)CN2CCOc3ccccc32)CC1 122821816 CUGAJLJZECXTOX-UHFFFAOYSA-N 393.487 2.615 0 50 GFAA O=C1NC[C@@H](c2ccc(F)cc2)Cc2[nH]c(-c3noc(-c4ccco4)n3)nc21 65404463 VSBRDSOOBANOIK-NSHDSACASA-N 379.351 2.929 0 50 GFAA c1cncc(CN2CCC[C@H](n3cc(-c4ccc5c(c4)OCCO5)nn3)C2)c1 67771025 HWIFIAIFGVTCBR-SFHVURJKSA-N 377.448 2.948 0 50 GFAA CC(=O)SC[C@H](Cc1ccccc1)C(=O)NCC(=O)OCc1ccccc1 1546843 ODUOJXZPIYUATO-IBGZPJMESA-N 385.485 2.985 0 50 GFAA biogenic,world CNS(=O)(=O)c1ccc(CN2CCC[C@@H](C(=O)c3cccs3)C2)cc1 71759577 QMPYOAQLCOITNJ-OAHLLOKOSA-N 378.519 2.751 0 50 GFAA Cc1cccc2c(N3CCC[C@@H](c4n[nH]cc4CN4CCOCC4)C3)ncnc12 328631275 QTDDXCYLMCHEEU-QGZVFWFLSA-N 392.507 2.878 0 50 GFAA O=S(=O)(c1cnc2ccccc2c1)N1CCC[C@@H](c2nncn2C2CC2)C1 330286735 AVTQFXKXNWEBMR-OAHLLOKOSA-N 383.477 2.730 0 50 GFAA Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCc3ccc(-n4ccnc4)nc3)c12 363183469 XCHJPEMEEKJDPW-UHFFFAOYSA-N 387.447 2.665 0 50 GFAA COCCS(=O)(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 154393317 VPHTYWGLSWDBOS-UHFFFAOYSA-N 388.489 2.597 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2CC[C@H](CN)C2)Cc2ccccc2C1 72157752 CVHZUEXHTLAIEF-HXUWFJFHSA-N 377.532 2.506 0 50 GFAA Cn1cc(-c2ccccc2CNC(=O)N2CCC(c3ccnn3C)CC2)cn1 366938136 LHTXDSBUGSKAFR-UHFFFAOYSA-N 378.480 2.910 0 50 GFAA O=C(O)[C@H]1CN(C(=O)Cc2n[nH]c3ccccc23)C[C@@H]1c1ccc(F)cc1F 368311940 GPPFJONIKRDQIU-CABCVRRESA-N 385.370 2.710 0 50 GFAA Cc1ccc(CN2CCN(c3cc(-c4ncon4)ccn3)C[C@@H]2CCO)cc1 72435605 SFTCTUSAEFYKIA-IBGZPJMESA-N 379.464 2.513 0 50 GFAA NC(=O)CC[C@@H]1CCCN(c2nnnn2-c2ccc(-c3ccccc3)cc2)C1 77355686 HEWQOUACSDSFIK-INIZCTEOSA-N 376.464 2.811 0 50 GFAA CCn1c(-c2cnn(C)c2)nnc1N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 333944639 SDVAKXHOBMPPOF-AWEZNQCLSA-N 398.433 2.884 0 50 GFAA NC1CCN(C(=O)/C=C/c2ccc(-n3cc(Br)cn3)c(F)c2)CC1 237840814 OKIJFEIGCFAKSM-DUXPYHPUSA-N 393.260 2.737 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2C[C@H](C)OC[C@@H]2c2ccccc2)c1 174005232 KPWQVMJOTSWKSS-OXJNMPFZSA-N 381.476 2.837 0 50 GFAA CNC(=O)[C@H]1CCCCN1CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 173207497 KNIAJKZOGTWLJS-QGZVFWFLSA-N 397.523 2.709 0 50 GFAA O=C(c1cnc2nc(O)nc(O)c2c1)N1CCC[C@@H](c2ccc(F)cc2)CC1 378494654 XIUNDGCFFSFURI-GFCCVEGCSA-N 382.395 2.985 0 50 GFAA COC(=O)[C@]1(C)CCN(C(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 177222685 OQTTVGHZPIYGHE-OAQYLSRUSA-N 396.422 2.827 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)Nc2cccc3c2OC(C)(C)C3)CC1 240465854 GAVAWSYIZVRERT-UHFFFAOYSA-N 395.507 2.869 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3nnc(C(C)C)s3)n2)c1 44891661 GDCYSGMGSIWXOP-UHFFFAOYSA-N 385.449 2.533 0 50 GFAA C[C@@]1(C(=O)O)CCN(CC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)C1 263560683 BPQMSSLFJFIKOP-GOSISDBHSA-N 377.441 2.608 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1ccc(CO)cc1)c1cc2ccccc2cn1 222667778 VRLNDLOUVHMIDA-TZIWHRDSSA-N 378.428 2.693 0 50 GFAA O=C(O)CC[C@@H]1CN(C(=O)c2cc(F)cc(Cl)c2)CC[C@@H]1N1CCOCC1 91818700 HQVZGSGPAQXXFS-DYVFJYSZSA-N 398.862 2.507 0 50 GFAA OC[C@H]1CN(Cc2cc3c(cc2Cl)OCO3)C[C@H]1CN1CCCCCC1 91427267 WGOHJYRFWUDLRJ-IAGOWNOFSA-N 380.916 2.985 0 50 GFAA Cc1nc(-c2nc([C@H](C)CN3CCOCC3)n(CC(F)(F)F)n2)cs1 96163002 HRRRFOIHDKAQAH-SNVBAGLBSA-N 375.420 2.708 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@H](c3ccc(C(=O)O)cc3)C2)c(=O)n1C 95380227 LKOSNCVIIKEFFI-KRWDZBQOSA-N 382.460 2.974 0 50 GFAA Cc1ccc(CN2CCN(CC(=O)Nc3ccc4nsnc4c3)CC2)cc1 22752085 PXTXJJPWDBFVML-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA C[C@H]1CN(C[C@@H]2CN(C(=O)c3ccc4ccccc4c3)C[C@@H]2CO)C[C@@H](C)O1 91694665 AEIJJKQQUMOSKA-WOSNLTMFSA-N 382.504 2.630 0 50 GFAA CNC[C@H]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2Br)C1 299739026 JPWKOLYKDUXVGA-WDEREUQCSA-N 375.694 2.938 0 50 GFAA Cc1ccc2[nH]c([C@@H]3CCCN(S(=O)(=O)CC4CCOCC4)C3)nc2c1 182495673 HTNYFXSIEHZUKJ-MRXNPFEDSA-N 377.510 2.807 0 50 GFAA CC(C)(C)c1csc(NC(=O)CN2CCC[C@H](c3cc(O)ncn3)C2)n1 252484954 GKZPBEKOZQBLKY-LBPRGKRZSA-N 375.498 2.754 0 50 GFAA O=C(C1CCN(c2nc3ccccc3o2)CC1)N1CCOCC2(CCOCC2)C1 185146188 BDOPMMCZZRUHGJ-UHFFFAOYSA-N 399.491 2.700 0 50 GFAA O=C(CN1CCCCC1)NC[C@@H]1Cc2cc(-c3cnccn3)cc(Cl)c2O1 299759917 PBBUYKMMTALJHI-INIZCTEOSA-N 386.883 2.703 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1c(O)c2cccc3c2n(c1=O)[C@H](C)C3 299738233 LPXNXUGLAJTIJT-LLVKDONJSA-N 378.384 2.863 0 50 GFAA CCOC(=O)c1cccc(-c2cccc(C(=O)N[C@@H](C)c3ncnn3C)c2)n1 584895018 QWRQNJJLVGBJHC-ZDUSSCGKSA-N 379.420 2.545 0 50 GFAA COc1ccc(OC)c(CN(C(=O)N[C@H]2COC[C@@H]2OC)C2CCCC2)c1 584890401 LAPISOGFHSZJJU-HKUYNNGSSA-N 378.469 2.572 0 50 GFAA O=C(Cc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)cc1)NC1CC1 952992332 ZWACKLZLBLPISU-VQTJNVASSA-N 397.519 2.875 0 50 GFAA C[C@@H](O)c1nc2ccc(NC(=O)c3ccc(N4CCN(C)CC4)cc3)cc2[nH]1 952982794 QYWJURQNWVWRAW-CQSZACIVSA-N 379.464 2.620 0 50 GFAA Cc1cncc(N2CCOC3(CCN(C(=O)CCc4ccccc4)CC3)C2)n1 952968340 GIDHGZCOFJQVSW-UHFFFAOYSA-N 380.492 2.616 0 50 GFAA COc1nccnc1N1CCC[C@H](CNC(=O)C2=Cc3ccccc3OC=C2)C1 952981882 IXVLGTYVYZPEQO-MRXNPFEDSA-N 392.459 2.808 0 50 GFAA O=C(CCC(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1)NC1CCCC1 170591522 QTEYCIHWCUZNML-OAHLLOKOSA-N 399.413 2.919 0 50 GFAA CC(C)c1cc(C(=O)N[C@H](C(=O)N2CCOCC2)C(C)C)c2ccccc2n1 193172002 HDDKIGUSFWBPNR-FQEVSTJZSA-N 383.492 2.971 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCC(C(=O)N2CCOCC2)CC1 1506398232 ANAILNGVONMGCJ-UHFFFAOYSA-N 393.487 2.768 0 50 GFAA Cc1ccc(OCCN2CCCN(C(=O)CCc3ccnn3C)CC2)cc1C 1529185830 QSCJAJHHPBWHJF-UHFFFAOYSA-N 384.524 2.583 0 50 GFAA Cn1c2ccccc2c2nnc(SCN3C(=O)c4ccccc4C3=O)nc21 856917 CKSZYXSLHLWGHH-UHFFFAOYSA-N 375.413 2.862 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@@H]2CN(C(=O)C3CCC3)C[C@@]2(CO)C1 1772818601 VFMBLGHBHKQMBL-YWZLYKJASA-N 391.899 2.733 0 50 GFAA O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(N3CCCCC3)c(C(=O)O)c1)C2=O 5101234 IGPSPRFFXUCAMR-UHFFFAOYSA-N 394.383 2.874 0 50 GFAA O=C(Cc1ccccc1)NC[C@H]1CCC2(CCN(C(=O)c3ccoc3)CC2)O1 11783121 JTRGXBWZCQNWEA-LJQANCHMSA-N 382.460 2.792 0 50 GFAA O=C([C@@H]1C[C@H](n2cnnn2)CN1Cc1cccc(Cl)c1)N1CCCCCC1 12279836 SPJQTZYRRDIOIV-ROUUACIJSA-N 388.903 2.545 0 50 GFAA CCCNC(=O)N1CC[C@@]2(CCCN(Cc3cc(OC)ccc3F)C2=O)C1 12432415 QEQOENRILLVWNA-FQEVSTJZSA-N 377.460 2.768 0 50 GFAA COc1ccc(Cn2cc(C(=O)NC3CCN(c4ccccc4)CC3)nn2)cc1 12435372 NJSQWNJXKDNEFM-UHFFFAOYSA-N 391.475 2.734 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)CN2CCCC2=O)C1 12716834 UKRMGCZQVGQYKZ-AWEZNQCLSA-N 382.382 2.749 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@H](NCCOC(C)C)C2 14540524 ZVXLFFFDYKEPCI-KRWDZBQOSA-N 388.512 2.640 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3ccc(COC)o3)CC2)CC1 15074937 RXAVXBDBYGFRPP-UHFFFAOYSA-N 377.529 2.582 0 50 GFAA COC[C@@H](C)N1CCC(Oc2cc(OC)ccc2C(=O)N2CCCC2)CC1 15079868 ZVTMZYPEQBUSJA-MRXNPFEDSA-N 376.497 2.809 0 50 GFAA COc1ccc([C@H]2CC(c3cccs3)=NN2C(=O)CN2CCOCC2)cc1 19913077 GJOXRZITFFSROX-GOSISDBHSA-N 385.489 2.767 0 50 GFAA COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(F)cc4)[nH]c3C)CC2)cn1 1857681035 VNPDYAXPXIYYOY-UHFFFAOYSA-N 395.438 2.890 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CC1)OCCc1sc(C(=O)O)cc12 1857684897 JLMXLFKNPPLIKD-UHFFFAOYSA-N 376.434 2.755 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857716706 PMHWEDADMJEUKR-SFTDATJTSA-N 382.508 2.890 0 50 GFAA COc1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cn1 1857719165 FVBIZSUKOWYTFD-FPOVZHCZSA-N 381.476 2.768 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N(C)CC4(CO)CCC4)CC3=O)sc2c1 1857722889 RUVKNVOEEFRYKO-AWEZNQCLSA-N 387.505 2.579 0 50 GFAA O=C(c1cc2cc(F)ccc2[nH]1)N1C[C@@H]2OC(=O)N(CCc3ccccn3)[C@@H]2C1 211202972 ABTWYVBDDMOCHB-MOPGFXCFSA-N 394.406 2.590 0 50 GFAA COc1cc(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c(C(N)=O)cc1OC 116158704 VDXAOTHWSBQHPN-MRXNPFEDSA-N 397.475 2.653 0 50 GFAA CN1CC[C@@H](NC(=O)c2ccccc2S(C)(=O)=O)[C@H]1c1ccc(F)c(F)c1 240551618 GUVSDUWOUDTMBS-SJLPKXTDSA-N 394.443 2.544 0 50 GFAA CCOc1cc(NC2CCN(C(=O)NCc3cc(C)cc(OC)c3)CC2)ncn1 467214193 CGBXIBJRTORFCZ-UHFFFAOYSA-N 399.495 2.978 0 50 GFAA CC[C@@](O)(C(=O)N1CCN(C(=O)c2ccco2)CC1)c1cccc(Cl)c1 800378379 IAHJCJAUMXURRS-IBGZPJMESA-N 376.840 2.515 0 50 GFAA Cc1cc(NC(=O)NCc2ccc3c(c2)CC(=O)N3C)ccc1C(=O)N(C)C 903189768 IATHDGHKRCEHKG-UHFFFAOYSA-N 380.448 2.537 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2)CN(C(=O)[C@@H]2CCc3nncn3C2)C1 952891521 FKPMBNWAPDAYQI-MRXNPFEDSA-N 390.491 2.637 0 50 GFAA C[C@H](CC(=O)N1CC[C@@H](C(F)(F)F)[C@@H](CO)C1)NC(=O)Nc1ccccc1 1875256684 RUJYQNFALJJLKP-UMVBOHGHSA-N 387.402 2.606 0 50 GFAA Cc1cs/c(=N\Cc2ccc(S(N)(=O)=O)cc2)n1Cc1ccc(F)cc1 1875252835 UWUKJDAYIAVLTP-UZYVYHOESA-N 391.493 2.794 0 50 GFAA Brc1ccc2c(=N[C@@H]3CCCN(Cc4ccccc4)C3)nc[nH]n12 1875264647 RKMFRASHIWESII-OAHLLOKOSA-N 386.297 2.990 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCCN3C(=O)c3ccc(F)c(C)c3)C2)ncn1 1875280551 WISNMIXDPXFGRO-PXNSSMCTSA-N 396.466 2.999 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)CC1)O2 1875394306 DFLSVXOHCRGQGW-QGZVFWFLSA-N 399.466 2.759 0 50 GFAA Cc1oc(-c2ccc(F)cc2)nc1CNC(=O)[C@@H]1C[C@H](Oc2ccncc2)CN1 1875304353 IDQHGGUVQYOEQY-ROUUACIJSA-N 396.422 2.610 0 50 GFAA Cc1ccc2[nH]c(C(=O)NC[C@H]3CCN(C(=O)C4(C)CCOCC4)C3)cc2c1 1875309589 CXFLBQDNJJZFOZ-MRXNPFEDSA-N 383.492 2.871 0 50 GFAA COC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1ccc(OC)c(OC)c1 4112551 CJWGRKNBQPORGM-MRXNPFEDSA-N 376.434 2.527 0 50 GFAA O=C(OCc1nccs1)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1 920123274 OLPGIZWSLSCJBF-UHFFFAOYSA-N 379.397 2.905 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1 134851019 OLYZNTJIEJPNFH-HNNXBMFYSA-N 388.489 2.876 0 50 GFAA COC(=O)C1=C(C)N=C2S[C@@H](C)C(=O)N2[C@H]1c1ccc(OC)c(OC)c1 2254232 MMELZDSVMIBFNE-BONVTDFDSA-N 376.434 2.525 0 50 GFAA CN(C)Cc1ccc(-c2cccc(C(=O)NCCCn3ccnc3)c2)c(CO)c1 2356148477 ZRSBZCWCCPLOKO-UHFFFAOYSA-N 392.503 2.924 0 50 GFAA O=C(CCCn1cccn1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356164802 HNFBFIDTULJCBW-QFIPXVFZSA-N 380.492 2.847 0 50 GFAA O=C(Cc1ccc(-n2cccn2)cc1)N1CCCN(Cc2cscn2)CC1 171020994 QXEVUKDUGHXVQY-UHFFFAOYSA-N 381.505 2.606 0 50 GFAA COc1ccccc1/C=C/CN1CCN(Cc2cccc(C)n2)[C@H](CCO)C1 105282365 PXJSRAKHUPZAQP-MECCDNJOSA-N 381.520 2.981 0 50 GFAA O=C1C[C@@H](c2ccc(OCCCN3CCOCC3)cc2)c2ccc(O)cc2N1 65435729 QVEZQSVHXCDCJI-FQEVSTJZSA-N 382.460 2.967 0 50 GFAA CSc1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)cn1 20166308 URKUOOXSVIUQCE-INIZCTEOSA-N 394.491 2.546 0 50 GFAA C[C@H]1CCc2c(sc(NC(=O)c3cc(C(F)(F)F)nn3C)c2C(N)=O)C1 2747804 MVLLXYJIHDEVHD-ZETCQYMHSA-N 386.399 2.976 0 50 GFAA CC(C)[C@H]1CN(CC(=O)Nc2cnn(C)c2)CCCN1Cc1ccc(F)cc1 71765062 NSBKORAZNABBBG-HXUWFJFHSA-N 387.503 2.730 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCC[C@]3(CCCCc4ccccc43)C2)o1 363967303 MXTINCISFROQFR-HXUWFJFHSA-N 388.489 2.827 0 50 GFAA CN1CC2(CCN(C(=O)c3cccnc3N(C)C3CCCCC3)CC2)OC1=O 77504699 JFFXZEAYAONNBV-UHFFFAOYSA-N 386.496 2.907 0 50 GFAA CC(C)CNC(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72145692 HTRJABXFMDEEOK-QFIPXVFZSA-N 393.531 2.781 0 50 GFAA COc1ccc(S(=O)(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cc1C(=O)O 284113324 SRBNOXFEFFCHNR-GXTWGEPZSA-N 394.276 2.598 0 50 GFAA Cc1nc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)ccc1C(=O)O 263360338 TXQGJTAQQKSNJT-INIZCTEOSA-N 381.432 2.513 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)[C@@H](c1ccc2c(c1)OCO2)N(C)C 426503260 KDAIQGSFEDXDBJ-HXUWFJFHSA-N 394.431 2.727 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC(CO)CC3)csc2C1 426370889 AOSICVZBTJMLKG-UHFFFAOYSA-N 389.521 2.756 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C(=O)CCCc1ccccc1)C2)C1CCC1 426395173 MJWFIZYHDGXBAA-UHFFFAOYSA-N 380.492 2.665 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2cccc(C)n2)CC3)cn1 91435085 UWHDRUVYNANWIJ-UHFFFAOYSA-N 379.508 2.893 0 50 GFAA Cn1c(CNC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)nc2ccccc21 426734270 JGVRJOBUHCMJAL-QGZVFWFLSA-N 379.464 2.859 0 50 GFAA Cn1nc(CN2CCCn3nc(CCC(=O)O)cc3C2)c2c(Cl)cccc21 95370322 GCXKADRUVXZVHL-UHFFFAOYSA-N 387.871 2.846 0 50 GFAA O=C(c1nc2ccccc2[nH]c1=O)N1CCC(c2nccn2CC2CC2)CC1 95517744 IRWDPBINEMYGQH-UHFFFAOYSA-N 377.448 2.549 0 50 GFAA O=C(Nc1cccc(F)c1)c1cccc(S(=O)(=O)NCc2ccccn2)c1 95379025 DDAIQQMIZKHYQC-UHFFFAOYSA-N 385.420 2.952 0 50 GFAA CCn1ccnc1C1CCN(C(=O)C[C@H]2CN(Cc3ccccc3)CCO2)CC1 95518426 NZIRAEYOOSWPOG-NRFANRHFSA-N 396.535 2.900 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4cnccc4C)C3)CCC2=O)cn1 91595919 NSDHVAVNXJYNHF-JOCHJYFZSA-N 393.491 2.533 0 50 GFAA CCn1c(CCNC(=O)[C@@H]2COc3c(cccc3OC)C2)nc2ccccc21 95388562 FPOCHKGQTJJMER-INIZCTEOSA-N 379.460 2.975 0 50 GFAA CC(C)Cc1nc(CN(C)S(=O)(=O)c2cc(-c3ccno3)cs2)no1 821483352 KUEKMZBAUSGQPB-UHFFFAOYSA-N 382.467 2.805 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CC2)n1 952871703 BUSPJQWIYQBHQD-UHFFFAOYSA-N 391.493 2.545 0 50 GFAA COCc1cc(C(=O)N2CCN(c3nncc4ccccc34)CC2)ccc1F 170646520 MUCRXTBJYJWGBK-UHFFFAOYSA-N 380.423 2.878 0 50 GFAA O=C(NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)[C@H]1C[C@H](F)CN1 188271686 VFWOISRMSODNKT-PKOBYXMFSA-N 382.414 2.995 0 50 GFAA CN(CC(=O)NC(C)(C)C)CC1CCN(C(=O)OCc2ccccc2)CC1 189579224 FBCKFQYGADQUAB-UHFFFAOYSA-N 375.513 2.882 0 50 GFAA CCC[C@@]1(COC)CCCN1C(=O)c1cnn(CC(=O)NC2CCCCC2)c1 192748778 KEKIRTOGOLSQTK-NRFANRHFSA-N 390.528 2.753 0 50 GFAA CN1CCc2ccc(NC(=O)NCc3ccccc3CN3CCC[C@@H]3CO)cc21 193744826 PWAWGUHPUWRQQG-OAQYLSRUSA-N 394.519 2.957 0 50 GFAA O=C([C@@H](Cc1ccccc1)NCc1nc(-c2ccccc2)c[nH]1)N1CCOCC1 194419029 PYFSHUJCNGALRK-HXUWFJFHSA-N 390.487 2.636 0 50 GFAA COc1cc(-c2onc(N3CCCN4CCC[C@H]4C3)c2C(=O)O)ccc1F 1704309255 OWLFBOIXHWHBTN-ZDUSSCGKSA-N 375.400 2.862 0 50 GFAA Cc1nc2sccn2c1CN1CCC(CCC(=O)NC[C@H]2CCCO2)CC1 11819098 YCYXCZSHVJDXCN-QGZVFWFLSA-N 390.553 2.992 0 50 GFAA CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC 12412601 DAXYUDFNWXHGBE-VKCGGMIFSA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro c1cncc(COC2CCN(c3nc4nonc4nc3NC3CCCC3)CC2)c1 12436342 ZISRWKOHLRMCOV-UHFFFAOYSA-N 395.467 2.948 0 50 GFAA COc1cc(C(=O)NCc2nnc(SCC(C)C)n2C)cc(OC)c1OC 12456515 ZKKHPUSQSBDZKN-UHFFFAOYSA-N 394.497 2.519 0 50 GFAA CCCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](N(C)Cc1ccon1)C2 14543487 LXVFOTCOYFDMDJ-KRWDZBQOSA-N 385.512 2.897 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)NCc2nc(C)c[nH]2)no1 15077579 RTPXYNMUGHKMCP-UHFFFAOYSA-N 376.800 2.877 0 50 GFAA C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF 1547017 ASXVEBPEZMSPHB-YJBOKZPZSA-N 386.423 2.567 0 50 GFAA in-vitro COc1ccc(NC(=O)C2=C(C)Nc3ncnn3[C@H]2c2cccnc2)c(OC)c1 4414387 YRVUUEATVZKUDS-SFHVURJKSA-N 392.419 2.618 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)N3CCC(C(=O)NC(C)(C)C)CC3)CC2=O)cc1 4731777 VPRQAFALQBRLEN-QGZVFWFLSA-N 385.508 2.501 0 50 GFAA Cn1cc(CC(=O)N[C@@H]2CC[C@H](NC(=O)c3ccc(O)cc3)C2)c2ccccc21 1857678293 LYJGGMNQGJBKSP-MSOLQXFVSA-N 391.471 2.894 0 50 GFAA CCn1cc(-c2nnc3n2C[C@@]2(CCN(CCCc4ccccc4)C2)OC3)cn1 1857689780 LDPFLWGZVHOFMB-QFIPXVFZSA-N 392.507 2.769 0 50 GFAA Cc1cnccc1N1CCC(N2C[C@@H](COc3ccc(F)cc3)OCC2=O)CC1 1857698435 RMFDDLYSHSVVGX-FQEVSTJZSA-N 399.466 2.804 0 50 GFAA CC(C)CN1CCC2(CC1)OCCc1sc(C(=O)NCCCCO)cc12 1857703733 QPIMEWACJJQADO-UHFFFAOYSA-N 380.554 2.770 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N[C@H]1CC(=O)Nc2ccccc21 1857713769 NCKFCIZEWWSYPI-AWEZNQCLSA-N 379.445 2.976 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4cc(C)no4)C[C@]34CC[C@H]2O4)cc1 1857716503 BFEAWEQTDQYERX-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA CN(C)Cc1ccc(N2CCN(C(=O)NCc3cc4ccccc4o3)CC2)nc1 114589566 MFKKURMNYFCRGM-UHFFFAOYSA-N 393.491 2.921 0 50 GFAA COc1cccc(C2(NC(=O)c3nn(C)c(C)c3Cl)CCOCC2)c1F 421541623 BLEKTRZACAQJTD-UHFFFAOYSA-N 381.835 2.965 0 50 GFAA COC(=O)c1ccc(-c2nc(CN3CCO[C@@H]([C@H]4CCCO4)C3)cs2)cc1 247461504 UKHFRUPNCNPJJH-QZTJIDSGSA-N 388.489 2.977 0 50 GFAA O=C(c1cnc(OCC(F)F)cn1)N1CCC[C@H](c2cc(O)cc(F)c2)C1 1875299417 KDYJNIKINDTBPC-NSHDSACASA-N 381.354 2.985 0 50 GFAA C[C@H]1CC(CO)(CO)CN1C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)F 1875297054 ASCMVCZTYZPNLJ-GWCFXTLKSA-N 396.356 2.786 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)c3ccc([S@](C)(=N)=O)cc3)cn2)C[C@@H](C)O1 1875292225 AQMOVRHZEHQMIG-QOHXFFFDSA-N 388.493 2.983 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)Cc2coc3cc(F)ccc23)N(c2cc(C)ncn2)C1 1875392048 QSISQBNYDKQKNK-IRXDYDNUSA-N 398.438 2.623 0 50 GFAA CCc1nc[nH]c1C(=O)N1CCN(C(=O)c2ccccc2COC)CC12CCC2 1775997629 MWBORSDYETZTHK-UHFFFAOYSA-N 396.491 2.639 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)c2ccc3nc[nH]c3c2)CCCCN1 2100533625 BGMPKTXVDXUHHW-SFHVURJKSA-N 397.523 2.550 0 50 GFAA COc1ccccc1-c1cnn2c(NCCCN3CCOCC3)cc(C)nc12 20565764 LNLITBWHLWQDHZ-UHFFFAOYSA-N 381.480 2.848 0 50 GFAA Cc1cc(=O)oc2cc(N(C)S(=O)(=O)c3ccc(C(=O)O)s3)ccc12 2325731830 JEYRJUUJLKXSCU-UHFFFAOYSA-N 379.415 2.686 0 50 GFAA O=C(Nc1cccc(Br)c1F)c1csc([C@H]2CNCCO2)n1 2325865674 LVSTWYQGNDQDAN-LLVKDONJSA-N 386.246 2.958 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1OC 893017 OEGJQYHOZDWRNA-UHFFFAOYSA-N 388.851 2.955 0 50 GFAA Cn1nc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)c2c(Cl)cccc21 2356139283 VPVQCHVSNPNRAJ-UHFFFAOYSA-N 377.853 2.811 0 50 GFAA Cn1ccc2c(C(=O)N3CC[C@@H](O)[C@](Cc4ccccc4)(C(=O)O)C3)cccc21 2356141469 CMTJQFDZLBVELH-NFBKMPQASA-N 392.455 2.699 0 50 GFAA CCc1ccccc1NC(=O)c1nnn(CC(=O)Nc2cccc(C)c2)c1N 4077464 IKDNOGUPVIZGKI-UHFFFAOYSA-N 378.436 2.622 0 50 GFAA CC(=O)Oc1ccccc1-c1nc2s/c(=C/c3ccc(Cl)cc3)c(=O)n2n1 4803635 ZLRHIXLTPZWQQZ-MHWRWJLKSA-N 397.843 2.944 0 50 GFAA COC1(c2nc(C3CCOCC3)no2)CCN(Cc2cnc(C)s2)CC1 225839103 CYYOYFZKFVVBNP-UHFFFAOYSA-N 378.498 2.866 0 50 GFAA Cc1noc([C@@H](C)N2CCN(C(=O)NCc3nc(C(C)(C)C)cs3)CC2)n1 111858278 CIPAOHKHUQVMQP-GFCCVEGCSA-N 392.529 2.720 0 50 GFAA CCC(=O)N[C@@H](c1nnc2n1CCN(Cc1ccc(F)cc1F)CC2)C(C)C 20452674 HTJKAAHMMXVLQB-LJQANCHMSA-N 391.466 2.838 0 50 GFAA Cc1cc(N2CCCCC2)nc(NCCNC(=O)c2ccc(F)cc2F)n1 67620712 KYNXNGUSBRDFBD-UHFFFAOYSA-N 375.423 2.895 0 50 GFAA COc1ccc([C@@H](C)NC(=O)c2cccc(N(C)S(C)(=O)=O)c2C)cc1 65363738 HDQAGGYQUWZQCM-CQSZACIVSA-N 376.478 2.890 0 50 GFAA COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(C)Cc1ccc([C@@H]2C[C@H]2C)o1 248029199 SSWIKTDWZHDCGS-YSGRDPCXSA-N 396.487 2.961 0 50 GFAA CC[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CCN1CCOC 253418195 WPDPGTZEEMNHMF-CYBMUJFWSA-N 394.459 2.656 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(N2CCO[C@H](c3nccs3)C2)n1 328635676 NOQDKIZJQYWXJJ-VYDXJSESSA-N 389.525 3.127 0 50 GFAA O=C(O)c1ccc(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)s1 261920614 KMHKUMAKILVPJI-UHFFFAOYSA-N 386.473 2.800 0 50 GFAA CC(C)N1CCNC(=O)[C@@H]1CC(=O)NCc1csc2ccc(Cl)cc12 72154349 PKZPKXGNGBYPFL-HNNXBMFYSA-N 379.913 2.770 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Cc4ccc(Cl)cc4)CC3)nn2)n1 72437446 VLDCZPIRCMAYGC-UHFFFAOYSA-N 396.882 2.515 0 50 GFAA N=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(Br)cc1Cl 136160563 GFJYYUBZPNOMNJ-NXEZZACHSA-N 381.704 2.756 0 50 GFAA CCc1nc(CN2CCN(C(=O)CCc3c[nH]c4ccc(C)cc34)CC2)no1 174705743 NTCCPPWMHTYRDY-UHFFFAOYSA-N 381.480 2.699 0 50 GFAA COCCN1CCN(C(=O)c2cc(COc3ccc4c(c3)CCCC4)on2)CC1 19836140 MLKCRNOUMDRIJR-UHFFFAOYSA-N 399.491 2.537 0 50 GFAA CC(C)(C)c1oc(C(N)=O)cc1CN1C[C@H]2CC[C@@H]1CN(c1ncccn1)C2 95371830 XJHQOKYCHUGIHV-GDBMZVCRSA-N 383.496 2.567 0 50 GFAA O=C1CCC2(CCN(c3nnc4ccccn34)CC2)CN1CCc1ccccn1 95379129 BWRPMQJHGNTRMD-UHFFFAOYSA-N 390.491 2.576 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 178367815 FOXYKMJGJRFRJS-INIZCTEOSA-N 399.516 2.755 0 50 GFAA O=C(COc1ccc(F)cc1)NCc1cc2n(n1)CCN(C1CCCCC1)C2 92028490 LWOCWVALTYBOLJ-UHFFFAOYSA-N 386.471 2.866 0 50 GFAA COc1ccc(CCN2CCC(CN(C)Cc3nc4ncccn4n3)CC2)cc1 95523783 DKTPZLKCPDVHQP-UHFFFAOYSA-N 394.523 2.519 0 50 GFAA CCn1ccnc1C1CCN(C(=O)CN2C[C@@H](c3ccccc3)CC2=O)CC1 91677539 IJBBOFDWAALECS-IBGZPJMESA-N 380.492 2.625 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c(C)o1 95529069 WPVGDDORHQAMSF-UHFFFAOYSA-N 382.464 2.546 0 50 GFAA Cc1cc(N2CCC(NCc3noc(C)n3)CC2)nc(-c2ccccc2O)n1 95531587 DZMMDBIWRGTBIP-UHFFFAOYSA-N 380.452 2.608 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cccc(-n3cc(Br)cn3)c2)C1 299745262 XGOXQIZVAVKMPM-GFCCVEGCSA-N 378.226 2.572 0 50 GFAA O=C(NCc1cc(F)cc(F)c1)c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2 263615568 DBPNWMBIYCMOIJ-QGZVFWFLSA-N 388.349 2.897 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4ccccc4F)c3CO2)cc1 263619053 WQNLCAODJWRYDR-SFHVURJKSA-N 382.395 2.627 0 50 GFAA CCn1ncc(C(=O)NC)c1NC(=O)[C@@H](c1ccc(F)cc1)N1CCCCC1 1940196094 KACPJJBYTLWJIQ-QGZVFWFLSA-N 387.459 2.567 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CCCN(C(=O)c2ccco2)C1 586080192 LAPZZGWVAQXWHK-ZDUSSCGKSA-N 398.868 2.525 0 50 GFAA CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc2ccccc2c(=O)s1 823832145 NJVKPSRGDXZRLX-KRWDZBQOSA-N 378.453 2.575 0 50 GFAA biogenic O=C(N[C@H]1CC2(CCCCC2)Oc2ccccc21)N1CCS(=O)(=O)CC1 584891754 IOEOFZVBARMQRQ-INIZCTEOSA-N 378.494 2.653 0 50 GFAA COc1ccc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)cc1OCc1cccc(C)c1 1529133771 BIWKWFQBQORTTN-OALUTQOASA-N 385.460 2.850 0 50 GFAA COCCN(CCOc1ccccc1F)C(=O)c1scc2c1OCCO2 952990066 JYWKDEAXVJQHNX-UHFFFAOYSA-N 381.425 2.826 0 50 GFAA CCC(CC)(CNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1)C(=O)O 170066855 FJVIJUGSNNCVNH-GDBMZVCRSA-N 380.872 2.867 0 50 GFAA C[C@H]1CN(C(=O)Nc2ccnn2Cc2ccc(F)cc2)CC2(CCOCC2)O1 279536732 LLMHKDVEDVKABX-HNNXBMFYSA-N 388.443 2.872 0 50 GFAA Cn1ccnc1Sc1ccc(NC(=O)[C@H]2CC23CCS(=O)(=O)CC3)cc1 188122158 AWCSWNONXWHOTC-OAHLLOKOSA-N 391.518 2.725 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3oc(COc4ccccc4)cc3C)C[C@@H]2O)n[nH]1 1704308440 RPQMRANEFLLPFQ-UZLBHIALSA-N 395.459 2.874 0 50 GFAA Cc1no[n+]([O-])c1COc1ccccc1/C=C1\N=C(c2ccccc2)OC1=O 1208644 JKLSLYZDCWBMQS-WJDWOHSUSA-N 377.356 2.540 0 50 GFAA COc1cccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2cc(OC)ccc2OC)c1 909916 FTQLJJVFTDMHST-IBGZPJMESA-N 397.431 2.979 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3C[C@@H]4COCC[C@]4(C(=O)O)C3)c2)cc1 1772701532 MPOICCOHXXMAEK-GCJKJVERSA-N 381.428 2.926 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CC[C@H](O)C[C@@H]2C2CC2)c2ccccc12 1772815011 GUKBYYWOQNQYLF-HNAYVOBHSA-N 388.489 2.722 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(C)C[C@H]2CCCCN2C)no1 12434436 IAGGBLQJCXTKCE-MRXNPFEDSA-N 381.480 2.937 0 50 GFAA Cc1noc(-c2cn([C@@H]3CCN(C(=O)c4cc(F)ccc4Cl)C3)nn2)n1 169777916 NGDYIOQVHSWYJB-LLVKDONJSA-N 376.779 2.516 0 50 GFAA CCOc1ccc(S(=O)(=O)NCCc2ccc(OC)c(OC)c2)cc1C 4854206 NGCNVXJADPJJNG-UHFFFAOYSA-N 379.478 2.932 0 50 GFAA O=C(NCCN1CCc2ccccc21)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2 1857676477 OHQXWQRTOUFCEV-BGWNEDDSSA-N 375.516 2.919 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4c(F)cccc4Cl)[C@@H]2CC(=O)N13 1857708072 STLRPRMGTYCSDH-FCEWJHQRSA-N 380.847 2.606 0 50 GFAA Cc1nn(C)c(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c1C 1857727059 KBQNBQPEGQUIPE-OKZBNKHCSA-N 388.899 2.635 0 50 GFAA O=S(=O)(C[C@H]1CCCCO1)Nc1ccc(-c2nnc3n2CCCC3)cc1 150859329 IKFZPKSXNZCXMA-MRXNPFEDSA-N 376.482 2.592 0 50 GFAA Cn1cc(C[C@@H]2CCN(C(=O)CNC(=O)c3ccc(C(C)(C)C)cc3)C2)cn1 363591473 YSMVBBHHARPKHV-INIZCTEOSA-N 382.508 2.539 0 50 GFAA CC[C@](NC(=O)C1CCN(C(=O)N(C)C)CC1)(C(=O)O)c1ccc(Cl)cc1 262667918 PSGODSDLQRAFNJ-LJQANCHMSA-N 395.887 2.540 0 50 GFAA Cc1ccccc1CN(C)C(=O)CN1C(=O)O[C@]2(CCc3ccccc32)C1=O 810014613 MZOCIJWKCYTYCD-QFIPXVFZSA-N 378.428 2.774 0 50 GFAA O=C(N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21)C1(n2cc(Br)cn2)CC1 826574789 DXHOWKAIZXEULM-SOUVJXGZSA-N 376.229 2.728 0 50 GFAA CC1(C)CCCc2c(N3CCC[C@H](n4cc(CO)nn4)C3)nc(Cl)nc21 848712414 JGRVZRREZDWSKE-ZDUSSCGKSA-N 376.892 2.669 0 50 GFAA Cc1cccc([C@H](CNC(=O)[C@H]2CCCC23CCNCC3)N2CCOCC2)c1 1875277117 IUTCGYYBVDAXGL-RTWAWAEBSA-N 385.552 2.654 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)CN1CCC2(CC1)C[C@@H](N)c1ccccc1O2 1875284268 UKFXSZNZWNWELV-RBBKRZOGSA-N 395.547 2.796 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2csc([C@@H]3CCCNC3)n2)C[C@H]1c1ccccc1 1875279875 JJLXHWFPIGOHQH-OWCLPIDISA-N 385.489 2.551 0 50 GFAA O=C(N[C@H](CNC(=O)C1SCCCS1)C1CCCC1)c1ccncc1F 1875347417 OMBSVRGGINJBSO-OAHLLOKOSA-N 397.541 2.822 0 50 GFAA CC(C)Oc1cccc(OCCN2CC[C@@H](O)[C@](CC3CC3)(C(=O)O)C2)c1 2100557145 OASXDMQCRFNPMI-TZIWHRDSSA-N 377.481 2.790 0 50 GFAA Cc1c(-c2nc(-c3ccc(Br)s3)no2)nnn1[C@H]1CCNC1 2325756074 SZKUATGWAWFDIH-QMMMGPOBSA-N 381.259 2.662 0 50 GFAA O=C(c1ccncc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2Cc2ccncc2)C1 2325794602 JWHOOCRWEOCCNR-UXHICEINSA-N 378.476 2.563 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)NC[C@H]3NCCc4sccc43)cc2n1 2325810663 WSNGFKVPJZOWGK-GFCCVEGCSA-N 395.410 2.735 0 50 GFAA O=S(=O)(Nc1ncccn1)c1ccc(Nc2ncnc3ccccc23)cc1 791325 VFDVQSPEAOHSPY-UHFFFAOYSA-N 378.417 2.964 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccc(SC)c2)S(C)(=O)=O)cc1 1115936 OGNRZEJSWOCNDO-UHFFFAOYSA-N 380.491 2.822 0 50 GFAA CN(C)c1ccc(-c2ccnc(N3CCC(N4CCC(O)CC4)CC3)n2)cc1 2356164269 MMBPXJLRHATHRI-UHFFFAOYSA-N 381.524 2.635 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N[C@@H]3CCCN(c4ncccn4)C3)cc2)c1C 2356170097 UURIXNABKRWPRY-LJQANCHMSA-N 388.475 2.949 0 50 GFAA Cc1ccc(C2=NS(=O)(=O)N(C)C(C(=O)N3[C@@H](C)CCC[C@H]3C)=C2)cc1 20366856 NCCNEAOVYUYEEH-GASCZTMLSA-N 375.494 2.648 0 50 GFAA CCOC(=O)c1cccc(NC(=O)C2CCN(C(=O)N(CC)CC)CC2)c1 56183150 FMMWBJJOQYQPCL-UHFFFAOYSA-N 375.469 2.976 0 50 GFAA CC[C@H](C(=O)NCc1ccccn1)N(c1cc(C)ccc1C)S(C)(=O)=O 65364745 BDQWCKDSPWSWFL-QGZVFWFLSA-N 375.494 2.559 0 50 GFAA O=c1[nH]c(-c2ccc(CN3CCN(c4ccccn4)CC3)cc2)nc2c1CCC2 20992469 DHTMXBOTAYYTTK-UHFFFAOYSA-N 387.487 2.643 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC[C@@](CO)(CCOc3ccccc3)C2)nn1 67886317 PTWBVGATQPUCCA-JOCHJYFZSA-N 393.491 2.925 0 50 GFAA COCCNC(=O)c1cccc(OC2CCN([C@@H](C)Cc3ccccn3)CC2)c1 11821018 UQMBUEJXQMMGCI-SFHVURJKSA-N 397.519 2.932 0 50 GFAA CCc1ccccc1CN1CCC(N2CCC[C@H](C(=O)NCCOC)C2)CC1 67855797 MICNIXVVKDMLAZ-NRFANRHFSA-N 387.568 2.688 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN(C)CCC(C)(C)O)C2=O)cc1 67675544 QBXVJHMFZRSDBP-JOCHJYFZSA-N 376.541 2.756 0 50 GFAA O=C(Nc1cnn(C[C@@H]2CCCCN2C(=O)c2ccncc2)c1)c1ccncc1 252504539 VJYFODHCOMZRDU-IBGZPJMESA-N 390.447 2.620 0 50 GFAA COC(=O)c1ccn(CSc2nc3ccccc3c(=O)n2Cc2ccco2)n1 2800350 ZOJQDRFLPUWATM-UHFFFAOYSA-N 396.428 2.771 0 50 GFAA COc1ccc(-c2ncc(CN3CCCn4nc([C@@H](C)O)cc4C3)cn2)cc1 219497677 OBMNLSCLJHSGJJ-OAHLLOKOSA-N 379.464 2.808 0 50 GFAA Cn1cc(NC(=O)CN2CCC[C@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)cn1 71615097 MYEXDBSMIYDYFL-AWEZNQCLSA-N 394.397 2.972 0 50 GFAA CC(C)(C)OC(=O)N1CCC(OC[C@@H](O)CN2CCc3ccccc3C2)CC1 219738711 UUOQXUZXSPUQJL-IBGZPJMESA-N 390.524 2.822 0 50 GFAA CN(C)S(=O)(=O)c1ccc2oc(SC[C@@H]3CC4(CCC4)C(=O)O3)nc2c1 253431655 SQAHBFQHWZWIQA-NSHDSACASA-N 396.490 2.656 0 50 GFAA COc1ccc(-n2ccnc2[C@H]2CCOC(C)(C)C2)cc1NS(C)(=O)=O 77302806 RLPADMNAPKFRJX-ZDUSSCGKSA-N 379.482 2.925 0 50 GFAA CO[C@@]1(C)CCCN(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)CC1 281126366 UTFLYKUHNHTUGZ-SFHVURJKSA-N 398.529 2.581 0 50 GFAA Cc1ccc(C(=O)N2CCc3[nH]c(-c4ccc(C(=O)O)cc4)nc3C2)c(O)c1 219467930 FDCZMFNQCZNZJJ-UHFFFAOYSA-N 377.400 2.987 0 50 GFAA Cc1cccn2cc(CNC(=O)[C@@H]3CCCN(C(=O)Cc4ccccc4)C3)nc12 363396827 YTIBZILXAOPBCJ-LJQANCHMSA-N 390.487 2.740 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)NCCc3nc4ccccc4c(=O)[nH]3)cc2)n1 77321822 QOQSMAUDWACLNY-UHFFFAOYSA-N 387.443 2.698 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](CNC(=O)c3cnn(C(C)(C)C)c3)C2)c1 157530014 HYTKTAPSOOSVDG-OAHLLOKOSA-N 386.496 2.912 0 50 GFAA O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CCC[C@](O)(CO)CC1 72171260 UCUCPQZRWWTANY-JOCHJYFZSA-N 377.444 2.646 0 50 GFAA CCOCCn1c(=O)[nH]c2cc(C(=O)NCc3ccc(F)cc3F)ccc21 77504376 SJVYNERXIZJNEQ-UHFFFAOYSA-N 375.375 2.574 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 226392748 MOOIWKWMSIFBDR-UOVPBQLFSA-N 376.884 2.731 0 50 GFAA CNC(=O)c1cccnc1N1CC[C@@]2(CCCN(CCc3ccccc3)C2)C1 426661984 HRYGSJMEIPIUCT-HSZRJFAPSA-N 378.520 2.976 0 50 GFAA CN(C)c1cc(CNC(=O)c2ccc(N3CCCC3)nn2)c2ccccc2n1 175611084 DMMAEDPWCWDISA-UHFFFAOYSA-N 376.464 2.621 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1Cc2ccccc2[C@H](O)C1 82126083 CIIMSADNCKBTHY-MRXNPFEDSA-N 382.445 2.690 0 50 GFAA Cc1nc2c(c(N3CCN(C4CCCC4)C(=O)C3)n1)Cc1ccccc1OC2 95511850 VDFCLHFSOVRJGI-UHFFFAOYSA-N 378.476 2.859 0 50 GFAA CN1C(=O)C[C@H](C(=O)O)C12CCN(Cc1ccc(OC3CCCC3)cc1)CC2 95363274 WAQQSKCWIUWAMV-LJQANCHMSA-N 386.492 2.906 0 50 GFAA Cc1nc(C2CC2)ncc1C(=O)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 95359713 XZVBHJGMALSLOS-WMLDXEAASA-N 383.521 2.856 0 50 GFAA CC(=O)c1ccc(N2CCN([C@@H](C(=O)O)c3cccc4c3OCC4)CC2)cc1 95374888 NGHPUMOMNHCRJI-HXUWFJFHSA-N 380.444 2.772 0 50 GFAA CCN1CC2(CCN(C(=O)c3cnccn3)CC2)C[C@@H](c2ccccc2)C1=O 91893620 HMPGBVDGQJGIHL-SFHVURJKSA-N 378.476 2.735 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCn3nc(Cc4ccccc4)cc3C2)c1C 97819504 ZIMWLRHAIMSTLB-UHFFFAOYSA-N 391.475 2.532 0 50 GFAA CCCOc1ccc(C(=O)N2CCN(Cc3noc(C)n3)CC2)cc1Cl 244778593 PTIWGQIDXBOCHZ-UHFFFAOYSA-N 378.860 2.778 0 50 GFAA O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)[C@H]1C[C@@H](O)CN1 299749641 LCSFQADFZPXQBS-OWDMVUQNSA-N 383.879 2.792 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)N1CCC[C@@H](Cn2ccnc2)C1 534669360 YRSVLJZHSHHFFY-SFHVURJKSA-N 394.479 2.521 0 50 GFAA CCCn1ccnc1CNC(=O)N1CCN(c2nc3ccccc3s2)CC1 534649825 GVFKULGJTXFHHB-UHFFFAOYSA-N 384.509 2.935 0 50 GFAA CCn1cc(C(=O)NC[C@@H]2CCCN(Cc3ccc(NC(C)=O)cc3)C2)cn1 823602200 XQKDSKYEHNKHFM-SFHVURJKSA-N 383.496 2.503 0 50 GFAA Cc1nn2cc(CNC(=O)[C@H]3CC(=O)N(c4ccc(C(C)C)cc4)C3)nc2s1 827696371 KJLQHYXFTNHOLO-HNNXBMFYSA-N 397.504 2.892 0 50 GFAA C[C@H](Oc1ccccc1CN1CCN(c2ccc(Cl)cn2)CC1)C(=O)O 825563763 BGYANFFBYGINNL-AWEZNQCLSA-N 375.856 2.909 0 50 GFAA Cc1cccc(S(=O)(=O)N2CCC[C@]3(C4=CCOCC4)COCC[C@@H]23)c1 1076086955 VMOYWMLPDBEKOY-WOJBJXKFSA-N 377.506 2.902 0 50 GFAA O=C(c1cccnc1N1CCOCC1)N1CCC([C@H](O)c2ccc(F)cc2)CC1 170995174 SDNYXJJYLKCXND-HXUWFJFHSA-N 399.466 2.643 0 50 GFAA O=C1CN(C(=O)[C@H]2CCCc3c(O)cccc32)CCN1Cc1cccc(F)c1 190496373 QXBPKPKLZCOMMH-IBGZPJMESA-N 382.435 2.822 0 50 GFAA CNS(=O)(=O)c1cc(NC(=O)Nc2cc(C3CCCC3)[nH]n2)ccc1C 192206215 UPARKVWOGGJODK-UHFFFAOYSA-N 377.470 2.928 0 50 GFAA CNC(=O)[C@H]1CC[C@H](CNS(=O)(=O)c2cc(C)c(F)cc2Cl)CC1 1506427621 YBBSDNCPANAOMR-HAQNSBGRSA-N 376.881 2.618 0 50 GFAA COc1ccnc(N2CCC[C@@H](CNC(=O)Cc3cn(C)c4ccccc34)C2)n1 1506423865 GPRZTSMAXDWBSX-INIZCTEOSA-N 393.491 2.552 0 50 GFAA CCOc1ccccc1CN(CC)C(=O)[C@H]1OCC(=O)N[C@@H]1c1ccccc1 1529186461 FIKSRSYZQXGNSW-RTWAWAEBSA-N 382.460 2.690 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1 1704352546 VJNBUCCHLTXNSX-UYAOXDASSA-N 377.444 2.961 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)NCCCn1ccnc1)C2 1772818413 SERSGCZJDKNNTQ-CQSZACIVSA-N 385.493 2.923 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)NCCCCc2ccccn2)CCC1=O 12304910 XBVQAKOWPHXBKG-LJQANCHMSA-N 395.503 2.968 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCCn1cncn1 12430202 KSPZQVFHSLPKIR-IBGZPJMESA-N 387.503 2.611 0 50 GFAA COc1ccc(OC)c(CC(=O)NC[C@@H]2CC(Cc3ccc(F)cc3)=NO2)c1 12454923 QPVUGONXYLVDGN-IBGZPJMESA-N 386.423 2.889 0 50 GFAA O=C(CCC(F)(F)F)N[C@@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 12465584 YYDAJLNVWWQKGH-CQSZACIVSA-N 386.418 2.521 0 50 GFAA COc1cc(OC)cc(-c2n[nH]c(SCC(=O)Nc3nccs3)n2)c1 6603390 ZISZMSUIKMPGAD-UHFFFAOYSA-N 377.451 2.676 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1 4839007 BMBGTBNRQFCAKN-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA Cc1ccnc(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)n1 6728447 VYUZGFHUHBOZEJ-SECBINFHSA-N 376.507 2.801 0 50 GFAA C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C[C@@H]1C(=O)O 1857529983 RWBHCNVTBCDYMT-NZVBXONLSA-N 399.274 2.777 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)CCc2ccc3c(c2)OCO3)[C@H]1c1ccccc1 1857702234 FQVJFZSPCBJAMY-GMAHTHKFSA-N 396.487 2.878 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2cccc(Cn3nc(C)cc3C)c2)CC[C@@H]1O 1857716854 HJIDNHXCQYRMNO-UNMCSNQZSA-N 385.508 2.534 0 50 GFAA CC(C)c1nnc([C@H]2CN(S(=O)(=O)C[C@@H](C)c3ccccc3)CCO2)o1 328626323 LOFROOKBNOLEMB-GDBMZVCRSA-N 379.482 2.700 0 50 GFAA CCOc1cccnc1S(=O)(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 1875298852 POMMTFGNTIUJHN-WMZOPIPTSA-N 376.478 2.927 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccccn1)N1CCC(S(=O)(=O)c2ccc(F)cc2)CC1 1875297785 DAGZZIYDVGZCDS-QZTJIDSGSA-N 388.464 2.789 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CC[C@@H](C)S(=O)(=O)C1 888101721 PUWPKNSJQAWATC-VUHPKUFZSA-N 394.537 2.950 0 50 GFAA O=C(c1ccccc1)N1CC[C@H]2[C@@H](C1)NC(=O)N2C1CCN(CC2CCC2)CC1 888103352 DQALKEGMDOSCTN-RTWAWAEBSA-N 396.535 2.559 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H](C)Cc2cccc(Br)c2)CC1 1776004448 RVBBUTJRLHIDHQ-CYBMUJFWSA-N 379.298 2.921 0 50 GFAA Cc1ccc2ncc(C(=O)N3CCC4(CC3)CNCc3ccccc3O4)n2c1 2325789491 SXVQBSHSXAGAPK-UHFFFAOYSA-N 376.460 2.800 0 50 GFAA Cc1ccn(C)c1C(=O)N(C)C[C@@H](C)NC(=O)[C@@H](C)OCc1ccc(F)cc1 2325793414 STXJWKOLDFBYHQ-HZPDHXFCSA-N 389.471 2.655 0 50 GFAA CC(C)c1nocc1C(=O)N1C[C@H](C)[C@H](NC(=O)COCC2CCCC2)C1 2325793689 DIEPXXJTIDXFTQ-WMLDXEAASA-N 377.485 2.582 0 50 GFAA O=C(O)CCC(=O)N1CCN(c2ccc(C(=O)c3ccc(F)cc3)cc2)CC1 1070866 IQXAVFVMIUTGOU-UHFFFAOYSA-N 384.407 2.570 0 50 GFAA CCn1c(S[C@@H](C)C(=O)Nc2nnc(C)s2)nnc1-c1ccncc1 4736476 GOTKVRIWPARAJE-VIFPVBQESA-N 375.483 2.639 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc(F)cc(F)c3)C[C@H]2CCO)CC1 104433401 NEJYZWOJSPXBTE-OAQYLSRUSA-N 381.511 2.706 0 50 GFAA Cc1nc2ncccn2c1C(=O)Nc1cc(C(N)=O)ccc1N1CCC[C@@H](C)C1 55100212 FREWLTUNLLPVRH-CYBMUJFWSA-N 392.463 2.625 0 50 GFAA COc1cc(OC)cc([C@@H]2CC(c3ccccc3OC)=NN2S(C)(=O)=O)c1 225495827 OILFGJPGDLQGQR-SFHVURJKSA-N 390.461 2.823 0 50 GFAA CSc1nc(-c2ccco2)nc(C)c1C(=O)N1CC[S@@](=O)C[C@H](C)C1 225460871 PTPLDUYCFQSIFC-SSINHNECSA-N 379.507 2.608 0 50 GFAA O=C(c1cc(Cc2ccccc2)ccc1O)N1CCO[C@@H](Cn2cccn2)C1 111650093 YKKNEXYAEAMDNU-LJQANCHMSA-N 377.444 2.721 0 50 GFAA COCCN(Cc1sccc1C)C(=O)[C@@H](c1cccnc1)N1CCOCC1 65504052 BFLIABFGBPXQSP-LJQANCHMSA-N 389.521 2.500 0 50 GFAA CCOC(=O)c1cc(C2CC2)nc2c1c(=O)n(Cc1cccc(C)c1)c(=O)n2C 12410796 FRHUNVNAIDZHQH-UHFFFAOYSA-N 393.443 2.506 0 50 GFAA CCOC(=O)c1c(-c2ccc(F)cc2)nc(N(C)S(C)(=O)=O)nc1C(C)C 22058938 TYISRAUZBAYPKG-UHFFFAOYSA-N 395.456 2.979 0 50 GFAA COc1ccnc(N2CCN(C(=O)Nc3cccc(Cl)c3N(C)C)CC2)n1 171522447 OMFAENDTQYEIAS-UHFFFAOYSA-N 390.875 2.559 0 50 GFAA O=C(NC1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)c1ccccc1 1406183 FVFOMMLQRWLQFX-UHFFFAOYSA-N 378.881 2.923 0 50 GFAA Cn1nccc1C(=O)NCCCn1nc(C(F)(F)F)c(Cl)c1C1CC1 2780785 UIFLTNKYJWNWEA-UHFFFAOYSA-N 375.782 2.986 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@]1(O)CCc2ccccc21 123596582 CNKFSIQMHBBEKQ-OAQYLSRUSA-N 380.423 2.645 0 50 GFAA COc1ccc(C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1N1CCNC1=O 363566320 QDCIWAVLJBBMLQ-UHFFFAOYSA-N 393.403 2.836 0 50 GFAA CC(C)n1nnnc1-c1ccc(NC(=O)N[C@H]2CCCc3nn(C)cc32)cc1F 367219944 PIHIZLJPZHMGGF-INIZCTEOSA-N 398.446 2.993 0 50 GFAA NC(=O)[C@@H]1CCC[C@H](NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 172442308 YTZWMQNIYYKSGR-CABCVRRESA-N 395.438 2.576 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)N1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1 71760735 LZVBBQZLKCLPHR-LJQANCHMSA-N 390.443 2.574 0 50 GFAA O=C(c1cn(C2CCCCC2)nn1)N1CCc2[nH]cnc2[C@@H]1c1ccncc1 72133651 FFJPKTIMJFIABA-IBGZPJMESA-N 377.452 2.689 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1 77538086 GSQXJMGFDQIGIJ-UHFFFAOYSA-N 379.526 2.539 0 50 GFAA Cn1nccc1NC(=O)Cn1ccc(-c2cnn(-c3cccc(Cl)c3)c2)n1 48170684 YJJCZSJTJMOLDB-UHFFFAOYSA-N 381.827 2.761 0 50 GFAA Cc1nsc(N2CCCN(C(=O)c3cc(-c4csc(C)n4)c[nH]3)CC2)n1 173364047 JSHNAENJMPYCLX-UHFFFAOYSA-N 388.522 2.959 0 50 GFAA COc1cc(Br)c(CNCCNc2ccc(C)nn2)c(OC)c1 242183874 XCQUGGLOPAYRDN-UHFFFAOYSA-N 381.274 2.766 0 50 GFAA CCO[C@@H]1COCC[C@H]1NC(=O)c1cc2c(C(F)(F)F)nn(C)c2s1 223338397 IZMPTBJLICXICM-NXEZZACHSA-N 377.388 2.577 0 50 GFAA COc1cc(-c2cn(Cc3ccccc3-n3ccnc3)nn2)cc2c1OCO2 82096727 AVPTXEWFFCKALV-UHFFFAOYSA-N 375.388 2.916 0 50 GFAA CCn1cc([C@@H]2C(C(=O)Nc3ccccc3OC)=C(C)Nc3ncnn32)c(C)n1 20607173 PULVLYJCOVZCJE-GOSISDBHSA-N 393.451 2.739 0 50 GFAA O=C(c1cc[nH]c1)N1CCC2(CCN(CCc3ccccc3)CC2)[C@@H](CO)C1 97447094 KDQDYTUXGZXKKG-OAQYLSRUSA-N 381.520 2.794 0 50 GFAA COCC(=O)N1CCC(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1 91519387 FKICHMVWFNXAKW-OAQYLSRUSA-N 380.488 2.972 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCO[C@H](c3cccc(O)c3)C2)[C@@H]1c1ccccc1 178623594 YMJNARBXMPBTHD-ONTIZHBOSA-N 394.471 2.902 0 50 GFAA O=C(O)[C@H]1Cc2[nH]cnc2CN1C(=O)CC(c1ccccc1)c1ccccc1 96167035 CHSBTFHWTXJOQL-HXUWFJFHSA-N 375.428 2.970 0 50 GFAA CCc1ocnc1C(=O)N1C[C@@H](c2ccc(OC)cc2)[C@@H]2[C@H]1C1CCN2CC1 95388627 VJSJQDKZXVWBNL-IOMROCGXSA-N 381.476 2.948 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@H]1CCS(=O)(=O)C1)c1ccccc1 334158349 INIPDONOVXROOX-KRWDZBQOSA-N 381.457 2.584 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1CCc2[nH]c(-c3ccccc3)nc2C1 95500157 INWCLYUXISXXJS-UHFFFAOYSA-N 384.439 2.977 0 50 GFAA COc1cccc(CN(CC(=O)Nc2nc(C)c(C(=O)O)s2)C2CC2)c1 252484370 FUWLZNRWSUFAQB-UHFFFAOYSA-N 375.450 2.761 0 50 GFAA CO[C@@H]1CCCO[C@@H]1O[C@@H]1[C@H](OC)CO[C@@H](Sc2ccccc2)[C@@H]1OC 257357707 PMVNXXXRJLDLRS-UPGMHYFXSA-N 384.494 2.702 0 50 GFAA O=C(O)C[C@@H](NC(=O)C[C@H]1Sc2ccccc2NC1=O)c1cccs1 299742025 ARZAVMYCRNZMNR-BXUZGUMPSA-N 376.459 2.883 0 50 GFAA CCOCCN1CCC[C@@]2(CCCN(C(=O)c3ccc4nc[nH]c4c3)[C@@H]2C)C1=O 1940196158 OQJYGNONARYQLK-ZHRRBRCNSA-N 398.507 2.833 0 50 GFAA Cc1nnc(Cc2ccc(NC(=O)N3CCC[C@H](c4ccncn4)C3)cc2)[nH]1 299769123 NBTWQWNAYROIKF-INIZCTEOSA-N 377.452 2.905 0 50 GFAA CC[C@H](NC(=O)NC1(C(=O)NC)CCCCC1)c1ccc(OC)c(OC)c1 584895167 PNOZOBSQCKZFII-HNNXBMFYSA-N 377.485 2.903 0 50 GFAA COc1cccc([C@H]2CN(C(=O)CCC(F)(F)F)C[C@@H]2C(=O)O)c1OC 216484976 OTJLCAWZKXHDLU-NEPJUHHUSA-N 375.343 2.673 0 50 GFAA CNC(=O)c1ccn([C@H]2CCCN(C(=O)Cc3ccc4ccccc4c3)C2)n1 277926153 RRVBNBWEJGZBJX-IBGZPJMESA-N 376.460 2.802 0 50 GFAA O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21 191547099 QIHSPMIBZJDZDP-DOTOQJQBSA-N 384.407 2.844 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCCC[C@H]3CO)ncn2)CC1 192294269 PMNAVDAIHLEBRK-SFHVURJKSA-N 397.523 2.917 0 50 GFAA CC(C)(CNC(=O)NC1CCN(CC2CC2)CC1)c1ccc2c(c1)OCCO2 195203323 MFKMAGLFCAMLCD-UHFFFAOYSA-N 387.524 2.909 0 50 GFAA O=C(COc1ccc(Br)cc1Br)NC[C@@H]1CCCO1 622221 PXUXHMBUWFRXSZ-JTQLQIEISA-N 393.075 2.886 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)Cc3ccc(F)cc3F)C1)CC2 1704303451 ZFQFNTCEXVKMIX-OAQYLSRUSA-N 386.446 2.870 0 50 GFAA CC[C@@]12C[C@H]3C[C@@](O)(C1)C[C@@](C(=O)N(CCN(C)C)Cc1cnc(C)[nH]1)(C3)C2 1772700695 DCLPUMVLBJEHMP-XYEHWOGUSA-N 388.556 2.720 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CC[C@H](C(=O)NCCC(C)C)CC2)cc1 1775953538 ACNNCOGMOHSNFV-QAQDUYKDSA-N 396.553 2.942 0 50 GFAA O=C(CCC1CCN(C(=O)c2ccc3ncccc3c2)CC1)N1CCOCC1 11667821 FSKYWHUCCNSFOJ-UHFFFAOYSA-N 381.476 2.726 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCN4CCC[C@@H]4C3)no2)c(Cl)c1 12019853 AFBNWSFPSKVYLZ-CYBMUJFWSA-N 391.855 2.836 0 50 GFAA O=C1[C@@H]2C[C@@H](CN2Cc2cccn2-c2ncccn2)N1c1cccc(Cl)c1 12123043 NLPXZGHRGOBDEN-ROUUACIJSA-N 379.851 2.910 0 50 GFAA CCCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](N(C)CCc1ccccn1)C2 14543547 RGLDEABHMSVYKK-LJQANCHMSA-N 395.551 2.956 0 50 GFAA CN(Cc1ccc2ccccc2n1)C(=O)c1ccc(N2CCC[C@@H](O)C2)nc1 19811969 AAUPTVYPSNPTPW-LJQANCHMSA-N 376.460 2.863 0 50 GFAA CN1CCCN(Cc2cccc(OC[C@@H](O)CN(C)C3CCCCC3)c2)CC1 19839892 PUHCWSFNGKMXRO-QFIPXVFZSA-N 389.584 2.828 0 50 GFAA O=C(Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1)c1nc2ncccn2n1 923924 LPJBLOPBEPMVBW-UHFFFAOYSA-N 375.266 2.502 0 50 GFAA CC(C)=CCN1CCC[C@@]2(C(=O)NCCc3cccc(C)n3)CCN(C)C[C@H]12 1857676925 ZKSLYZABCPMWTJ-JTHBVZDNSA-N 384.568 2.801 0 50 GFAA O=C(Cn1cccn1)N1CCCOc2cccc(c2)CC[C@@H]2CCCCN2CC1 1857697092 VDILRWSJWKWPSC-NRFANRHFSA-N 396.535 2.982 0 50 GFAA COc1ccc([C@H]2[C@H](CO)OCCN2C(=O)c2ccc3[nH]ccc3c2)cc1OC 1857720053 BSUNLFYAIRRLRK-SFTDATJTSA-N 396.443 2.760 0 50 GFAA COC(=O)c1ccc(CN2CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1857735669 GGJOKDYYZFTBFT-MZKRTTBSSA-N 392.455 2.748 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)Cc3ccccc3)[C@H]3CC[C@]2(C1)O3 1875243647 QHUPDUDDBIKOLI-DZCCDHAISA-N 377.488 2.733 0 50 GFAA NC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)C1CC1 237892630 AWUOLYCQEQMCCF-PMACEKPBSA-N 397.906 2.761 0 50 GFAA CN(CCOc1cccc(Cl)c1)c1cc(N2CCC[C@@H](CO)C2)ncn1 246281965 ANKRQNUAGCKUIC-OAHLLOKOSA-N 376.888 2.854 0 50 GFAA CC[C@@H]1CN(C)c2ccccc2CN1C(=O)Nc1ccc(=O)n(CCOC)c1 162950509 RCTSCRIDYKBCIF-GOSISDBHSA-N 384.480 2.757 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@H](CNC(=O)c1cccc(O)n1)Cc1ccccc1 820515930 NCUWLTYTGRBYSP-INIZCTEOSA-N 385.464 2.995 0 50 GFAA O=C(c1cc(=O)cc(C(=O)N2CC(C3CCCC3)C2)[nH]1)N1CC(C2CCCC2)C1 935759664 PAJAIPSKZSFMET-UHFFFAOYSA-N 397.519 2.899 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C2CCN(C(=O)C[C@H]3CCCO3)CC2)C1 839830157 IWZJIQSYXBDOAU-KZNAEPCWSA-N 396.528 2.866 0 50 GFAA O=c1n(Cc2coc(-c3ccccc3C(F)(F)F)n2)nnn1C1CCOCC1 1875291401 XSWVODHGVGFFMA-UHFFFAOYSA-N 395.341 2.513 0 50 GFAA CN1CCC(n2nc([C@H]3CCOC3)nc2-c2n[nH]c3c2CC(F)(F)CC3)CC1 1875331382 XQVIQFZDZMQWHM-LBPRGKRZSA-N 392.454 2.563 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)N1CCC(Cc2ccccc2)CC1 1875399282 UWJPFVHCHKZHAG-PWRODBHTSA-N 382.508 2.687 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)Cc3cccc(OCCN(C)C)c3)n[nH]c21 1875393438 FLLGXKIRMUBAOQ-CABCVRRESA-N 386.496 2.645 0 50 GFAA O=C(NOCCF)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 1875319950 ZSVIGIQETTZJIH-UHFFFAOYSA-N 381.367 2.766 0 50 GFAA CCC1CCC(N(C)C(=O)C(=O)NCc2cc(OCC(F)F)ccn2)CC1 1323712268 JIYZDUOLLLDZBQ-UHFFFAOYSA-N 383.439 2.769 0 50 GFAA COC(=O)C1=CN(C[C@@H]2CCCO2)C=C(C(=O)OC)C1c1ccc(F)cc1 909475 ASQCUFZOVOTEKQ-HNNXBMFYSA-N 375.396 2.518 0 50 GFAA Cc1ccc2cccnc2c1S(=O)(=O)N1CCC(N=c2cc[nH]cc2)CC1 2325783033 VFEDILSZCRLQMR-UHFFFAOYSA-N 382.489 2.625 0 50 GFAA CC1(c2nn[nH]n2)CN(C(=O)c2ccccc2OCc2ccc(Cl)cc2)C1 2325806994 SLVDYQVAOAPIAZ-UHFFFAOYSA-N 383.839 2.846 0 50 GFAA CCc1nocc1C(=O)N1CC[C@@H]([C@@H](C)Nc2ncc(Br)cn2)C1 2325841285 MWTUZBHRWCZVPU-GHMZBOCLSA-N 394.273 2.752 0 50 GFAA CCc1ccc([C@@H](C)NC(=O)Cn2cc(-c3ccc4c(=N)[nH][nH]c4c3)nn2)cc1 2325869408 MHTAJSZZXPJWSV-CYBMUJFWSA-N 389.463 2.674 0 50 GFAA CCOc1ccc(N(CC(=O)NC2CC2)S(=O)(=O)c2ccc(C)cc2)cc1 878988 ORJIUYLHKGYIQA-UHFFFAOYSA-N 388.489 2.868 0 50 GFAA COc1ccccc1-n1cc(CN2CCC[C@]3(CCc4c[nH]c(=N)nc43)C2)cn1 2356154753 IMZRBNLIRMHUKU-QFIPXVFZSA-N 390.491 2.563 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)c1ccc3nnc([C@@H](O)C(C)C)n3c1)C2 2356165484 BEMQODAVFNWIML-IBGZPJMESA-N 380.448 2.626 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)nc(C)n1 55369302 QUZQVYHSTGLIEY-HXUWFJFHSA-N 393.535 2.829 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C[C@H]3CN(Cc4ccccc4)CCCO3)C2)no1 225421390 INPCZXPBOHDWBT-SFTDATJTSA-N 384.524 2.924 0 50 GFAA COc1cc(NC(=O)NC/C=C/CNC(=O)OC(C)(C)C)ccc1NC(C)=O 225739776 FYKGWWRXIQLWNV-VOTSOKGWSA-N 392.456 2.856 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)C1CCN(C/C=C/c2ccco2)CC1 20908136 IKIDPOIDANMVJW-HNQUOIGGSA-N 378.436 2.619 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(c2ncc(C)c(N)n2)CCO3)n1 67908543 CANLCVSRBUONKL-UHFFFAOYSA-N 378.436 2.546 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1 67817962 JEQPIVIGAPVOME-UHFFFAOYSA-N 376.464 2.701 0 50 GFAA CCN1C(=O)/C(=C\c2cnn(CC)c2)N=C1SCC(=O)NCc1ccccc1 2784534 PCKYOQXRNVOHHC-LICLKQGHSA-N 397.504 2.512 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)N[C@H](C)c2ccccc2)S(C)(=O)=O)cc1 35338751 RZTDLPNHAIPQMA-CABCVRRESA-N 376.478 2.727 0 50 GFAA Cc1ccc2nc(CN(C)C(=O)c3cn(Cc4ccccc4F)nn3)[nH]c2c1 72161033 JCNSEADKGGSNFW-UHFFFAOYSA-N 378.411 2.922 0 50 GFAA C[C@H](CCNC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[S@](C)=O 477194386 PBMHFVGDZDCTHI-DDDOEAIBSA-N 391.459 2.740 0 50 GFAA C[C@H]1CN(C(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)[C@@H]1c1ccccc1 124488256 PVGSIXUEXWGOON-BUXKBTBVSA-N 381.407 2.869 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(C(=O)CCC3CC3)CC2)C1 71747931 VYRLWXFCEYYZFE-HXUWFJFHSA-N 398.551 2.591 0 50 GFAA O=C(N1CC=C(c2ccccc2)C1)C1(S(=O)(=O)c2ccccc2)CCOCC1 368168464 SUUBUQCEBZCNPL-UHFFFAOYSA-N 397.496 2.935 0 50 GFAA CO[C@@H]1C[C@@H](c2nncn2C)N(C(=O)Nc2cn(C)nc2C2CCCCC2)C1 333354326 BRPSBQANZQMKBM-ZBFHGGJFSA-N 387.488 2.590 0 50 GFAA COc1ccc(CN2CCN(C(=O)NCc3cnc(C)cc3C)CC2)cc1F 455562726 SFWQAROMGXUWRM-UHFFFAOYSA-N 386.471 2.874 0 50 GFAA O=C(Nc1ccc(O)c(F)c1F)C1CCN(S(=O)(=O)c2ccccc2)CC1 456792296 IUJOPDOYJJVDGP-UHFFFAOYSA-N 396.415 2.710 0 50 GFAA O=C(O)CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc2c(c1)OCC(=O)N2 263500749 SUWVPTKSNMINOP-CQSZACIVSA-N 383.404 2.615 0 50 GFAA NC(=O)CN1CCC(NC(=O)c2ccc(-c3ccc4occc4c3)cc2)CC1 426500323 SZHRQSNSWVVPGE-UHFFFAOYSA-N 377.444 2.779 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccc(C)cc2)cc1 135769808 IVURGWXIBVBMFH-SLFFLAALSA-N 377.444 2.539 0 50 GFAA CCn1nc(C)c(CNC(=O)N2CCN(c3cc(C)cc(C)c3)C(=O)C2)c1C 426395928 IJVCYUFAMCARMX-UHFFFAOYSA-N 383.496 2.695 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95506155 SEAISECFMMNMRU-QGZVFWFLSA-N 387.447 2.618 0 50 GFAA CCCc1ccccc1NC(=O)N1CCN(c2cc(C)nc3ncnn23)CC1 97784699 NBOOICNUKOZIEL-UHFFFAOYSA-N 379.468 2.739 0 50 GFAA CS(=O)(=O)CCN1CCN(C(=O)Nc2cccc(-c3ccccc3)c2)CC1 95504412 WVGCPOFUVKAXIO-UHFFFAOYSA-N 387.505 2.548 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)/C(=C(\O)N[C@@H]1CCS(=O)(=O)C1)S2 334158926 BKOZBLITUOKODU-KXXJMABESA-N 393.534 2.500 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC(c2nccn2Cc2ccncc2)CC1 92022600 KWWUYXPALMJVDT-UHFFFAOYSA-N 386.459 2.994 0 50 GFAA CN(CCC(=O)Nc1ccc(C(N)=O)cc1)C[C@@H]1CCN(c2ccccc2)C1 243893762 AUBQHSCJLKSRAL-KRWDZBQOSA-N 380.492 2.572 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N[C@H]1CCCN(c2cccnc2)C1=O 183748883 LPXHBVKFIHLFFZ-IBGZPJMESA-N 390.447 2.644 0 50 GFAA Cc1c(C(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)cnc2ccnn12 1940198290 BFVABOCILMSNRN-OXQOHEQNSA-N 387.443 2.573 0 50 GFAA Cc1n[nH]c(C)c1CN(C)C(=O)c1cccc(-c2ccc(CO)cc2CO)c1 299774652 IMOWRNINLXRRQP-UHFFFAOYSA-N 379.460 2.950 0 50 GFAA O=C(NC[C@@H]1CC(Cc2ccc(F)cc2)=NO1)c1cc2c(nc1O)CCCC2 299788756 WSSFUUPFPDRIGN-KRWDZBQOSA-N 383.423 2.923 0 50 GFAA CN1CC[C@@](C)(CNC(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)C1 670435769 OMVIHFTXTJOMNL-NRFANRHFSA-N 386.517 2.732 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(CNC(=O)c3ccoc3)CC2)c2cc(F)ccc2N1 952867594 QUDQPAAEABFEEQ-QGZVFWFLSA-N 399.422 2.513 0 50 GFAA CCc1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)cn1 1565508565 VRZZDNNGUOKMIU-UZLBHIALSA-N 376.504 2.743 0 50 GFAA C[C@@H]1CN(Cc2ccccc2NC(=O)N2CCc3ccnc(O)c3C2)C[C@@H](C)O1 276949526 OOGPBYFVZCGBIV-HZPDHXFCSA-N 396.491 2.987 0 50 GFAA Cc1cc(-c2nc(-c3ccnc(N4CCCCC4)c3)no2)ccc1S(N)(=O)=O 170606740 PAOGJHXYZYJKHN-UHFFFAOYSA-N 399.476 2.745 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)Nc3nnc(CC4CCCC4)o3)ccc21 194900796 JULSUDZDTRGNSS-UHFFFAOYSA-N 390.465 2.512 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N(C)Cc2ccc(C(F)(F)F)cc2)C1 1506396644 LMCXSDZTFFUESN-CQSZACIVSA-N 380.432 2.740 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)c1ccc(C(=O)N2CCOCC2)cn1 1529169062 SGOSKVFDKDSIHT-UHFFFAOYSA-N 393.491 2.808 0 50 GFAA CCOCC(=O)N1CCC(C(=O)Nc2ccnn2[C@H](C)c2ccccc2)CC1 1529113020 AYDCQPKLMOFKJQ-MRXNPFEDSA-N 384.480 2.706 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3cccc(C(=O)O)n3)CC1)OCC2 1704333144 WKFXEAKPTAPDJV-UHFFFAOYSA-N 384.432 2.865 0 50 GFAA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(Cl)c(OC)cc2Cl)C1 1120017 RTPPZZQALHSCMZ-JTQLQIEISA-N 396.292 2.966 0 50 GFAA C/C(Cl)=C/Cn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 829828 LEPWNUWRQOBYTD-FLIBITNWSA-N 376.869 2.858 0 50 GFAA biogenic COCCN(C(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1)C(C)C 14978163 SMCDEKSGAPYSOC-UHFFFAOYSA-N 388.508 2.963 0 50 GFAA CCN1CCC[C@H]1CNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 15064381 ZZTOAXPNJOKSMW-IBGZPJMESA-N 399.535 2.681 0 50 GFAA Cc1cccc(CNC(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)c1 15077256 HTSYGHSQSJHRAE-HXUWFJFHSA-N 383.536 2.724 0 50 GFAA CCNC(=O)N1[C@H]2CC[C@@H]1C[C@]1(C2)CN(c2noc(-c3ccccc3)n2)CCO1 1857725655 HLYPXLXVZYTHHV-LFUKPOHLSA-N 397.479 2.668 0 50 GFAA Cc1nn(-c2ccc(C(=O)N(C)C[C@@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237232211 YQBFVXYRMJBGKG-INIZCTEOSA-N 385.464 2.615 0 50 GFAA O=C(NC1CC1)c1cn(CC[C@@H]2CCCCN2C(=O)/C=C/c2cccs2)nn1 14990878 OUVYMERKFGIIBT-FDMDGMSGSA-N 399.520 2.716 0 50 GFAA CN(CC(=O)N1C[C@H]2CC[C@@H](C1)N(Cc1ccccc1)C2)Cc1ccccn1 247984224 KFKSHDGOQFYZIY-UNMCSNQZSA-N 378.520 2.636 0 50 GFAA CNc1cnc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cn1 952893020 GXOBFGADMSUROI-INIZCTEOSA-N 391.357 2.674 0 50 GFAA C=CC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncsc1C(F)(F)F 1875383097 GNVIGAUKJRELCJ-DGCLKSJQSA-N 381.379 2.860 0 50 GFAA O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@H]3C2)C1 886091321 POZZXGOCULESEG-SNPRPXQTSA-N 394.878 2.828 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)cc(O)n1 2100482807 AAIMOVKQPZITDM-QHCPKHFHSA-N 393.487 2.936 0 50 GFAA CCOC(=O)c1c(CN2CCOCC2)[nH]c(C(=O)OCc2ccccc2)c1C 19830710 WFMZJOZEVDOCRB-UHFFFAOYSA-N 386.448 2.689 0 50 GFAA CC[C@H](C)N(C)CCNC(=O)C(=O)N1CC[C@H](c2cc(C)c(Cl)cc2O)C1 2325757204 VENSYVCLVVSEBS-GJZGRUSLSA-N 395.931 2.516 0 50 GFAA O=C(Cc1ccc(-n2cnnc2)cc1)N1C[C@@H](C2CCNCC2)c2ccccc21 2325798788 ATTHSEBLFRQASX-NRFANRHFSA-N 387.487 2.940 0 50 GFAA Cc1cc(C(=O)O)cc(NS(=O)(=O)c2ccc(Br)o2)c1O 2325874754 ZVMWFMUAQZPJEX-UHFFFAOYSA-N 376.184 2.555 0 50 GFAA Cn1c(=O)c2c(nc(SC(c3ccccc3)c3ccccc3)n2C)n(C)c1=O 1087341 APULFYUWWFSEQF-UHFFFAOYSA-N 392.484 2.852 0 50 GFAA COc1ccc(CNC2=NC(=O)C[C@@H](C(=O)Nc3ccc(F)cc3)S2)cc1 1107389 UZFLDMDDNJKAGZ-INIZCTEOSA-N 387.436 2.951 0 50 GFAA COC(=O)c1cncnc1N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356144683 IUBQVVBXUJRIET-UHFFFAOYSA-N 378.432 2.813 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCO[C@H](c2ccccn2)C1 2356154538 ZNJSVNIRAVZXSX-KRWDZBQOSA-N 399.516 2.508 0 50 GFAA COC(=O)c1ccc(N2CCOCC2)c(NC(=O)COc2cccc(C)c2)c1 7389699 RXJCASQDZHQABW-UHFFFAOYSA-N 384.432 2.636 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1C(=O)NC(C)C 10008962 ZQRBLSLFGKPBLQ-AWEZNQCLSA-N 376.478 2.873 0 50 GFAA Cn1ncc2c1ncn1nc(-c3ccnn3COc3ccc(Cl)cc3)nc21 2802458 CNGJCPSZUQQYBN-UHFFFAOYSA-N 380.799 2.564 0 50 GFAA COc1cccc([C@@H]2CCN(Cc3cnc(-c4ccccn4)nc3)C[C@H]2O)c1 65373750 QQHFUYVFRDPCQA-PZJWPPBQSA-N 376.460 2.898 0 50 GFAA CCCn1ncc(C)c1NC(=O)Cn1ccnc1C(=O)c1ccc(OC)cc1 20780331 NREABCQEDGJAHU-UHFFFAOYSA-N 381.436 2.676 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 252484741 GGDRQVAYWIJESM-NSHDSACASA-N 398.389 2.633 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)[C@@H]1c1ccccc1 124488005 PVGSIXUEXWGOON-BLVKFPJESA-N 381.407 2.869 0 50 GFAA CCn1cnnc1CCNC(=O)c1csc2nc(-c3ccccc3F)cn12 67650662 IXMGOHWKZZODCI-UHFFFAOYSA-N 384.440 2.786 0 50 GFAA Cc1c(CN(C)C(=O)c2cc3cc(Br)ccc3oc2=O)cnn1C 2755070 PWPLGSGTIMEYBZ-UHFFFAOYSA-N 390.237 2.870 0 50 GFAA CN(C)[C@H](Cc1ccccc1)C(=O)N1CCC(NC(=O)c2ccsc2)CC1 171665564 QZRVCSUSPHTIEJ-LJQANCHMSA-N 385.533 2.642 0 50 GFAA COc1ccccc1C1=NO[C@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)C1 6738332 GPFXTOLNSRMQHU-FQEVSTJZSA-N 383.423 2.676 0 50 GFAA Cc1cccc(C(N)=O)c1NCC(=O)N(C)Cc1cc(Br)cs1 154228621 QSINZSAIUNPDAK-UHFFFAOYSA-N 396.310 2.988 0 50 GFAA CC(C)Cn1ncc(C(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1C1CC1 362380866 RMMDIBSLBAMZGV-INIZCTEOSA-N 395.507 2.524 0 50 GFAA CC(C)CN(C)CCCN1CC2(CCN(C(=O)[C@@H]3CC3(C)C)CC2)OC1=O 72454464 RPAIDUOUHZKYGH-KRWDZBQOSA-N 379.545 2.824 0 50 GFAA C[C@H]1[C@H](C)N(C(=O)OC(C)(C)C)CCN1Cc1ccc2c(c1)oc(=O)n2C 241439887 NNDCAHOMLCUQCB-KBPBESRZSA-N 375.469 2.961 0 50 GFAA CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)N2[C@H](C)CCC[C@H]2C)C1=O 241586428 OVZDYBCEULMFSA-VTJXTGGHSA-N 387.480 2.642 0 50 GFAA Cc1nc2scc(C3CC3)n2c1CN1CCC[C@@]2(CCS(=O)(=O)C2)C1 333836687 MOPLIGLXERICIL-GOSISDBHSA-N 379.551 2.982 0 50 GFAA COc1ncc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 71754795 UJMUOZLDVQNUFC-IBGZPJMESA-N 386.471 2.997 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](CCc3ccc(F)cc3)C2)cnc2cc(=O)[nH]n12 71759933 HNRKSVCBJKVMTP-MRXNPFEDSA-N 382.439 2.955 0 50 GFAA Cc1cc(C(=O)N(C)Cc2nc(-c3ccccc3)no2)c2c(C)nn(C)c2n1 72472820 XSQXRLRXTHZHMC-UHFFFAOYSA-N 376.420 2.907 0 50 GFAA COc1cccc(-c2cc(F)ccc2[C@@H]2Cc3nc(N)nc(C)c3C(=O)N2)n1 60329724 WSMQUUGTQYPVPD-HNNXBMFYSA-N 379.395 2.604 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)[C@H](c1ccc2c(c1)OCO2)N(C)C 426503259 KDAIQGSFEDXDBJ-FQEVSTJZSA-N 394.431 2.727 0 50 GFAA COc1ccc(CN2CCC(CNC(=O)COc3ccc(C=O)cc3)CC2)cc1 263859036 CKLJUQINCCHYIO-UHFFFAOYSA-N 396.487 2.915 0 50 GFAA COc1cccc2c(C)nc(NC3=NCN(CCc4ccccc4)CN3)nc12 19320801 YARGLCHCQRWJEY-UHFFFAOYSA-N 376.464 2.778 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N[C@@H](C)Cn3ccc(C)n3)c2n1 20602214 CAXJEDHTWZNLHJ-LBPRGKRZSA-N 394.401 2.777 0 50 GFAA O=C(O)Cn1nccc1[C@H]1CCCN(C(=O)CCc2ccc(F)c(F)c2)C1 426514626 IFLNGUPZZNYPSV-AWEZNQCLSA-N 377.391 2.585 0 50 GFAA C[C@@H]1Cc2ccccc2N1CC(=O)N(c1ccccc1)[C@H]1CCS(=O)(=O)C1 239432788 WLCWZCUNPAXJQV-APWZRJJASA-N 384.501 2.658 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N(C)Cc1ccc2nsnc2c1 97323876 IVMNTACVAFRNDK-ZDUSSCGKSA-N 382.445 2.784 0 50 GFAA Cc1nc2sccn2c1CN(C)C(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C 267526645 OGTGMQVLRAMZIX-LBPRGKRZSA-N 383.477 2.753 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C[C@@H]3CCCO3)CC2)c1 95520126 HPCQMNKQZXVAMK-IBGZPJMESA-N 388.508 2.953 0 50 GFAA O=C(NC1CCCC1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95362854 SBHKBNILBLVWRU-IOMROCGXSA-N 383.492 2.930 0 50 GFAA c1ccc(-c2cn([C@H]3COC[C@@H]3N3CCCCC3)nn2)c(Cn2cccn2)c1 92045840 XAPNXYHXYQXDBW-SFTDATJTSA-N 378.480 2.616 0 50 GFAA O=c1c2ccccc2ncn1Cc1nc([C@H]2CCOC2)nn1Cc1ccccc1 96179788 KZVSAVNAGQEPES-KRWDZBQOSA-N 387.443 2.589 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Nc1ccc(Cl)cc1Cl 239425679 UZTJJCITPDODGP-GQYKBVJTSA-N 391.254 2.985 0 50 GFAA CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1ccc(OCC(F)(F)F)nn1 182115312 MYSKBBKNZUCLOD-HNNXBMFYSA-N 383.370 2.922 0 50 GFAA O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NC[C@H]1CN(C(=O)Nc2ccccc2)[C@H]2CCN1C2 299754288 GBCMXZIMMPEIIH-OEUJLIAZSA-N 396.535 2.920 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N3CCC(N4CCCCC4)CC3)cn12 1940193452 NGZASYXDJGGKIR-LJQANCHMSA-N 385.512 2.509 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)c1cccc(-c2nc(C)n(C)n2)c1)C1CC1 299795665 OVPFLDNXMIQCQM-UHFFFAOYSA-N 378.480 2.946 0 50 GFAA Cn1nccc1C(=O)N1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 952972896 MERPWZDOSDVZEW-UHFFFAOYSA-N 387.793 2.840 0 50 GFAA CN(Cc1nccs1)[C@H]1CC12CCN(C(=O)c1ccc3nc[nH]c3n1)CC2 275653654 KTDPLBOZKJAOGE-HNNXBMFYSA-N 382.493 2.541 0 50 GFAA O=S(=O)(Nc1ccc(-n2cnnc2)cc1)c1c(F)cccc1Br 170617379 GDQDJYBVACBUTP-UHFFFAOYSA-N 397.229 2.970 0 50 GFAA C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 170612379 FQRRTYMNAIHMFX-KBPBESRZSA-N 377.485 2.805 0 50 GFAA Cc1nsc(NC(=O)[C@H]2CCN(c3cccc(Br)c3)C2=O)n1 170643522 RUHLTDBQZDOKCC-LLVKDONJSA-N 381.255 2.601 0 50 GFAA CCC[C@@]1(COC)CCCN1C(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O 193758422 CFNKHYOYTJXDME-NRFANRHFSA-N 388.512 2.619 0 50 GFAA Cc1ccccc1OC[C@@H](O)C(=O)N(C)CCc1nc2ccc(Cl)cc2[nH]1 1506397360 BROSDWKRDBWMQM-QGZVFWFLSA-N 387.867 2.966 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2c(F)cccc2F)cc1OC 1529189551 RGOLEYPJHXUICF-WOJBJXKFSA-N 379.403 2.916 0 50 GFAA Cc1ccc(-c2ccccc2CN2C[C@@H]3CN(Cc4cnc[nH]4)C[C@]3(CO)C2)o1 1772805694 PMHKNQXNMHZHBF-XXBNENTESA-N 392.503 2.904 0 50 GFAA O=C(NC[C@H](c1ccccc1)N1CCCCCC1)c1cc(N2CCOCC2)no1 1772813035 TYUAMSNVHFCQLQ-LJQANCHMSA-N 398.507 2.858 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4cc(C)n(C)n4)C3)C2)c1 11839637 KQZCRFFOXNXROP-JOCHJYFZSA-N 382.508 2.865 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)c2cnc(C)cn2)C1 12053520 DORRUHNVXNMKLW-SFHVURJKSA-N 382.508 2.820 0 50 GFAA CCOC(=O)c1ccc(NC(=O)[C@H]2CC(=O)Nc3nc4ccccc4n32)cc1 12407282 HCIQCPISOUEFQN-MRXNPFEDSA-N 378.388 2.735 0 50 GFAA CCS(=O)(=O)c1ncc(CN(CCO)C(C)C)n1CCCc1ccccc1 12444849 GIFKFWXCDHFBDN-UHFFFAOYSA-N 393.553 2.512 0 50 GFAA COc1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)C[C@@H]2CCO)c(F)c1 19792887 KKOPHZJLGWKCJF-KRWDZBQOSA-N 398.482 2.779 0 50 GFAA CN(C)C(=O)c1ccc([C@H]2CCCN2C(=O)Cn2nc3ccccc3n2)s1 19835820 HASSTRZVNGQJFN-OAHLLOKOSA-N 383.477 2.558 0 50 GFAA CCNc1ncc(C(=O)N[C@H]2C[C@H](Cn3cc(Cl)cn3)C[C@@H]2O)cc1Cl 1857531448 WFPTWGJGWDUZPR-LKTVYLICSA-N 398.294 2.586 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCC3(CC2)OCCc2sc(C(=O)O)cc23)n1 1857690152 CBXNSNRUNPFZLT-UHFFFAOYSA-N 388.445 2.916 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCC4(CO)CCCC4)CC3=O)sc2c1 1857718715 PWVYNLGHJHBDBI-AWEZNQCLSA-N 387.505 2.627 0 50 GFAA COC[C@@H]1CCC[C@@H]1NC1CCN(c2ccc(N3CCN(C)C3=O)cc2)CC1 214670857 DIGZVMJEAMYYTO-UWJYYQICSA-N 386.540 2.932 0 50 GFAA COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NC[C@H]3CCCO3)cc2)c1 1159754 RYRXJJBENAPIBN-QGZVFWFLSA-N 384.432 2.865 0 50 GFAA Cc1c(C(=O)N2CCNC(=O)C2(C)C)cnn1-c1cccc(C(F)(F)F)c1 109892935 VZAYJWLHBNVIOP-UHFFFAOYSA-N 380.370 2.550 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)Cc2csc(-c3ccc(Cl)s3)n2)CCO1 238196253 URBLMGYNROWAIR-SNVBAGLBSA-N 386.882 2.770 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)CCc3ccccc3C(=O)O)CC2)n1 911507707 CDCPVGQGAVUCBZ-UHFFFAOYSA-N 382.464 2.580 0 50 GFAA C[C@H](CO)NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1Br 821376683 HUSMAPOPKDILGE-ZWNOBZJWSA-N 387.274 2.512 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCCO[C@H]1C1CCN(C(=O)C[C@H]2CCCO2)CC1 837247778 XPSLCPOFSKEKQX-LMMKCTJWSA-N 396.528 2.866 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)o1 846355641 VTBPMGYNIBOVPU-SFHVURJKSA-N 397.880 2.601 0 50 GFAA CC(C)c1nn(C)cc1-c1noc([C@H]2CCc3nnn(C4CCOCC4)c3C2)n1 952895957 YPVCXCANILCCEO-ZDUSSCGKSA-N 397.483 2.809 0 50 GFAA O=C(O)c1csc(C[C@H]2CCCN(Cc3ccc(-n4cccn4)nc3)C2)n1 1875298761 MIXOEQIEDXSPBK-CQSZACIVSA-N 383.477 2.877 0 50 GFAA Cc1c(C(=O)NS(=O)(=O)C[C@@H]2CCCCC2(F)F)sc2cncn12 1875303985 VRLXFVTWZHMQOU-JTQLQIEISA-N 377.438 2.589 0 50 GFAA CCn1cc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2cnc3ccccc3c2)cn1 1875310349 NAARLKXPSOCXMI-WOJBJXKFSA-N 391.475 2.922 0 50 GFAA O=C(NC1CC2(CCNCC2)C1)C(=O)N1CC=C(c2cccc3ccccc23)C1 2325775795 UPQFIZLXLUGWFW-UHFFFAOYSA-N 389.499 2.714 0 50 GFAA COc1cc(NC(=O)CS(=O)(=O)Cc2ccccc2)c(OC)cc1Cl 987747 MTLCTNSDOWZJDE-UHFFFAOYSA-N 383.853 2.911 0 50 GFAA CCOC(=O)C(NC(C)=O)(C(=O)OCC)C1c2ccccc2-c2ccccc21 1694611 PIDILKQZANKQKU-UHFFFAOYSA-N 381.428 2.800 0 50 GFAA COc1cccc(N2C(=O)N(c3ccccc3Cl)[C@@H]3CS(=O)(=O)C[C@H]32)c1 4172210 QDGMBDNHDQYNFO-IAGOWNOFSA-N 392.864 2.961 0 50 GFAA CCn1c(CC(=O)Nc2ccccc2)nnc1SCC(=O)NC1CCCC1 4735988 HVMAPEQPIJKJJK-UHFFFAOYSA-N 387.509 2.630 0 50 GFAA CC[C@@H](Sc1nnc(-c2ccncc2)n1C)C(=O)Nc1nnc(C)s1 4736182 NSEJONQCCYWOIA-LLVKDONJSA-N 375.483 2.546 0 50 GFAA CN(c1ccccc1)c1nc(N)nc(Cn2c(=O)oc3ccc(Cl)cc32)n1 6662411 VOVVBEJUMQRGCT-UHFFFAOYSA-N 382.811 2.831 0 50 GFAA O=C(c1ccc(NC[C@@H]2CCCCO2)nc1)N1CCC(Cn2cccn2)CC1 20600146 UYHNQTLWVMFFNV-IBGZPJMESA-N 383.496 2.812 0 50 GFAA Cc1cccc(C(=O)Nc2cc(NC(=O)CSc3n[nH]c(N)n3)ccc2C)c1 65404751 LCFMWLUYWZZVOH-UHFFFAOYSA-N 396.476 2.987 0 50 GFAA CC(=O)[C@@]1(O)CC[C@@H]2[C@@H]3C[C@H](C)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@H](O)C[C@@]21C 25547996 FAOZLTXFLGPHNG-YXNQXYGFSA-N 376.468 2.923 0 50 GFAA CCc1ccc(CN2CCC(N3CCC[C@@H](C(=O)NCCOC)C3)CC2)cc1 67723675 AGVZRWZDYXTWOE-OAQYLSRUSA-N 387.568 2.688 0 50 GFAA COc1ccc(C(=O)NCCn2c(=O)[nH]c3ccccc32)c(OCC2CC2)c1 252478637 AQTPRSCVPRCJBE-UHFFFAOYSA-N 381.432 2.557 0 50 GFAA CCCN1CCN(Cc2oc3ccc(C)cc3c2C)[C@H]2CS(=O)(=O)C[C@H]21 72474668 QBWKTJHSRBXUII-MSOLQXFVSA-N 376.522 2.743 0 50 GFAA CN(Cc1cccs1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71763480 SIUXSDCUTMCZIG-QGZVFWFLSA-N 389.565 2.820 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)Cn3ccccc3=O)CC2)c1 77539998 XFQAUYUFSAABFD-UHFFFAOYSA-N 376.460 2.953 0 50 GFAA COc1cc(CNCCc2cccnc2)ccc1OC[C@@H](O)CN(C)C(C)C 12303599 JNGYUUWIUTYUGR-FQEVSTJZSA-N 387.524 2.502 0 50 GFAA O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccc2nccn2c1 172107847 XWRCVVAFPMGZNE-FQEVSTJZSA-N 378.476 2.510 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N[C@@H](C)C(C)C)c2=O)cc1 77355937 BFAGPOREHFDWRP-INIZCTEOSA-N 394.475 2.870 0 50 GFAA Cn1ncnc1[C@H]1c2n[nH]c(=O)c3cc(F)cc(c23)N[C@@H]1c1ccc(F)cc1 72318110 HWGQMRYQVZSGDQ-HZPDHXFCSA-N 380.358 2.629 0 50 GFAA investigational Cc1ccc(C(N)=O)c(N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n1 71745869 UTCYQUYFOQJUDX-IBGZPJMESA-N 398.482 2.892 0 50 GFAA C[C@H]1CN(CC2CCN(C(=O)c3cccc4ccc(O)nc34)CC2)C[C@@H](C)O1 377432690 HNQPFXRKNFSXGB-IYBDPMFKSA-N 383.492 2.902 0 50 GFAA CCS(=O)(=O)c1ccc2oc(Cn3ccc(C(F)(F)F)cc3=O)nc2c1 283213072 ZHRQWEDOESHACI-UHFFFAOYSA-N 386.351 2.850 0 50 GFAA CC[C@]1(CNC(=O)c2ccccc2OCC(=O)N(C)C)OCCc2ccccc21 291205786 LPDOTYAYXSLTNZ-HSZRJFAPSA-N 396.487 2.762 0 50 GFAA CCn1cc(CN(Cc2ccccc2)S(=O)(=O)c2cnn(CC)c2C)cn1 20604096 VJWXVODRLJYWPH-UHFFFAOYSA-N 387.509 2.819 0 50 GFAA O=C(NC[C@H]1CC(=O)N(C2CCCC2)C1)c1cccc(-c2ncccc2O)c1 426491526 LGBSUAXLLFZDSG-OAHLLOKOSA-N 379.460 2.975 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccncc3F)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95367232 ZADHZHNCDKGQCA-CEWLAPEOSA-N 381.451 2.932 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4ccccc4F)C3)CCC2=O)cn1 95531352 MRZZZODOHCGGST-JOCHJYFZSA-N 396.466 2.969 0 50 GFAA COc1ccc(NC(=O)N2CCC3(CC2)c2ccccc2C[C@@H]3O)c(OC)n1 96153874 APUFJOPVKRESKC-KRWDZBQOSA-N 383.448 2.582 0 50 GFAA CCOc1ccc(NC(=O)NCCN2CCC[C@H](CO)C2)cc1C(F)(F)F 96137325 PBNFSESOSNWOEW-ZDUSSCGKSA-N 389.418 2.930 0 50 GFAA CCc1ccc(-c2nc(CS(=O)(=O)Cc3nnc(C)n3C)cs2)cc1 180046154 UEMZIIXXKLPIHY-UHFFFAOYSA-N 376.507 2.924 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)o1 91288758 FXXJBSQJKDXWOV-UHFFFAOYSA-N 397.475 2.771 0 50 GFAA Cc1nc(CN2CCCC[C@@H]2C(=O)Nc2cccc(-c3nnc(C)s3)c2)n[nH]1 95517353 IXZBVHYAEZYHCC-MRXNPFEDSA-N 397.508 2.933 0 50 GFAA CN1CCCCC[C@@H]1C(=O)N1CCC2(CC1)CCN(Cc1ccccc1)C2=O 95380378 YYKBFCGJTORCBN-HXUWFJFHSA-N 383.536 2.902 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC=C4C[C@H](O)CC[C@@]43COS(=O)(=O)O)[C@H]1CCC2=O 247653844 OFAHVPXLWWIVAF-WZDWFBNESA-N 384.494 2.679 0 50 GFAA CNC(=O)c1cccc(NC(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c1 298458022 SVJUDFMNRKAVPO-UHFFFAOYSA-N 396.447 2.634 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)NCc1csc(-c2cnccn2)n1 534657531 LHZJFFNRGGOBBU-UHFFFAOYSA-N 383.481 2.544 0 50 GFAA COc1ccc(Cl)cc1CN(C)C(=O)NCC[C@@H](C)N1CCN(C)CC1 534655576 XVSQLCGMTOIKRN-OAHLLOKOSA-N 382.936 2.516 0 50 GFAA CCC1=NO[C@H](CNC(=O)c2ccc(-c3cc(OC(C)C)nc(N)n3)cc2)C1 534673147 IKGLTKTWDKTFPD-INIZCTEOSA-N 383.452 2.798 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@H](C(=O)N1CCCCCC1)C2)c1cccnc1 299758035 KHYYPNSDTLVFKG-CQSZACIVSA-N 398.488 2.938 0 50 GFAA O=C1CCCN1CCCC(=O)N(Cc1ccncc1)Cc1ccc2c(c1)OCO2 827884281 YYZHFGKNCFZWPC-UHFFFAOYSA-N 395.459 2.742 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N[C@H]1CCCN(C(=O)c2ccco2)C1 827860805 IXGWMVACLIAFOZ-INIZCTEOSA-N 392.459 2.928 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCC[C@@]2(CC1)CNC(=O)O2 952981738 WCAVPENYLBOFDO-GOSISDBHSA-N 379.844 2.793 0 50 GFAA COc1ccc(Cl)cc1C(=O)NCC1CCN(c2nccnc2OC)CC1 952968012 DMRAJDZMLGEGMV-UHFFFAOYSA-N 390.871 2.794 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)Cc1cc(C)[nH]n1)CC2 275814261 VPRFRPZNFNHGBL-GOSISDBHSA-N 386.521 2.752 0 50 GFAA CCCNC(=O)c1ccc(NC(=O)[C@H]2COCCN2CC2CCC2)cc1Cl 188261453 KXTZJHUOGWKPOT-GOSISDBHSA-N 393.915 2.919 0 50 GFAA COCc1cc(N(C)CCOc2ccc(C(F)(F)F)cc2)n2ncnc2n1 190329001 IICFIOUPXRVSPA-UHFFFAOYSA-N 381.358 2.805 0 50 GFAA CC(=O)Nc1ccc(OC[C@H](O)Cn2nc(C(F)(F)F)c3cnccc32)cc1 193007198 CKNYAKWVMFWSTM-CYBMUJFWSA-N 394.353 2.848 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)N[C@@H]1c2ccccc2C[C@@H]1O 1506417581 RSTXRSFPFDDBGD-SUMWQHHRSA-N 376.459 2.648 0 50 GFAA Cc1ccc(-c2csc(NC(=O)[C@H]3[C@@H]4C=C[C@@]5(CN(C)C(=O)[C@@H]35)O4)n2)s1 1529160053 XFHZOMFQDGXIKV-NASWQRNTSA-N 387.486 2.530 0 50 GFAA c1ccc(-c2nc3ncccn3c2CN2CCN3[C@@H](C4CC4)COC[C@H]3C2)cc1 1529158709 JGLGCULUAXUTRD-TZIWHRDSSA-N 389.503 2.691 0 50 GFAA C/C=C/Cn1c(Sc2nc3ccccc3s2)nc2c1c(=O)[nH]c(=O)n2C 5252221 QPCRLRGYDDFLLH-ONEGZZNKSA-N 385.474 2.760 0 50 GFAA CCNc1ncc(CN2CCCN(C(=O)C3(c4ccc(C)cc4)CC3)CC2)cn1 1775978794 VUSOOUGIMMPWSW-UHFFFAOYSA-N 393.535 2.983 0 50 GFAA O=C(CN1CCCN(C(=O)c2cc(F)cc(F)c2)CC1)NC1CCCCC1 1772707626 XSTWQNSVFBYXGO-UHFFFAOYSA-N 379.451 2.562 0 50 GFAA O=C1CCc2cc(S(=O)(=O)NCc3ccccc3Cl)cc3c2N1CC3 5153582 WEMDARSGVXCXMH-UHFFFAOYSA-N 376.865 2.654 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCCc2ccc(F)cc2)c1=O 11840555 UKTBGTJSSOWZFH-UHFFFAOYSA-N 399.466 2.825 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)Cc3nonc3C)CC2)c1 12385178 VCZGKMJNZIINMT-UHFFFAOYSA-N 386.452 2.587 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N4CC[C@H](O)C4)cc3o2)cc1OC 14953321 RGFAUSBFVWCJQS-HNNXBMFYSA-N 382.416 2.643 0 50 GFAA COc1ccc(-c2csc(NC(=O)CSc3nc(C)cc(=O)[nH]3)n2)cc1 18220066 MJARRLOVODVUIA-UHFFFAOYSA-N 388.474 2.941 0 50 GFAA O=C(NCCCN1CCOCC1)c1cn(-c2ccccc2)nc1-c1ccccc1 19300289 DMJMJWFAKWKEJZ-UHFFFAOYSA-N 390.487 2.991 0 50 GFAA Cc1ccc([C@@H]2NC(=O)N(CC(=O)Nc3ccccc3F)C3=C2C(=O)OC3)cc1 169757939 DURFLHHATIRGDT-IBGZPJMESA-N 395.390 2.650 0 50 GFAA Cc1c(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)nnn1C1CCNCC1 152975430 SRFDKECBFAUNNY-UHFFFAOYSA-N 394.357 2.923 0 50 GFAA Cc1cc(-c2nc(CC(N)=O)nn2-c2cccc3cccnc23)nn1C(C)C 1857668268 JOHXTUXWNUNEMV-UHFFFAOYSA-N 375.436 2.596 0 50 GFAA Cc1ccc(CC(=O)NC[C@H]2[C@H]3CN(C(=O)C4CCC4)C[C@]34CC[C@H]2O4)cc1C 1857737821 FDBBXLFJQZBNFD-FBHSLPMESA-N 396.531 2.768 0 50 GFAA c1cc(-c2ccc3c(c2)OCO3)cc(N2CCN3[C@@H](C4CC4)COC[C@H]3C2)n1 1875251004 KIZMQXMEIFVFJD-RTBURBONSA-N 379.460 2.777 0 50 GFAA CS(=O)(=O)c1cccnc1CNC(=O)N1CC[C@H](c2cccc(Cl)c2)C1 432360020 SWELBLVSYHVHEE-AWEZNQCLSA-N 393.896 2.838 0 50 GFAA CN(C(=O)c1ccc(Br)nc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 746528543 CGMFLGUYZYCJAK-LBPRGKRZSA-N 384.274 2.926 0 50 GFAA NC[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)C1CC1 238079282 AWUOLYCQEQMCCF-UXHICEINSA-N 397.906 2.761 0 50 GFAA CC(C)CC[C@]1(C2CCN(Cc3ccc4c(c3)CCO4)CC2)NC(=O)NC1=O 12040730 BAVANPBXGDZDQQ-JOCHJYFZSA-N 385.508 2.848 0 50 GFAA COc1ccc(-c2cc3c(N4CCC(C(=O)O)CC4)nccn3n2)cc1OC 33247629 RDHKGZYOYCLZIO-UHFFFAOYSA-N 382.420 2.715 0 50 GFAA in-vitro CCC(CC)C(=O)N1CCC[C@@H](n2cc(CNC(=O)OC(C)(C)C)nn2)C1 837244202 QUWGHVAQPVHAKO-MRXNPFEDSA-N 379.505 2.903 0 50 GFAA CCCC1(O)CCN(C(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)CC1 952845955 SXRAGKMUJNKXTF-UHFFFAOYSA-N 394.415 2.715 0 50 GFAA O=C(NC[C@@H](c1ccccc1)C(F)F)N[C@H](CCc1ccncc1)C(=O)O 1875291006 LEDVTDYDPXPINH-JKSUJKDBSA-N 377.391 2.816 0 50 GFAA Oc1cc(N2CC[C@@H](Nc3nc(-c4ccccn4)nc4sccc34)C2)ncn1 1875362645 NVLBUTHAPRMPAV-GFCCVEGCSA-N 391.460 2.940 0 50 GFAA Cn1cc(CC(=O)N[C@@H]2CCC[C@H]2CNCc2ccc(Cl)cc2F)cn1 1875374696 XUROJXXEMXHWMF-MAUKXSAKSA-N 378.879 2.830 0 50 GFAA COC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc(C)c(CC(C)C)[nH]1 4625824 FVGVMNSOPRLGNS-QGZVFWFLSA-N 389.521 2.909 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3oc(-c4cccc(Cl)c4)nc3c2)C(=O)N1 1857798118 POKCCFLZBDZPHL-CYBMUJFWSA-N 383.791 2.683 0 50 GFAA CCc1noc(-c2ccc(CCNC(=O)c3ccc4c(c3)C[C@@H](N)C4)cc2)n1 2325760841 YHIYJTXSPWPYFW-IBGZPJMESA-N 376.460 2.697 0 50 GFAA C[C@]1(C(=O)N[C@H]2CCN(C(=O)c3ccc4c(c3)NCC4)C[C@@H]2F)CCCS1 2325827167 YBLJMJDCXIKAJV-TWOQFEAHSA-N 391.512 2.609 0 50 GFAA Cc1ccccc1[C@@H]1CN(C(=O)Cc2sc(-c3ccn(C)n3)nc2C)CCN1 913478833 RDQSDBOOVFWMFB-SFHVURJKSA-N 395.532 2.876 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)c2ccccc2)cc1 637656 ZFGSPAQASKRAEI-UHFFFAOYSA-N 388.489 2.903 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(O)c(OC)c2)cc1 845631 LQLCKYJZZWGCGI-SFHVURJKSA-N 383.404 2.676 0 50 GFAA Cc1ccc2c(-c3ccc(C(=O)NC[C@@H]4CN(C)C(=O)CO4)cc3)cccc2n1 2356137934 AYOPWEBJFVHOBJ-GOSISDBHSA-N 389.455 2.797 0 50 GFAA CC[C@]12COC(=O)N1CCN(C(=O)c1ccc(-c3ccncc3OC)cc1)C2 2356146666 PKJBKEFQGCZHOQ-NRFANRHFSA-N 381.432 2.814 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)[C@H]4CCCN4)C3)[C@@H]3CCCCN23)c1 2356158230 FYCVMTAEERKAGO-FUOIXIIKSA-N 397.563 2.691 0 50 GFAA CCCCC(=O)Nc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 2851479 KIAASBCNKIPTKB-UHFFFAOYSA-N 375.450 2.715 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@]23CCCN(Cc2ccccn2)C3=O)cc1 2356170030 RHUXUJWJRNQYDW-QHCPKHFHSA-N 392.503 2.945 0 50 GFAA CC(=O)Nc1nnc(SCC(=O)Nc2ccc(Br)cc2)s1 9109750 WXESEQWQYOQLCG-UHFFFAOYSA-N 387.284 2.990 0 50 GFAA Cc1c(C(=O)Nc2ccccc2CN2CCOCC2)cnn1-c1ccccn1 55816782 AMYJUZCSGMIUIJ-UHFFFAOYSA-N 377.448 2.660 0 50 GFAA CCN(Cc1cnc(S(=O)(=O)CC)n1Cc1ccccc1)C[C@@H]1CCCO1 55118785 HSJDXIUKCBNNAH-IBGZPJMESA-N 391.537 2.726 0 50 GFAA O=C(NCc1ccc(F)cc1)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 20112217 VRBQMINBFPIIRH-UHFFFAOYSA-N 390.480 2.684 0 50 GFAA COc1ccc(Oc2cccc(CN3CCC4(CC3)NCCNC4=O)c2)cc1 67514289 APYVYLIQLDYCHO-UHFFFAOYSA-N 381.476 2.542 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)c3ccccc3Cl)CC2)ncn1 67603636 XGKBRQKWBNPKBW-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA CN(C)S(=O)(=O)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67871388 CFYLCUMJORWFSX-UHFFFAOYSA-N 382.869 2.713 0 50 GFAA Cn1ncc2c(O)c(C(=O)N(Cc3ccccc3)CC3(O)CCCC3)cnc21 119356327 CFHAIRFHAIIVHW-UHFFFAOYSA-N 380.448 2.621 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cnc3c(cnn3C)c2O)C(F)(F)F)cc1 119499989 UVAGLCBKHQCZLN-CQSZACIVSA-N 380.326 2.716 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)ncn3)CC2)cc1 38528343 FRWPANGGXSKLJS-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CS(=O)(=O)N1CC[C@H](C(=O)N2CCCc3ccccc32)Oc2ccccc21 30946849 PTKJHXNPLOJROL-LJQANCHMSA-N 386.473 2.583 0 50 GFAA CC1(C)C(=O)NCCN1C(=O)c1cc(-c2cccs2)n(-c2ccccc2)n1 151629326 WEINQWGJKYCHEI-UHFFFAOYSA-N 380.473 2.951 0 50 GFAA Cc1cc(C)cc(OCc2noc(CN3CCN(Cc4ccncc4)CC3)n2)c1 153115689 YGYDAQUQTOGWBX-UHFFFAOYSA-N 393.491 2.978 0 50 GFAA Cc1nnc(CNC(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)o1 71767987 UWRGUSGKGLEXIY-QFIPXVFZSA-N 390.443 2.541 0 50 GFAA CCOc1cc(C(=O)N2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)ccc1C 368997063 AAZDQWHQVNBIGK-HNNXBMFYSA-N 384.436 2.646 0 50 GFAA CCCN(CCN1CCCCCC1)C(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 494842257 MUXXXKPSYVKDRJ-UHFFFAOYSA-N 395.569 2.679 0 50 GFAA CCCN(C(=O)c1nnn(C2CCNCC2)c1C)[C@@H]1C[C@H](OCC)C1(C)C 236743313 QXFYXUPEBFPCLM-SJORKVTESA-N 377.533 2.567 0 50 GFAA CCN(C(=O)C[C@@H]1C(=O)NCCN1CCc1ccccc1)C1CCCCCC1 72130702 SDBFAWHGNZWQEZ-OAQYLSRUSA-N 385.552 2.991 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@H]1COc2ccccc2C1=O 128976133 APATZDSLTDSSLN-IBGZPJMESA-N 375.428 2.792 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)c1c[nH]c2ncccc12 173533088 ALZNOLXHULYOKP-UHFFFAOYSA-N 376.385 2.859 0 50 GFAA COc1ccc(S(=O)(=O)N2CCNC(=O)[C@H]2c2ccccc2)c2ccccc12 131184066 MHMUXHPQVNMJQJ-HXUWFJFHSA-N 396.468 2.710 0 50 GFAA NC(=O)[C@H](NC(=O)[C@H]1CCN(c2ccccc2Cl)C1)c1ccc(F)cc1 290637366 DJPBVOGFGKZWTO-SUMWQHHRSA-N 375.831 2.648 0 50 GFAA CCc1cnc(C)nc1N1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91390986 OTBJHNKHPVBJRZ-OAQYLSRUSA-N 382.512 2.522 0 50 GFAA Cc1ccccc1CN(CC(C)C)C(=O)Cn1ncc(N2CCCC2)cc1=O 95507334 DEJOLJNIJZEGPX-UHFFFAOYSA-N 382.508 2.837 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)c2ccc(OC)cc2O)C3)c1 96137596 YSZMVISFAIUVNF-UHFFFAOYSA-N 379.416 2.998 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C(=O)N1CN(C(=O)C(F)(F)F)c1ccccc1 239046274 FMKSDXUBMCDTLT-OSLXHZNNSA-N 390.361 2.593 0 50 GFAA CCOc1cc2c(cc1CN1CCN(C)[C@]3(CCC(=O)N(C)CC3)C1)CCC2 95392073 KCDFFRLHVCWLKQ-QHCPKHFHSA-N 385.552 2.703 0 50 GFAA COc1ccc(OC)c(CC(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)c1 91694079 UNVXRFYEJVGLPZ-UHFFFAOYSA-N 395.459 2.672 0 50 GFAA COc1ccc([C@H](NC(=O)c2cc(-c3ccccc3)on2)[C@H]2C[C@@H](O)C2)cn1 244742238 OEHPMCUIGFGYBS-YRNRMSPPSA-N 379.416 2.987 0 50 GFAA COc1ccc(-c2nc3c([nH]2)CCN(C(=O)CCc2scnc2C)C3)cn1 252489418 JQQGPJYXTQWNSA-UHFFFAOYSA-N 383.477 2.763 0 50 GFAA C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]3CC[C@@]4(OCO[C@]45COCO5)[C@H]3CC(=O)[C@@H]12 257347630 NJDQZPLIXBEZLQ-JXYRFBGOSA-N 390.476 2.831 0 50 GFAA O=C(NC1(CN2CCOCC2)CCCCC1)c1cccc(-c2cncnc2)c1 299762305 UJIYOCHWUNLIPD-UHFFFAOYSA-N 380.492 2.909 0 50 GFAA CN1CCCN(Cc2cc(-c3ccc4c(c3)OCO4)ccc2OCC(=O)O)CC1 299775839 LEDNOQMMBIBREM-UHFFFAOYSA-N 398.459 2.683 0 50 GFAA C[C@H](CNC(=O)N(Cc1ccncc1)Cc1ccc(F)cc1)N1CCOCC1 584897671 JQUSABRBFSCZCC-QGZVFWFLSA-N 386.471 2.653 0 50 GFAA CCCn1ccnc1CN1CCC[C@@H](CNC(=O)Cc2csc(C)n2)C1 823031041 QNRYBXNLAHSLOM-INIZCTEOSA-N 375.542 2.629 0 50 GFAA CN(Cc1cc(-c2ccccn2)no1)C(=O)CCNC(=O)c1ccc(F)cc1 952974607 OMVUGJXGNDILHR-UHFFFAOYSA-N 382.395 2.654 0 50 GFAA COc1ccc2nc(CCN(C)C(=O)[C@@H](Cc3cnc[nH]3)n3cccc3)[nH]c2c1 952978968 WKDUTBIBORGBJE-LJQANCHMSA-N 392.463 2.581 0 50 GFAA O=C1CN(C(=O)C2CCN(Cc3ccco3)CC2)CCN1Cc1ccccc1F 952871772 ASESQJJCLFSZPH-UHFFFAOYSA-N 399.466 2.502 0 50 GFAA CN1CC[C@H](CNC(=O)NC[C@@H]2CCC[C@H]2O)[C@H]1c1ccc(Cl)c(F)c1 270724378 XDWVCJMKMKGYIB-MJSCVDMRSA-N 383.895 2.932 0 50 GFAA NS(=O)(=O)c1cccnc1NCC1(c2ccccc2Br)CC1 301379260 XQCQVGYYVZTPHD-UHFFFAOYSA-N 382.283 2.635 0 50 GFAA COCCN1C(=O)C[C@@H](CNc2nc3ccccc3o2)[C@@H]1c1cnn(C)c1C 275265500 IJYKBIXLMPKXJG-IFXJQAMLSA-N 383.452 2.518 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)Cc2c(C)nc3ccccc3c2C)CC1 186632028 LZJLRBMRMJRAMF-UHFFFAOYSA-N 383.492 2.792 0 50 GFAA O=C(COC(=O)Cc1cc[nH]n1)Nc1cccc(CSc2ccccn2)c1 787781835 CSJDTYSLLMHCCM-UHFFFAOYSA-N 382.445 2.821 0 50 GFAA CC(C)c1ccc(CN2CC[C@H](N3CCN(c4ccccn4)CC3)[C@@H](O)C2)cc1 1615633352 NZKQYVLLSCMYSS-GOTSBHOMSA-N 394.563 2.962 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)c1nccc(N2CCC[C@@H](O)C2)n1 1529145952 QKHURQLNXNEZEH-MRXNPFEDSA-N 380.496 2.691 0 50 GFAA Cc1cc(N2CCC3(CC2)OCC[C@@](C)(NC(=O)c2ccccc2)[C@@H]3O)ccn1 1772711039 YDUONEKTGHLCBZ-FCHUYYIVSA-N 395.503 2.699 0 50 GFAA Cc1ccccc1[C@H](NC(=O)c1cc(N2CCOCC2)no1)c1ccncc1 1772807940 WLBDFHFTGFYVSX-HXUWFJFHSA-N 378.432 2.734 0 50 GFAA Cc1c([C@@H](C)NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)cnn1C 11879218 AIBAJMAJSLRLRT-LLVKDONJSA-N 384.392 2.515 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 12457273 LJLKEIXPMVEWMZ-JOCHJYFZSA-N 384.476 2.599 0 50 GFAA O=C1NCCN(Cc2ccc3ccccc3c2)[C@H]1CC(=O)N1CCCCCC1 12459655 YURGXFUAMNRRGS-NRFANRHFSA-N 379.504 2.933 0 50 GFAA Cn1cnnc1SCCNC(=O)CCc1nnc(CCC2CCCCC2)o1 15071130 YBQSMPQRTWXRLO-UHFFFAOYSA-N 392.529 2.552 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3cnc4sc(C)c(C)n4c3=O)CC2)c1C 16652514 SAPYWRKZMINJFZ-UHFFFAOYSA-N 396.516 2.952 0 50 GFAA OCC[C@@H]1CN(Cc2cccc3nonc23)CCN1Cc1ccc(F)c(F)c1 19228676 AJBJTONRQUPXFN-MRXNPFEDSA-N 388.418 2.570 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC[C@H]2c2ccc(C(=O)N3CCSCC3)s2)n1 19794506 CNEJFTPSVQYGMZ-ZDUSSCGKSA-N 390.534 2.946 0 50 GFAA O=C(c1cnc2c(c1)CCCC2)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857723840 YXBKJQJUUVICKO-GMAHTHKFSA-N 398.478 2.528 0 50 GFAA Cc1cn2cccc(C(=O)N[C@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)c2n1 1857729351 XCZDFCZDIHTMMF-CMKODMSKSA-N 376.460 2.587 0 50 GFAA COCCCn1c(C(=O)N2CCCCC2)cc2c(=O)n3cccc(C)c3nc21 5244133 OXJRJJJNQQOYFH-UHFFFAOYSA-N 382.464 2.620 0 50 GFAA Cc1nn(-c2ccc(C(=O)N(C)C[C@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237241171 YQBFVXYRMJBGKG-MRXNPFEDSA-N 385.464 2.615 0 50 GFAA O=C(N[C@H]1COc2c(Cl)cccc21)c1ccc(=O)n(-c2ccc(F)cc2)n1 365945729 JKHGEMGVFLHULO-INIZCTEOSA-N 385.782 2.889 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCc3nnc(-c4ccc(F)cc4)cc3C2)[nH]1 952892747 CDBZVRNNYMYTFC-UHFFFAOYSA-N 380.379 2.596 0 50 GFAA Cn1cc(-c2ccc(C(=O)N3CC[C@H](C4CC4)[C@@H]3c3nc(O)n[nH]3)cc2)cn1 1875401991 XYIZUHAQJHZZBU-IAGOWNOFSA-N 378.436 2.524 0 50 GFAA O=C(NC[C@H]1CN(c2ccnc3ccncc23)CCCO1)c1ccc(F)cc1 888103522 KXFIOJOOVFMOQU-KRWDZBQOSA-N 380.423 2.794 0 50 GFAA Cc1cc(C(=O)NC2(C3CCN(C(=O)c4scnc4C)CC3)CC2)ccn1 1775990066 CJSQDXCMSYAZMN-UHFFFAOYSA-N 384.505 2.970 0 50 GFAA CSCC[C@@H](NC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 2876716 FSWIZRWICPPRCU-MRXNPFEDSA-N 386.473 2.948 0 50 GFAA Cn1c(CC(=O)N2C[C@@H](CCN)Cc3ccccc32)nnc1-c1ccccc1 2325795232 RVMGMCWMBUPBPQ-INIZCTEOSA-N 375.476 2.579 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCC[C@@H]1c1ccccc1I 859383919 PQSOQHMVUGUDEO-CQSZACIVSA-N 398.244 2.599 0 50 GFAA CCN1CCN(CCC(=O)Nc2ccc3c(c2)ncn3-c2ccccc2)CC1 134396668 DMOCASXLCKNTRQ-UHFFFAOYSA-N 377.492 2.992 0 50 GFAA CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=S)NC(C)=O)cc1 677228 ZBXMXGGRLKUELN-UHFFFAOYSA-N 377.491 2.735 0 50 GFAA COc1ccc([C@H]2CC(=O)c3cnc(NC[C@@H]4CCCO4)nc3C2)cc1OC 2111727 RKRQPQBKWSMWIS-CABCVRRESA-N 383.448 2.997 0 50 GFAA biogenic Cc1nc2ccc(C(=O)N3CCC[C@]4(CCc5c[nH]c(=N)nc54)C3)cc2nc1C 2356144235 ODJCXVXZBFVDDD-QFIPXVFZSA-N 388.475 2.569 0 50 GFAA CN1CCC(C(=O)N2CCC3(CC2)C[C@@](C)(O)CCO3)(c2ccccc2)CC1 2356145099 APCDSQIJYNCWPD-NRFANRHFSA-N 386.536 2.573 0 50 GFAA CCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccc(OC(F)F)cc2)n1 4834503 ZVQIHABOSMBFLD-UHFFFAOYSA-N 391.783 2.777 0 50 GFAA COC(=O)[C@@H]1C[C@H](C(=O)NCc2ccc(F)cc2)[C@H](c2ccccc2F)N1C 55182876 AXYIQQOWFZCCDY-WDSOQIARSA-N 388.414 2.816 0 50 GFAA COCCN(Cc1scnc1C)C(=O)Cc1csc(NC(=O)C(C)C)n1 225618483 DDYZWFKVLYSHKQ-UHFFFAOYSA-N 396.538 2.720 0 50 GFAA CCOCc1nnc(NC(=O)C2CCN(C(=O)c3ccccc3F)CC2)s1 9341627 HTNDLACNGHBOKQ-UHFFFAOYSA-N 392.456 2.705 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2CCN(CC)CC2)sc2c1CCCCC2 20608815 LGKRKIHLEQGNTI-UHFFFAOYSA-N 393.553 2.770 0 50 GFAA CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)N1CCN(Cc3ccccc3)CC1)C(=O)C2 101030194 PMKBLFJSSLFUQR-GHTZIAJQSA-N 390.549 2.529 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)N[C@@H]4CCCN(C)C4)co3)ccc2s1 67869382 XBUBRSPJZXNLDA-CYBMUJFWSA-N 386.477 2.996 0 50 GFAA O=C(Nc1ccnn1C1CCN(c2ncnc3c2CCC3)CC1)c1cccnc1 67854711 XBOHNBDSUQWADS-UHFFFAOYSA-N 389.463 2.651 0 50 GFAA Cc1ccc(=O)n(CC(=O)NCc2cccnc2Oc2c(C)cccc2C)n1 67741177 ITIRIAFSQTXTMS-UHFFFAOYSA-N 378.432 2.672 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cnn2ccccc12 470717884 NJUSBYYQALREHQ-KRWDZBQOSA-N 384.386 2.534 0 50 GFAA O=C(c1ccc(-c2ccc(O)cc2)nc1)N1CCCN(c2ncccn2)CC1 67675508 UJGGXLZWISJNDO-UHFFFAOYSA-N 375.432 2.597 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCC(O)CC1 71774929 AOBLWFBEOOQNHE-UHFFFAOYSA-N 398.532 2.667 0 50 GFAA C[C@@H]1CN(Cc2cccc(CNC(=O)N3CCC(c4ccn[nH]4)CC3)c2)CCO1 157706432 DCDAGZANNVOEPL-QGZVFWFLSA-N 397.523 2.720 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N1CCC[C@H]1c1nc(-c2ccccc2)no1 77471560 JACFQSZDCGKPGD-HNNXBMFYSA-N 377.404 2.675 0 50 GFAA CC(C)c1cccc(O[C@@H](C(=O)NCCc2nc(=O)o[nH]2)c2ccccc2)c1 447633236 WNRSESDQUJQJJA-LJQANCHMSA-N 381.432 2.965 0 50 GFAA Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@H](C)c1nnnn1C 241231174 KSUGQPOEDMCYMV-CYBMUJFWSA-N 379.424 2.654 0 50 GFAA CCS(=O)(=O)CCN(C)C(=O)N[C@H](C)c1ccc2cc(OC)ccc2c1 426578844 RJKSOXYYFXPBHB-CQSZACIVSA-N 378.494 2.986 0 50 GFAA CCc1nc(-c2ccc(C(=O)N3CCCN(CC(F)(F)F)CC3)cc2)n[nH]1 178480242 BFAKWSHIRALXJZ-UHFFFAOYSA-N 381.402 2.744 0 50 GFAA CCCCc1nc(C)cc(NCCNC(=O)Nc2ccc3[nH]c(=O)oc3c2)n1 97657214 FEVKKIKYPDRPTG-UHFFFAOYSA-N 384.440 2.796 0 50 GFAA COc1ccc2c(c1)OC[C@]1(C(=O)O)CN(Cc3cc(C(C)(C)C)n[nH]3)C[C@H]21 95356104 XUASZYXWWHQWJT-IIBYNOLFSA-N 385.464 2.779 0 50 GFAA CCn1nccc1C(=O)N1C[C@@H](c2ccc(OC)cc2)[C@@H]2[C@H]1C1CCN2CC1 95385162 PMSOVEZYPUJRCS-CEWLAPEOSA-N 380.492 2.614 0 50 GFAA Cn1cc(C(=O)N2CC[C@@H](Cc3cccc(CO)c3)C2)c(=O)c2ccccc21 95373750 FRDJTLYBHLARRM-KRWDZBQOSA-N 376.456 2.736 0 50 GFAA Cc1nc(-c2cc3c(s2)CCN(C[C@H](O)CN2CCCC2=O)C3)cs1 180876854 SWYPUOUTPLOUNB-AWEZNQCLSA-N 377.535 2.521 0 50 GFAA CCN1CCN(c2cccc(NC(=O)Cn3ccc(=O)c4ccccc43)c2)CC1 184270747 XHCXJNVWVZJPIA-UHFFFAOYSA-N 390.487 2.782 0 50 GFAA Cc1cc(CC(=O)NCC2CCN(C(=O)c3cc4ccccc4o3)CC2)on1 827861839 UDWGAUIEZFNWHT-UHFFFAOYSA-N 381.432 2.940 0 50 GFAA CSCCN1CCC(NC(=O)N2CCC(O)(c3ccccc3)CC2)CC1 584893910 XKJIVYQIRCJEHW-UHFFFAOYSA-N 377.554 2.507 0 50 GFAA O=C(NCc1cnn(-c2cccc(F)c2)c1)c1ccccc1N1CCOCC1 670459520 KFTBYHPLNPLGHB-UHFFFAOYSA-N 380.423 2.778 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NC[C@@H]1CCN(c2ccccc2F)C1 952988412 NYWOWODDQYGLPX-KRWDZBQOSA-N 383.467 2.663 0 50 GFAA Cc1c(CN2CC[C@]3(O)CCN(C(=O)N4CCCC4)C[C@@H]3C2)[nH]c2ccccc12 1565525894 MTKXWTSDCHSMRR-MBSDFSHPSA-N 396.535 2.951 0 50 GFAA O=C1O[C@H]2CN(Cc3c[nH]nc3-c3ccccc3)C[C@H]2N1Cc1ccccn1 1565525418 NWOAKSPVHSWVLE-MOPGFXCFSA-N 375.432 2.677 0 50 GFAA O=C(NS(=O)(=O)N1CCCC1)c1ccc(Oc2ccc(F)c(F)c2)cc1 170626161 QEWSHZLUGWXGFZ-UHFFFAOYSA-N 382.388 2.828 0 50 GFAA Cn1cc([C@H](OC(=O)CN2C(=O)CCCc3ccccc32)C(F)(F)F)cn1 170626410 JQSBGSDUPDJERY-KRWDZBQOSA-N 381.354 2.936 0 50 GFAA Cc1cc(C[C@@H]2CN(C3CCN(c4ccc(F)c(F)c4)CC3)C[C@@H]2O)on1 1529127055 YNCKBFVLTNURQY-VLIAUNLRSA-N 377.435 2.765 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1529144027 DEIXTNZWXOJGPI-UYAOXDASSA-N 381.476 2.514 0 50 GFAA O=C(c1ccccc1-c1nn[nH]n1)N1CCC2(CC1)OCCc1sccc12 1704306517 VPWOWGAEYCAVCA-UHFFFAOYSA-N 381.461 2.632 0 50 GFAA CN(C)C[C@H]1[C@@H]2CN(C(=O)[C@@H]3CCc4sc(-c5ccncc5)nc4C3)C[C@H]12 1772819824 UWESDNISXSCDRE-VQHPVUNQSA-N 382.533 2.576 0 50 GFAA CC(=O)NCC(=O)N1C[C@@H]2CN(C3CCCCC3)C[C@]2(CCc2ccccc2)C1 1772819890 WQVSWQVUCJJHDD-XUZZJYLKSA-N 397.563 2.848 0 50 GFAA CSCC(=O)N1C[C@H]2CN(C(=O)c3ccc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772706506 QVQHGSFLQBZWGU-PGRDOPGGSA-N 397.544 2.911 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1 11753679 ZIFRSEVDVQKODQ-UHFFFAOYSA-N 397.435 2.502 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](Sc2ccc(F)cc2)CN1C1CCN(C)CC1 12135697 LPJQGHZQTHNDDW-MOPGFXCFSA-N 379.545 2.980 0 50 GFAA CC(C)c1cc(CN2CCC[C@@H](CNC(=O)c3ccc4c(c3)OCO4)C2)n[nH]1 12302938 AVQCIWMYBRXWNC-HNNXBMFYSA-N 384.480 2.904 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2cnsn2)C1)NCc1ccc(F)c(F)c1 12593187 AUBRUWCKICQHIP-GFCCVEGCSA-N 394.447 2.765 0 50 GFAA COc1ccccc1/C=C/CN1CCNC(=O)[C@@H]1CC(=O)N(C)C1CCCCC1 14970842 UQKWTAZDWXZHTH-MFUYTVRRSA-N 399.535 2.690 0 50 GFAA CNc1ncccc1CN1CCC[C@@H]1c1ccc(C(=O)NCCN(C)C)s1 19771186 LWDSLZRTIZCDAN-MRXNPFEDSA-N 387.553 2.813 0 50 GFAA c1ccc(CCCN2CC[C@]3(C2)Cn2c(nnc2-c2cccnc2)CO3)cc1 1857690213 WPYMHXBSDUFBRI-QFIPXVFZSA-N 375.476 2.948 0 50 GFAA Cc1nc(C)c(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)s1 1857722950 QWWWCXNGFPTNKT-YRNRMSPPSA-N 383.473 2.675 0 50 GFAA CC(C)(C)NC(=O)N1C[C@@H]2[C@H](CNC(=O)CC3CCCC3)[C@H]3CC[C@]2(C1)O3 1857738123 RURJNSVUMLDULF-BIZBXSGISA-N 377.529 2.670 0 50 GFAA Cc1n[nH]c(-c2ccccc2)c1NC(=O)Cn1cc(Br)ccc1=O 225416667 CDFBSNMZAWFOHR-UHFFFAOYSA-N 387.237 2.948 0 50 GFAA O=CNCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2560725 AJWAZAXPESSBGE-FQEVSTJZSA-N 396.443 2.895 0 50 GFAA in-vitro O=C(O)CC[C@@H]1CCCN(C(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)C1 237964799 BTDFASSEYOFPND-XJKSGUPXSA-N 378.856 2.796 0 50 GFAA CC(=O)N1CCN(Cc2ccccc2NC(=O)c2oc(CC3CC3)nc2C)CC1 241869009 STRZVSLXNRBFQD-UHFFFAOYSA-N 396.491 2.852 0 50 GFAA Cc1nnc2ccc(N3CCO[C@@H](c4cccc(OC(F)(F)F)c4)C3)nn12 377162177 QETPCJCVAOIXHW-CQSZACIVSA-N 379.342 2.909 0 50 GFAA Cc1nc2cc(C(=O)N3CCC4(CC3)COc3ccccc34)ccc2n1CCO 1875297708 BBACEGVAMZOTEL-UHFFFAOYSA-N 391.471 2.903 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@H]4CC(F)(F)[C@H]4C3)nn2C)cc1OC 1875298014 LWROFPIPSNAVNT-OLZOCXBDSA-N 377.391 2.832 0 50 GFAA CCOC(=O)c1sc(CCNC(=O)c2cc(CN)c(Cl)s2)nc1C 1875292397 HDBCGAMQUQFXSB-UHFFFAOYSA-N 387.914 2.774 0 50 GFAA C[C@@H]1CN(C(=O)c2cc3cnccc3[nH]2)C[C@@H]1NC(=O)c1coc(C2CCC2)n1 1875333854 NYRAXUBPEKIVTI-PXAZEXFGSA-N 393.447 2.709 0 50 GFAA Cc1csc(C(=O)NC[C@@]2(O)CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)c1 1875305695 YOAGFFKVCZDIOB-UGKGYDQZSA-N 398.528 2.944 0 50 GFAA Cn1cnc([C@H](CNc2ncnc3[nH]c(Br)cc23)N2CCCC2)c1 1875313412 NGMXPOYKYCSVHQ-ZDUSSCGKSA-N 390.289 2.703 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1cccc(-n2ccnc2)c1 1875401338 JKVGVWOLFJRZMQ-MSOLQXFVSA-N 392.463 2.803 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 784100 ZVRUOOMIMYVPQU-LJQANCHMSA-N 384.457 2.902 0 50 GFAA COc1nc(Nc2ccc(OC(F)(F)Cl)cc2)nc(N2CCOCC2)n1 3616721 CRVWGTUNFCQDRA-UHFFFAOYSA-N 387.774 2.628 0 50 GFAA CCOC(=O)c1ccc(N2CC3=C(C2=O)[C@H](c2ccccc2)NC(=O)N3C)cc1 4727959 YFHGODJIYPDRPI-IBGZPJMESA-N 391.427 2.860 0 50 GFAA O=S(=O)(Nc1ccc(-c2ccncc2)cc1)c1ccc2nc(O)nc(O)c2c1 1260616198 OPBGIIQHYNFABO-UHFFFAOYSA-N 394.412 2.904 0 50 GFAA C[C@H](O)Cn1cc(-c2nc([C@H]3COc4ccccc43)nn2C2CCC2)ccc1=O 2325880168 XOVUMWAGLFFPGA-KSSFIOAISA-N 392.459 2.737 0 50 GFAA Cc1ccc(N(CC(=O)N2CCc3ccccc3C2)S(C)(=O)=O)cc1Cl 656673 CLGYRLZHIJJHSF-UHFFFAOYSA-N 392.908 2.999 0 50 GFAA CCc1cnc(N[C@H]2CC[C@H](C(=O)NCCOc3ccccc3)C[C@@H]2OC)nc1 2356140364 GDOARHPEORNRDE-IHPCNDPISA-N 398.507 2.830 0 50 GFAA O=C(c1cccn1C1CC1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356147118 IUPSJNNYLUWFBA-SPEDKVCISA-N 385.508 2.724 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356151807 ALLJLRDBIIFQMP-FQEVSTJZSA-N 384.867 2.927 0 50 GFAA CCCC[C@H](NC(=O)[C@H](CCC)NC(=O)OCc1ccccc1)C(=O)OC 4764491 BNYZLPWEUVICEG-IRXDYDNUSA-N 378.469 2.930 0 50 GFAA Cc1n[nH]c(C)c1CCNC(=O)c1coc(CN2CCc3ccccc3C2)n1 23340578 NOFHDBIKUWAJGO-UHFFFAOYSA-N 379.464 2.545 0 50 GFAA CN(Cc1ccon1)c1ccc(C(=O)N2CCCC[C@@H]2CCn2cccn2)cn1 39455453 VMIGHWKIBZIJAZ-LJQANCHMSA-N 394.479 2.988 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1c(Cl)cccc1Cl)CCN2CC1CC1 72411316 KBFKEGGTDPYCIE-SJORKVTESA-N 389.348 2.687 0 50 GFAA C[C@H](O)C1CCN(c2cc(N3CCC([C@H](C)O)CC3)c3ccncc3n2)CC1 328590373 FDENFUXPAXJACV-HOTGVXAUSA-N 384.524 2.824 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccc4nn[nH]c4c3)CC2)cn1 328638567 PEDQJLGZZUJOKX-HNNXBMFYSA-N 379.468 2.526 0 50 GFAA C[C@H](NC(=O)c1ccnc(N2CCN(C)CC2)c1)c1ncc(-c2ccccc2)o1 125530210 BEEQHPAONVUBRQ-INIZCTEOSA-N 391.475 2.979 0 50 GFAA CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1CC[C@H](C(=O)O)C1 263302315 XAFRYDVKFGPXQO-OSMZGAPFSA-N 385.258 2.641 0 50 GFAA Cn1nc(-c2ccccn2)cc1NC(=O)Cn1cc(-c2ccc(F)cn2)cn1 48488459 PZBWVPUPXONSAM-UHFFFAOYSA-N 377.383 2.518 0 50 GFAA CCN(Cc1cccnc1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71747885 SKHMZNLODQDLBK-HXUWFJFHSA-N 398.551 2.543 0 50 GFAA CCn1c(=O)[nH]c2cc(C(=O)Nc3cc(F)ccc3NC(C)C)ccc2c1=O 173516197 XYDQQPCCWKJIOT-UHFFFAOYSA-N 384.411 2.921 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 173771046 VIIBQWLASQMVEQ-SGTLLEGYSA-N 378.467 2.913 0 50 GFAA CC(=O)Nc1cccc(NC(=O)CN(CCO)Cc2cccc(Cl)c2)c1 241644503 PRJFVLFVAJPSTA-UHFFFAOYSA-N 375.856 2.731 0 50 GFAA Cn1cc(C(=O)N2CCOC[C@H]2c2ncn(CC(F)(F)F)n2)c2ccccc21 286044943 LAGNAIZQIYRCFZ-HNNXBMFYSA-N 393.369 2.546 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@H](Cc1ccccc1)n1cnnn1 426722732 XLSNEHLIIURFEQ-FQEVSTJZSA-N 388.431 2.771 0 50 GFAA C[C@H](NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccc2c(c1)OCO2 178109823 YQEMGFCJGGLYGQ-NSHDSACASA-N 394.415 2.628 0 50 GFAA CC(=O)NCc1cc2n(n1)CCN(C(=O)[C@H](C)Oc1cc(C)ccc1C(C)C)C2 426475304 BFOMZIAXVVQGGH-INIZCTEOSA-N 398.507 2.761 0 50 GFAA CC(C)n1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)cn1 20600245 ZDRYYXYZWBGVSJ-SFHVURJKSA-N 378.467 2.811 0 50 GFAA O=C(NCCc1noc([C@H]2CCCO2)n1)Nc1ccnn1Cc1ccccc1 95502810 IBRINRAGSZZBIJ-OAHLLOKOSA-N 382.424 2.530 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)NC[C@@H]1COc2ccccc2C1 92046421 CEJMAEBNBBUZFZ-OAHLLOKOSA-N 377.444 2.939 0 50 GFAA C[C@H](CNC(=O)c1cccc(-c2cc(C(=O)NC3CC3)ccn2)c1)n1ccnc1 426581356 XBTYPQCQUYQMJB-OAHLLOKOSA-N 389.459 2.828 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C(=O)N1c1cccc(I)c1 239347187 MHPWIUHQCRHJIL-GXYBRJDSSA-N 391.208 2.849 0 50 GFAA O=C(c1cc2ncc(CCO)cn2n1)N1CCCC[C@H]1CCc1cccs1 426628116 DDJOYWLVAFDKLT-INIZCTEOSA-N 384.505 2.953 0 50 GFAA NC(=O)c1cccnc1N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95388923 ABQNIIRISCAEAG-IPMKNSEASA-N 384.430 2.525 0 50 GFAA COc1ccc(Cl)cc1NC(=O)N1CCC[C@H](CN2CCN(C)CC2)C1 96136429 XFLXRWOLBOWKBG-OAHLLOKOSA-N 380.920 2.840 0 50 GFAA O=C(COc1ccc2c(c1)CCCC2)NCc1ccnc(O[C@H]2CCOC2)c1 162834563 IGUBPSHQFXQDCN-FQEVSTJZSA-N 382.460 2.823 0 50 GFAA CC(=O)NCc1ccc(-c2ccc3ncnc(N4CCN(C)CC4)c3c2)cc1 96166305 UNPRPQBGDQLKID-UHFFFAOYSA-N 375.476 2.685 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(CN(C)C)o2)C1 95503083 MIAXXYUITRPXRN-QGZVFWFLSA-N 387.528 2.509 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 180308614 PRVJVMVBYYVSSH-KRWDZBQOSA-N 384.929 2.736 0 50 GFAA O=C(NC[C@H]1CCN(c2ccccc2F)C1)N1CCN(c2ccncc2)CC1 643441458 CMBXRAZCSWTQRO-QGZVFWFLSA-N 383.471 2.579 0 50 GFAA Cc1ncsc1NC(=O)C12C3C4C1C1C2C3C41C(=O)Nc1scnc1C 1335820317 ITUNAELWWXRGEM-UHFFFAOYSA-N 384.486 2.532 0 50 GFAA CNS(=O)(=O)c1cccc(CN[C@H](C)c2nnn(-c3ccc(C)cc3)c2C)c1 268838994 MTNMNOAPXZITKF-OAHLLOKOSA-N 399.520 2.643 0 50 GFAA C[C@@](NC(=O)C[C@H](O)Cc1ccccc1)(C(N)=O)c1cccc(C(F)(F)F)c1 390832939 XIIDQAHXMGRNRU-APWZRJJASA-N 394.393 2.516 0 50 GFAA Cc1cc(C)n(CCCNc2nc(C)nc(NCCCn3nc(C)cc3C)n2)n1 170598778 VBROCIVZPOJTDE-UHFFFAOYSA-N 397.531 2.811 0 50 GFAA O=C(c1cc2ccccc2nc1O)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565525192 KOBMKZXNYBWBET-QAPCUYQASA-N 381.476 2.656 0 50 GFAA COc1ccc([C@@H](CC(=O)NC[C@@H](C)O)c2ccc3cccnc3c2O)cc1 1848443399 OEXICGODEIUYPY-AUUYWEPGSA-N 380.444 2.968 0 50 GFAA Cc1cc(C)cc(-n2ncc3c2CCC[C@H]3NC(=O)CCN2CCCC2=O)c1 11817396 FUGOLPFDDPWMCD-LJQANCHMSA-N 380.492 2.995 0 50 GFAA CC1(C)CS(=O)(=O)N(c2ccc(Cl)c(C(=O)Nc3nccs3)c2)C1=O 12004241 LYMSLRZNTHQBAW-UHFFFAOYSA-N 399.881 2.751 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)c3ccc4c(c3)C(=O)N(C)C4=O)C2)cc1 12308197 QSZQFPNVGZYXLZ-MRXNPFEDSA-N 393.443 2.638 0 50 GFAA COc1ccc(C(=O)N2CCCCC2)cc1S(=O)(=O)N1CCCCCC1 13581643 IXVWLFCPNVFRFT-UHFFFAOYSA-N 380.510 2.886 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2F)CN(C(=O)c2cccnc2)CC1=O 14753198 GVQQAFWTWQFMLI-IBGZPJMESA-N 399.466 2.747 0 50 GFAA NC(=O)[C@@H]1CCCN1c1ccc(-c2nc(CCCc3ccccc3)no2)cn1 19148118 WBTLGHKUOUNNKV-KRWDZBQOSA-N 377.448 2.761 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@H](c4ccccc4)N4CCCN4[C@]3(C)C2=O)cc1 19169288 HADLUEXZIMKMLH-IPJJNNNSSA-N 377.444 2.621 0 50 GFAA CN=[S@]1(=O)CCC[C@@]2(CCCN2C(=O)c2cc(OC)c(C)c(OC)c2)C1 1857527975 NTBOQPCTXDZHAK-SIBVEZHUSA-N 380.510 2.879 0 50 GFAA O=C1CC2(CCN(C(=O)NCc3ccccc3)CC2)OCCN1CC1CCC1 1857694428 BOWFWDKQIHFDFU-UHFFFAOYSA-N 385.508 2.780 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4cc(F)cc(Cl)c4)[C@@H]2CC(=O)N13 1857717659 RIGQGTJQJRTGOM-FCEWJHQRSA-N 380.847 2.606 0 50 GFAA CCCc1nnc(N2C[C@H](C(=O)NCc3ccc(SC)cc3)CC2=O)s1 1857741588 ZQLSOTOAYCTYKC-CYBMUJFWSA-N 390.534 2.882 0 50 GFAA O=C(NCc1c(F)cccc1OC(F)F)N1CCC[C@H](Cn2ccnn2)C1 129436759 PQTQHSUSIJULLT-LBPRGKRZSA-N 383.374 2.640 0 50 GFAA CC[C@H](C)c1cn2c(n1)CN(C(=O)N[C@@H]1CCO[C@H]1c1ccc(O)nc1)CC2 1875392374 GCEBBGNWBZRRSC-OHNRDTAOSA-N 385.468 2.553 0 50 GFAA C=CC(=O)NCC(=O)N[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 1875301622 NENYSLLQENABGO-FQEVSTJZSA-N 386.835 2.619 0 50 GFAA CC[C@H](O)[C@H](C)C(=O)N[C@@H](CNC(=O)[C@H](C)c1ccco1)C1CCCCC1 1875344655 OIEDRSZWDYQWMF-MVJTYMMSSA-N 378.513 2.971 0 50 GFAA O=C(c1cnccn1)N1CC[C@@H](c2ccc(F)cc2)[C@H](Nc2ncccn2)C1 888103757 XORJYIAYVWRMLP-FUHWJXTLSA-N 378.411 2.516 0 50 GFAA C[C@H](C(=O)Nc1nnc(-c2cnccn2)o1)N1C(=O)c2cccc3cccc1c23 2100482573 JMRWCTUYEORJAM-LLVKDONJSA-N 386.371 2.667 0 50 GFAA O=C1CO[C@H](C(=O)NCCn2ccc3ccccc32)[C@@H](c2ccccc2Cl)N1 2100557165 XPWMBNVFBCHKPY-UXHICEINSA-N 397.862 2.667 0 50 GFAA CN(C)C(=O)c1cccnc1N1CCN(c2ccc(Br)cc2)CC1 2325756889 OCVVYIMQQZAORD-UHFFFAOYSA-N 389.297 2.873 0 50 GFAA O=C(C[C@@H](c1ccc(F)c(F)c1)C1CC1)N[C@H](C(=O)O)C1CC(C(=O)O)C1 2325877461 RMKHKPPULQDQSS-GIOFZSJBSA-N 381.375 2.529 0 50 GFAA Cc1sc2nc(CN3CCOCC3)nc(N[C@@H]3CCN[C@H]4CC[C@@H]43)c2c1C 2332239226 CWQXOJRNRLMNLK-HRCADAONSA-N 387.553 2.693 0 50 GFAA CC1(C)OB(O)c2cc(NC(=O)c3ccc(-n4cccn4)cc3Cl)ccc21 212295023 JUSVAUWJLCQPHI-UHFFFAOYSA-N 381.628 2.731 0 50 GFAA O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)NCc1ccncc1 832084 ADWLHCYCJDWCHZ-UHFFFAOYSA-N 381.457 2.593 0 50 GFAA COc1ccc(CC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc1F 2356158524 NNYRMERAJDBGCX-JOCHJYFZSA-N 398.482 2.739 0 50 GFAA COc1ccc(Cl)cc1NC(=O)C[C@H](NCCc1ccccc1)C(=O)O 2853080 JERVTSJTZVUUBF-INIZCTEOSA-N 376.840 2.963 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)CCc2nc(-c3ccccc3F)no2)C1 55413655 ZWAAJKVUNSSNQN-ZDUSSCGKSA-N 375.400 2.610 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@@H]1OC 460119138 XUZPLEIBQNYDIX-IMJJTQAJSA-N 394.269 2.761 0 50 GFAA CCc1nccn1CCCNC(=O)CCSc1ccc2c(c1)OCCO2 55054563 XVXLGIIRIWAWJJ-UHFFFAOYSA-N 375.494 2.905 0 50 GFAA CO[C@H]1CCCN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)C1 20536660 XXZZEWLZSHSHMD-FQEVSTJZSA-N 397.523 2.836 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCN(c2ccc(-n3cccn3)nn2)CC1 65364391 AJHNCNKUPZYITN-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA c1ccc(Cc2noc(CN3CCN(CCOc4ccccc4)CC3)n2)cc1 22932993 SXQLFTFCMPSKII-UHFFFAOYSA-N 378.476 2.857 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)[C@H](c1ccc(N(C)C)cc1)CC(=O)N2 65404664 VSINZPVERZPTHC-AWEZNQCLSA-N 389.477 2.607 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Cn2ccc(C(F)(F)F)n2)CC1 138823489 HDHICULSMHBVGT-UHFFFAOYSA-N 382.386 2.696 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)cc1 11932793 XQJIXQPLUZXFTR-IBGZPJMESA-N 375.432 2.819 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1cccc(Cl)c1)CC(=O)N2 33011462 MIQYVQYHNCQSMP-CYBMUJFWSA-N 379.811 2.746 0 50 GFAA C[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)CC[S@@]1=O 253424844 LEAIVVMXLVBJDW-SXBQZSJRSA-N 398.550 2.778 0 50 GFAA CC(C)Cn1ncc(C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)c1C1CC1 153621293 CWWSMNLUWDSLIE-MRXNPFEDSA-N 397.523 2.967 0 50 GFAA CCn1c(N)nc2cc(C(=O)N3CCc4[nH]c5ccc(F)cc5c4C3)cnc21 77342122 LKJDXBNXFIPVDF-UHFFFAOYSA-N 378.411 2.852 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@H]2CC(=O)N(Cc3cccc(F)c3)C2)s1 72132930 MFMPTTPBRSLFEL-AWEZNQCLSA-N 376.457 2.553 0 50 GFAA Cc1nc(C)n(C[C@H](C)C(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)n1 72409058 QQXLCASNPRDWKL-MRTVRIQXSA-N 385.556 2.644 0 50 GFAA Cc1ccc(CNC(=O)CCc2nc3cccnc3[nH]2)c(O[C@H]2CCOC2)c1 156856602 HKNWJIKQAJFRGD-INIZCTEOSA-N 380.448 2.683 0 50 GFAA COC[C@H](O)CNC(=O)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2 241719966 QREGGNGPUODLTB-OAHLLOKOSA-N 377.872 2.532 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)N[C@H]3CCc4nc(C(C)(C)C)cn4C3)cn21 333191572 SGFMQWCYKPVBPD-KGLIPLIRSA-N 391.541 2.568 0 50 GFAA O=S(=O)(NC1CCN(c2ncnc3[nH]ccc23)CC1)c1ccc(Cl)cc1 376725827 JHUBESKTOPNRFU-UHFFFAOYSA-N 391.884 2.559 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CC3(CCN(C(=O)C4CC4)CC3)C[C@H]2C(=O)O)c1 72412209 ASECGHUKRFRTCV-IBGZPJMESA-N 398.503 2.550 0 50 GFAA O=C(NCc1ccc2nsnc2c1)N1CCC(OCc2cccnc2)CC1 426369960 POSJEBBPCWZAEB-UHFFFAOYSA-N 383.477 2.977 0 50 GFAA CCCCn1c(CN2CC[C@@H](Nc3ncccn3)[C@H](O)C2)nc2ccccc21 426535265 VVDQXRMRFZGCII-IEBWSBKVSA-N 380.496 2.674 0 50 GFAA Cn1nccc1C1=CCN(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)CC1 288767336 CSRLRNAUGOBYIN-MRXNPFEDSA-N 399.882 2.678 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)N[C@@H]1CCS(=O)(=O)c3ccccc31)CCO2 289031916 JJGKYYVEKCEROB-QGZVFWFLSA-N 386.473 2.818 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2COc3c(C)cccc3C2)cc1Cl 289641818 UXXJVCUFXBHREQ-AWEZNQCLSA-N 394.880 2.889 0 50 GFAA C[C@@H](NC(=O)c1ccc(-c2cncc(C(=O)O)n2)cc1)c1nc(C2CC2)no1 426594840 LHYBBQUWNVIFST-SNVBAGLBSA-N 379.376 2.593 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)c1ccc(OC)cc1F)C[C@H]2CO 97729632 CAYVPDLEFMLPQT-INIZCTEOSA-N 378.488 2.781 0 50 GFAA C[C@@]1(c2ccccc2)CCCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)C1 92062347 KJEDYNAMDRKRBM-HXUWFJFHSA-N 386.473 2.760 0 50 GFAA CN(CCc1cnn(C)c1)C(=O)c1cnc(CSc2ccccc2)nc1O 92097291 IIALOYKIZBBODK-UHFFFAOYSA-N 383.477 2.523 0 50 GFAA COCCc1nc(CSc2nncn2C)n(-c2cccc(Cl)c2C)n1 96150521 WZTVDWCFTAACCJ-UHFFFAOYSA-N 378.889 2.839 0 50 GFAA Cc1cc(Cl)cc(Cl)c1CNC(=O)[C@H]1CCC(=O)N(CCN(C)C)C1 91445110 VLXLMPTULBERDS-ZDUSSCGKSA-N 386.323 2.718 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)c2cccc(-n3cccn3)c2)CC1 95508996 YMHRAMRTKQYWPT-UHFFFAOYSA-N 379.464 2.735 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)N1CCN(C2Cc3ccccc3C2)CC1 95508439 DAUNIKCRJRRTSG-UHFFFAOYSA-N 388.475 2.584 0 50 GFAA Cc1cccc(C[C@@H](CNC(=O)c2ccc3c(c2)NC(=O)CS3)C(=O)O)c1 299753290 XQFZWGIHKRTQHY-HNNXBMFYSA-N 384.457 2.713 0 50 GFAA COc1cccc(-n2cc([C@@H](C)NC(=O)N3CCN(CC4CC4)CC3)cn2)c1 534660506 KTGNTVUHBLDNTO-MRXNPFEDSA-N 383.496 2.679 0 50 GFAA CN(C)c1ccnc(-c2ccc(C(=O)N[C@@H](c3nccn3C)C3CC3)cc2)n1 534666255 COWANFRGSJBXTA-GOSISDBHSA-N 376.464 2.824 0 50 GFAA CCn1nc(C)c([C@@H](C)NC(=O)CCCn2nnc(-c3ccc(F)cc3)n2)c1C 823593257 FKRONDVMEQBFLS-CYBMUJFWSA-N 399.474 2.970 0 50 GFAA COc1ccc(Cl)cc1-n1nc(CC(N)=O)nc1[C@@H](C)N1CCCCC1 824746143 UVVHLQTXEDJTCG-GFCCVEGCSA-N 377.876 2.504 0 50 GFAA COc1ccc(-n2cnnc2)cc1NC(=O)c1cc(OC)c(OC)c(OC)c1 952974827 JGCVLLZNXPZSAZ-UHFFFAOYSA-N 384.392 2.554 0 50 GFAA Cc1cc(-n2cccn2)ccc1CN(Cc1cccnc1)C[C@@H]1CCC(=O)N1 952990893 XZJRQRKWUKTXLI-FQEVSTJZSA-N 375.476 2.857 0 50 GFAA CCO[C@H]1COCC[C@@H]1NC(=O)c1cc2c(C(F)(F)F)nn(C)c2s1 1565528528 IZMPTBJLICXICM-UWVGGRQHSA-N 377.388 2.577 0 50 GFAA Cc1ccc(C2(CNC(=O)N3CCS(=O)(=O)C(C)(C)C3)CCC2)cc1C 408242968 AQHITSQFIMSKQR-UHFFFAOYSA-N 378.538 2.944 0 50 GFAA O=C(NCc1ccccc1)C1CCN(C(=O)N[C@H]2COc3ccccc32)CC1 194701309 OYOZXBLOEBYARS-IBGZPJMESA-N 379.460 2.858 0 50 GFAA Cc1ccc(F)c(C(=O)NCC2CCN(C[C@@H]3COCCO3)CC2)c1Cl 1506421464 JUZRYRCORUCWHG-OAHLLOKOSA-N 384.879 2.645 0 50 GFAA CN(C(=O)c1ccc(-c2noc(C3CC3)n2)cc1)[C@H]1C[C@H]2CNC(=O)C[C@H]2C1 1704337942 IUGOHBVIIKVCAC-IXDOHACOSA-N 380.448 2.601 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C[C@H]2CCC(=O)N(C)C2)CC1 1800414647 VNTIQJGLGOUBPJ-KRWDZBQOSA-N 379.932 2.513 0 50 GFAA CN1CC[C@]2(C(=O)NC3CCC3)CCCN(C(=O)c3cccc4cc[nH]c34)[C@H]2C1 1775981121 ACKIVPWSUHFMHE-WMZHIEFXSA-N 394.519 2.763 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)NCCNc2ccc(Nc3ccncc3)nn2)c1 11697858 VEOPKKLTCVBTTQ-UHFFFAOYSA-N 398.492 2.622 0 50 GFAA Cc1ccc(N2C[C@H](c3nnc(NC(=O)[C@H]4CCCO4)s3)CC2=O)cc1C 12862836 YHRQQZAGTRGURR-UKRRQHHQSA-N 386.477 2.793 0 50 GFAA O=C(Nc1nncs1)[C@@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 13944777 QUFHMDVRGVEQPY-LLVKDONJSA-N 389.868 2.703 0 50 GFAA O=S(=O)(N[C@@H]1c2cccc3cccc(c23)[C@@H]1N1CCNCC1)c1ccccc1 19810991 DFHHBGRWPZJXGB-YADHBBJMSA-N 393.512 2.819 0 50 GFAA O=C(c1ccccc1F)N1CCC[C@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169777765 CJCISKSQJOJDHL-ZDUSSCGKSA-N 382.399 2.822 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(Cc4cccc(F)c4)CC3)n[nH]c21 1857529049 HLTVBJUJFOHPQS-KGLIPLIRSA-N 387.455 2.781 0 50 GFAA CN(CCn1cnc2ccccc21)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C 1857678684 KLTQFOHQVFODNM-FOIQADDNSA-N 389.521 2.693 0 50 GFAA O=C(CCn1ccccc1=O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857728376 YXFSDWOGLAXTBF-WOJBJXKFSA-N 396.487 2.512 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N(C)Cc4cc(C)on4)CC3=O)sc2c1 1857731799 PBLABDZEPZDGKF-CYBMUJFWSA-N 384.461 2.913 0 50 GFAA O=C(c1cnc[nH]1)N1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NC2CCC2)C1 1875242818 CXYUFKOFZZWPID-QFIPXVFZSA-N 392.507 2.584 0 50 GFAA C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 158181272 BHSDYVHYUFRWHR-AWEZNQCLSA-N 396.878 2.982 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CC[C@]2(C[C@@H](O)c3ccccc3O2)C1 818410062 XZYGRDZQYNIXAO-HFXUHXBXSA-N 392.455 2.527 0 50 GFAA O=C(N[C@H]1CCC[C@@H](C(=O)O)C1)NC1(Cc2ccc(F)cc2)CCOCC1 1875291701 IWUKDUJONZWGAN-WBVHZDCISA-N 378.444 2.860 0 50 GFAA NS(=O)(=O)C[C@H]1CCN(C(=O)c2ccc(Sc3ccccc3)cc2)C1 1875327217 PGUTUFSWTQISCE-AWEZNQCLSA-N 376.503 2.588 0 50 GFAA O=C([C@H]1Cc2ccccc21)N1CCCN(Cc2ncnn2-c2ccccc2)CC1 1875325941 HDTQBFUGMMECHS-NRFANRHFSA-N 387.487 2.642 0 50 GFAA CN(C)c1c(F)cc(NC(=O)N2C[C@@H](O)C[C@@H]2c2nc(C3CC3)no2)cc1F 1875301884 USYWSXQBRXYZCL-SMDDNHRTSA-N 393.394 2.631 0 50 GFAA Cc1cccc(F)c1-n1nc(C(=O)Nc2nccn(C3CC3)c2=O)c2c1CCC2 886085683 KHTWSCRKRJAUKS-UHFFFAOYSA-N 393.422 2.952 0 50 GFAA CCCN1C(=O)[C@]2(CCN(C(=O)Cc3cn4ccsc4n3)C2)c2ccccc21 2100540544 LHNULYLVMMPELV-NRFANRHFSA-N 394.500 2.865 0 50 GFAA CCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc2ccccc12 796306 URJZGSNAIPCDIZ-UHFFFAOYSA-N 380.473 2.747 0 50 GFAA C[C@@H](C(=O)N1CCN(c2ccccc2Cl)CC1)N1C(=O)c2ccccc2C1=O 1029022 LWDOSUNYENFPLM-AWEZNQCLSA-N 397.862 2.673 0 50 GFAA COc1ccc(NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(C)=O)cc1OC 1061329 LHIDERXJRPKMPO-GOSISDBHSA-N 381.432 2.871 0 50 GFAA CCC[C@H](C)NS(=O)(=O)c1ccc(OC)c(I)c1 1076607 FDAATYAJXWAPLP-VIFPVBQESA-N 383.251 2.767 0 50 GFAA N#Cc1c(C(F)(F)F)cc(-c2ccccc2)nc1SCC(=O)NCC(=O)O 2313729 GADQCYQRLBILDW-UHFFFAOYSA-N 395.362 2.932 0 50 GFAA CN(C(=O)c1ccc2nc(C(F)(F)F)[nH]c2c1)[C@@H]1C[C@@H]2CNC(=O)C[C@@H]2C1 2356144827 NQPCUYGAFYLNLR-TUAOUCFPSA-N 380.370 2.568 0 50 GFAA Cc1ccc(OCC(=O)N(Cc2ccc(F)cc2)[C@H]2CCS(=O)(=O)C2)cc1 4866349 FLQQTVHFBZUDDS-SFHVURJKSA-N 391.464 2.729 0 50 GFAA Cc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 222034231 XADIRNBALBQSRL-XJKSGUPXSA-N 382.913 2.812 0 50 GFAA CN[C@H]1CCCN(C(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)C1 133272509 ZWLUGJYWWWUJDX-HNNXBMFYSA-N 395.429 2.656 0 50 GFAA O=C([C@H]1CCCO1)N1CCN(C(=S)Nc2ccccc2C(F)(F)F)CC1 8682703 ZQWDGNPUZKZRDO-CQSZACIVSA-N 387.427 2.725 0 50 GFAA NC(=O)c1cccnc1N1CCC(n2cc(-c3ccccc3Cl)nn2)CC1 55060544 GGHNXIIPWYKXSZ-UHFFFAOYSA-N 382.855 2.934 0 50 GFAA Cc1c(Cl)cccc1NC(=O)N1CCN(c2cc(-n3cccn3)ncn2)CC1 23144592 FWXPXMAQKONPNN-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA CN1CCC(N(C)[C@H]2CCCC[C@H]2N(C)S(=O)(=O)c2cccs2)CC1 246467086 JIQYLUJAPCZVLK-DLBZAZTESA-N 385.599 2.706 0 50 GFAA O=S(=O)(c1ccc(Cl)s1)N1CCCN(CC[C@H]2CCCO2)CC1 248933746 BQNGYOZWJBVZJJ-CYBMUJFWSA-N 378.947 2.667 0 50 GFAA NC(=O)c1ccc(NC(=O)CCCNC(=O)c2ccc(Cl)cc2)c(F)c1 467496128 QYNOFHLQHAHRGI-UHFFFAOYSA-N 377.803 2.727 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c1 65363878 INCSPKZAFRBJHC-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cc1ncc(-c2cc(C(=O)N3CCN(C)C(=O)[C@@H]3C)c3cccc(C)c3n2)cn1 63845244 RDCTWVRKGHOTHX-AWEZNQCLSA-N 389.459 2.611 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1ccccc1Cl)CC(=O)N2 33011458 HFKQOBZSTCJBGT-GFCCVEGCSA-N 379.811 2.746 0 50 GFAA CC[C@H]1CN(c2ccc(S(C)(=O)=O)cc2C(F)(F)F)CCN1CCOC 253418201 WPDPGTZEEMNHMF-ZDUSSCGKSA-N 394.459 2.656 0 50 GFAA COc1ccc2cc(NC(=O)[C@H]3OCC(=O)N(C)[C@@H]3c3ccccc3)ccc2n1 435736897 CICCPNCWDGGDRF-RTWAWAEBSA-N 391.427 2.780 0 50 GFAA Cc1cc(C)cc(OCc2noc(CN3CCN(Cc4ccon4)CC3)n2)c1 156987142 KSYIUIJGUUJWRN-UHFFFAOYSA-N 383.452 2.571 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cc(Cl)sc1Cl 129439476 BGISAMVESSIQET-ZETCQYMHSA-N 397.309 2.606 0 50 GFAA CCN1CCN(C2CCN(C(=O)N[C@@H](C)Cc3ccccc3F)CC2)C1=O 374589952 CPALZNUILATFOE-HNNXBMFYSA-N 376.476 2.688 0 50 GFAA Cn1cc([C@@H](NC(=O)c2ccc(CN3CCCCC3)cc2)C2CC(O)C2)cn1 218982914 YYXNIKSQVDIFHW-MNLRITNHSA-N 382.508 2.648 0 50 GFAA CC(=O)N1CC2(CCN(CCOc3ccc(Cl)cc3)CC2)C[C@H]1C(=O)O 72146351 QTQOOIFWJUQVMJ-KRWDZBQOSA-N 380.872 2.506 0 50 GFAA O=C(NCCc1csc(N2CCCC2)n1)Nc1cccc(-n2ccnn2)c1 130577970 QKCGGCZOYXWBSW-UHFFFAOYSA-N 383.481 2.688 0 50 GFAA O=C(NC[C@H]1CCCCN1S(=O)(=O)c1c[nH]c2ncccc12)c1ccccc1 175341117 PAKOCEBJNVSUQO-MRXNPFEDSA-N 398.488 2.536 0 50 GFAA Cc1ccc(N2C[C@@H](NC(=O)c3cc(O)nc4cc(F)ccc34)CC2=O)cc1 426612539 OMWNYWJWEJCKGG-AWEZNQCLSA-N 379.391 2.923 0 50 GFAA O=C(Cn1nccc1[C@@H]1CCCNC1)NCc1nc(-c2ccccc2)cs1 426430571 BNDZKKUNPXEHPS-MRXNPFEDSA-N 381.505 2.790 0 50 GFAA O=C(N[C@@H]1COCC[C@H]1Oc1ccc(CO)cc1)c1ccnc2ccccc12 220360395 HSWRESFOSNGPNO-NHCUHLMSSA-N 378.428 2.693 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3nnc(-c4cccc(Cl)c4)s3)C[C@H]21 499180362 OZQQHCKLJLXJPA-ZIAGYGMSSA-N 393.900 2.795 0 50 GFAA CCN1C[C@@]2(CCCN(C(=O)c3ccc(-c4ccccc4)[nH]c3=O)C2)CCC1=O 82115841 QZKADBXBZSIAPF-HSZRJFAPSA-N 393.487 2.907 0 50 GFAA Cc1ccc2nc(-c3cccnc3)cc(C(=O)NCCN3CCOCC3)c2c1 20407712 LWSFUBWASLYHOX-UHFFFAOYSA-N 376.460 2.667 0 50 GFAA Cc1cccc(-c2noc(CCCC(=O)NC(C)(C)c3nnc(N)s3)n2)c1 426598846 JNEOUZOYDAHRDG-UHFFFAOYSA-N 386.481 2.853 0 50 GFAA CCCCS(=O)(=O)N1C[C@@H](c2ccc(OC)cc2)[C@@H]2[C@H]1C1CCN2CC1 95360921 QWPZCRYYJADJMR-XUVXKRRUSA-N 378.538 2.687 0 50 GFAA C[C@H](Cc1cnccn1)NC(=O)Nc1cc(N2CCOCC2)ccc1Cl 96141763 WTVYLCVKZRVZJJ-CYBMUJFWSA-N 375.860 2.719 0 50 GFAA CCOc1cccc(CN2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)c1 230145557 LDKCTYFSNXYERN-HSZRJFAPSA-N 385.552 2.994 0 50 GFAA COc1ccc(CN2CC(c3ccccn3)C2)c(OC[C@@H](O)CN2CCCC2)c1 95519279 LIEVLRUSRVPXHJ-FQEVSTJZSA-N 397.519 2.525 0 50 GFAA COC(=O)c1ccccc1-c1cccc(C(=O)N2CCNC(=O)[C@@H]2C(C)C)c1 426593785 ODZAFAFKVXOIMW-IBGZPJMESA-N 380.444 2.737 0 50 GFAA O=C(NCc1ncnn1-c1ccccc1)N1CCCN2c3ccccc3C[C@@H]2C1 292704352 YKPSIRNBRCNIPH-LJQANCHMSA-N 388.475 2.614 0 50 GFAA Cc1nn(C)c(NC(=O)N2CCC[C@@]3(CC2)CNC(=O)O3)c1-c1ccccc1 95522031 JNAAFQVIHSBTLX-HXUWFJFHSA-N 383.452 2.892 0 50 GFAA COc1cc(C(=O)NC[C@@H](C)O)ccc1OC1CCN(C2CCCC2)CC1 95511059 PEHSKDMEFBRALQ-OAHLLOKOSA-N 376.497 2.592 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(c2cc(N3CCCC3)cnn2)C1 95496965 ZZHUPXLDFDYBEK-GOSISDBHSA-N 383.544 2.609 0 50 GFAA COc1cccc2c1OC[C@@]1(C(=O)O)CN(CCC(F)(F)C(F)F)C[C@@H]21 1073369744 AANICPCFEASWED-ZBEGNZNMSA-N 377.334 2.848 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C1 299740379 ZCHLWNAFOZCNOT-ZDUSSCGKSA-N 377.286 2.625 0 50 GFAA c1ccc(Cc2nnc3n2CCN(Cc2nnc(-c4ccco4)o2)CC3)cc1 252491994 MATMFOJLVDVUFC-UHFFFAOYSA-N 376.420 2.570 0 50 GFAA COc1cccc(CN[C@@H]2CNC(=O)c3cc(-c4ccc(C)cc4)nn32)c1OC 263618735 VFZPKHPNJSPPRL-FQEVSTJZSA-N 392.459 2.908 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2csc(-c3ccccc3)n2)C1 276643915 XVXGLKCFYFCEGW-HNNXBMFYSA-N 394.504 2.529 0 50 GFAA O=C(NC1CCN(c2cccnn2)CC1)N[C@@H]1CCCN(c2ccccc2F)C1 277512020 QRBKGKCSNHAUCS-QGZVFWFLSA-N 398.486 2.553 0 50 GFAA Cc1cn(-c2ccccc2)nc1C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 186655665 GHHXNGRAEVQJQH-IBGZPJMESA-N 388.471 2.959 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCCN(c3nc4ccccc4s3)CC2)cn1C 1506422577 DAIFSKLAUGZTAI-UHFFFAOYSA-N 382.489 2.656 0 50 GFAA COCCN1C[C@@H](CNC2CCN(c3ccc(C)c(Cl)c3)CC2)CC1=O 1506411011 GUXMCFHLFOVSHU-MRXNPFEDSA-N 379.932 2.702 0 50 GFAA Cc1cc(N2CCC[C@H](CNC(=O)c3cc(-c4ccccc4)no3)C2)nc(N)n1 1506418600 SYFCMFIIMRJIPM-OAHLLOKOSA-N 392.463 2.669 0 50 GFAA Cc1cc(O)nc(S[C@H](C)C(=O)N2CCCN(Cc3cccs3)CC2)n1 1506403393 OIUXOWQLUVGVMX-CQSZACIVSA-N 392.550 2.767 0 50 GFAA CN(CC(=O)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1)Cc1ccccc1 1704355532 PXRNTIAKFDHCGA-NFBKMPQASA-N 389.499 2.729 0 50 GFAA Fc1cnc(N2CCC3(CC2)OCCc2sccc23)nc1N1CCOCC1 1704311249 BDMXPGFDTXWZHH-UHFFFAOYSA-N 390.484 2.582 0 50 GFAA CCc1c(C)nn(CC(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)c1C 1704352176 QYEITJSVLCZJOW-GCJKJVERSA-N 392.503 2.673 0 50 GFAA CC[C@H]1[C@@H]2OC(=O)[C@H](C)[C@H]2[C@H]2C[C@@H]([C@@H]3C[C@H](C)C(=O)O3)N3[C@@H]4CCC[C@H]1[C@]23O4 1772820092 RRHMLMRBONYJOT-LVGGMOBISA-N 389.492 2.699 0 50 GFAA Cc1cc(=O)n2nc(N3CCC[C@@H](C(=O)N[C@@H](C)c4ccccc4)C3)sc2n1 5149064 FJKVGYLFYFQGGM-GOEBONIOSA-N 397.504 2.553 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)NCCCc2cccnc2)CCC1=O 11821149 AICQBYXYUVDYMG-IBGZPJMESA-N 381.476 2.578 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)CC[C@@]2(Cc3ccsc3)CCC(=O)N2)C1 12244079 AQIXFVNJTIAVKO-OXQOHEQNSA-N 392.521 2.521 0 50 GFAA CC(C)OCCCN[C@H]1CCc2c(c(C(=O)N(C)C)nn2Cc2ccccc2)C1 14535743 PSVXRUZDCACXFY-IBGZPJMESA-N 398.551 2.895 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)NCc1cc(C)cc(OC)c1 1857529539 VPMPMPVKBZUCGN-RBDMOPTHSA-N 383.492 2.831 0 50 GFAA CCc1nccn1CCC(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857666980 BLOWBWDVAGZGGK-UHFFFAOYSA-N 377.492 2.864 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)Nc2ccc3c(c2)OCO3)[C@H]1c1ccccc1 1857683652 YPAJRPOCHONSOS-PMACEKPBSA-N 383.448 2.951 0 50 GFAA Cc1cccc(CN2CCC3(CC2)CC(=O)N(C[C@@H]2CCCCO2)CCO3)n1 1857694402 AMMJGKBFRNIRPB-FQEVSTJZSA-N 387.524 2.543 0 50 GFAA Cc1cncc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)c1 1857731591 LBOWTWUOKMGMPC-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA O=C(NCCc1ccccc1)[C@@]12CCCCN1C[C@@H](NC1CCSCC1)C2 1875247375 KVNBIVGJJBDSQG-UNMCSNQZSA-N 387.593 2.828 0 50 GFAA CCCCc1ccc(NC(=O)CSc2nc(C)c(CCO)c(=O)[nH]2)cc1 11905688 SZPBTWFDAKHDLU-UHFFFAOYSA-N 375.494 2.687 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)N[C@H](C)Cc2ccsc2)c1=O 14982696 WXBUZWDPJOBSHI-CQSZACIVSA-N 389.521 2.677 0 50 GFAA O=C(NCc1cccc(-n2cncn2)c1)[C@H]1CCCN(Cc2ccccc2)C1 265513735 AYUJBFHGHLUZFS-FQEVSTJZSA-N 375.476 2.796 0 50 GFAA CC(=O)NCCCC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704342478 DBLRIWNDHGFLAL-QHCPKHFHSA-N 392.503 2.866 0 50 GFAA COC(=O)C[C@@H]1Cc2ccccc2CN1C(=O)c1ccc2c(O)nc(C)nc2c1 1875297779 CVDIDAYRRMKZHZ-KRWDZBQOSA-N 391.427 2.774 0 50 GFAA Cn1c([C@@H]2CCc3c[nH]nc3C2)nnc1N1CCC(c2ncc(Cl)cn2)CC1 1875277018 WQSIVKJEPVHPRP-CYBMUJFWSA-N 398.902 2.638 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1cc(Oc2ccccc2)ccn1 1875402666 JOUXRDWHUYPTJZ-XFQXTVEOSA-N 378.432 2.640 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)Cc1cc(-c2ccccc2)on1 1875400911 CFCLRBXAYOPQCP-VQIMIIECSA-N 393.447 2.718 0 50 GFAA Cc1nc([C@H](C)NC(=O)N2CCc3ccc(S(C)(=O)=O)cc3CC2)cs1 888102331 RZGZJUZSNPYYIX-LBPRGKRZSA-N 393.534 2.726 0 50 GFAA CC[C@@H](C(=O)N[C@H]1CC[C@H](NC(=O)[C@@H](CC(C)C)OC)CC1)N(CC)CC 1775986879 NIYLAKDBPFDGFB-CADBVGFASA-N 383.577 2.712 0 50 GFAA O=C([C@@H]1CCC[C@@H](CC(F)(F)F)C1)N(CCc1nn[nH]n1)Cc1cccnc1 2325808221 GKIDLLFPAPUTRI-UKRRQHHQSA-N 396.417 2.925 0 50 GFAA CCOc1ccc(-n2nnnc2SCC(=O)Nc2ccc(OC)cc2)cc1 625996 YXSMOYYOCLLKLE-UHFFFAOYSA-N 385.449 2.800 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2ncccn2)sc(C(C)=O)c1C 2502666 ZHBDRPYHCSKZOF-UHFFFAOYSA-N 379.463 2.957 0 50 GFAA CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1-c1ccncc1 2842939 ROXDRWJYIGUQSV-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc3c(cc2C)N(C(C)=O)CCO3)cc1 6779586 LMIIRLVMNBQHOO-UHFFFAOYSA-N 376.434 2.550 0 50 GFAA Cc1c(Cl)cccc1NC(=S)NCCc1ccc(S(N)(=O)=O)cc1 8689994 FDYWZBZWPRQWEJ-UHFFFAOYSA-N 383.926 2.825 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)N[C@@H]2CCc3cc(Cl)ccc32)CC1 171193810 PHVJEELLEYYFHU-LJQANCHMSA-N 399.926 2.974 0 50 GFAA COc1ccccc1-n1cc(CN2CCN(C3CCCC3)[C@@H](CCO)C2)cn1 20418660 PAUAUIWDDIYZAM-FQEVSTJZSA-N 384.524 2.692 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CCC[C@H]2c2ccc(C(N)=O)s2)c1C 23398409 KYGDLEUNTIADOO-AWEZNQCLSA-N 388.493 2.617 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)N2CCN(c3ccc(F)cc3)CC2)CC1 59749426 ZKQBUCQYQANWFO-UHFFFAOYSA-N 390.503 2.648 0 50 GFAA Cc1cc(CNc2ccc(C(=O)N(C)C[C@H]3COc4ccccc4O3)cn2)on1 67967326 LDRUQKJJQZXUJR-KRWDZBQOSA-N 394.431 2.902 0 50 GFAA Cc1nn(CCCNC(=O)c2cc(C(C)C)n3ncnc3n2)c(C)c1Cl 216343025 WUWJHUIPPDLVEF-UHFFFAOYSA-N 375.864 2.535 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(Cc3csc(C4CCCC4)n3)C2=O)nn1 328611643 MFAOQAFWMIOAPE-HNNXBMFYSA-N 388.497 2.841 0 50 GFAA O=C(Cc1ccc(Br)cc1)N1CCC(N2CCCCC2=O)CC1 120498084 YKRVLICSMIANGB-UHFFFAOYSA-N 379.298 2.995 0 50 GFAA O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C(=O)[C@@H](O)Cc2ccccc2)C1 474946582 NCIWXBLVLCQVCR-RDJZCZTQSA-N 387.867 2.516 0 50 GFAA COCCN(C)C[C@@H]1CCCN1CC(=O)N[C@H](c1ccc(F)cc1)C(C)C 230134385 WSBRVSMVKAYGAI-FPOVZHCZSA-N 379.520 2.682 0 50 GFAA O=C(c1cccnc1)N1CCc2c(ncnc2NCCOc2ccccc2)C1 71738576 CKIPOMLNZAXRIZ-UHFFFAOYSA-N 375.432 2.561 0 50 GFAA COc1ccc(Cl)cc1-c1nnc2sc(-c3ccn4nnnc4c3)nn12 65356324 INOPNMULNHRKLS-UHFFFAOYSA-N 384.812 2.620 0 50 GFAA Cc1cnn(C2(C(=O)O)CCN(Cc3cnc(-c4cccs4)nc3)CC2)c1 77340288 OVBHCSQECPHTAC-UHFFFAOYSA-N 383.477 2.786 0 50 GFAA CC(C)[C@H](CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1)Cc1ccccc1 241338585 MCBBCEPKTNNUNC-KRWDZBQOSA-N 395.546 2.883 0 50 GFAA Cc1nc2c(c(C)c1CCC(=O)N1CC[C@H](Nc3ccccc3)C1)c(=O)[nH]n2C 174696931 UDGJUUWHKQZGAE-KRWDZBQOSA-N 393.491 2.524 0 50 GFAA O=C(CCN1CCCCC1=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 220471086 JGEFCDDGZFQECZ-CWZMJNCASA-N 381.476 2.566 0 50 GFAA Cn1cc(SCC(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)c2ccccc21 426500298 OUYUMSMGAXRSKC-CQSZACIVSA-N 380.535 2.554 0 50 GFAA O=C(O)[C@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cnn(Cc2cccc3ccccc23)c1 225747429 NGEGGVYNURDQQT-ZRNYENFQSA-N 389.411 2.677 0 50 GFAA CN1CCN(C(=O)c2cnn3c(C(F)F)cc(-c4ccc(F)cc4)nc23)CC1 20601873 FBTYWSZKLHCFFU-UHFFFAOYSA-N 389.381 2.861 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)NC[C@H]2CCCOC2)CC1 95512803 ALMOFTKOPIPFGT-OAHLLOKOSA-N 394.899 2.886 0 50 GFAA Cc1[nH]nc(CCC(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)c1C 97743079 PPWPQPBYNBLLFM-UHFFFAOYSA-N 375.517 2.582 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@@H]1CCCN1)CC2 95530009 NQPNSSHFOBRWFT-FQEVSTJZSA-N 381.451 2.644 0 50 GFAA CSc1ccccc1C(=O)N[C@@H]1CCN(Cc2csc(C)n2)C[C@H]1O 426436538 IVUKACJBINFNER-HZPDHXFCSA-N 377.535 2.539 0 50 GFAA O=C(CC(=O)N1CCC(c2noc3cc(F)ccc23)CC1)NCC(F)(F)F 290994694 STUDWGKBSRZOOU-UHFFFAOYSA-N 387.333 2.742 0 50 GFAA CNS(=O)(=O)c1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1OC 96142095 OPQMXSOQIOVFNB-INIZCTEOSA-N 389.477 2.972 0 50 GFAA C[C@H](O)C(=O)N1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95530070 IAGFVFQQEJHNIT-SFHVURJKSA-N 386.536 2.867 0 50 GFAA Cc1nc(-c2ncc(C(=O)NC[C@@H](C)N(C)c3ccccc3)c(O)n2)cs1 91663863 VGZVLIQKYHANFU-GFCCVEGCSA-N 383.477 2.869 0 50 GFAA CC(C)n1cnnc1CN1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91908008 IBHRHEINKQPBGX-UHFFFAOYSA-N 382.512 2.659 0 50 GFAA CN1CCN(C(=O)Nc2cn(C)nc2C2CCCCC2)C[C@@H]1c1nccn1C 296697290 ANNLNQXBIRNSLC-QGZVFWFLSA-N 385.516 2.722 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 269611165 FGLUKKMWZYHERX-NXEZZACHSA-N 381.723 2.850 0 50 GFAA CN(C)Cc1nc(N2CC[C@H](CO)[C@H](O)C2)c2c(-c3ccccc3)csc2n1 170091016 MANSNGNSLWLXQE-NVXWUHKLSA-N 398.532 2.599 0 50 GFAA Cc1nc(C[C@H]2CCCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)C2)no1 170616841 INPCZXPBOHDWBT-NHCUHLMSSA-N 384.524 2.924 0 50 GFAA COc1ccccc1[C@@H]1CCCN1C(=O)NC[C@H](C(C)C)N1CCN(C)CC1 170838733 VPAFFAOJOMWKDO-VQTJNVASSA-N 388.556 2.814 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@]3(C2)C(=O)Nc2ccccc23)nc(O)n1 1506424253 KATQMROLKDUAII-OAQYLSRUSA-N 380.448 2.507 0 50 GFAA CCOC(=O)N1CCC(N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)CC1 1529152439 TUYUAXQCCBMHPU-DYESRHJHSA-N 383.492 2.691 0 50 GFAA CC(C)Cn1cc(C(=O)NC(C)C)c(=O)c(C(=O)N(C)Cc2cccs2)c1 11910415 UAXGPFLICUHXDC-UHFFFAOYSA-N 389.521 2.976 0 50 GFAA CCN(CC)C(=O)c1cn([C@@H]2CCCN(Cc3ccc(F)cc3F)C2)nn1 12218519 ODFLTEGIIVDJAE-MRXNPFEDSA-N 377.439 2.875 0 50 GFAA COCC(=O)N1CCC(Oc2ccc(C(=O)NCCc3ccccc3)cc2)CC1 14957609 BKKHIHPYSZEVKR-UHFFFAOYSA-N 396.487 2.675 0 50 GFAA Nc1cc(N)nc(S[C@@H](C(=O)NCc2ccc(F)cc2)c2ccccc2)n1 19926859 RAXUVRKQYAUBFI-QGZVFWFLSA-N 383.452 2.930 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4ccc(F)cc4Cl)CC3)nn2)n1 169777293 JHXLJQFPUGAOIR-UHFFFAOYSA-N 390.806 2.906 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)CCc4ccccc4)nnc23)n1 169780484 LKVUHSYWQIRRSD-UHFFFAOYSA-N 376.420 2.591 0 50 GFAA COc1cccc(OC)c1C(=O)N1CCCN(C(=O)Cc2cccs2)CC1 169845001 XZBCTVYNYCWXHQ-UHFFFAOYSA-N 388.489 2.683 0 50 GFAA Cc1ccccc1N1CCC[C@@H](NC(=O)c2ccnc(N3CCCCC3)n2)C1=O 1857532498 LFCFJKMDZAWYEE-GOSISDBHSA-N 393.491 2.701 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ccc(O)cn3)C1)CC2 1857714173 URPDXQWGBCMSKC-OAQYLSRUSA-N 382.464 2.701 0 50 GFAA COc1ccccc1OCC(=O)N1CCO[C@@H](CN(C)C)[C@@H]1c1ccccc1 1857722459 IYSVEPWNRHXXHI-UNMCSNQZSA-N 384.476 2.604 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3csc(-c4cccs4)n3)C[C@@H]2O)on1 1857737599 ULIAGAWOKDOJKZ-RISCZKNCSA-N 375.475 2.844 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)C1 328646982 SZQUXPBUGUQDCE-INIZCTEOSA-N 395.438 2.804 0 50 GFAA CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCO[C@H](CC(=O)O)C1 237019350 ZDMILKFNYBDYTC-DZGCQCFKSA-N 384.270 2.720 0 50 GFAA COCc1ccc(C(=O)NC[C@@H]2Cc3cc(-c4ccc(OC)nn4)ccc3O2)o1 12150141 LXITWQWDVITZQM-INIZCTEOSA-N 395.415 2.625 0 50 GFAA COc1ccc(C2=NN(C(C)=O)[C@@H](c3ccccc3NS(C)(=O)=O)C2)cc1 252509753 YUUPSKYXZPFKQM-LJQANCHMSA-N 387.461 2.764 0 50 GFAA C[C@@H](Oc1cccc(CO)c1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 162848182 LMXJTXVKSLBWGM-QGZVFWFLSA-N 396.487 2.615 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2F)CN(C(=O)[C@@H]2C[C@@]23CCNC3)C1 952892723 BWYOFYWDILBMGR-KSFYIVLOSA-N 382.483 2.922 0 50 GFAA Cc1nccc(=NCC2CCN(C(=O)c3cc(Cl)c(Cl)n3C)CC2)[nH]1 1875309342 IZLCNIDUQUYJSH-UHFFFAOYSA-N 382.295 2.817 0 50 GFAA C[C@H](O)c1cn(Cc2ccc(C(=O)N[C@@H](Cc3ccccc3)C3CC3)o2)nn1 1875317592 DTKKENSILILUKG-KSSFIOAISA-N 380.448 2.724 0 50 GFAA Cc1cc(Cl)cc(C(=O)N2CC3(CN(C)C[C@H]3c3ccnc(N(C)C)n3)C2)c1 1875395443 CJTUKOOQVSIQHY-KRWDZBQOSA-N 399.926 2.676 0 50 GFAA C=CC(=O)N1CCN(C(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)[C@@H](C)C1 1875381125 KYXKOAFRCOEBLF-HNNXBMFYSA-N 387.480 2.821 0 50 GFAA NC(=O)C1CCC2(CC1)CC(NC(=O)c1nc(C(F)(F)F)n3c1CCCC3)C2 1875300398 BMHDVRAAMLPZGQ-UHFFFAOYSA-N 398.429 2.792 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)cc(O)n1 2100482806 AAIMOVKQPZITDM-HSZRJFAPSA-N 393.487 2.936 0 50 GFAA CC(C)[C@H]1CC(=O)c2nc(NC(=O)c3ccc4c(c3)N(C)C(=O)CO4)oc2C1 2100545360 QSGWIHMKQDXCMH-LBPRGKRZSA-N 383.404 2.683 0 50 GFAA CC[C@]1(C)Cc2c(c(N3CCOCC3)nc3sc4c(=O)[nH]cnc4c23)CO1 18187751 IRXSIBLJBNTOAF-LJQANCHMSA-N 386.477 2.611 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1nc(C(F)(F)F)n2ccccc12)C1CC(F)(F)C1 2325788467 IJUNGNUZJBSAQW-SECBINFHSA-N 391.296 2.972 0 50 GFAA Cc1nc2ccc(C(=O)N3CCC[C@@]4(CCc5c[nH]c(=N)nc54)C3)cc2nc1C 2356144234 ODJCXVXZBFVDDD-JOCHJYFZSA-N 388.475 2.569 0 50 GFAA COc1ccc(S(=O)(=O)NCc2nc(-c3ccc(Cl)cc3)no2)cc1 4838125 ZQNXKKIJYWIKRW-UHFFFAOYSA-N 379.825 2.877 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C(=O)COc3ccccc32)sc(C)c1C 8390935 USALIFPWSUOCMT-UHFFFAOYSA-N 388.445 2.906 0 50 GFAA COc1ccccc1/C=C(/C(=O)NC[C@H](CO)[C@H]1CCOC1)c1ccccc1 225488581 URBRQVCTHMKOTI-LFQSBUTJSA-N 381.472 2.997 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@H](O)[C@@H]1/C=C/[C@H](O)COc1ccccc1 27640255 LYXKJZCRLQWIIN-MLSROPDHSA-N 388.460 2.750 0 50 GFAA in-vitro CCC1CCN(C[C@@]2(O)CCCN(Cc3cc(OC)ccc3F)C2=O)CC1 67563182 QXSIRQXJKXHYEN-NRFANRHFSA-N 378.488 2.810 0 50 GFAA COc1c(F)ccc(C(=O)N2CC[C@@H](c3ccc4c(c3)OCO4)[C@H](O)C2)c1F 65405867 ZSEQFZNZQYJPRP-SWLSCSKDSA-N 391.370 2.693 0 50 GFAA COc1ccc([C@@H]2CC(=O)Nc3cc(NC(=O)CN(C)C)c(C)cc32)cc1O 65397865 JRHPDLBHEZANQJ-AWEZNQCLSA-N 383.448 2.683 0 50 GFAA Cc1csc(-c2cccc(C(=O)NS(=O)(=O)c3ncccc3F)c2)n1 252483832 FJNLTBVVSWGCQW-UHFFFAOYSA-N 377.422 2.771 0 50 GFAA COc1ccc(F)c(N2CCN(C(=O)[C@H]3CCO[C@@H]3c3cccnc3)CC2)c1 330051186 NBYDWLRNKJMIAS-FXAWDEMLSA-N 385.439 2.656 0 50 GFAA Cc1cccc(C)c1OCCN(Cc1cn2c(n1)CCCC2)S(C)(=O)=O 328638848 WPLORWABRZYVBD-UHFFFAOYSA-N 377.510 2.677 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)Cc3cnc4ccccn34)CC2)OC1=O 77505080 UXKNGTSQBCXYRU-MRXNPFEDSA-N 384.480 2.879 0 50 GFAA COC1(CNC(=O)[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)CCC1 378604417 CLAWCXWMKLQEBY-AWEZNQCLSA-N 396.434 2.826 0 50 GFAA Cc1ccc2nc(C)c(C(=O)N[C@H]3CC(=O)N(CCc4ccccc4)C3)n2c1 72126425 LODRBHVMSVOEFC-SFHVURJKSA-N 376.460 2.525 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(Cc3cscn3)CC2)C1 71746465 PINRPRFYOVYWTH-KRWDZBQOSA-N 399.564 2.531 0 50 GFAA CNC1CCN(c2ccc(C(=O)N3CCC[C@H](C(=O)CC(C)C)C3)cn2)CC1 71764385 XIOOFFAJFDVPEK-SFHVURJKSA-N 386.540 2.737 0 50 GFAA CN1CC[C@H](NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)[C@H]1c1ccccc1 241316707 LUHOKNHAIFXEGW-DLBZAZTESA-N 394.443 2.858 0 50 GFAA Cc1nc(C(=O)N(Cc2nc(O)c3ccccc3n2)C(C)C)ccc1C(=O)O 448986675 PRHMHJKEWRMCJN-UHFFFAOYSA-N 380.404 2.788 0 50 GFAA CC(C)(C)c1ncsc1C(=O)Nc1cc(C(=O)O)cc(S(C)(=O)=O)c1 262176791 OKARHVHTCGZHKU-UHFFFAOYSA-N 382.463 2.795 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1)c1noc2c1CCCC2 262405266 AQIPMICNSULVEV-UHFFFAOYSA-N 397.431 2.743 0 50 GFAA O=C(O)c1ccccc1CCC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 262701903 AXGLQYWEIYEMNW-LJQANCHMSA-N 398.503 2.959 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)c(=O)[nH]1 72426244 FHNAJDGMFWOASV-JOCHJYFZSA-N 380.492 2.597 0 50 GFAA Cc1cc(-n2cncn2)ccc1C(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 173088545 MMVMALRADLKYCY-MRXNPFEDSA-N 395.507 2.686 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1ccc(-n2cncn2)c(F)c1 173488516 DRRQNYIOOPCIGS-UHFFFAOYSA-N 385.374 2.634 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N(C)Cc3cnn(-c4ccc(F)cc4)c3)c2n1 82156537 LFCNJCRQAYKDCG-UHFFFAOYSA-N 378.411 2.943 0 50 GFAA CCCn1nc(C)c(S(=O)(=O)N(CC)Cc2c(C)nn(CC)c2C)c1C 20614233 KDOTVDNHIYNLNP-UHFFFAOYSA-N 381.546 2.954 0 50 GFAA CNc1cc(C(=O)N2C[C@H](c3cccc(OC)c3)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95373779 SFABOKXSCHNQJK-CEMLEFRQSA-N 392.503 2.834 0 50 GFAA COCc1noc(CN2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)n1 91270331 GKUCKGJXSDPKRA-UHFFFAOYSA-N 384.480 2.621 0 50 GFAA O=C(CCN1CCC(O)(c2ccc(F)cc2)CC1)Nc1nnc(C2CC2)s1 65529597 WMYCLCOSSLYTCS-UHFFFAOYSA-N 390.484 2.867 0 50 GFAA Cc1cc2nc(C(=O)NCC3(c4ccccc4)CCN(C)CC3)cc(C)n2n1 299758592 KPQYRARHFUOCSL-UHFFFAOYSA-N 377.492 2.740 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)NCCOc1cccc2cccnc12 827831094 SNXMQSZCLIDIPE-LJQANCHMSA-N 389.455 2.746 0 50 GFAA CC1(C(=O)NCC2CCN(Cc3cc4cc5c(cc4nc3O)OCO5)CC2)CC1 827654726 OFMCRKBJUPLDOO-UHFFFAOYSA-N 397.475 2.797 0 50 GFAA Cc1nn(C2CCOCC2)c(C)c1C(=O)Nc1c(C(N)=O)oc2ccccc12 857572543 AUYLONQOYFAJOZ-UHFFFAOYSA-N 382.420 2.949 0 50 GFAA Cc1ocnc1C(=O)N1CCC(CNC(=O)c2cn(C)c3ccccc23)CC1 952977555 BIZLMNGHNILIHQ-UHFFFAOYSA-N 380.448 2.757 0 50 GFAA O=C(c1cccc(Nc2ncccn2)c1)N1C[C@@H]2C[C@@H](C1)[C@@H]1CCCC(=O)N1C2 888088531 DYEOVCDKPUXQEM-IEZWGBDMSA-N 391.475 2.693 0 50 GFAA O=C(Nc1cc(C(F)(F)F)ccc1-n1cccn1)N1CCO[C@]2(CCOC2)C1 185359912 FOEMCGLBXCCTAB-QGZVFWFLSA-N 396.369 2.914 0 50 GFAA CN1CCC(N(C)[C@@H]2CCCC[C@@H]2N(C)S(=O)(=O)c2cccs2)CC1 167078595 JIQYLUJAPCZVLK-SJORKVTESA-N 385.599 2.706 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CCC(N2CCc3ccccc3C2)CC1 1318392234 UMGDSLYDZTZGSD-UHFFFAOYSA-N 391.471 2.644 0 50 GFAA COc1ccccc1-c1noc(CCCC(=O)Nc2cnn3c2NCCC3)n1 1506403905 WTAJHSCDXAVNJV-UHFFFAOYSA-N 382.424 2.719 0 50 GFAA O=C(c1ccc(N2CCC[C@@H](COc3ccccc3F)C2)nc1)N1CCOCC1 1529191900 IOYHNOVPTQMHAL-QGZVFWFLSA-N 399.466 2.989 0 50 GFAA COc1cccc(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c1C 1704298950 KZOPIQGWTPSSBP-DENIHFKCSA-N 383.444 2.524 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(Cc2cccnc2)CC1 11668060 YWQTYQYWZPJTFH-UHFFFAOYSA-N 399.491 2.510 0 50 GFAA C[C@@H](Cc1ccc(O)cc1)N1CCC(N2CCC(C(=O)NC3CC3)CC2)CC1 11700885 XDQZGQMYGVGZHD-KRWDZBQOSA-N 385.552 2.778 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@H]2CC23CCN(C[C@@H]2CC=CCC2)CC3)CC1 11998267 QUSONGRXVQCWQT-RTBURBONSA-N 389.540 2.746 0 50 GFAA O=C1CCCN1CC(=O)N1CC[C@@]2(CCCN(CCC3CCCCC3)C2)C1 12056833 CLZXYXSQXHZBTE-JOCHJYFZSA-N 375.557 2.894 0 50 GFAA CCOC(=O)[C@H]1CCCN(Cc2cc3ccc(F)cc3n(CCOC)c2=O)C1 12166908 DHUHRVJRHFNJEE-INIZCTEOSA-N 390.455 2.562 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H](CNC(=O)c3cccs3)C2)cc1 12315785 MNCHAXPWTZASAV-OAHLLOKOSA-N 378.519 2.887 0 50 GFAA COc1ccccc1CC(=O)N1CC[C@@H]2[C@H](CCCN2C(=O)c2ccco2)C1 15072330 CZVQCIIDFLCLJO-QZTJIDSGSA-N 382.460 2.984 0 50 GFAA O=C(CSc1ncccn1)N[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 19143958 QETAXTVQROJRFW-CYBMUJFWSA-N 397.426 2.768 0 50 GFAA Cc1nc(N2CCC(NC(=O)COc3ccccc3)CC2)cc(C(F)(F)F)n1 169772278 AQZKHLMXBRVBES-UHFFFAOYSA-N 394.397 2.968 0 50 GFAA CO[C@H]1C[C@@H](CN)N(c2cc(NCC3(c4cccc(Cl)c4)CC3)ncn2)C1 1857530362 BJIADOFFTGCLEK-IRXDYDNUSA-N 387.915 2.826 0 50 GFAA CCCCCc1nc(-c2nc3ccccn3c2C)n([C@H]2CCS(=O)(=O)C2)n1 1857675857 GLAIAXVXEIXROX-HNNXBMFYSA-N 387.509 2.994 0 50 GFAA COc1cc2c(cc1CN1CC[C@]3(C1)Cn1c(nnc1C1CC1)CO3)CCC2 1857682504 LMOAOJYVYRJJQD-QFIPXVFZSA-N 380.492 2.828 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)NCCc3ccc(O)cc3)CC2)oc1C 265202662 UFNNVKKTJFKRME-UHFFFAOYSA-N 386.496 2.751 0 50 GFAA Cn1c(C(=O)N[C@@H](CCO)c2cccc(OC(F)(F)F)c2)cnc1Cl 824020942 DJASQUMJEKJLPD-NSHDSACASA-N 377.750 2.826 0 50 GFAA C[C@@H](OC(=O)c1ccccc1OCc1cn2ccccc2n1)[C@@H]1CCNC(=O)C1 1263661236 CNTGOJXBCIZSTO-HZPDHXFCSA-N 393.443 2.985 0 50 GFAA Cc1nc(C(=O)OC[C@@H]2CCC3(CCC4(CC3)OCCO4)O2)c2ccnc-2[nH]1 1875311340 VNNRHKNPXUEPHT-AWEZNQCLSA-N 387.436 2.610 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@H]2COc3c(cccc3OC)C2)CC1 886054752 BDJOTVIGWBPXBN-QGZVFWFLSA-N 384.480 2.804 0 50 GFAA C[C@@H](O)c1cn(-c2cccc(C(=O)NCc3cccc(-c4cc[nH]n4)c3)c2)nn1 2325869698 YFOLAFHKABURFS-CQSZACIVSA-N 388.431 2.641 0 50 GFAA O=C(O)c1cncc(C(=O)N2CC[C@@]3(CCCN(Cc4ccccc4)C3)C2)c1 911362557 NEQPAYRIEKERMW-JOCHJYFZSA-N 379.460 2.908 0 50 GFAA CCc1ccccc1NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 1148343 CZYWTMIPOFRKLH-UHFFFAOYSA-N 376.478 2.953 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(CCCOc2ccc(C(=O)O)cc2)CC[C@H]1O 2356155411 FZZGWUKPNCVERL-WIYYLYMNSA-N 393.480 2.728 0 50 GFAA Cc1noc([C@H](C)N2CCN(C(=O)NCc3nc(C(C)(C)C)cs3)CC2)n1 111858279 CIPAOHKHUQVMQP-LBPRGKRZSA-N 392.529 2.720 0 50 GFAA CC(=O)N1CCc2cc(NS(=O)(=O)c3ccc(C(=O)O)cc3Cl)ccc21 462074229 KZDQZLAZKBJYNH-UHFFFAOYSA-N 394.836 2.748 0 50 GFAA COC(=O)c1ccc(N2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1 55054333 WBSZHRPZBLDCIU-UHFFFAOYSA-N 378.432 2.845 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H]3CC(=O)N(c4cccc(F)c4)C3)n1)CCNC2 20535540 ZGUKWIYQSAXMDY-ZDUSSCGKSA-N 393.422 2.745 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(F)c(C)c3)CC2)C1 67908570 PQKRUAUVLFHMQF-IBGZPJMESA-N 391.531 2.573 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](N(C)Cc1cnn(-c3ccccc3)c1)C2 67855281 SCVCGWIYWAEZGJ-QGZVFWFLSA-N 379.464 2.776 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN(C)Cc3ccsc3)C2=O)c1 67974537 QSSYXIQABBENID-FQEVSTJZSA-N 392.496 2.881 0 50 GFAA O=C(NCC1=CCCCC1)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 72442237 RUVPXZPQBIRIBB-UHFFFAOYSA-N 376.522 2.845 0 50 GFAA O=S(=O)(c1cnn(-c2ccccc2)c1)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 121593135 LMSBLZKNAGQMAE-UZLBHIALSA-N 386.521 2.510 0 50 GFAA O=C([C@@H]1CC2(CCNCC2)CN1)N(CCc1ccccc1)Cc1ccccc1 72120872 HWEQSUADQYPJSY-QFIPXVFZSA-N 377.532 2.990 0 50 GFAA COc1cccc(C(=O)NCC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)c1 363664877 KZOYEIJNXMRGOT-IBGZPJMESA-N 396.491 2.930 0 50 GFAA CCn1ccnc(N2CCC(N[C@H](C)c3ccc(OC)c(OC)c3)CC2)c1=O 365097430 YVXGQRIQDCOMND-OAHLLOKOSA-N 386.496 2.600 0 50 GFAA Cc1c(C(=O)N2CCC[C@]23CCOC3)sc2nc3n(c(=O)c12)CCCCC3 367653584 OQRFIAZMGILDBM-HXUWFJFHSA-N 387.505 2.888 0 50 GFAA O=C(c1cnc(O)c(Br)c1)N1CCNC[C@@H]1c1cccc(Cl)c1 261630615 CVYYUEWKFPVLKP-CQSZACIVSA-N 396.672 2.990 0 50 GFAA O=C(c1ccccc1-c1ncc[nH]1)N1CCN(CCOc2ccccc2)CC1 77287359 DDUMQUXNQZFNGF-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N[C@H]2CCCN(C3CCCCCC3)C2)cc1 72149612 KQBSPTWVRSHLRZ-INIZCTEOSA-N 380.510 2.850 0 50 GFAA CC(C)=CCN1CCNC(=O)[C@@H]1CC(=O)N1CCc2[nH]c3c(C)cccc3c2C1 72158077 ZJELQKXMFUMSCB-FQEVSTJZSA-N 394.519 2.518 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4ccc(Cl)cc4Cl)ccc3n2n1 72117492 WIXXKJIQDXHTOY-UHFFFAOYSA-N 379.232 2.852 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)c1 72140639 KSUTWRNWBVXFHN-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA COc1ccccc1[C@@H]1[C@@H]2C(=O)N(c3ccc(C)cc3)C(=O)[C@@H]2N2CCCN12 136732370 ZSNNWEDGCLUMBI-XUVXKRRUSA-N 377.444 2.539 0 50 GFAA CCCC[C@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)c1cnn(CC)c1 82121526 MUEJYJUOQWYVTK-KRWDZBQOSA-N 384.480 2.959 0 50 GFAA O=C(N[C@@H](c1ccccc1)c1ccncc1)N1CCN(C2CCOCC2)CC1 426405726 OBUUIPZRNQWTIU-NRFANRHFSA-N 380.492 2.677 0 50 GFAA NC(=O)c1ccc(-c2cccc(C(=O)NCc3n[nH]c4c3CCCCC4)c2)o1 426386874 IWRKVWMIULUMSN-UHFFFAOYSA-N 378.432 2.968 0 50 GFAA Cc1ccc([C@@H](C(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)N(C)C)cc1 95357752 UMTURIRLSJWCRA-FQEVSTJZSA-N 386.927 2.991 0 50 GFAA Cc1nc2c(c(NCC[C@@H](C)N3CCN(C)CC3)n1)Cc1ccccc1OC2 95512392 GXCBANUWTCWKGE-MRXNPFEDSA-N 381.524 2.706 0 50 GFAA Cc1nc2cc(CC(=O)N3CCC[C@H](c4nccn4CCN(C)C)C3)ccc2[nH]1 95376089 OVSIKSIUHYVFQS-SFHVURJKSA-N 394.523 2.578 0 50 GFAA O=C(CC(F)(F)F)N1CCC(c2nnc(Cn3ccnc3)n2C2CC2)CC1 96149080 JHYBTSRDASWGBK-UHFFFAOYSA-N 382.390 2.516 0 50 GFAA CCN(CC)C(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 95527853 OOUPUADVUFGJHJ-UHFFFAOYSA-N 388.917 2.625 0 50 GFAA CN(C)CCn1ccnc1C1CCN(C(=O)c2cn(C)c3ccccc23)CC1 95513097 GPGGYFHVLCMBPX-UHFFFAOYSA-N 379.508 2.956 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNC(=O)c2cc(-c3cccn3C)[nH]n2)C1 91644719 GBAJAMKIQWFXBE-QGZVFWFLSA-N 377.492 2.943 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)c1ccc3c(c1)CCO3)CC2 95521396 UATOPEOVJJBHHI-UHFFFAOYSA-N 380.492 2.744 0 50 GFAA Cc1ccc(C2(C(=O)N[C@@H]3CCN(Cc4csc(C)n4)C[C@H]3O)CC2)cc1 299760801 XHGJSLXFOPWXPK-RTBURBONSA-N 385.533 2.543 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)cn1 584900660 JHINRPVQTOPWAK-AWEZNQCLSA-N 375.860 2.503 0 50 GFAA COC[C@@H]1CCCCN(Cc2nnnn2-c2ccccc2Br)C1 170597091 KAZVEFJQGPFWTB-CYBMUJFWSA-N 380.290 2.673 0 50 GFAA C[C@@H](NC(=O)c1cnn2ccccc12)c1cc(F)ccc1N1CCC(O)CC1 755461413 NWIYQZZBNQXVLL-CQSZACIVSA-N 382.439 2.926 0 50 GFAA O=C(CCCN1CCCCC1=O)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1615740129 PCUWSCHFUARZJQ-RXVVDRJESA-N 395.503 2.701 0 50 GFAA CCc1nccn1CCNS(=O)(=O)c1ccc(-c2c(C)noc2C)s1 1506415706 BULREZQGEMPSQF-UHFFFAOYSA-N 380.495 2.757 0 50 GFAA CC(=O)Oc1ccccc1-c1nc2s/c(=C/c3ccc(C)cc3)c(=O)n2n1 1188288 BSDVAHOOALXMRH-GZTJUZNOSA-N 377.425 2.599 0 50 GFAA CCCN1C[C@H]2CN(C(=O)c3ccc(=O)n(C)c3)C[C@]2(CCc2ccccc2)C1 1772809902 GVBCYIMGUWNXSQ-URXFXBBRSA-N 393.531 2.802 0 50 GFAA CCCCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(NC(C)=O)c2)c1 12866275 CVTKECRWTPGMEN-UHFFFAOYSA-N 389.477 2.976 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C1CCN(C)CC1 15068562 VGBNGNITYAUPKU-UHFFFAOYSA-N 389.584 2.950 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CC2)C[C@@H]3C(=O)N2C[C@H](C)O[C@H](C)C2)c1 18086042 GHQKRHOLMYHMCU-WSTZPKSXSA-N 384.520 2.802 0 50 GFAA CC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)cc1 169772841 HDCDSWSFIPGPNS-LBPRGKRZSA-N 395.394 2.652 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1csc(-c2cccs2)n1 1857710256 NVSFWPKFRQQJNR-VNHYZAJKSA-N 375.519 2.853 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N(CC1CCC1)C[C@@H]1CCCO1 1857714260 OIILLERDHFZDSU-INIZCTEOSA-N 379.526 2.709 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NC(C)(C)Cc3ccc(F)cc3)CC2=O)s1 1857731883 SESCFZQWLZWUSG-CYBMUJFWSA-N 390.484 2.730 0 50 GFAA COc1nc(NC2CCN(C(=O)CC(C)C)CC2)nc(N2CCCCCC2)n1 301488854 JZLTVQUTSUPIKQ-UHFFFAOYSA-N 390.532 2.710 0 50 GFAA C[C@H](NC(=O)[C@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2556577 VXGGBPQPMISJCA-STQMWFEESA-N 382.416 2.503 0 50 GFAA in-vitro Cc1cc(C(=O)N2CC3(CCOCC3)c3ccccc32)ccc1-n1cnnn1 328595039 JAKVCFYXRSZEBD-UHFFFAOYSA-N 375.432 2.679 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@@H](CC(=O)O)c1ccc(F)cc1 236588146 BOGARULPOPTJRJ-VQTJNVASSA-N 398.434 2.994 0 50 GFAA CC[C@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCC(F)(F)F)c1=O 15069674 IUXVIQCJIYSYBR-NSHDSACASA-N 387.402 2.784 0 50 GFAA C[C@@H]1CN(C(=O)CCC[S@@](=O)c2ccc(Br)cc2)C[C@@H](C)N1 154108308 OWVHGOAAYZVWDP-VJBOLBCHSA-N 387.343 2.546 0 50 GFAA CN(C)Cc1cnc(CN(Cc2nccs2)[C@H]2CC23CCNCC3)s1 952887636 ULSZXNPNEHMVOY-HNNXBMFYSA-N 377.583 2.806 0 50 GFAA O=C(c1ccccc1-c1nc2ccccc2s1)N1CCN2C[C@H](O)C[C@H]2C1 1875266981 FXUUHBDCFRESAT-LSDHHAIUSA-N 379.485 2.854 0 50 GFAA O=C(CO[C@@H]1CCCNC1)N1Cc2cc(Br)ccc2C2CC1C2 1875307420 XYOPSRJFOZYNHZ-VDSRIPIWSA-N 379.298 2.806 0 50 GFAA COc1cc(Br)cc2cc(C(=O)NCc3ccncc3)c(=O)oc12 4708390 MHZVBCRSWBNEEU-UHFFFAOYSA-N 389.205 2.889 0 50 GFAA Cc1cncc(C2CCN(C(=O)c3cccc(N4CCN(C)CC4)n3)CC2)c1 2325766705 WEVSENDIACQWFJ-UHFFFAOYSA-N 379.508 2.557 0 50 GFAA O=C(NC[C@H](O)C1CCOCC1)c1cccc(Nc2ncnc3ccccc23)c1 2325779950 SPZCEGNSTZJOCM-FQEVSTJZSA-N 392.459 2.891 0 50 GFAA NCc1cccc(CNC(=O)[C@@H]2CCO[C@H]2c2cnn(-c3ccccc3F)c2)c1 2325787561 HNVVKLJGMUXRPN-NQIIRXRSSA-N 394.450 2.864 0 50 GFAA O=C(N[C@@H](CO)[C@@H](O)c1cccnc1)c1cccc2[nH]c(-c3cccs3)nc12 1471065743 DHMVCGPMQTUXIV-YJBOKZPZSA-N 394.456 2.511 0 50 GFAA CC[C@@H](CC(=O)N1CC2(C[C@H](NC(=O)c3ncoc3C)c3nccn32)C1)C(C)C 2332238090 YOPVIMUBQXDRBC-HOTGVXAUSA-N 399.495 2.664 0 50 GFAA CCS(=O)(=O)N(CC(=O)Nc1ccc(C(C)=O)cc1)c1ccc(OC)cc1 1153560 LCWMMNJDGMWGRT-UHFFFAOYSA-N 390.461 2.693 0 50 GFAA CC(C)OC(=O)Nc1ccc2c(c1)N(C(=O)CNCCO)c1ccccc1CC2 1828794 HOCASTTYVPLLEC-UHFFFAOYSA-N 397.475 2.989 0 50 GFAA Cc1cc(-c2nnc(NC(=O)C3CCN(C(=O)c4ccncc4)CC3)o2)cs1 2356138469 MSNOQHRXZZPRIG-UHFFFAOYSA-N 397.460 2.992 0 50 GFAA COc1ccc(CN2Cc3nnc(CCc4c(C)n[nH]c4C)n3[C@@H](C)C2=O)cc1 2356143505 KOTGTAQMPQGNDI-HNNXBMFYSA-N 394.479 2.515 0 50 GFAA CN(CCC[C@@H]1CCCO1)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356145431 BTCCDYVVIKXBQK-OAHLLOKOSA-N 378.538 2.931 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(Cc3ccn4ncnc4c3)CC1)OCC2 2356158705 VZLZJFJGHOWSHT-UHFFFAOYSA-N 394.475 2.811 0 50 GFAA O=C(Nc1ccc(N2CCN(C(=O)c3ccco3)CC2)cc1)c1cccnc1 4412820 OKCRRFQZYCSJAH-UHFFFAOYSA-N 376.416 2.889 0 50 GFAA C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc2c1OC(F)(F)O2 414369428 JFGXSVJNIYJUDA-LLVKDONJSA-N 384.404 2.849 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@H](c3[nH]ncc3-c3ccc(F)cc3)C2)c(=O)[nH]1 67842254 FWOSCANTLZUAMY-HNNXBMFYSA-N 395.438 2.556 0 50 GFAA Cn1cc(Cl)c(-c2c(-c3ccccc3)ncn2[C@H]2CCS(=O)(=O)C2)n1 65431246 YFFNEAFOYFTJLL-ZDUSSCGKSA-N 376.869 2.964 0 50 GFAA CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)c2nccnc2N)cc1 465261003 BYDHMWBEQAXOGN-UHFFFAOYSA-N 398.444 2.897 0 50 GFAA CN(C)C(=O)C1CCN(c2cccc3c2C(=O)N(Cc2cccs2)C3=O)CC1 12151908 KHDFHGNCZURPHE-UHFFFAOYSA-N 397.500 2.849 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)NC[C@H](c3ccco3)N(C)C)cn2)C[C@@H](C)O1 229753348 VFXDGFIUJNPKDQ-BFYDXBDKSA-N 387.484 2.713 0 50 GFAA O=C(NCCc1cscn1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 120315255 HLYXYZSNDYPULC-GFCCVEGCSA-N 382.436 2.865 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCCCc2ccccn2)C1 77454774 SFWLVOCFMKKQLY-UHFFFAOYSA-N 388.475 2.883 0 50 GFAA NC(=O)C1(C(=O)N2CCC[C@@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)CC1 72156717 LUZDXZAPWQROFH-MRXNPFEDSA-N 376.456 2.625 0 50 GFAA Cc1nn(C)c2ncc(C(=O)N[C@@H](C)[C@@H]3CCN(Cc4ccccc4)C3)cc12 252535715 GRALOZNBSAJZSJ-MAUKXSAKSA-N 377.492 2.917 0 50 GFAA CCN1C[C@H](CCN2CCOCC2)[C@@](c2ccccc2)(c2cccnc2)C1=O 71769362 DHPMSMRUUUKJSL-JTHBVZDNSA-N 379.504 2.568 0 50 GFAA CC(=O)N(CC(=O)O)[C@@H]1CCCN(C(=O)C[C@H](C)c2ccccc2F)CC1 328626106 DVCOZJRHDJKEIB-GOEBONIOSA-N 378.444 2.634 0 50 GFAA Cc1nc(CNC(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)no1 71416361 JRSZBOHCEIOWJO-JOCHJYFZSA-N 390.443 2.541 0 50 GFAA Cc1[nH]c(C(=O)O)c(C)c1C(=O)N(CCCn1ccnc1)Cc1ccncc1 214953902 XLXMXVOXAKLCDX-UHFFFAOYSA-N 381.436 2.654 0 50 GFAA CN1CC[C@@H](CNS(=O)(=O)Cc2cccc(Cl)c2)[C@@H]1c1cccnc1 377312994 ZZYLGLYDQRQKSS-WMZOPIPTSA-N 379.913 2.847 0 50 GFAA COC[C@H]1CCCN(C(=O)c2ccc(NCc3ccc4c(c3)OCO4)nc2)C1 14976755 MJUXDBYHENDSSA-INIZCTEOSA-N 383.448 2.921 0 50 GFAA CN(CC(=O)O)C[C@H]1CN(C(=O)Nc2ccccc2-c2ccccc2)CCO1 263462500 FCSPJLCGSIISJC-KRWDZBQOSA-N 383.448 2.603 0 50 GFAA O=C(CCc1ccccc1)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 82230633 DFXXCBBFLAKEIC-UHFFFAOYSA-N 379.508 2.748 0 50 GFAA CNC(=O)c1nn(CC2CCCCC2)c2c1C[C@@H](N1CCSCC1)CC2 82039558 VGHVHEYBUVHVSB-INIZCTEOSA-N 376.570 2.729 0 50 GFAA Cc1cccc(NC(=O)N2CCC(c3nnc(Cn4cccn4)n3C)CC2)c1 91793348 LFOMZFCWEFMZRI-UHFFFAOYSA-N 379.468 2.780 0 50 GFAA CCn1nc(C)cc1C(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95373289 YJMJIUFIVDIWGI-FXAWDEMLSA-N 378.520 2.915 0 50 GFAA O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCCC[C@@H]1CCn1cccn1 95511927 QUKYFVBTLDKYHM-CQSZACIVSA-N 382.386 2.535 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CCN(c4ccccc4F)CC3)n2)c1 96101559 WOVXOAUHUOEWLB-UHFFFAOYSA-N 393.470 2.967 0 50 GFAA CCc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4cnc(C)cn4)C3)CC2)[nH]1 91794357 NLOHVCKWPIACHQ-UHFFFAOYSA-N 395.507 2.721 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)s1 95498851 RODPLEPGIGVZJW-HXUWFJFHSA-N 386.521 2.867 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCc1nc(-c2ccsc2)no1 299750573 NXYMNPMZMWOGSA-HNNXBMFYSA-N 383.429 2.769 0 50 GFAA Cc1ccc2c(c1)CN(CCNC(=O)c1cc(C(F)(F)F)n[nH]1)C[C@H](C)O2 299788725 ZTTPMOWWXSYOQW-LBPRGKRZSA-N 382.386 2.750 0 50 GFAA CN1CCC(C(=O)NCc2csc(-c3cnccn3)n2)(c2ccccc2)CC1 823759622 XXPSSIFPXKDTHU-UHFFFAOYSA-N 393.516 2.880 0 50 GFAA COCc1nc(Cc2cc(OC)ccc2OC)n(-c2ccccc2C(=O)O)n1 670456854 XAXFJCOFYFHZRN-UHFFFAOYSA-N 383.404 2.720 0 50 GFAA COc1ccc(-n2cnnc2)cc1NC(=O)[C@H](C)N1CCc2ccccc2C1 952978498 LZDHAXCWOZGJLC-HNNXBMFYSA-N 377.448 2.661 0 50 GFAA COc1ccc(OC)c2[nH]c(C(=O)N3C[C@@H]4C[C@@H](C3)[C@@H]3CCCC(=O)N3C4)cc12 888088446 ACMMPUOLMHQVET-ZQIUZPCESA-N 397.475 2.658 0 50 GFAA Cc1ncc(C(=O)N2CCN(c3ncnc(C)c3C)CC2)c(-c2ccccc2)n1 952963809 KPRIKWUIKPQAJG-UHFFFAOYSA-N 388.475 2.821 0 50 GFAA Cc1c(-c2ccccc2)oc2c(C(=O)N3CCO[C@@H](C(=O)O)C3)cccc2c1=O 408513462 QMNYXLXFRIOLFT-QGZVFWFLSA-N 393.395 2.694 0 50 GFAA COc1cc(CCC(=O)N2CC[C@@](C)(C(=O)O)C2)ccc1OCC(F)(F)F 269048459 UKHXKEJWVCJVAI-QGZVFWFLSA-N 389.370 2.892 0 50 GFAA Cc1ccc(N2CCC[C@H](NS(=O)(=O)Cc3noc4ccccc34)C2=O)cc1 185851091 XIGLDMYIOVSQMF-KRWDZBQOSA-N 399.472 2.751 0 50 GFAA C[C@H](C(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O)n1nnc(-c2ccccc2)n1 170611712 YVQCGMVZYSTTEC-YVHKJVDXSA-N 393.491 2.647 0 50 GFAA CC(C)(C)OCc1cc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)no1 186472131 NVVXBEQGJROLIX-UHFFFAOYSA-N 394.497 2.781 0 50 GFAA CC1(C)CN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)CC2(CCCC2)O1 190800413 WJHGDPWWVRHYPP-KRWDZBQOSA-N 394.537 2.906 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CCN4[C@H](COC[C@H]4C4CC4)C3)o2)c1 1615955754 ZCVUMIMUKNXYKN-HKUYNNGSSA-N 382.460 2.890 0 50 GFAA CN(C)CCN(Cc1cnc[nH]1)C(=O)c1ccc(-c2noc(C3CC3)n2)cc1 1704304565 HAURCVLPISPDIW-UHFFFAOYSA-N 380.452 2.541 0 50 GFAA COCC(=O)N1C[C@@H]2CN(c3ncccc3F)C[C@@]2(CCc2ccccc2)C1 1772819363 SFPLOAQUZQURBW-XMSQKQJNSA-N 383.467 2.765 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(C)CCCN2CCCC2)no1 11936264 RHXHISNZEJHRMH-UHFFFAOYSA-N 381.480 2.939 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)NCCc3cccc(C)n3)o2)c1 12305967 QWAMHAKVAHIMCH-UHFFFAOYSA-N 394.475 2.858 0 50 GFAA COc1ccc(OC)c(CC(=O)N[C@@H]2CCCN(C3Cc4ccccc4C3)C2)c1 12456218 PZELYTSMHONUSS-HXUWFJFHSA-N 394.515 2.994 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1/C=C/c1ccccc1 2502869 YJTIBKAOZXCIGQ-FDMDGMSGSA-N 386.473 2.867 0 50 GFAA Cn1nc(C(F)F)cc1C(=O)N[C@H]1CCC[C@@H](CNC(=O)c2cscn2)C1 1857681904 PXWNWHAUCUPLSR-MNOVXSKESA-N 397.451 2.533 0 50 GFAA Cc1nccnc1N1C[C@@H]2[C@H](CNC(=O)CCc3ccccc3)[C@H]3CC[C@]2(C1)O3 1857736939 XCZOYMPKLGEIMD-DZCCDHAISA-N 392.503 2.518 0 50 GFAA O=C(CO)N1CCC2(CC1)OCCc1cc(-c3ccc4n[nH]cc4c3)sc12 1857738560 NQQJVCLCGRSCKE-UHFFFAOYSA-N 383.473 2.674 0 50 GFAA CC(C)COc1ccc(C(=O)N/C(=C/c2ccc3c(c2)OCO3)C(N)=O)cc1 820039 OARMGTLFBMQOEN-RQZCQDPDSA-N 382.416 2.706 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCC(=O)O)C[C@H]1CCCO1 237728581 YFMHPUXJLTZJEY-MRXNPFEDSA-N 391.855 2.930 0 50 GFAA CC(C)CN1CC[C@H](CNC(=O)N2CCC(c3nnc4ccccn34)CC2)C1 133812667 MAPWICNGUGDTMI-QGZVFWFLSA-N 384.528 2.596 0 50 GFAA COC(=O)[C@H](NC(=O)CCc1c[nH]c2ccccc12)c1ccc(OC)c(O)c1 474576824 HYKSUBZXBWUFNM-HXUWFJFHSA-N 382.416 2.845 0 50 GFAA CN1CCC(=O)Nc2cc(C(=O)NC[C@H]3CCN(c4ccc(F)cc4)C3)ccc21 155814145 DNSWICBMCPRGQW-OAHLLOKOSA-N 396.466 2.860 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCCO[C@@H]1C1CCN(C(=O)C[C@@H]2CCCO2)CC1 837247782 XPSLCPOFSKEKQX-YQVWRLOYSA-N 396.528 2.866 0 50 GFAA Cc1ccc2ncc(C(=O)N[C@H]3CC[C@H](NC(=O)c4cnc(C)s4)CC3)n2c1 1875280412 FKMWNUPVNQLTSO-SHTZXODSSA-N 397.504 2.879 0 50 GFAA O=C(Cn1cc(Br)ccc1=O)N1CCSc2ccccc2C1 1875263254 UZSQFIJZEAOURR-UHFFFAOYSA-N 379.279 2.745 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)n[nH]c21 1875290476 KBDDFNACSJCANK-OLZOCXBDSA-N 392.450 2.914 0 50 GFAA C[C@H]1CC2(CCN(c3ncc(Cl)cn3)CC2)CN1C(=O)CN(C)C1CCC1 1875312764 UGTSKKNUDZOOOE-HNNXBMFYSA-N 391.947 2.822 0 50 GFAA CC(C)[C@@H](C(=O)N1C[C@@H]2CCN(C(=O)C3(CN(C)C)CC3)[C@@H]2C1)c1ccccc1 1875336591 HTQVRCLSEJKUMX-PWRODBHTSA-N 397.563 2.827 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1cc(C(F)(F)F)ncc1Cl 1875400611 GFLJEHBTQNBPMK-ZWKOPEQDSA-N 388.777 2.520 0 50 GFAA CC(C)[C@@H](CC1CCCCC1)C(=O)N1CCn2c(nn(CC(F)F)c2=O)C1 888091093 DWKDHZUYMNCZJD-OAHLLOKOSA-N 384.471 2.895 0 50 GFAA CCCCOCC(=O)NC[C@@H]1CN(C(=O)c2occc2C)C[C@@H]1C(F)(F)F 1775989239 HVOCDMKOHIQHQS-KGLIPLIRSA-N 390.402 2.771 0 50 GFAA CCOC(=O)C1CCN(C2CCN(c3nncc(-c4ccccc4)n3)CC2)CC1 11661597 WJTPJOUDPHBHAT-UHFFFAOYSA-N 395.507 2.783 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)cc1-c1ccccn1 2325786212 SWOGYUOQSUCGCU-CWFSZBLJSA-N 392.459 2.523 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@H]3CCN(C)C[C@H]3c3cnn(C)c3)cc2)c1C 849596509 ORDZZMWGMQCYTP-SFTDATJTSA-N 392.507 2.897 0 50 GFAA CCOc1ccc(NC(=O)COc2ccc(Br)cc2)c(C(N)=O)c1 129183608 XKXHJTVDDIBMEP-UHFFFAOYSA-N 393.237 2.964 0 50 GFAA CCC(=O)N[C@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 1787032 NIZVQHHNPBJKLL-LLVKDONJSA-N 398.699 2.894 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccncc1)c1cnc(Nc2ccccc2)nc1 2356150896 DYYPQAASFOHMBS-VQIMIIECSA-N 375.432 2.603 0 50 GFAA Cc1nc([C@H]2OCC(=O)N(C3CC3)[C@@H]2c2cccnc2)n(-c2ccc(F)cc2)n1 2356153481 IZVAWELHUBQNNL-UXHICEINSA-N 393.422 2.913 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c1 4976102 AWSLXCPMJCFVSM-MRXNPFEDSA-N 383.423 2.814 0 50 GFAA CC(C)NC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccco2)CC1 4976377 HUSGZELLLZFKCL-UHFFFAOYSA-N 383.448 2.909 0 50 GFAA CN1CCc2ccc(NC(=O)N3CCN(c4ccc(Cl)cn4)CC3)cc2C1=O 136384413 UPZLMRMJJRBXIH-UHFFFAOYSA-N 399.882 2.717 0 50 GFAA COC(=O)c1ccc(C)c(S(=O)(=O)N[C@@H](c2ccccc2)C(C)(C)CO)c1 225657982 QYBPNSCPMFLASI-SFHVURJKSA-N 391.489 2.820 0 50 GFAA CC[C@H](C)c1n[nH]c2c1CN(C(=O)c1cn3c4c(cccc4c1=O)CC3)CC2 20201127 DVUCUHAMOFCZEK-ZDUSSCGKSA-N 376.460 2.993 0 50 GFAA CC12CN(C(=O)c3cccs3)CC(C)(CN(C(=O)c3cccs3)C1)C2O 28444276 CYJOXLCAIQLULA-UHFFFAOYSA-N 390.530 2.795 0 50 GFAA O=C(NCCN1CCCOC1=O)c1ccc([C@H]2CCCN2CC2CC2)s1 23580947 OIQLDYFTZZTKHY-OAHLLOKOSA-N 377.510 2.867 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Nc3ccc(F)cc3F)CC2)n1 67613091 KCPKSJXGTABAHS-UHFFFAOYSA-N 376.411 2.849 0 50 GFAA O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCN(CCOc2ccccc2)CC1 77565380 POWXRKILZGLHHK-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA CCn1ccnc1CN(C(=O)[C@@H]1COc2ccccc21)[C@@H]1CC12CCNCC2 328642112 QVTRJOJZGQITIH-IEBWSBKVSA-N 380.492 2.550 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2Nc2nc(N(C)C)cc(C(F)(F)F)n2)cn1 328627109 MJSJREGFAFWTCV-SWLSCSKDSA-N 384.406 3.110 0 50 GFAA CCc1noc([C@H](C)N2CCN(C(=O)CCc3cn(C)c4ccccc34)CC2)n1 151273034 SEJDNSOEKDLLKQ-INIZCTEOSA-N 395.507 2.962 0 50 GFAA CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cncs3)CC2)cc1 330494958 PTSAYBXLAYZXSU-CQSZACIVSA-N 393.534 2.803 0 50 GFAA CCCN(CCO)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71749843 BORVEZZBIDQPSZ-HSZRJFAPSA-N 380.488 2.765 0 50 GFAA COC(=O)N1CCc2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2C1 77519006 VKFQNCPIVKMUPD-UHFFFAOYSA-N 386.473 2.953 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)s1 71749473 HUJQIBYIWSIHKP-HNNXBMFYSA-N 375.538 2.652 0 50 GFAA Cn1nc(C(=O)N2CCOC[C@H]2c2nc3ccccc3s2)cc1OC(F)F 374321728 BVVCHNPBXKVCRQ-LBPRGKRZSA-N 394.403 2.845 0 50 GFAA CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1cnn2ccccc12 376217549 DYYJASRJDGLGDU-OAQYLSRUSA-N 390.487 2.950 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@H](c3ccsc3)C2)n(-c2ccccc2)n1 237981416 BGVOBCQKTDFZQI-KRWDZBQOSA-N 383.429 2.846 0 50 GFAA NC(=O)COc1ccc([C@H]2CC(=O)Nc3c2ncn3-c2cccc(Cl)c2)cc1 40284242 MTTMGNGCMKKWBJ-MRXNPFEDSA-N 396.834 2.864 0 50 GFAA C[C@H]1CN(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)CC[S@](=O)C1 458368150 QODLDHXCCBYVTO-PWFNWSNSSA-N 391.468 2.923 0 50 GFAA COc1cccc(CN2CCN(Cc3cc(CC(C)C)[nH]n3)C[C@H]2CCO)c1 42496494 BOFLETROIGNYDD-OAQYLSRUSA-N 386.540 2.686 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@]3(CCN(CCCn4cnnn4)C3)C2=O)cc1 426551988 NMUVCDZNVLLBNQ-QFIPXVFZSA-N 396.539 2.701 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)CCn2ccc(C)n2)C3)cc1 95360626 XENAVCBBAZQZSO-VQTJNVASSA-N 382.508 2.713 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)c2nc3cc(C)ccn3c2F)n1 426399308 YJJZVAGLNYARME-ZDUSSCGKSA-N 387.415 2.721 0 50 GFAA COc1c(C)cc(-c2cccc(C(=O)NC[C@H]3CN(C)CCN3C)c2)cc1C 299801166 YXEMCMZKWUGDHS-NRFANRHFSA-N 381.520 2.955 0 50 GFAA CC(C)=CCN1CCC(N2C[C@H](COc3ccc(F)cc3)OCC2=O)CC1 299797358 ONBNSBABWMRYCN-HXUWFJFHSA-N 376.472 2.863 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)C1CCN(C(=O)N(C)C)CC1 299515272 VEXHNFGQEVHMTA-UHFFFAOYSA-N 386.496 2.563 0 50 GFAA COc1ccc(Oc2ccc(NC(=O)[C@@H]3CCc4nn(C)c(=O)n4C3)cc2)cc1 824684111 PXOXDJHPWAZOEX-CQSZACIVSA-N 394.431 2.584 0 50 GFAA O=C(CCCn1cncn1)NC[C@@H]1CCCN(Cc2cc3ccccc3o2)C1 828022174 FKCHUGJYNQBGQK-KRWDZBQOSA-N 381.480 2.833 0 50 GFAA O=C(NCc1ccc2nc[nH]c2c1)N1CCCN(C2Cc3ccccc3C2)CC1 584896039 BGYPLGMFLUHKDW-UHFFFAOYSA-N 389.503 2.948 0 50 GFAA CCc1nc2cc(NC(=O)[C@@H](c3ccccc3)n3cnnn3)ccc2n1CC 952872121 KEJIVCFHMMHGNT-LJQANCHMSA-N 375.436 2.833 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)c2ccc(-c3cc[nH]n3)o2)n1 952976565 KVGYPEFJAZCONN-LBPRGKRZSA-N 377.426 2.702 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)cc1OC 1565527714 KYTXFTHGJJLOAX-HKUYNNGSSA-N 381.476 2.835 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)c2cccc(NC(=O)c3cccnc3)c2)[C@@]12CCCO2 273716671 QRXGMQGOBJYQAM-JQVVWYNYSA-N 395.459 2.790 0 50 GFAA CCCCn1cc(C(=O)NC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)c(C)n1 186125706 WPBCUCKHYZFFGH-MRXNPFEDSA-N 393.871 2.880 0 50 GFAA CNC(=O)CC[C@H]1CCCN(S(=O)(=O)c2cc(C)c(F)cc2Cl)C1 1506420917 DOQLQMQIMDWELK-GFCCVEGCSA-N 376.881 2.714 0 50 GFAA CN1C(=O)[C@@]2(CCCN(C(=O)/C=C/c3cc(CO)cs3)C2)c2ccccc21 1506419077 WWVQEEMQVVYJCI-QQUYBBDPSA-N 382.485 2.790 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(c3nnc4ccccn34)CC2)cc1OC 1506415973 BWEDYWRSHDNCJB-IBGZPJMESA-N 396.447 2.752 0 50 GFAA O=C1CC[C@H](C(=O)N2CCCN(Cc3ccccc3-c3ccccc3)CC2)CN1 1529180658 HHDYGZASTOVLQT-FQEVSTJZSA-N 391.515 2.914 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3ccc(CCN)cc3)CC1)OCC2 1704339527 KWWBTPWXPZTICM-UHFFFAOYSA-N 380.488 2.901 0 50 GFAA Nc1nc(CCNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)cs1 1772810024 HGWVKQLGLVMMMD-LBPRGKRZSA-N 385.518 2.708 0 50 GFAA Cc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCN(C(=O)C3CC3)CC2)o1 1772711090 WBSGUGJCGANKME-UHFFFAOYSA-N 395.459 2.925 0 50 GFAA CN(C[C@@H]1COc2ccccc2O1)C(=O)c1cn(Cc2ccccc2Cl)nn1 11716297 YCSZDERZGAEVMU-OAHLLOKOSA-N 398.850 2.892 0 50 GFAA COc1ccc2c(c1)O[C@H](C)CN(CCC(=O)NCCCc1ccncc1)C2 12247056 ONXWMFIFQNIVBO-QGZVFWFLSA-N 383.492 2.812 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1)NCc1cccnc1 12448967 IAZQUFQUOSRCHG-NRFANRHFSA-N 393.487 2.720 0 50 GFAA CCc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)s1 13331450 UQWUVDIUVIYDAB-UHFFFAOYSA-N 382.482 2.596 0 50 GFAA C[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)C1 15067020 DTCYGQKHTLNRBP-YPMHNXCESA-N 375.494 2.885 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3ccc(OC)cc3F)C2)CC1 19228079 SZUWSVVAZOUXOT-QGZVFWFLSA-N 379.476 2.573 0 50 GFAA CCn1c2ccccc2c2cc(CN3C[C@H](O)[C@@H](N4CCOCC4)C3)ccc21 19866120 UKDOFQBFGHRRCA-GOTSBHOMSA-N 379.504 2.692 0 50 GFAA Cn1cncc1C(=O)N1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccc2s1 1857690647 JFBFROVIRBVTCN-QWHZDKJVSA-N 394.500 2.915 0 50 GFAA Cc1nc(C)c(CN2[C@H]3CC[C@@H]2C[C@]2(C3)CN(c3cnccn3)CCO2)s1 1857723843 ZAKCZTDINQLUCY-YRWFTTLQSA-N 385.537 2.952 0 50 GFAA COCc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 252478509 AOMWDALOPMZDTM-UHFFFAOYSA-N 388.489 2.872 0 50 GFAA Cc1cc(C(=O)Nc2ccc(N3CCOCC3)cn2)nn1-c1c(F)cccc1F 252539428 NYJDLTSMTQJOCX-UHFFFAOYSA-N 399.401 2.943 0 50 GFAA O=C(N[C@H]1C[C@@H](c2nc(-c3cnc4cnccn34)no2)C1)OCc1ccccc1 844865775 PDVDNGMNFABAMS-GASCZTMLSA-N 390.403 2.952 0 50 GFAA CCCS(=O)(=O)N1CCC(NC(=O)N[C@@H](C)C2CCC(F)(F)CC2)CC1 847282719 YBAYRSZMJBISAJ-ZDUSSCGKSA-N 395.516 2.704 0 50 GFAA COC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H]2C[C@]23CCc2ccccc23)cc1 1875276045 GOSAHJFQNMIZBP-UTKZUKDTSA-N 379.416 2.576 0 50 GFAA CN(C(=O)c1cc(C(C)(C)C)on1)C1CC(NC(=O)c2cnn(C(F)F)c2)C1 1875334023 VGUXPCKEMXQLQX-UHFFFAOYSA-N 395.410 2.597 0 50 GFAA COC(=O)c1cccc(O[C@@H]2CCN(C(=O)c3cc4c([nH]3)CCCC4=O)C2)c1 1875310512 SOPLFZUJCTWGJO-OAHLLOKOSA-N 382.416 2.614 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)N=c1cc(CC(C)(C)C)[nH][nH]1 1875392996 CPBWXZNIJWRTNU-FIKMYACPSA-N 385.512 2.570 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)c2cn3ccc(C)c(C)c3n2)C1 1875309009 MIUYXMZQAWFKQB-HNNXBMFYSA-N 380.452 2.652 0 50 GFAA Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@@]45CCCC[C@@H]4C5)C3)CC2)s1 1875328151 BAAKAGVRUFIAHQ-IIBYNOLFSA-N 387.549 2.605 0 50 GFAA O=C(OCCN1C(=O)c2ccccc2S1(=O)=O)c1ccc2c(c1)C=CCC2 2325744014 UTURPEMXXUZTGY-UHFFFAOYSA-N 383.425 2.648 0 50 GFAA CN(C)c1ccccc1CNC[C@@H]1C[C@H](C(=O)N[C@H](C2CC2)C(F)(F)F)CO1 2332237618 DZLXUICVUPJUKT-XYJFISCASA-N 399.457 2.704 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(c2ncccc2C(F)(F)F)CC[C@H]1O 2356152659 UOBSRMQDFHVYTA-CRAIPNDOSA-N 380.366 2.985 0 50 GFAA Cc1cc(NS(=O)(=O)c2ccc(NC(=O)c3c(C)noc3C)cc2)no1 2872853 FTHPDDXXJKXICF-UHFFFAOYSA-N 376.394 2.641 0 50 GFAA Cc1nc[nH]c1CN1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 2356169670 GRRPFVPIBDLVLE-UHFFFAOYSA-N 376.464 2.756 0 50 GFAA O=C(c1ccc(N2CCCC2=O)cc1)N1CC[C@@H](c2ccc(F)cc2)[C@H](O)C1 65387140 ITLCOFZYRIPTBP-VQTJNVASSA-N 382.435 2.943 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)Cc3ccccc3Cl)C2)CC1 23339039 JKFNCVHNZWFDSR-QGZVFWFLSA-N 393.915 2.648 0 50 GFAA CCn1ccnc1CN1CCC[C@@H](N2CCN(c3ccccc3OC)CC2)C1 23374841 GBRASSKOXNFZQF-LJQANCHMSA-N 383.540 2.698 0 50 GFAA COc1cccc(CN2CCN(Cc3ccccc3F)[C@@H](CCO)C2)c1OC 20600997 AGZFTFLZHJEWAH-IBGZPJMESA-N 388.483 2.912 0 50 GFAA CC(=O)c1cccc(O[C@H](C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1 152200658 BFKISVJREFQPSX-DYESRHJHSA-N 394.471 2.964 0 50 GFAA O=C1C[C@@H](NCc2cccn2-c2ncccn2)CN1CCc1cccc(Cl)c1 12387201 RSUJZBKZQAXFGA-GOSISDBHSA-N 395.894 2.854 0 50 GFAA CO[C@H](CNC(=O)[C@H]1C[C@H]1c1ccccc1)CNC(=O)[C@@H]1C[C@@H]1c1ccccc1 252511653 JAYXVKSAZONTGI-YUBLJMCLSA-N 392.499 2.841 0 50 GFAA CCCc1ncncc1C(=O)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 72152117 PPCUCXNDKZCQNE-INIZCTEOSA-N 382.464 2.917 0 50 GFAA COc1ccc(C[C@@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)CCO2)cc1 71551718 CQIPXENBLSMJSN-GOSISDBHSA-N 379.460 2.974 0 50 GFAA COc1ccc(-c2nc(CN3CCC4(CC3)CNC(=O)O4)c(C)o2)c(F)c1 71721276 MXXWKLYTONIXMW-UHFFFAOYSA-N 375.400 2.872 0 50 GFAA CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H](S(C)(=O)=O)C1 239722362 CCMADLNTILRFON-ZIAGYGMSSA-N 396.488 2.591 0 50 GFAA COc1ccc([C@H]2OCC[C@@H]2NC(=O)N2CC[C@@H](O)[C@H](C3CCCC3)C2)cn1 333580740 KASHKMVVGKZRBB-PNYFIKQUSA-N 389.496 2.503 0 50 GFAA O=C(Cn1cc(-c2ccc(Cl)cc2)ncc1=O)N[C@H](C(=O)O)c1ccccc1 218356088 SGHPGJOXXKVAPN-IBGZPJMESA-N 397.818 2.506 0 50 GFAA COc1ccccc1-n1cc(S(=O)(=O)N2CCN(C)Cc3ccccc32)cn1 173116508 DWLPWBNYFHVANE-UHFFFAOYSA-N 398.488 2.522 0 50 GFAA Cc1cc(CN2CCC3(CC2)CN(CCCN(C)CC(C)C)C(=O)O3)on1 72410051 RCAMGRQCIZXWAE-UHFFFAOYSA-N 378.517 2.748 0 50 GFAA O=C(c1cnco1)N1CCC(Oc2ccccc2C(=O)N2CCCCC2)CC1 95510637 BCRODSLKWDCJBB-UHFFFAOYSA-N 383.448 2.984 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)C1 238997400 AFOURSBHZGYIQY-NHYWBVRUSA-N 399.274 2.900 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)NC[C@H]1COc2ccccc2C1 92046419 CEJMAEBNBBUZFZ-HNNXBMFYSA-N 377.444 2.939 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)s1 95498852 RODPLEPGIGVZJW-FQEVSTJZSA-N 386.521 2.867 0 50 GFAA Cc1cccc(N2C[C@H](C(=O)NCc3cn(C)nc3C(F)(F)F)CC2=O)c1C 178953690 NKHGYENPMASTKD-CYBMUJFWSA-N 394.397 2.725 0 50 GFAA COCCNC(=O)c1ccc(NC(=O)N2CCC(CSC)CC2)c(C)c1 97758038 JLFXNHNYCHLBLZ-UHFFFAOYSA-N 379.526 2.978 0 50 GFAA CC1(C)CCN(S(=O)(=O)N2CCC[C@@H](c3cccc(C(=O)O)c3)C2)CC1 95353549 LOMASRQRINGQJM-QGZVFWFLSA-N 380.510 2.931 0 50 GFAA Cc1ccc(-c2ccc(CN3C[C@H](CO)[C@H](CN4CCN(C)CC4)C3)o2)cc1 91595799 AFVVBKSEOZYHMT-NHCUHLMSSA-N 383.536 2.543 0 50 GFAA Cc1cc(C(=O)N(C)CC2CCN(CCc3ccccc3F)CC2)cc(=O)[nH]1 95503245 DXCVGKOHHWZCAU-UHFFFAOYSA-N 385.483 2.849 0 50 GFAA CN1CCC(NC(=O)[C@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1 91974393 RLJGRPIQVXNPCU-HNNXBMFYSA-N 397.441 2.654 0 50 GFAA O=C(c1ccc(-c2ccc(F)cc2)cc1)N1C[C@H](CO)[C@H](CN2CCOCC2)C1 91651022 PFSANKXAQHJDAM-NHCUHLMSSA-N 398.478 2.505 0 50 GFAA O=C1COc2cc(C(=O)N3CCC(n4ccc(C(F)(F)F)n4)CC3)ccc2N1 183063681 YUCUYYALAJOZFS-UHFFFAOYSA-N 394.353 2.710 0 50 GFAA Cc1nc2cc(CNC(=O)CCCc3nc(-c4ccncc4)no3)ccc2n1C 828027341 ZPPPTIGKUJIHHI-UHFFFAOYSA-N 390.447 2.966 0 50 GFAA CC(C)N1CCNC(=O)[C@@H]1CC(=O)NCc1sc2ccccc2c1Cl 670451873 WRKBLQMGLZEPCF-ZDUSSCGKSA-N 379.913 2.770 0 50 GFAA COc1cc(C(=O)O)ccc1-c1ccc(C(=O)N[C@H]2CN3CCC2CC3)cc1 670458652 IFSHVBQXDNUGTP-IBGZPJMESA-N 380.444 2.884 0 50 GFAA CN(C[C@@H]1CCN(c2ccccc2)C1)C(=O)Cn1ccc(=O)c2ccccc21 952976193 HXGQPAQPUNDSKG-SFHVURJKSA-N 375.472 2.986 0 50 GFAA Clc1ccc2nc(CCCNCc3cnc(N4CCOCC4)nc3)[nH]c2c1 952970755 AVRCVUGUDFFWBC-UHFFFAOYSA-N 386.887 2.565 0 50 GFAA CC(=O)N1CCC[C@H](C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)C1 185196718 GYTRPOOMYPBYPN-GJZGRUSLSA-N 383.414 2.659 0 50 GFAA CC(C)C(=O)N1CCN(C(=O)c2csc(Cc3cccc(F)c3)n2)CC1 272413374 GTBZDWANUJXCRJ-UHFFFAOYSA-N 375.469 2.813 0 50 GFAA Cc1noc([C@]2(O)CCN(S(=O)(=O)c3cc4cc(Cl)ccc4s3)C2)n1 275216914 BREFMYHAZUOCCO-HNNXBMFYSA-N 399.881 2.528 0 50 GFAA O=C(Cc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc1)NC1CC1 1616116257 ZWACKLZLBLPISU-UXHICEINSA-N 397.519 2.875 0 50 GFAA FC(F)(F)c1nnc(N2CCN([C@@H]3CCN(c4ccccc4)C3)CC2)s1 1506399153 ZHEOMMJUOYBATN-CQSZACIVSA-N 383.443 2.958 0 50 GFAA COc1ccc(CNC(=O)C2CCN([C@H](C)Cn3nc(C)cc3C)CC2)cc1 1506395947 KJBDRPXKJKGWQQ-GOSISDBHSA-N 384.524 2.925 0 50 GFAA CCCCn1nc(COc2ccccc2)nc1[C@H]1CCCN(C(=O)CO)CC1 1772816633 XQENKCSCHMNVON-KRWDZBQOSA-N 386.496 2.746 0 50 GFAA CCn1nc(CC(C)C)cc1-c1nc([C@H]2CCCN(C)C2)nn1-c1cnn(C)c1 1772809060 KZECVIOZVVYWAO-INIZCTEOSA-N 396.543 2.892 0 50 GFAA CN(C)S(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc(-c2cccc(F)c2)cc1 12074952 OPKNNTFBYVNYJL-SFHVURJKSA-N 391.468 2.702 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C[C@H]1CCOC1 12587643 QUOKPLROVKLTEB-HXUWFJFHSA-N 376.541 2.892 0 50 GFAA O=C(N[C@@H]1CCOC1)C1CCN(C2CCN(CCCc3ccccc3)CC2)CC1 19300431 GKHWEMZSDQYBJR-JOCHJYFZSA-N 399.579 2.701 0 50 GFAA COCCN(Cc1cnc(S(C)(=O)=O)n1CCCc1ccccc1)C(C)C 19939460 JEIMIBWNWBLASG-UHFFFAOYSA-N 393.553 2.776 0 50 GFAA CCC(=O)N1CCC[C@@]2(CN(CCCOc3ccccc3OC)CC[C@H]2O)C1 1857690916 USSYNIXRBSOYRT-IFMALSPDSA-N 390.524 2.550 0 50 GFAA Cc1cc(N2CCO[C@@]3(C[C@@H]4CC[C@H](C3)N4[C@@H](C)C(N)=O)C2)c2ccccc2n1 1857725411 VQACKNRCOURDOB-VOLVWJTLSA-N 394.519 2.619 0 50 GFAA CN1C[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCc3ccccc3F)cc1)C2 1857738045 PDHXKSLWVMDWEO-APWZRJJASA-N 384.451 2.807 0 50 GFAA CS(=O)(=O)N[C@@H]1CCN(C(=O)c2cc(-c3ccccc3)ccc2Cl)C1 116834854 OTKSDLQXHVUTCB-OAHLLOKOSA-N 378.881 2.771 0 50 GFAA CC(C)CC[C@@]1(C2CCN(Cc3ccc4c(c3)CCO4)CC2)NC(=O)NC1=O 12040726 BAVANPBXGDZDQQ-QFIPXVFZSA-N 385.508 2.848 0 50 GFAA CCS(=O)(=O)N1CCC(NC(=O)N[C@H](c2ccccc2C)C2CC2)CC1 264899331 YRYLOMFUGBWMID-SFHVURJKSA-N 379.526 2.559 0 50 GFAA O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NCc1cc(O)nc2ccccc12 267083010 JUTVRNKGQQCGPJ-IBGZPJMESA-N 391.471 2.848 0 50 GFAA O=C(N[C@H](CC1CC(F)(F)C1)C(=O)O)[C@H](c1ccccc1)N1CCCCC1=O 1875305558 FDFQTRXQFWGSAN-WBVHZDCISA-N 394.418 2.745 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NC3CCC(F)(F)CC3)C2)c1C 1875397071 JRFMOQXIGYVFME-OAHLLOKOSA-N 381.471 2.541 0 50 GFAA Cn1cncc1C(=O)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100537114 JCHDESGUQSYUGT-JOCHJYFZSA-N 390.487 2.998 0 50 GFAA O=C1C[C@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c1cccc(F)c1 100153570 MRNOCDDCSWDWNS-FERLCFGISA-N 393.462 2.789 0 50 GFAA COc1cccc(OC)c1[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)C1 2325786691 RZLLRTNILRMLFS-MRXNPFEDSA-N 378.432 2.914 0 50 GFAA COc1ccc([C@@H]2CCCCCN2C(=O)Cc2ccc(-c3nn[nH]n3)nc2)cc1 2325808438 ZWPSRKNIYBZHCN-IBGZPJMESA-N 392.463 2.957 0 50 GFAA COC(=O)Cn1c(CCS(=O)(=O)c2ccc(Cl)cc2)nc2ccccc21 896616 OHJLERIFHFCJJK-UHFFFAOYSA-N 392.864 2.879 0 50 GFAA CC1=C(C(=O)OC(C)C)[C@@H](c2cc3c(cc2Br)OCO3)NC(=O)N1 1107809 GXBJJPFPDGOBSW-CQSZACIVSA-N 397.225 2.757 0 50 GFAA CCCCOc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)OCCOC)cc1 4917835 BATCAFGCSPYUJR-QGZVFWFLSA-N 378.494 2.848 0 50 GFAA CCc1ccc(NC(=O)[C@@H]2CCCN2c2nn3c(=O)cc(C)nc3s2)cc1 6807220 DODDANQDTHKCBE-HNNXBMFYSA-N 383.477 2.629 0 50 GFAA COCc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)c1 29143692 ZOXDYASKIAAUTH-UHFFFAOYSA-N 394.518 2.934 0 50 GFAA CCOc1ccccc1NC(=O)N1CCN(c2cc(N(C)C)nc(C)n2)CC1 65363634 BUAOEAGAGVUXOF-UHFFFAOYSA-N 384.484 2.604 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCC4=NNC(=O)CC4)C3)C2)c1 12464558 FGBXFKFZYIWAQW-HSZRJFAPSA-N 396.535 2.856 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)c3ccc(OCc4ccccc4)nc3)CC2)CCO1 171258704 XXMAJYCKJNIWEL-SFHVURJKSA-N 395.503 2.986 0 50 GFAA O=S(=O)(Cc1noc2ccccc12)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 280617124 YTIPHLBOYBHQDB-HDICACEKSA-N 397.500 2.721 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC2CCCC2)cc1)c1ncc(F)cc1F 252493904 NGDBQYZKNSFENP-UHFFFAOYSA-N 381.404 2.833 0 50 GFAA COc1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 1537496 SJDOMIRMMUGQQK-UHFFFAOYSA-N 393.487 2.894 0 50 GFAA aggregator,biogenic,in-vivo O=C(Cc1nc(-c2cccnc2)n[nH]1)N[C@H]1CCCN(C2CCCCCC2)C1 72153161 DKLFRIHCSRCTBE-KRWDZBQOSA-N 382.512 2.713 0 50 GFAA Cc1noc2ncnc(N3CCC4(CC3)CC(=O)N(Cc3ccccc3)C4)c12 72457114 CPWIWZSMYPXZRJ-UHFFFAOYSA-N 377.448 2.945 0 50 GFAA Cc1ccc(C(=O)N2CCC(c3n[nH]c(=O)n3Cc3ccccc3)CC2)cc1 71760110 WXFSNMWXMWKWDG-UHFFFAOYSA-N 376.460 2.948 0 50 GFAA O=C1C[C@@H](NC(=O)CCCc2nc(-c3cccnc3)no2)c2ccccc2N1 222528408 OMWJIBLFDMXPKP-MRXNPFEDSA-N 377.404 2.654 0 50 GFAA Cc1cc(C)cc(NC(=O)[C@@H]2O[C@@H]3OC(C)(C)O[C@@H]3[C@@H]3OC(C)(C)O[C@@H]23)c1 229990771 NMPFJWNIAMWBKN-XSDHEKCYSA-N 377.437 2.638 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1)c1cc(C2CC2)no1 263550432 WCVSLTKAOUZVKU-MRXNPFEDSA-N 383.404 2.884 0 50 GFAA Nc1[nH]nc(C(=O)NCc2csc(-c3ncccn3)n2)c1-c1ccccc1 222945169 GVYMAFDPZBBCNZ-UHFFFAOYSA-N 377.433 2.502 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@@H]4CC[C@@H](N)C4)csc3C2)nc1 426685458 VHQFAQMYGAZMHX-HZPDHXFCSA-N 384.549 2.873 0 50 GFAA CC1(C)CN(Cc2ccc(OCCCN3CCOCC3)cc2)CC[C@]1(C)O 92045788 XVLQMWUXQCKFGV-QFIPXVFZSA-N 376.541 2.771 0 50 GFAA Cc1noc(CN2CCC(CCC(=O)Nc3ccc4c(c3)OCCO4)CC2)n1 95503046 JTHLCXLIIRYYRU-UHFFFAOYSA-N 386.452 2.780 0 50 GFAA NC(=O)c1ccnc(N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)c1 95500905 XEDLBFAYBLVNNV-UHFFFAOYSA-N 392.503 2.632 0 50 GFAA CCS(=O)(=O)c1cc(F)ccc1NC(=O)N1CCC[C@H](n2cc(C)cn2)C1 184279093 GVKUQJXRRLPTMG-HNNXBMFYSA-N 394.472 2.993 0 50 GFAA O=C(c1cc(F)ccc1F)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263615215 BFJZXVDALKLXCE-UHFFFAOYSA-N 397.429 2.849 0 50 GFAA COC[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccnn1C 299767389 GYZBFVICGWSLAV-QGZVFWFLSA-N 385.468 2.555 0 50 GFAA O=C(NCCNC(=O)c1ccc(F)cc1)NC[C@@H]1CCN(C2CCCCC2)C1 584900112 SBQZVAINSOHPSM-INIZCTEOSA-N 390.503 2.509 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)c1cnc(-c2ccncc2)nc1 952869425 SMKKAXSEKUHSRA-UHFFFAOYSA-N 375.432 2.623 0 50 GFAA COc1cc(OC)c(C(=O)NC2CCC(O)(c3cccnc3)CC2)cc1OC 170083138 HQAAAYBNDCQLPR-UHFFFAOYSA-N 386.448 2.668 0 50 GFAA COc1ccc(CNC(=O)C2CCN(C(=O)c3n[nH]c(C)c3Cl)CC2)cc1 1506427679 RSOKWCQEXQNSOI-UHFFFAOYSA-N 390.871 2.549 0 50 GFAA CNC(=O)CCC(C)(C)NS(=O)(=O)c1cc(Cl)c(OC)cc1Cl 1506411768 KXZFZRAHPKIUFE-UHFFFAOYSA-N 383.297 2.585 0 50 GFAA Cc1ccc(C)c(OCCc2nnc(NC(=O)[C@H](C)Cn3cncn3)s2)c1 1506427516 WLVGZQIHJSDOSG-CQSZACIVSA-N 386.481 2.643 0 50 GFAA CO[C@H]1CN(C(=O)c2cc(O)nc3ccc(C)cc23)C[C@H]1Cc1cc(C)no1 1704336135 GINNPYXDNFHVNF-KUHUBIRLSA-N 381.432 2.875 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)C2=CCCC2)C1)N1CCN(c2ccccn2)CC1 13637072 VBWJVUYGYOEDCZ-LJQANCHMSA-N 396.535 2.859 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCc1ccccc1OC)C2 14743097 DRYZUZGCBLZQQW-QGZVFWFLSA-N 382.508 2.795 0 50 GFAA Cc1ncccc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 14979002 GXQJJMOAXPSKQO-CQSZACIVSA-N 377.366 2.940 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C(=O)c2cnc(C)cn2)cc1 15079346 OMDVGHWJTJYBIO-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA Cc1nn(CC(=O)Nc2ccc(N3CCOCC3)cc2)c(C)c1Br 15951926 VZXLLKSVMYTNQE-UHFFFAOYSA-N 393.285 2.738 0 50 GFAA Cn1cc(CN2CCC3(CC2)c2ccccc2[C@@H](N2CCCCC2)[C@@H]3O)cn1 19851367 ZTOOFSXDINUJQC-YADHBBJMSA-N 380.536 2.855 0 50 GFAA COc1ccccc1C(=O)N1CCC2(CC1)NC(=O)N(c1ccc(F)cc1)N2 169764122 PTLGVVTWLGYWFO-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA O=C(c1cccc(-n2cnnc2)c1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857677126 XYJKJOUNSCCCMS-UHFFFAOYSA-N 384.443 2.898 0 50 GFAA O=C1NCCC[C@]12CN(Cc1ccc(OCc3ccccc3)cc1)CC[C@H]2O 1857689378 BVSBFGUKSRZSHM-FYYLOGMGSA-N 380.488 2.729 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2ccccn2)C[C@H]1NC(=O)c1cc(C)oc1C 1857691842 YVNTVPDIMLGZJG-KFKAGJAMSA-N 385.464 2.521 0 50 GFAA O=C1C[C@@H](CN2[C@H]3CC[C@@H]2C[C@]2(C3)CN(C/C=C/c3ccccc3)CCO2)CN1 1857701826 QMYCBUSIQGIHKM-QFWWPQJOSA-N 395.547 2.534 0 50 GFAA O=C(O)c1ccc2c(c1)N(C(=O)c1cccc(NC(=O)[C@H]3CCCO3)c1)CC2 908049103 ZJMQDLWGLNVBIY-GOSISDBHSA-N 380.400 2.705 0 50 GFAA Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)cn(C)c1=O 1875359486 FTMPWQJZNAVOFX-UHFFFAOYSA-N 377.400 2.837 0 50 GFAA Cn1ncc(C(=O)NC[C@@H](CO)c2ccc(F)cc2F)c1Cc1ccccc1 1875358368 TUXZVZXLHVDYCP-HNNXBMFYSA-N 385.414 2.795 0 50 GFAA Cc1cc(C)cc([C@@H](N)C(=O)N2CCC[C@@H](n3c(O)nc4cccnc43)C2)c1 1875327201 ORFQDEWLHZDFPO-SJLPKXTDSA-N 379.464 2.617 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccnc(Oc2ccccc2)c1 1875402142 COHWCIZCESZFQC-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA O=C(O)C[C@@H](NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 4126540 SGQLMLKFYNQNOY-GFCCVEGCSA-N 397.865 2.839 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3c2c(O)nc2nc4ccccc4n32)ccc1O 4624521 JISZXEKOFFJVID-NSHDSACASA-N 376.372 2.776 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2nncn2C)sc2c1CCCC2 713775 MTZYLHAHFRPOEW-UHFFFAOYSA-N 380.495 2.663 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NCc1ccncc1 804816 JYORKCGKDXJANT-UHFFFAOYSA-N 395.484 2.589 0 50 GFAA CCOc1ccccc1N(CC(=O)NC1CC1)S(=O)(=O)c1ccc(C)cc1 879969 HUZZITJFRGDAMZ-UHFFFAOYSA-N 388.489 2.868 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2ccccc2N2CCOCC2)C1=O 2356149380 XCZYBGIIONIZQN-QFIPXVFZSA-N 385.508 2.529 0 50 GFAA CC(C)(C)C(=O)N[C@]1(C(F)(F)F)NC(=O)N(c2ccc(Cl)cc2)C1=O 2863460 RKVAUMFCYXURQK-AWEZNQCLSA-N 377.750 2.817 0 50 GFAA O=C(COc1ccc(Br)cc1)Nc1cc(C(=O)O)cc(C(=O)O)c1 4725174 AYUDDNFSWFLWSE-UHFFFAOYSA-N 394.177 2.863 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2Cl)C1 4868036 XPEAOUXCAGEILO-JTQLQIEISA-N 377.293 2.673 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)ncn1 67601931 YDLSTXYKOLTBDU-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)N1CC[C@@H]2CCCC[C@H]2C1 247807034 BWWYBRYBOWYFEM-YESZJQIVSA-N 384.476 2.849 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(N(C)CC3(CO)CC3)nc2)C1 67871817 DPFHBKKKPIWQDK-SFHVURJKSA-N 387.524 2.758 0 50 GFAA COc1ccc(CC2(CO)CCN(S(=O)(=O)c3ccccc3F)CC2)cc1 23543574 SXMNOUWXNSLUFH-UHFFFAOYSA-N 393.480 2.840 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)NCCCc2cccc3ccccc23)CC1 67630023 UROUTYUGGROXPK-UHFFFAOYSA-N 388.533 2.950 0 50 GFAA Cc1nc2cc(C(=O)N3CC[C@@H](c4ccc5c(c4)OCO5)[C@H](O)C3)ccc2[nH]1 67714731 YTYROLHESOUDGP-MAUKXSAKSA-N 379.416 2.591 0 50 GFAA CC(=O)N(CC(=O)O)[C@@H]1CCCN(CCCOc2c(C)cccc2C)CC1 328604226 JBEVAHAOFOHGFF-LJQANCHMSA-N 376.497 2.860 0 50 GFAA CC(C)=CCN1CCN(Cc2c(F)cccc2Cl)[C@H]2CS(=O)(=O)C[C@H]21 72412429 MGHWBBBKINSEHT-MSOLQXFVSA-N 386.920 2.729 0 50 GFAA COc1cc(CCNC(=O)NC2CCN(Cc3ccncc3)CC2)ccc1C 172603518 CXESSTNMCRXIAE-UHFFFAOYSA-N 382.508 2.905 0 50 GFAA CCOc1cc(CN2CCCS(=O)(=O)CC2)ccc1OCC(F)(F)F 378347826 WIMCPXXDWRDSIA-UHFFFAOYSA-N 381.416 2.647 0 50 GFAA CN(C)[C@@H]1[C@@H](NC(=O)Cc2ccccc2OCc2ccccc2)[C@H]2CCO[C@H]21 222994877 WPJYTOITDVWNTA-YJSIEXFISA-N 380.488 2.642 0 50 GFAA CN1CCC(N2CCN(C(=O)NCc3cccc(C(F)(F)F)c3)CC2)CC1 426584048 QOTMBUHSHHHXAD-UHFFFAOYSA-N 384.446 2.627 0 50 GFAA Cc1ccc(N(C)C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc1 288831452 CMEYVODKAJIQNR-UHFFFAOYSA-N 387.505 2.770 0 50 GFAA CC(C)[C@H](Nc1ncnc2ccccc12)C(=O)NCCCc1csc(N)n1 426399321 BNOCVDKKMLCYFQ-INIZCTEOSA-N 384.509 2.854 0 50 GFAA CCN(CCc1nc2ccc(OC)cc2[nH]1)C(=O)NCc1nc(C)cc(C)n1 426508177 ZUPHEPDWGVJKJZ-UHFFFAOYSA-N 382.468 2.753 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC3CCOCC3)csc2C1 426397617 QTSNBMVGUJROTL-UHFFFAOYSA-N 375.494 2.820 0 50 GFAA CCN1C[C@H](CNC(=O)N(Cc2ccccc2)Cc2cccc(C)n2)CC1=O 426589908 CSOVTMUTXSFBAN-IBGZPJMESA-N 380.492 2.970 0 50 GFAA COCc1ncc(CN2CCC(Cc3nncn3-c3ccccc3)CC2)cn1 82108382 LCHIOUJNIXPSPB-UHFFFAOYSA-N 378.480 2.658 0 50 GFAA CCN(CCCc1ccccc1)c1cc([C@@H]2CCOC2)nc(N2CC(O)C2)n1 426399181 IARMUOCYPAVPMH-GOSISDBHSA-N 382.508 2.621 0 50 GFAA COc1cccc2c1OC[C@]1(C(=O)O)CN(C(=O)CCc3cccs3)C[C@H]21 95530224 MFUNMXPDLSXHGQ-FOIQADDNSA-N 387.457 2.779 0 50 GFAA Cc1nc(CN2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)n(C)c1C 96150821 UUQKVCPCALOHNN-UHFFFAOYSA-N 394.527 2.588 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCC4(CC3)[C@@H](C(=O)O)CC(=O)N4C)oc2c1 95384484 YZKFIRDNRBLPIR-OAHLLOKOSA-N 384.432 2.587 0 50 GFAA O=C(c1ccc(CO)cc1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95359059 AJRHFWNENWODLP-BHDDXSALSA-N 378.472 2.587 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)ccc1O 91486705 LIEAVYCQGLNYEF-UHFFFAOYSA-N 396.491 2.511 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@@H]2CCCN(c3ccccn3)C2)s1 96153175 TZWZIUIDLFDASV-CQSZACIVSA-N 377.539 2.757 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]3(CCCN(CCO)C3=O)C2)c(-c2ccccc2)o1 91664948 BISWBQFNLZVVSW-QFIPXVFZSA-N 382.460 2.702 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCCn1cncn1 95523255 GXULFKDUYOOEBC-SFHVURJKSA-N 378.432 2.735 0 50 GFAA C[C@@H]1CC(=O)N[C@H](C(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)C1 293986233 CJHHLNWJMAPOPD-SJCJKPOMSA-N 398.334 2.989 0 50 GFAA CN(C)Cc1c(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)oc2ccccc12 183049698 UJQLIWXCNCMFGL-SFHVURJKSA-N 392.459 2.815 0 50 GFAA CCOc1c(CNC(=O)N2CCN(Cc3ccccn3)CC2)cccc1OC 534667056 KVVSFCXRXYAVME-UHFFFAOYSA-N 384.480 2.516 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccccn2)CN1C/C(C)=C/c1ccccc1 299795066 LQTCFSUXGRJSKO-JHQMRULCSA-N 379.460 2.531 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@@H](c3ccc(C)cc3)N(C)C)CC2)c1 824781022 IMDZOSVCGWNNJK-JOCHJYFZSA-N 381.520 2.951 0 50 GFAA CN(C[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)NCCc1ccc(N(C)C)cc1 584896160 CIQXMKLNKHHTSS-GOSISDBHSA-N 386.540 2.728 0 50 GFAA Ic1cc(-c2noc([C@@H]3CCCc4nn[nH]c43)n2)cs1 952895951 YLUKBLDFNHYDPH-SSDOTTSWSA-N 399.217 2.989 0 50 GFAA O=C(CCCc1cccs1)NCC1CCN(c2nccnc2C(=O)O)CC1 952990985 NUCWMTUUGNBYED-UHFFFAOYSA-N 388.493 2.592 0 50 GFAA COc1ccc([C@@H](CC(=O)O)NC(=O)[C@H]2CCOc3ccccc32)cc1OC 268936044 HSVYPFNDLSKBNE-JKSUJKDBSA-N 385.416 2.902 0 50 GFAA COc1ccc(C2(CNC(=O)CSc3nnc(N)s3)CCCC2)cc1 952962388 CPMDABGJBWZNKQ-UHFFFAOYSA-N 378.523 2.849 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CNS(=O)(=O)Cc3ccc(F)c(Cl)c3)O2)n1 275352567 UHFZVAGHQQNYQM-RISCZKNCSA-N 389.836 2.510 0 50 GFAA COc1ccc(-c2cc(C(=O)O[C@@H]3CC(=O)N(C)C3)nn2-c2ccccc2)cc1 764731136 IXUMOIMVUOGMHG-GOSISDBHSA-N 391.427 2.935 0 50 GFAA COCCc1noc([C@@H]2CCCN(C(=O)c3nc4c(s3)CCCC4)C2)n1 1506408722 ZQWNXKSAIPZPRP-GFCCVEGCSA-N 376.482 2.614 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3cnc(Nc4ccccc4)nc3)CCN12 1529134349 YGVCPJUTWMQCMD-RBUKOAKNSA-N 381.480 2.546 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529159874 TZNFRHXMRKPVMR-NFBKMPQASA-N 393.487 2.950 0 50 GFAA Cc1ccc(C)c(OCCc2nnc(NC(=O)c3ccc(=O)n(C)c3)s2)c1 1529179170 AAFOFCYMASDWGC-UHFFFAOYSA-N 384.461 2.727 0 50 GFAA CCc1oc(C(=O)N[C@H]2COC[C@H]2Cc2ccncc2)cc1CN1CCCC1 1616081999 HGVSQAWGEVJUCA-MOPGFXCFSA-N 383.492 2.820 0 50 GFAA COCCNC(=O)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 11711685 AXZZTHDOHSTVBG-UHFFFAOYSA-N 380.492 2.611 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)n1 11879206 BHPOYRBSXUVIIR-ZDUSSCGKSA-N 398.419 2.614 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@@H](C(=O)c2cc(F)ccc2OC)C1 12316140 ZSCVFRVAHSJSHM-CYBMUJFWSA-N 389.427 2.829 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)c4ccc(F)c(Cl)c4)nnc3c2)n1 169776247 RJQJFIVXNGZCFB-UHFFFAOYSA-N 386.774 2.810 0 50 GFAA O=C([C@H]1CC[C@H](Nc2ncccn2)[C@@H](O)C1)N1CCC(c2ccccc2)CC1 1857705576 NEAVQOGQTRNNTM-UFYCRDLUSA-N 380.492 2.824 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)CCOC21CCN(C[C@@H]2CCCNC2)CC1 1857707713 YVTGNTDBNMHJBY-MRXNPFEDSA-N 391.581 2.750 0 50 GFAA Cc1nc(N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c2cccnc2n1 1857729538 DIKKWAFECIEWDD-OAQYLSRUSA-N 375.432 2.587 0 50 GFAA O=C(Nc1cnn(C[C@@H]2CCCCN2C(=O)c2cccnc2)c1)c1cccnc1 241401122 NBIDKBQVOVMZOO-IBGZPJMESA-N 390.447 2.620 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2ccc(Cl)cc2)cn1 456374861 JLAUSVRVUQKRFY-OAHLLOKOSA-N 379.869 2.750 0 50 GFAA CCOC(=O)N1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 19958005 PVCMZLRVCMUBGZ-ZDUSSCGKSA-N 377.268 2.507 0 50 GFAA O=C(N1CCOCC1)N1CCN(c2ccc3cc(F)cc(Cl)c3n2)CC1 1261451082 OUPSPEODQFRFRX-UHFFFAOYSA-N 378.835 2.602 0 50 GFAA COC(=O)[C@@H]1CCCN(C(=O)Cn2nc(C(F)(F)F)c3c2CCCC3)CC1 1875319053 PKZBIKNUYFMMNN-GFCCVEGCSA-N 387.402 2.582 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1cc(-c2ccccc2Cl)no1 1875402626 JDONWNFTCHMIFL-JCURWCKSSA-N 386.839 2.761 0 50 GFAA Cc1nc(N2CCCCC2)ncc1C(=O)N1CC2(COc3ccccc3C2)C1 2100542852 JCCUHGHYWKFAIS-UHFFFAOYSA-N 378.476 2.853 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1ccccc1 2434533 SSGYLVIVHULTSV-QGZVFWFLSA-N 385.851 2.618 0 50 GFAA CSc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 3561829 OELGEDPZVHTHAP-UHFFFAOYSA-N 392.502 2.682 0 50 GFAA C[C@H](CCc1ccccc1)NC(=O)c1ccccc1OCC(=O)N1CCOCC1 4842341 YDSXWMXQNUOZHJ-GOSISDBHSA-N 396.487 2.675 0 50 GFAA CS(=O)(=O)c1ccc(-c2nnn(Cc3cccc(Br)c3)n2)cc1 4866462 PBWVHRHSYSXWLL-UHFFFAOYSA-N 393.266 2.554 0 50 GFAA Cc1ccc(CN2CCN(c3cc(-c4ncon4)ccn3)C[C@H]2CCO)cc1 106947414 SFTCTUSAEFYKIA-LJQANCHMSA-N 379.464 2.513 0 50 GFAA Cc1cc(C(F)(F)F)ccc1OCC(=O)NC[C@@H]1CN(CC(C)C)CCO1 225543034 GUUGYZRORKWIFR-MRXNPFEDSA-N 388.430 2.866 0 50 GFAA COc1ccc(-c2noc([C@](C)(O)CN3Cc4ccccc4C3=O)n2)c(OC)c1 225507125 QIHRGHWKOAWFHV-OAQYLSRUSA-N 395.415 2.617 0 50 GFAA O=S(=O)(Nc1cccc2c1OCC[C@@H]2O)c1cnn(-c2ccccc2F)c1 225616636 OBSVTRJCMSCRAE-KRWDZBQOSA-N 389.408 2.628 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)n1 67741175 MHFADPQVTPNRBE-AZUAARDMSA-N 376.460 2.686 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)[C@@H](c3cccnc3)N3CCOCC3)cc2c1C 67872420 PDDVLMBOTXDUBH-OAQYLSRUSA-N 378.476 2.869 0 50 GFAA O=C(NC1CCCCCC1)[C@@H]1c2ccccc2C(=O)N1CCCN1CCOCC1 20152491 VUZRVVPXLOVJBN-NRFANRHFSA-N 399.535 2.745 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3ccc(-c4ccccc4)cc3)CC2)nn1 65361923 ARORMORCTQYLOR-UHFFFAOYSA-N 394.500 2.963 0 50 GFAA CCOc1cc2c(cc1NC(=O)CN1CCN(c3ccccn3)CC1)O[C@@H](C)C2 121235321 FJYGBAKPISFRKU-INIZCTEOSA-N 396.491 2.564 0 50 GFAA CC1=C(C(=O)N(C)Cc2csc(C(C)C)n2)[C@H](c2cccnc2)NC(=O)N1 67654929 VBODBLHJWSKZJL-INIZCTEOSA-N 385.493 2.948 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN2C(=O)[C@H](C)Cc2c(C)nn(C)c2C)cc1 363253296 LFUYVDLJTYLQFJ-JLTOFOAXSA-N 398.507 2.854 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)c1nn(-c2ccccc2)c2c1CCC2 363910445 ONRKWNRRTSJVPS-UHFFFAOYSA-N 384.443 2.872 0 50 GFAA O=C(O)CN(C(=O)c1csc(Cc2ccccc2F)n1)C1CCOCC1 238115437 HPDVYIBHLIVUER-UHFFFAOYSA-N 378.425 2.579 0 50 GFAA Cc1ccc(Oc2ccc(OCC(=O)N3CC[C@H](N4CCNCC4)C3)cc2)cc1 261973442 BSHVWMMVSMNBLO-IBGZPJMESA-N 395.503 2.672 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 378505234 BVFHONGJIDVWJB-JTSKRJEESA-N 379.504 2.963 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCC3(CC2)C[C@@H](C(=O)O)N(C(=O)C2CC2)C3)c1 72435899 YWGGSXGRNZUAGN-SFHVURJKSA-N 384.476 2.621 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)[C@@H]2CC(Cc3cccc(F)c3)=NO2)CC1 19865122 MRMJULQCBRRUFV-NRFANRHFSA-N 396.466 2.561 0 50 GFAA CN(Cc1ccccc1)c1ncc2c(n1)CC(C)(C)C[C@H]2NC(=O)c1ncn[nH]1 91876670 AUKOYJRBXWKTPV-MRXNPFEDSA-N 391.479 2.675 0 50 GFAA COc1cc2c(cc1OC)CN([C@@H](C(=O)O)c1ccc3c(c1)OCCO3)CC2 95387919 SJZIAMIDNONNBX-HXUWFJFHSA-N 385.416 2.659 0 50 GFAA O=C(O)[C@H](c1ccc2c(c1)OCCO2)N1CCC(OCc2cccnc2)CC1 95374702 BUOIEISURLOCNO-FQEVSTJZSA-N 384.432 2.660 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(Cc2ccc(-n3ccnc3)cc2)CC1 96151708 UGENLBKQOGHYOY-UHFFFAOYSA-N 393.539 2.925 0 50 GFAA CN(CC(=O)N[C@H]1CCCc2sc(Cl)cc21)c1ncnc2nc[nH]c12 293777906 VTPHCNNXGROYKH-JTQLQIEISA-N 376.873 2.698 0 50 GFAA CN(Cc1nc(-c2cccnc2)no1)C(=O)c1ccc([C@@H]2CCCNC2)cc1 95367258 BBGWWVJIXFFDOY-QGZVFWFLSA-N 377.448 2.871 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2cccc(F)c2)CC1 96139400 UYQRDMYWOIGFEP-UHFFFAOYSA-N 382.443 2.702 0 50 GFAA Cc1nnn(-c2ccc(NC(=O)[C@H](Sc3cnn[nH]3)c3ccccc3)cc2)n1 252494364 NTRRFRVXOYLISQ-QGZVFWFLSA-N 392.448 2.561 0 50 GFAA CC(C)N(C[C@H]1CCC(=O)N1)C(=O)c1cccc(-c2csc(C(N)=O)c2)c1 534658239 MMJFNAOJVPHIHA-MRXNPFEDSA-N 385.489 2.643 0 50 GFAA O=C(N[C@H]1CCS(=O)(=O)C1)c1cccnc1SC/C=C/c1ccccc1 670452701 GOPLEXYGNQBPHS-WHWKNOJMSA-N 388.514 2.804 0 50 GFAA Cc1sc(S(N)(=O)=O)cc1C(=O)N(Cc1ccccc1)C[C@H]1CCCO1 1346306462 NAPBGXRSNAWZKL-OAHLLOKOSA-N 394.518 2.525 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(c3ccccn3)C2)cc1C 952971125 XBGHGMCABOWWLA-INIZCTEOSA-N 382.464 2.830 0 50 GFAA C[C@@]12CC3CC(OCCNC(=O)[C@@H]4CCCN(C(N)=O)C4)(C1)C[C@](C)(C3)C2 952981652 NAGZYSKZKFPAJZ-RKFCVKKLSA-N 377.529 2.659 0 50 GFAA COc1ccc(CN2CC[C@H](O)[C@H](C(=O)O)C2)cc1OCc1ccc(F)cc1 1615964683 PIUQFSWUULZLMH-MSOLQXFVSA-N 389.423 2.681 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCC[C@H](c2cc(O)ncn2)C1 1506403349 NYNDQHAMKJEGTK-ZDUSSCGKSA-N 388.855 2.879 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CCC(OCc3cccnc3)CC2)CC1 1506406746 OKZDAVWKOBIUHX-UHFFFAOYSA-N 380.492 2.762 0 50 GFAA O=C(c1cccc2c1OCCO2)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529172303 DBMZFNVHQHOXEW-UZLBHIALSA-N 390.439 2.682 0 50 GFAA Cc1cc(=O)oc2ccn(CCc3nc(-c4ccc(N(C)C)cc4)no3)c(=O)c12 1772491315 DCJPPYRBWRFAQZ-UHFFFAOYSA-N 392.415 2.622 0 50 GFAA Cc1cccn2ncc(C(=O)NC34C[C@@H]5C[C@H](C3)CC(n3cncn3)(C5)C4)c12 1772706157 HWBWQJLUVXQCIZ-XBLGPDGASA-N 376.464 2.712 0 50 GFAA COc1ccccc1OCc1cc(C(=O)N2CCC(N3CCCC3)CC2)no1 11772597 JVQDKRABOZECMF-UHFFFAOYSA-N 385.464 2.963 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)N(C)[C@H]3CCOC3)CC2)CC1 11879972 RDWZIEQZTIOTSX-QHCPKHFHSA-N 399.579 2.919 0 50 GFAA CC(C)N(C[C@H]1CCC(=O)N1)C(=O)c1cc(Cn2ccc3ccccc32)[nH]n1 12300940 VCYUSLBFTPNBJO-MRXNPFEDSA-N 379.464 2.542 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)C2=C(C)OCCO2)CC1 12386043 PCBCKJCNYZMYLQ-UHFFFAOYSA-N 388.508 2.686 0 50 GFAA COc1cccc(C(=O)NCC2CCN(C(=O)c3cccc(OC)c3)CC2)c1 13324132 QQPLWFDHNKUNHX-UHFFFAOYSA-N 382.460 2.986 0 50 GFAA Cc1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(F)cc4Cl)C3)nn2)n1 169777912 XVYUHJBIFPUUOU-LLVKDONJSA-N 376.779 2.516 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCC(Cn2cccn2)CC1 1857700168 BCJCTUSOUNAQKQ-UHFFFAOYSA-N 382.493 2.911 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3C[C@@H]4[C@H](CO)[C@H]5CC[C@]4(C3)O5)c2)c1 1857730233 NLRZKPTYRKWCEL-ZZLPTCMGSA-N 379.456 2.974 0 50 GFAA CS(=O)(=O)c1ccc(-c2nccn2C2CCN(c3ncccn3)CC2)cc1 1857741402 QRZLWPXBRXXZRM-UHFFFAOYSA-N 383.477 2.585 0 50 GFAA CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 4598914 XGJGWYRHLPSMLW-IRXDYDNUSA-N 378.469 2.943 0 50 GFAA in-vitro COc1ccccc1CN1C(=O)O[C@H]2CN(Cc3nc4ccccc4n3C)C[C@H]21 248024750 KYQSVZIVMYJGHW-QUCCMNQESA-N 392.459 2.787 0 50 GFAA CC(=O)NCc1ccc(C(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)cc1 367852034 YIOQKSQKVXXOET-QHCPKHFHSA-N 380.488 2.780 0 50 GFAA CC1(C(=O)N[C@H](CO)Cc2ccc(O)cc2)CCN(Cc2ccccc2)CC1 157109326 KNTUVMDPPCSTBJ-FQEVSTJZSA-N 382.504 2.714 0 50 GFAA CCOc1cccnc1S(=O)(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 1875298851 POMMTFGNTIUJHN-SJLPKXTDSA-N 376.478 2.927 0 50 GFAA O=C(CCCC(=O)Nc1ncn(Cc2ccccc2)n1)NCc1ccccc1 1875257889 VXGQJEGJXCSKKP-UHFFFAOYSA-N 377.448 2.752 0 50 GFAA CNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)c2ccccc12 1875313515 ONXYAGVEESNTTE-IBGZPJMESA-N 382.485 2.784 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](C)c3cccc(F)c3)C2)c1C 1875397065 JMVCYHZWKSZLFL-CRAIPNDOSA-N 385.487 2.864 0 50 GFAA Cc1cc(CCN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)ccc1F 1875400280 VXXITRVGVQHINQ-GOSISDBHSA-N 399.514 2.654 0 50 GFAA C[C@@H](CC(=O)N[C@@](C)(CNC(=O)c1cc(C2CC2)[nH]n1)C1CC1)c1ccncc1 1775997163 XHKCZWFAJMQCHF-FPTDNZKUSA-N 395.507 2.891 0 50 GFAA COC(=O)c1coc(C2CN(C(=O)CO[C@@H]3C[C@H](C)CC[C@H]3C(C)C)C2)n1 2325811018 XTPQJVBVEUWBPZ-UKPHBRMFSA-N 378.469 2.864 0 50 GFAA CCN1CCN(c2cccc(N=c3cc[nH]c(-c4ccc(F)cn4)n3)c2)CC1 2325860098 XLIJUKBTBNJRMA-UHFFFAOYSA-N 378.455 2.985 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nnnn2-c2ccccc2C)cc1 1118656 FUBQAUQSIKZKMT-UHFFFAOYSA-N 397.460 2.878 0 50 GFAA Oc1nc(-c2cccnc2)nc2c1CCC21CCN(C[C@@H]2CCCNC2)CC1 2356135507 HNQNMUYCIKMWCK-MRXNPFEDSA-N 379.508 2.524 0 50 GFAA COC(=O)C1=C(C)N(C(C)C)C(=O)[C@]1(NC(=O)C1CCCCC1)C(F)(F)F 2871969 IEUWPCFLIBYUFF-KRWDZBQOSA-N 390.402 2.682 0 50 GFAA COc1ccccc1CNC(=O)Cc1c(C)c2ccc(OC)c(OC)c2oc1=O 4090016 PQVRHTQDFJGUKX-UHFFFAOYSA-N 397.427 2.986 0 50 GFAA biogenic C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCO1 4410563 ANBKWOVLQRFZTG-SZMVWBNQSA-N 392.496 2.780 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(=O)N1CCCCC1 4999253 YVNKJFUVQQMXDX-UHFFFAOYSA-N 375.450 2.517 0 50 GFAA CCS(=O)(=O)N(Cc1ccccc1)c1c(C)n(C)n(-c2ccccc2)c1=O 6747142 LRJMFJALAOJMMB-UHFFFAOYSA-N 385.489 2.841 0 50 GFAA O=C(Nc1cccnc1)[C@@H]1CCCN(c2ncnc3c2nc2n3CCCCC2)C1 6899836 OCKLQHLECHUIKW-OAHLLOKOSA-N 391.479 2.803 0 50 GFAA COCCCN1CC[C@@H](Cn2cc(Oc3ccccc3)c(=O)c(C(=O)O)c2)C1 55308078 JZOIPHFAYBAFHB-MRXNPFEDSA-N 386.448 2.697 0 50 GFAA CC(C)CCN1CCN(Cc2ccc(OCCN(C)C)cc2)C[C@H]1CCO 104642755 PLSRKBGRMUBIBU-OAQYLSRUSA-N 377.573 2.542 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(OC)cc3F)[C@@H](CCO)C2)o1 20919659 OHWOUXUCIKGUEQ-KRWDZBQOSA-N 392.471 2.643 0 50 GFAA c1ccc2c(c1)nnn2CCNC1CCN(c2ccc(-n3ccnc3)cc2)CC1 20782805 UJOJMLOWIVEROK-UHFFFAOYSA-N 387.491 2.876 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3C)CC2)c(OC)c1 20418618 PELSKHLTCJSYQS-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA Cc1c(CN(C)C[C@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)cnn1C 67804701 YGNYRSBNSJFUCL-HSZRJFAPSA-N 398.551 2.837 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccc(C)c(C)c4)CC3)ncn2)n1 67613805 RSJMRHWWOYJKNP-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2nc(O)cc(C(F)(F)F)n2)n1C 328630720 JQAQKYMWKHNLNJ-GFCCVEGCSA-N 397.401 2.626 0 50 GFAA CN(CC(=O)OC[C@H]1CC(=O)N(c2ccccc2)C1)C(=O)OCc1ccccc1 252485190 GOVXHVGWRWOPIV-SFHVURJKSA-N 396.443 2.851 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(c3ccc4ccccc4n3)CC2)C1 71639101 VLWQYTCBIAMAPU-IBGZPJMESA-N 396.535 2.678 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CNS(=O)(=O)C3=Cc4ccccc4CC3)O2)n1 328608703 AZVUCTTUGDECJP-WBVHZDCISA-N 375.450 2.505 0 50 GFAA CC(=O)c1cccc(O[C@H](C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1 152200844 BFKISVJREFQPSX-UTKZUKDTSA-N 394.471 2.964 0 50 GFAA O=S(=O)(CCn1ccnc1-c1ccc([C@@H]2CCCCO2)o1)N1CCCC1 77537621 HPTRVCDAFDUPJE-HNNXBMFYSA-N 379.482 2.810 0 50 GFAA Cc1ccc2[nH]c(CN3CCN(C4CCN(C)CC4)[C@H](CCO)C3)c(C)c2c1 39557983 DLZDJEJIOPDFID-HXUWFJFHSA-N 384.568 2.748 0 50 GFAA COC(=O)[C@@H]1Cc2cc(OC)c(OC)cc2CN1CC(=O)Nc1ccc(C)cc1 35754340 CVJAAUBSOABKGD-SFHVURJKSA-N 398.459 2.551 0 50 GFAA CC1=CCN(C(=O)[C@@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1 77427788 BGQBHWDLPNFANQ-BLRYILKCSA-N 392.499 2.764 0 50 GFAA CC(C)N(CCNC(=O)N1CCC2(CC1)C[C@H]2C(=O)N(C)C1CC1)C(C)C 378487556 GLZTUOJPXGSIDG-SFHVURJKSA-N 378.561 2.538 0 50 GFAA COC(=O)[C@H]1CCCN(C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)C1 448877699 JCIPWSOEUFERII-FQEVSTJZSA-N 394.471 2.950 0 50 GFAA Fc1cccc(CN2CCN(Cc3cccc(CN4CCOCC4)c3)CC2)c1 72169887 WBHXPQOEJBVDAE-UHFFFAOYSA-N 383.511 2.976 0 50 GFAA C[C@@H](C1CCN(C(=O)c2ccc(OC(F)F)cc2)CC1)N1CCN(C)CC1 82120208 KHYNLXUFNCYRHH-HNNXBMFYSA-N 381.467 2.776 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 91713779 DNQXBDCUCOOKKV-JOCHJYFZSA-N 380.444 2.658 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NCCc1cnn(-c3ccccc3)c1)C2 95528095 JUQVONQTPBNXOL-SFHVURJKSA-N 377.444 2.791 0 50 GFAA O=C(COc1cccc(Cl)c1)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 91526613 PJEHUZVMSNSKOQ-FQEVSTJZSA-N 376.884 2.970 0 50 GFAA Nc1nc(NC2CC2)cc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)n1 95526251 ROLGVAVCRCMGOK-INIZCTEOSA-N 390.495 2.657 0 50 GFAA CCc1ccccc1OC1CN(C(=O)CCn2c(CO)nc3ccccc32)C1 96180611 VPNOJOYHZJPTJM-UHFFFAOYSA-N 379.460 2.771 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCC4(CC3)[C@H](C(=O)O)CC(=O)N4C)oc2c1 95384483 YZKFIRDNRBLPIR-HNNXBMFYSA-N 384.432 2.587 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)NC[C@H]1COc2ccccc2C1 96131496 DEZIUUBKXNTAMM-HNNXBMFYSA-N 378.432 2.822 0 50 GFAA Cc1c(NC(=O)CN(C)C)cccc1NC(=O)N(C)CC[C@@H]1CCCCO1 96141923 HAUCWIBFMDJSAU-INIZCTEOSA-N 376.501 2.918 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccc(Cl)cc3O)C2)CCC1=O 91325517 JPEBCQXDQHCBSL-IBGZPJMESA-N 380.872 2.537 0 50 GFAA CN(C)C(=O)c1ccc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)nc1 95519519 RQVKDGDOBIBFEE-IBGZPJMESA-N 390.491 2.807 0 50 GFAA O=c1c2ccccc2cnn1CCNC1CCN(c2nc3ccccc3o2)CC1 95359349 LLVMZQHQSCXMNR-UHFFFAOYSA-N 389.459 2.796 0 50 GFAA O=C([C@H](O)[C@H](O)c1nc2ccccc2s1)N1CC[C@H](Cc2ccccc2)C1 180808977 AYUNLJBSWADZGP-AYOQOUSVSA-N 382.485 2.782 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N[C@@H](c1cccs1)[C@H]1C[C@@H](O)C1 244795606 RJQLAEDTWLLFNP-QWQRMKEZSA-N 379.503 2.540 0 50 GFAA COc1ccc([C@H](NC(=O)Cn2cnc3ccccc32)[C@H]2C[C@@H](O)C2)cc1F 252535872 HBKHCYVMKNAWCE-ZSDSOXJFSA-N 383.423 2.812 0 50 GFAA COCCN1CCCN(C(=O)c2ccccc2NC(=O)c2ccccc2)CC1 299247332 PYOKSOSONNQOCR-UHFFFAOYSA-N 381.476 2.733 0 50 GFAA C[C@H](c1ccc(C(=O)NCc2cccnc2-n2cncn2)o1)N1CCCCC1 299782388 VOHJUDXUNRXHRK-OAHLLOKOSA-N 380.452 2.732 0 50 GFAA O=C(Nc1ccc2nc(CN3CCCCC3)[nH]c2c1)c1ccn2nccc2n1 1331922355 IFQVVEROXVTYBD-UHFFFAOYSA-N 375.436 2.844 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)NC23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)c1C 952977698 IRDWSVAJRKYHKA-XBLGPDGASA-N 381.480 2.904 0 50 GFAA CN1C(=O)COc2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCO3)cc21 952970819 BZNOOFZKTIBBAP-HNNXBMFYSA-N 382.416 2.852 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc(OC)c(C(=O)N(C)C)c1 952965770 BZDANDUDFDHXAM-LJQANCHMSA-N 381.476 2.782 0 50 GFAA CC(=O)c1ncc(C(=O)N2CCC(CNC(=O)c3cc(C)oc3C)CC2)s1 952964510 MDHCEMQRTFLBLO-UHFFFAOYSA-N 389.477 2.838 0 50 GFAA CCCC[C@H]1CN(c2cc(C(=O)N3CCN(C)CC3)ccn2)C[C@@H](C2CC2)O1 1615734914 IITGTTHUNXEBPE-PMACEKPBSA-N 386.540 2.643 0 50 GFAA O=C([C@H](Cc1ccccc1)n1cnnn1)N1CCOc2ccc(Cl)cc2C1 1506405969 PBCULNORDKXIPE-KRWDZBQOSA-N 383.839 2.532 0 50 GFAA Fc1cnc(N2CCC[C@H](c3nc4ccccc4[nH]3)C2)nc1N1CCOCC1 1506406883 RXTCKSAPRKFCJC-AWEZNQCLSA-N 382.443 2.713 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)c2cnc(SC)nc2)CC1 1704313459 NRIKBSUDGDIGAM-UHFFFAOYSA-N 385.489 2.911 0 50 GFAA CSc1ccc(S(=O)(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)cc1 5050546 AESADNTWTXFQRK-UHFFFAOYSA-N 386.520 2.605 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)N(C)CCc2ccccc2)c1=O 12190264 YZVPAZKAYTWJRX-UHFFFAOYSA-N 383.492 2.569 0 50 GFAA Cn1ccc(C(=O)N2CCC[C@@H]3CN(C(=O)CCCc4ccccc4)CC[C@@H]32)n1 12218817 ZAPNXUASKGLCMI-CTNGQTDRSA-N 394.519 2.896 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)C3CCOCC3)C2)c1 13594297 CPERAQHCPWJDON-KRWDZBQOSA-N 388.508 2.757 0 50 GFAA O=C(Cn1cccn1)N1CC[C@@H](C2CCN(Cc3cccc(F)c3F)CC2)C1 14977264 XLIVCHMDDSXAGX-QGZVFWFLSA-N 388.462 2.922 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)NC[C@@H](C)c2ccccc2)c1=O 14983003 SXLPNYXXFIVADR-MRXNPFEDSA-N 383.492 2.788 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1C2 1857668316 ATCXIQFBGMRLFF-LZJOCLMNSA-N 394.519 2.904 0 50 GFAA CCn1cc(C(=O)N2[C@H]3CC[C@@H]2[C@](CC)(C(=O)O)C3)c(=O)c2ccc(C)nc21 1857671454 SKBCWOZSJKVFHE-CQURBHOASA-N 383.448 2.583 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)cc(O)n1 1857726961 IRWQLYPTKZTODI-RTBURBONSA-N 382.460 2.983 0 50 GFAA Cc1nc2ccc(C(=O)N3CC[C@H](c4ccc5c(c4)OCO5)[C@@H](O)C3)cc2[nH]1 209966959 YTYROLHESOUDGP-QAPCUYQASA-N 379.416 2.591 0 50 GFAA COC[C@@H](NCc1nc(N)nc(=Nc2ccccc2C)[nH]1)c1cccc(Cl)c1 411761599 YDTZEQYNHCVVMQ-QGZVFWFLSA-N 398.898 3.058 0 50 GFAA Cc1cccc(S(=O)(=O)CCCN2C(=O)N[C@@](C)(c3cccs3)C2=O)c1 164858297 YOAKNTFRRMGOSV-SFHVURJKSA-N 392.502 2.688 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)C1 814335997 PYWVYBVWQZGGHS-SMDDNHRTSA-N 381.391 2.999 0 50 GFAA COc1ccc(-c2nnc(N3CCc4ccc(S(C)(=O)=O)cc4CC3)o2)cc1 1875270122 VWDRIDFKMXRTNI-UHFFFAOYSA-N 399.472 2.754 0 50 GFAA COc1ccccc1[C@H](CNC(=O)N1CC[C@@H](O)CC12CC2)N1CCCCC1 1875288999 OUKCFDAZOBIZKT-MJGOQNOKSA-N 387.524 2.921 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)N[C@H]1CCCc3occc31)CCO2 1875393154 HWJFRTXRHWRAPB-IWKOHUFWSA-N 395.525 2.719 0 50 GFAA CC(C)[C@H](NS(C)(=O)=O)C(=O)N[C@H](CNc1ccccc1)c1ccccc1 1875344454 LEKSXEWRYBLFFQ-MOPGFXCFSA-N 389.521 2.530 0 50 GFAA COc1cc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)ccc1OC1CCCC1 1875403487 VENXKERMXMUPCA-ATZDWAIDSA-N 399.491 2.783 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1Br 4144244 AKEGIBOVECMXSC-CQSZACIVSA-N 383.242 2.657 0 50 GFAA CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)O 2564501 XINBRUNUJFZFGH-MOPGFXCFSA-N 398.459 2.750 0 50 GFAA COc1cccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCOc2ccccc2)c1 4113566 NVQBVXFXTSDXPR-IBGZPJMESA-N 382.416 2.945 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1nccs1 10435148 ZZHJGUNNPTVYQO-UHFFFAOYSA-N 381.479 2.579 0 50 GFAA CCc1c(O)nc(SCC(=O)N2CCCCC2)n(-c2ccccc2C)c1=O 8772844 RACDSWBFHRSSBK-UHFFFAOYSA-N 387.505 2.914 0 50 GFAA CC[C@H](c1ccc(F)cc1F)N1CCN(c2ccc(C(=O)N(C)C)nn2)CC1 413171932 OAOLFAVJYMVBDO-GOSISDBHSA-N 389.450 2.730 0 50 GFAA COC1CCN(c2ccc(C(=O)N3CCCC[C@H]3CCn3cccn3)cn2)CC1 20993652 VCDSBPUAVFZYJF-IBGZPJMESA-N 397.523 2.978 0 50 GFAA COc1cc(C(=O)Nc2ccc(NC(=O)C(C)(C)C)c(OC)c2)nc(OC)n1 65383766 OVXSJBPDALCSFK-UHFFFAOYSA-N 388.424 2.739 0 50 GFAA OCC[C@@H]1CN(Cc2cccn2-c2cccnc2)CCN1Cc1ccccc1 20998737 SBJDLFQECAKTHI-JOCHJYFZSA-N 376.504 2.941 0 50 GFAA Cc1csc(CCNC[C@]2(O)CCCN(CCC3CCCCC3)C2=O)n1 67834090 MHILBODTXDENOX-HXUWFJFHSA-N 379.570 2.908 0 50 GFAA CCn1cc(-c2cc(C(=O)N(C)Cc3nncn3C)c3cc(F)ccc3n2)cn1 63847775 WYUJQABWWJFXFS-UHFFFAOYSA-N 393.426 2.658 0 50 GFAA COc1ccc(CN2CCN(C3CCCCC3)[C@H](CCO)C2)c(OC)c1OC 39442047 IFPJLLWMGFTDGS-LJQANCHMSA-N 392.540 2.914 0 50 GFAA CCn1nc(C)c(C(=O)Nc2cnn(Cn3nc(C)c(Cl)c3C)c2)c1C 2786296 USXUPYXLYMEUGC-UHFFFAOYSA-N 375.864 2.941 0 50 GFAA Cc1ccc(C(=O)N2CCc3c(nc(-c4ccncc4)nc3N(C)C)C2)c(O)c1 71730462 OKBTYHWZBKVRSI-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA Cc1noc(C2CCN(Cc3nnc(C(=O)Nc4ccccc4)s3)CC2)n1 121932486 LIVWEJXUNHDJTP-UHFFFAOYSA-N 384.465 2.861 0 50 GFAA COC(=O)c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1ncn(C)c1Cl 253433510 XRWXRTCZNZXDBH-UHFFFAOYSA-N 398.655 2.968 0 50 GFAA C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCN(C2CCOCC2)C1=O 331502650 BGWVZCYKNLAFJO-DYVFJYSZSA-N 398.425 2.780 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)Nc1ccn(Cc3ccncc3)n1)CC2 172367903 ABPFUWLHXWQIEK-UHFFFAOYSA-N 393.447 2.934 0 50 GFAA COCCNC(=O)Cn1cc(NC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)cn1 363592429 JXSORQSUGOZZAE-LJQANCHMSA-N 399.495 2.632 0 50 GFAA COc1ccccc1[C@@H](NC(=O)CCc1c(C)nc(C)[nH]c1=O)c1ccco1 128918647 ZBGMPLOJZAENDY-HXUWFJFHSA-N 381.432 2.827 0 50 GFAA CC[C@@H](O)CCNC(=O)c1c(F)ccc(S(=O)(=O)C2CCCC2)c1F 241170983 KDGYPQRUWJDVSS-LLVKDONJSA-N 375.437 2.572 0 50 GFAA CCN1CCN(Cc2ccc3c(c2)Cc2ccccc2-3)[C@H]2CS(=O)(=O)C[C@H]21 77518238 FKWUGCCFVIJPBY-YADHBBJMSA-N 382.529 2.561 0 50 GFAA COc1ccc2cc([C@@H]3CN(C(=O)c4cc(=O)c(OC)c[nH]4)CCO3)ccc2c1 71388527 QBQRHIWRLVOTHI-NRFANRHFSA-N 394.427 2.759 0 50 GFAA Cc1cc(C)c(NC(=O)C[C@H]2COc3ccc(C(=O)N(C)C)cc3N2C)c(C)n1 71746778 TYLSXZJGMPWVTI-KRWDZBQOSA-N 396.491 2.935 0 50 GFAA O=C(CN1CC[C@@H](c2ccccc2)C1)N1CCCN(Cc2ccncc2)CC1 222457689 LOIROICQVUWFOM-JOCHJYFZSA-N 378.520 2.605 0 50 GFAA O=C(Cn1ccc([C@@H]2CCCNC2)n1)N1CCC(OCc2ccccc2)CC1 426701468 RBKIGCBIGPCVAP-LJQANCHMSA-N 382.508 2.558 0 50 GFAA CC(C)N1C(=O)[C@@]2(Cc3c(Cl)cccc3N3CCCC[C@H]32)C(=O)NC1=S 229915158 SCUJNEBFSBCZLW-HNAYVOBHSA-N 391.924 2.893 0 50 GFAA O=C(c1cccc(OCn2cc(Cl)cn2)c1)N1CCC2(CC1)OCCO2 20606114 OZDBGPBSPZKPBI-UHFFFAOYSA-N 377.828 2.552 0 50 GFAA Nc1cc(-c2ccc(C(=O)N3CCCC[C@@H]3CCn3ccnc3)cc2)ncn1 426420383 RGBAUCQFQBUXFL-GOSISDBHSA-N 376.464 3.007 0 50 GFAA COc1ccccc1CNC(=O)CN1CCC[C@@H](c2ccc(C(=O)O)cc2)C1 95372553 DRYKWFKHDWVAQF-LJQANCHMSA-N 382.460 2.889 0 50 GFAA O=C(c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc1)N1CCCCC1 239439154 ZMTXTZVBIWXYBD-IPJCAIGPSA-N 376.456 2.870 0 50 GFAA O=C(CCc1cccc(Cl)c1)N1CC[C@H](N2CCOCC2)[C@H](CCCO)C1 92002422 SNQUCNHWDDDQPA-QUCCMNQESA-N 394.943 2.594 0 50 GFAA CNCC(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95517222 NPUZTSUSGFOPJE-UHFFFAOYSA-N 393.915 2.602 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Cn3ccc4ccccc43)C2)CCC1=O 91351029 YNFDJAUSMXOOBL-JOCHJYFZSA-N 383.492 2.519 0 50 GFAA CCN(CC)C(=O)c1ccc(NC(=O)N[C@H](COC)c2ccnn2C)c(C)c1 97547522 IJKKGQWCVPPQFS-QGZVFWFLSA-N 387.484 2.720 0 50 GFAA O=C(c1cccc(N2CCNC2=O)c1)N1CCc2[nH]c(-c3ccccc3)nc2C1 96165879 SCSRGVPRMCFEEB-UHFFFAOYSA-N 387.443 2.805 0 50 GFAA Cc1ccc(SCCN(C)C(=O)c2ccc(N3CC(=O)NC3=O)cc2)cc1 97694943 YDQMDWLTDALMSS-UHFFFAOYSA-N 383.473 2.916 0 50 GFAA O=C(CCCN1CCCC1)N1CCC(c2nccn2Cc2cccnc2)CC1 95497251 VFRRGCXFKJYNCH-UHFFFAOYSA-N 381.524 2.908 0 50 GFAA O=C(Cc1ccc2c(c1)NC(=O)C2)NCc1ccc(COC2CCOCC2)cc1 183186543 IQJNKCLDOHNGEW-UHFFFAOYSA-N 394.471 2.736 0 50 GFAA C[C@@H](CNC(=O)N1CCC(c2nc3ccccc3o2)CC1)CN1CCOCC1 163377706 XHRTVWIOYODLRH-INIZCTEOSA-N 386.496 2.685 0 50 GFAA c1ccc(-n2cc(CCNCc3cnc(NC[C@H]4CCCO4)nc3)cn2)cc1 952960379 OICQVXMLAXBTOJ-HXUWFJFHSA-N 378.480 2.586 0 50 GFAA O=C([C@@H](c1ccccc1)C1CCCC1)N1CCC(N2CCN(CCO)CC2)CC1 952981344 WBKVYCSVDFPYMS-QHCPKHFHSA-N 399.579 2.561 0 50 GFAA COc1cc(C)sc1C(=O)N[C@H]1CCOC[C@@H]1Oc1ccc(CO)cc1 1565514670 AJKFQAHBEISVGG-RDJZCZTQSA-N 377.462 2.524 0 50 GFAA C[C@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)CCS(=O)(=O)C1 191873481 IVMKGLBQJATFQK-NSHDSACASA-N 384.910 2.970 0 50 GFAA CC(=O)Nc1ccc(NC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)cc1C 731572666 FBHPWQPABRQPAG-UHFFFAOYSA-N 380.379 2.891 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](OCc2ccccn2)C1 1506408089 VGUYACQGHCUMSJ-IBGZPJMESA-N 381.476 2.740 0 50 GFAA Cc1nccn1-c1ccccc1CNC1CCN(C(=O)c2ccncc2)CC1 1506401451 RQKPCUHAVZKTNC-UHFFFAOYSA-N 375.476 2.970 0 50 GFAA CO[C@H]1CN(c2cc(C(F)(F)F)nc(N(C)C)n2)C[C@H]1Cc1cc(C)no1 1704342882 FTISBSAFDCMVEI-YPMHNXCESA-N 385.390 2.552 0 50 GFAA O=C(c1ccc(CNc2nccc(N3CCC[C@H](O)C3)n2)cc1)N1CCCCC1 1704341612 XVIRHAFMEBCNKU-IBGZPJMESA-N 395.507 2.676 0 50 GFAA Cc1ccc(CN2CCC3(CC[C@H](CNC(=O)c4ccn(C)n4)O3)CC2)cc1 11973768 QRSPHNCGAUHDNV-LJQANCHMSA-N 382.508 2.672 0 50 GFAA CCOC(=O)C[C@H](NC(=O)c1cn(Cc2ccccc2Cl)nn1)C(C)C 12112379 KULSFHAFVTYIAD-HNNXBMFYSA-N 378.860 2.687 0 50 GFAA Cc1cc(C)cc(CN2CCN(C(=O)c3cn(C4CCCCC4)nn3)CC2=O)c1 12572824 UIPCEQFKCCALER-UHFFFAOYSA-N 395.507 2.885 0 50 GFAA COc1ccc(C(=O)[C@@H]2CCCN(C(=O)CSc3ncccn3)C2)cc1F 12576182 UWXAFSDJXQVHIS-CQSZACIVSA-N 389.452 2.838 0 50 GFAA CCCC[C@@H]1CN(CCNC(=O)[C@@H]2CCCN2C(C)=O)Cc2ccccc2O1 14882903 FVXYPRCPHVCUBD-UXHICEINSA-N 387.524 2.567 0 50 GFAA CCc1csc(CCNC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3F)C2)n1 14952213 ZKJIJGZMKZMNCR-OAHLLOKOSA-N 389.496 2.942 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N3CCN(C4CCCC4)CC3)n[nH]2)c1 15070902 RLRJATCQSBPLEC-UHFFFAOYSA-N 396.491 2.892 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCN1CCOCC1)c1ccccc1Cl 19831369 AFVACRSWLOVRRC-UHFFFAOYSA-N 387.867 2.654 0 50 GFAA O=C(c1cc(-c2ccccc2)n[nH]1)N1CCC2(CC1)NC(c1ccccc1)=NO2 169755043 ZUBAKMWGDAEHLO-UHFFFAOYSA-N 387.443 2.991 0 50 GFAA CCCc1ccc(-c2ccc(C(=O)N3C[C@H]4COC[C@@H](C3)C(=O)N4)cc2)cc1 1857734354 IUVYKCRDABZBSK-RTWAWAEBSA-N 378.472 2.893 0 50 GFAA O=C(c1ccc2ncnn2c1)N1CCC2(CC1)C[C@@H](O)C[C@H](c1ccccc1)O2 1857739448 KGXXZRVHCMGUKX-RBUKOAKNSA-N 392.459 2.617 0 50 GFAA Cc1ccccc1-n1ncc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c1C 110954256 FXXOUKHZZJCPDC-IBGZPJMESA-N 382.508 2.816 0 50 GFAA O=C1OC[C@@]23CC[C@@H](O2)[C@@H](C(=O)N2CCC(c4c[nH]c5cc(F)ccc45)CC2)[C@@H]13 859328975 LEPMAVUYBORQLY-NXWNEQKCSA-N 398.434 2.734 0 50 GFAA CCC(=O)Nc1cc2ccccc2cc1C(=O)N1CCC(NC(=O)NC)CC1 1875266054 BURRXJCSBBVXSU-UHFFFAOYSA-N 382.464 2.722 0 50 GFAA C[C@H](NC(=O)c1cc2c(cc1F)CCNC2)c1ccccc1N1CCOCC1 1875304239 DQNXTJMQCOPDBH-HNNXBMFYSA-N 383.467 2.799 0 50 GFAA O=C(/C=c1/nc(O)/c(=C/c2cccc(O)c2F)s1)c1ccc(Cl)cc1 1875341807 JFPHIACKCAGZFM-SRKDFGFSSA-N 375.808 2.839 0 50 GFAA FC(F)c1n[nH]c2c1CN(c1ncnc3ccc(N4CCOCC4)cc13)CC2 1875392314 QNRIPGUFTGEDKZ-UHFFFAOYSA-N 386.406 2.690 0 50 GFAA CCc1nc2cc(F)ccc2cc1C(=O)N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O 1875400625 GSODPCRSGQXSOV-CJMONDIMSA-N 382.439 2.702 0 50 GFAA Cc1cccc([C@@H](C)C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)CCc2cnccn2)c1 1775991282 KGBDFBLFJKDIGU-UIFIKXQLSA-N 392.503 2.723 0 50 GFAA Cc1nc(C)c(C(=O)N2CCO[C@@H]3CC[C@H](C(=O)NCC(C)C)C[C@H]32)s1 2100483103 RGJPHPNMBGLESU-ARFHVFGLSA-N 379.526 2.542 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N2CCCc3ccccc3C2)OCC(=O)N1C 2100483334 LVERLIWTSUSGMU-YADHBBJMSA-N 378.472 2.868 0 50 GFAA NCc1cc(NC(=O)N[C@H]2CCCN3CCSC[C@H]23)cc(C(F)(F)F)c1 926163454 XGPPFMLAGARUNA-LSDHHAIUSA-N 388.459 2.865 0 50 GFAA Cc1ccc(Nc2nc(N)nc(CN3CCN(c4ccccc4F)CC3)n2)cc1 1419215 SODRUIDWSWLJID-UHFFFAOYSA-N 393.470 2.967 0 50 GFAA O=C(c1cccc2c3c([nH]c12)CCCC3)N1CCC[C@@]12CCCN(CCO)C2=O 2356137685 VJFIMRSKVZMSQR-HSZRJFAPSA-N 395.503 2.636 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCC[C@]3(CN(C)C(=O)O3)C2)cc1 2356160591 ZGNRWXFACWTWQR-NRFANRHFSA-N 381.432 2.814 0 50 GFAA COc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 2999136 RBJAEFSJHSZRGX-UHFFFAOYSA-N 392.452 2.874 0 50 GFAA COC(=O)c1c(NC(=O)CSc2ccccn2)sc(C(=O)N(C)C)c1C 6698221 OBMNVHKEJOZSFW-UHFFFAOYSA-N 393.490 2.671 0 50 GFAA COc1ccccc1NC(=O)Cc1noc([C@@H]2Cc3ccccc3N2C(C)=O)n1 109429637 BYFYZEVXIOJWHL-KRWDZBQOSA-N 392.415 2.910 0 50 GFAA COc1ccccc1CNC(=O)Cn1nnc(-c2ccc(Cl)cc2Cl)n1 225404829 FTMXJLAHSZNKPX-UHFFFAOYSA-N 392.246 2.972 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)N2CCO[C@H](C(=O)C3CC3)C2)C[C@@H](C)O1 225681111 HCMLEMXKQCYXDR-KHYOSLBOSA-N 387.480 2.512 0 50 GFAA O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cc3c(s2)CCOC3)cc1 112255659 MBTVKZHPIIXIEP-UHFFFAOYSA-N 399.516 2.899 0 50 GFAA Cc1nc(CN2C(=O)N[C@](CCCc3ccccc3)(C3CCNCC3)C2=O)co1 67677625 MDDQCYFORJBGNN-JOCHJYFZSA-N 396.491 2.796 0 50 GFAA CCc1nccn1[C@H]1CCCN(CC(=O)Nc2nnc(C(C)(C)C)s2)C1 137202300 PXUFWEKVAXFMDB-ZDUSSCGKSA-N 376.530 2.870 0 50 GFAA CN(Cc1nccn1C)C(=O)c1coc(COc2cccc3cnccc23)n1 67473044 RDLMAYKITRWHJA-UHFFFAOYSA-N 377.404 2.808 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CC[C@H]4[C@H](CCC(=O)N4C4CC4)C3)cc2)o1 129710205 SAKOBCFYXBWQKF-AEFFLSMTSA-N 380.448 2.661 0 50 GFAA Cc1cc(N(C)C[C@@H]2CCC[C@@H]2O)nc([C@H](C)N(C)C[C@H]2CCC[C@@H]2O)n1 252477722 UPDBJVBVCQAZNM-PJVZLEMVSA-N 376.545 2.536 0 50 GFAA O=C(O)C(CCCCc1ccc(CCCCC(C(=O)O)C(=O)O)cc1)C(=O)O 39931437 WBBGERWARIZMMY-UHFFFAOYSA-N 394.420 2.683 0 50 GFAA Cc1nnsc1CN1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 77376709 ABYNSACBWIHTJD-UHFFFAOYSA-N 388.493 2.712 0 50 GFAA Cc1ccc(NC(=O)C(=O)N2CCC(O)(C(F)(F)F)CC2)cc1C(F)(F)F 120751541 QZHXUOIFQKJMNX-UHFFFAOYSA-N 398.303 2.868 0 50 GFAA c1ccc(-n2cc(CN3CCC(c4nnc5n4CCCCC5)CC3)nn2)cc1 72173730 PKNQBJSVZGCCJN-UHFFFAOYSA-N 377.496 2.965 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccncc3)nc2N[C@H](CO)c2ccccc2)C1 71479671 JFDAEYQHDIYDCW-HXUWFJFHSA-N 389.459 2.589 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@@H]2CN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1 451230675 UNQKNPGWECWRBP-JZXOWHBKSA-N 392.421 2.890 0 50 GFAA Cc1nc2sc3c(c2c(=O)n1C[C@@H](O)CN1CCC(C)CC1)CCCC3 155049798 VVJUBTXLNNJENL-HNNXBMFYSA-N 375.538 2.738 0 50 GFAA C[C@@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCC[C@H](CN2CCCCCC2)C1 155160735 HQQBAJRRFDSIRT-RBUKOAKNSA-N 398.551 2.948 0 50 GFAA Cc1nn(CC(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1Cl 72478366 LCMSEBKSAQNMIO-UHFFFAOYSA-N 375.885 2.803 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(CCCF)CC2)C1 71770805 ZXQLVJLNBAXKBV-HXUWFJFHSA-N 375.532 2.881 0 50 GFAA CCS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H]2c2cc(C)on2)cc1 378473787 LMAHHRCTNWPWOY-KRWDZBQOSA-N 377.466 2.823 0 50 GFAA Cc1ccc(N2C[C@@H](C)N(C(=O)c3cc4nc(C)cc(C)n4n3)CC2=O)cc1 82148301 OZTHNOYZMRXONS-MRXNPFEDSA-N 377.448 2.532 0 50 GFAA c1coc(CN2CCC(N[C@@H]3CCOC[C@H]3OCc3cscn3)CC2)c1 223160704 ODZOZKCJQIOPJD-RTBURBONSA-N 377.510 2.664 0 50 GFAA O=C(Cn1nc(C(F)(F)F)c2c1CCC2)Nc1[nH]ncc1Br 20607523 KBIDOSARNRGFRT-UHFFFAOYSA-N 378.152 2.515 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)CSc1ccncc1)C[C@H]2CO 97675408 XHRUMVHAELHMKL-KRWDZBQOSA-N 377.554 2.507 0 50 GFAA CCOc1cc(CN2CCC3(CC2)CC(=O)N(CCCOC)C3)ccc1O 95390812 KBOPOQCOOBYDQX-UHFFFAOYSA-N 376.497 2.642 0 50 GFAA CNC[C@H]1CCN(C(=O)c2cc(Br)nn2-c2ccc(C)cc2)C1 178985290 PQKXBHKTLBUONO-CYBMUJFWSA-N 377.286 2.625 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3ccc4[nH]nnc4c3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95360699 MTPBFMFUMJYBAC-STZQEDGTSA-N 387.487 2.969 0 50 GFAA Cc1nc(CCNC(=O)[C@@H](C)N2CCc3ccccc3C2)nc2c1CCCC2 95352366 LPNHGCSNMJOHBM-QGZVFWFLSA-N 378.520 2.769 0 50 GFAA O=S(=O)(c1ccccc1)N(C1CC1)C1CCN(Cc2cscn2)CC1 252502226 UNTHIFRXTVUECQ-UHFFFAOYSA-N 377.535 2.961 0 50 GFAA CN(C(=O)Nc1nc(-c2cccc(Cl)c2)ns1)[C@@H]1CCN2CCO[C@H]1C2 297222306 PRCHWVSNNAUVMX-KGLIPLIRSA-N 393.900 2.795 0 50 GFAA O=C(NCCc1ccccc1)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263617354 NJMDHIUZDYFQBN-UHFFFAOYSA-N 388.471 2.602 0 50 GFAA c1cncc(CN2CCN(Cc3ccc(OC[C@@H]4CCCNC4)cc3)CC2)c1 299776823 DJNKDUVZYBQVRO-JOCHJYFZSA-N 380.536 2.778 0 50 GFAA O=C1NCCN(C(=O)NCCCOC2CCCCC2)[C@@H]1c1ccc(F)cc1 584892071 YAWXVZCBDKEVIA-GOSISDBHSA-N 377.460 2.748 0 50 GFAA COC(=O)c1ccc(-c2cccc(C(=O)N(C)[C@@H]3CCN(C)C3)c2)cc1OC 584896107 RKNXMHWTZSTHRB-GOSISDBHSA-N 382.460 2.925 0 50 GFAA Cc1ccc2[nH]c(C(=O)N[C@H]3CCOC[C@@H]3Oc3ccc(CO)cc3)cc2c1 1565508089 DVNQDEHKVURZJO-FPOVZHCZSA-N 380.444 2.935 0 50 GFAA O=C(c1cnccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1ccc(Cl)s1 1565508686 XGBOYBZZLRJWPW-NEPJUHHUSA-N 376.869 2.568 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCN[C@@H](C)C3)cc2Br)no1 408519282 IEXISOSNCUCJBU-NSHDSACASA-N 394.269 2.758 0 50 GFAA Cc1ccccc1-c1cc(C(=O)N(C)[C@H](C)C(N)=O)c2cnn(C(C)C)c2n1 170592832 BGWIHGMFZGHDJL-CQSZACIVSA-N 379.464 2.933 0 50 GFAA C[C@H](NC(=O)NC(C)(C)C)[C@@H]1CCCN(c2ncc(Br)cn2)C1 170634096 OKQNLQSJAURHRV-NWDGAFQWSA-N 384.322 2.942 0 50 GFAA CN(C)c1cccc(S(=O)(=O)N2C[C@H](n3ccnc3)Cc3ccccc32)c1 170606307 KZXUSTKEHUWNIN-GOSISDBHSA-N 382.489 2.942 0 50 GFAA CN(C)CCn1c(=O)oc2ccc(NC(=O)[C@@H]3CCCc4cccnc43)cc21 194180542 FLUUCZORFAUVFA-MRXNPFEDSA-N 380.448 2.610 0 50 GFAA O=S(=O)(N1CCCCC1)N(CCc1ccc(F)cc1)Cc1cccnc1 1506396757 IYCNNUFWSSXAJU-UHFFFAOYSA-N 377.485 2.996 0 50 GFAA COC(=O)c1ccc(/C=c2/sc3nc(-c4ccc(Cl)cc4)nn3c2=O)cc1 628925 RIPFOJFPESWGID-XNTDXEJSSA-N 397.843 2.806 0 50 GFAA CS(=O)(=O)Cc1ccc(N2CCC3(CC2)OCCc2sccc23)nc1 1704305513 KSUPWHWMZBUSLT-UHFFFAOYSA-N 378.519 2.756 0 50 GFAA O=C(c1cc2ccccc2cn1)N1CCCN(CCn2cc(Cl)cn2)CC1 1772712483 NHDFPWHBNGZSMH-UHFFFAOYSA-N 383.883 2.933 0 50 GFAA O=C(NCCCOc1cccnc1)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 14978923 PHPOHITZLZYCNS-SFHVURJKSA-N 399.466 2.587 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C1 19111534 VDNFDWHREAWWGK-INIZCTEOSA-N 384.480 2.886 0 50 GFAA COc1ccccc1C(=O)N1CCC(c2n[nH]c(=O)n2-c2ccc(C)cc2)CC1 169779808 MCBAMQJYVXUUEO-UHFFFAOYSA-N 392.459 2.897 0 50 GFAA CN1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)on2)CC12CCOCC2 1857699446 UWMLSYALLUYTJK-UHFFFAOYSA-N 375.856 2.932 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCc1cn2ccccc2n1 1857730246 NWLFWMJZKNLJDW-OAHLLOKOSA-N 390.447 2.793 0 50 GFAA COc1cc(C)ccc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857732395 OKGNEPJLNMIEDD-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA O=C(C(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1)N1CCCC1 1704330804 GKSPSDDZMGIBPW-HSZRJFAPSA-N 390.487 2.572 0 50 GFAA C[C@H](NC(=O)[C@H]1COc2ccc(O)cc2O1)[C@@H](O)c1c(F)cccc1Cl 866791170 WJVILMIOUZMVMW-ABROLUODSA-N 381.787 2.563 0 50 GFAA CNS(=O)(=O)C[C@H]1CCCN(C(=O)c2cc3cc(C)[nH]c3cc2Cl)C1 1875326577 MIRCKECIOPSHBJ-LBPRGKRZSA-N 383.901 2.531 0 50 GFAA Cc1oc(C)c(C(=O)N[C@H]2CCCCCN(C(=O)CCCCC(N)=O)C2)c1C 1775993122 ZWDXUUSOHVCERS-KRWDZBQOSA-N 391.512 2.752 0 50 GFAA COc1ccc(/C=c2\sc3nc4cc(Br)cnc4n3c2=O)cc1 13550057 FOAKGRWXJVRSHA-MLPAPPSSSA-N 388.246 2.623 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 18136881 RZIXHFYAMYCAOX-OAQYLSRUSA-N 393.487 2.930 0 50 GFAA CCCN(C(=O)COc1ccc(-n2cnnn2)cc1)[C@H]1CCc2ccccc21 2325731523 QCSKIKIQBNVSNU-FQEVSTJZSA-N 377.448 2.967 0 50 GFAA O=C(C[C@H]1CN(C(=O)Cc2ccoc2)C2(CCC2)CO1)N1CC=CCC2(CC2)C1 2325785350 RBFJLTVVFJIXDS-IBGZPJMESA-N 398.503 2.931 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCN(C(=O)c3c(C4CC4)cnn3C)C2)nc1C 2325793270 NPDHOJBUPDBBSC-DOTOQJQBSA-N 395.507 2.590 0 50 GFAA C[C@@H]1[C@@H](NC(=O)C23CCC(CC2)C3)CCN1C(=O)c1cc2ccccc2nn1 2325793481 WKWYLILVSHAPRI-RHMTYGGXSA-N 378.476 2.929 0 50 GFAA CN=c1[nH]c(C(=O)N2CCC[C@]23CCCN(c2ccc(C)cc2)C3=O)cs1 2356139308 VWTJFIRZMNEMIN-FQEVSTJZSA-N 384.505 2.717 0 50 GFAA O=C(NCc1ncccc1Cl)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356143099 VFTGXQFQGUKXOY-VWLHBSKXSA-N 396.878 2.683 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Nc2cc(Cl)ccc2OC)C1=O 2356151652 RWGKHDFNYSFWKZ-LJQANCHMSA-N 395.887 2.984 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2c[nH]nc2-c2ccc(F)cc2)C1=O 2356151904 GAOIYQUYALXKFA-NRFANRHFSA-N 386.471 2.819 0 50 GFAA O=C(NCCc1ccc(F)cc1)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356162073 WJJMMBOSHMVZBH-BOCKYXSRSA-N 393.462 2.816 0 50 GFAA O=C(Nc1cc(N2CCNC2=O)ccc1F)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 410782005 FOPDINMJXBJYCJ-MQYQWHSLSA-N 387.333 2.650 0 50 GFAA CCSc1nnc(-c2ccccc2NC(=O)[C@H](CC)n2cccn2)c(=O)[nH]1 55393512 RWDIODQGUZKQSQ-AWEZNQCLSA-N 384.465 2.730 0 50 GFAA Cc1noc([C@H](C)N2CCN(C(=O)NCc3nc4ccccc4s3)CC2)n1 111789862 BYPGNJRHVGCZSO-LBPRGKRZSA-N 386.481 2.576 0 50 GFAA CC(C)[C@H]1CN(C)CCN1C(=O)c1cc(COc2ccc(F)cc2F)[nH]n1 55325188 MKDIULKEQALMHA-QGZVFWFLSA-N 378.423 2.679 0 50 GFAA Cc1ccc(OCCc2nnc(NC(=O)CCN3CCCCO3)s2)cc1 55253069 SJLQFWVULLHKML-UHFFFAOYSA-N 376.482 2.824 0 50 GFAA Cc1ccc(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c(C)c1 100707234 MYGVSCXQVPWBOK-IBGZPJMESA-N 379.460 2.884 0 50 GFAA Cc1nn(-c2ccc(Cl)nn2)c2c1[C@@H](c1ccc3c(c1)OCO3)CC(=O)N2 65363525 ACYXRURFGQRACN-LLVKDONJSA-N 383.795 2.827 0 50 GFAA Cc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)/C=C/c1ccccc1Br 328612473 OTVOCVFPWZBMFC-PLWJUESGSA-N 397.298 2.774 0 50 GFAA COc1ccccc1N1CC[C@H](NS(=O)(=O)c2ccc(C)cc2Cl)C1=O 153075012 MCJOYUQBMCYLGL-AWEZNQCLSA-N 394.880 2.741 0 50 GFAA O=C(NCCCn1ccnc1)/C(=C\c1ccc(F)cc1)NC(=O)c1ccccc1 33932242 VBFIQGZPXIDDIZ-HMMYKYKNSA-N 392.434 3.000 0 50 GFAA Cc1ccncc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 72145934 UJRPAMFIGYHLAM-CQSZACIVSA-N 377.366 2.940 0 50 GFAA CC(=O)N1CC[C@@H](NC(=O)c2ccnc(NC(=O)C3CC3)c2)c2ccccc21 367700614 WLZPEYHIYZZFOU-QGZVFWFLSA-N 378.432 2.658 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1CCN(C(=O)[C@H]2CC[C@H](C(=O)O)CC2)CC1 262706898 JZBIDYKQNHGZCO-JOCQHMNTSA-N 396.846 2.655 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2cc3c(n(C)c2=O)CCCC3)[C@@H](C)C1 77515925 PIAWPEBFNYFOLT-KRWDZBQOSA-N 379.504 2.923 0 50 GFAA NS(=O)(=O)c1ccc(CCn2ccnc2-c2cccc3cccnc23)cc1 71681709 XOXXLEPHPOANLK-UHFFFAOYSA-N 378.457 2.988 0 50 GFAA CN1CCN(c2ccc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc2)CC1 243891662 RQGXKGYAYBYQOJ-UHFFFAOYSA-N 379.460 2.837 0 50 GFAA CCS(=O)(=O)N1CCC(NC(=O)c2cncc(-c3cccc(C)c3)c2)CC1 178087431 VGTGHPBKYGPPOB-UHFFFAOYSA-N 387.505 2.601 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)c1nn(-c2ccccc2)cc1O 175259992 RUHZYUIYTPXLNO-UHFFFAOYSA-N 390.443 2.630 0 50 GFAA O=C(CSCC1CC1)N1CCC[C@@]2(CCC(=O)N(Cc3ccncc3)C2)C1 82155565 PLFHRXCJQUJKHZ-OAQYLSRUSA-N 387.549 2.956 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cncc(C(F)(F)F)c1 288995758 YTYRUTFWCYXORR-UHFFFAOYSA-N 379.338 2.825 0 50 GFAA Cn1ccnc1CNC(=O)N1CCC(c2cc(Cc3ccccc3)[nH]n2)CC1 426494408 LRZJRUASNYTMEP-UHFFFAOYSA-N 378.480 2.823 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)NCc1nnc(-c2ccccc2)o1 426642927 QFFLFNXEUYCLFL-UHFFFAOYSA-N 390.403 2.821 0 50 GFAA Cn1ccnc1CNC(=O)c1cccc(-c2ccc(C(=O)N3CCCC3)o2)c1 426546154 KYPSGENXEBQNGA-UHFFFAOYSA-N 378.432 2.846 0 50 GFAA NC(=O)CN1CCC[C@H](C(=O)Nc2cccc(-c3cc4ccccc4[nH]3)c2)C1 95529301 GOQDTAALCUCYOV-KRWDZBQOSA-N 376.460 2.971 0 50 GFAA Cc1cc(N2CCCN(C(=O)Nc3cccc(-n4cnnc4)c3)CC2)ccn1 426590053 XIKZHHWOOFKJDF-UHFFFAOYSA-N 377.452 2.715 0 50 GFAA Cn1cnc(CNC(=O)N2C[C@H](c3cccc(C(F)(F)F)c3)OC(C)(C)C2)n1 293279701 XYARTMZZQNOSHS-CQSZACIVSA-N 397.401 2.896 0 50 GFAA O=C(CCc1ccc2c(c1)OCCO2)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 180024231 GIDVKPWSPYILME-LJQANCHMSA-N 394.471 2.555 0 50 GFAA CCN1C[C@H](NC2CCN(c3cc(C)nc(-c4ccccc4)n3)CC2)CC1=O 96140466 ASLFSVQOUSGKPE-LJQANCHMSA-N 379.508 2.631 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@H]1CCCN(C(=O)c2ccncc2O)C1 95511486 IGCPQLKKOMIIFK-QGZVFWFLSA-N 396.491 2.516 0 50 GFAA CN1CCO[C@@H](CNC(=O)c2cccc(-c3ccc4nccc(N)c4c3)c2)C1 534589573 XZZZPRWYOMZNCK-SFHVURJKSA-N 376.460 2.544 0 50 GFAA c1cc(-c2noc(-c3cc4n(n3)C[C@H](c3ccc5c(c3)OCO5)OC4)n2)ccn1 263618584 UMQIHNCJJNMBLI-GOSISDBHSA-N 389.371 2.995 0 50 GFAA CN(C)c1cc(C(=O)N2CCNC(=O)[C@@H]2c2cccc(F)c2)c2ccccc2n1 1940195469 FVOWEIQRDHQIQM-FQEVSTJZSA-N 392.434 2.753 0 50 GFAA COCCN1CCC[C@@]2(CCCN(C(=O)Cc3noc4ccccc34)[C@H]2C)C1=O 1940197891 ZUBNOOIWXXSVDT-AOMKIAJQSA-N 399.491 2.636 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)NC[C@@H]3COc4ccccc4O3)CC2)cc1 827758172 PKQBQDMVGOZGEJ-LJQANCHMSA-N 394.471 2.803 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)c1 268184044 JJDUFOHBWMGPNS-ZBFHGGJFSA-N 387.436 2.768 0 50 GFAA O[C@H]1CN(Cc2cccn2-c2ccccn2)CC[C@@H]1c1ccc2c(c1)OCO2 1565506240 JEKXOJJKFNYWED-MOPGFXCFSA-N 377.444 2.951 0 50 GFAA CC(C)(C)c1cc(CS(=O)(=O)NCCCN2CCc3ccccc3C2)no1 170616473 DIUYVVFIWLIWNR-UHFFFAOYSA-N 391.537 2.840 0 50 GFAA CN(C)CC1(CO)CCN(c2noc(-c3ccc(Cl)cc3)c2C(=O)O)CC1 1772706061 UXWVGMQUHSWKBN-UHFFFAOYSA-N 393.871 2.834 0 50 GFAA NC(=O)c1ccc(CNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)cc1 1772813381 YYYZYBWBERAEHP-MRXNPFEDSA-N 392.484 2.725 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cncnc4)C[C@@H]2CN(Cc2cc[nH]n2)C3)cc1 1772814021 FSOFNJICPYFMQK-FYYLOGMGSA-N 388.519 2.767 0 50 GFAA O=C(N[C@H]1CCOC1)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 11668213 CVDHXNZJARLTQG-IBGZPJMESA-N 381.476 2.644 0 50 GFAA Cc1cc(=O)c(C(=O)NC(C)(C)CO)c(CC2CCCC2)n1Cc1cccnc1 12243810 LEAOZZYWRRFUEK-UHFFFAOYSA-N 397.519 2.833 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)C2=CCCC2)C1)N1CCN(c2ccccn2)CC1 13637069 VBWJVUYGYOEDCZ-IBGZPJMESA-N 396.535 2.859 0 50 GFAA CCc1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)n1 169778654 VLTCEWHLJPFRSX-LLVKDONJSA-N 390.806 2.770 0 50 GFAA COc1c(N2C[C@@H]3CCCN[C@H]3C2)c(C)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 1857526846 AYDPRSBEZLFMKY-GUYCJALGSA-N 397.475 2.540 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(c3ncccn3)CC1)OCC2)N1CCCC1 1857693129 JETZYEYSTPHMGA-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N4CC(c5ccccn5)C4)CC3=O)sc2c1 1857736633 OLZBBOJUBDHNLI-CQSZACIVSA-N 392.484 2.979 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NC1CCNCC1 1857738238 YFIWLOAHZUTADV-ZDUSSCGKSA-N 376.888 2.956 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)cn1 456374858 JLAUSVRVUQKRFY-HNNXBMFYSA-N 379.869 2.750 0 50 GFAA CN(C)CC1CCN(c2ccccc2NC(=O)[C@@H]2C[C@H]2c2cnn(C)c2)CC1 373444680 XLATXYIXVZTKBJ-RBUKOAKNSA-N 381.524 2.940 0 50 GFAA CCCC(=O)N1CCC(c2nnc3n2CCN(C(=O)OC(C)(C)C)C3)CC1 802399209 WUVRNDOXHHUGKR-UHFFFAOYSA-N 377.489 2.535 0 50 GFAA Cc1cc(C(=O)N2CCCOCC23CC3)ccc1NS(=O)(=O)C(F)(F)F 952874721 RQUOFYXONQSVKS-UHFFFAOYSA-N 392.399 2.652 0 50 GFAA O=C(NOC1CCC1)N1CC[C@](c2nc(-c3cccnc3)no2)(C(F)(F)F)C1 952893411 LXOLQGCQWDWWIH-INIZCTEOSA-N 397.357 2.831 0 50 GFAA Cn1ncc2c(N[C@@H]3CN(C(=O)C4CC4)CC[C@H]3c3ccc(F)cc3)ncnc21 888103381 GARVKLVYLUJICK-FUHWJXTLSA-N 394.454 2.709 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)c2ccnc(OC3CCCCC3)c2)o1 1775959224 OJMCGEDLCZNVRY-GDBMZVCRSA-N 386.452 2.687 0 50 GFAA N[C@@H](Cc1cccc(F)c1)C(=O)N1CCn2c(nnc2-c2ccc(Cl)cc2)C1 2325775089 ZNBQBQXGRDRYJT-KRWDZBQOSA-N 399.857 2.650 0 50 GFAA CCC(CC)(CC)C(=O)N[C@@H]1CC2(CN(C(=O)c3conc3C)C2)n2ccnc21 2332237645 FWOBFJJMXBWIGH-MRXNPFEDSA-N 399.495 2.808 0 50 GFAA OCC1CCN([C@H]2CCCN(C3CCN(c4ccccc4F)CC3)C2)CC1 20541541 ASFSLIQYOFTYDM-FQEVSTJZSA-N 375.532 2.963 0 50 GFAA CCC(=O)NC(=S)Nc1cc(Cl)ccc1N1CCN(C(=O)CC)CC1 1051421 PHOXDCXTSSFSME-UHFFFAOYSA-N 382.917 2.622 0 50 GFAA O=C(c1cccc(Br)c1)N1CCN(C(=O)N2CCCCC2)CC1 1126094 BPLKODUOLYISEX-UHFFFAOYSA-N 380.286 2.813 0 50 GFAA Cc1ccc(N2C[C@@H](N=c3[nH]oc(-c4ccccc4)c3C(=O)O)CC2=O)cc1 2356155517 GJUBWXXDOFUBBW-HNNXBMFYSA-N 377.400 2.988 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)ccc1Cl 2851216 RKYFEBLWMIBHMY-UHFFFAOYSA-N 382.825 2.886 0 50 GFAA O=C(Cn1c(=O)n(-c2ccccc2)c(=O)c2ccccc21)N1CCc2ccccc21 6662081 JQHYZRGLEGHZTI-UHFFFAOYSA-N 397.434 2.742 0 50 GFAA O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)c1ccc(F)cc1 6701327 HJNSSXPVKASKRR-UHFFFAOYSA-N 385.420 2.952 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)C[C@@H]1C 245436938 VZRYUPXQOTXEER-OKZBNKHCSA-N 391.512 2.553 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)[C@@H]1CCCN1C(=O)C1CCCCC1 55228624 FQGGLMFAVOQFCZ-SFHVURJKSA-N 387.528 2.971 0 50 GFAA Cc1cc(C(F)(F)F)ccc1OCC(=O)NC[C@H]1CN(CC(C)C)CCO1 225543069 GUUGYZRORKWIFR-INIZCTEOSA-N 388.430 2.866 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H](Cn3ccnc3)C2)cc1NC(=O)[C@@H]1CCCO1 20821561 FHFUDHFEPARDCZ-XLIONFOSSA-N 396.491 2.861 0 50 GFAA C[C@@H]1CCCN(c2ccc(C(N)=O)cc2NC(=O)c2c[nH]c(=O)c(Cl)c2)C1 55099846 KJXLMCAJMONHKM-LLVKDONJSA-N 388.855 2.616 0 50 GFAA CSCCCN1CCC[C@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 20323297 NFGRMVWNQIAAHY-IBGZPJMESA-N 391.581 2.750 0 50 GFAA CN1CC[C@H](N(C)Cc2ccc(-c3nc(-c4ccncc4)cc(=O)[nH]3)cc2)C1 67696025 GQQZGAKHWVBVRT-IBGZPJMESA-N 375.476 2.635 0 50 GFAA O=C1CCCN1c1ccc(N2CCC(NCCOc3cccnc3)CC2)cc1 20909390 SDWFWHLZWGPOSB-UHFFFAOYSA-N 380.492 2.846 0 50 GFAA CCN(Cc1ccc(C)o1)C(=O)[C@@H]1C[C@@H](NC(=O)c2ccccc2Cl)CN1 67725579 LTSNIYLMQOXMMX-KDOFPFPSSA-N 389.883 2.750 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@@H]32)o1 248179768 XURXPNLCGDDBRJ-QKGCVVFFSA-N 380.510 2.911 0 50 GFAA Cc1ccc2c(C(=O)N[C@@H](C)Cn3cncn3)cc(-c3cncnc3)nc2c1C 63846771 FYICTUGDIVYNIO-AWEZNQCLSA-N 387.447 2.719 0 50 GFAA CCc1nccn1CCCNC(=O)[C@@H]1CCC(=O)N(Cc2cccc(F)c2)C1 67675165 WLCHDUXXRXFUAS-QGZVFWFLSA-N 386.471 2.530 0 50 GFAA CCN(C[C@H]1CCCO1)C(=O)CCc1nnc(CCc2ccccc2OC)o1 12596567 SVXNPHOZAGUWAX-QGZVFWFLSA-N 387.480 2.824 0 50 GFAA O=C(Cn1nc(C(F)F)c(Cl)c1C1CC1)N1N=CC[C@@]1(O)C(F)(F)F 6317283 OMRRNGMHHQBDIY-GFCCVEGCSA-N 386.708 2.821 0 50 GFAA COc1ccccc1OC1CCN(S(=O)(=O)NCc2ccccc2)CC1 71754308 WDQMOAYFGZKXDF-UHFFFAOYSA-N 376.478 2.573 0 50 GFAA COc1cc(C)cc(C)c1S(=O)(=O)N1Cc2cnnn2Cc2ccccc21 365249340 YEBRJJOYAVCFEO-UHFFFAOYSA-N 384.461 2.661 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1(C)C 490526106 DISPOWTYYCWITI-UHFFFAOYSA-N 396.944 2.980 0 50 GFAA Cc1nc(C)c(CCNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)s1 173618444 WIFUKRPECPZIPK-GOSISDBHSA-N 377.485 2.631 0 50 GFAA COc1cc([C@@H](C)N[C@@H]2CCCN(c3cccnc3)C2=O)cc(OC)c1OC 240540889 GPYSUEWPJNFKMS-RHSMWYFYSA-N 385.464 2.954 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CCN1 262956558 WCAJXJNGDWZMTD-AXAPSJFSSA-N 384.307 2.855 0 50 GFAA CC(C)N1CCC[C@H](CNC(=O)N2CCn3c(nnc3-c3ccccc3)C2)C1 174743080 XJDYHHACSRGVQX-QGZVFWFLSA-N 382.512 2.591 0 50 GFAA CNC(=O)COc1ccccc1-c1ccc(C(=O)N2CCC[C@H](OC)C2)cc1 426705717 PAZNYQBOJAJUAR-SFHVURJKSA-N 382.460 2.729 0 50 GFAA Cc1cc(N2CCC(NC(=O)N3CCC(OCC(C)C)CC3)CC2)nc(C)n1 176877275 MXWXVVWKMVFLIU-UHFFFAOYSA-N 389.544 2.909 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1NC(=O)CN(C1CC1)[C@H]1CCc2ccccc21 161588714 YCCNWDMDADDBOK-FQEVSTJZSA-N 399.516 2.733 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)ccn1 291380845 SLJQODZHXJGCPR-QFIPXVFZSA-N 396.491 2.633 0 50 GFAA Cc1nc(CSc2nnc(C3CCNCC3)n2C[C@H]2CCCO2)cs1 426521140 BYPUQOXROPYHIJ-OAHLLOKOSA-N 379.555 2.981 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCCn1cncn1 95523254 GXULFKDUYOOEBC-GOSISDBHSA-N 378.432 2.735 0 50 GFAA O=C(CN1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2)NC1CC1 92001653 SOAZVBHERUCYKH-FQEVSTJZSA-N 381.520 2.526 0 50 GFAA O=C(N[C@H]1C[C@@H](c2cc(N3CCOCC3)ncn2)C1)c1ccc(Cl)s1 244874272 WXTWPTSVTRZMST-TXEJJXNPSA-N 378.885 2.704 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252527709 DEQDWYWGZHAUFL-ZMPRRUGASA-N 377.444 2.669 0 50 GFAA CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@@H]1c1ccc(Cl)cc1 55220588 CKMUZWWNPBVCHN-QGZVFWFLSA-N 377.872 2.997 0 50 GFAA O=C1N(CCCc2cccnc2)C(=O)C2(CCNCC2)N1Cc1ccccc1 299758964 MKZQRCCLKPHEFP-UHFFFAOYSA-N 378.476 2.601 0 50 GFAA Cc1nc(C)c(CC(=O)NCCc2nc(O)c3c(C)c(C)sc3n2)s1 299794338 JUDQRIMLALQMGS-UHFFFAOYSA-N 376.507 2.988 0 50 GFAA O=C(c1cccs1)N1CCC(NCCc2nc(-c3ccccn3)no2)CC1 952973336 GSENJBWUJLEABP-UHFFFAOYSA-N 383.477 2.630 0 50 GFAA O=C(Cc1ccc(NC(=O)c2ccccc2N2CCOCC2)cc1)NC1CC1 952990912 XPBYXTFZCDEMPI-UHFFFAOYSA-N 379.460 2.597 0 50 GFAA Cc1ccccc1[C@H]1CN(C(=O)c2cc(-c3ccccn3)[nH]n2)C[C@@H]1C(=O)O 1565516989 KWBMFPVCSCQVAP-CVEARBPZSA-N 376.416 2.721 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)[C@@H](C)Oc2cc(C)ccc2Cl)CC1 186637741 YXUVHAKVLJGICR-CQSZACIVSA-N 382.888 2.813 0 50 GFAA C[C@H]1CN(c2ccccc2F)CCN1C(=O)c1cn(-c2ccc(F)cc2)nn1 190241558 ZUAXUHLTLYAONZ-AWEZNQCLSA-N 383.402 2.896 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)cc1 195474285 JGICOWSVJHKSPV-LJQANCHMSA-N 389.459 2.622 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)NCc2csc(-c3cccs3)n2)cc1 1506417971 MXXAQYYUGYOGPS-UHFFFAOYSA-N 393.515 2.710 0 50 GFAA Cc1sc2nc(CCNc3cncc(C(=O)N4CCCC4)n3)nc(O)c2c1C 1506414598 GLEARLRXKRSVLT-UHFFFAOYSA-N 398.492 2.694 0 50 GFAA C=CC(=O)N[C@@H](NC(=S)Nc1ccccc1OC)C(Cl)(Cl)Cl 5570273 GLQGTXVETZXEKV-NSHDSACASA-N 382.700 2.980 0 50 GFAA Cc1nc(CNC(=O)c2cn(Cc3ccccc3Cl)nn2)nc2c1CCCC2 12706515 YXHIVYUMDNGEQV-UHFFFAOYSA-N 396.882 2.887 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)Cc2ccsc2)CC1 15079487 IRSHXDJYJAVGMV-IBGZPJMESA-N 391.581 2.910 0 50 GFAA COC(=O)/C=C1/N=C(Nc2nc(C)cc(C)n2)N(c2ccc(Cl)cc2C)C1=O 17145517 ANQUPTLEFNIYJE-NTEUORMPSA-N 399.838 2.927 0 50 GFAA COc1ccc(CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1OC 19211540 IBKIMYVMLAEQOM-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA Cc1nnc(-n2ccc3c(cnc4c(-c5ccc(F)cc5)c(C)nn43)c2=O)[nH]1 19821359 PSFPJDRAJUJXLR-UHFFFAOYSA-N 375.367 2.574 0 50 GFAA c1ccc(CCCN2CC[C@@]3(C2)Cn2c(nnc2-c2cccnc2)CO3)cc1 1857690212 WPYMHXBSDUFBRI-JOCHJYFZSA-N 375.476 2.948 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1-n1ccnc1-c1ccc2c(c1)CCO2 1857691388 JCISHRILETVFLP-QGZVFWFLSA-N 398.488 2.647 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)N2CCC[C@@H](CN)C2)cc1OC 1857694614 GEKYORNQMIQLRD-INIZCTEOSA-N 399.491 2.766 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1O 1857711129 IVLJEPZQPKEABX-KNKQGSTJSA-N 378.428 2.615 0 50 GFAA O=C(c1ncc(F)cc1F)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1857719097 CUVWXKAAGDGDIH-UHFFFAOYSA-N 386.402 2.853 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)o1 1857729486 CMDHOGJZXZSRKS-JOCHJYFZSA-N 397.475 2.862 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(Cn3cnnn3)cc2)C[C@@H](c2ccccc2)O1 1857735736 IMGUBCURVDHHGC-RTWAWAEBSA-N 391.475 2.960 0 50 GFAA CN(C)c1ncc(NC(=O)c2ccn(-c3cccc(Br)c3)n2)cn1 124683287 RLMMBJVYURQQSO-UHFFFAOYSA-N 387.241 2.743 0 50 GFAA CC1=C(CCN2CCC[C@H](n3cc(C(=O)NCCO)nn3)C2)C(C)(C)CCC1 14977290 FZYVMXDWJODIHH-KRWDZBQOSA-N 389.544 2.554 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1cc(-n2cccn2)ccn1 265455935 QJGDFVGUFVACJC-UHFFFAOYSA-N 397.429 2.940 0 50 GFAA O=C(N1CCOC[C@H]1Cc1c[nH]c2ccccc12)C(F)(F)C1(O)CCCC1 952845485 CJFQQBHCLRBHKK-OAHLLOKOSA-N 378.419 2.878 0 50 GFAA Cc1ccc(CNC(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)c(N2CCOCC2)c1 1875314811 UKNFGHOOSCEOKR-CVEARBPZSA-N 398.507 2.517 0 50 GFAA CS(=O)(=O)Cc1ccc(NC(=O)[C@H]2CCc3cc(F)ccc3O2)cc1F 1875306380 CMYWDYWAQNRVTE-QGZVFWFLSA-N 381.400 2.842 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@](C)(CO)c2cc(Cl)cc(Cl)c2)CC1 1875366138 SZDIKELUCHVESW-GOSISDBHSA-N 385.291 2.742 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)Cc1ccc2c(c1)CCCO2 1875401737 QKGKNNSNAURJLD-PXNSSMCTSA-N 396.491 2.871 0 50 GFAA C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)Nc1cnc2c(c1)CNCC2 2325722332 GCSRHNCYVFSJAF-LBPRGKRZSA-N 395.488 2.637 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccnnc1)C(=O)N1CC[C@@H]1Cc1ccccc1 2325763842 ILQCZLAWQOFPIG-RTBURBONSA-N 396.491 2.756 0 50 GFAA C[C@H](CNC(=O)C(C)(C)C1CCCCC1)N(C)C(=O)C[C@H]1CCC(=O)N1C 2325794324 YRRCTKIFNUKQLI-NVXWUHKLSA-N 379.545 2.567 0 50 GFAA O=C(/C=C/Cc1cc(F)c(F)cc1F)N1CCn2c(nnc2C(F)(F)F)C1 143210409 QSSHJJFVCWMIKH-HNQUOIGGSA-N 390.287 2.855 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)Cn1cnc2cc(Cl)ccc2c1=O 624924 AJFVKURMKZFTJA-UHFFFAOYSA-N 385.807 2.865 0 50 GFAA COC(=O)c1c(N)n(Cc2ccc3c(c2)OCO3)c2nc3ccccc3nc12 636257 ROGUIFUEHGDUTP-UHFFFAOYSA-N 376.372 2.730 0 50 GFAA O=C(OCc1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1 1129612 QJGUTMFKTDMGKB-UHFFFAOYSA-N 389.429 2.557 0 50 GFAA COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cc(Br)cc(OC)c1OC 1136717 BZGFFOHPYLPPOL-CYBMUJFWSA-N 399.241 2.609 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2cccc(F)c2)S(C)(=O)=O)cc1 2854667 XNUVSXMHRVQDEP-UHFFFAOYSA-N 396.509 2.809 0 50 GFAA Cc1csc(CN(C)C[C@@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)n1 55253462 VSAXWUHSNVHKGS-IBGZPJMESA-N 395.475 2.715 0 50 GFAA CC(C)N1CCN(C(=O)c2coc(COc3cccc4cnccc34)n2)CC1 67920986 RCNQUGVYNQQWPR-UHFFFAOYSA-N 380.448 2.968 0 50 GFAA O=C(NCCNc1cc(-n2cccn2)ncn1)c1ccc(Cl)cc1Cl 65361871 FSOBCNGUBBBCBE-UHFFFAOYSA-N 377.235 2.811 0 50 GFAA O[C@@H](COc1ccc(CNC2CCOCC2)cc1)CN1CCc2ccccc2C1 20207660 BPTDFBKZWFODQP-HSZRJFAPSA-N 396.531 2.753 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3cccc(C)c3C)CC2)cc(-n2ccnc2)n1 65364581 LYUZCTXOMLVQGH-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CC[C@@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 25664461 VFBACQGDAHTASH-PVAVHDDUSA-N 378.469 2.943 0 50 GFAA Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)CCNC(=O)c1ccccc1 252443953 CUDZKFDHBWZESM-TZIWHRDSSA-N 377.488 2.949 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 12298357 KUOZUKOFJFFNHF-JOCHJYFZSA-N 381.451 2.805 0 50 GFAA COc1ccc(CN2CC[C@H](NC(=O)c3ccnc4ccccc34)C2=O)cc1 172266453 QSGKXLIFJAOMSN-FQEVSTJZSA-N 375.428 2.774 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CC(=O)N[C@@H](C)[C@H]1CCCO1 2780144 LOHRPVLZFPPFCC-IONNQARKSA-N 384.196 2.657 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1ccc3c(c1)OCO3)CC2 120815461 HDHTYUJJUVWHGW-GFCCVEGCSA-N 393.365 2.954 0 50 GFAA CCOc1cccc(N2CCN(C(=O)c3cc(F)ccc3-n3cccn3)CC2)n1 475758926 ZJMOHMIQRFPNFG-UHFFFAOYSA-N 395.438 2.768 0 50 GFAA CC[C@H]1CN(C(=O)c2nn(C)c3c2CCCC3)CCC(=O)N1Cc1ccccc1 71751029 AUTSJWHWRUWJNS-SFHVURJKSA-N 394.519 2.952 0 50 GFAA Cc1nccn1-c1cc(NCCNC(=O)Nc2ccc(F)c(Cl)c2)ncn1 35598129 PEPBWPNNBNPCGA-UHFFFAOYSA-N 389.822 2.997 0 50 GFAA Cc1cc(NC(=O)c2cnn(CC(=O)NC3CCCCC3)c2)ccc1C(=O)O 261778850 NUPKDPMTJHSTMR-UHFFFAOYSA-N 384.436 2.591 0 50 GFAA NC(=O)c1cncc(N2CCC[C@@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)n1 71765324 HCERGIVBMHMJGZ-MRXNPFEDSA-N 386.455 2.927 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC3(CC2)CN(CCOc2ccccc2)C(=O)O3)c1 77506118 USSMBAWVSPUUAH-UHFFFAOYSA-N 383.448 2.829 0 50 GFAA C[C@H](N1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1)C(F)(F)F 175961993 ZSJPYWUJMIMCRU-HNNXBMFYSA-N 384.446 2.933 0 50 GFAA CN1CCN([C@H]2CCN(C(=O)NC(c3ccccc3)c3ccccc3)C2)CC1 426690194 AJMDCBLRTKKARH-NRFANRHFSA-N 378.520 2.807 0 50 GFAA CCN(Cc1cnn(CC)c1)C(=O)c1ccc(-c2nc(=NC)c(F)c[nH]2)cc1 426594889 OGYORIXEXGHFSS-UHFFFAOYSA-N 382.443 2.625 0 50 GFAA COc1cccc(-n2cc(CNC(=O)c3ccc(C(C)C)n(C)c3=O)cn2)c1 426443420 RNMLHNUDNBTAIK-UHFFFAOYSA-N 380.448 2.633 0 50 GFAA CCN1CC[C@H](CNC(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)C1 426740548 NSSUEHDRMYOLNH-GOSISDBHSA-N 386.517 2.732 0 50 GFAA CCNc1ccnc(-c2cccc(C(=O)N3CCC[C@@]4(CCN(C)C4)C3)c2)n1 426620282 RUGNGZFDCXDKCG-QFIPXVFZSA-N 379.508 3.133 0 50 GFAA C[C@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)c1cc(F)cc(F)c1 426612476 DDICVIRFVBZUJR-HNNXBMFYSA-N 380.483 2.695 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2n[nH]c4c2CCC4)C3)cc1 95364359 WOZGRZJWBNVDCC-DLBZAZTESA-N 380.492 2.644 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)N2CCC(c3cccc(O)c3)CC2)c1 97694675 COJWEQVAUASURU-UHFFFAOYSA-N 389.477 2.712 0 50 GFAA CCn1nc(C)c(NC(=O)CN2CCC(N3CCc4ccccc4C3)CC2)c1C 65397059 NBGDSNNPWDKFCP-UHFFFAOYSA-N 395.551 2.981 0 50 GFAA COCCN1CC[C@@H](CNS(=O)(=O)c2ccc(Cl)c(C)c2Cl)C1 670452819 YJGGAVRMKSXKBT-LBPRGKRZSA-N 381.325 2.548 0 50 GFAA O=S(=O)(NCCCCCN1CCOCC1)c1cc(Cl)c(Cl)s1 670471470 QXYNIFMBXYUMJC-UHFFFAOYSA-N 387.354 2.836 0 50 GFAA O=C(NCCC(=O)N(Cc1ccccn1)C[C@H]1CCCO1)c1ccc(F)cc1 952984996 DLTWPVCSMXUOGA-LJQANCHMSA-N 385.439 2.548 0 50 GFAA CCc1nc2n(n1)C[C@H](NC(=O)c1cnc(Cc3ccccc3F)s1)CC2 185422422 XPFRKUMBTICHRT-CYBMUJFWSA-N 385.468 2.772 0 50 GFAA CN(C)c1ccc(NC(=O)c2ccc(I)c(O)c2)cn1 170595324 KPOIRVRMIUVOFI-UHFFFAOYSA-N 383.189 2.710 0 50 GFAA Cc1cc(N2CCOCC2)ccc1NC(=O)c1ccc(-n2cncn2)c(C)c1 170640826 ZDAJDZKDOOXUNX-UHFFFAOYSA-N 377.448 2.973 0 50 GFAA CCn1nccc1N1CCC[C@@H](NC(=O)CCc2c[nH]c3c(C)cccc23)C1=O 189921172 UJCGJJJXSRAKGU-GOSISDBHSA-N 393.491 2.937 0 50 GFAA Cc1nnc(CN(C)C(=O)[C@H]2CCc3sc(-c4c(C)noc4C)nc3C2)o1 1772808968 HNARAQDLNSRTNY-LBPRGKRZSA-N 387.465 2.870 0 50 GFAA O=C(c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)N1CCOCC1 5598873 MHFNHXPTMFSVQH-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(Cl)c1 5633475 PLEZZYQKWNBGNU-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA O=C(Cc1ccccn1)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 11937191 OHLFRRXBRJKPCF-OAHLLOKOSA-N 377.366 2.560 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)Cn4cccn4)C3)C2)c1 11999207 RPJNMHHBAQGUHZ-OAQYLSRUSA-N 386.471 2.546 0 50 GFAA CC[C@H](NC(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1)c1ccncc1 12302359 VLICDJGGFMCZAD-INIZCTEOSA-N 380.404 2.994 0 50 GFAA Cc1ccc2[nH]c(C3CCN(C(=O)[C@@H]4CCC(=O)N(C5CC5)C4)CC3)nc2c1 12306721 QKWRZMAYTYMTFV-MRXNPFEDSA-N 380.492 2.978 0 50 GFAA CCNC(=O)c1cn(CCc2ccccc2)cc(C(=O)N2CCC[C@H](C)C2)c1=O 14990587 SDHOOGOBKXVRKI-KRWDZBQOSA-N 395.503 2.713 0 50 GFAA Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 16605030 SITPZPGFXKYTQB-KRWDZBQOSA-N 382.460 2.835 0 50 GFAA COC(=O)C[C@H](c1cnn(C(C)C)c1)c1c(O)n2cc(Cl)ccc2nc1=O 205970608 PXEWGBFNHSNNJC-CYBMUJFWSA-N 390.827 2.526 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCc3c(Cl)c(C(F)(F)F)nn3C)n[nH]c21 1857531078 VMBOZJLHJWOPEN-RQJHMYQMSA-N 391.781 2.768 0 50 GFAA O=C1CCOC2(CCN(C(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)CN1 1857712849 IYZDTAVLCHSHCQ-UHFFFAOYSA-N 390.789 2.870 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(c3cc(C(F)(F)F)ncn3)CCN12 1857675300 RUYRRVLGNAXHIF-KRWDZBQOSA-N 378.354 2.749 0 50 GFAA O=C(O)[C@H]1CN(C(=O)Cc2cccs2)CC12CCN(Cc1ccco1)CC2 1857689468 FGQXFMHRUJZOBJ-QGZVFWFLSA-N 388.489 2.709 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857714216 NHXRIEDNJBXLKZ-UHFFFAOYSA-N 376.460 2.991 0 50 GFAA CC(C)CC(=O)NC[C@H]1[C@H]2CN(Cc3cc(C(C)C)on3)C[C@]23CC[C@H]1O3 1857729326 DFPPXWDNLKJJAD-XKGFGPFHSA-N 375.513 2.940 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ncccc3F)C[C@]23CC[C@H]1O3)c1ccccc1F 1857737328 HTQFZSKHOVLHEM-JTQINKHRSA-N 385.414 2.774 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccnn1[C@H]1CCCc2ccccc21 115954885 BEYMXOGRAZAYSK-FQEVSTJZSA-N 399.458 2.966 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 4899605 HPTFPWMPQFBSHP-IBGZPJMESA-N 394.427 2.601 0 50 GFAA in-vitro COCCCn1c(C(=O)N2CCC[C@H](C)C2)cc2c(=O)n3cccc(C)c3nc21 5246834 CAXKPOWLJDKHPD-HNNXBMFYSA-N 396.491 2.866 0 50 GFAA Fc1cnc(N2CC[C@](c3nc(-c4cccnc4)no3)(C(F)(F)F)C2)cn1 952895728 WYHKILUHKADUEW-HNNXBMFYSA-N 380.305 2.771 0 50 GFAA CC(C)C[C@H](CNC(=O)C[C@@H]1CCOC1)NC(=O)Cc1ccc2cnccc2c1 1875331574 ODEJZAUKTBMBBE-GHTZIAJQSA-N 397.519 2.851 0 50 GFAA O=C(NC1CC1)N[C@H]1CCN(C(=O)c2cc(C(F)(F)F)nc3ccccc23)C1 1875310116 FDGXZSZYFOSJQB-LBPRGKRZSA-N 392.381 2.930 0 50 GFAA Cc1ccc(C(=O)N[C@]23CCC[C@H]2N(C(=O)[C@@H](C(C)C)N(C)C)CC3)s1 1775993391 ZUFWYMJLJXUDEF-HLIPFELVSA-N 377.554 2.896 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2ccc(Br)cc2)NC(=O)N1 706383 QKMKMANBZFNUGU-ZFWWWQNUSA-N 395.253 2.799 0 50 GFAA biogenic Cn1c(C2CC2)nc2cc(CNC(=O)c3ccc4c(c3)OCCNC4)ccc21 2325795344 AVZFNZGYWDTFQG-UHFFFAOYSA-N 376.460 2.863 0 50 GFAA c1ccc(Cc2nccc(=NCCN=c3ccc(-c4ccccc4)n[nH]3)[nH]2)cc1 2325862153 KWKOBFJUUJOIFI-UHFFFAOYSA-N 382.471 2.892 0 50 GFAA CCOc1ccc(NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1 1127001 JSQNVFJKIXZPRT-UHFFFAOYSA-N 376.478 2.928 0 50 GFAA O=C(CCc1cn[nH]c1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356141711 MNCJXQJVBWJPFG-QFIPXVFZSA-N 380.492 2.569 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ncc[nH]2)CC[C@@H]1Nc1ncnc(C)c1C 2356145203 GDWRPRJFKVPKSM-ULQDDVLXSA-N 386.500 2.509 0 50 GFAA CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC)c(Br)cc1OC 4755217 PEQKWZHPMWRRDM-CQSZACIVSA-N 399.241 2.657 0 50 GFAA Cc1c(NS(=O)(=O)c2cc(F)ccc2F)c(=O)n(-c2ccccc2)n1C 6706688 AVZGODBLBSRXBA-UHFFFAOYSA-N 379.388 2.563 0 50 GFAA COc1cc(N2CCN(C(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)CC2)ncn1 460907047 SSJALNUTDTZFEF-INIZCTEOSA-N 399.495 2.865 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4nc(C)cc4C)nc(C)n3)CC2)cc1 67603984 CQWNMQGQNLGNAP-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA CC(C)NC(=O)[C@H](C)N1CCC(n2nccc2NC(=O)C2CCCC2)CC1 67677144 OVXHWIYMSGVRJJ-HNNXBMFYSA-N 375.517 2.562 0 50 GFAA CN(C)c1cccc([C@H]2CCCN2C(=O)Cn2c(=O)n(C)c3ccccc32)c1 117821733 VQPOXIHZEZYUET-GOSISDBHSA-N 378.476 2.770 0 50 GFAA Cc1ccc2nc(CN(C)C(=O)c3ccc(C)c(N4CCNC4=O)c3)[nH]c2c1 67688884 WPLBAUYVPZTVTG-UHFFFAOYSA-N 377.448 2.982 0 50 GFAA CSCCCN1CCC(N2CCC[C@H](C(=O)NCc3cccnc3)C2)CC1 71479396 UQYYUOIGFUSRLK-IBGZPJMESA-N 390.597 2.627 0 50 GFAA CCc1noc(C)c1C(=O)N1CCCn2nc([C@H](O)c3ccccc3)cc2C1 219045808 GTEUOLJXKBDZKE-HXUWFJFHSA-N 380.448 2.870 0 50 GFAA COc1ccc(-n2nnc(C(=O)N3CCOC[C@H]3c3ccc(C)o3)c2C)cc1 172265314 MDNFKJHDCFVHDP-KRWDZBQOSA-N 382.420 2.699 0 50 GFAA CN(C[C@@H]1CCCN(C)[C@H]1c1ccnn1C)C(=O)c1cc(O)nc(C2CC2)c1 329208409 XXNSZYPLYKWPRU-MGPUTAFESA-N 383.496 2.553 0 50 GFAA CC(=O)N1c2ccccc2C[C@H]1C(=O)Nc1cccc(Cl)c1-n1cncn1 364498211 BQSMDBRRWQFGGF-KRWDZBQOSA-N 381.823 2.837 0 50 GFAA CCn1nccc1C(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71748627 SKSBIXHSRWSBMM-IBGZPJMESA-N 386.471 2.941 0 50 GFAA Cc1c(C(=O)Nc2cc(Br)c(=O)n(C)c2)c(O)nc2ccccc12 126906986 GBUJSGTTXXWLFX-UHFFFAOYSA-N 388.221 2.962 0 50 GFAA C[C@H]1NCCN(C(=O)c2cccc(NC(=O)c3ccc4[nH]cnc4c3)c2)[C@@H]1C 262773530 KJXUKAXYQYOHQV-ZIAGYGMSSA-N 377.448 2.638 0 50 GFAA CS(=O)(=O)Nc1c[nH]nc1[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 371607959 PNLUIIRQEPEGRY-JTQLQIEISA-N 389.403 2.579 0 50 GFAA Cc1nc2c(c(=O)[nH]1)CCN(C(=O)c1c(-c3ccccc3Cl)noc1C)C2 72161676 RQLBLSPVURHAHS-UHFFFAOYSA-N 384.823 2.894 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@H](C)CCC(=O)O)c2)cc1 262127002 JTUSOZRNUROIGG-CQSZACIVSA-N 390.461 2.779 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2S(=O)(=O)c2ccc3ccccc3c2)O1 242196981 XGRRCLPTJQVYEO-CJODITQLSA-N 389.473 2.712 0 50 GFAA CC(C)NC(=O)Nc1cccc(C(=O)N[C@@H](c2ccccc2)c2nc[nH]n2)c1 378528459 IRMMNBSNNIDJSX-KRWDZBQOSA-N 378.436 2.854 0 50 GFAA COc1cccc(CN2CC3(CCN(CCCn4ccnc4)CC3)CC2=O)c1 77470741 SWVUIUCMTJUWRO-UHFFFAOYSA-N 382.508 2.797 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C1 174160126 BAHNZMOCXBRWTR-UXHICEINSA-N 395.503 2.789 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)N2CCN(c3ccccc3F)CC2)CC1 42723028 GIGBBTMDFBATTO-UHFFFAOYSA-N 390.503 2.648 0 50 GFAA Cc1cc(C)c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)N2CCN(C)CC2)o1 175615358 FAEFOLBRKABPQI-LJQANCHMSA-N 381.476 2.632 0 50 GFAA CCOC(=O)c1cc(C2CC2)nc2c1c(=O)n(Cc1ccc(C)cc1)c(=O)n2C 20168592 HMGSYJASVAQIEJ-UHFFFAOYSA-N 393.443 2.506 0 50 GFAA O=C(Nc1ccc(F)cc1)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 82230338 XAXIUNUFDODBBQ-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)CN3CCCCC3=O)CC2)C1 95361728 XAWKPIFFVJGQJR-FQEVSTJZSA-N 383.536 2.727 0 50 GFAA Cc1nc(C)n(CCc2nc3c([nH]2)C[C@@H](c2ccc(Cl)cc2)CNC3=O)n1 95528860 SLHUPANRSSZGQP-CQSZACIVSA-N 384.871 2.584 0 50 GFAA COc1ccc([C@H](CC(=O)N2CC(N3CCOCC3)C2)c2ccccc2)cc1 95526747 CMRRTOCMZIFCFR-JOCHJYFZSA-N 380.488 2.760 0 50 GFAA Cc1cccc(-n2cnc(C(=O)N3CCC[C@@H]3c3ccc(C(N)=O)s3)c2)n1 23128562 QARFLBWAALPLTL-CQSZACIVSA-N 381.461 2.713 0 50 GFAA CCn1nc(C)c(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)c1C 91724446 KHXXJAUUFOTVAN-UHFFFAOYSA-N 384.528 2.539 0 50 GFAA COCCN(Cc1ccccc1C)C(=O)Nc1ccc(-n2nnnc2C)cc1 95523945 GGKRJZHAFALLQE-UHFFFAOYSA-N 380.452 2.960 0 50 GFAA COCc1cc(F)ccc1NC(=O)N1CCN(Cc2cn3ccccc3n2)CC1 184720024 DMIJHMHNOOSVEM-UHFFFAOYSA-N 397.454 2.970 0 50 GFAA COC(=O)c1cn([C@H]2C[C@@H](C(F)(F)F)Oc3ccccc32)cc2c(=O)[nH]nc1-2 263588868 ZJBIPBGXBCBAMV-JSGCOSHPSA-N 393.321 2.766 0 50 GFAA Cc1cc(=NC(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)[nH]o1 1940197749 OARNFENXWGXIDV-JOCHJYFZSA-N 375.428 2.891 0 50 GFAA C[C@H](CC(=O)OCC1c2ccccc2-c2ccccc21)C[C@@H](N)[C@@H](O)CC(=O)O 232319637 NMCBHZITLTYUHZ-DLPLYFIVSA-N 397.471 2.921 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)Cn2cnc3ccccc3c2=O)cc1 827861526 QXHPJAWVHMEQEY-CQSZACIVSA-N 376.416 2.551 0 50 GFAA COCc1nnc(NC(=O)c2cc3ccc(OC)c(OC)c3c(=O)s2)s1 824490871 ZZHUTHFZGTXOTN-UHFFFAOYSA-N 393.446 2.529 0 50 GFAA C[C@@H](C(=O)Nc1cccc(-n2cccn2)c1)N(c1ccccc1)S(C)(=O)=O 952991903 XCQMHDJUJPMJPS-HNNXBMFYSA-N 384.461 2.666 0 50 GFAA O=C(c1cccnc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)NCc1ccc(F)cc1 1565509702 KFPKKTFXCPOXRI-APWZRJJASA-N 382.439 2.667 0 50 GFAA CCCOc1ccc(-c2nc(C(=O)N3CCOC[C@@H]3C(=O)O)cs2)cc1 268963779 BCVWUTHGPNYMQF-OAHLLOKOSA-N 376.434 2.525 0 50 GFAA CCOc1ccc(S(=O)(=O)N(C)C)cc1NCc1cnc2cc(C)ccn12 408516487 TZYAHGBVJRSIAN-UHFFFAOYSA-N 388.493 2.904 0 50 GFAA Cc1nc(CN2CCC(C(=O)NCc3ccnc(-n4cccn4)c3)CC2)cs1 170684482 IDVXZNQDTZBYPJ-UHFFFAOYSA-N 396.520 2.561 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)N2CCCN(c3ccccc3)CC2)CC1=O 193524942 AENJVQMHMVNTDW-GOSISDBHSA-N 393.487 2.787 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12)N(C)CC 1704301045 HNMGGXHENYWMTH-SFHVURJKSA-N 390.524 2.825 0 50 GFAA CCOC(=O)N1CCN(C(=O)C[C@H](c2cccc(O)c2)c2ccccc2O)CC1 12299021 UZZKEWDPEQAYOE-LJQANCHMSA-N 398.459 2.921 0 50 GFAA CCOC(=O)c1cnn2c(C(=O)OC)cc(-c3cccc(OC(F)F)c3)nc12 13645359 NDYBZTNXASULJZ-UHFFFAOYSA-N 391.330 2.961 0 50 GFAA CCN(CC)CC(=O)N(C)C[C@@H]1CCCN(CCc2ccccc2OC)C1 14965953 UULNBAZERVSAON-IBGZPJMESA-N 375.557 2.750 0 50 GFAA C[C@@H](NC(=O)COc1ccc(-c2ncccn2)cc1CN(C)C)c1nccs1 14982556 CHXMPFXEMGHQMW-CQSZACIVSA-N 397.504 2.918 0 50 GFAA O=C(CSc1ncccn1)N[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 19143963 QETAXTVQROJRFW-ZDUSSCGKSA-N 397.426 2.768 0 50 GFAA COc1cc(CN2CCN(C(=O)c3cccs3)CC2)cc(OC)c1OC 19789552 YCHJENABGBTLCB-UHFFFAOYSA-N 376.478 2.732 0 50 GFAA CC(C)COc1ccc(C(=O)N/C(=C\c2ccco2)C(=O)N2CCOCC2)cc1 4580153 KAMBCTKFOUPVJU-ZHZULCJRSA-N 398.459 2.944 0 50 GFAA CCn1nc2c(c1C(=O)NCc1cnc(OC)c(Cl)c1)C[C@@H](C)O[C@H]2C 1857531200 KGUZALWAFMZZHJ-MNOVXSKESA-N 378.860 2.912 0 50 GFAA Cc1n[nH]c(C)c1CC(=O)N[C@H]1CN(CC(F)(F)F)C[C@@H]1c1ccccc1 1857532259 LYSMXLVEIFJYBM-SJORKVTESA-N 380.414 2.716 0 50 GFAA COc1ccccc1Cc1nc(-c2cnc3cccnn23)n([C@@H]2CCOC2)n1 1857675263 PWKLLOPAPASKIS-OAHLLOKOSA-N 376.420 2.549 0 50 GFAA O=C1CC2(CCN(Cc3cnc[nH]3)CC2)OCCN1C/C=C/c1ccccc1 1857690229 XHRPSNBLJVMGMX-QPJJXVBHSA-N 380.492 2.707 0 50 GFAA CN(C)Cc1nc(C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)cs1 1857711400 XHWLPKBKHVYEFV-UHFFFAOYSA-N 395.532 2.846 0 50 GFAA COC(=O)C(C)(C)NC(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857732290 KQTQOZJUMXIAJS-LLVKDONJSA-N 379.844 2.765 0 50 GFAA Cc1cc(N[C@@H](c2ccc(Br)cc2)[C@@H](C)CO)n2ncnc2n1 225607104 XUAJAYXQAGTHLR-ZUZCIYMTSA-N 376.258 2.977 0 50 GFAA Cc1noc(C2CN(C(=O)c3cc(Br)cnc3OCC3CC3)C2)n1 376024563 QQTFYTNGWPTMNO-UHFFFAOYSA-N 393.241 2.564 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)Nc3cccc(Cl)c3Cl)CC2)[C@H]1O 1704299602 POWLRLDHZATVQH-GOEBONIOSA-N 389.279 2.892 0 50 GFAA O=C1CCCc2ccc(S(=O)(=O)NC(=O)C(F)(F)Cc3ccccc3)cc21 811212097 MLWDMTWUKDZPGV-UHFFFAOYSA-N 393.411 2.889 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@H]2c2nccn2Cc2ccccc2)cccc1=O 952890615 FIELSDPQJKXGSV-LJQANCHMSA-N 376.460 2.853 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2)CN(C(=O)COC2CCOCC2)C1 952891828 IVAYERWJYMBUSY-UHFFFAOYSA-N 383.492 2.979 0 50 GFAA Cc1nc(S(=O)(=O)N2CCn3c(nc4c3CCCC4)C2)c(-c2ccccc2)o1 1875396457 IBHFMEAEJZDZAK-UHFFFAOYSA-N 398.488 2.930 0 50 GFAA OC[C@H]1CN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C2(CC2)CO1 1875318848 WTKDOEOOKPZZHY-CQSZACIVSA-N 383.473 2.790 0 50 GFAA O=C(Nc1c(F)ccc2c1OCO2)N1CCCN(c2ncccc2F)CC1 880662813 LAFKFOCENYYGCH-UHFFFAOYSA-N 376.363 2.833 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]1Oc2ccccc2O[C@H]1C 4867084 CLJQWQMNTFSHPW-BBATYDOGSA-N 387.388 2.657 0 50 GFAA COC(=O)c1ccc2c(c1)C[C@H](NC(=O)c1cnn(C)c1Cc1ccccc1)C2 2325792695 FODSCTNJAGOGNG-LJQANCHMSA-N 389.455 2.695 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)cc1C 887308 GEIGWWWFKAVLCZ-UHFFFAOYSA-N 376.478 2.523 0 50 GFAA CCc1sc(C(=O)N2CCN(c3ncccn3)CC2)cc1Br 1052233 CCXMHFVKHUAJSS-UHFFFAOYSA-N 381.299 2.825 0 50 GFAA COc1ccc(CCNC(=O)C[C@@H]2Nc3cc(C)c(C)cc3NC2=O)cc1OC 4058431 GITHRRWGRSZHGK-SFHVURJKSA-N 397.475 2.802 0 50 GFAA CN(C)c1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 6698067 BCOSZDAWNUHPRB-UHFFFAOYSA-N 387.505 2.792 0 50 GFAA COc1cccc(CCNC(=O)[C@H]2CCCN2C(=O)C2CCCCC2)c1OC 55384974 QIOQMOIYEGUWDO-GOSISDBHSA-N 388.508 2.934 0 50 GFAA CC(C)[C@H]1CC[C@@H](C)CCN1C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 117527439 WXOYWOSCJYRYJY-CXAGYDPISA-N 398.500 2.841 0 50 GFAA O=C1CCC[C@H]1CC(=O)N1CCC(Oc2ccc(Cl)cc2)(C(=O)O)CC1 65372548 YJVRESWAKAZBLQ-ZDUSSCGKSA-N 379.840 2.924 0 50 GFAA Cc1c(C(=O)O)sc2ncnc(NCCc3nc(-c4cccnc4)n[nH]3)c12 67817260 QZNUTMBUQHPCFD-UHFFFAOYSA-N 381.421 2.533 0 50 GFAA CCOC(=O)c1n[nH]cc1-c1c(-c2ccccc2)ncn1CCN1CCCC1=O 67975127 VNJPIYQFDMMACO-UHFFFAOYSA-N 393.447 2.739 0 50 GFAA C[C@H]1Cc2cc(Br)cc3c(=O)c(C(=O)NC[C@@H]4CCCO4)cn1c23 33089173 YUWZOTCGDOVTOW-GWCFXTLKSA-N 391.265 2.790 0 50 GFAA O=C(c1cn[nH]n1)N1CCN(C(=O)N(c2ccccc2)c2ccccc2)CC1 72122330 JQOQPJXLROFIDP-UHFFFAOYSA-N 376.420 2.521 0 50 GFAA O=C(CCCN1CCN(c2ccccc2)CC1)N[C@@H]1COc2ccccc2C1 171863533 IUZMFSRDTYNLKN-FQEVSTJZSA-N 379.504 2.709 0 50 GFAA COc1ccc([C@H]2N=C(O)N(c3cc(C(=O)N(C)C)ccc3C)C2=O)c(OC)c1 328595211 OFAOGVAYKAXDFW-GOSISDBHSA-N 397.431 2.716 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)[C@H]3CSCCS3)CC2)cn1 328633733 MGBQDXDFERSSGN-GOEBONIOSA-N 380.583 2.789 0 50 GFAA CCc1cc2c(NC[C@@H]3CC(=O)N(C)[C@H]3c3cnn(C)c3C)ncnc2s1 328608476 ANIKBPMKWJZDKJ-YVEFUNNKSA-N 384.509 2.927 0 50 GFAA Cn1ncc2c(N3CCCN(c4ccncc4)CC3)nc(-c3cccnc3)nc21 72150094 RQULYJZXQOIWLM-UHFFFAOYSA-N 386.463 2.537 0 50 GFAA CN1CC[C@@H](N(C)C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)C1 72135483 HOBXOGMQMVFUIL-HSZRJFAPSA-N 391.559 2.861 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)cc1OC(F)F 156480992 KOJFEMKDKCVRNS-CQSZACIVSA-N 393.390 2.908 0 50 GFAA Cn1cc(NC(=O)CN2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)cn1 71765106 HKBVTAMQZKLYMW-CQSZACIVSA-N 394.397 2.972 0 50 GFAA CCc1nnc(-c2ccc(NC(=O)N3CCC[C@@H](Cn4ccnn4)C3)cc2)o1 127850196 GDEOWFROHLJSCX-CQSZACIVSA-N 381.440 2.835 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1)c1noc2c1CCCC2 262429406 JCLYUGNNSJEYBN-INIZCTEOSA-N 397.431 2.885 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(-n2ccnc2)cc1 158939102 MRINXTSRYLLKHJ-HXUWFJFHSA-N 388.471 2.836 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cccs1 237969621 VLVGCUXOAUHIFR-MFKMUULPSA-N 394.399 2.711 0 50 GFAA O=C(NCC[C@H]1CCCO1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 237944825 QXTUUXRLCJMILC-CYBMUJFWSA-N 397.353 2.888 0 50 GFAA Cc1ccc(C(=O)N2CCc3c(nc(-c4ccccn4)nc3N(C)C)C2)c(O)c1 71759974 RDGAFTDXTXGKCG-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(Cc3cccc(F)c3)CC2)cc1 20176940 OZPMWHSOLDLUIF-UHFFFAOYSA-N 378.469 2.731 0 50 GFAA Cc1cc(C)n([C@H]2CCN(C(=O)CCCc3nc(-c4cccnc4)no3)C2)n1 426386855 FAYJPDDHMPUUDK-KRWDZBQOSA-N 380.452 2.741 0 50 GFAA CCCN1C[C@@H](NC(=O)c2ccc(-c3ccc4c(cnn4C)c3)cc2)CC1=O 426533671 CFHQBYYKDRYSIB-IBGZPJMESA-N 376.460 2.981 0 50 GFAA Cc1cnccc1N1CCN(C(=O)NCCCn2ncc3ccccc32)CC1 426490403 WEDWGSMCPCIMIF-UHFFFAOYSA-N 378.480 2.662 0 50 GFAA CN(C)C(=O)COc1ccccc1CN1CCC[C@H](c2nnc3ccccn23)C1 179779649 NYHSVSAZHPWZCG-SFHVURJKSA-N 393.491 2.576 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)c1cn(C)c3ccccc13)CC2 91444776 QFSKNIMRSKHUEU-UHFFFAOYSA-N 383.492 2.670 0 50 GFAA CCN(C(=O)Nc1ccc(OCc2ccco2)cc1)[C@@H]1CCS(=O)(=O)C1 96162961 SDBGKXCOHRLYCV-OAHLLOKOSA-N 378.450 2.900 0 50 GFAA CSc1ccccc1NC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]2OC(C)(C)O[C@H]21 238901091 KUGGZXDTDOYROY-JRBZFYFNSA-N 395.477 2.744 0 50 GFAA CCCn1nc(C)c(CNC(=O)Nc2cc(-n3cnnc3)ccc2OC)c1C 97334136 TZSQKMURHKKOAZ-UHFFFAOYSA-N 383.456 2.821 0 50 GFAA CCc1nc(C)sc1C(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccn1)C2 95357815 SUXHRBFFIGOXLX-LSDHHAIUSA-N 384.505 2.786 0 50 GFAA CN(C)Cc1nnc([C@H]2C[C@H](NC(=O)c3cc4c(s3)CCCCC4)C2)n1C 252570562 WUCLBTVAKPJWOL-SHTZXODSSA-N 387.553 2.883 0 50 GFAA Cn1cncc1C(=O)NCC1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1 828202289 YUAFWBBNMITZDD-UHFFFAOYSA-N 396.470 2.591 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)N2CCc3ccccc3C2)cc1C(=O)N(C)C 952975068 XVBPUKCYBRSWJH-OAHLLOKOSA-N 381.476 2.782 0 50 GFAA CCc1c(C)nc(C)nc1N1C[C@H]2c3ccc(OC)cc3OC[C@@]2(C(=O)O)C1 1565508602 BBROCYUSWQHWND-UWJYYQICSA-N 383.448 2.732 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1ccccc1)CCN2C/C=C/c1ccccc1 1565511964 CXICIFBYZFDDPD-XXIKFKTHSA-N 382.529 2.683 0 50 GFAA C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1C(=O)[C@H]2COCCN2C1=O 271999457 ACOGILRBPSAINY-KBXCAEBGSA-N 379.416 2.663 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@H](C)Oc4c(F)cccc43)ccc21 186865446 GIXUFLPEYYXEMN-LBPRGKRZSA-N 390.436 2.711 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)c1cccc(N2CCOC2=O)c1 189269771 NWLRDKPGFJGEIK-UHFFFAOYSA-N 385.386 2.647 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)N2CCNC(=O)C23CCCC3)n1 1506407110 INWYMLBFRHLUFN-UHFFFAOYSA-N 382.464 2.639 0 50 GFAA Cc1cc(NC(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)no1 5438246 NEXYWIYGLFKGKV-UHFFFAOYSA-N 378.237 2.549 0 50 GFAA CC(=O)NCCC(=O)N1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 12457649 BJJGLIXTYLNBRK-NRFANRHFSA-N 380.488 2.962 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccccc2F)C1)C(=O)c1cc2ncccn2n1 12470287 ASNRZSHPWMSIIU-QGZVFWFLSA-N 395.482 2.895 0 50 GFAA O=C(NCCN1CC[C@@H](c2ccccc2)C1)c1cn(Cc2ccc(F)cc2)nn1 12575821 JQVCJSJHCVFCSY-LJQANCHMSA-N 393.466 2.685 0 50 GFAA CC[C@@]1(CCC(=O)N2CCCN(c3nc4ccccc4o3)CC2)CCC(=O)N1 14974107 SUJHBXSQASJTMG-NRFANRHFSA-N 384.480 2.706 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@@H](Nc2ccc(OC)c(OC)c2)C1 15068530 GLTJUMAXILRZGH-MRXNPFEDSA-N 388.468 2.680 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@H](CNC(=O)c2ccccc2Cl)C1 15076809 XEOYQFGAEAVAFT-CQSZACIVSA-N 380.872 2.652 0 50 GFAA COC(=O)c1ccc(CNCc2c(C(=O)N3CCCC3)nc3ccccn23)cc1 19838635 WSBHRNRJHBTAPO-UHFFFAOYSA-N 392.459 2.647 0 50 GFAA O=C1CC2(CCN(C3CCN(c4ccccc4Cl)CC3)CC2)OCCN1 1857704804 GTGNITPYGFYMHI-UHFFFAOYSA-N 377.916 2.680 0 50 GFAA O=C([C@H]1C[C@@H]2CC[C@H]1O2)N1CCC(C2CCN(c3nncs3)CC2)CC1 1857717998 JYOJPQMUCDYWRJ-YESZJQIVSA-N 376.526 2.561 0 50 GFAA CN1CCC[C@H]1CC(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1857720862 NYWSUHSZFQTOOC-HNNXBMFYSA-N 386.540 2.770 0 50 GFAA COCc1ncc(CN2[C@H]3CC[C@@H]2[C@](Cc2ccccc2)(C(=O)N(C)C)C3)cn1 1857731823 PYDVPFPSLDIOKV-MIZPHKNDSA-N 394.519 2.677 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H]2C(=O)O)nn1-c1ccc(Br)cc1 237696399 OLBHAQLTVDJTRD-AWEZNQCLSA-N 378.226 2.632 0 50 GFAA C[C@@H](NC(=O)N[C@@H]1C[C@H]2CC[C@@]1(C)C2(C)C)c1cccc(S(N)(=O)=O)c1 241897380 TYFXVEQOJQUCHG-OZSDWXKXSA-N 379.526 2.909 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2cscn2)cc1F 247892249 NEQJSFXNYKUTIW-ZBFHGGJFSA-N 375.469 2.914 0 50 GFAA CC(=O)NC[C@H]1CCCN(c2cc(C(F)(F)F)nc(-c3ccncc3)n2)C1 266470953 ZWAXDWCAHYWYFI-CYBMUJFWSA-N 379.386 2.910 0 50 GFAA Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@@H](CO)[C@H](O)C1CCCCC1 913048882 LGPYUDUXRFKZLA-FUHWJXTLSA-N 391.899 2.866 0 50 GFAA COc1ccc(Cl)cc1C1(CNC(=O)N[C@H]2C[C@H](OC)C2)CCOCC1 952884402 BOGSWOWZXAJZBP-SHTZXODSSA-N 382.888 2.873 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC2(CC(CO)C2)C1)c1cccs1 1875299507 NDNGZSRFIQJTHN-OVCWQMANSA-N 398.528 2.757 0 50 GFAA CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)c3ccc(Cl)c(N4CCCC4)n3)[C@H]2C1 1875404535 LTZFXQWBLBHCSG-ZOBUZTSGSA-N 390.915 2.712 0 50 GFAA CC(C)C1(C(=O)N2CC[C@]3(C2)c2ncn(C)c2CCN3C(=O)[C@@H]2CC2(C)C)CC1 2325776796 AAXGAIYWHLILLY-HJPURHCSSA-N 398.551 2.715 0 50 GFAA CC[C@]1(C)C[C@@H]1C(=O)N1CCN(CCNC(=O)C23CC(C(C)(C)C)(C2)C3)CC1 2325793796 IAVWTKZLWRQIMZ-WVKMRRALSA-N 389.584 2.899 0 50 GFAA Cn1c(Cc2cccs2)nnc1SCC(=O)Nc1ccc2c(c1)OCO2 1058050 OJKCFVRCSJJLLO-UHFFFAOYSA-N 388.474 2.927 0 50 GFAA O=C([C@@H]1CCCO1)N1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)CC1 1139340 XTLMEYCVKCLWGM-AWEZNQCLSA-N 387.427 2.725 0 50 GFAA Cc1ccnc(NC(=O)CCC(=O)NCCCSc2nnc(C)s2)c1 55284446 JKBRTPNMHDXHFF-UHFFFAOYSA-N 379.511 2.567 0 50 GFAA C[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)n1c(=O)[nH]c2ccccc2c1=O 9172279 SSKCDTUANZHXHS-INIZCTEOSA-N 391.471 2.732 0 50 GFAA CCc1ccc2oc(C(=O)Nc3ccc4c(c3)N(C)C(=O)CO4)cc(=O)c2c1 28404086 CSIFQSYAINHNLU-UHFFFAOYSA-N 378.384 2.963 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c(F)cccc3F)C[C@H]2CCO)CC1 104346520 ZWWMXKYZVONICI-GOSISDBHSA-N 381.511 2.706 0 50 GFAA COc1ccnc(N2CCN(C(=O)c3cc(C)ccc3N3CCCC3)CC2)c1 116640543 AWNGJTOQVJCJGB-UHFFFAOYSA-N 380.492 2.961 0 50 GFAA Cc1cc(NC(=O)Cn2cnc(C3CCC3)cc2=O)n(-c2ccccc2F)n1 134399102 CXGMJCNSQXFVFU-UHFFFAOYSA-N 381.411 2.783 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)Nc3cc(F)cc(F)c3)nn2)n1 67604919 NOONUJPQAXJGSR-UHFFFAOYSA-N 387.394 2.791 0 50 GFAA Cc1cc(C)nc(N[C@]2(C(F)(F)F)N=C(O)N(CCc3ccccc3)C2=O)n1 65363120 PQZRADVXNGAVMC-KRWDZBQOSA-N 393.369 2.763 0 50 GFAA CC[C@H](C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1)N1CCCC1 67805755 KCFNDRRRIPDVNZ-MRXNPFEDSA-N 383.448 2.829 0 50 GFAA CN(C[C@H]1CCCCO1)c1ccc(C(=O)N2CCC(Cn3cccn3)CC2)cn1 20991985 DCCFNXQBZNNPTI-HXUWFJFHSA-N 397.523 2.836 0 50 GFAA COc1ccc([C@H](NC(=O)N(C)Cc2cnc(N(C)C)nc2)C(F)F)cc1F 252503889 VHAGOWJIROEFSF-HNNXBMFYSA-N 397.401 2.838 0 50 GFAA COc1cc(-c2nc(CN3CCn4nc(C)cc4C3)c(C)o2)cc2c1OCO2 72457841 FJXNGIWBSWYTJZ-UHFFFAOYSA-N 382.420 2.908 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)C2CCN(c3cnccn3)CC2)C[C@@H](C)O1 122189870 MLONAFNTHWGOFL-CALCHBBNSA-N 395.507 2.945 0 50 GFAA CCN1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@@H]1c1ncc[nH]1 328625905 LCINWEMJZWTSRX-CYBMUJFWSA-N 389.308 2.784 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCN2CCCC2=O)CCCN1Cc1ccc(F)cc1 72153128 QNYXCLFQXFDKKF-HXUWFJFHSA-N 389.515 2.897 0 50 GFAA CN(Cc1csc(-c2ccccc2)n1)C(=O)[C@@H]1CSC(C)(C)C(=O)N1 72433162 FGTPJCJPVUNNQZ-AWEZNQCLSA-N 375.519 2.779 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1)c1cn(CC[C@@H]2CCCCN2)nn1 77357966 ZKQYRKTZCRBPMB-HNNXBMFYSA-N 381.402 2.759 0 50 GFAA Cc1cc(C)n2c(C(=O)Nc3nn(C)c4cccc(OC(C)C)c34)nnc2n1 77426032 CGGPLAJANIGARJ-UHFFFAOYSA-N 379.424 2.667 0 50 GFAA CC(C)(C)c1csc([C@H]2CN(C(=O)c3ccc4nccnc4n3)CCO2)n1 333662649 HGNWMXPPXUVOMB-CQSZACIVSA-N 383.477 2.993 0 50 GFAA N[C@H]1CCCN(C(=O)/C=C/c2ccc(-n3cc(Br)cn3)c(F)c2)C1 157772376 HZINQVIYPSTXDH-YVZNUBBCSA-N 393.260 2.737 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)C2)CN1CC1CC1 77386887 QKWFMYBUQGGHBS-QFIPXVFZSA-N 393.491 2.727 0 50 GFAA O=C(Nc1nccs1)[C@H]1CCCN1C(=O)CCc1nc(C2CCCC2)no1 130131286 ZFRBUHIXMWPXKK-CYBMUJFWSA-N 389.481 2.746 0 50 GFAA CCc1cc(N2CCC(NC(=O)N3CCC[C@@H]3c3ccncc3)CC2)ncn1 175470929 SBLVEPIKXJQVMY-LJQANCHMSA-N 380.496 2.950 0 50 GFAA CN1CCN(C(=O)NCc2coc3ccccc23)C[C@H]1c1nc(C2CC2)no1 286655267 CTZGGONLUHLONP-INIZCTEOSA-N 381.436 2.892 0 50 GFAA O=C(c1ccc(-c2ccccc2)[nH]c1=O)N1CCOc2ccc(CO)cc2C1 91713101 RVPFJJYALQHQSA-UHFFFAOYSA-N 376.412 2.569 0 50 GFAA CNC(=O)Cc1ccc(NC(=O)NC2CCN(c3ccccc3F)CC2)cc1 97213349 CBWFENIUGCCSTL-UHFFFAOYSA-N 384.455 2.905 0 50 GFAA O=C(NCc1n[nH]c2c1CCC2)N1CCC[C@H]1c1nc(-c2ccccc2)no1 426414680 RMVXEYJGPHCVOB-KRWDZBQOSA-N 378.436 2.995 0 50 GFAA CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCCN(C(=O)OCc2ccccc2)C1 21302984 DUJRIGHZAUCYQH-LJQANCHMSA-N 378.425 2.767 0 50 GFAA Cn1cnnc1CN1CCC[C@H](C(=O)Nc2ccc(-c3cscn3)cc2)C1 95527692 TWPTYSJKPDDTFN-HNNXBMFYSA-N 382.493 2.789 0 50 GFAA CC(C)c1nccn1[C@@H](C)C(=O)N1CCc2nnc(-c3ccccc3)n2CC1 95523361 IBJFFLWJFVGKAT-INIZCTEOSA-N 378.480 2.911 0 50 GFAA Cc1nnc([C@H](C)NC(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)o1 95527307 GSEODFLWNYEIEM-ZDUSSCGKSA-N 398.463 2.649 0 50 GFAA CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cccnc1-n1cc(Br)cn1 294946496 IPOUNWFHYVELMB-WFASDCNBSA-N 393.285 2.653 0 50 GFAA O=C(NC1CCN(CC2CCCC2)CC1)N1CCN(Cc2ccccn2)CC1 184609463 NDYSCJGSUKLHMW-UHFFFAOYSA-N 385.556 2.563 0 50 GFAA C[C@@H]1CCC(=O)N1c1cccc(NC(=O)N2CCN(c3ccccn3)CC2)c1 299762633 VNBNRGFSPUSGQB-MRXNPFEDSA-N 379.464 2.951 0 50 GFAA CN(C(=O)NCCCSc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 584901941 DFQKVINBJVGLGO-ZDUSSCGKSA-N 376.931 2.651 0 50 GFAA O=C(NC[C@@H](c1ccccn1)N1CCOCC1)NC12CC3CC(CC(C3)C1)C2 952983721 QQUMUHKELDCGLW-BUMILGAPSA-N 384.524 2.723 0 50 GFAA O=C(Nc1cccc(CN2CCCC2)c1)[C@H]1CC(=O)N(Cc2cccnc2)C1 952972172 WMKCKPDCHFLOPT-IBGZPJMESA-N 378.476 2.665 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CCOC[C@@H]3C(=O)O)ccc21 268986351 PZZKQFMZANKBLF-CYBMUJFWSA-N 385.342 2.562 0 50 GFAA CNC(=O)C1CN(C(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)C1 186189620 LQZUBOLFZRKBEJ-UHFFFAOYSA-N 396.834 2.875 0 50 GFAA C[C@H](NC(=O)CN1CCSC[C@@H]1C(=O)OC(C)(C)C)c1ccc(F)cc1 170598099 RKEFOGGRFSFQAZ-XJKSGUPXSA-N 382.501 2.762 0 50 GFAA COC(=O)c1cccn2cc(COC(=O)c3cc(Cl)c4c(c3)OCO4)nc12 170653148 NNNJOYITPAZQMV-UHFFFAOYSA-N 388.763 2.860 0 50 GFAA Cn1cnnc1-c1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1 194145177 OIMKAGVJLQXSQU-UHFFFAOYSA-N 397.460 2.558 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N2CC[C@H](N(C)C)C2)cc1 1704306037 UNTVDPJTMMBMTL-INIZCTEOSA-N 384.480 2.727 0 50 GFAA COC(=O)[C@@H]1CCCCN1C(=O)c1cc(COc2ccc(C)cc2OC)on1 11813325 NROHDHTZYYUTRX-INIZCTEOSA-N 388.420 2.738 0 50 GFAA Cc1cccnc1CN(C)C(=O)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 11821593 BMJPMMDQCMZIMU-GOSISDBHSA-N 383.467 2.969 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NC(=O)CN2CCCC2=O)cc1 12051242 ZMAZDZZREIVGJK-SFHVURJKSA-N 380.492 2.933 0 50 GFAA COc1cccc(CN2CCC[C@H](NC(=O)Cn3cnc4ccccc43)C2)c1 12308853 NZQTXICOYBXGIJ-SFHVURJKSA-N 378.476 2.826 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2cccs2)c1 12404429 BHKQVDUHYJMPBX-CQSZACIVSA-N 389.502 2.784 0 50 GFAA COCCOC1CCN(C(=O)c2cc(COc3ccc(F)cc3F)on2)CC1 12703952 IQVSPACJTVMDRP-UHFFFAOYSA-N 396.390 2.799 0 50 GFAA CCN1CCN(C(=O)[C@@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1 14955331 AXFLSTBLNZEBSO-MRXNPFEDSA-N 397.441 2.608 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)c1coc(COc2cccc(F)c2)n1 15078087 QCOBIEZDOLQTBQ-INIZCTEOSA-N 376.384 2.951 0 50 GFAA Cn1c(=O)n(C)c2cc(NC(=O)C3CCN(Cc4ccccc4)CC3)ccc21 16607172 UHAGVWFXOQZISB-UHFFFAOYSA-N 378.476 2.728 0 50 GFAA Cc1nnc(SCC(=O)N2CCC[C@@H]2c2ccc(C(=O)NC3CC3)s2)o1 19147625 KCJMZJZBZGVGSX-GFCCVEGCSA-N 392.506 2.788 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccc4nonc34)C[C@@H]2CCO)cc1 19794815 NVRQJRPXXHOVTD-IBGZPJMESA-N 396.491 2.690 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ncccc3O)C1)CC2 1857667574 IZEMNZVDLKVMCZ-OAQYLSRUSA-N 382.464 2.701 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3-c3c(N4CCCC4)nn(C)c3C)c2n1 1857681839 BZKOGAFZYLNSGV-UHFFFAOYSA-N 376.468 2.841 0 50 GFAA CCc1ncnc(N2CCC3(CC2)CN(CCC(C)C)C(=O)CCO3)c1F 1857710668 JOSBKDGQFLJTQL-UHFFFAOYSA-N 378.492 2.812 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCc3cc(Cl)no3)C1)CC2 1857713683 COCFLBHFXPNDHJ-SFHVURJKSA-N 376.844 2.571 0 50 GFAA C[C@@H]1CN(C(=O)C2CCN(c3ccc(Cl)cn3)CC2)C[C@@]2(CCCOC2)O1 225470582 DLFRIYQHIZEOFU-FOIQADDNSA-N 393.915 2.748 0 50 GFAA CS(=O)(=O)c1ccc(-n2nnnc2CN2CCCC3(CCCCC3)C2)cc1 111323871 UAQHXYYBJFHSBZ-UHFFFAOYSA-N 389.525 2.612 0 50 GFAA CCc1c(C(=O)Nc2ccc3c(c2)N(C(N)=O)CC3)cnn1-c1ccccn1 428031449 KYMQVQINVLAKSX-UHFFFAOYSA-N 376.420 2.523 0 50 GFAA CCc1[nH]c(C(=O)Nc2ncc(C3CCNCC3)s2)c(C)c1C(=O)OC 261997430 FTCYOCONQFZJJY-UHFFFAOYSA-N 376.482 2.848 0 50 GFAA O=C(O)c1cnc([C@H]2CCCN2C[C@H](O)COCc2ccc(Cl)cc2)nc1 1875282896 XLJUGIGBLISNQW-DLBZAZTESA-N 391.855 2.543 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(c4ccc(F)cc4F)CC3)n[nH]c21 1875395099 LAYAJGGHRCBMGX-NEPJUHHUSA-N 376.407 2.673 0 50 GFAA CC(C)[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](CNc1ccccc1)c1ccccc1 1875344456 LEKSXEWRYBLFFQ-RBUKOAKNSA-N 389.521 2.530 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 11697641 ZOIIJXORQYIKHS-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1 1114734 INWDCDPDKJSPJQ-UHFFFAOYSA-N 376.478 2.880 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Cc2cccc(C(F)(F)F)c2)C1=O 2356168449 DUJPKMJITPJLMM-LJQANCHMSA-N 398.425 2.878 0 50 GFAA CO[C@H]1CCCN(c2ccc(C(=O)NCCCn3ccnc3C(C)C)cn2)C1 67921176 KAFIXSLIHWTRKH-SFHVURJKSA-N 385.512 2.837 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3cn(C)c4ccccc34)C2)CC1 22851380 ZBECNJKJKAAPIT-LJQANCHMSA-N 384.524 2.917 0 50 GFAA Cc1ccc(CN2CCN(C3CCN(Cc4ccccn4)CC3)C[C@@H]2CCO)o1 20449958 WQFONRGAXXMATJ-QFIPXVFZSA-N 398.551 2.516 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN2CCC[C@@H](C(=O)c3ccccn3)C2)cc1 65405841 YZUKRGFBQPPHNI-QGZVFWFLSA-N 394.475 2.598 0 50 GFAA Cc1nc(-c2cccc(C(=O)NS(=O)(=O)c3ncccc3F)c2)cs1 252478513 AOQLWMCCAQRVOQ-UHFFFAOYSA-N 377.422 2.771 0 50 GFAA COc1ccc(CN2CCC[C@H]2C(=O)NC2CC2)cc1OCc1cccnc1 121492963 KINGXZIKSLCBLG-IBGZPJMESA-N 381.476 2.912 0 50 GFAA CCc1nc([C@H]2CN(C)C[C@@H]2C(=O)N2CC(Oc3cccc(C)c3)C2)c(C)[nH]1 71750217 WWIFIXFOPZNRHP-OALUTQOASA-N 382.508 2.524 0 50 GFAA COc1ccc(CC[C@H](C)NC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)cc1 328625753 KYXNLUUWBXECSW-LZFQIVBZSA-N 384.524 2.867 0 50 GFAA Cc1nc2n(n1)CCC[C@H]2NS(=O)(=O)/C=C/c1ccccc1Br 328612476 OTVOCVFPWZBMFC-QSYFUGGGSA-N 397.298 2.774 0 50 GFAA CCCc1noc(CCCC(=O)N2CCN(c3nc4ccccc4o3)CC2)n1 172392032 YAFIFOBFTNRFRW-UHFFFAOYSA-N 383.452 2.835 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CCc3c(C)n[nH]c3C)CC2)OC1=O 72462664 BTCGKGMBJLGPQK-CQSZACIVSA-N 376.501 2.961 0 50 GFAA COc1ccccc1-c1cc(C(=O)N[C@H]2CCN(C(=O)C3CCCCC3)C2)[nH]n1 153214742 YQASPYSZZWBVNI-INIZCTEOSA-N 396.491 2.996 0 50 GFAA COC[C@@H]1CN(C(=O)c2cccc(OCc3cn4cc(C)ccc4n3)c2)CCO1 172625666 KKAICRFXEJXPOO-FQEVSTJZSA-N 395.459 2.709 0 50 GFAA C[C@H](CS(C)(=O)=O)N[C@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 368142545 PPXYERHEALFZPF-WIBUTAKZSA-N 393.480 2.600 0 50 GFAA O=C(c1ccc2c(c1)OCCO2)N1CCC[C@H]1c1nc(-c2ccccn2)no1 82121464 ATUSHYRDMGTESL-HNNXBMFYSA-N 378.388 2.880 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3nnc(-c4cccc(Cl)c4)s3)C[C@H]21 499180359 OZQQHCKLJLXJPA-KGLIPLIRSA-N 393.900 2.795 0 50 GFAA C[C@H](N)C(=O)N1CCC(Oc2cc(Cl)ccc2C(=O)N2CCCCC2)CC1 95502336 VGPCKMAKBYGJOI-AWEZNQCLSA-N 393.915 2.683 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)CSCCN3CCCC3)C2)c1 95367988 GDKDDYDCCWMEEG-GOSISDBHSA-N 376.522 2.920 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCC[C@@]4(CCCN(C)C4=O)[C@@H]3C)c2)no1 1940197074 PZCDFOOZQTUGEF-QKKBWIMNSA-N 382.464 2.908 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2cccs2)C1)c1cnc(-c2ccccn2)nc1 828199588 JWVCWFMWLKKEHU-MRXNPFEDSA-N 379.489 2.995 0 50 GFAA O=C(NCCCSCc1ccco1)N1CCC[C@H](c2cc(O)ncn2)C1 670433926 PCYGENLMQMBWPW-AWEZNQCLSA-N 376.482 2.988 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)N1CCO[C@H](c2ccccc2)C1 952990351 YFXKBMPSOYWKDV-IBGZPJMESA-N 383.473 2.943 0 50 GFAA Cc1cc(CCC(=O)N(CC(=O)O)C[C@H]2CCCO2)ccc1Br 170592060 UISGMKWCTKRWHA-CQSZACIVSA-N 384.270 2.782 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CC[C@@H](Nc4ccccc4)C3)ccc2N1 170690006 BVCPKBAZXVEIJA-QGZVFWFLSA-N 385.489 2.837 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)[C@@H]3COCCO3)cc2C(F)(F)F)C[C@@H](C)O1 170620832 YSEZLZFSBGFKMJ-HSMVNMDESA-N 388.386 2.673 0 50 GFAA O=C1NCC2(CCN(C[C@@H](O)Cn3c4ccccc4c4ccccc43)CC2)O1 782003768 HXFDSHCSICRONE-MRXNPFEDSA-N 379.460 2.730 0 50 GFAA O=C(c1nnc2n1CCCCC2)N1C[C@H]2CCC[C@](O)(c3ccccc3)[C@H]2C1 1704335312 CZOZDQHQOXCRRL-NRJQMVOHSA-N 380.492 2.764 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCCN(CC(=O)N(C)c2ccccc2)CC1 1772702364 RKIDUZNYTNMNCS-LJQANCHMSA-N 395.503 2.651 0 50 GFAA COc1ccc(C(=O)N2C[C@H](O)[C@@H](N(C)Cc3cccc(SC)c3)C2)cc1 11838278 BGHOMGCMGJBKIW-PMACEKPBSA-N 386.517 2.734 0 50 GFAA CC(C)N1CCNC(=O)[C@@H]1CC(=O)N(CCc1ccccc1)Cc1ccccc1 12075642 BORJYPJJAFGWRY-QFIPXVFZSA-N 393.531 2.857 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(C(=O)c3ccncc3)CC2)O1)C1CCCCC1 12156306 XGHPKHDXCDMDSV-IBGZPJMESA-N 385.508 2.932 0 50 GFAA Cc1c(CC(=O)N2CCSCC2)c2c(n1C[C@H]1CCCO1)CCCC2=O 12591411 WAFWXIHWLPCOES-OAHLLOKOSA-N 376.522 2.612 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2F)CN(C(=O)c2ccccn2)CC1=O 14741501 XYEUNLKXQHGHSC-SFHVURJKSA-N 399.466 2.747 0 50 GFAA CCCNC(=O)C1CCN(S(=O)(=O)c2cc(C(C)C)ccc2OC)CC1 16579501 ZPKCHFMNVRZRJC-UHFFFAOYSA-N 382.526 2.746 0 50 GFAA O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cnn(Cc2ccc(Cl)c(Cl)c2)c1 169619976 ORQFGHOGKYZHFZ-FPCVCCKLSA-N 392.242 2.905 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)c4cccc(F)c4)nnc23)n1 169776116 NZBBJLYZYAUEMY-UHFFFAOYSA-N 380.383 2.972 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)/C=C/c4ccco4)nnc23)n1 169781024 QINKIWHUXWAXHS-BQYQJAHWSA-N 378.392 2.825 0 50 GFAA COc1ccc(CN2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cc1C(=O)O 1857672978 CAIKPGNNVDYGNC-JOCHJYFZSA-N 396.443 2.643 0 50 GFAA CCc1ccc(CN2[C@H]3CC[C@@H]2[C@](CC)(C(=O)NCCc2cnn[nH]2)C3)s1 1857718210 CSXZFMSJKBUWDW-QKYXUNIQSA-N 387.553 2.921 0 50 GFAA COC(=O)[C@H]1C[C@H](NC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)C1 1857719844 VRPKWLMMIIEXCN-YRGRVCCFSA-N 391.855 2.765 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CCc3cccnc3)C[C@]23CC[C@H]1O3)c1ccccc1 1857720455 VJXPWYAVAHXKOY-ZZLPTCMGSA-N 377.488 2.534 0 50 GFAA O=C(NCCN1CCCC1)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857732158 FFQDUYYWQFFXLD-AWEZNQCLSA-N 376.888 2.910 0 50 GFAA CCOc1ccccc1C(=O)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857732958 OXCVKWCOIMMPSQ-UNMCSNQZSA-N 387.451 2.653 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N4CCc5nocc5C4)CC3=O)sc2c1 1857735576 FOVCFQOOLWBWEQ-LBPRGKRZSA-N 382.445 2.531 0 50 GFAA c1ccc(-c2nc([C@H]3CC[C@H]4OCCN[C@@H]4C3)n(CCc3cnc[nH]3)n2)cc1 1857736026 MSPPEIJSVXQFQK-QXAKKESOSA-N 378.480 2.535 0 50 GFAA CN(C)CCn1ncc(C(=O)NCC2(O)CCCCCC2)c1-c1ccccc1 225474396 OKDCRTPPEGMZMH-UHFFFAOYSA-N 384.524 2.927 0 50 GFAA CCOc1ccc(C)cc1S(=O)(=O)N1CCN(c2ccccc2OC)CC1 12420604 PXLGMHIFVOCWQE-UHFFFAOYSA-N 390.505 2.913 0 50 GFAA COc1ccccc1N1CCC(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CC1 138733422 WPTWUPLMPHEQLG-INIZCTEOSA-N 385.508 2.571 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1C[C@@H]2C[C@H](C(=O)O)C[C@@H]21 907945252 STZDAKVSKPZEJH-XPBAASLYSA-N 387.402 2.781 0 50 GFAA CC(C)Cn1nnc2c1C[C@H](c1nc(-c3ccc4c(O)ncnc4c3)no1)CC2 952893224 IGBYVPRQHHKVPO-CYBMUJFWSA-N 391.435 2.905 0 50 GFAA CC(=O)NCc1cc(O[C@H]2CCN(C[C@@H]3CCc4ccccc4C3)C2)ccn1 886072106 RNBZODMIMFOBCU-JPYJTQIMSA-N 379.504 2.976 0 50 GFAA COCCc1nsc(N[C@@H]2CN(C(=O)CC3CCC3)C[C@H]2C(F)(F)F)n1 1775991061 DEFWPHHVFXINOO-VXGBXAGGSA-N 392.447 2.718 0 50 GFAA Cc1c(NC(=S)NC(=O)c2ccccc2F)c(=O)n(-c2ccccc2)n1C 1112475 VROHRLURJZESJA-UHFFFAOYSA-N 384.436 2.750 0 50 GFAA Cc1ncc(C(=O)N2C[C@H]3[C@@H](CN(C)C)[C@@H]4CC[C@@]3(C2)O4)c(-c2ccccc2)n1 2356150936 IZNJYMCEFHZSMK-NVJIOZQYSA-N 392.503 2.633 0 50 GFAA COCCC[C@@]1(CO)CN(Cc2cc(Cl)cc(Cl)c2OC)CC[C@H]1O 2356167721 ZQBFAUHNIYYGAH-AEFFLSMTSA-N 392.323 2.974 0 50 GFAA CN(C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1)C1CCCCC1 55042046 ZCBVTMKIQDBSMZ-GOSISDBHSA-N 395.906 2.961 0 50 GFAA Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1)C2=O 247693661 SXBRAVPNPXGHLK-LZLYRXPVSA-N 394.471 2.650 0 50 GFAA O=C(NCc1cccnc1-n1cnc2ccccc21)c1cc(Cl)c[nH]c1=O 67840998 PDWVMSPYJUAFMI-UHFFFAOYSA-N 379.807 2.692 0 50 GFAA Cc1cc(C(F)(F)F)cc(N(C)CCn2cc(C(=O)N3CCCCC3)nn2)n1 67850428 OJLURZOSUDSYGZ-UHFFFAOYSA-N 396.417 2.763 0 50 GFAA CC(C)CN1C[C@H](OCc2ccncc2)CN(Cc2ccc(O)cc2)CC1=O 20856177 RPJOKTVVMITWNO-OAQYLSRUSA-N 383.492 2.673 0 50 GFAA Cc1ncc2c(c1-c1noc(CC3CCOCC3)n1)CCN(c1ncccn1)C2 20166607 DKTIUJFPTZROGO-UHFFFAOYSA-N 392.463 2.762 0 50 GFAA COc1ccc(-c2nc3ncc4c(=O)n(Cc5ccccn5)ccc4n3n2)cc1 20102157 AFCJXCFDCOLSHT-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA Cc1nc(C[C@@H]2CCCN(CC(=O)Nc3ccc(N4CCCCC4)nc3)C2)no1 171404895 XYGZOWLCJMNNSC-KRWDZBQOSA-N 398.511 2.657 0 50 GFAA CS(=O)(=O)N1CCC(NC[C@H](c2ccccc2)N2CCCCCC2)CC1 67785641 OJDCVOUJGCTAED-HXUWFJFHSA-N 379.570 2.617 0 50 GFAA Cc1noc(C)c1CO[C@@H]1CCOC[C@H]1NC(=O)c1ccc2c(c1)CCCO2 218834942 VTAQHAKAOUQONB-UYAOXDASSA-N 386.448 2.721 0 50 GFAA Cn1c([C@H]2CCCN2Cc2nc3ccccc3c(=O)n2C)nc2c1CCCC2 328631568 KQLTVIODLQTPSP-LJQANCHMSA-N 377.492 2.883 0 50 GFAA COc1ccc([C@H](CO)N(C)C[C@]23C[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1 253426023 XMBYMXNNXLCEBH-MDKPJZGXSA-N 376.497 2.917 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@H](C(=O)NCCc4cccs4)C3)nn12 32093377 DKSHKHJWLJXVDO-HNNXBMFYSA-N 398.536 2.885 0 50 GFAA CC[C@@H]1CN(C(=O)CCn2cc(Cl)cn2)CCC(=O)N1Cc1ccccc1 71751166 YJMYJZFKFOSGHJ-GOSISDBHSA-N 388.899 2.966 0 50 GFAA O=C([C@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1)N1CCCOCC1 71753929 TZSVHJMSOQHEBE-QFIPXVFZSA-N 399.579 2.654 0 50 GFAA CCc1nc(N)sc1C(=O)N1CCC(=O)N(Cc2ccccc2)[C@H](CC)C1 71745433 CWCDSAQHAURKPZ-OAHLLOKOSA-N 386.521 2.941 0 50 GFAA Cc1cn([C@H](C)c2ccccc2)nc1NC(=O)NCC1CCN(CCO)CC1 241409083 NELHJLOFWZIUAQ-QGZVFWFLSA-N 385.512 2.627 0 50 GFAA CC(C)CNC(=O)CN1CCC[C@@]2(CCC(=O)N(CCc3ccccc3)C2)C1 77378349 JPZUHNFHGBHRNX-HSZRJFAPSA-N 385.552 2.706 0 50 GFAA N[C@@H]1CCCN(C(=O)/C=C/c2ccc(-n3cc(Br)cn3)c(F)c2)C1 157772508 HZINQVIYPSTXDH-YVARQFDVSA-N 393.260 2.737 0 50 GFAA COc1ccc(-c2ncc(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)s2)cc1 173352429 OSONCMHGOYRHIM-GFCCVEGCSA-N 399.394 2.712 0 50 GFAA Cc1c(NC(=O)N[C@H]2c3ccccc3O[C@H]2C)cccc1S(=O)(=O)N(C)C 455968903 QPWZSCMWUOSVQA-SCLBCKFNSA-N 389.477 2.889 0 50 GFAA NC(=O)c1cc(NC[C@@H](c2ccc(C(F)(F)F)cc2)N2CCOCC2)ccn1 132008870 YNEWEZUJKKYECL-KRWDZBQOSA-N 394.397 2.685 0 50 GFAA COc1ccccc1-n1cc(C(=O)NCc2noc(-c3ccccc3)n2)cn1 92078248 LZHOYMYSNVTXGN-UHFFFAOYSA-N 375.388 2.861 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Nc1cc(Cl)ccc1Cl 239248020 XWOIEBCMEHRJBZ-FDJUTITPSA-N 391.254 2.985 0 50 GFAA Cc1cccnc1N1CCN(C(=O)Nc2cc(-c3ccccn3)nn2C)CC1 96150534 WDGAHHPDGZZPIN-UHFFFAOYSA-N 377.452 2.540 0 50 GFAA O=c1oc2ccccc2n1Cc1cn([C@@H]2CCN(Cc3ccccc3)C2)nn1 91382006 KZHZMVVUVACSPB-GOSISDBHSA-N 375.432 2.681 0 50 GFAA COCCNC(=O)c1ccc(NC(=O)NCc2ccc3c(c2)CCCO3)cc1 96133288 WEFFRWDWKGHWLZ-UHFFFAOYSA-N 383.448 2.710 0 50 GFAA CCCCn1nc(COc2ccccc2)nc1[C@@H]1CCCN1S(C)(=O)=O 96153122 BGCGCZZNFKPVPH-INIZCTEOSA-N 378.498 2.754 0 50 GFAA Cc1ncsc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 95353284 PCWVMWIYBDGAAA-UHFFFAOYSA-N 398.532 2.934 0 50 GFAA Cc1cc(N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)nc(N(C)C)n1 91304454 NSWUCLAQXVITSF-UHFFFAOYSA-N 394.523 2.655 0 50 GFAA O=C(NCc1noc(-c2ccccc2)n1)c1cnc(-c2cccs2)nc1O 91689991 WZSPBHDYWSKIAJ-UHFFFAOYSA-N 379.401 2.891 0 50 GFAA COCCN1C(=O)[C@@H]2[C@@H](C(=O)C(C)(C)C)N3c4ccccc4C(C)=C[C@H]3[C@@H]2C1=O 245310702 KBFDNAPGBWEVPX-VJANTYMQSA-N 396.487 2.524 0 50 GFAA O=C(NC[C@@H]1CCCN1)c1cccn(Cc2c(Cl)cccc2Cl)c1=O 244900277 ZZDUJGOFICTONM-LBPRGKRZSA-N 380.275 2.685 0 50 GFAA O=C(NCC1(c2cccs2)CCCCC1)N1CCOC[C@H]1c1nc[nH]n1 297207853 LDPMGZCEQKMGNK-AWEZNQCLSA-N 375.498 2.851 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1cnn2c1CCCC2 183043029 QXGPTMRQIVOPNP-HNNXBMFYSA-N 376.819 2.547 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263616057 GTAZWUOOENTANU-OAHLLOKOSA-N 379.464 2.734 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)C[C@@H]2NC(=O)c3ccccc32)cc1 67833853 IATGOVHCLAGJEB-SFHVURJKSA-N 376.416 2.576 0 50 GFAA COc1ccc2cc(C(=O)Nc3nc(-c4ccco4)n[nH]3)sc(=O)c2c1OC 824519534 YAVBVXWMKZJNER-UHFFFAOYSA-N 398.400 2.909 0 50 GFAA CCc1cc(N2CCN(Cc3ccc(OC)c(Cn4cccn4)c3)CC2)ncn1 824722745 IIQSZEOPCZXZJR-UHFFFAOYSA-N 392.507 2.615 0 50 GFAA O=S(=O)(N[C@H]1CCCN(Cc2cccs2)C1)c1ccc2oc(O)nc2c1 828414756 FRBDKQKTBFIQJG-LBPRGKRZSA-N 393.490 2.538 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCC[C@H]2CN)CC1 1342087101 KHAJGGRXABCUES-GHTZIAJQSA-N 396.535 2.583 0 50 GFAA Clc1cc2c(cc1CNC13C[C@@H]4C[C@H](C1)CC(n1ncnn1)(C4)C3)OCO2 952873711 YRRSKSUGDQLKAN-NFAYLAGKSA-N 387.871 2.893 0 50 GFAA CCOc1ccc(C(=O)NCC2CCN(C(=O)Cc3ccccn3)CC2)cc1 952966093 GVTJWEZTEMMTEA-UHFFFAOYSA-N 381.476 2.691 0 50 GFAA C[C@H](NC(=O)NC1(CN2CCCC2)CCCCC1)[C@H](O)c1ccc(O)cc1 1565530632 BVGZUENHHSBGJH-LPHOPBHVSA-N 375.513 2.912 0 50 GFAA CCCC(C)(C)NC(=O)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1 408518850 FKRICQFCOTXIMV-UHFFFAOYSA-N 392.519 2.990 0 50 GFAA NC(=O)NC1CCN(C(=O)c2cccc(-n3nccc3-c3ccccc3)c2)CC1 170651378 MIUYIRIFRRHESE-UHFFFAOYSA-N 389.459 2.812 0 50 GFAA COCCOc1ccc(N[C@H]2CCCN(c3cnn(C)c3)C2=O)cc1Cl 170644332 MHIAJFZSENTYQG-INIZCTEOSA-N 378.860 2.706 0 50 GFAA C[C@@H]1C[C@H]1c1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)o1 170641636 LMDMHIBCJIJPFA-MWLCHTKSSA-N 396.852 2.866 0 50 GFAA COc1cccc(CN(CCN(C)C)C(=O)c2cc(-c3cccnc3)on2)c1 170611651 JEJSYNZWFZFAEG-UHFFFAOYSA-N 380.448 2.949 0 50 GFAA Cc1occc1C(=O)NC1CCN(CC(=O)N2c3ccccc3C[C@@H]2C)CC1 170777855 VKBIWBNLCBFXHE-HNNXBMFYSA-N 381.476 2.760 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)NC1CCN(c2ncccn2)CC1 170703802 JRIHAKFOHRDIST-UHFFFAOYSA-N 383.477 2.829 0 50 GFAA O=C(NCc1ccccc1)C1CCN(C(=O)c2nc3cccnc3s2)CC1 193862097 PXMHCVYFTWXLLQ-UHFFFAOYSA-N 380.473 2.860 0 50 GFAA O=C(C1CC1)N1CCC(N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)CC1 1704340004 BHLGKLMSUMPYMK-XMSQKQJNSA-N 379.504 2.783 0 50 GFAA O=C(NC[C@@H]1CCCN(S(=O)(=O)/C=C/c2ccccc2)C1)c1cccnc1 11813630 IQYSSJUMKREQJC-HGZMWJMZSA-N 385.489 2.524 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)N[C@@H](CO)C(C)C)no3)ccc2s1 12001461 SVGFCULBQWXFNF-INIZCTEOSA-N 375.450 2.918 0 50 GFAA O=C(CCC1CCN(C(=O)c2cccc(N3CCCC3=O)c2)CC1)NC1CC1 12075283 WNRZIBDEKPTNAV-UHFFFAOYSA-N 383.492 2.724 0 50 GFAA CN(Cc1ccco1)C(=O)c1nn(C)c2c1C[C@@H](NCc1ccccc1)CC2 14741569 DCLHEIADKKUVQF-KRWDZBQOSA-N 378.476 2.932 0 50 GFAA COCCN1C(=O)N(C(C)C)C(=O)C12CCN(Cc1c[nH]c3ccccc13)CC2 14748898 SGVIMZPUIBVAKK-UHFFFAOYSA-N 398.507 2.822 0 50 GFAA COCCNC(=O)CCC1CCN(Cc2cnn(-c3ccccc3F)c2)CC1 14962408 RXBDDQGQQHVLTL-UHFFFAOYSA-N 388.487 2.766 0 50 GFAA Cc1cc(OCc2cc(C(=O)N3CCC[C@H]3C(N)=O)no2)cc(C)c1Cl 15065354 MKBLZDLRQUGGOD-HNNXBMFYSA-N 377.828 2.614 0 50 GFAA CN(Cc1ccccn1)c1ccc(C(=O)N2CCC[C@@H](Cn3ccnc3)C2)cn1 19148356 WQBSWKSWHFRLBN-SFHVURJKSA-N 390.491 2.862 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)c(OC)c1OC 19552780 MAHYYDSQWHFUQH-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA O=C(C1CCC1)N1CCC[C@@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169777628 PIEFRUHBNWONJG-MRXNPFEDSA-N 378.436 2.959 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCc1noc(C2CCC2)n1 1857667696 OVGJAZLGCYERDB-ZDUSSCGKSA-N 396.451 2.796 0 50 GFAA CCOC(=O)N1CC[C@@H](NCc2nc(-c3ccc(OC)c(O)c3)oc2C)C1 1857685749 RRYULLIZTRCRGW-CQSZACIVSA-N 375.425 2.685 0 50 GFAA Nc1nccc(N2CCC[C@@H](OC(=O)c3cc(Br)ccc3F)C2)n1 225743074 IMCKGUWPQCMMIL-LLVKDONJSA-N 395.232 2.786 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC[C@@H](N)C2)cc1OC 237396294 STXYKTQOQUDJAI-MRXNPFEDSA-N 392.459 2.730 0 50 GFAA O=C(NCc1nc(-c2ccccc2)cs1)[C@@H]1CC(=O)N(c2nccs2)C1 362850195 GVCMOOOVHMUIKS-CYBMUJFWSA-N 384.486 2.936 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCO[C@H](c2cccc(Br)c2)C1 368826659 WTWCNIGZKICLPJ-HNNXBMFYSA-N 387.237 2.934 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)c3ccc(C(N)=O)c(Cl)c3)cn2)C[C@@H](C)O1 1875280438 JMBYYZHXAZHMKC-TXEJJXNPSA-N 388.855 2.700 0 50 GFAA Cc1ccc(CC(=O)N=[S@](C)(=O)CC2CN(C(=O)c3ccccc3)C2)cc1 1875302369 MUZFMNPPRHJMPM-HHHXNRCGSA-N 384.501 2.934 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2c(C)[nH]c3ccccc23)N(c2cc(C)ncn2)C1 1875392056 AVEGUQDRDHCMGS-HOTGVXAUSA-N 379.464 2.598 0 50 GFAA CCSCCN1CCCNC(=O)CC[C@@H](c2ccccc2)CCNC(=O)C1 2100533412 NZJIXWPZPQCUFJ-LJQANCHMSA-N 391.581 2.632 0 50 GFAA Cc1nsc(NC(=O)N[C@H](C(N)=O)[C@H](C)c2ccccc2)c1Br 2325804039 RBSHCVPXFCXGTD-PELKAZGASA-N 397.298 2.993 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1 931379219 GTCCLFLSIRFRIK-GOSISDBHSA-N 388.512 2.591 0 50 GFAA COCCCN1C(=O)c2ccc(C(=O)O[C@H](C)C(=O)c3ccccc3)cc2C1=O 1941483 RJAKKNKTCOGUSO-CQSZACIVSA-N 395.411 2.747 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2ccc(-n3ccnc3)cc2)CC[C@@H]1O 2356136258 MNHHJQYXJXJYOT-GHTZIAJQSA-N 385.464 2.586 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@@]12CCCN2Cc1ccc2c(c1)OCO2 2356142003 ZLGJYLUCHLDKJG-SPEDKVCISA-N 386.492 2.676 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cnc4cccnn34)C2=O)cc1 2356147394 UISCEFYZXCWAHF-QFIPXVFZSA-N 389.459 2.840 0 50 GFAA O=C(CCc1ccccc1)N[C@@]1(C(F)(F)F)NC(c2ccccc2)=NC1=O 2872236 KVKRMMVFHDMNCU-GOSISDBHSA-N 375.350 2.571 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H](Cn3ccnc3)C2)cc1NC(=O)[C@H]1CCCO1 20821569 FHFUDHFEPARDCZ-YLJYHZDGSA-N 396.491 2.861 0 50 GFAA O=C1Nc2ccccc2/C1=C1\NC(=S)N(c2nc3ccccc3s2)C1=O 100888286 AFKZBCLUMCIVCG-BUHFOSPRSA-N 378.438 2.881 0 50 GFAA CCCn1ncc(CN2CCN(Cc3cccc(OC)c3)[C@@H](CCO)C2)c1C 23145331 HQIADAZSCQKMEW-NRFANRHFSA-N 386.540 2.679 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3nc4c(s3)C[C@@H](C)CC4)CC(=O)N2C)cnn1C 328640149 XFIJWVDOSHEPAO-TVSHIAKJSA-N 387.553 2.619 0 50 GFAA COC(=O)c1ccccc1NC(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20220931 WLRBSLXKJNOUCU-UHFFFAOYSA-N 397.431 2.552 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(NC[C@@H](c2cnn(C)c2)N(C)C)ncn1 328656175 ZBSBWGQCMVECCR-ZWOKBUDYSA-N 387.532 2.540 0 50 GFAA C[C@@H](C1CCN(Cc2cc3c(cc2Cl)OCO3)CC1)N1CCN(C)CC1 65387790 PYWWAYAXEGRYJV-HNNXBMFYSA-N 379.932 2.917 0 50 GFAA Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)NCCN1CCN(C)CC1 252490552 KWVGUOHTDIWFKT-UHFFFAOYSA-N 396.413 2.646 0 50 GFAA O=C(c1coc(COc2ccccc2)n1)N1CCC(O)(c2ccccn2)CC1 71278750 ZRBLQIPINOMXRP-UHFFFAOYSA-N 379.416 2.772 0 50 GFAA COc1ccc(Cl)cc1CN(Cc1cn2c(n1)CCCC2)S(C)(=O)=O 328626555 LVQDZVFFXIZHBM-UHFFFAOYSA-N 383.901 2.843 0 50 GFAA Cc1coc(-c2cccc(NC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)c2)n1 154553434 UAEDSKHLBAWJNE-UHFFFAOYSA-N 390.399 2.954 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1CCN(c2cccc(Cl)c2)C1 364212991 NMDWOVYZTOSRNR-KRWDZBQOSA-N 396.882 2.999 0 50 GFAA COC(=O)c1ccc(Cn2nc(-c3ccc(OC)c(OC)c3)ccc2=O)cc1 38790910 VMEGITNCCPVKCC-UHFFFAOYSA-N 380.400 2.762 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)COc3ccccc3O)CC2)OC1=O 77379681 RFTJBCUKPFSNQM-OAHLLOKOSA-N 376.453 2.773 0 50 GFAA CN(Cc1cc2n(n1)CCN(c1ccncc1)C2)Cc1noc2c1CCCC2 72474053 DCEBAFOSPTXVOI-UHFFFAOYSA-N 378.480 2.797 0 50 GFAA Cc1ccc(CN(C(=O)C[C@@H]2C(=O)NCCN2Cc2ccoc2)C(C)C)cc1 72174537 OPVQGLVPCOLJJS-HXUWFJFHSA-N 383.492 2.716 0 50 GFAA C[C@H](NC(=O)c1cn2cc(-c3ccc(F)cc3)n(C)c(=O)c2n1)c1ccco1 72426668 SQBOKWCUUOPFHY-LBPRGKRZSA-N 380.379 2.923 0 50 GFAA Cc1ccc(N2CCC[C@H](NC(=O)c3ccccc3Cn3cncn3)C2=O)cc1 174040502 QOMAMOUVKRSMQZ-FQEVSTJZSA-N 389.459 2.560 0 50 GFAA Cc1ccc(-c2cn(C3CCN(C(=O)c4cn5cccnc5n4)CC3)nn2)cc1 48159291 MTFFOFNEIYTAGQ-UHFFFAOYSA-N 387.447 2.774 0 50 GFAA CN(CC(=O)N1CCc2sccc2C1)C1CCN(CCc2ccccn2)CC1 177255403 UYUXIIXAXLYMJW-UHFFFAOYSA-N 398.576 2.667 0 50 GFAA Cc1ccc(N2CC[C@H](CNC(=O)C3CCN(C4CCOCC4)CC3)C2)cc1 426379599 BPWVKCUTUNKZIG-LJQANCHMSA-N 385.552 2.829 0 50 GFAA O=C(NC[C@@H](c1ccccc1)N1CCCCC1)N1CCC(n2cnnc2)CC1 426662516 VLWYEQLKYOGXEA-FQEVSTJZSA-N 382.512 2.852 0 50 GFAA COCC1(C(=O)N2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)CC1 426395129 GBZLXVBFHWHYAR-FQEVSTJZSA-N 392.446 2.733 0 50 GFAA C=CC(=O)Nc1cc(NC(=O)Cn2c(=O)n(CC)c3ccccc32)ccc1F 176731900 ACXVAGJFAUYLNS-UHFFFAOYSA-N 382.395 2.725 0 50 GFAA Cc1cc(N2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)nc(-c2ccccc2)n1 230177570 XOTCTEYICPAYRZ-JOCHJYFZSA-N 379.508 2.585 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)C[C@H](O)c3cccc(F)c3)CC2)cc1 179790950 AAFVHBWSTIEVQQ-FQEVSTJZSA-N 384.451 2.979 0 50 GFAA CCc1nn(C)cc1CN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1 179759158 WWWYXMKUBZZHGP-INIZCTEOSA-N 380.496 2.911 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c1 92020342 NKPRJXLADORBQM-QFIPXVFZSA-N 380.492 2.806 0 50 GFAA O=C(O)c1ccc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)nc1 95356357 MJGWZJJCPJHGFD-UHFFFAOYSA-N 394.475 2.627 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)N(C)CC 91390913 ZEECIHBFXJRBBE-IBGZPJMESA-N 386.540 2.543 0 50 GFAA COc1ccccc1Cn1nccc1NC(=O)N1CCC[C@@H]1Cn1cccn1 299774329 HBAXQEDWVGUMOS-QGZVFWFLSA-N 380.452 2.833 0 50 GFAA O=C([C@@H]1COc2ccccc2O1)N1CCC(N2CCc3ccccc3C2)CC1 299303547 AFWUTBDJVVJBIX-QFIPXVFZSA-N 378.472 2.876 0 50 GFAA Cc1cc(CN2CCC(CNC(=O)c3cnc(N(C)C)nc3C)CC2)oc1C 823742105 VEWAYYKFVGLPME-UHFFFAOYSA-N 385.512 2.703 0 50 GFAA CNC(=O)C[C@H](C)N(C)C(=O)c1cccc(-c2cc(C)c(C(=O)O)c(C)n2)c1 584897736 OGUJTUBUZHQTHL-ZDUSSCGKSA-N 383.448 2.660 0 50 GFAA Cc1cc2nc(CN(C)C(=O)NCc3ccc(C(=O)N(C)C)o3)[nH]c2cc1C 584884283 IRHVGYPTOWVIQZ-UHFFFAOYSA-N 383.452 2.816 0 50 GFAA COC(=O)c1ccc(-c2cccc(C(=O)NC[C@@]3(C)CCCO3)c2)c(CO)c1 584904211 XTCOBZHGXZRUNU-JOCHJYFZSA-N 383.444 2.931 0 50 GFAA CCc1nccn1CCC(=O)N1C[C@@H]2CC[C@H]1CN(Cc1c(C)noc1C)C2 1565525743 KMDPTGOMSRFHIJ-MSOLQXFVSA-N 385.512 2.563 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 269921024 JBIBAKWYLJHICK-RLLQIKCJSA-N 399.491 2.767 0 50 GFAA NC(=O)c1cc([C@@H]2CCCN(C(=O)c3ccnc(OC4CCCCC4)c3)C2)n[nH]1 271847494 VLGNSWUOIPGGHO-OAHLLOKOSA-N 397.479 2.635 0 50 GFAA CC[C@H](C)[C@H](C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276621537 WQLKTVJEPOBBHA-CDXJDZJCSA-N 381.524 2.921 0 50 GFAA CC[C@@]1(C)NC(=O)N(NC(=O)[C@H](C)Sc2nc3ccccc3s2)C1=O 278629056 GIAXHKDCTLPHBD-XXFAHNHDSA-N 378.479 2.529 0 50 GFAA CNS(=O)(=O)c1ccc(NC(=O)NC2(c3ccc(Cl)cc3)CCC2)nc1 190634403 LBNMUGYDCDOIJH-UHFFFAOYSA-N 394.884 2.844 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCC[C@@H](C4(O)CC4)C3)c2)o1 1772813916 AZPOOPLXLUZXMO-MRXNPFEDSA-N 376.478 2.884 0 50 GFAA Cc1c(CC(=O)NCCc2ccco2)c2c(n1C[C@@H]1CCCO1)CCCC2=O 11841309 UGGUSEDWJPDCHJ-KRWDZBQOSA-N 384.476 2.989 0 50 GFAA COCCNC(=O)c1cccc(NC(=S)NC(=O)c2ccccc2Cl)c1 12138828 OWMBSMJGXGWBCE-UHFFFAOYSA-N 391.880 2.843 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1CC1CCCCC1)NCc1cccc2[nH]ccc12 19792383 QRXVOJAEFHWHKY-FQEVSTJZSA-N 382.508 2.555 0 50 GFAA O=C(NCCc1cccs1)c1cc2n(n1)C[C@H](c1ccc3c(c1)OCO3)OC2 169759889 WXANNKWNVYPWNZ-LJQANCHMSA-N 397.456 2.917 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1 155008013 PFASVGDQUVFJEJ-AWEZNQCLSA-N 388.468 2.646 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)CCc3nc4ccccc4s3)C[C@]23CC[C@H]1O3 1857699652 XQBSXWZQMZDLBL-GYQJYAJYSA-N 385.533 2.797 0 50 GFAA CCc1noc(CNC(=O)C[C@@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)n1 1857701527 MOWXPBWASOTLFV-ZDUSSCGKSA-N 399.451 2.705 0 50 GFAA CC(C)(CO)NC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)C1CCC1 1857711353 VIQOSEJDRHPYDU-YCRNBWNJSA-N 384.520 2.666 0 50 GFAA CCc1ccccc1C(=O)NC[C@H]1[C@H]2CN(C(=O)C3CCC3)C[C@]23CC[C@H]1O3 1857724325 VLBPTKVXDOJTCL-DZCCDHAISA-N 382.504 2.785 0 50 GFAA N=c1cc(CN2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cc[nH]1 1857727374 PUYQGWOOURIMKY-JOCHJYFZSA-N 388.475 2.532 0 50 GFAA COc1cccc([C@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)c1 130853457 LKIBEOZHCJVEDB-LJQANCHMSA-N 391.493 2.769 0 50 GFAA O=C(O)[C@H]1CCCCN1C(=O)c1cnn(-c2ccc(Br)cc2)c1 136463134 IWDKEMYAYBGFKY-CQSZACIVSA-N 378.226 2.714 0 50 GFAA COc1cc2nccc(N3CC[C@H](CNC(N)=O)C3)c2cc1Br 1875266413 MQVFYMLKNTZBOQ-SNVBAGLBSA-N 379.258 2.501 0 50 GFAA Cn1ncc(C(F)(F)F)c1S(=O)(=O)N1C[C@@H](F)[C@@H](Cc2ccccc2)C1 1875396695 RFCJUUFSUYNKPD-GXTWGEPZSA-N 391.390 2.640 0 50 GFAA C[C@@H]1CN(C(=O)c2cccc3nc[nH]c23)CC[C@@H]1NC(=O)c1ncc(F)cc1F 1875338974 RWJYOVLIONYAMR-ABAIWWIYSA-N 399.401 2.517 0 50 GFAA Cc1cc(C(=O)NCC23CC(CN2C(=O)C24CC(C(C)(C)C)(C2)C4)C3)ncn1 2325794210 VBLDUAZCPPTCTH-UHFFFAOYSA-N 382.508 2.722 0 50 GFAA O=C(COc1ccc(CN2CCCc3ccccc3C2)cc1)N1CCOCC1 2356135052 NNJQCOIPJGZYAR-UHFFFAOYSA-N 380.488 2.873 0 50 GFAA CN(C)C(=O)CCC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356145142 CTSOVUFXLBYOCR-HSZRJFAPSA-N 392.503 2.818 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC[C@]12CCCN(C)C2=O 2356148519 CFQGZCIGCSYMQN-QFIPXVFZSA-N 380.492 2.645 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)N(C)Cc2cccc(O)c2)[C@H]1c1ccccc1 2356168098 PJMDOVUXLYZDNP-RTWAWAEBSA-N 382.460 2.728 0 50 GFAA O=C(c1cnc(O)c2ccccc12)N1CCc2nc(Cc3ccccc3)nn2CC1 2356168799 OBQPEIAVUVHDHI-UHFFFAOYSA-N 399.454 2.821 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987179 KGFLYLCKHGUYDY-GOEBONIOSA-N 376.363 2.567 0 50 GFAA O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@@H](CO)c1ccc(F)cc1 412719361 UZARHFPPEGMYRG-FQEVSTJZSA-N 399.510 2.620 0 50 GFAA COC(=O)[C@@H]1CCc2c(nn(CCCSC)c2I)C1 225824703 SODQYKBZFRFRSW-SECBINFHSA-N 394.278 2.519 0 50 GFAA O=C(Nc1cccnc1)C1CCN(S(=O)(=O)Cc2ccc(Cl)cc2)CC1 24608749 ORIINCVYIGUAHZ-UHFFFAOYSA-N 393.896 2.916 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 249096666 IJOVMZDPTHBCLN-RDBSUJKOSA-N 382.863 2.980 0 50 GFAA O=C(NCCN1CCCOC1=O)c1ccc([C@@H]2CCCN2CC2CC2)s1 23580945 OIQLDYFTZZTKHY-HNNXBMFYSA-N 377.510 2.867 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)[C@@H]3CCCN3C(N)=O)CC2)c1 67473400 WZCAKWNXYRVMJL-SFHVURJKSA-N 381.480 2.634 0 50 GFAA NC(=O)[C@H]1CCCCN1C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 124480423 QNDJCZNHJSVQKX-CQSZACIVSA-N 399.451 2.615 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CCN(C(C)C)[C@H](C)C3)nc2)on1 39404916 WZGOPCCYQFZWKE-MRXNPFEDSA-N 385.512 2.871 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(c3ncccn3)CC2)C1 71708073 LFTASKBVQQVBEC-HXUWFJFHSA-N 393.535 2.516 0 50 GFAA O=C1CCCc2ccc(S(=O)(=O)Nc3ccc(-c4cncnc4)cn3)cc21 378062773 VEIGCJNYVRTSTR-UHFFFAOYSA-N 380.429 2.858 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(N2CCCC2=O)ccc1F 238041478 UBIHYSRASHEMKK-GOSISDBHSA-N 382.391 2.604 0 50 GFAA C[C@H](C(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)n1c(S)nnc1-c1cccs1 239653956 BLWSQEOYKKCFLK-FPQZTECRSA-N 378.523 2.786 0 50 GFAA C[C@@]1(C(=O)N2CCN(C(=O)[C@@]3(C)CC3(Cl)Cl)CC2)CC1(Cl)Cl 17079212 ZLVDTBFMMHRPBA-TXEJJXNPSA-N 388.122 2.825 0 50 GFAA CC(C)(C)Oc1cccc(CCC(=O)N[C@H]2CCCN(c3ncccn3)C2)n1 176974418 RZYPPLDQDPOGIR-KRWDZBQOSA-N 383.496 2.767 0 50 GFAA Cn1cc(CNC(=O)c2ccc(-c3ccc(N4CCOCC4)cc3)cc2)cn1 426734147 RCWPIWPXJNGPED-UHFFFAOYSA-N 376.460 2.854 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)NCCCn4ccnn4)cc3o2)c1 95498968 PWXWRCXAKBFDCQ-UHFFFAOYSA-N 377.404 2.915 0 50 GFAA Cc1ccccc1N1CC[C@H](CNC(=O)Nc2ccc3c(c2)OCC(=O)N3)C1 97468587 DXWZHXNXBRHNMX-OAHLLOKOSA-N 380.448 2.974 0 50 GFAA CCc1ccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)nc1 91650243 MIVCYPPGPDRVJF-UHFFFAOYSA-N 379.508 2.653 0 50 GFAA COCc1nc(NCc2ccccc2-n2ccnc2C)cc([C@H]2CCOC2)n1 426388409 MONRRNRIFXRERK-KRWDZBQOSA-N 379.464 3.233 0 50 GFAA CN1CCN(C)[C@H](CNC(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)C1 96139708 AUAVVJMBHUFSQM-QGZVFWFLSA-N 378.480 2.597 0 50 GFAA COc1cc(OC)nc(N2CCC(c3nccn3Cc3ccncc3)CC2)n1 95498053 VVBPYWWBRQAGMH-UHFFFAOYSA-N 380.452 2.518 0 50 GFAA CCc1nc(C)sc1CNS(=O)(=O)c1cccc(C(=O)NC(C)C)c1 95365362 WYZJTIHDWDEAEQ-UHFFFAOYSA-N 381.523 2.631 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)Nc2cccc(-c3nnc(C)s3)c2)CC1 95507253 CHBIJLICLRKDTL-UHFFFAOYSA-N 394.522 2.514 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)N2CC3(CCOC3)C2)c1 296453499 VPIMMRCNJJUSSA-UHFFFAOYSA-N 395.525 2.588 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)NCc3cc(CC(C)C)no3)cc12 670434317 IOPFYTXJOXDOBQ-UHFFFAOYSA-N 375.450 2.914 0 50 GFAA O=C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1ccc(Br)cc1Cl 241371366 MMZZOIXMIYDAPD-AOOOYVTPSA-N 378.675 2.987 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)c1ccccc1N1CCOCC1 952974822 KLELLKJDENSGLT-UHFFFAOYSA-N 389.565 2.613 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)[C@H]1C[C@H]2C=C[C@@H]1C2 1565506676 UYCLYPZSVYYVGZ-MANSERQUSA-N 395.503 2.564 0 50 GFAA Cc1cc(C(=O)N2CC[S@](=O)C[C@H]2c2cnn(C)c2)cc(C)c1OC(F)F 277416484 HZUXOLDATNFWHT-QZXCRCNTSA-N 397.447 2.584 0 50 GFAA COC(=O)[C@H]1CC[C@@H](NC(=O)c2ccc(OCc3cn4ccccc4n3)cc2)C1 170618104 OBPNVYPIPLQQQM-DLBZAZTESA-N 393.443 2.985 0 50 GFAA CCn1cc([C@@H]2CN(C(=O)c3cnc(OCC4CC4)c(Cl)c3)CCO2)cn1 191738609 DWEACGAJPBUEAC-KRWDZBQOSA-N 390.871 2.954 0 50 GFAA CN(C)CCOc1cccc(CN(Cc2ccccn2)C(=O)[C@@H]2CCCO2)c1 11882095 CGOICQDCTUEDMP-NRFANRHFSA-N 383.492 2.730 0 50 GFAA Cn1nc(C(=O)N2CCC[C@@H](C(=O)c3cccc(C(F)(F)F)c3)C2)ccc1=O 12835799 CJOAJRXGIPQEQK-CYBMUJFWSA-N 393.365 2.534 0 50 GFAA COc1ccccc1/C=C/CN1CCNC(=O)[C@H]1CC(=O)N(C)C1CCCCC1 14970846 UQKWTAZDWXZHTH-CSNYQSHPSA-N 399.535 2.690 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@H](CNS(=O)(=O)Cc3ccccc3)C2)o1 14973394 YHNZWNBYOUYTLT-GOSISDBHSA-N 390.505 2.868 0 50 GFAA CCCN(CC1CC1)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl 15069943 FSIDJLPDLUHXOM-SFHVURJKSA-N 395.906 2.818 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3ccccc3Cl)C2)c1C 1857531343 LHHNDEUYSDAHII-MRXNPFEDSA-N 387.915 2.817 0 50 GFAA O=C1CO[C@H](COc2ccc(F)cc2)CN1C1CCN(C2CCCC2)CC1 1857680028 FGLIXUHSXHJQEV-FQEVSTJZSA-N 376.472 2.839 0 50 GFAA COc1ccc(CN(C(=O)c2ccc3c(c2)CC[C@H](N)C(=O)N3)C2CC2)cc1 912103323 SBONTZZZEXORRP-IBGZPJMESA-N 379.460 2.712 0 50 GFAA COc1ccc(C(=O)NC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)nn1 156666432 QBMJDWNOTWUPFN-UHFFFAOYSA-N 394.397 2.898 0 50 GFAA O=C(O)[C@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2Br)C1 262640041 OMJUWDLSNGGQMH-QMMMGPOBSA-N 382.663 2.588 0 50 GFAA CC(C)c1ccccc1CNC(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1 1875264180 QKSOGYGGCSBGQT-KRWDZBQOSA-N 379.526 2.520 0 50 GFAA Cn1nccc1-c1ccc(N2CCN(c3ccc(Br)cc3)CC2)nn1 1875360906 NJYJPFBVKOQXSE-UHFFFAOYSA-N 399.296 2.966 0 50 GFAA O[C@@H]1C[C@H](Cn2cccn2)C[C@H]1NCc1ccccc1-n1nnc2ccccc21 1875399774 IWFCIFUPIOIZFV-ZWDAVXSWSA-N 388.475 2.546 0 50 GFAA COc1ccc([C@H](NC(=O)[C@@H](C)Oc2ccc3c(c2)CCC3)C(=O)O)cc1O 1875322797 IMFBMTLMOIYNSY-BLVKFPJESA-N 385.416 2.599 0 50 GFAA O=C(CCc1cccc(Br)c1)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875403349 UFSQNHKQGIOEGS-DJIMGWMZSA-N 392.297 2.534 0 50 GFAA CN1CCC[C@H](CNC(=O)NCCc2nccn2C)[C@@H]1c1cccc(Cl)c1 1775996414 RSWZEBYISJFEJH-APWZRJJASA-N 389.931 2.998 0 50 GFAA COc1cccc(N2C(=O)C[C@H](N3CCN(c4ccc(Cl)cc4)CC3)C2=O)c1 705120 SGLQGOVQKOROSI-IBGZPJMESA-N 399.878 2.803 0 50 GFAA Cc1ccn(C)c1C(=O)N(C)C[C@H](C)NC(=O)[C@@H](C)OCc1ccc(F)cc1 2325793415 STXJWKOLDFBYHQ-JKSUJKDBSA-N 389.471 2.655 0 50 GFAA Cc1nsc(NC(=O)N[C@H](C(N)=O)[C@@H](C)c2ccccc2)c1Br 2325804042 RBSHCVPXFCXGTD-UFBFGSQYSA-N 397.298 2.993 0 50 GFAA COc1cc(CN)ccc1NC(=O)c1cn2c(Br)cccc2n1 2325856601 WMRLIRKYQCOINE-UHFFFAOYSA-N 375.226 2.816 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)N3CCc4ccccc4C3)C2)cc1 784604 QPNRGLIEFVASHN-FQEVSTJZSA-N 398.528 2.981 0 50 GFAA COC(=O)c1coc(CN2CCC[C@@]23CCCN(c2ccc(C)cc2)C3=O)n1 2356153012 MXSQOPLJPGDBAG-NRFANRHFSA-N 383.448 2.931 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(Cc2ccc(-n3ccnc3)cc2)CC[C@H]1O 2356154817 LIFWMLSSHHWXFK-FYYLOGMGSA-N 391.471 2.753 0 50 GFAA O=C(CCn1c(=O)oc2ccccc21)N1CCN(c2ccccc2Cl)CC1 4057743 QXJSNVAFIUZCMX-UHFFFAOYSA-N 385.851 2.987 0 50 GFAA COCCNC(=O)c1cnn2c1N[C@@H](c1ccc(OC)cc1)C[C@H]2C(F)(F)F 4952963 DKRZYGJWELFHBV-CABCVRRESA-N 398.385 2.928 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)[C@H]2C3CCC(CC3)[C@H]2C(=O)O)CC1 6715191 SLONXHAASRIKPK-ZGIUJUBFSA-N 386.492 2.871 0 50 GFAA CCNC(=O)[C@@H](C)N1C(=O)C2(CCN(C[C@H](C)CC)CC2)Nc2ccccc21 55119622 DZJZLEQTEHVITB-IAGOWNOFSA-N 386.540 2.850 0 50 GFAA C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)O[C@H]3CCCN(C)C3)c2)C1 248087492 BOOCVYNAIUOAHD-JZXOWHBKSA-N 394.537 2.604 0 50 GFAA COc1ccccc1-n1cc([C@@H]2CC(=O)NCc3nc4sccn4c32)cn1 65396989 WLARIXNTTVVGEJ-ZDUSSCGKSA-N 379.445 2.742 0 50 GFAA CC(=O)N[C@@H](C)C(=O)N1CCC[C@H](c2nc(C)ncc2-c2ccc(F)cc2)C1 12217226 QVDQYUAUDFUVPF-GUYCJALGSA-N 384.455 2.822 0 50 GFAA Cc1nn(Cc2ccc(C(=O)NC[C@H]3CCCO3)o2)c(C)c1Br 2780343 XQBXEYJBZIZXJV-GFCCVEGCSA-N 382.258 2.813 0 50 GFAA O=C(c1ccc(OC[C@H]2CCCO2)cc1)N1CCC(N2CCCCC2=O)CC1 120299179 CBHGWGUQRDKEJE-HXUWFJFHSA-N 386.492 2.862 0 50 GFAA O=C(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCC(N2CCCCC2=O)CC1 120299025 CBHGWGUQRDKEJE-FQEVSTJZSA-N 386.492 2.862 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@@H]2CC[C@H]1CN(Cc1[nH]cnc1C)C2 1073301044 AFROMZAGHXRHBY-CABCVRRESA-N 376.936 2.764 0 50 GFAA O=C(c1ccc(N[C@@H]2CCCOC2)nc1)N1CCC(Oc2cccnc2)CC1 71754346 PRHBKSDAXUGRLP-QGZVFWFLSA-N 382.464 2.751 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N[C@@H]2c3ccccc3C[C@H]2O)CC1 123565451 ZWFUSNQMHGZIRH-FGZHOGPDSA-N 379.504 2.917 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2cccs2)C1 72411611 XQNVRLRRWSTELJ-PKOBYXMFSA-N 383.517 2.768 0 50 GFAA NC(=O)c1cccnc1N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 72156916 MMTOQPLVSFDCPX-NRFANRHFSA-N 386.446 2.951 0 50 GFAA O=C1Nc2ccccc2C[C@@H]1CCC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 238026076 XGYOKSGNVWCOIR-QFBILLFUSA-N 378.428 2.616 0 50 GFAA C[C@H]1[C@H](C)CCC[C@H]1N(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(=O)n(C)n1 242273708 YFIGVMVSODHRAL-RVKKMQEKSA-N 397.475 2.976 0 50 GFAA CCCc1cc(C(=O)N2CCn3nc([C@H](O)Cc4ccccc4)cc3C2)no1 221429086 PRMYQMDYNIPVFZ-HXUWFJFHSA-N 380.448 2.756 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](CNC(=O)c3cc(N)nc(Cl)c3)C2)c1 177106630 BERQZXMUYINXKC-LBPRGKRZSA-N 390.871 2.591 0 50 GFAA CCc1nc(C)c(C(=O)N[C@@H]2COCC[C@@H]2OCc2c(C)noc2C)s1 222809662 QWFIWLWWYPVLKZ-CABCVRRESA-N 379.482 2.723 0 50 GFAA Cc1nc(CCNC(=O)Nc2ccnn2Cc2cccs2)nc2c1CCC2 96163901 BMZNNORMKKIXFK-UHFFFAOYSA-N 382.493 2.944 0 50 GFAA CCCc1nnc(N2CC[C@@H]3C[C@H](N4CCOCC4)CC[C@@]3(COC)C2)s1 95382492 TZMQPOULTHXRLY-HLIPFELVSA-N 394.585 2.834 0 50 GFAA Cn1ccnc1[C@@H](O)C1CCN(C(=O)Nc2cccc(-c3cnc[nH]3)c2)CC1 97499488 HLEOURKKVKBHII-SFHVURJKSA-N 380.452 2.788 0 50 GFAA CN(Cc1ccccc1)C(=O)CCC1CCN(C(=O)c2cccc(N)n2)CC1 95497118 OMZRZWUQAKRVRG-UHFFFAOYSA-N 380.492 2.955 0 50 GFAA CCCCn1nccc1NC(=O)N1CCN(C(=O)c2ccc(OC)cc2)CC1 96152155 HPVKJMVZPRIIHG-UHFFFAOYSA-N 385.468 2.682 0 50 GFAA COC(=O)c1cc(=O)n(Cc2ccc(C)cc2)n2c(N)nc(-c3ccccc3)c12 253495682 NLJHLSZIVZFMGV-UHFFFAOYSA-N 388.427 2.889 0 50 GFAA Cc1oc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1C(=O)O 299750888 OQHBMPZHQUWRRZ-DOTOQJQBSA-N 390.823 2.775 0 50 GFAA CN(C)C(=O)Cc1ccccc1NC(=O)NCC[C@H]1COc2ccccc2O1 299797528 NDPMCMHRHSNVHM-INIZCTEOSA-N 383.448 2.669 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NCc2ccccc2F)CN1C1Cc2ccccc2C1 299762494 MEYNHGZCISKKLO-KNQAVFIVSA-N 381.495 2.662 0 50 GFAA C[C@@H](CNC(=O)N(Cc1ccncc1)Cc1ccc(F)cc1)N1CCOCC1 584897670 JQUSABRBFSCZCC-KRWDZBQOSA-N 386.471 2.653 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)Nc1nnc([C@H]2CCCO2)s1 1467168958 JMRZTMUCVYYCEI-GFCCVEGCSA-N 395.872 2.595 0 50 GFAA CC[C@@H]1CN(C(=O)[C@@H]2CCCC[C@@H]2C(=O)N2c3ccccc3C[C@H]2C)C[C@@H]1O 408022368 WMFYLLHAPSGPDC-OVIIUWAXSA-N 384.520 3.000 0 50 GFAA Cc1cccc2c1N(C(=O)C(=O)N(C[C@@H]1CCCO1)c1ccc(N)cc1F)CC2 170603796 TUXGTKZUZIRTTJ-KRWDZBQOSA-N 397.450 2.818 0 50 GFAA O=C(CCCNC(=O)c1ccsc1)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 170602571 CFFRRLDQGGQIDR-XJKSGUPXSA-N 392.443 2.858 0 50 GFAA CCOC(CC(=O)Nc1cc(C(F)(F)F)ccc1NS(C)(=O)=O)OCC 170610300 QCJFYABNUXQTCR-UHFFFAOYSA-N 398.403 2.805 0 50 GFAA COc1ccc(-n2ccnc2CN[C@H]2CC(=O)N(Cc3ccc(F)cc3)C2)cc1 12303216 DZYITPLCKYISQR-SFHVURJKSA-N 394.450 2.911 0 50 GFAA CCOC(=O)c1c(N)sc2c1CCN(S(=O)(=O)c1ccc(C)cc1)C2 12413825 SHZNHJWXPHRWRT-UHFFFAOYSA-N 380.491 2.562 0 50 GFAA CC(C)CN1C[C@@H](COc2cccc(F)c2)C[C@@H](C(=O)NCCCN(C)C)C1 14536175 OQMGYRXJFDGYHU-RBUKOAKNSA-N 393.547 2.867 0 50 GFAA COc1cccc(OCc2nc(C(=O)N(C)Cc3c(C)nn(C)c3C)co2)c1 14972108 QGCUJHJMTZQJLY-UHFFFAOYSA-N 384.436 2.885 0 50 GFAA COc1ccc(/C=C2/SC(=O)N(CC(=O)Nc3nccs3)C2=O)cc1 985990 WCANNGFJAKYBAH-XYOKQWHBSA-N 375.431 2.827 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1nc(C2CC2)n2ccccc12 1857527435 JQYFULJDTBHYCA-RHSMWYFYSA-N 392.463 2.659 0 50 GFAA CC(=O)N1CCC[C@@]2(CN(Cc3cccc(CC(F)(F)F)c3)CC[C@H]2O)C1 1857693883 QNLNZWWORICMOT-RTBURBONSA-N 384.442 2.987 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cccnc3O)C1)CC2 1857711526 FANSTYLQYOLVIS-OAQYLSRUSA-N 382.464 2.701 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)NCCc3ccccc3F)CC2=O)s1 1857713146 FWMJWNLPZDNYHP-ZDUSSCGKSA-N 376.457 2.512 0 50 GFAA O=C(c1ccno1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857715265 JMAQRZMMKQSAKK-UHFFFAOYSA-N 376.416 2.957 0 50 GFAA Cc1nc(C)n(-c2ccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)O)cc2)n1 237955485 HBCBVZGACBVHEQ-LJQANCHMSA-N 376.416 2.536 0 50 GFAA CN(C(=O)c1cc(C(F)(F)F)cnc1O)[C@@H]1CCN(Cc2ccccc2)C1=O 822363820 DQJWPEHBPUWLFA-OAHLLOKOSA-N 393.365 2.679 0 50 GFAA FC(F)COCCN1CC[C@](c2nc(-c3cccnc3)no2)(C(F)(F)F)C1 952891402 DJEFTOKGPNBGFC-HNNXBMFYSA-N 392.328 2.919 0 50 GFAA O=C(Nc1cn(-c2ccccc2C(F)(F)F)nn1)N[C@@H]1C[C@@H]2OCCC[C@@H]21 1875277468 MWIXQVVLQFPDOF-QKCSRTOESA-N 381.358 2.975 0 50 GFAA C[C@@H]1C[C@H](C(=O)N2CCOC3(CCS(=O)(=Nc4ccccc4)CC3)C2)CO1 1875395762 LIHJTGUKBHRYDC-KSUWFQEQSA-N 392.521 2.603 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)N[C@@H]1CCCc3occc31)CCO2 1875393153 HWJFRTXRHWRAPB-GITGVNTFSA-N 395.525 2.719 0 50 GFAA CC(=O)CCCC(=O)N[C@@H]1CCN(C(=O)C(C)(C)c2cnc[nH]2)CC(C)(C)C1 1775997247 YPEPZWMEYYJPDN-MRXNPFEDSA-N 390.528 2.580 0 50 GFAA O=C1N(CCO)c2ccccc2[C@]12CCN(c1ccc(-c3ccccc3)nn1)C2 2100480659 NIRSBPHKFVHCET-HSZRJFAPSA-N 386.455 2.631 0 50 GFAA CCn1c(CN2CCN(Cc3cccc(C)n3)[C@@H](CCO)C2)nc2ccccc21 20203148 CEZNWMMDSSNNIH-FQEVSTJZSA-N 393.535 2.828 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)CO[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)CC2)[nH]1 2325783439 ZZKQDJFTCLLXJI-JCGIZDLHSA-N 378.517 2.521 0 50 GFAA CC(C)(C)OC(=O)c1ccccc1CNC(=O)c1cnc2ncnc(O)c2c1 2325879583 ZZQMRHLTHOCDRX-UHFFFAOYSA-N 380.404 2.616 0 50 GFAA CCOc1ccc(NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 816918 BYSKTMXNOJTALY-CQSZACIVSA-N 392.477 2.887 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 2841947 IGSRCCQQQPWJMK-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 4667267 MKOLLYPARQRULR-GHMZBOCLSA-N 378.288 2.564 0 50 GFAA COc1ccc(C(=O)N2CCC(C)CC2)cc1S(=O)(=O)N1CCCCC1 9063788 URSDLLIUZDHKLQ-UHFFFAOYSA-N 380.510 2.742 0 50 GFAA COc1cc([C@H](C)NC2CCN(c3nccs3)CC2)ccc1OCCO 463078849 UFZLFCINUSNFDG-AWEZNQCLSA-N 377.510 2.842 0 50 GFAA CS[C@H](C)Cc1c(-c2ccccc2)ncn1CCCN(CCO)CCO 65422561 MFDXOGLTGJRUOG-QGZVFWFLSA-N 377.554 2.521 0 50 GFAA Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N1CCS(=O)(=O)C[C@H]1C 252527558 CWESILDHOOGSFE-GFCCVEGCSA-N 390.465 2.573 0 50 GFAA OC[C@H]1CCCCN1CCn1cnc(-c2ccccc2)c1CCn1cccn1 65428240 MMXYOCGFLWMDDA-HXUWFJFHSA-N 379.508 2.836 0 50 GFAA O=C(CCSCc1ccc(F)cc1)N1CCC(N2CCC[C@H](O)C2)CC1 72133674 RPFSKKRWCRKABC-IBGZPJMESA-N 380.529 2.897 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N3CCC[C@@H]3C(=O)Nc3nccs3)c2c1 121225770 HYZUFGFQMUOIJF-MRXNPFEDSA-N 384.461 2.805 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1F)N1CCN(c2ncnc3ccsc23)CC1 124373831 KKAIOCDHWXRVDM-ZDUSSCGKSA-N 385.468 2.980 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)NC2(CO)Cc3ccccc3C2)C[C@@H](C)O1 363130836 BIUQJCOPTLNQHM-CALCHBBNSA-N 395.503 2.952 0 50 GFAA NCc1cc(C(=O)N2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)co1 363732763 CQXJKVDJQXDSTF-LJQANCHMSA-N 377.444 2.926 0 50 GFAA Cc1ccc(-n2cc(C(=O)Nc3cccc(N4C(=O)CCC4=O)c3C)nn2)cc1 130796632 LORZHDMHHPCIHP-UHFFFAOYSA-N 389.415 2.790 0 50 GFAA CCc1cc(C(=O)NCc2cc3c(nc2OC)CN(C2CCCC2)C3=O)ccn1 71762831 SRXNIRSNGBRUNS-UHFFFAOYSA-N 394.475 2.876 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCCn2cccn2)Cc2ccccc2C1 72172637 SMPLWNKMESYGSS-UHFFFAOYSA-N 388.515 2.711 0 50 GFAA O=C(Nc1cc(-c2ccncc2)n[nH]1)C1CCN(C(=O)c2ccccc2)CC1 175829050 WDGQSVSOIXZSRB-UHFFFAOYSA-N 375.432 2.963 0 50 GFAA CCS(=O)(=O)CCNC(=O)c1ccc(-c2cc(C(C)=O)ccc2F)cc1 426518473 ZTXVLZKRPSUTGK-UHFFFAOYSA-N 377.437 2.860 0 50 GFAA CC(C)N1C[C@H](CNC(=O)N2CCC(N(C)Cc3ccccc3)CC2)CC1=O 426497350 ZCVYXSPOERHBJT-IBGZPJMESA-N 386.540 2.549 0 50 GFAA CNC(=O)Cn1cc(NC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)cn1 194350039 GVRVCFFDBLNAHT-UHFFFAOYSA-N 394.460 2.590 0 50 GFAA Cc1nc(C(C)C)cc(N2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)n1 91518863 KTRQEVZUUCPYOO-QFIPXVFZSA-N 385.556 2.822 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCN(Cc3csc(C)n3)CC2)cc1C 95369093 CNKPXACAUSPDOR-GOSISDBHSA-N 375.494 2.712 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(O)c(Cl)c2)C1 95498906 VBMFAIJWEIQKKR-HNNXBMFYSA-N 376.888 2.824 0 50 GFAA Cc1cccc(OCC(=O)N2CCC[C@@H](c3nccn3CCCN(C)C)C2)c1 95352582 DEUZTPMTRZLCTN-LJQANCHMSA-N 384.524 2.928 0 50 GFAA O=C(NC[C@@H]1CCCN1)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 95506506 GJBBHUSYYZZWLS-IBGZPJMESA-N 394.519 2.607 0 50 GFAA Cc1ncsc1CCC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1ccncc1)C2 95383376 OBOXRGNLCKVJNF-DOTOQJQBSA-N 384.505 2.542 0 50 GFAA CCn1ncc(CN(Cc2ccncc2)CC2CCN(CCOC)CC2)c1C 63845078 OYKVHEOAGPVHAI-UHFFFAOYSA-N 385.556 2.967 0 50 GFAA Cc1n[nH]c([C@@H]2CCCN(C(=O)Nc3ccc(C(=O)NC(C)C)cc3C)C2)n1 299772397 VXEDTCRNTJTMNU-MRXNPFEDSA-N 384.484 2.971 0 50 GFAA CN(c1ccc(C(=O)Nc2ccccc2CN2CCCC2)cc1)S(C)(=O)=O 952965030 FGXMLUHKHZLRCV-UHFFFAOYSA-N 387.505 2.931 0 50 GFAA COCCN1C[C@H](C(=O)Nc2cccc(NC(=O)C3CCCC3)c2C)CC1=O 952860846 URNGAZBKBXXCOQ-MRXNPFEDSA-N 387.480 2.557 0 50 GFAA C[C@H]1NC(=O)N(c2ccccc2NC(=O)c2cc(-c3ccsc3)[nH]n2)C1=O 952988144 NUOKOSQHHOYHNV-SNVBAGLBSA-N 381.417 2.835 0 50 GFAA C[C@@H]1CN(C(=O)c2c(C(F)F)nc3cnccn23)CC[C@H](C(F)(F)F)O1 893229453 GYEMBSABORCAEZ-RKDXNWHRSA-N 378.301 2.849 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@@H](Nc2cc(N3CCOCC3)ncn2)C1 302897116 PIYKAYRTXVCQDB-OAHLLOKOSA-N 389.887 2.666 0 50 GFAA O=C([C@H]1CC12CCS(=O)(=O)CC2)N1CCCc2cccc(OC(F)F)c21 274882259 DAGVZJYYUOCFRD-CYBMUJFWSA-N 385.432 2.782 0 50 GFAA CCOCCC1(CNC(=O)C2=NO[C@@H](CNC(=O)OC(C)(C)C)C2)CCCC1 170608066 PXOWELCURLSFAT-OAHLLOKOSA-N 397.516 2.759 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CN(c1cncc(C(=O)N2CCCC2)n1)CC3 1704303646 NAQZSMIWQBVPFB-UHFFFAOYSA-N 377.448 2.765 0 50 GFAA NC(=O)CN1C[C@H]2CN(Cc3c(F)cccc3F)C[C@]2(CCc2ccccc2)C1 1772805087 YGFVMLRSODWZPK-WZONZLPQSA-N 399.485 2.817 0 50 GFAA Cc1cc(=O)n2nc(N3CCC[C@H](C(=O)N[C@@H](C)c4ccccc4)C3)sc2n1 5149062 FJKVGYLFYFQGGM-HOCLYGCPSA-N 397.504 2.553 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2CCCO2)CC1)N1CCN(c2ccccc2)CC1 11753914 NNHQUYLYSKCCNQ-NRFANRHFSA-N 399.535 2.533 0 50 GFAA O=C1NC(=O)[C@@](Cc2ccccc2F)(C2CCN(Cc3ccccc3)CC2)N1 11999546 ITRHXSAECDOEAT-JOCHJYFZSA-N 381.451 2.859 0 50 GFAA CCNC(=O)c1cn(Cc2ccccc2)cc(C(=O)NC2CCCCC2)c1=O 12038850 XGAUIZHDSUSTMT-UHFFFAOYSA-N 381.476 2.709 0 50 GFAA COc1ccc(CCN2C[C@H](NC(=O)Nc3cccc(OC)c3)CC2=O)cc1 12304324 BSRKANDCKJISQD-QGZVFWFLSA-N 383.448 2.669 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)c1 12583501 BUSJCNSNVCRXBZ-OAHLLOKOSA-N 385.468 2.505 0 50 GFAA O=C(c1cn[nH]c1)N1CC(=O)N(C2CCCCC2)C[C@H](OCc2ccccc2)C1 14741913 CLAQXFXZZIJFOW-HXUWFJFHSA-N 396.491 2.612 0 50 GFAA O=C(NCc1nnc2c(-c3nc(C4CC4)no3)cccn12)c1ccc(F)cc1 169776072 XNZMIZCOVKARKB-UHFFFAOYSA-N 378.367 2.726 0 50 GFAA CC[C@@]12COC(=O)N1CCN(C(=O)c1ccc(N3CCCC3)c(Cl)c1)C2 1857676427 NVDBYAJJRODLHQ-LJQANCHMSA-N 377.872 2.997 0 50 GFAA Cc1c(C(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)nc2ccccn12 1857728870 PMWGPEBHVNDEHQ-UHFFFAOYSA-N 375.432 2.682 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@@H](Cn2cccn2)C1)c1ccccc1 111076540 HPLZPNGKNHYOMC-GOSISDBHSA-N 390.443 2.677 0 50 GFAA Cc1ccccc1-c1noc(CN2CCC[C@@]3(CCc4cnc(N)nc43)C2)n1 1704360434 YFJDCIIOQLSHBU-OAQYLSRUSA-N 376.464 2.897 0 50 GFAA Cc1ccc(N2CCC(C(=O)N[C@@](C)(Cc3ccccc3)C(=O)O)CC2)nc1 1875270926 JANCAQIBXMQDSP-QFIPXVFZSA-N 381.476 2.809 0 50 GFAA O=C(NC[C@]1(O)CCc2ccccc21)N[C@@H]1Cc2n[nH]cc2[C@@H](C(F)(F)F)C1 1875278178 GEKMZXZQANEZAC-XLWVJDPXSA-N 394.397 2.504 0 50 GFAA O=C1CCN(Cc2cscn2)C(=O)N1C[C@@H]1CCN(c2ccc(F)cc2)C1 1875293476 RLFMKHIQKUZFPM-CQSZACIVSA-N 388.468 2.963 0 50 GFAA O=C1CC2(CN1)CN(C(=O)N[C@H](c1cccc3ccccc13)C(F)(F)F)C2 1875254950 YOLJKKHPPSTARH-MRXNPFEDSA-N 377.366 2.975 0 50 GFAA Cc1cc([C@@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)oc1C 1875398075 ZXSQJGFDYCNSQL-NVXWUHKLSA-N 385.512 2.935 0 50 GFAA CN(Cc1c(F)cccc1Cl)C(=O)CNc1cc(F)c(F)cc1C(N)=O 1875321890 ADLJAIBJTUDPAR-UHFFFAOYSA-N 385.773 2.927 0 50 GFAA Cc1[nH][nH]c(=NC(=O)[C@H]2CCCN(C3CCOCC3)C2)c1-c1ccc(F)cc1 2100556845 JYEQNASQVIUGIQ-INIZCTEOSA-N 386.471 2.776 0 50 GFAA O=C1CN(Cc2coc(-c3cccs3)n2)C(=O)N1Cc1cc(C2CC2)n[nH]1 2332239242 ZSLRSHGNBHLXOL-UHFFFAOYSA-N 383.433 2.968 0 50 GFAA Cc1ccc(-n2c(-c3ccccc3)cn3c4c(=O)n(C)c(=O)n(C)c4nc23)cc1 709322 LXKSYDKTOOKBNJ-UHFFFAOYSA-N 385.427 2.651 0 50 GFAA CC(C)(C)NC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 869223 AAJPBGSVEDDJSI-GOSISDBHSA-N 390.480 2.856 0 50 GFAA CCOc1ccc(S(=O)(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1 3877716 NXRCZOUEUBRXNR-UHFFFAOYSA-N 387.461 2.684 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc(-c4ccccc4)no3)C[C@@H]2CCO)o1 20453168 DWLSBENWYUWAKH-SFHVURJKSA-N 382.464 2.707 0 50 GFAA CCOC(=O)c1nn(CCC(F)(F)F)c2c1CN(C(=O)c1ccncc1)CC2 20513622 JOMJSZKAYKHFJJ-UHFFFAOYSA-N 396.369 2.606 0 50 GFAA Cc1ccccc1C(=O)Nc1ccc2c(c1)nc(CN1CCN(C)CC1)n2C 20706622 JGAWXTKEIOZUIC-UHFFFAOYSA-N 377.492 2.881 0 50 GFAA Cn1cc(N2CC[C@@H](NC(=O)c3cccc(OCc4cccs4)c3)C2=O)cn1 117693135 OYWYFQVWUUSYBB-GOSISDBHSA-N 396.472 2.596 0 50 GFAA Cn1nc2ccccc2c1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 475906062 MUGLIQDBSZWTJS-HNNXBMFYSA-N 381.411 2.749 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(Cc3cc(Cl)cc4cccnc34)C2=O)nn1 328611220 KSGLSVCCHNLUNL-INIZCTEOSA-N 398.854 2.928 0 50 GFAA COc1cccc(C[C@H](NC(C)=O)C(=O)Nc2ncc(-c3ccccc3)cn2)c1 484702650 KITYWTSGJUWUFY-FQEVSTJZSA-N 390.443 2.838 0 50 GFAA O=C(c1ccccc1)[C@H]1CCCN(C(=O)c2ccc3c(c2)ncn3CCO)C1 77439937 PNISLWFEPVZSQI-SFHVURJKSA-N 377.444 2.764 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CCN1 262956560 WCAJXJNGDWZMTD-FFSVYQOJSA-N 384.307 2.855 0 50 GFAA O=C(O)[C@@H]1CCCN1C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 238069802 UWXYIWAKVOOKPQ-AWEZNQCLSA-N 380.853 2.994 0 50 GFAA O=C(CCC(=O)N1CCN(c2ccccc2)C(=O)C1)NC1CCCCCCC1 82137418 AQDDXOAFFPNKGJ-UHFFFAOYSA-N 385.508 2.871 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C(=O)c2cncnc2C)cc1 95498873 OTTVFQBNDKOJLS-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA CCN(C(=O)Nc1ccc(OCc2ccco2)cc1)[C@H]1CCS(=O)(=O)C1 96162962 SDBGKXCOHRLYCV-HNNXBMFYSA-N 378.450 2.900 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N([C@@H]4CCN(C)C4)C3)CC2)cc1C 95517822 XEDNAJQISDWHLY-LJQANCHMSA-N 399.535 2.553 0 50 GFAA CC[C@H](O)Cn1nc(COc2ccccc2)nc1-c1nn(C)c(C)c1Cl 96150487 GYVUFEMWDNLOAX-ZDUSSCGKSA-N 375.860 2.990 0 50 GFAA O=C(N1C[C@@H]2c3ccccc3OC[C@]2(C(=O)O)C1)C1(c2ccccc2F)CC1 95386731 PKKHAAOMPNMDID-OPAMFIHVSA-N 381.403 2.947 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95509894 PNWONJKAHQZCNK-IBGZPJMESA-N 376.460 2.981 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccccc2-n2cccn2)[C@H]2C[C@@H](O)C2)cn1 244840231 UJHLCVSSGFKEBQ-GQIGUUNPSA-N 378.432 2.518 0 50 GFAA Cc1nnc(-c2cccc(C(=O)N[C@@H]3CC(=O)N(c4c(F)cccc4F)C3)c2)o1 180879401 WOIPZCKAWSZNFT-CQSZACIVSA-N 398.369 2.859 0 50 GFAA COc1ccc(-c2n[nH]c(C)c2CC(=O)N[C@H](C(=O)O)c2ccccc2)cc1 253407423 JWCLYVRLQHFHLI-FQEVSTJZSA-N 379.416 2.878 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1CCC[C@H](N2CCCC2)CC1 182028536 KFGXKXCILYAQDN-ZDUSSCGKSA-N 377.432 2.739 0 50 GFAA Cc1cc(N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)nc(-c2cccnc2)n1 299715130 WVUTUABPVZWQEO-KDURUIRLSA-N 380.540 2.842 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)n2cccc2)cc1N1CCCCS1(=O)=O 253409969 MSAXRVMUHZRART-CQSZACIVSA-N 377.466 2.626 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)N3CCC[C@@H](c4ccncn4)C3)n2)cc1 534590196 GQPUQIDTUALOFZ-MRXNPFEDSA-N 378.436 2.924 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@@H](NCc2cc(F)ccc2F)CNC3=O)c1 263618998 WKXOPXKXRSJDEO-LJQANCHMSA-N 384.386 2.869 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N(C)C[C@H]3CCCN4CCCC[C@@H]34)CC2=O)cc1 299754448 PXMAICBDTVDHQB-OPYAIIAOSA-N 399.535 2.771 0 50 GFAA biogenic CC(C)CCOc1ccccc1CCNC(=O)N1CCC[C@@](O)(CO)CC1 584895153 ISMBOHYNRACSTB-NRFANRHFSA-N 378.513 2.573 0 50 GFAA O=C([C@H]1CCc2ccccc21)N1CCCN(S(=O)(=O)c2ccccc2)CC1 591155072 HWYCQYBCYYGIQS-FQEVSTJZSA-N 384.501 2.640 0 50 GFAA Cc1cccc(C(=O)NC[C@@H]2CCCN(c3nccc(C(F)(F)F)n3)C2)n1 952963945 AQPPMYJWPSJYAZ-ZDUSSCGKSA-N 379.386 2.845 0 50 GFAA CC(C)[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1 276532798 RBHMAZWUMZYAFU-MOPGFXCFSA-N 381.524 2.606 0 50 GFAA C[C@@H](c1nnnn1C1CC1)N1CCN(C(=O)c2cccc3ccccc23)CC1 170611912 UJWTXWVIKZPQQN-HNNXBMFYSA-N 376.464 2.680 0 50 GFAA CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 189059810 SLUKPRKCAOHYLX-APWZRJJASA-N 379.520 2.879 0 50 GFAA CN1CCN(C(=O)c2cncc(N(C)Cc3cccc(C(F)(F)F)c3)n2)CC1 1506429598 VQAALBVAWYEFOV-UHFFFAOYSA-N 393.413 2.519 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N1CCCN(Cc2cccs2)CC1 1506397122 NLEZDBVNYQYDQR-QGZVFWFLSA-N 399.516 2.917 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)N3C[C@H]4CC=CC[C@H]4C3)OCC(=O)N2C2CC2)cc1 1529188693 AJPKJCSIJBSYQS-XQTRSNPVSA-N 396.487 2.551 0 50 GFAA Cc1nnc(CN2CCCN(C(=O)Cc3c(C)[nH]c4ccccc34)CC2)s1 1772702866 AGJNAFLFOBPLHY-UHFFFAOYSA-N 383.521 2.913 0 50 GFAA O=C(CCc1ccccc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@]2(CO)C1 1772819851 VOVMVOMAPFIBDV-REWPJTCUSA-N 382.479 2.711 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772709036 GMILPQGNNQAFEX-JPYJTQIMSA-N 395.455 2.871 0 50 GFAA COc1cc(-c2onc(NC[C@@H]3CC(=O)N(C4CC4)C3)c2C(=O)O)ccc1F 1772701386 OBFAWQYEMBXHNA-JTQLQIEISA-N 389.383 2.610 0 50 GFAA C[C@H]1C(=O)N2CCC[C@H]2CN1Cc1ccccc1OCCCCn1ccnc1 1772813818 VYVLLZPBSPSTBU-ICSRJNTNSA-N 382.508 2.937 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cc[nH]n4)C[C@H]2CN(C2CCOCC2)C3)cc1 1772811805 ZPKYABWOCNYDPH-REWPJTCUSA-N 380.536 2.955 0 50 GFAA O=C(Cc1cccnc1)N1CCCN(C2CCN(Cc3ccccc3)CC2)CC1 1775983867 DJDLASAIAXOUQD-UHFFFAOYSA-N 392.547 2.823 0 50 GFAA CCc1noc(CNC(=O)[C@@H]2CCc3sc(-c4c(C)noc4C)nc3C2)n1 1772811539 YLKNLBFRDIEIQV-LLVKDONJSA-N 387.465 2.782 0 50 GFAA CCCN1C[C@H]2CN(C(=O)CCCn3cncn3)C[C@@]2(CCc2ccccc2)C1 1772819169 GGPUAGZHXRXONI-JTHBVZDNSA-N 395.551 2.862 0 50 GFAA COc1cccc(CN2CCc3c(c(C(=O)NCc4ccccc4)nn3C)C2)c1 14741286 NIIRDFRHSXFTLZ-UHFFFAOYSA-N 390.487 2.917 0 50 GFAA COCc1ccc(CN2CCC[C@@H](CNS(=O)(=O)Cc3ccccc3)C2)o1 15068609 FBYGNVRTBGDJGX-SFHVURJKSA-N 392.521 2.758 0 50 GFAA O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1ccccc1Br 16527322 JIKGUVORMWLCCS-RYUDHWBXSA-N 377.238 2.729 0 50 GFAA O=C(O)[C@@H]1CN(CCCc2ccccc2)CC12CCN(Cc1cc[nH]n1)CC2 1857682477 LAMJWMKUXJVXDB-FQEVSTJZSA-N 382.508 2.641 0 50 GFAA O=C(NCCOc1ccc(F)cc1)[C@]1(Cc2cscn2)C[C@@H]2CC[C@H]1N2 1857696489 CUCYGINKVNXKHS-YJLNNSPDSA-N 375.469 2.531 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1ccccc1-n1cnnc1)CC2 1857711563 GTHMUSULEQTVFP-UHFFFAOYSA-N 398.470 2.909 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccnc3)C[C@]23CC[C@H]1O3)c1ccc(Cl)o1 1857739154 KVAONPNUMITNLW-QCBUCWTNSA-N 387.867 2.737 0 50 GFAA COc1ccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)cc1OC 1875246441 HCEXKAPIDKIEAC-SFTDATJTSA-N 384.476 2.848 0 50 GFAA O=C1NCC[C@H]1N1CCN(c2cccc(OCc3ccccc3Cl)c2)CC1 253415622 GCNOYWMCWALGQN-HXUWFJFHSA-N 385.895 2.930 0 50 GFAA Cc1c(C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)sc2nccn12 363146334 ZJEGBDKFZQJTTI-UHFFFAOYSA-N 382.489 2.986 0 50 GFAA CN(CCCO)Cc1ccc(-c2nc(COc3ccccc3)cc(=O)[nH]2)cc1 23398247 SWVBRIGFDPNEIY-UHFFFAOYSA-N 379.460 2.830 0 50 GFAA COc1ccc2cc(NC(=O)N3CCN(Cc4cc(C)on4)CC3)ccc2n1 263643926 FBFGUYOKVXLMPQ-UHFFFAOYSA-N 381.436 2.890 0 50 GFAA COc1cc2c(cc1OC)CN(CC(=O)N1CCC[C@]3(C1)CC3(F)F)CC2 846582660 ZEYMDKWBFGZXLN-LJQANCHMSA-N 380.435 2.710 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)N1CC[C@@H](O)CC12CC2)N1CCCCC1 1875288998 OUKCFDAZOBIZKT-IEBWSBKVSA-N 387.524 2.921 0 50 GFAA CCn1nc2c(c1C(=O)NCc1cc(Br)c[nH]1)C[C@H](C)O[C@@H]2C 1875314101 HGQDNXZMHDKQKO-VHSXEESVSA-N 381.274 2.946 0 50 GFAA Cc1cccc(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2nnsc2Cl)n1 888103459 IRBMEVMTDRQTMF-YHWZYXNKSA-N 377.901 2.820 0 50 GFAA Cc1cc(C(=O)O)ccc1S(=O)(=O)N1CCN(Cc2ccccc2)[C@@H](C)C1 396357619 HWTLPGNLPIPISO-INIZCTEOSA-N 388.489 2.588 0 50 GFAA CNc1ncccc1C(=O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100483035 NMMAYBQATCTTPT-QHCPKHFHSA-N 392.503 2.963 0 50 GFAA O=C(/C=C/c1c(Cl)nc2sccn12)Nc1cnn(C[C@H]2CCCN2)c1 2325779153 JUDHKAUXBFZXNT-PGLGOXFNSA-N 376.873 2.650 0 50 GFAA NC(=O)c1ccc(NC(=O)Cn2ccc3cc(Br)ccc32)c(O)c1 2325875064 FJXXVSNSAFCJES-UHFFFAOYSA-N 388.221 2.847 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1 2325889691 JHJUMJOEGNYPLD-IBGZPJMESA-N 377.444 2.539 0 50 GFAA Cc1cccc2[nH]cc(CCNC(=O)NC3CCN(C[C@@H]4CCOC4)CC3)c12 132919740 LTUOCWRRPRUVJW-KRWDZBQOSA-N 384.524 2.819 0 50 GFAA Cc1cc(S(=O)(=O)NCC(C)C)ccc1OCC(=O)Nc1ccccc1 1065569 QYBALOLBMACVDF-UHFFFAOYSA-N 376.478 2.947 0 50 GFAA O=C(NCCc1nc2ccccc2[nH]1)c1cc2c(s1)C1(CCNCC1)OCC2 2356133889 KFFGAAAVCQQGKI-UHFFFAOYSA-N 396.516 2.748 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N3CC(c4nc5ccccc5[nH]4)C3)cn12 2356165668 FKYXDHWAUQZIJW-GOSISDBHSA-N 390.447 2.535 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)cc1=O 2356167488 QGEKJEZMXXKEPQ-HSZRJFAPSA-N 393.487 2.666 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)OCc1ccccc1 4763003 NFJJNKNWOMGSKP-IBGZPJMESA-N 396.443 2.647 0 50 GFAA Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)cc1 6646757 JJXJNHKMHSTPPI-UHFFFAOYSA-N 384.910 2.857 0 50 GFAA COCCC(=O)N1CCC[C@@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 55385267 SCSYVCKGVWLWES-GOSISDBHSA-N 399.457 2.855 0 50 GFAA COc1ccc(CC2(CO)CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1 20119654 MYYUCHWNPWHRRA-UHFFFAOYSA-N 389.517 2.842 0 50 GFAA O=C(CCN1CCC[C@@H](c2nc(-c3cccnc3)no2)C1)NCc1ccco1 65398199 YFAPACVJZMBWCN-MRXNPFEDSA-N 381.436 2.611 0 50 GFAA CC(=O)Nc1ccccc1NC(=O)CN[C@H]1CCCN(Cc2ccccc2)C1 65405080 JDAIJRSJFXRSHL-IBGZPJMESA-N 380.492 2.838 0 50 GFAA O=C(O)c1nn(CC2CC2)c2c1CN(C(=O)c1nccc3ccccc13)CC2 67981690 OJKHLKPMPXQLDG-UHFFFAOYSA-N 376.416 2.738 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](CCc3ccc(F)cc3)C2)cnc2cc(=O)[nH]n12 71759934 HNRKSVCBJKVMTP-INIZCTEOSA-N 382.439 2.955 0 50 GFAA C[C@@H]1CN(c2c(F)c(F)c3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)C[C@@H](C)N1 6625674 QIPQASLPWJVQMH-RKDXNWHRSA-N 395.381 2.639 0 50 GFAA biogenic,in-vitro Cc1ccc2nc(N3CCC[C@H](O)C3)c(CN(C)Cc3cnn(C)c3)cc2c1 72409086 HXFFWRLYPOGGEC-FQEVSTJZSA-N 379.508 2.870 0 50 GFAA COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1 8059042 KTSVQHMWSRQNRP-LBPRGKRZSA-N 378.450 2.702 0 50 GFAA Cc1noc([C@H]2C[C@H](O)CN2S(=O)(=O)c2cc3cc(Cl)ccc3s2)n1 328626957 MGWRNAPBSKCHBO-NWDGAFQWSA-N 399.881 2.743 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(NC[C@H](c2cnn(C)c2)N(C)C)ncn1 328656173 ZBSBWGQCMVECCR-QKLQHJQFSA-N 387.532 2.540 0 50 GFAA NCc1cc(C(=O)N2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)co1 363732762 CQXJKVDJQXDSTF-IBGZPJMESA-N 377.444 2.926 0 50 GFAA O=c1c2ccccc2c(-c2cccs2)nn1Cc1nnn(CC(F)(F)F)n1 439209528 NBZYMSVFOULJJW-UHFFFAOYSA-N 392.366 2.722 0 50 GFAA C[C@@H](Oc1cccc(F)c1)C(=O)N1CCN(c2ncnc3ccsc23)CC1 126607816 ZXLXTUBRGNGRTK-CYBMUJFWSA-N 386.452 2.947 0 50 GFAA O=C(N[C@@H]1CCc2ncnn2C1)N1CCC(Cc2cccc(F)c2F)CC1 333632665 RCSJHWYCSDMDTR-OAHLLOKOSA-N 375.423 2.535 0 50 GFAA Cc1cc(N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)nc(C(C)C)n1 71415730 NSXLSXNKKZKFGH-QGZVFWFLSA-N 385.556 2.868 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2nn(C)c(=O)c3ccccc23)CCCN1CC1CC1 71498203 ZGXYZJGDCPYBFU-IBGZPJMESA-N 382.508 2.516 0 50 GFAA CCC(CC)(CNC(=O)[C@@H](CCSC)NC(=O)c1cccc(C)c1)C(=O)O 241719803 QPSXVJAPMBQQQW-MRXNPFEDSA-N 394.537 2.854 0 50 GFAA C[C@@H]1[C@@H](C(=O)NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 242167629 WYDGKHCOZBRDDA-NJAFHUGGSA-N 376.497 2.742 0 50 GFAA COCc1nn2c(ncc3c(=O)n(CCN(C)C)ccc32)c1-c1ccc(F)cc1 40397076 SILIKRSLKHJYCJ-UHFFFAOYSA-N 395.438 2.558 0 50 GFAA O=S(=O)(c1c[nH]c2ncccc12)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 285286461 JWJXQKWUPUYDJI-OAQYLSRUSA-N 396.516 2.850 0 50 GFAA CCn1cnnc1C1CCN(CC(=O)N(Cc2ccc(C)cc2)C2CC2)CC1 177833955 FIIJAHNJOIPUOG-UHFFFAOYSA-N 381.524 2.977 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@H](C)CO)c1 95519581 LYFZSTFNLYAGDR-OAHLLOKOSA-N 376.497 2.592 0 50 GFAA CCc1ccc(CN2CCC(c3nnc(Cn4cccn4)n3CC)CC2)nc1 91351010 JLRIYQJAFVFLIV-UHFFFAOYSA-N 379.512 2.880 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1c1ccccc1F 97466834 FOWPICIYAXCKBB-GOSISDBHSA-N 387.842 2.933 0 50 GFAA CN1CCN(CCCNC(=O)Nc2cccc(NC(=O)C3CCCC3)c2)CC1 96136405 JEWDXRGQEVWYHX-UHFFFAOYSA-N 387.528 2.574 0 50 GFAA O=C1N(C2CCCCC2)CCC[C@]12CCN(c1nnnn1-c1ccccc1)C2 91636294 AQWLGBMAMZZITD-OAQYLSRUSA-N 380.496 2.814 0 50 GFAA O=C(NCc1csc(-c2ncccn2)n1)c1cccc(Cn2cccn2)c1 91593791 VGGQXZJYNNYCHR-UHFFFAOYSA-N 376.445 2.775 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1n[nH]c(N)c1-c1ccccc1)C2 95530727 YYLKXGYVYWOPGZ-ZDUSSCGKSA-N 378.432 2.649 0 50 GFAA CC(C)C1=NO[C@@H](C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)C1 91931408 MFIUJFAGXROVOX-LJQANCHMSA-N 398.507 2.614 0 50 GFAA CCOc1ccccc1[C@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95387475 AVRTXXRKKWZBBH-GOSISDBHSA-N 375.494 2.794 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(c2ncc(C(C)C)cn2)CC1 96153287 WVNAZCDLPCJHSB-UHFFFAOYSA-N 380.500 2.840 0 50 GFAA Cc1cnc(N2CCC[C@@H]2c2nc(-c3cccnc3)no2)nc1-c1ccnn1C 23505283 QUFAOTKAMAJMBU-MRXNPFEDSA-N 388.435 2.972 0 50 GFAA C[C@@H](NS(C)(=O)=O)c1nc(Cc2cccs2)nn1Cc1ccccc1 96139051 RFKYYDIIPXFEBR-CYBMUJFWSA-N 376.507 2.589 0 50 GFAA CCCCn1ccnc1[C@H]1CCCN(C(=O)Cn2c(=O)oc3ccccc32)C1 95530661 BKCLBPPJTXRAAX-INIZCTEOSA-N 382.464 2.997 0 50 GFAA CCCCS(=O)(=O)N1CCC(C(=O)Nc2ccc3c(C)n[nH]c3c2)CC1 180318963 HRJSNOSKVMHGKH-UHFFFAOYSA-N 378.498 2.652 0 50 GFAA COC(=O)[C@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 299035236 TUVCFAYOSZKLJN-XHDPSFHLSA-N 399.274 2.620 0 50 GFAA O=C(c1ccc(-c2cncc(O)n2)cc1)N1CCC(CCn2cccn2)CC1 534660589 UCIORGFSHJMQSJ-UHFFFAOYSA-N 377.448 2.988 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@@H](C(=O)N1CCCCCC1)C2)c1ccncc1 299790421 BBCSMNHSGXQWIB-AWEZNQCLSA-N 398.488 2.938 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCC[C@H](c3nnc4ccccn34)C2)o1 825647622 ARPPREQQFLWPEY-AWEZNQCLSA-N 395.492 2.982 0 50 GFAA O=C(N[C@@H]1CCCN(C2CCCC2)C1)N1CCN(c2ncccc2Cl)CC1 584885900 VYUGPENHWRPBHG-MRXNPFEDSA-N 391.947 2.974 0 50 GFAA Cc1cccc(N2CCC(NS(=O)(=O)c3c(C)nn(C)c3Cl)CC2)c1 670465604 YJXCHZDHASJVRD-UHFFFAOYSA-N 382.917 2.638 0 50 GFAA CC(C)C(=O)N1CCC2(CC1)CN(c1ccc(-c3ccccc3)nn1)CCO2 952990322 USUWNPQBFIJTSW-UHFFFAOYSA-N 380.492 2.997 0 50 GFAA O=C(Nc1cc(Cl)cc(Cl)c1)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 170591906 QEFRMGMUXSBBSS-WFASDCNBSA-N 393.292 2.851 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2[nH]1 170838667 VMVNELLCUSJBDD-BEFAXECRSA-N 376.460 2.974 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCc2nc[nH]c2[C@H]1c1cccnc1 1336001323 RKRVUPGDPSQOSE-LJQANCHMSA-N 375.432 2.572 0 50 GFAA CCCC(=O)Nc1cccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)c1 1529118215 GMWBUYGZCCLTTC-TZIWHRDSSA-N 382.460 3.000 0 50 GFAA CCOC(=O)CCNC(=O)/C(=C\c1ccc(OC)cc1)NC(=O)c1ccccc1 5103005 FIOCYLWOXJVXKJ-XDJHFCHBSA-N 396.443 2.536 0 50 GFAA CNC(=O)c1ccc(CNC(=O)[C@@H](Cc2ccc(O)cc2)c2ccccc2)o1 1772701910 PUIIDYSVJDJVBT-IBGZPJMESA-N 378.428 2.988 0 50 GFAA COc1cc(C)ccc1OCc1cc(C(=O)NCC(C)(C)CN(C)C)no1 11661901 SVISSQQLTDKEJJ-UHFFFAOYSA-N 375.469 2.888 0 50 GFAA O=C(c1cn([C@H]2CCCN(Cc3c(F)cccc3F)C2)nn1)N1CCCC1 12454846 GSDKIZOZYYLCLO-AWEZNQCLSA-N 375.423 2.629 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4ccccc4C)CC3)nn2)n1 13009042 UMMXKDLMKKTHFK-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1ccccc1C(=O)Nc1ccc2c(c1)nc(CN1CCOCC1)n2C 13724977 ZOULOMVDNCZNAM-UHFFFAOYSA-N 380.448 2.666 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@@]1(O)CN1CCC(N2CCCC2)CC1 14981213 HIBHIIONFIHUCT-XMMPIXPASA-N 399.579 2.533 0 50 GFAA Cc1cc(C)n(CCN(C)C(=O)CCc2nnc(COc3ccccc3)o2)n1 15064709 QOVREWCJMXXOLB-UHFFFAOYSA-N 383.452 2.553 0 50 GFAA CCOCCCN[C@@H]1CCc2c(c(C(=O)N(C)C)nn2Cc2ccccc2)C1 19147836 MWKWZNOYRAHLMU-GOSISDBHSA-N 384.524 2.507 0 50 GFAA O=C(c1cccs1)N1CCN(Cc2nc(CCc3ccccc3)no2)CC1 19224166 XSOWIGOKSPESBI-UHFFFAOYSA-N 382.489 2.874 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](CC)O3)c1C 1857672135 LTRAFTKQSVCKOK-CVEARBPZSA-N 392.496 2.733 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)NCCc2cc[nH]n2)cc1OC 1857687258 NFRDUMUMNRJDPQ-UHFFFAOYSA-N 396.447 2.650 0 50 GFAA COCC1(C(=O)N2CCC[C@@]3(CN(CC4CCCCC4)CC[C@H]3O)C2)CC1 1857691909 GHMWQQUTFIDWRO-DENIHFKCSA-N 378.557 2.669 0 50 GFAA Cc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3ccccn3)[C@H]3CC[C@]2(C1)O3 1857719585 QCRDOPWYRFKGNH-KLJZETAQSA-N 377.488 2.799 0 50 GFAA CCOc1cccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1 1857730881 BCSKNXJIQFNUSV-MZKRTTBSSA-N 392.455 3.000 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccc(F)c(C)c4)C[C@]34CC[C@H]2O4)no1 1857738119 RUDQYJSAIKVAOX-VTAPXXACSA-N 399.466 2.840 0 50 GFAA NC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCC1(c2cccc(F)c2)CC1 124833624 CVJAKDUDGLPBRB-LJQANCHMSA-N 394.450 2.734 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)N1CCOC2(CCC2)C1 127526102 ZLEJYKUKFWDVHH-INIZCTEOSA-N 392.883 2.735 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 237642395 UYWMTSRUPUJRIL-QGZVFWFLSA-N 396.281 2.821 0 50 GFAA O=C([C@H]1CCOc2ccc(Cl)cc21)N1CCN(c2ncncc2Cl)CC1 952845773 UNNWCVWYOAPWOC-ZDUSSCGKSA-N 393.274 2.998 0 50 GFAA CCC(=O)N[C@@H](C(=O)N1CCC(C2(C(=O)OC)CCC2)CC1)c1ccccc1 1875298354 XVYYPWLYCXDYCJ-LJQANCHMSA-N 386.492 2.836 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1NCc1cc2n(n1)CCC2 1875399293 VFDAUEDFTVUSJH-MAODMQOUSA-N 377.492 2.622 0 50 GFAA CCCn1/c(=N/S(=O)(=O)c2c(O)cccc2OC)n(CC)c2ccccc21 1875322722 DEUWUBOYIWHEKZ-FMQUCBEESA-N 389.477 2.877 0 50 GFAA Cc1c(C(=O)N2CCOC3(CCS(=N)(=O)CC3)C2)cnn1C1CCCCC1 1875395831 NBBIRNMJMGJABB-UHFFFAOYSA-N 394.541 2.748 0 50 GFAA CC1(CS(C)(=O)=O)CCN([C@@H](C(=O)O)c2ccc(F)cc2Cl)CC1 1776578186 ZNQGVSUISOTKPY-CQSZACIVSA-N 377.865 2.752 0 50 GFAA Cc1cccc(OC2CN(C(=O)c3ccc4nnc(-c5cccn5C)n4c3)C2)c1 2100473630 PZVMWHTVAQSLSV-UHFFFAOYSA-N 387.443 2.947 0 50 GFAA O=C(O)Cn1ccc2c(NS(=O)(=O)Cc3noc4ccccc34)cccc21 2325841128 DTMZPBWKYVYPLR-UHFFFAOYSA-N 385.401 2.809 0 50 GFAA COc1cc(NC(=O)NC[C@@H]2Cc3ccccc3CN2)cc(-n2cccn2)c1 2325860039 VQCIXMRNZICGRV-SFHVURJKSA-N 377.448 2.717 0 50 GFAA Cc1cccc(Nc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccccc2)c1 634712 CFIOKJRTLCPCJD-UHFFFAOYSA-N 375.432 2.534 0 50 GFAA CCN(CC)c1ccc(C(=O)N2CCC[C@]3(CCc4c[nH]c(=N)nc43)C2)cc1 2356141423 AJOMOOHSXRNBPV-QFIPXVFZSA-N 379.508 2.856 0 50 GFAA O=C1COc2cc(C(=O)N3CCC4(CC3)OCCc3sccc34)ccc2N1 2356146441 GTUKBIRHQHZNLA-UHFFFAOYSA-N 384.457 2.783 0 50 GFAA COc1cc(-c2ccc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc2)c(=N)[nH]c1C 2356162637 HKXAVTCICBFEET-PZJWPPBQSA-N 389.455 2.866 0 50 GFAA CN1CCN(C(=O)c2cc3nc(-c4cccs4)cc(C(F)(F)F)n3n2)CC1 57800775 FNQBAESOVRNAEY-UHFFFAOYSA-N 395.410 2.864 0 50 GFAA O=c1[nH]c2ccccc2cc1CN(C[C@@H]1CCCO1)S(=O)(=O)c1ccccc1 9448533 FYVXLOVFZXHFLJ-SFHVURJKSA-N 398.484 2.898 0 50 GFAA COc1ccc(NC(=O)N2C[C@@H](OC)Cc3ccccc32)cc1S(C)(=O)=O 417348042 IGQFIKXAERUQMT-HNNXBMFYSA-N 390.461 2.708 0 50 GFAA Cc1nccnc1-c1ccn(CC(=O)Nc2ccnn2C[C@H]2CC=CCC2)n1 20661433 PFNUHCVAZAPNOA-INIZCTEOSA-N 377.452 2.840 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1ccc(I)cc1)[C@H]1C=C[C@H]2C12CC2 101362861 SXBUIFRWYXAUGI-AAVRWANBSA-N 391.208 2.993 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1cccnc1)c1ccc(Cl)cc1 20567983 ZNULKTVQPJAEIS-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA Cc1nc(NCCNC(=O)c2ccc(C(C)(C)C)cc2)cc(N2CCOCC2)n1 67621491 NIXMEGSITCRCJD-UHFFFAOYSA-N 397.523 2.761 0 50 GFAA CC(C)(C)c1ccc(C(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)cc1 67603564 RPEWUURTSOHLBR-UHFFFAOYSA-N 390.491 2.922 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@H]2COCCO2)CCO3)s1 67817807 RTLKLKNYVFKMBH-MRXNPFEDSA-N 375.446 2.566 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCC[C@@H]2OCC[C@H]21 230227021 APGBLPZJCNTXFY-ZNMIVQPWSA-N 392.912 2.961 0 50 GFAA C[C@H](CC(C)(C)O)N1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 72473099 DIVXAGBWZHKDOK-QGZVFWFLSA-N 376.497 2.902 0 50 GFAA COc1cc(/C=C/C(=O)N(CC(=O)O)C2CCOCC2)ccc1OC(C)C 328595075 JZTUSUPCARFAAC-FNORWQNLSA-N 377.437 2.588 0 50 GFAA COc1ccc(CN2CCN(c3ncnc4c3CCC4)C[C@@H]2CCO)c(C)c1C 72406777 PZXQHQXDNMEKAK-IBGZPJMESA-N 396.535 2.664 0 50 GFAA Cc1nc(CN2CCC(C(=O)N3CC[C@@H](Oc4cccnc4)C3)CC2)cs1 123069579 BCMIKZJFTPRLIF-LJQANCHMSA-N 386.521 2.738 0 50 GFAA CNS(=O)(=O)c1ccc(-c2nccn2C[C@H]2OCCc3ccccc32)cc1 71497876 KZGLESTZHKZBGT-LJQANCHMSA-N 383.473 2.772 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)Cn3nc(C)c(C)c3C)CC2)OC1=O 77439759 FUNGRVVLAYFHSB-AWEZNQCLSA-N 376.501 2.810 0 50 GFAA Nc1nc(N2CCc3ccccc3C2)[nH]c(=O)c1C(=S)Nc1ccccc1 40385565 FYBFUMQBYKSEOB-UHFFFAOYSA-N 377.473 2.702 0 50 GFAA C[C@@H]1Oc2ccc(C(=O)C3CCN(c4cccc(C(=O)O)n4)CC3)cc2NC1=O 263407807 LFEJBSSWDQDDQT-LBPRGKRZSA-N 395.415 2.599 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3c[nH]nc3-c3ccc(F)cc3)C2)no1 426477605 RZLWMIPIOITCFN-AWEZNQCLSA-N 384.415 2.996 0 50 GFAA CCc1ocnc1C(=O)N1CCC[C@H]1c1ccc(C(=O)N2CCOCC2)s1 19223620 MIHVLICHGKZXKR-ZDUSSCGKSA-N 389.477 2.748 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CCn3c(C4CCCC4)nnc3[C@H]2C)c(O)n1 289061956 MEEZBSLSDOFANK-CQSZACIVSA-N 384.484 2.940 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1CCC2(CC1)[C@H](C(=O)O)CC(=O)N2C 95383832 JWAZSDQFRWOPQF-LBPRGKRZSA-N 379.844 2.578 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCC3(CC2)CC(=O)N(C[C@@H]2CCCO2)C3)s1 95362048 YSJPRDNFAIRELA-HNNXBMFYSA-N 390.505 2.584 0 50 GFAA Cc1cc2ncn(C[C@H](O)CN3CCN(c4ccncc4Cl)CC3)c2cc1C 162479171 SKWGFJFFWUFMBE-QGZVFWFLSA-N 399.926 2.885 0 50 GFAA C[C@@H](O)C(=O)N1CCC(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)CC1 95511884 VRASCSXGUBBDCQ-CQSZACIVSA-N 392.459 2.788 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCC(c2nccn2Cc2cccnc2)CC1 95505609 HKYXSMGNGZNLDC-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA COc1ccc(OC(F)F)c(CNC(=O)c2cnc3c(C)cccn3c2=O)c1 180360647 QGBGHZQLBHKQPA-UHFFFAOYSA-N 389.358 2.543 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ncccc3F)CC2)CN1CCc1cccnc1 91602722 OWHPFBVDRZLCKO-UHFFFAOYSA-N 396.466 2.703 0 50 GFAA COc1cc(F)c(C(=O)N[C@@H](c2ccc(OC)nc2)[C@H]2C[C@@H](O)C2)c(F)c1 244619935 FIUQTGWODPWJFJ-IUUKEHGRSA-N 378.375 2.619 0 50 GFAA Cc1ccc(NC(=O)C2CCN(Cc3cc(-c4cnn(C)c4C)no3)CC2)nc1 184637508 LDRMZOQWPKJHLN-UHFFFAOYSA-N 394.479 2.938 0 50 GFAA O=C(O)COc1cccc(CNC(=O)c2cc(Cl)c3c(c2)OCCO3)c1 299748005 FUDFGKJCEKTBHQ-UHFFFAOYSA-N 377.780 2.505 0 50 GFAA CCN(Cc1nc(C)no1)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1 534657584 UPRSOKQIEZZKRH-UHFFFAOYSA-N 385.468 2.523 0 50 GFAA OCCN1CCN(C2CCN(Cc3ccc(-c4ccccc4)s3)CC2)CC1 952978572 ASBZOAMNYLDLSA-UHFFFAOYSA-N 385.577 2.989 0 50 GFAA C[C@H](NC(=O)c1cccs1)C(=O)N[C@@H](CC(=O)O)c1ccc(Cl)c(F)c1 170592127 JPXTYANJFCGXMN-ZANVPECISA-N 398.843 2.991 0 50 GFAA Cn1cc([C@H]2CSCCN2CC(=O)NC2CCC(C(F)(F)F)CC2)cn1 170612050 LPGCALWZVHRQED-YMAMQOFZSA-N 390.475 2.747 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)Nc2cc3c(cc2F)NC(=O)CC3)nn1 187422742 UCURLINYCYPTDQ-UHFFFAOYSA-N 383.358 2.991 0 50 GFAA O=C(c1cc(=O)n(-c2ccccc2)[nH]1)N1CCC([C@H](O)c2cccs2)CC1 1506425593 BOGKGDNXFAVSIZ-IBGZPJMESA-N 383.473 2.813 0 50 GFAA Nc1ncc(C(=O)N2CCC[C@@H](C(=O)c3ccccn3)C2)c(-c2ccccc2)n1 1506400200 JEQMDZCXKKJFNI-MRXNPFEDSA-N 387.443 2.856 0 50 GFAA COc1cc(-c2onc(NCCC(=O)N3CCCC3)c2C(=O)O)ccc1F 1704355690 WRPCTGYTYUCDGK-UHFFFAOYSA-N 377.372 2.612 0 50 GFAA COCCn1ccnc1CN1C[C@@H]2CN(Cc3nc(C(C)C)cs3)CC[C@@H]21 1775984140 ZNGNGFPQWHJBEN-WMZOPIPTSA-N 389.569 2.816 0 50 GFAA Cc1nc(C(=O)N2CCC[C@@H](c3nc(C4CCOCC4)n[nH]3)CC2)cs1 1772705583 JYRXZWGQVVCOMC-CYBMUJFWSA-N 375.498 2.874 0 50 GFAA NC(=O)c1ccc(CNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)cc1 1772813380 YYYZYBWBERAEHP-INIZCTEOSA-N 392.484 2.725 0 50 GFAA CCCn1cc(CN(CC2CCN(CCOC)CC2)C[C@H]2CCCO2)c(C)n1 12702570 SUEBWDFOBLUZPK-JOCHJYFZSA-N 392.588 2.941 0 50 GFAA O=C(NC[C@@H]1COc2ccccc2O1)c1coc(COc2ccccc2F)n1 12713129 CMJGHTKIRDHVMI-CYBMUJFWSA-N 384.363 2.963 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H](NC(=O)Cc2cccs2)C1 12744393 VZCGWAGBRCJFHP-INIZCTEOSA-N 386.521 2.747 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1cc(F)cc(F)c1 15063954 BIZHVZXHDYKHRN-SFHVURJKSA-N 384.390 2.544 0 50 GFAA CCOC(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1ccc(CO)o1)CC2 19835429 KEQGZHMJNRQBEH-UHFFFAOYSA-N 395.459 2.752 0 50 GFAA O=C(NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12)c1ccc(F)cc1 169776307 LIFDORAZRNFFSS-UHFFFAOYSA-N 378.367 2.726 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cc(=O)c4ccccc4o3)CC2)O1 1857668165 ODWAHYTULQCQDC-DNVCBOLYSA-N 385.460 2.964 0 50 GFAA COc1ccc(Oc2ccc(C(=O)N3C[C@@H]4CCOC[C@]4(CO)C3)cc2)cc1 1857668930 XVWQPOYAMYZKSZ-HTAPYJJXSA-N 383.444 2.959 0 50 GFAA CCN(C)C(=O)[C@H]1[C@@H]2CC[C@H]1CN2C(=O)CCc1nc(-c2cccc(C)c2)no1 1857671321 DRDRWTXWEKFMIS-ABSDTBQOSA-N 396.491 2.693 0 50 GFAA C[C@H]1CN2C[C@@H](NC(=O)c3cc4c(-c5ccccc5)nn(C)c4s3)C[C@H]2CO1 1857687618 WTFLTTZAAMJZIP-BPUTZDHNSA-N 396.516 2.893 0 50 GFAA Cc1ocnc1C(=O)N[C@H]1CCC[C@@H](CNC(=O)c2nn(C)c3ccccc23)C1 1857691121 ZIROFNXIBOQVQP-CABCVRRESA-N 395.463 2.588 0 50 GFAA Cc1cccc2nc(C(=O)N[C@@H]3CC[C@H](NC(=O)Cc4ccc(F)cc4)C3)cn12 1857705685 QNIPQLDEAUYDDX-ZWKOTPCHSA-N 394.450 2.792 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)c1ccc(Cl)c(Cl)c1 104255660 YEFCTMCIJSAHED-MUAIWGBPSA-N 377.227 2.691 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)c1cc(N2CCC[C@@H](CO)C2)ncn1 266853273 SCSRHOAZDXJFEY-LLVKDONJSA-N 387.431 2.797 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCC[C@]3(CCc4cnc(N)nc43)C2)c1 1704316486 RIEBEYBYFUEUGH-QFIPXVFZSA-N 390.491 2.733 0 50 GFAA C[C@H](NC(=O)c1cnc(C2CC2)nc1N)c1cc(F)ccc1N1CCC(O)CC1 807035280 NGJHRCGOCQSJRZ-LBPRGKRZSA-N 399.470 2.527 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)cc1 837140763 RJWWIRZPBCIOKY-ZWKOTPCHSA-N 399.491 2.570 0 50 GFAA C[C@@H](OC(=O)[C@@H]1CNC(=O)c2ccccc21)C(=O)N1CCSc2ccccc21 860417127 CXSITQJPUPEWMQ-CZUORRHYSA-N 396.468 2.584 0 50 GFAA COc1ccc(-c2cc(NC(=O)c3ccc(S(C)(=O)=O)cc3)ncn2)cc1 1875357187 WGQOFHCUOIAPGP-UHFFFAOYSA-N 383.429 2.808 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1nc(-c2cccnc2Cl)ns1)C(C)C 888094362 LNJQMCVWRBEBSI-SNVBAGLBSA-N 376.891 2.666 0 50 GFAA C[C@H](Oc1cccc2ccccc12)C(=O)N1CC[C@H](c2cc(O)nc(O)n2)C1 898231124 HVZYCXFZESYJNA-ZFWWWQNUSA-N 379.416 2.824 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@]2(C1)C(=O)N(Cc1ccccn1)c1ccccc12 2100557304 QIQDBOODFCELMU-DEOSSOPVSA-N 398.466 2.736 0 50 GFAA Cc1nc2ccc(OC(F)(F)F)cc2cc1C(=O)N=c1[nH]n(C)c(C)c1CN 2325756582 WBKSNFAVDDGXBC-UHFFFAOYSA-N 393.369 2.617 0 50 GFAA Fc1cnc(N2CCN(c3ccc(Br)c(C4CC4)n3)CC2)nc1 2325764522 PZJTUNLQPPGYBI-UHFFFAOYSA-N 378.249 2.977 0 50 GFAA COc1ccc2oc(=O)c(C(=O)N3CCN(c4ccccc4OC)CC3)cc2c1 887177 QTEPFDOZYLGOPK-UHFFFAOYSA-N 394.427 2.773 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)c1 902625 BOFWNPXLFXOZJI-CQSZACIVSA-N 379.445 2.900 0 50 GFAA aggregator CCOc1ccccc1NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 1101772 MWZQQFPAHIGYFL-UHFFFAOYSA-N 392.477 2.790 0 50 GFAA CCN1CCN(c2ncc3c(n2)C[C@H](c2ccc(OC)c(OC)c2)CC3=O)CC1 2362121 LLMZGDUAKVPUOZ-INIZCTEOSA-N 396.491 2.548 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(C(=O)OC)cc2)nnc1-c1ccccn1 2369470 GJDLCOLRKDGOIQ-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2c[nH]c3ccc(F)cc3c2=O)C1=O 2356149545 HBBSKEDSPVHHNT-OAQYLSRUSA-N 385.439 2.673 0 50 GFAA CCc1ccccc1N1CCN(S(=O)(=O)c2ccc(F)cc2OC)CC1 2846401 UELHCAPBUKGEIF-UHFFFAOYSA-N 378.469 2.908 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)c1ccc(F)c(Cl)c1 3017130 QXCMUWGGRARDQH-UHFFFAOYSA-N 396.871 2.830 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3ccc(F)cn3)CC1)OCC2 2356170838 LZDSJNQGMNGRDD-UHFFFAOYSA-N 386.423 2.942 0 50 GFAA COc1ccc([C@@H]2N[C@@H](C(=O)O)Cc3c2[nH]c2ccccc32)c(OC)c1OC 4012430 NEEYWOPERFZLCV-WBVHZDCISA-N 382.416 2.882 0 50 GFAA biogenic O=C(OC[C@H]1OC(=O)C(F)(F)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 4975969 SHHNEUNVMZNOID-HUUCEWRRSA-N 376.311 2.630 0 50 GFAA in-vitro CC(C)c1ccc([C@H](N)CNC(=O)c2cc(N3CCNC3=O)ccc2F)cc1 225468376 GVCYNPSKYIJISA-LJQANCHMSA-N 384.455 2.909 0 50 GFAA CCCO[C@H]1CCCN(C(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)CC1 225401825 XCUMXPKSPFGGJX-SFHVURJKSA-N 397.560 2.737 0 50 GFAA CC(C)N1[C@H]2CC[C@H]1CN(C(=O)NCC1CCN(CC(F)(F)F)CC1)CC2 249054658 CWXVWMXPVIMIJF-IRXDYDNUSA-N 390.494 2.917 0 50 GFAA C[C@@H](Cc1cnccn1)N1CCCn2nc(C(=O)Nc3ccccc3)cc2C1 65371096 PIGHYFZYUGYHRS-INIZCTEOSA-N 376.464 2.762 0 50 GFAA CCc1noc([C@@H](C)NC(=O)c2cc(Cn3c(C)nc4ccccc43)on2)n1 67472870 JPYMZTHDZNRHMI-LLVKDONJSA-N 380.408 2.817 0 50 GFAA O=C1N(Cc2nnc3n2CCCCC3)C(O)=N[C@]12CCc1cc(Cl)ccc12 330346256 GHIXDSFEAFKUAJ-IBGZPJMESA-N 385.855 2.756 0 50 GFAA CCn1cc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 2809387 DOLNZHMTHIGWGW-GJZGRUSLSA-N 390.484 2.795 0 50 GFAA COCc1nc([C@H]2C[C@@H](NC(=O)c3c(F)ccc(C)c3Cl)C2)cc(=O)[nH]1 219319326 KUKWLSWAIBVYNG-XYPYZODXSA-N 379.819 2.693 0 50 GFAA O=C(N[C@H](C(=O)Nc1cn[nH]c1)c1ccccc1)c1ccc(-c2cc[nH]n2)s1 431905615 VVJIFDDCCOGCLN-KRWDZBQOSA-N 392.444 2.971 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3ccccn3)C[C@H]21 329058091 TXWTWOPBOZIBOG-CVEARBPZSA-N 398.511 2.502 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 125944403 IWGVSNNVVHOBSF-UYAOXDASSA-N 396.487 2.930 0 50 GFAA COCCN1CC[C@H](NC(=O)N2CCC(c3cccc4cnccc34)CC2)C1 365458415 FCLYIEIKSSASML-IBGZPJMESA-N 382.508 2.845 0 50 GFAA CC[C@@H]1CCc2nc(NC(=O)[C@H]3COCCN3CC(F)(F)F)sc2C1 332216190 WUVPVYWDHSVPMK-ZYHUDNBSSA-N 377.432 2.860 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CN(C[C@@H](C)c2ccccc2)C(=O)O3)[nH]n1 72427241 RAECAGXSDWBWMG-OAHLLOKOSA-N 382.464 2.949 0 50 GFAA CCCN(C(=O)c1nnn(C2CCNCC2)c1C)[C@@H]1C[C@@H](OCC)C1(C)C 236741200 QXFYXUPEBFPCLM-IAGOWNOFSA-N 377.533 2.567 0 50 GFAA O=C(Cn1cnccc1=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 490430140 VVYKNSPZLYMKLA-MRXNPFEDSA-N 382.807 2.868 0 50 GFAA CC(C)N(C)C(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72147055 PVVPUWZSJCGIEH-QFIPXVFZSA-N 393.531 2.876 0 50 GFAA O=C(N[C@H](C(=O)O)[C@@H]1CCCOC1)c1ccc(COc2ccc(F)cc2)o1 262697262 ABYSFXPMDMJYBR-PXAZEXFGSA-N 377.368 2.607 0 50 GFAA CN(C[C@H]1CCOC1)C(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 237241200 RIIGMEHUKSAZCO-LLVKDONJSA-N 397.353 2.698 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71765575 HMENXBWBCFVHCZ-IBGZPJMESA-N 382.508 2.667 0 50 GFAA O=C(O)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1CC(=O)Nc2ccccc21 238124597 LAOOGIOQZBYKGN-AWEZNQCLSA-N 388.370 2.894 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCC3(CC2)c2ccccc2C[C@@H]3O)CC1 72151876 FYJVKRHLVFNRFA-QFIPXVFZSA-N 391.515 2.637 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3ccccc3N3CCOCC3)c2)n1C 378218793 PUSQNZKCPWDHKS-UHFFFAOYSA-N 377.448 2.879 0 50 GFAA O=C(Nc1ccccc1N1CCc2ccccc21)N[C@H]1COC[C@H]1n1ccnn1 284622990 RWOQHMWLODEKQE-FXAWDEMLSA-N 390.447 2.734 0 50 GFAA Cc1ccccc1OC[C@H](O)CN1CCc2c(cccc2N2CCOC2=O)C1 174063974 UWWDQDOYHIIQHB-GOSISDBHSA-N 382.460 2.750 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N2CCn3nc([C@H](C)O)cc3C2)cc1C 223446803 DGMNSGRCRGSWSG-HNNXBMFYSA-N 385.464 2.649 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N3CCCN(Cc4ccccc4F)CC3)c2n1 82133585 JEVXKZCSVZVSES-UHFFFAOYSA-N 381.455 2.833 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc(-c2cc(C(=O)N3CCCC3)ccn2)cc1 426497060 BHYZRGBNCPRPJX-LJQANCHMSA-N 379.460 2.893 0 50 GFAA CCCN1CCC(N2C[C@@H](NCC3CCCCC3)C[C@H]2C(=O)NCC)CC1 20912019 XVMFECBTZVDHCT-FPOVZHCZSA-N 378.605 2.610 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)Cn1c(=O)oc2ccccc21 91871769 JIMVRROYEJEJSP-ZDUSSCGKSA-N 389.415 2.632 0 50 GFAA CC(=O)Nc1ccc(CN2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)cc1 95379964 HUOGHZPLGCSVBW-WIYYLYMNSA-N 378.476 2.777 0 50 GFAA Cc1cc(N2CCC(N[C@H](Cn3ccnc3)c3ccccc3)CC2)nc(N)n1 95365512 NHRGVJIUUTWBOF-LJQANCHMSA-N 377.496 2.564 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(Cc1nnc(-c3ccccc3)o1)C2 95375713 ARRKLHWUJRJWNQ-SJLPKXTDSA-N 389.459 2.868 0 50 GFAA COc1cc(CCC(=O)N2CC[C@H](N(C)C)[C@H](CCC(=O)O)C2)ccc1C 91391393 NKOBPZHDSPHRAW-MSOLQXFVSA-N 376.497 2.580 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c(C)o1 91451984 VXSHEKGNUKYHFS-OAQYLSRUSA-N 384.480 2.707 0 50 GFAA COc1ccc(C(=O)N2CCC([C@H](O)c3cccs3)CC2)cc1OCCN 426478162 UCURIKVEUGBARF-IBGZPJMESA-N 390.505 2.680 0 50 GFAA O=C(CCn1c(CO)nc2ccccc21)NCc1cc(-c2ccccc2)on1 96133268 GGFCHRUHVDGGAO-UHFFFAOYSA-N 376.416 2.890 0 50 GFAA O=C(CN1CCN(C23CC4CC(CC(C4)C2)C3)CC1)Nc1cccc2nonc12 22752280 SHUQZSHDMMAGEV-UHFFFAOYSA-N 395.507 2.748 0 50 GFAA O=C(NCc1nnc2n1CCCCC2)Nc1cnn(Cc2ccccc2F)c1 96142029 RWWOYSNYMRCZMK-UHFFFAOYSA-N 383.431 2.710 0 50 GFAA CC(C)C(=O)N1CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC1 95508200 AIUSQZSGTAPERS-UHFFFAOYSA-N 395.931 2.657 0 50 GFAA O=C(NC1CCN(Cc2ccccn2)CC1)c1cccc(Cn2cccn2)c1 91725117 MNVHFVPEWDMXKG-UHFFFAOYSA-N 375.476 2.721 0 50 GFAA COC(=O)[C@@H]1[C@@H](c2ccccc2)[C@H](C(=O)N2CCOCC2)[C@H]1c1ccccc1 239309133 HFJKDTBIAOUSBU-FXELSEDVSA-N 379.456 2.832 0 50 GFAA CCc1cc(C(=O)NCc2cc3n(n2)CCCN(C(=O)C2CCC2)C3)cs1 91518635 BUFDGBCPWSPLRO-UHFFFAOYSA-N 386.521 2.969 0 50 GFAA O=C(c1ccc(=O)n(-c2ccccc2)n1)N(Cc1ccccc1)[C@@H](CO)C1CC1 181448329 VVRQJAUWDBIBEH-NRFANRHFSA-N 389.455 2.646 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)Nc1cccc(OC)c1 252346755 AALVAOSULXSDMX-IWMITWMQSA-N 395.503 2.879 0 50 GFAA O=C(NCc1csc(Br)c1)[C@H]1CC[C@@H](C(F)(F)F)NC1=O 298471280 PZSIHCBQKCPRQD-SFYZADRCSA-N 385.205 2.584 0 50 GFAA c1cncc(CN2CCN(Cc3ccc(OC[C@H]4CCCNC4)cc3)CC2)c1 299776826 DJNKDUVZYBQVRO-QFIPXVFZSA-N 380.536 2.778 0 50 GFAA O=C(NCCOc1cccc2cccnc12)C1(N2CCOCC2)CCCCC1 827661171 JRFOOZCGXUWPCN-UHFFFAOYSA-N 383.492 2.765 0 50 GFAA CN(CCN1CCCCCC1)C(=O)c1ccc(-c2cnc3ncnn3c2)cc1 584895912 GLROYILVTQIUPN-UHFFFAOYSA-N 378.480 2.739 0 50 GFAA O=C(NCCc1noc(-c2ccccc2)n1)c1ccccc1N1CCOCC1 952989675 OGMCZMNOOZZZNN-UHFFFAOYSA-N 378.432 2.546 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)c1ccccc1N1CCOCC1 952982900 QEPISYFCFATMQZ-UHFFFAOYSA-N 381.476 2.608 0 50 GFAA C[C@H](C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccc(Cl)s1 275867469 ZRDBLMDTRWVIPA-RYUDHWBXSA-N 379.917 2.610 0 50 GFAA COc1cccc(C2(C(=O)N3CCN(c4ccnc(C)n4)CC3)CCCC2)c1 185399022 LPOCADRQIDSFAF-UHFFFAOYSA-N 380.492 2.954 0 50 GFAA COCCC1(CNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)CCCCC1 170599333 SWXOEBVTIICEHT-IAGOWNOFSA-N 378.513 2.655 0 50 GFAA O=C(NCc1ccccc1N1CCCCC1)[C@H]1CC12CCS(=O)(=O)CC2 187220689 YCFXQNCLHCZRFF-QGZVFWFLSA-N 376.522 2.508 0 50 GFAA O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N[C@H]1CCCc2c(O)cccc21 190316152 QOGKNYLXACAZPX-INIZCTEOSA-N 383.839 2.893 0 50 GFAA CN(Cc1cccnc1)C[C@H]1CCN(S(=O)(=O)c2cccc3ncccc23)C1 192935209 UEDIHPOBKLMXTA-GOSISDBHSA-N 396.516 2.772 0 50 GFAA CCCCN1CCC(NC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1 194954291 WQGXIHCQGWBROB-UHFFFAOYSA-N 399.539 2.941 0 50 GFAA Cc1nc2sccn2c1C(=O)N1C[C@H](Cc2ccnc3ccccc23)[C@@H](O)C1 1615964755 WZAVUMFOYWKJFO-YJBOKZPZSA-N 392.484 2.928 0 50 GFAA O=C(NC[C@H]1CCCN(c2ncc(Cl)cc2F)C1)c1cc2ncccn2n1 1506420525 HJAYXJVOZKFXKY-GFCCVEGCSA-N 388.834 2.563 0 50 GFAA Cc1nc(CN2C[C@H]3CN(C(=O)C4CCC4)C[C@]3(CCc3ccccc3)C2)n[nH]1 1772708427 BGVIIWLSJLGYEM-REWPJTCUSA-N 393.535 2.806 0 50 GFAA O=C1CCCN1CCC1CCN(c2nc3nonc3nc2NC2CCCC2)CC1 12594531 AAMOUCVYAREJMI-UHFFFAOYSA-N 399.499 2.596 0 50 GFAA Cc1ccc(N(CCCC(=O)NCc2ccncc2)S(C)(=O)=O)cc1C 13678241 PKQRMYCSFHMVEF-UHFFFAOYSA-N 375.494 2.561 0 50 GFAA CC(C)N1C(=O)N(CCc2ccccc2)C2(CCN(C3CCOCC3)CC2)C1=O 14543083 VGLNHALKFQCDPE-UHFFFAOYSA-N 399.535 2.915 0 50 GFAA COc1ccc(N(CC(=O)Nc2cc(C)ccc2C)S(C)(=O)=O)c(OC)c1 15769481 NJNHSCGOJUUBPL-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA Cc1ccccc1NC(=O)[C@H](C)N(c1ccc2c(c1)OCCO2)S(C)(=O)=O 16577102 RCAAUAQAIVPTLW-AWEZNQCLSA-N 390.461 2.559 0 50 GFAA Cc1cccc(N2CCN(Cc3cccc(-c4nc(C)cc(=O)[nH]4)c3)CC2)n1 19114130 AHHBJLUTYJDJLV-UHFFFAOYSA-N 375.476 2.771 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19681847 XDPLINGRRZIOKT-UHFFFAOYSA-N 394.880 2.575 0 50 GFAA COc1ccc(CC(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)cc1 169779698 VLYNPZDBALWBSR-UHFFFAOYSA-N 392.459 2.518 0 50 GFAA COC(=O)C1(NC(=O)C[C@@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)CC1 1857671529 HARLJGONXMBZMV-LBPRGKRZSA-N 391.855 2.910 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc(OC)c(OC)c1 1857678345 WEMBEUXIYKBQPV-BOFPYLFWSA-N 397.493 2.589 0 50 GFAA Cn1ccnc1CN1CCO[C@@]2(CCN(CCCCOCc3ccccc3)C2)C1 1857694063 YYPRHZHIPWNUKC-HSZRJFAPSA-N 398.551 2.694 0 50 GFAA O=C(c1ccccc1OC(F)(F)C(F)F)N1CCO[C@H]2C[C@H](CO)C[C@@H]21 1857695664 SUSIBJCYXYMBAR-OSMZGAPFSA-N 377.334 2.535 0 50 GFAA O=C(O)c1cccc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857716788 FEDLSCPRBQDFLP-KNKQGSTJSA-N 378.428 2.659 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(Cl)s3)C[C@]23CC[C@H]1O3 1857731958 VROXBRNEUQSAIL-ZOMKSWQUSA-N 386.970 2.860 0 50 GFAA OC[C@H]1CCN(Cc2ccc(OCCCCN3CCCCC3)cc2)C[C@H]1O 1875240996 NNAYEYCTZGJFSK-IFMALSPDSA-N 376.541 2.507 0 50 GFAA CC(=O)N1CCN(c2nnc(C3CC3)n2C[C@@H]2CCCO2)CC12CCCCC2 328802607 CGEYTMQRLYFTBJ-SFHVURJKSA-N 387.528 2.706 0 50 GFAA CN(Cc1cccc(-c2nc(C3CCOCC3)cc(=O)[nH]2)c1)Cc1cc[nH]n1 23543774 VFSAZNNNNXKVBF-UHFFFAOYSA-N 379.464 2.686 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)NC2CCC(c3nc(C)no3)CC2)C12CCOCC2 369650215 VRXCWBYKMUUQRE-SJJHQCBESA-N 392.500 2.678 0 50 GFAA CS(=O)(=O)N1CCCN(Cc2nc(-c3c(F)cccc3F)cs2)CC1 158613121 OJZNUMNJNBHGJV-UHFFFAOYSA-N 387.477 2.556 0 50 GFAA C[C@H](N1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1)C(F)(F)F 267398858 JAAKDXSCTOVQRM-INIZCTEOSA-N 383.458 2.994 0 50 GFAA Cc1cccc(-c2nnc([C@H](C)N(C)Cc3ccccc3S(N)(=O)=O)o2)c1 814656040 OQQCUGFIURHGEE-AWEZNQCLSA-N 386.477 2.885 0 50 GFAA NC(=O)C1(NC(=O)c2csc(-c3ccc(F)c(F)c3)n2)CC(C(F)F)C1 1875297129 DARFOTZBPCIJPZ-UHFFFAOYSA-N 387.358 2.717 0 50 GFAA O=C(NCC1(c2ccccc2Cl)CCOCC1)[C@@H]1CNCC[C@]12CCOC2 1875277091 GFCOMBKLQIEYBK-LAUBAEHRSA-N 392.927 2.521 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(F)cc1OC)C[C@H](C)O[C@@H]2C 1875315745 GGYUCAGVMGLOFY-QWHCGFSZSA-N 391.443 2.629 0 50 GFAA C=CC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)CCc1nc2ccccc2o1 1875371140 QJARYLUPHYPRRY-VGOFRKELSA-N 375.428 2.845 0 50 GFAA CCN1CCN(c2ccc(C(F)(F)F)cc2NC(=O)N[C@H](C)CCO)CC1 1875339396 IIUPFNIWKNIIDJ-CYBMUJFWSA-N 388.434 2.740 0 50 GFAA COCCn1nc(C(=O)NCc2ccc(F)cc2OC)c2c1[C@H](C)O[C@H](C)C2 1875404052 RVMINHVUZNPDJK-OLZOCXBDSA-N 391.443 2.629 0 50 GFAA CC(C)C[C@H](NC(=O)c1cscc1C(F)(F)F)C(=O)N1CCOCC1 888100882 NHZHGGZGFIMYPN-ZDUSSCGKSA-N 378.416 2.770 0 50 GFAA COc1cc(C)c(-c2csc(NC(=O)Cc3cnc(O)nc3O)n2)cc1C 2100557009 LWNSXDLDIZQJQC-UHFFFAOYSA-N 386.433 2.818 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CC[C@@H](c2ccon2)C1 2325774506 QOCGOXZLUYGJAK-BZNIZROVSA-N 392.818 2.772 0 50 GFAA Cc1ccccc1NC(=O)CSc1nn2c(=O)c(C(C)(C)C)nnc2s1 629324 ZIHFIOXLGURHDA-UHFFFAOYSA-N 389.506 2.883 0 50 GFAA Cc1ccc(N([C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)S(C)(=O)=O)cc1 1057403 IZCZRDPCZHPCJK-CQSZACIVSA-N 390.461 2.559 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 1128975 YJQWCKFPMYMHFS-GFCCVEGCSA-N 376.434 2.744 0 50 GFAA CN1C(=O)[C@@H](CC(=O)Nc2ccc(F)cc2)N(Cc2ccc(F)cc2)C1=S 1185075 TZMULPPLVOOASK-MRXNPFEDSA-N 389.427 2.921 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@H](C(=O)c2cccs2)[C@@](O)(C(F)(F)F)N1 4171827 DJGDSNJZNRODIA-LALPHHSUSA-N 388.342 2.991 0 50 GFAA CN1[C@H]2CC[C@H]1CN(C(=O)NCc1ccc(NC(=O)c3cccnc3)cc1)CC2 246474968 VOFAXMSPGVTATB-PMACEKPBSA-N 393.491 2.712 0 50 GFAA C[C@@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)N1CCOCC1 52524580 DFGIFZVRHVLYED-IBGZPJMESA-N 382.508 2.557 0 50 GFAA C[C@H](C(=O)N1CCc2onc(-c3ccc(Cl)cc3)c2C1)N1CCOCC1 67770208 GRFYGMHXDBVMOZ-CYBMUJFWSA-N 375.856 2.600 0 50 GFAA C[C@@H]1CCCC[C@H]1OCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1 248113172 YVICTHXNCOAIDP-BHIYHBOVSA-N 394.537 2.551 0 50 GFAA COCCN1CCN(C(=O)c2csc(-c3ccccc3OC)n2)C[C@@H]1C 117295084 WICMSKALODEOJF-AWEZNQCLSA-N 375.494 2.611 0 50 GFAA Cc1ccc(Sc2cc(N3CCN(Cc4ncc[nH]4)CC3)nc(N)n2)cc1 65497656 VPDSJSWJQSADML-UHFFFAOYSA-N 381.509 2.564 0 50 GFAA O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N[C@@H]1CCCN(c2ccccc2)C1 474823283 SVMMQRZSZARLJF-QGZVFWFLSA-N 396.882 2.779 0 50 GFAA Cc1nn(CCc2nnc(-c3nn(C)cc3Br)o2)c(C)c1Cl 2786322 PNQPXVXEOOJASG-UHFFFAOYSA-N 385.653 2.942 0 50 GFAA Cc1c(Cl)c(C(F)(F)F)nn1[C@@H](C)c1nc2c3cnn(C)c3ncn2n1 2802436 CZROLDQJYCIOAV-ZETCQYMHSA-N 384.753 2.797 0 50 GFAA O=C(NCc1ccccc1Cn1cccn1)Nc1ccn(Cc2ccncc2)n1 172368423 PVXUUUHWUDAAIU-UHFFFAOYSA-N 387.447 2.893 0 50 GFAA CCS(=O)(=O)Nc1ccccc1-c1nc(CNC(=O)c2ccco2)c(C)o1 11841074 NDQXWQONFKXFML-UHFFFAOYSA-N 389.433 2.935 0 50 GFAA CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)C(=O)Nc1ccccc1N1CCCCCC1 121843700 JJDDNUKJIZUXGE-LZQZEXGQSA-N 385.508 2.935 0 50 GFAA O=c1oc2ccccc2n1CCN1CCN([C@H]2CCc3ccccc3C2)CC1 216251104 NQTXXVLDRMVCRQ-FQEVSTJZSA-N 377.488 2.770 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)CCc1cccnc1)C2 72172714 WTTXYDOOLAOECL-UHFFFAOYSA-N 388.475 2.517 0 50 GFAA Cn1ncc2c(=O)n(CC(=O)Nc3ccccc3Sc3ccccc3)cnc21 14020053 MDBXTEDCBKAZTD-UHFFFAOYSA-N 391.456 2.920 0 50 GFAA CS(=O)(=O)c1nc2ccccc2n1C[C@H]1CCN(C(=O)c2ccccc2)C1 282248643 RBBDLSPZJAQVKT-HNNXBMFYSA-N 383.473 2.602 0 50 GFAA CC(C)Oc1cccc(C(=O)[C@@H]2CCCN(CC(=O)Nc3cnn(C)c3)C2)c1 71755075 ZLMSWJQLVICJIZ-QGZVFWFLSA-N 384.480 2.741 0 50 GFAA CCCn1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)c1C 39399430 SCIULDHHTKFWQU-LJQANCHMSA-N 392.494 2.949 0 50 GFAA O=C(CCc1cc2n(n1)CCNC2)N[C@@H](c1ccccc1)[C@H](O)c1ccccc1 72429842 FQVBMCVFCJKMIY-XZOQPEGZSA-N 390.487 2.510 0 50 GFAA Cc1cc2occ(CC(=O)Nc3ccnn3[C@@H]3CCS(=O)(=O)C3)c2cc1C 174217591 KSOIIVOORVQOGM-OAHLLOKOSA-N 387.461 2.787 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCCO1 77323427 UDYOMJXIWKRADB-CUWPLCDZSA-N 392.455 2.857 0 50 GFAA Cn1nccc1[C@H](O)c1cc2n(n1)CCN(Cc1ccc(F)c(Cl)c1)C2 221318239 GGXKRWGKKMSSNS-GOSISDBHSA-N 375.835 2.507 0 50 GFAA CC(=O)c1ccc(C(=O)NCCc2nc3sc(C)c(C)c3c(=O)[nH]2)s1 223904727 RSOCSANRQOYNCN-UHFFFAOYSA-N 375.475 2.838 0 50 GFAA CCCn1ncc(CN2CCC3(CCC(=O)N(CCCOC)C3)CC2)c1C 91596119 WKUYCIAORMBPNB-UHFFFAOYSA-N 376.545 2.843 0 50 GFAA CCc1cnc(C)nc1N1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1 91468516 RXEUYRMZKMNDJE-UHFFFAOYSA-N 394.523 2.855 0 50 GFAA Cn1cnnc1[C@@H]1CCCN(C(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 292848155 QYJQSGDRHHIASZ-QGZVFWFLSA-N 386.471 2.700 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)N(C)CC3)N2CCOCC2)o1 180244021 GRIAZPGTCYRLLF-IBGZPJMESA-N 384.480 2.775 0 50 GFAA CC1(C)O[C@@H]2O[C@H](COC(=O)c3ccccc3Cl)[C@@H]3OC(C)(C)O[C@H]3[C@@H]2O1 247953549 LBWVFYWBICENNB-NMNMXBMNSA-N 398.839 2.893 0 50 GFAA Cc1ncnc(N2CCN(CC(=O)Nc3ccc(OC(C)C)cc3)CC2)c1C 243932698 BYCKBHMUNGLUAS-UHFFFAOYSA-N 383.496 2.641 0 50 GFAA CO[C@@H]1Cc2ccccc2N(C(=O)Nc2ccccc2N(C)S(C)(=O)=O)C1 297643833 MVIKBFZHAFHMAE-OAHLLOKOSA-N 389.477 2.692 0 50 GFAA CCn1ccnc1CN(C)C(=O)N[C@@H](C)c1nc(-c2ccc(OC)cc2)no1 534653244 IWRBOBOONPBWMU-ZDUSSCGKSA-N 384.440 2.864 0 50 GFAA CCOc1ccccc1CN[C@H]1CNC(=O)c2cc(-c3ccc(OC)cc3)nn21 263616474 IWYCSOKAMXOHNB-OAQYLSRUSA-N 392.459 2.989 0 50 GFAA CCS(=O)(=O)Nc1cccc(N2CCC(NCCc3ccncc3)CC2)c1 299756775 IVMVLBNIAXGMEZ-UHFFFAOYSA-N 388.537 2.644 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)cc2)CC1 823764837 KDQWCAWVJUHHOM-INIZCTEOSA-N 385.508 2.889 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNCc2cn(C)nc2-c2ccccc2)cc1 952986213 KAWQOGOKUXBBHB-UHFFFAOYSA-N 398.532 2.854 0 50 GFAA CO[C@@H](CNC(=O)N1CCC(C)(C)S(=O)(=O)CC1)c1ccc(Cl)cc1 278212402 KLDJCEGWGUFGBK-HNNXBMFYSA-N 388.917 2.636 0 50 GFAA Cc1ccc(-n2nnc(C(=O)NC[C@H]3Cc4ccccc4N(C)C3)c2C)cc1 170602409 IATZCVHYHYXYIU-QGZVFWFLSA-N 375.476 2.923 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CCN1Cc1ccccc1 170600284 PZYWCRGXMSPFJE-PVAVHDDUSA-N 397.441 2.709 0 50 GFAA CCCC(=O)N1CCCC[C@@H]1C(=O)Nc1nnn(Cc2ccccc2F)c1C 192369863 VWAJPBBQRTUKRW-QGZVFWFLSA-N 387.459 2.894 0 50 GFAA CN(CCOc1cccc(CNC(=O)C[C@H]2CCCOC2)c1)C1CCOCC1 193132804 SYJRJGMREUVAAC-LJQANCHMSA-N 390.524 2.609 0 50 GFAA CCCc1cnc(N2CCC[C@@H](CNC(=O)Cn3nc(C)c(CC)c3C)C2)nc1 1506427469 WEVGEURNHZZXGM-IBGZPJMESA-N 398.555 2.838 0 50 GFAA COc1ccc(F)cc1[C@H](C(=O)O)N1CCN(c2ncnc3ccccc23)CC1 1506413666 STRLOHJZSQDVCP-LJQANCHMSA-N 396.422 2.725 0 50 GFAA CCOc1cc(CN2C[C@H]3CCCN3C(=O)[C@H]2C)ccc1OCCn1ccnc1 1772816593 WSHLNMRENWLSIX-IEBWSBKVSA-N 398.507 2.556 0 50 GFAA CN1CC2(CCN(C(=O)c3ccccc3-c3ccccc3F)CC2)OCC1=O 1772804756 SVPYPRWNFPHLCW-UHFFFAOYSA-N 382.435 2.956 0 50 GFAA COc1ccc2c3c([nH]c2c1)[C@H](C=C(C)C)N1C(=O)[C@@H]2CCCN2C(=O)[C@@H]1C3 5854773 DBEYVIGIPJSTOR-FHWLQOOXSA-N 379.460 2.942 0 50 GFAA endogenous,in-man O=C1N[C@H](CC(=O)N2CCC(CCC(=O)N3CCCC3)CC2)c2ccccc21 11879331 VZWXDLDHXKERPU-LJQANCHMSA-N 383.492 2.502 0 50 GFAA CN(CCC1CCOCC1)C(=O)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12052092 NBBVCMFHLIOEIU-LJQANCHMSA-N 390.499 2.882 0 50 GFAA Cc1ncsc1CCCNC(=O)c1cn(Cc2c(F)cccc2F)nn1 12571496 DLRPOPCYJZTFGM-UHFFFAOYSA-N 377.420 2.732 0 50 GFAA CCn1cc(CN2CC[C@]3(C2)Cn2c(nnc2-c2ccccc2Cl)CO3)cn1 1857670090 PWCWWMVWOWYKKY-FQEVSTJZSA-N 398.898 2.990 0 50 GFAA O=C(c1cc[nH]c1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857670400 MDLPCMHRDHCEMC-NRFANRHFSA-N 375.432 2.693 0 50 GFAA Cc1nc(C)c(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)o1 1857691867 ZJRQNVFGJCEROB-IXDOHACOSA-N 375.856 2.889 0 50 GFAA CCC(CC)C(=O)NC[C@H]1[C@H]2CN(C(=O)c3ccsc3)C[C@]23CC[C@H]1O3 1857713973 ZWNKQWVPPFIHBY-TVKQPGBESA-N 376.522 2.920 0 50 GFAA COCCCn1c(C(=O)N2CCCC[C@@H]2C)cc2c(=O)n3ccccc3nc21 5244279 NWSPVRIEKWGIHI-HNNXBMFYSA-N 382.464 2.700 0 50 GFAA O=C1C[C@H](c2nc(-c3cc(OC(F)F)ccc3F)no2)CN1c1cn[nH]c1 349652246 KQWMSFFFHCBSFP-QMMMGPOBSA-N 379.298 2.721 0 50 GFAA COC[C@@]1(C(=O)O)CCN(C(=O)c2cc(C)c(Br)c(Cl)c2)C1 263057155 QIAMRRYCBGYDPD-OAHLLOKOSA-N 390.661 2.974 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 264257340 CGJSEHZOPLXQLV-FQEVSTJZSA-N 389.499 2.794 0 50 GFAA COc1ccc(Cl)cc1C(F)(F)C(=O)N1CCO[C@]2(CCCOC2)C1 935917361 ZIENHYLMDQZMTO-MRXNPFEDSA-N 375.799 2.848 0 50 GFAA O=C1c2ccccc2CCN1NS(=O)(=O)c1ccc([C@@H]2CC2(F)F)cc1 1875290665 WEUYJKJANYGVTM-INIZCTEOSA-N 378.400 2.701 0 50 GFAA Cc1ccc(-c2nc(-c3cnn(CCO)c3)nn2[C@H]2C[C@H](C)O[C@H](C)C2)cn1 1875340542 HEVZRVSPBACQJP-JLVBRIDZSA-N 382.468 2.633 0 50 GFAA O=C(NC[C@@H]1C[C@H]1c1c(F)cccc1F)N1CCC2(CCC2)S(=O)(=O)CC1 886091708 MQXUPFOPPLAFEA-UONOGXRCSA-N 398.475 2.821 0 50 GFAA OCc1cn(CCCN[C@H](Cc2ccc(Br)cc2)C2CCC2)nn1 888096819 NELKPTZDSXTQMI-GOSISDBHSA-N 393.329 2.924 0 50 GFAA Cc1nc2c([nH]1)C[C@H](NC(=O)Cc1cn3cc(Cl)cc(Cl)c3n1)CC2 2325781361 IIULOAQKLLFKDE-LLVKDONJSA-N 378.263 2.889 0 50 GFAA CN=c1[nH]cnc2cc(C(=O)N3CCNC[C@H]3c3ccccc3Cl)ccc12 2325856864 GJANTFZNPYZXJX-SFHVURJKSA-N 381.867 2.534 0 50 GFAA O=C(C[C@@H]1Oc2ccccc2NC1=O)Nc1cccc([C@@H]2CCCC(=O)N2)c1 895189021 RCPRTOHDRFVNFU-YJBOKZPZSA-N 379.416 2.756 0 50 GFAA COc1ccc(C)cc1N(CC(=O)NCc1ccc(Cl)cc1)S(C)(=O)=O 879887 YFXDZKGICNWOPW-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA COC(=O)c1cc(NC(=S)NC(=O)c2ccc(F)cc2)cc(C(=O)OC)c1 1135132 VJBWCQJFWYORRQ-UHFFFAOYSA-N 390.392 2.526 0 50 GFAA COC(=O)c1sc(NC(=O)CSc2ccccn2)c(C(=O)OC)c1C 2641028 QMSQYFMDAMFWBA-UHFFFAOYSA-N 380.447 2.756 0 50 GFAA CCCn1nc(N(Cc2cc(C(N)=O)oc2C(C)(C)C)S(C)(=O)=O)cc1C 2356159289 UMRYDICNUDXLQJ-UHFFFAOYSA-N 396.513 2.557 0 50 GFAA CCn1ncc(NC(=O)Cn2ncc3cc(-c4ccc(OC)cc4)ccc32)n1 55308278 UBGWJYJWGFSOOQ-UHFFFAOYSA-N 376.420 2.962 0 50 GFAA COCCn1c(CN(C)Cc2ccccc2)cnc1S(=O)(=O)CCC(C)C 55042373 SRZDTSRFNLIHPZ-UHFFFAOYSA-N 393.553 2.981 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1cccc(C(F)(F)F)c1 100971671 YGMQTFAWIBFVRZ-GREKMHCPSA-N 378.350 2.841 0 50 GFAA C[C@@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2)n1)NC(=O)c1cc([C@@H](C)O)n[nH]1 117196038 BLIJXOOIHRSQRB-NWDGAFQWSA-N 398.854 2.670 0 50 GFAA investigational O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)N=c1[nH]c2ccccc2[nH]1 67640904 BRPJXEPMRGPRKK-UHFFFAOYSA-N 379.807 2.501 0 50 GFAA Cc1nc(N2CCCCC2)cc(N2CCN(C(=O)COc3ccccc3)CC2)n1 67629516 PJBGTZSFNWWOFV-UHFFFAOYSA-N 395.507 2.503 0 50 GFAA CN(C)CC(=O)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67908894 YZAOYZWNOXALFS-UHFFFAOYSA-N 383.473 2.952 0 50 GFAA COc1ccccc1Cn1ncc2c1NC(=O)C[C@@H]2c1ccc2c(c1)nnn2C 65406992 KKDVLTQUHGXATH-OAHLLOKOSA-N 388.431 2.696 0 50 GFAA CCOP(=O)(CN(CC(=O)O)CP(=O)(OCC)OCC)OCC 4948709 WFNGQLJDQRSKRW-UHFFFAOYSA-N 375.295 2.820 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)Nc2ccc(-n3ccnn3)cc2)C1 122133076 TYRZYXSUTSNNOS-MRXNPFEDSA-N 378.436 2.676 0 50 GFAA CN(C)CCN(C(=O)[C@H]1CC1(Cl)Cl)c1ccc(Br)cn1 328589909 PGSXMQALLPAVBR-SNVBAGLBSA-N 381.101 2.933 0 50 GFAA CC(=O)N[C@H](CC(=O)NCc1ccc(-n2ccnc2)nc1)c1ccc(Cl)cc1 363430962 KKCIUVALWDIBTI-GOSISDBHSA-N 397.866 2.804 0 50 GFAA O=C(CNC(=O)c1ccccc1OC(F)F)Nc1ncn(C2CCCCC2)n1 154007928 KTACZYJWUIIZKR-UHFFFAOYSA-N 393.394 2.753 0 50 GFAA C[C@H]1CN(C)c2ccccc2CN1C(=O)NCc1ccc(-n2ccnc2)nc1 364297927 USZMMYYFSXOMES-INIZCTEOSA-N 376.464 2.817 0 50 GFAA CN(CCCO)C(=O)CC[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71754100 NAPVODLICHXUKW-QHCPKHFHSA-N 380.488 2.765 0 50 GFAA COc1ccc(CN(CC2CCC2)C(=O)[C@H]2CCc3[nH]nnc3C2)c(OC)c1 286841315 UOXWGCSAGSDKBH-HNNXBMFYSA-N 384.480 2.756 0 50 GFAA Cc1cc(C)n(-c2ccc(=O)n(CC(=O)Nc3ccc(Cl)c(Cl)c3)n2)n1 40266685 UQMFFBLTYSHLDH-UHFFFAOYSA-N 392.246 2.991 0 50 GFAA CC1(C)CC(CC(=O)N2CCC(n3cc(C(C)(C)O)nn3)CC2)CC(C)(C)N1 48488388 JCWRIZTUYRXRPO-UHFFFAOYSA-N 391.560 2.616 0 50 GFAA O=C(c1ccc[nH]1)N1CCN(C2CCN(c3nc4ccccc4o3)CC2)CC1 95383543 FWAPKWIZWDTFOT-UHFFFAOYSA-N 379.464 2.583 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95503198 GXAWXPMQEYUSCD-MRXNPFEDSA-N 384.509 2.689 0 50 GFAA Cc1cc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)nc(N(C)C)n1 95521587 ALMPRLSOGSVUFP-SFHVURJKSA-N 377.496 2.875 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@H]1CCCN1)CC2 95506233 NQPNSSHFOBRWFT-HXUWFJFHSA-N 381.451 2.644 0 50 GFAA O=C(c1ccc([C@@H]2CCCNC2)cc1)N1CCN(Cc2cccc(O)c2)CC1 95358877 AHUACIWHRISORN-OAQYLSRUSA-N 379.504 2.817 0 50 GFAA O=C(c1cccc2c1CCCC2)N1CCOC[C@H]1c1ncn(CC(F)(F)F)n1 296527293 AKPQVRTVXZJHNV-INIZCTEOSA-N 394.397 2.933 0 50 GFAA CC(C)c1nnc2n1C[C@@H](NC(=O)N1Cc3cnn(-c4ccccc4)c3C1)CC2 297250581 JIBNANYMQWUWSI-INIZCTEOSA-N 391.479 2.627 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CC[C@@H]4OCc5cnnn5[C@H]4C3)coc2c1C 299800336 WEVDLYDHMVULRV-ROUUACIJSA-N 380.448 2.864 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC2(CC1)C[C@@H]2C(=O)Nc1cc(C)cc(C)c1 299800979 XKJWVLCLLOIMIM-UXHICEINSA-N 397.519 2.882 0 50 GFAA Cc1cccc(CN(C[C@H]2CCCO2)S(=O)(=O)c2cc(C(N)=O)cs2)c1 825216269 YAHMIPZSTARKMH-MRXNPFEDSA-N 394.518 2.525 0 50 GFAA O=C(NCC1CCN(C(=O)Cc2c(F)cccc2Cl)CC1)[C@H]1CCCO1 952967853 CENDOINSONGYGD-QGZVFWFLSA-N 382.863 2.555 0 50 GFAA Cc1ccc(OCC(=O)N2CCC[C@@H](CNC(=O)Cc3cccnc3)C2)cc1C 952973821 IGHMTRKBFLNIIY-FQEVSTJZSA-N 395.503 2.675 0 50 GFAA Cc1ccoc1C(=O)NCC1CCN(C(=O)Cc2cnc3c(C)cccn23)CC1 952979180 MQXQLUBQPMRTRQ-UHFFFAOYSA-N 394.475 2.755 0 50 GFAA CCCOc1c(Cl)cccc1NC(=O)c1cn(C[C@H]2CCCNC2)nn1 952986481 IXUSOEXSCCCRFQ-ZDUSSCGKSA-N 377.876 2.972 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)CCn1cccn1)CC2 275768470 SCALNSDEDNTRQH-SFHVURJKSA-N 386.521 2.765 0 50 GFAA O=C(N1CCC(Cc2ccccc2)CC1)N1CCC(N2CCCNC2=O)CC1 278836545 RCSINVMRWONQEB-UHFFFAOYSA-N 384.524 2.941 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)C2)no1 170616840 INPCZXPBOHDWBT-LEWJYISDSA-N 384.524 2.924 0 50 GFAA CO[C@@H](C)[C@H](C)N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 191722070 OSOMUIGGRXSHOB-MJBXVCDLSA-N 380.444 2.802 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cc(F)ccc3-n3nc(C)cc3C)C[C@@H]2O)on1 1529107136 WQPVEUVSYJWKKD-UTKZUKDTSA-N 384.455 2.960 0 50 GFAA COc1ccc([C@@H](CC(=O)NCCCO)c2ccc3cccnc3c2O)cc1 1776111823 RVYYKHCMPWPIGM-LJQANCHMSA-N 380.444 2.970 0 50 GFAA C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCN(c2ncccn2)CC1 12380506 IBXNVGXHCGJTBW-GFCCVEGCSA-N 381.263 2.900 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)c3cc(CC(C)C)nc(N)n3)C2)cc1 12436112 JUHOBFAIVDGQKT-MRXNPFEDSA-N 383.496 2.983 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCCCC3)cc(-n3cnnn3)c2)cc1OC 15006665 DJGFZRCFRMDZPT-UHFFFAOYSA-N 393.447 2.973 0 50 GFAA Cn1c(C(=O)N2CCC(CCC(=O)N3CCOCC3)CC2)cc2ccccc21 15079935 XEHBVTNFGVCZHJ-UHFFFAOYSA-N 383.492 2.670 0 50 GFAA O=C(CCCOc1ccccc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19953081 BVDBHZMWAAOOHF-UHFFFAOYSA-N 382.460 2.919 0 50 GFAA COc1cc(=O)n2c(c1C(=O)N1CCN(c3ccc(C)cc3C)CC1)CCCC2 169752843 UQEZBRVPWDIYHL-UHFFFAOYSA-N 395.503 2.772 0 50 GFAA CCOc1ccccc1C(=O)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779728 SGSROZBQTVMICA-UHFFFAOYSA-N 392.459 2.979 0 50 GFAA COc1cc(Oc2cc(C(=O)NCC3CCNCC3)ccc2OC)ccc1CN 1857693080 HGUFEWDLCFZURD-UHFFFAOYSA-N 399.491 2.684 0 50 GFAA O=C1NCCC[C@]12CN(c1ccnc3c(C(F)(F)F)cccc13)CC[C@@H]2O 1857702820 PWOUVZRLLKVRLV-MAUKXSAKSA-N 379.382 2.721 0 50 GFAA Cc1c(C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cnc2ccnn12 1857709112 GDNQJDJNVWGMHI-UHFFFAOYSA-N 386.459 2.679 0 50 GFAA CC(C)CC(=O)NC[C@H]1[C@H]2CN(C(=O)NC3CCCCC3)C[C@]23CC[C@H]1O3 1857712592 RLTVTHJXDJYPGA-XKGFGPFHSA-N 377.529 2.670 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N1CCC[C@H]1c1nc(C(C)C)no1 1857740277 LOSHSUNLODXPNR-ZDUSSCGKSA-N 391.497 2.772 0 50 GFAA Cc1cnc2c(C(=O)N3CCc4c(-c5ccccc5)nn(C)c4CC3)cnn2c1 1875247021 PIHDUKOTCYHLPI-UHFFFAOYSA-N 386.459 2.679 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CC[C@H](c3ccc4c(c3)OCO4)[C@@H](O)C2)c1C 210196637 QSFWUAUBVWWZHJ-CVEARBPZSA-N 384.432 2.553 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3nncn3C)C2)cc1C(F)(F)F 225523778 CWMIHUHRMOBXRE-GFCCVEGCSA-N 388.415 2.711 0 50 GFAA CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCO[C@@H](CC(=O)O)C1 237019291 ZDMILKFNYBDYTC-ZFWWWQNUSA-N 384.270 2.720 0 50 GFAA Cn1cc(N2CCN(C(=O)Nc3ccn(-c4ccccc4Cl)n3)CC2)cn1 129571898 QTHGEHWTGARPBW-UHFFFAOYSA-N 385.859 2.613 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCc2ccccc2[C@H]1C(N)=O)c1ccc(Cl)cc1 370787773 HMKTYDLNSRUHOS-ICSRJNTNSA-N 399.878 2.519 0 50 GFAA CC(C)C(=O)N1CCC(C(=O)Nc2cc(C(C)(C)C)nn2-c2ncccn2)CC1 264680523 ZUCKSTPJUFYWPS-UHFFFAOYSA-N 398.511 2.793 0 50 GFAA CC(=O)Nc1ccc(CNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)cc1 811998553 ZRWOIXFTDATIEH-INIZCTEOSA-N 375.375 2.726 0 50 GFAA C[C@@H]1C[C@H](NC(=O)N2Cc3cnn(-c4ccccn4)c3CC(C)(C)C2)CCN1C 952890936 NYJFMCZBCSULTB-SJLPKXTDSA-N 396.539 2.844 0 50 GFAA CN(CC(F)(F)F)C1CCN(c2nnc(-c3cn[nH]c3)n2CC2CC2)CC1 1875268608 CKYZEUHZIGUYJE-UHFFFAOYSA-N 383.422 2.541 0 50 GFAA COc1ccc2c(c1)CC[C@@H](NC(=O)[C@@H](C)n1c(C)nc3ccccc3c1=O)C2 1875259192 LGPOMJUPGUYIPZ-RDTXWAMCSA-N 391.471 2.948 0 50 GFAA CCCOc1ccc2[nH]cc(CC(=O)NC[C@@H](CO)Cc3ccncc3)c2c1 1875274300 GRMKBFXKQVMLJO-KRWDZBQOSA-N 381.476 2.862 0 50 GFAA CCn1c(-c2cc3c(F)c(F)ccc3[nH]2)nnc1N1CC[C@H]2OC(=O)O[C@H]2C1 1875279267 KOOJKLODQQJFKW-KGLIPLIRSA-N 389.362 2.839 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N(Cc2scnc2C)C[C@@H]2CCNC2)n1 876818735 YEMXSLVUCJGLGN-GFCCVEGCSA-N 399.442 2.821 0 50 GFAA C=CC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)Cc2noc3ccccc23)C1 1875383396 RVGYGNHQPIDBHP-LBEPJEHYSA-N 389.455 2.889 0 50 GFAA O=C(Nc1ccc(=O)n(Cc2ccc(F)cc2F)c1)[C@@]12C[C@H]3CC[C@H](N3)[C@@H]1C2 1875394070 TZGKQWXZNLXIJP-NHAHXKBOSA-N 385.414 2.644 0 50 GFAA Cc1nc(C[C@@H]2CCNC2)sc1C(=O)N1CCCCC[C@H]1c1ncon1 1875315302 ORHFPFMQBZYVQE-KBPBESRZSA-N 375.498 2.744 0 50 GFAA O=C(Cc1ccc2cccnc2c1)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 1875403062 PBZJUOCZLSYASX-NIKGAXFTSA-N 384.867 2.583 0 50 GFAA C[C@@H]1CCN(c2ccc3nnc(Br)n3n2)C[C@@H]1C(=O)OC(C)(C)C 882511688 CXIIJRNYTCQEAE-MNOVXSKESA-N 396.289 2.691 0 50 GFAA Nc1ncc(C(=O)N2CC(Oc3ccc(Br)cc3)C2)cc1Cl 2325818441 BWCISFIHQLCBAH-UHFFFAOYSA-N 382.645 2.983 0 50 GFAA O=C(Cn1cc(NC(=O)[C@H]2Cc3cc(Cl)ccc3O2)cn1)NC1CCCC1 145571304 SYLOBKZYFGQTQQ-QGZVFWFLSA-N 388.855 2.538 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)COc2ccccc2Cl)c1 945334 OUXONJRGOMGTHB-UHFFFAOYSA-N 377.780 2.931 0 50 GFAA CN1C[C@H]2C[C@@H](N(C)C(=O)c3c[nH]c4cc(Cl)ccc4c3=O)C[C@H]2CC1=O 2356164191 IVNLVBQNIXIZLY-SCRDCRAPSA-N 387.867 2.510 0 50 GFAA Cc1ccc(C(=O)N/C(=C\c2ccco2)C(=O)NCCCn2ccnc2)cc1 4892259 SVGBTGFFBPAPJY-RGEXLXHISA-N 378.432 2.762 0 50 GFAA Fc1ccc(-n2nnnc2Cc2cc3c(cc2Br)OCO3)cc1 10336733 AOBDICUOVSSDFZ-UHFFFAOYSA-N 377.173 2.883 0 50 GFAA C[C@@H]1O[C@H](C)C[C@H]1CNc1ncnc2ccc(I)cc12 413526816 CRIJGJRTLLMLJF-VWYCJHECSA-N 383.233 3.460 0 50 GFAA Cc1nc(C[C@H]2CCCN(C[C@H]3CN(Cc4ccccc4)CCCO3)C2)no1 225421430 INPCZXPBOHDWBT-RTWAWAEBSA-N 384.524 2.924 0 50 GFAA Cc1nc([C@H]2CCCCN2C(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)n[nH]1 225502061 VTXKIOLYRRHIQX-RTBURBONSA-N 395.507 2.648 0 50 GFAA COCc1cc(CN2CCN(Cc3ccc(C)o3)[C@H](CCO)C2)ccc1OC 104451205 CBNVDDSBBMWOCP-HXUWFJFHSA-N 388.508 2.812 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)Nc1ccccc1 112016530 XTXWYFVUDOEOFU-FUHWJXTLSA-N 379.460 2.682 0 50 GFAA COc1ccc(NC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)c(OC)c1 20247444 XDJPPSKZOKEQJK-RMKNXTFCSA-N 395.503 2.973 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)c1cn(C)c(=O)c3ccccc13)CC2 62001579 PBCVNNZRIRPDLH-UHFFFAOYSA-N 378.428 2.754 0 50 GFAA biogenic CC1=C(C(=O)NCc2coc(-c3ccccc3)n2)[C@H](c2cccnc2)NC(=O)N1 67880065 RHAVHNDQBOMOHV-SFHVURJKSA-N 389.415 2.681 0 50 GFAA COC(=O)c1cc(I)ccc1I 69586248 DYYAKMJJKVLJFN-UHFFFAOYSA-N 387.942 2.682 0 50 GFAA CC(=O)N1CCc2c(nc(C)nc2N[C@H](C)CN2CCc3ccccc3C2)C1 71750421 HHWIWYXVKYTKHM-OAHLLOKOSA-N 379.508 2.548 0 50 GFAA O=C(CCc1ccccc1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71415681 ZLKMVBILIDOABE-OAQYLSRUSA-N 397.563 2.945 0 50 GFAA CN1C[C@H](C(=O)NC2(c3cccc(F)c3)CCOCC2)c2ccccc2C1=O 377509972 GZOPMJSFXQAWTP-IBGZPJMESA-N 382.435 2.817 0 50 GFAA COc1cccc2c(C(=O)N3CCC(n4nnc5c4CCCC5)CC3)n[nH]c12 377704704 YHSJYPRKZUXINB-UHFFFAOYSA-N 380.452 2.519 0 50 GFAA CCCc1cc(C(=O)OCC)c(NC(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)O)s1 225627990 WZHXSPWZDFLGBW-MQYQWHSLSA-N 381.450 2.694 0 50 GFAA O=C1CN(C(=O)c2conc2-c2ccccc2)CCN1Cc1cccc(F)c1 82092627 SUSAPKVSXJIFEX-UHFFFAOYSA-N 379.391 2.965 0 50 GFAA O=C(CC(c1ccccc1)c1ccccc1)Nn1c(=O)[nH]c2ccccc2c1=O 17078670 YFNKZQRJMBRIKZ-UHFFFAOYSA-N 385.423 2.982 0 50 GFAA CC1(C)Cc2cc(CNC(=O)N3CCC[C@H](c4cc(O)ncn4)C3)ccc2O1 426415281 GJUVLADCFUTSHI-HNNXBMFYSA-N 382.464 2.985 0 50 GFAA Cc1cccc2c1OC[C@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)C2 289711788 FJJGNERQJXTHBW-QGZVFWFLSA-N 393.443 2.769 0 50 GFAA CN(C)C(=O)c1cccnc1N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95505935 YLIKIXJRSWXJJU-QGZVFWFLSA-N 390.491 2.807 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)N2CCC[C@@H](Cn3ccnc3)C2)n1 426383312 PCGYDQYXISACCB-ZDUSSCGKSA-N 382.390 2.622 0 50 GFAA CCc1cc(N2CCC(N[C@H](C)Cc3cccc(C)n3)CC2)nc(N(C)C)n1 95527712 ISTAGTAHLBQAGI-QGZVFWFLSA-N 382.556 2.998 0 50 GFAA CN(Cc1nc(-c2cccnc2)no1)C(=O)c1ccc([C@H]2CCCNC2)cc1 95367259 BBGWWVJIXFFDOY-KRWDZBQOSA-N 377.448 2.871 0 50 GFAA C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N(CC(=O)O)C1CCOCC1 299747019 BVSFNULQCSVVPH-SNVBAGLBSA-N 376.236 2.853 0 50 GFAA COc1cccc(-n2cc([C@H](C)NC(=O)N3CCc4nc(C)[nH]c4C3)cn2)c1 534672555 MTFRGCIVTOUKSC-ZDUSSCGKSA-N 380.452 2.741 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NCc1c[nH]nc1-c1ccc(F)cc1 827836745 BAHPSRDURNBEKD-UHFFFAOYSA-N 380.423 2.727 0 50 GFAA C[C@H]1CCCN(CCOc2ccccc2CN2CCN(c3cnccn3)CC2)C1 822413206 VYQWNGANUGNEEW-FQEVSTJZSA-N 395.551 2.910 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)CCn2cnc3ccccc3c2=O)cc1 828052342 UTPLXCSJQBZETE-HNNXBMFYSA-N 390.443 2.941 0 50 GFAA NS(=O)(=O)c1ccc2c(c1)N(Cc1ccn(-c3ccccc3F)n1)CCC2 189195986 YWLJTGOOMRGBFJ-UHFFFAOYSA-N 386.452 2.612 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N(Cc1ccncc1)C[C@@H]1CCC(=O)N1 1506403866 OJGKOQZJHIQTKL-KRWDZBQOSA-N 376.460 2.721 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)[C@@H]2CC3CCN2CC3)CC1 1800409876 LDELOLKBQLJNGL-IBGZPJMESA-N 391.943 2.656 0 50 GFAA COCC(=O)N1C[C@H]2CN(C3CCSCC3)C[C@@]2(CCc2ccccc2)C1 1772704613 CXBLEBKHWDVUEL-KNQAVFIVSA-N 388.577 2.922 0 50 GFAA NC(=O)CN1C[C@H]2CN(Cc3c(F)cccc3F)C[C@@]2(CCc2ccccc2)C1 1772805085 YGFVMLRSODWZPK-JPYJTQIMSA-N 399.485 2.817 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cnc[nH]4)C[C@H]2CN(c2nncs2)C3)cc1 1772808835 CFLLWDFVRSXYCB-PXNSSMCTSA-N 380.521 2.832 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)CCc3cnccn3)C2)cc1 12585549 AJWIECVXCOLDQD-FQEVSTJZSA-N 396.535 2.831 0 50 GFAA O=C(CCn1ccccc1=O)N[C@H]1CCC[C@H]2CN(C(=O)CC3CCCC3)C[C@@H]12 1857681656 ICASARRGKWHCKL-ZCNNSNEGSA-N 399.535 2.562 0 50 GFAA O=C(CCc1ccc(O)cc1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccc1 216564186 DWRMZQFJKUVBOR-UXHICEINSA-N 378.472 2.974 0 50 GFAA CC(=O)NC[C@H]1CCCN(C(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)C1 124457744 JHKQLZMGHZCLNR-MRXNPFEDSA-N 379.460 2.672 0 50 GFAA O=C(c1cn(Cc2cccs2)nn1)N1CCNC[C@H]1c1cccc(Cl)c1 262073993 SQUGJEKYDHABLB-KRWDZBQOSA-N 387.896 2.828 0 50 GFAA Cc1cccc(C)c1NC(=O)CN1CCN(Cc2cccc(C(=O)O)c2)CC1 263443555 FFIXMICRKBOPQQ-UHFFFAOYSA-N 381.476 2.758 0 50 GFAA CCOC(=O)c1c(C(F)(F)F)csc1NS(=O)(=O)c1cnn(CC)c1 952884912 RJKPZGFJNPYYSG-UHFFFAOYSA-N 397.400 2.961 0 50 GFAA CC(=O)Nc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)ccn1 1875268567 HFOKSXNRUCMLOQ-OLZOCXBDSA-N 376.457 2.510 0 50 GFAA CO[C@@H](C(=O)N=[S@](C)(=O)c1ccnn1C)c1ccccc1C(F)(F)F 1875312202 WUAVLWIJCGKGSF-YMXBGEKHSA-N 375.372 2.810 0 50 GFAA Cc1cnc2n1CC[C@H](NC(=O)N(C)[C@H](c1ccc(F)cc1)c1ncccn1)C2 1875329466 XBGMHFHOIBLUDK-PKOBYXMFSA-N 394.454 2.866 0 50 GFAA Cc1noc2nc(-c3cccc(C(F)(F)F)c3)cc(C(=O)NS(C)(=O)=O)c12 1875391054 NDQHKLZFADOAOM-UHFFFAOYSA-N 399.350 2.906 0 50 GFAA N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC[C@@H](O)c1ccccc1C(F)(F)F 884108330 XSSSLMDEEKRGEM-SJLPKXTDSA-N 391.393 2.906 0 50 GFAA O=C(c1csc(-c2cnccn2)n1)N1CC2(CCN(Cc3ccccc3)C2)C1 2325764256 HQJZIHRXVXKUKU-UHFFFAOYSA-N 391.500 2.948 0 50 GFAA COC(=O)[C@@H]1CN(C2=Nc3ccccc3Oc3ccccc32)CCN1C(C)=O 2325798757 YBDRRNITYNJPCJ-KRWDZBQOSA-N 379.416 2.576 0 50 GFAA C[C@@H](Sc1nncn1C)c1cccc(NC(=O)c2cnn(CCN(C)C)c2)c1 2325800914 MLXWQZURKVMKHH-CQSZACIVSA-N 399.524 2.679 0 50 GFAA COC(=O)c1cc(=NC(=O)N[C@H]2CCC[C@@H]2c2ccc(Cl)cc2)[nH]n1C 2325819152 WPVCAFHKHWTDGL-KGLIPLIRSA-N 376.844 2.740 0 50 GFAA CCN(C[C@H](C)NC(=O)[C@H]1C[C@@H]1F)C(=O)Cc1cc(Br)cs1 2325822317 QDEHLJQNYOPESL-XDTLVQLUSA-N 391.306 2.764 0 50 GFAA Cc1cccc(C(=O)N[C@H]2CC3(CN(C(=O)C4CC(C)C4)C3)n3ccnc32)c1C 2332237723 JEHHMXMVHFDAOS-YVNUBYTISA-N 392.503 2.958 0 50 GFAA N=c1n(CCN2CCCCC2)c2ccccc2n1C[C@@H](O)COc1ccccc1 847462 YZVGXJBXRGLPRH-LJQANCHMSA-N 394.519 2.848 0 50 GFAA COCCSc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)s1 2865382 QEXUWEMXNRRQHU-LBPRGKRZSA-N 392.506 2.577 0 50 GFAA CN(C)Cc1nc(N2CC[C@@H](CO)[C@@H](O)C2)c2c(-c3ccccc3)csc2n1 225359971 MANSNGNSLWLXQE-RDJZCZTQSA-N 398.532 2.599 0 50 GFAA CC(C)c1cc(C(=O)N2CCn3nc(C(=O)Nc4ccccc4)cc3C2)[nH]n1 67724047 HSYLYHPONWPGKJ-UHFFFAOYSA-N 378.436 2.638 0 50 GFAA CCCCn1c(CN2CC[C@H](N(C)C)C2)cnc1S(=O)(=O)C1CCCCC1 20599317 PEQLAHLIUCJRHG-KRWDZBQOSA-N 396.601 2.926 0 50 GFAA CC(C)CCN1CCC[C@H]1c1ccc(C(=O)N2CCS(=O)(=O)CC2)s1 23581654 CIMVBRLBGAAONU-HNNXBMFYSA-N 384.567 2.802 0 50 GFAA CNC(=O)[C@H]1CC[C@@](C)(c2nc(-c3c(C)ncc4c3CCNC4)no2)C1(C)C 20363672 XUNQPOGONCYBPK-VFNWGFHPSA-N 383.496 2.526 0 50 GFAA CCc1ccc(C(=O)N2CCN(C(=O)c3coc(=O)c4ccccc34)CC2)cc1 424580434 WVKGDVHENXHWGX-UHFFFAOYSA-N 390.439 2.954 0 50 GFAA Cc1ccc(C(=O)N2CCOCC2)cc1NCC(=O)N1CCCc2ccccc21 120304162 JCBLZMGSSPENBM-UHFFFAOYSA-N 393.487 2.859 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1ccn(Cc2c(F)cccc2Cl)n1 2804977 KDUQULGPLRAFRV-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA O=C(CCCn1cccn1)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72145862 TYYBSGVLENTEEK-IBGZPJMESA-N 376.460 2.734 0 50 GFAA COCCC[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCC2)c1 215843913 ZIJROSHZMXVIRW-KRWDZBQOSA-N 380.510 2.502 0 50 GFAA CC(C)(C)n1cc(CN2CCC[C@@H](c3n[nH]cc3CN3CCOCC3)C2)cn1 328636967 OJXLFQXYSFOJID-GOSISDBHSA-N 386.544 2.573 0 50 GFAA CCN(Cc1ccncc1)C(=O)C[C@H]1COCCN1C(=O)NC1CCCCC1 72429835 ZOIKEAYHWPEHSR-IBGZPJMESA-N 388.512 2.563 0 50 GFAA Ic1ccc2ncnc(N3CC([C@@H]4CCOC4)C3)c2c1 366486587 YFMTUTUGBZWBDP-SNVBAGLBSA-N 381.217 2.707 0 50 GFAA Cc1cc(N2CCC[C@@H](NC3CCN(C(=O)CC(C)(C)C)CC3)C2)n(C)n1 333296634 GTHSMVONNHZTKU-GOSISDBHSA-N 375.561 2.714 0 50 GFAA Cc1oc(C(=O)N2CCC[C@@H]2[C@@H]2CCCc3ccccc32)cc1S(N)(=O)=O 370394718 LXDCLZBPJWYJRE-IAGOWNOFSA-N 388.489 2.960 0 50 GFAA CS(=O)(=O)NCCc1ccc(C(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1 239352455 ACGFHOWQZGOSMU-NZSAHSFTSA-N 378.538 2.867 0 50 GFAA O=C(NCCSC1CCCC1)c1cccc(S(=O)(=O)N2CCCC2)c1 46450307 DNYSAOULPUSTSD-UHFFFAOYSA-N 382.551 2.877 0 50 GFAA O=C(O)CCC(=O)Nc1sc2c(c1C(=O)NCc1cccnc1)CCCC2 17079104 LAWMBLZJDPAHKU-UHFFFAOYSA-N 387.461 2.755 0 50 GFAA O=C(CN1CCc2ccccc2C1)N[C@@H]1CCCN(Cc2cccnc2)CC1 82120563 FWWAGBDNHFXQGV-JOCHJYFZSA-N 378.520 2.611 0 50 GFAA O=C(NCc1ccc2c(c1)CCO2)N1CCC[C@]2(C1)C(=O)Nc1ccccc12 426698506 WGXAMCVWNPDOGB-JOCHJYFZSA-N 377.444 2.817 0 50 GFAA NC[C@@H]1CCCN(C(=O)c2cccc(-c3nc4ccccc4n3CCO)c2)C1 426597320 YXWSJDZZCCUFHC-INIZCTEOSA-N 378.476 2.507 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 290762564 VLIVVICYULOEIR-NSHDSACASA-N 380.330 2.813 0 50 GFAA Cc1nc(C)n(CCc2nc3c([nH]2)C[C@H](c2ccc(Cl)cc2)CNC3=O)n1 95528861 SLHUPANRSSZGQP-AWEZNQCLSA-N 384.871 2.584 0 50 GFAA Cc1oncc1S(=O)(=O)N(C)C[C@H]1CCCN(CCc2ccccc2F)C1 95515181 VHFJIFKEOUWOKM-MRXNPFEDSA-N 395.500 2.697 0 50 GFAA CNC[C@@H]1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)C1 178999471 PEWAMAGHBWDOHE-QFBILLFUSA-N 389.499 2.679 0 50 GFAA Cc1ncc(S(C)(=O)=O)c(N2CCC[C@@H](C(=O)c3sccc3C)C2)n1 95372698 BHRLNCUVCWZFQD-CYBMUJFWSA-N 379.507 2.658 0 50 GFAA O=C(NCCCN1CCCc2ccccc21)Nc1cnc2sccn2c1=O 97602224 UJXVDMCFOBXJPV-UHFFFAOYSA-N 383.477 2.720 0 50 GFAA O=C(Nc1ccc2ncccc2c1)N1CCN(Cc2ccco2)[C@@H](CCO)C1 95508294 TWUXMXUQSBSONT-SFHVURJKSA-N 380.448 2.929 0 50 GFAA CN(C[C@@H](O)CO)C(=O)c1ccc2oc(-c3ccc(C(F)(F)F)cc3)nc2c1 95522813 PRWZGFJDUZKJIG-CQSZACIVSA-N 394.349 2.939 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)c3ccc(S(=O)(=O)NC(C)C)cc3)c2c1C 182633931 KBUZDIFBYMYBQY-UHFFFAOYSA-N 387.465 2.514 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccccc1Cn1ccnc1)CO2 298307235 NYEHUAWEDJVNRC-LJQANCHMSA-N 377.444 2.808 0 50 GFAA CCCCN1CCn2nc(CNC(=O)N3CCC[C@H](OCCC)C3)cc2C1 534581861 GHSRITNOIUJIAA-IBGZPJMESA-N 377.533 2.599 0 50 GFAA CC(=O)Nc1sc(NC(=O)[C@@H]2CCn3ncnc3C2)nc1-c1ccccc1 1940198207 UZTATJUWJOMPEA-CYBMUJFWSA-N 382.449 2.561 0 50 GFAA O=C(c1ccc(Cl)c(NC(=O)N2CC[C@H]3CNC[C@H]32)c1)N1CCCCC1 299766809 FXEGPCTYBYRXIV-WMLDXEAASA-N 376.888 2.792 0 50 GFAA O=C(NCc1noc(-c2cccs2)n1)c1ccc(CSc2nc[nH]n2)o1 828164166 QPDFBJQSXFTHNN-UHFFFAOYSA-N 388.434 2.732 0 50 GFAA Cc1nc2cc(CNC(=O)CSc3nc(-c4ccco4)n[nH]3)ccc2n1C 828027277 DZTQQAZKKROASJ-UHFFFAOYSA-N 382.449 2.668 0 50 GFAA COc1nc2c(cc1C(=O)NCCc1nc(O)c3c(C)c(C)sc3n1)CCC2 670457994 IZXGTIKHFHJQQD-UHFFFAOYSA-N 398.488 2.879 0 50 GFAA O=C(NC1CCN(Cc2cccs2)CC1)c1cc(=O)n(-c2ccccc2)[nH]1 670473135 OBKMGSPPKHOPQV-UHFFFAOYSA-N 382.489 2.622 0 50 GFAA Cn1cc(CC(=O)NC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)c2ccccc21 670451096 QXAGVQLQEMIWCC-MBWAJUJLSA-N 390.491 2.572 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cc(O)nc3ccc(Br)cc23)C1 165542275 NRRIGIBTSAIVLJ-SECBINFHSA-N 379.210 2.640 0 50 GFAA COc1ccc([C@@H]2CCCN2C(=O)c2cc3c(O)ncnc3cn2)cc1OC 275093716 CUDQZYDNVCSYSD-INIZCTEOSA-N 380.404 2.725 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O 170091712 XDURUSXDDGFTMN-OAHLLOKOSA-N 385.351 2.853 0 50 GFAA C[C@H]1CN(C(=O)NCC(C)(C)Cc2cccc(Cl)c2)CCS(=O)(=O)C1 192195996 VVSXNLSHRKXVHY-AWEZNQCLSA-N 386.945 2.985 0 50 GFAA NC(=O)c1cccc2c1CCCN2C(=O)[C@H]1CCCN(Cc2ccccc2)C1 194944106 AVYXBMQGPNJOGH-SFHVURJKSA-N 377.488 2.977 0 50 GFAA Cc1ccc(N2CCC(N3C[C@H](Cc4cnccn4)[C@@H](O)C3)CC2)cc1Cl 1615964788 QGTPRVZFWJKNRR-KKSFZXQISA-N 386.927 2.943 0 50 GFAA Cc1ccc(-c2ccc(O)nn2)cc1NC(=O)[C@@H]1CN(C)c2ccccc2O1 1506396069 MSIRWNQFKUHGNK-IBGZPJMESA-N 376.416 2.994 0 50 GFAA CO[C@@H](C)c1nnc(NC(=O)CCSc2nnc(-c3ccncc3)o2)s1 1529174495 WQGCWNZFCYLHSY-VIFPVBQESA-N 392.466 2.811 0 50 GFAA Cc1c(NC(=O)c2ccco2)cccc1C(=O)N1C[C@@H]2CCCN2C(=O)[C@@H]1C 1772703124 ZJZBFTOPQUIHJA-GJZGRUSLSA-N 381.432 2.676 0 50 GFAA CCn1ccnc1CN(C)C(=O)c1cc(COc2cccc(C(C)=O)c2)on1 11664403 WGNDLGCOROENNK-UHFFFAOYSA-N 382.420 2.945 0 50 GFAA Cc1nc(CCNC(=O)c2cn(C/C=C/c3ccccc3)nn2)nc2c1CCC2 11813244 IHMWHHGZLPMHTQ-RMKNXTFCSA-N 388.475 2.551 0 50 GFAA O=C(c1cn2ccsc2n1)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 11936618 IKCIHNXRVBLXTF-CQSZACIVSA-N 384.461 2.884 0 50 GFAA COCc1ccc(C(=O)NCc2nnc(SC)n2-c2ccc(OC)cc2)o1 12152515 QSQNSJOYXNVYIL-UHFFFAOYSA-N 388.449 2.667 0 50 GFAA CN(C)CCN(C)C(=O)c1cccc(OC2CCN(Cc3ccccn3)CC2)c1 12448762 HEQJYALVHBJGSP-UHFFFAOYSA-N 396.535 2.759 0 50 GFAA CCNC(=O)N1CCC(n2nccc2NC(=O)CCOc2ccccc2)CC1 12021794 PHLMKMRVLPYUML-UHFFFAOYSA-N 385.468 2.657 0 50 GFAA CN1CCN(C(=O)c2cnn3c2N[C@H](c2ccccc2)C[C@@H]3C(F)(F)F)CC1 13124600 YHYMFGJYGJMYJJ-JKSUJKDBSA-N 393.413 2.931 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3cc(C)on3)C2)cc1OC 15073604 QDSDUGYAPQGSES-KRWDZBQOSA-N 387.480 2.779 0 50 GFAA Cc1cccc(CS(=O)(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1 16579747 KNORJGZEVDWRPT-KRWDZBQOSA-N 388.489 2.846 0 50 GFAA O=C(NCc1ccc(F)cc1)c1cc2n(n1)C[C@H](c1ccc3c(c1)OCO3)OC2 169769978 WOSNWXGDEQMMNO-HXUWFJFHSA-N 395.390 2.952 0 50 GFAA O=C(N1CCC(Cn2ccnc2)CC1)[C@]12CCCCN1C[C@@H](NC1CCCC1)C2 1857684365 LFNHWKLYPRFETN-JTHBVZDNSA-N 399.583 2.651 0 50 GFAA COCCn1cnnc1[C@@H](C)n1ccnc1-c1cc2ccc(OC)cc2nc1O 1857694389 ACUROAFSWIEPFT-CYBMUJFWSA-N 394.435 2.660 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)[C@H](O)Cc1ccccc1)CC2 1857710789 PUHKSCTXSTVKLF-OAQYLSRUSA-N 375.472 2.618 0 50 GFAA COc1cnc(C)cc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857731322 DVYNIYPIFCFVGK-JOCHJYFZSA-N 394.475 2.892 0 50 GFAA CC[C@H](C)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 4794507 VFBACQGDAHTASH-UAGQMJEPSA-N 378.469 2.943 0 50 GFAA NCCCOC1CCN(C(=O)C2(c3ccccc3Cl)CCOCC2)CC1 237830544 CLZFXDAJQPDDBE-UHFFFAOYSA-N 380.916 2.745 0 50 GFAA O=C(O)CN(C(=O)CCc1ccc(Br)cc1F)C1CCOCC1 238097121 FGGMZGNIFQYJQZ-UHFFFAOYSA-N 388.233 2.613 0 50 GFAA O=S(=O)(c1cc(F)cc(Cl)c1)N1Cc2cnnn2Cc2ccccc21 364953700 HVNVCUMRCIVZCO-UHFFFAOYSA-N 378.816 2.828 0 50 GFAA COCCc1nc(CN2CCOC[C@@H]2c2c(C)nn(-c3ccccc3)c2C)no1 952887308 OOKLOSBQMHXCLW-GOSISDBHSA-N 397.479 2.635 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CC[C@H]3SCCS[C@@H]23)c(Cl)c1 2325779868 MDDHWOAZHYAGHY-MCIONIFRSA-N 391.967 2.853 0 50 GFAA Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2ccccc2CN)CC3)c1 2325795099 DWUFTBJXXLSOSG-LJQANCHMSA-N 375.476 2.591 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCC(O)(c3ccccc3Cl)CC2)C1 2325889364 MGIDNXNCEUNZRG-HNNXBMFYSA-N 376.884 2.575 0 50 GFAA COc1cc(SC)ccc1C(=O)Nc1ccc2c(c1)CCN2S(C)(=O)=O 784108 ZVCDBHMUIAEATN-UHFFFAOYSA-N 392.502 2.992 0 50 GFAA COC(=O)c1sc(NC(=O)c2ccc(OC)c(OC)c2)c(C(=O)OC)c1C 802361 YEJHRKKJCOZUIG-UHFFFAOYSA-N 393.417 2.899 0 50 GFAA O=C(COc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)N1CCOCC1 1128536 PKPVTYBAWMJQNR-UHFFFAOYSA-N 377.824 2.563 0 50 GFAA Cn1ccc2ccc(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)nc21 2356149054 HRYXKONPDMVAQE-UHFFFAOYSA-N 375.432 2.612 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nnc(CSCC)n2C)cc1 2880727 DLWWJEWGGULEKR-UHFFFAOYSA-N 394.522 2.976 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Nc1ccccc1Cl 3483344 VDAAVLMOBDFHTA-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA O=C(Nc1nccs1)c1cccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 101419041 DWVDQHLNFXGIOB-GVARAGBVSA-N 383.429 2.857 0 50 GFAA O=C(NC1CCCC1)C1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1 24607537 AHMLKMZDQYDIDR-UHFFFAOYSA-N 384.929 2.941 0 50 GFAA COc1ccc2c(c1)OC(C)(C)CN(C(=O)Nc1cc(OC(F)F)n(C)n1)C2 421092383 FSMWHYLANKCMKV-UHFFFAOYSA-N 396.394 3.235 0 50 GFAA Cn1cc(S(=O)(=O)Nc2ccn(Cc3c(Cl)cccc3Cl)n2)cn1 2804059 LJSGHWTXCGYPDI-UHFFFAOYSA-N 386.264 2.773 0 50 GFAA CCOc1nc(C)ccc1C(=O)Nc1ccc2nc(CN3CCOCC3)[nH]c2c1 252509699 YTMQJRXBEVAKRY-UHFFFAOYSA-N 395.463 2.750 0 50 GFAA C[C@H]1CN(Cc2ccc(CNC(=O)[C@H]3CCCc4cn[nH]c43)cc2)C[C@@H](C)O1 229975432 GOFWVXNPHPCHLP-YRNRMSPPSA-N 382.508 2.755 0 50 GFAA CCCNC(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72158387 SPJLNIMXFCUPNT-NRFANRHFSA-N 379.504 2.535 0 50 GFAA COc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCC[C@@]2(CC=CCC2)C1 364119809 HHTCJMDXNQMMMT-IBGZPJMESA-N 379.478 2.833 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NC(=O)c1oc2c(c1C)C(=O)CC(C)(C)C2 155381077 QMSNJUOBQVAUFB-LBPRGKRZSA-N 386.452 2.746 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1CCN(c2ccc(F)c(Cl)c2)CC1 216102697 FYQAKCUDPPADIB-UHFFFAOYSA-N 377.847 2.757 0 50 GFAA Cc1noc2nc(-c3cccs3)cc(C(=O)N[C@@H](C)CN3CCOCC3)c12 13642070 XRHXTLQVVRSHHW-LBPRGKRZSA-N 386.477 2.710 0 50 GFAA COCC1(C(=O)N2C[C@H](c3ccccc3OC)[C@@H]3[C@H]2C2CCN3CC2)CCC1 72152085 VRYRTSLIEBDQEH-HMXCVIKNSA-N 384.520 2.901 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c(=O)c1CCC(=O)N[C@](C)(CO)C1CCCCC1 157993785 BKIMGACGCLVRGK-JOCHJYFZSA-N 398.507 2.520 0 50 GFAA Cn1c(=O)n(CC(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)c2ccccc21 129528759 RGFBUDWOVMTYKU-OAHLLOKOSA-N 398.438 2.709 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NC1CCN(Cc2ccccn2)CC1 131827522 BYQGFVJJVGMUGW-IBGZPJMESA-N 386.540 2.589 0 50 GFAA CCN1CCN(c2ccc(Cl)cc2NC(=O)N2CC[C@@](C)(C(=O)O)C2)CC1 263499061 SEBKUIUXTVNWKL-LJQANCHMSA-N 394.903 2.810 0 50 GFAA O=C(N[C@H]1CCCCN(C(=O)Cc2ccccc2)C1)c1n[nH]c2ccccc12 82096971 WQRAFAUEPSTZEZ-KRWDZBQOSA-N 376.460 2.917 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3cc(C)c4nc(N)sc4c3)CC2=O)cc1 82099882 DLAJREAKOOGGPD-UHFFFAOYSA-N 380.473 2.984 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H](C(=O)NCc3ccn4ccnc4c3)C2)cc1 178358896 BDKAJKUCVFJSNU-IBGZPJMESA-N 376.460 2.811 0 50 GFAA Cc1cccc(-n2cc(CN3CCC[C@@H](c4ccn(CC(=O)O)n4)C3)cn2)c1 426370181 VNARNXMOFVNJJH-GOSISDBHSA-N 379.464 2.841 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91943225 HKWCTJYEDRATGI-UHFFFAOYSA-N 395.507 2.559 0 50 GFAA COc1cc(C(=O)N[C@H]2CCNC2)ccc1OC1CCN(C2CCCC2)CC1 95521054 LBWREEQSGNUHOD-KRWDZBQOSA-N 387.524 2.573 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)o1 91770456 ZBCRBHQDYLYVPY-UHFFFAOYSA-N 382.464 2.731 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C[C@H](c4ccccc4)[C@@H](C3)[C@H]2C1=O)Nc1nccs1 239305921 GESMQKMAAZFFAQ-JYXJIEJFSA-N 381.457 2.506 0 50 GFAA Nc1ncccc1CN1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91325953 YDAVYEXLTNHMMQ-UHFFFAOYSA-N 386.446 2.957 0 50 GFAA CCN1CC2(CCN(C(=O)c3cnn(C)c3)CC2)C[C@@H](c2ccccc2)C1=O 91746574 FAVHVERYSMUFGS-IBGZPJMESA-N 380.492 2.679 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCc1cccnc1 252535810 GXRCPBYIKPYFJB-UHFFFAOYSA-N 379.395 2.680 0 50 GFAA CC1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCN(Cc2ccccc2)CC1 184634246 FXSGOZQQKHUXOR-UHFFFAOYSA-N 381.476 2.792 0 50 GFAA Cc1ccc([C@H](C)CCN2CCC(CNC(=O)Cn3ccccc3=O)CC2)o1 827861522 QGKQKIKIXQLUDK-QGZVFWFLSA-N 385.508 2.772 0 50 GFAA O=C(c1ccco1)N1CCOC2(CCN(c3ncnc4ccsc34)CC2)C1 828188876 IYURDAVRZPKPLT-UHFFFAOYSA-N 384.461 2.796 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)cc1OC 824312833 AEKWIKZLSJOXLW-OAHLLOKOSA-N 398.463 2.530 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)N[C@H]1CCCN(Cc2cccs2)C1 584888918 NCLVRWTVACVJSB-INIZCTEOSA-N 375.542 2.904 0 50 GFAA COc1ccc(-c2nnc(C)o2)cc1NC(=O)c1cc(C(C)C)n2ncnc2n1 952979365 NWUVJXRVTVGIJO-UHFFFAOYSA-N 393.407 2.867 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC3(CCc4ccccc43)CC2)CN1Cc1ccccn1 952968947 QQKFTLKAEHZHFX-LJQANCHMSA-N 389.499 2.937 0 50 GFAA CN(Cc1sc2ccccc2c1Cl)C(=O)[C@@H]1CCCN(CC(N)=O)C1 952869288 GYIYLQQWZTZLRK-GFCCVEGCSA-N 379.913 2.710 0 50 GFAA Cc1ccc(Br)c(S(=O)(=O)N2CCC[C@H](CC(=O)O)C2)c1 275367884 VVTUHNKSYGPBFX-LLVKDONJSA-N 376.272 2.633 0 50 GFAA CCN(CCNC(=O)N1C[C@@H](OC)C[C@@H]1c1nc(C)no1)c1ccccc1C 192369814 LIASPSQOKGEJSS-FUHWJXTLSA-N 387.484 2.684 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)c2ccc(CSc3nc[nH]n3)o2)C1 1506431394 IVWOANHEXCDGIM-CYBMUJFWSA-N 397.460 2.820 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCC([C@H](O)c4cccs4)CC3)c12 1529191447 YUBBHEACZGVKIS-KRWDZBQOSA-N 386.477 2.986 0 50 GFAA Cc1cccc(Cn2ncc(C)c2NC(=O)CC[C@@H](C)N2CCN(C)CC2)c1 1529151141 FVUJTJFAUXYVTO-LJQANCHMSA-N 383.540 2.903 0 50 GFAA Cc1cccc(-c2noc(CCC(=O)N[C@@H]3COC[C@H]3Cc3ccncc3)n2)c1 1704352468 ZGISENOBNUVTPJ-RTBURBONSA-N 392.459 2.747 0 50 GFAA O=C(CCc1ccc(F)cc1)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1 1704343092 SGJZEKBGGMTNFU-SIKLNZKXSA-N 385.435 2.665 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2C[C@@H]3COCC[C@]3(C(=O)O)C2)c1 1772701035 BCFXTOSJWLHSQL-VGSWGCGISA-N 381.428 2.926 0 50 GFAA O=C(NC[C@H]1CCCN(S(=O)(=O)/C=C/c2ccccc2)C1)c1cccnc1 11813629 IQYSSJUMKREQJC-LVMGUKCRSA-N 385.489 2.524 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)[C@@H]2CC(CCc3ccccc3)=NO2)C1 12097203 QEEDTWHYYWJGSN-QUCCMNQESA-N 385.508 2.871 0 50 GFAA COc1ccc(F)cc1C(=O)[C@H]1CCCN(C(=O)CSc2ncccn2)C1 12432548 XWMVPMVVOHTXIO-ZDUSSCGKSA-N 389.452 2.838 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCC[C@H](Nc2ccccc2)C1 12435762 TYDIDYBICLVXMA-SFHVURJKSA-N 378.480 2.777 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C[C@@H]1CCOC1 12587638 QUOKPLROVKLTEB-FQEVSTJZSA-N 376.541 2.892 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 13944734 DRQNZRLMMXYSAL-INIZCTEOSA-N 396.878 2.924 0 50 GFAA CC(C)OCCCN[C@@H]1CCc2c(c(C(=O)N(C)C)nn2Cc2ccccc2)C1 14535742 PSVXRUZDCACXFY-LJQANCHMSA-N 398.551 2.895 0 50 GFAA Cc1cccn2c(CN[C@H](C)Cc3cccs3)c(C(=O)N3CCOCC3)nc12 19229553 GYWSIDWFVKXFPN-MRXNPFEDSA-N 398.532 2.897 0 50 GFAA Cc1ccc(C2=NOC3(CCN(C(=O)c4ccc(N(C)C)cc4)CC3)N2)cc1 169754997 JHKRUBJNKYWVLA-UHFFFAOYSA-N 378.476 2.975 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)C[C@@H]1CCc3ccccc3C1)CCO2 1857528033 XPGUBDNRHDWETL-QRUJNEEXSA-N 390.549 2.671 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1ccc3c(c1)CCO3)C2)[C@@H](O)c1ccccc1 1857681489 LAVOILNXFMPGHY-JVSAHFFESA-N 392.499 2.682 0 50 GFAA CCN1CCN(CCOc2ccccc2-c2nccn2CCC(C)(C)O)CC1 1857698569 YQFDKCUTYZMKAP-UHFFFAOYSA-N 386.540 2.727 0 50 GFAA CCn1ccc(C(=O)N2CCC3(CCc4c(O)nc(C(C)(C)C)nc43)CC2)n1 1857711795 FMBSESBONAJQFU-UHFFFAOYSA-N 383.496 2.816 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)Cc3csc(-c4ccccc4)n3)C[C@]23CC[C@H]1O3 1857731852 RJONOONHHWVPAC-JZJXAQOMSA-N 397.544 2.920 0 50 GFAA O=C(NCC[C@H]1C[C@@H](O)C1)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1875243349 CPDWSOOAKCWALM-NFAWXSAZSA-N 377.872 2.975 0 50 GFAA Cn1nc(-c2ccccc2)c2c(NC(=O)C[C@@H](O)Cc3ccccc3)[nH]nc21 486458301 HWWFTEZGVNELIN-INIZCTEOSA-N 375.432 2.896 0 50 GFAA CC[C@H]1CC[C@@H](C)N(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1 952845452 VMHMAWIJBYLUGL-SJORKVTESA-N 378.538 2.568 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](N[C@H](C)c3cc4ccccc4[nH]3)C2)n1 1875397551 DMEPFRBVVXFTNN-NVXWUHKLSA-N 392.507 2.864 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)c2cn3ccc(C)c(C)c3n2)C1 1875309010 MIUYXMZQAWFKQB-OAHLLOKOSA-N 380.452 2.652 0 50 GFAA C[C@]1(NC(=O)c2c[nH]c3nccc-3c2)CCN(C(=O)c2coc(C3CCC3)n2)C1 1875333801 MCZQGOPIKBTXOP-NRFANRHFSA-N 393.447 2.805 0 50 GFAA COc1ccc2nc(Cl)ccc2c1S(=O)(=O)N1C[C@H](CN)CC12CCC2 1875305958 NZXRVVSKUCECRT-LBPRGKRZSA-N 395.912 2.789 0 50 GFAA COC(=O)c1ccc(C[C@H](N)C(=O)NCc2ccccc2OC(F)(F)F)cc1 2325786347 DMSABCZACKYWGR-HNNXBMFYSA-N 396.365 2.558 0 50 GFAA N[C@H]1CCc2cc(C(=O)NCc3ccccc3-c3ccncc3)ccc2NC1=O 2325857235 UQOIAJWNRBSNPF-FQEVSTJZSA-N 386.455 2.891 0 50 GFAA O=C(NC(=S)Nc1ccc(I)cn1)c1cccs1 679125 YGVVCNBLRXNKHC-UHFFFAOYSA-N 389.243 2.875 0 50 GFAA COc1cc(C=O)c(Br)cc1OCC(=O)NCc1ccccc1 1135080 FGVKGEQTUYCTAV-UHFFFAOYSA-N 378.222 2.965 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCN(C(=O)N(C)C)CC3)ncnc21 2356168893 GPECZWBKKJHWLT-UHFFFAOYSA-N 387.532 2.629 0 50 GFAA COCCNC(=O)c1ccccc1-c1nc(-c2ccc(OC)c(OC)c2)no1 2875762 ROEAXPWJZXIPHE-UHFFFAOYSA-N 383.404 2.797 0 50 GFAA COC(=O)c1c(NC(=O)C2CCCCC2)sc(C(=O)N2CCOCC2)c1C 2879834 MOASKHWFIQUEPW-UHFFFAOYSA-N 394.493 2.834 0 50 GFAA Cc1cc(C)cc(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1 4317787 OQXDSSGTXQVDLS-FQEVSTJZSA-N 379.460 2.884 0 50 GFAA CCn1ncc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@@H](CCO)C2)c1C 23373575 OPUNMPATZMCDBX-NRFANRHFSA-N 386.540 2.597 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@H](NCCc3cccc(Cl)c3)C2=O)cc1 20137661 GFAAGKLUEIOOAP-SFHVURJKSA-N 385.851 2.763 0 50 GFAA COc1cc(CN2CCN(Cc3cnc(C)s3)C[C@@H]2CCO)cc(OC)c1 20911878 LXGBZRRODUKCKL-KRWDZBQOSA-N 391.537 2.538 0 50 GFAA CC(C)COc1ccc(C(C)(C)CNC(=O)[C@@H]2CCCN2S(C)(=O)=O)cc1 171522692 ZIQPSXWNJOUCJG-SFHVURJKSA-N 396.553 2.539 0 50 GFAA CN1CC2(CCN(c3nnnn3-c3ccc(-c4ccccc4)cc3)CC2)CC1=O 72435306 IVDLNZYDCIXUTC-UHFFFAOYSA-N 388.475 2.778 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)Nc1ccccc1-c1nc(CC)n[nH]1 155487078 DJUKIFLRWYYTGN-UHFFFAOYSA-N 393.447 2.801 0 50 GFAA c1cc(CN2CCCCC2)cc(-c2noc(-c3ncn([C@H]4CCCNC4)n3)n2)c1 261623953 BYACMYFIDZALNM-SFHVURJKSA-N 393.495 2.906 0 50 GFAA COCCN(C)CCN1CC2(CCN(C3CCCCCCC3)CC2)OC1=O 72456929 PWZYVPZTMZQETD-UHFFFAOYSA-N 381.561 2.964 0 50 GFAA Cc1nc([C@@H](NC(=O)COc2ccccc2F)c2ccc3c(c2)OCCO3)no1 371011718 UTDRAQQJYDRCLQ-IBGZPJMESA-N 399.378 2.573 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CCn3nc(C)cc3C)CC2)OC1=O 77535559 ZJOPWEQBNMKJTG-INIZCTEOSA-N 376.501 2.892 0 50 GFAA CN(Cc1ccoc1)Cc1cc2n(n1)CCN(C(=O)c1ccc(Cl)cn1)C2 72433653 WOSOWGSWVGGFLW-UHFFFAOYSA-N 385.855 2.813 0 50 GFAA CC(C)CCN1C[C@@]2(CCCN(c3nnnn3-c3ccccc3)C2)CCC1=O 77488145 GCXVIVOAQXPETB-OAQYLSRUSA-N 382.512 2.917 0 50 GFAA O=C(c1cccn2c(O)nnc12)N1CCC(c2nc(-c3ccccc3)no2)CC1 378560145 MRHCDNOFWZCAOO-UHFFFAOYSA-N 390.403 2.505 0 50 GFAA Cc1c(C(=O)N2CCN(c3nc4ccccc4s3)CC2)cnc2ccnn12 72426765 RHAYCTGFBORRNN-UHFFFAOYSA-N 378.461 2.610 0 50 GFAA CCCOc1ccccc1C(=O)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 71714753 JKGMMWQCIFNZIQ-UHFFFAOYSA-N 390.443 2.819 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1)c1cc(C2CC2)no1 263550431 WCVSLTKAOUZVKU-INIZCTEOSA-N 383.404 2.884 0 50 GFAA CCc1ccccc1OCCN(C)C(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1 426435025 VCGMMGIRLCCQCU-MRXNPFEDSA-N 375.513 2.916 0 50 GFAA CCN(C)C[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1 177870544 GTIPSVPKUAOJFQ-GOSISDBHSA-N 386.540 2.583 0 50 GFAA Cc1cc(N2C(=O)C[C@H](N3CCC(c4nc5ccccc5o4)CC3)C2=O)no1 19874349 OYUUDAFCLPJLGL-HNNXBMFYSA-N 380.404 2.636 0 50 GFAA CN(Cc1cccc(OC[C@H](O)CN2CCCCCC2)c1)C1CCOCC1 95527414 FJASVSISASXVDS-OAQYLSRUSA-N 376.541 2.913 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1nc(C)c[nH]1 95520399 BQCNMLLWXIJKMI-UHFFFAOYSA-N 388.487 2.858 0 50 GFAA CC[C@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)N(C)CC 91390914 ZEECIHBFXJRBBE-LJQANCHMSA-N 386.540 2.543 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)c2c[nH]c3ccc(F)cc3c2=O)C1 95511708 FJQFILMQULNGFH-CQSZACIVSA-N 398.438 2.530 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(C(=O)c1cc(=O)c3ccccc3o1)CC2 95531194 NDLGEABCNJLYNL-UHFFFAOYSA-N 392.459 2.526 0 50 GFAA CCc1nc(CNC(=O)N2CCC(C(=O)NCc3ccco3)CC2)cs1 426395975 QQDKHTBLPHHDMX-UHFFFAOYSA-N 376.482 2.537 0 50 GFAA Cn1c(=O)cc(C(=O)N2C[C@@H]3CC[C@H](C2)N(CC2CCC2)C3)c2ccccc21 95376370 NTKNRNANHZSHPZ-QZTJIDSGSA-N 379.504 2.875 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N(C)Cc3nc(CC(C)C)no3)c(=O)[nH]2)cc1 91391474 NLAMKMOKMCPPLB-UHFFFAOYSA-N 381.436 2.599 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](c3cccc(C(=O)O)c3)C2)cc1 95372189 HUBQQHLGSNOCKL-QGZVFWFLSA-N 387.457 2.808 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)c2ccc(-c3ccc(Cn4ccnc4)cn3)cc2)C1 534578888 IIUWBIQTFBVUIJ-HXUWFJFHSA-N 375.476 2.770 0 50 GFAA CN(C)C[C@](C)(O)c1ccc2c(c1)CN(Cc1nc3ccccc3[nH]1)CCO2 299765284 DUEKVDWXDBTRBX-QFIPXVFZSA-N 380.492 2.727 0 50 GFAA Cc1cc(C)n(CCN(C)C(=O)CCSc2ccc3c(c2)OCCO3)n1 299773274 CJAIFTHNZUFZJY-UHFFFAOYSA-N 375.494 2.912 0 50 GFAA Cc1nc(-c2ccc(NC(=O)CN3C[C@@H](c4ccccc4)CC3=O)cc2)n[nH]1 827831071 OGMCMFYMTQELSF-KRWDZBQOSA-N 375.432 2.735 0 50 GFAA Cc1ccccc1N1CC[C@@H](CNC(=O)c2cccc(N3CCNC3=O)c2)C1 670466651 VZGZOFVIZJRYBO-KRWDZBQOSA-N 378.476 2.781 0 50 GFAA COc1cc(-n2cnnn2)ccc1NC(=O)c1ccc(CN2CCC(C)CC2)o1 952974195 HZCJCGIZJYCLMG-UHFFFAOYSA-N 396.451 2.748 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 268944429 MBEYIXSPAJKZCP-BZSNNMDCSA-N 379.412 2.599 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)N1CCCN(C2CCCC2)CC1 186780910 WWNOYONNWSBRSF-UHFFFAOYSA-N 390.494 2.921 0 50 GFAA Cc1nc(C)c(S(=O)(=O)N2CCN(c3cncc4ccccc34)CC2)s1 191993793 UQQZYLLJUSPBEA-UHFFFAOYSA-N 388.518 2.819 0 50 GFAA COc1ccccc1C(=O)NCC(=O)N1CCC(c2nc3ccccc3o2)CC1 193261702 HAEXCMUNOFLFKA-UHFFFAOYSA-N 393.443 2.972 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3ncccc3Cl)CC2)cc1N1CCNC1=O 1506420433 GGABAUMSDRLHNJ-UHFFFAOYSA-N 399.882 2.535 0 50 GFAA COc1cccc(C)c1C(=O)N1CCCN(CCC(=O)Nc2cccnc2)CC1 1529167850 PBDKKDWELPTJFW-UHFFFAOYSA-N 396.491 2.575 0 50 GFAA CN(CC(=O)Nc1nnc([C@@H]2CCCO2)s1)Cc1cccc(-n2cccn2)c1 1529119173 CJVZDGRTABLDGG-INIZCTEOSA-N 398.492 2.646 0 50 GFAA CCC(=O)N[C@]1(C)CCOC2(CCN(Cc3ccc4ncccc4c3)CC2)[C@H]1O 1772703015 FYUQLQCFZFMPLI-FCHUYYIVSA-N 397.519 2.636 0 50 GFAA CC(C)c1cc(C(F)(F)F)nc(N2CCN(CC[C@@H]3COCCO3)CC2)n1 1775978653 GTFQOFLBOJCUEQ-CQSZACIVSA-N 388.434 2.546 0 50 GFAA O=C(Cc1cccs1)N1C[C@@H]2CN(Cc3cc4ccccc4o3)C[C@]2(CO)C1 1772810313 FXUUJDZRYDNLRH-HTAPYJJXSA-N 396.512 2.990 0 50 GFAA COc1ccc(-c2onc(N3CCC[C@H](c4n[nH]c(C)n4)C3)c2C(=O)O)cc1 1772705836 AISFMDKQIQPFIR-ZDUSSCGKSA-N 383.408 2.859 0 50 GFAA CCc1noc(CNC(=O)[C@H]2CCc3sc(-c4c(C)noc4C)nc3C2)n1 1772811541 YLKNLBFRDIEIQV-NSHDSACASA-N 387.465 2.782 0 50 GFAA CN(C)CCOc1cccc(CN(Cc2ccccn2)C(=O)[C@H]2CCCO2)c1 11882096 CGOICQDCTUEDMP-OAQYLSRUSA-N 383.492 2.730 0 50 GFAA O=C(c1cn(Cc2ccc(F)cc2)nn1)N(Cc1ccncc1)C[C@@H]1CCCO1 12436260 PZJCAUXZVJHJJB-IBGZPJMESA-N 395.438 2.682 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@H](N1CCSCC1)C2 14534806 FCYDURMCDIWEFW-HNNXBMFYSA-N 388.537 2.674 0 50 GFAA CCCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](N(C)CCc1ccccn1)C2 14543545 RGLDEABHMSVYKK-IBGZPJMESA-N 395.551 2.956 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2F)CCCN(C(=O)CCC(=O)OC)C1 14980949 UBPDQKUDWKASJH-HXUWFJFHSA-N 397.418 2.632 0 50 GFAA O=C(NCCCO)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 15062741 UCIOZZUABTYTBK-UHFFFAOYSA-N 382.504 2.885 0 50 GFAA O=C(Cn1nc(Cc2ccccc2)c2ccccc2c1=O)NCCc1ccco1 19761667 SXMAQRPNVMPTOX-UHFFFAOYSA-N 387.439 2.939 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(c3cnc4ccccc4n3)C1)CC2 1857696722 NJWBGSGGRCIRBV-OAQYLSRUSA-N 376.464 2.676 0 50 GFAA COC(=O)N1CCCC[C@@H]1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857709772 QQSDFPJFPNUVBF-LJQANCHMSA-N 396.491 2.635 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@]23CC[C@H]1O3 1857721608 XYLUJBMVZMZNEA-JRBPQWBISA-N 378.513 2.593 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N1C[C@@H]2[C@H](CN(C)C)[C@H]3CC[C@]2(C1)O3 1857730084 JDXROKJDTJFZBN-IXIUHKBRSA-N 378.900 2.595 0 50 GFAA O=C(c1c[nH]nc1[C@H]1CCOC1)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 330320491 FDYKBWCSLQTNNI-HOTGVXAUSA-N 392.463 2.719 0 50 GFAA N=C(NCCNC(=O)c1ccc(Br)cc1)NCCc1cccs1 849066245 KSXSFCQRABNJCW-UHFFFAOYSA-N 395.326 2.597 0 50 GFAA CN(C[C@H](O)CN1CCC(c2nccc(-c3cccc(F)c3)n2)CC1)C1CC1 952893663 UZSZQUDHKBDKDY-FQEVSTJZSA-N 384.499 2.917 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2cccc(C(=O)NCc3ccccc3)c2)cn1 1875385192 OBKSQORBDSQECO-RXFWQSSRSA-N 376.460 2.613 0 50 GFAA CN(C[C@@H]1COc2ccccc2O1)c1ncnc2ccc(N3CCOCC3)cc12 1875332628 BJYYQDUEVTVSFN-QGZVFWFLSA-N 392.459 2.743 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC3(CC2)CN(C)C(=O)O3)c(Cl)c1Cl 2325818044 UBIZBDKCZFMYBA-UHFFFAOYSA-N 393.292 2.907 0 50 GFAA O=C(COc1ccccc1O)N[C@H]1CCC[C@@H]1NC(=O)C12CCC(F)(CC1)C2 2325872189 LPKRNZJDHPXYKS-LDSOLPTJSA-N 390.455 2.597 0 50 GFAA COC(=O)c1c(NC(=O)CCN2C(=O)c3ccccc3C2=O)sc2c1CCC2 856517 HFYISRWWJPRHGW-UHFFFAOYSA-N 398.440 2.648 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NCc1ccc(O)c(F)c1 132984739 AGZFJGURGXDUHR-QGZVFWFLSA-N 386.423 2.851 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)c1cc2c(s1)C1(CCNCC1)OCC2 2356136382 RXKCMFMZIDUEOF-UHFFFAOYSA-N 386.473 2.558 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cccc4ncnn34)C2=O)cc1 2356153951 BPIWPUVGCFASRF-JOCHJYFZSA-N 389.459 2.840 0 50 GFAA CCC[C@]1(C(=O)O)CCN(c2nc3c(c(C(F)(F)F)n2)CCCC3)C[C@@H]1O 2356158373 ZHLOZDYQTNZCEN-GUYCJALGSA-N 387.402 2.816 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C(=O)c2conc2-c2ccccc2)C1 2356159398 YSLUWXINLTVWPN-NRFANRHFSA-N 375.432 2.664 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1C/C=C/c1ccccc1)NCCC1=CCCCC1 55360104 WZBRDTDAECZTFF-JYNAJPCDSA-N 381.520 2.897 0 50 GFAA CN1CCC(N(CCc2ccccc2)Cc2ccccc2OCC(N)=O)CC1 63844735 IFLVSTSDARKMNC-UHFFFAOYSA-N 381.520 2.690 0 50 GFAA CN(Cc1c(C(=O)N(C)C)nc2ccc(Cl)cn12)C[C@@H](O)c1ccccc1 20998762 QTSUHBZXOUVFHT-QGZVFWFLSA-N 386.883 2.855 0 50 GFAA NC(=O)[C@@H]1CCCN1Cc1cccc(C(=O)Nc2ccnn2C2CCCC2)c1 65405632 AKVJUTONYDPBBK-SFHVURJKSA-N 381.480 2.700 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)c1cnc[nH]c1=O)C2 67884430 BISUUYDGDVJYKS-UHFFFAOYSA-N 397.456 2.850 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CC(=O)N[C@@H](C)[C@@H]1CCCO1 2780146 LOHRPVLZFPPFCC-CBAPKCEASA-N 384.196 2.657 0 50 GFAA CCN(CC)C(=O)c1ccc(CNC(=O)c2cccc(C(=O)NC3CC3)c2)cc1 438956567 FWPYISVVKADSGM-UHFFFAOYSA-N 393.487 2.991 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCN(Cc2ccccc2)CC1 363208769 YGIHWEMEBGZBBA-UHFFFAOYSA-N 390.491 2.685 0 50 GFAA CCn1cc([C@@H]2CN(C(=O)Nc3cc4c(cc3F)CCC(=O)N4)CCO2)cn1 365235879 ZURDIOKQCIJVAV-KRWDZBQOSA-N 387.415 2.532 0 50 GFAA CN1C(=O)[C@@](CC(=O)N2CCC(CO)CC2)(Cc2ccccc2)c2ccccc21 71751593 FGKDZHXGHLGZRS-XMMPIXPASA-N 392.499 2.765 0 50 GFAA COC(=O)C[C@H](c1cccc(O)c1)c1oc(CN2CCCCC2)cc(=O)c1O 217641197 XXMYEOAWSCYDFA-QGZVFWFLSA-N 387.432 2.732 0 50 GFAA biogenic O=C(Nc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H](CO)C2)ccn1)C1CC1 376074300 MJCGWJMKHDMFMD-MOPGFXCFSA-N 379.460 2.668 0 50 GFAA c1cc2nnnn2nc1N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 370981549 BSNLMVDLUMWYBT-CQSZACIVSA-N 382.472 2.799 0 50 GFAA Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@@](C)(C(=O)O)C1 237604259 IJQRBOCUSUCBSZ-GOSISDBHSA-N 379.819 2.969 0 50 GFAA Cc1ccn2c(F)c(C(=O)N3CCC(C(=O)NCc4ccco4)CC3)nc2c1 216314749 UALMAUHKXTYDCA-UHFFFAOYSA-N 384.411 2.543 0 50 GFAA c1ccc(CCCc2noc(-c3ccc(N4C[C@@H]5CNC[C@@H]5C4)nc3)n2)cc1 72128170 IXPCOSKEZGLBGE-KDURUIRLSA-N 375.476 2.963 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)NC[C@@H](Cc1ccccc1)C(=O)O 237735548 VHRWTJPZKVLFJM-CQSZACIVSA-N 384.461 2.525 0 50 GFAA C[C@H]1CN(C(=O)c2nc3sccn3c2CN(C)Cc2ccco2)C[C@@H](C)O1 71721357 ZHUNBSUSKPADFG-OKILXGFUSA-N 388.493 2.870 0 50 GFAA CSCCN(C)C(=O)[C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 82138543 OGLCGVWMNOXDCN-LJQANCHMSA-N 390.597 2.579 0 50 GFAA O=C(NC[C@@H]1C[C@H](F)CN1C(=O)c1csc(Cc2ccccc2)n1)C1CC1 82096475 YFMDBKJFBNORNM-HOTGVXAUSA-N 387.480 2.813 0 50 GFAA CCS(=O)(=O)CCN(C)C(=O)N[C@@H](C)c1ccc2cc(OC)ccc2c1 426578842 RJKSOXYYFXPBHB-AWEZNQCLSA-N 378.494 2.986 0 50 GFAA Cc1cccc(C[C@@H](C)NC(=O)N2CCC(c3nnc4ccccn34)CC2)n1 426707440 OECCTXYAYKOSBM-MRXNPFEDSA-N 378.480 2.953 0 50 GFAA CC[C@@H](NC(=O)c1cc(C)nc2[nH]c(=O)[nH]c(=O)c12)C12CC3CC(CC(C3)C1)C2 20607260 YHDKKOZGXYWBNS-CPUAJEGOSA-N 396.491 2.645 0 50 GFAA CCOC(=O)[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(c1ccnc(C)c1)C2 96149216 HCEUSWDCOGOSHR-WOIUINJBSA-N 387.524 2.651 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)c1cccc([C@H]2CCCNC2)c1 95379698 BFTHZRGLTKKVEV-KRWDZBQOSA-N 385.895 2.967 0 50 GFAA O=C(OCc1ccccc1)[C@H]1[C@H]2C=C[C@@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 239426017 VPPDEEZJOFBAPZ-NVJIOZQYSA-N 375.424 2.712 0 50 GFAA CCn1c(Cn2ccnc2C)nnc1C1CCN(C(=O)CC(F)(F)F)CC1 96151730 VBSSNKRKRRBYHI-UHFFFAOYSA-N 384.406 2.510 0 50 GFAA COc1ccc([C@H](NC(=O)c2cc(Cl)ccc2OC)[C@H]2C[C@@H](O)C2)cn1 244678761 IJOQGDOYBNHIRU-WRSAYESZSA-N 376.840 2.994 0 50 GFAA Cc1cccc(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)c1F 181323689 VMNZRFVCCQTACL-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA Cc1ocnc1C(=O)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 67472856 GCFGCMAOQDEUEJ-LSDHHAIUSA-N 375.812 2.524 0 50 GFAA O=C([C@H]1CCCN(C2CCN(c3nc4ccccc4o3)CC2)C1)N1CC=CC1 71662759 DHDUTPQVCVXMIH-KRWDZBQOSA-N 380.492 2.907 0 50 GFAA O=C(COCc1ccccc1)NC[C@H]1CCCN(C(=O)Cc2cccc(F)c2)C1 828022165 APNCUYPJXKZHSN-HXUWFJFHSA-N 398.478 2.940 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)NC1CCOCC1)CC2 276496854 PEDJRNDQRGIGCF-SFHVURJKSA-N 391.537 2.840 0 50 GFAA C[C@H]1CCc2sc(C(=O)N3CC[C@@H](N(C)Cc4nccc(N)n4)C3)cc2C1 276518172 QKNSJZQHIRQANP-DZGCQCFKSA-N 385.537 2.592 0 50 GFAA COc1ccc(-c2nc(CN(C)[C@@H]3CCN(Cc4ccccc4)C3=O)no2)cc1 191753870 OGUMZBMZXKSCLZ-LJQANCHMSA-N 392.459 2.978 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)CCn2c(O)nc3ccccc32)C1 1506422168 PBZJAUOLLMLGJC-OAHLLOKOSA-N 378.432 2.649 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)Nc3nnc(CCN(C)C)s3)c2)n1 1506395466 IYZNJOVNUOBDNB-UHFFFAOYSA-N 384.509 2.756 0 50 GFAA O=C(CN1CCc2ccccc2C1)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 1506401053 HQEJMFFBIJJXEW-UHFFFAOYSA-N 391.475 2.866 0 50 GFAA Cc1cc([C@@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)ccc1F 1506428198 NOUXFAOQTZMLHH-IBGZPJMESA-N 385.439 2.683 0 50 GFAA Cc1cnc(CN2CC3(CCN(Cc4ccc(F)cc4)CC3)OCCC2=O)cn1 1704304106 APWLONDSZRYCLK-UHFFFAOYSA-N 398.482 2.708 0 50 GFAA Cc1cccn2ncc(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)c12 1772706764 GJOHUJSJIAFFGN-UHFFFAOYSA-N 375.432 2.682 0 50 GFAA NC(=O)c1ccc(-c2cccc3c2O[C@H](CNC(=O)/C=C/c2ccccn2)C3)cc1 11790152 NDDQFMYGHCFRJR-SGWGQVFISA-N 399.450 2.981 0 50 GFAA Cc1c(CC(=O)NCc2ccccn2)c2c(n1C[C@@H]1CCCO1)CCCC2=O 12432944 HHSRWNIYTXNWHU-KRWDZBQOSA-N 381.476 2.748 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)C4CCC4)C3)C2=O)c1OC 12597455 VMUUKOIEZQLHEG-QFIPXVFZSA-N 386.492 2.845 0 50 GFAA COCCNC(=O)c1nn(CCC(C)C)c2c1CN(C(=O)c1ccccc1)CC2 14537862 XWRUGRFRIKDUAN-UHFFFAOYSA-N 398.507 2.504 0 50 GFAA COc1cccc(CO[C@@H]2CN(Cc3cccnc3)CC(=O)N(CC(C)C)C2)c1 14538126 HMJTVLIZMAIYNR-JOCHJYFZSA-N 397.519 2.976 0 50 GFAA Nc1nc(CN2CCN(CCc3ccccc3)CC2)nc(Nc2ccccc2)n1 19899219 KTPVGTSTPDDRFY-UHFFFAOYSA-N 389.507 2.558 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4cccc(C)c4)nnc3c2)n1 169776214 ZBQNAOWLURYYMX-UHFFFAOYSA-N 376.420 2.970 0 50 GFAA CCN1CCN(C(=O)C[C@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)CC1 1857667159 GNGYUUMPUUTTGF-MRXNPFEDSA-N 386.496 2.607 0 50 GFAA COc1ccc(C(=O)NCc2nonc2C)cc1Oc1ccc(CN)cc1F 1857693414 WHVCTMIDZNCHAZ-UHFFFAOYSA-N 386.383 2.707 0 50 GFAA Cc1cnc2c(C(=O)N3CCc4nn(C)c(-c5ccccc5)c4CC3)cnn2c1 1857697224 KYDOSJGTCFCJDV-UHFFFAOYSA-N 386.459 2.679 0 50 GFAA CCn1ncc(NS(=O)(=O)c2ccc(C(=O)O)cc2C)c1C(F)(F)F 410403745 DIYJICFRGIBGMF-UHFFFAOYSA-N 377.344 2.729 0 50 GFAA Cc1c(C(=O)Nc2ccc3c(c2)N(C(N)=O)CC3)nnn1-c1ccccc1Cl 225629712 VGDFTCAXHUKZQX-UHFFFAOYSA-N 396.838 2.923 0 50 GFAA CC(=O)N1CCC(N[C@@H](C)c2cc3c(cc2Br)OCCO3)CC1 121488001 LGWHVXDSMWFJDE-NSHDSACASA-N 383.286 2.882 0 50 GFAA CC(=O)Nc1ccc(C(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)cc1 264751499 WJFBYGWNRBFTMV-UHFFFAOYSA-N 384.480 2.892 0 50 GFAA O=C(c1cc2ccccc2n1Cc1ccncc1)N1CC[C@@H]2OCCO[C@H]2C1 1875274894 ZTDCNFRMPDZHGL-SFTDATJTSA-N 377.444 2.715 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)CC1)C(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 1875336309 CHIWWEZDZCRDII-OIISXLGYSA-N 397.475 2.634 0 50 GFAA O=C(C[C@H](c1ccccc1)N1CCOC1=O)N1c2ccncc2N2CC[C@H]1C2 1875396729 SSNATLKWKWLOEH-FUHWJXTLSA-N 378.432 2.591 0 50 GFAA CO[C@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1 1775957230 JPVVHQITLDWRQZ-AEGPPILISA-N 377.828 2.571 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)NCc1noc(-c2ccc3c(c2)OCO3)n1 2100482278 NJQOTQFUOFHBOY-UHFFFAOYSA-N 382.376 2.619 0 50 GFAA C[C@H]1c2cc(O)ccc2CCN1Cc1nc(Nc2ccc(F)cc2)[nH]c(=N)n1 2325756513 AMUYTSKXAVHHFS-LBPRGKRZSA-N 380.427 2.992 0 50 GFAA C[C@H](c1ccccc1)N1C[C@@H](C(=O)N2CCOC[C@H]2CC(F)(F)F)CC1=O 2325819567 JHFPMCBUZCEMKR-VNQPRFMTSA-N 384.398 2.776 0 50 GFAA COc1ccc(C)cc1NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 877052 DOMQZDAFPTUCLO-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(Cl)c(Cl)c1 4918831 HYVZEEJMNZCBKS-ZDUSSCGKSA-N 375.277 2.976 0 50 GFAA O=C(c1cccs1)N1CCN(Cc2nc(Cc3ccccc3F)no2)CC1 20915027 RCMNONBBHROZLO-UHFFFAOYSA-N 386.452 2.819 0 50 GFAA O=c1cc([C@@H]2CCCO2)nc(-c2ccc(CN3CC(n4cccn4)C3)cc2)[nH]1 23380364 DOQGZQUAYVUIKV-IBGZPJMESA-N 377.448 2.542 0 50 GFAA C[C@@H]1CCCCN1C1CN(C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)C1 67640921 NVBWEDCPEJYHCS-OAHLLOKOSA-N 378.480 2.507 0 50 GFAA CC(C)c1nc(CNC(=O)c2ccc(N[C@@H](C)Cc3ccncc3)nc2)no1 67769919 ZPFFTKIABLCGDV-AWEZNQCLSA-N 380.452 2.956 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1C(=O)O 232756673 FRFJGSFUQNPKLM-INIZCTEOSA-N 394.518 2.870 0 50 GFAA CCOc1cc2c(c3[nH]c(C(=O)N4C[C@H](C(N)=O)CC[C@H]4C)cc13)O[C@@H](C)C2 229755730 OCAUEIOZOLDUNZ-FRRDWIJNSA-N 385.464 2.616 0 50 GFAA C[C@@H]1CCc2c(sc(NC(=O)c3cc(C(F)(F)F)nn3C)c2C(N)=O)C1 2747805 MVLLXYJIHDEVHD-SSDOTTSWSA-N 386.399 2.976 0 50 GFAA CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(F)(F)F)cn1 425110998 NPEPLLNZRQUNTA-MRXNPFEDSA-N 377.366 2.804 0 50 GFAA COCCn1cc(CNC(=O)c2ccn(-c3cccc(C(F)(F)F)c3)n2)cn1 281693609 ASADDJCHVICDOZ-UHFFFAOYSA-N 393.369 2.664 0 50 GFAA CS(=O)(=O)C1(C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)CCC1 281637360 QMPFCDGLGJNNEJ-UHFFFAOYSA-N 387.383 2.797 0 50 GFAA Cc1c(CN(C)C(=O)C[C@@H]2C(=O)NCCN2CC(C)(C)C)[nH]c2ccccc12 72161169 GIJRPIRIWBJITE-LJQANCHMSA-N 384.524 2.671 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@@H](O)COCc2cccs2)n1C 328629625 IKPWLQGGXKCJTO-QAPCUYQASA-N 391.537 2.551 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCN(Cc3ccncc3Cl)CC2)c1 173467209 NMPRNVSOUDXFEK-UHFFFAOYSA-N 379.913 2.858 0 50 GFAA Cc1ccccc1-n1cc(C(=O)N2CCC(n3cc(C(=O)O)cn3)CC2)cn1 263273701 XSWIXVCUBHOXBA-UHFFFAOYSA-N 379.420 2.553 0 50 GFAA CCCc1ccc(CN2CCC[C@@H](c3nnc(CN4CCOCC4)n3C)C2)o1 426484933 XNZGBKYETAOWHN-QGZVFWFLSA-N 387.528 2.572 0 50 GFAA CCc1oc2c(Cl)cc(NC(=O)N3CCNC(=O)[C@@H]3CCO)cc2c1C 426374443 WUXYKARRCSQXKE-AWEZNQCLSA-N 379.844 2.672 0 50 GFAA O=C(C1CC1)N1CCC[C@@H](Cn2cc(-c3ccc(-n4cccn4)cc3)nn2)C1 91943712 ZKRUHLUVADWSTA-MRXNPFEDSA-N 376.464 2.779 0 50 GFAA COc1ccc(CN(C)Cc2ccccn2)cc1OC[C@@H](O)CN1CCCC1 95525801 YECLBMNMUAZZDG-FQEVSTJZSA-N 385.508 2.558 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2CCN(C(=O)c3ncoc3C3CC3)CC2)n1 91894275 XCABRLGIOBRIMW-UHFFFAOYSA-N 381.358 2.632 0 50 GFAA CC(C)c1ccc(N2C[C@H](C(=O)NCc3ncc4c(n3)CCC4)CC2=O)cc1 92065760 PGZRYWPFWVTRLG-QGZVFWFLSA-N 378.476 2.758 0 50 GFAA Cc1nn(C)cc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91745848 NNVHJFAVIOLORD-UHFFFAOYSA-N 394.519 2.816 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2ccc(F)c(F)c2)C3)[nH]n1 91440568 RRWIDHRHDVVNLR-UHFFFAOYSA-N 388.418 2.651 0 50 GFAA Cc1nccn1CC1(CNC(=O)N2CCC[C@@H](OCc3ccccn3)C2)CC1 534651699 RVTDGBVHYQILOJ-LJQANCHMSA-N 383.496 2.758 0 50 GFAA Cc1ccc(-c2cc3n(n2)[C@H](NCc2ccc4c(c2)OCO4)CNC3=O)c(C)c1 263618098 RFKABVRBUSDZIJ-NRFANRHFSA-N 390.443 2.927 0 50 GFAA O=C(NC[C@H](c1ccccn1)N1CCOCC1)c1c[nH]nc1C1CCCCC1 828138366 DLJNBCRYVDFPRC-LJQANCHMSA-N 383.496 2.656 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)C2(c3ccccc3F)CC2)cc1 825176940 WWOTWRZCEWEDBX-UHFFFAOYSA-N 390.480 2.651 0 50 GFAA Cc1csc(NC2CCN(C(=O)[C@H]3CSCN3C(=O)C(C)(C)C)CC2)n1 170598531 NKBIIXKBTHNUOF-CQSZACIVSA-N 396.582 2.802 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](O)[C@H](Cc3cnccn3)C2)c2cccc(Cl)c2n1 1704341354 ZONGIUBCIHDZTD-FZKQIMNGSA-N 382.851 2.662 0 50 GFAA Cc1ccsc1C(=O)N1CCCN(CC(=O)N2CCc3ccccc32)CC1 1772710607 NLSMKUVRIPXUGH-UHFFFAOYSA-N 383.517 2.794 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)CSC 11956623 KTAYDEPLQBDCNT-QGZVFWFLSA-N 376.566 2.704 0 50 GFAA Cc1cccc(C(=O)NC(=S)Nc2ccc(C(=O)N3CCOCC3)cc2)c1 12138825 CJWRTUHRUZSVPT-UHFFFAOYSA-N 383.473 2.594 0 50 GFAA C[C@]1(COc2ccc(C(=O)N3CCC(Cn4cccn4)CC3)cn2)CCCNC1 12429833 YIFDAIOZQQVSCK-QFIPXVFZSA-N 397.523 2.599 0 50 GFAA COc1ccc(F)c(C[C@@]2(CCC(=O)NCc3cccnc3)CCC(=O)N2)c1 14880399 PYNJHOIMSXEOKO-OAQYLSRUSA-N 385.439 2.517 0 50 GFAA O=C(NCCN1CCCOCC1)N1CC[C@H](c2ccccc2C(F)(F)F)C1 1857527442 KGCOQXZUYULZRR-HNNXBMFYSA-N 385.430 2.927 0 50 GFAA NC(=O)Cc1nc([C@@H]2CCn3nccc3C2)n(-c2ccc(Cl)c(Cl)c2)n1 1857670775 BQBVXZGCHZSXBX-SNVBAGLBSA-N 391.262 2.528 0 50 GFAA O=C(NCc1cscn1)[C@@]12CCCCN1C[C@@H](Nc1cc(C3CC3)ncn1)C2 1857683949 SGJBOTKDHXZOCW-YWZLYKJASA-N 398.536 2.536 0 50 GFAA CS(=O)(=O)c1ccc(-c2nccn2[C@H]2CCOC3(CCOCC3)C2)cc1 1857726978 GUDYFOPUBXEYFP-INIZCTEOSA-N 376.478 2.854 0 50 GFAA CCN(C)c1nc(C)nc2c1CC[C@]21CCCN(C(=O)c2cc(OC)ccn2)C1 1875243962 GBKIRNFNPDKXMF-QFIPXVFZSA-N 395.507 2.765 0 50 GFAA Cc1cnc(C)c(-c2cc(F)c3c(c2)C[C@@H](CNC(=O)[C@H]2CCCCN2C)O3)n1 12131410 SGVSYOXJNKMLAO-PKOBYXMFSA-N 398.482 2.804 0 50 GFAA C[C@@H](N1CCN(C[C@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1)C(F)(F)F 240555615 GWQAPVMHOQGERQ-LAVFITLUSA-N 390.490 2.925 0 50 GFAA Cc1ccc(C[C@H](CO)NC(=O)[C@H](NC(=O)OC(C)(C)C)C2CCC2)cc1 817595124 QBRGTWLJNXAGHV-QZTJIDSGSA-N 376.497 2.708 0 50 GFAA O=C(NC[C@H]1CS(=O)(=O)c2ccccc21)N1CC[C@]2(CCc3ccccc32)C1 873027105 MLJFXIYNXPCKMV-HTAPYJJXSA-N 396.512 2.857 0 50 GFAA O=C(N[C@@H]1CC2(CCCC2)Oc2ccccc21)C(F)(F)c1cnc(O)nc1O 1875262828 NQJZUPGTCDTZRF-CYBMUJFWSA-N 391.374 2.932 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1)N1C[C@H]2[C@H](O)C[C@H]2C1 1875269557 YWTXDGWBZURJKA-BMGDILEWSA-N 378.407 2.526 0 50 GFAA CS[C@@H](CNC(=O)N1Cc2nc(O)nc(O)c2C1)c1cccc(Cl)c1 1875300605 KDRBZFOJASJDBO-ZDUSSCGKSA-N 380.857 2.671 0 50 GFAA O=C([C@H](Cc1ccc(F)cc1)c1ccccc1)N1CC[C@](CCO)(C(=O)O)C1 1875313918 XYNOFRIUDSATHP-DENIHFKCSA-N 385.435 2.838 0 50 GFAA Cc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)nc1 1875310137 GCEGGRSHKLGLLM-NWDGAFQWSA-N 380.370 2.858 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@H]([C@@H]3CCCCN3c3ncc(F)cn3)C2)n1 1875312496 MZQWPSSIJDGHNP-QAPCUYQASA-N 386.475 2.743 0 50 GFAA CCOCc1nc(C(=O)NS(=O)(=O)Cc2ccc(Cl)c(F)c2)cs1 2325773642 FOOLSUBYKMBBSE-UHFFFAOYSA-N 392.861 2.732 0 50 GFAA CC(C)CCN1C[C@H](CC(=O)NCC(C)(C)c2ccn(C)n2)OCC12CCC2 2325785394 WHWFMULLTDHCQD-SFHVURJKSA-N 390.572 2.874 0 50 GFAA COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3ccc(Br)cc32)cc1 659165 LUZKTAQYDAYQDL-KRWDZBQOSA-N 376.206 2.870 0 50 GFAA O=C(Nc1nc2ccc(S(=O)(=O)N3CCCC3)cc2s1)c1ccncc1 937599 KOOAHIKUKNUZFS-UHFFFAOYSA-N 388.474 2.728 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356134015 SRCLZFRKYYFHNN-QFIPXVFZSA-N 379.508 2.729 0 50 GFAA Cc1nc([C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)n(C2CCN(C)CC2)n1 2356144983 VLWYTOOVLRURRG-RTWAWAEBSA-N 397.523 2.903 0 50 GFAA O=S1(=O)CC[C@H](CCN2CCC3(CC2)OCCc2c3[nH]c3ccccc23)C1 2356145785 WNVCQHDVXWSVGA-INIZCTEOSA-N 388.533 2.857 0 50 GFAA CCOc1ccccc1NC(=O)N1CCC[C@]12CCCN(CCOC)C2=O 2356153362 CVLONDLQGGCALK-FQEVSTJZSA-N 375.469 2.721 0 50 GFAA CCCCn1c(C)cn2c3c(=O)n(Cc4ccccc4C)c(=O)n(C)c3nc12 4250990 MGWDAVBQVWKYTP-UHFFFAOYSA-N 379.464 2.615 0 50 GFAA COC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc(OC)c(OC)cc2Cl)C1=O 4951969 HNGMQXOAWCIWNP-UVDXRHSJSA-N 385.825 2.955 0 50 GFAA CCCS(=O)(=O)N1CCC[C@H](C(=O)Nc2cccc(Br)c2)C1 6743773 OEKOEPJEDVWRCU-LBPRGKRZSA-N 389.315 2.839 0 50 GFAA Cc1ccc2cc(C3(O)CCN(C(=O)CCn4ccnc4C)CC3)ccc2n1 67789657 WNCBKZLVYQPLOS-UHFFFAOYSA-N 378.476 2.948 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@@H]2CCCNC2=O)CCO3)s1 67886185 RDGMTGHIMJAXKC-OAHLLOKOSA-N 386.473 2.676 0 50 GFAA O=C1C[C@H](c2cccnc2N2CCOCC2)c2cnn(-c3ccccc3)c2N1 65394202 MAJCJTBBAHRVBF-QGZVFWFLSA-N 375.432 2.578 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)cc1 171988723 QJRABYGRKCJWPK-PZJWPPBQSA-N 393.487 2.614 0 50 GFAA O=C(Cn1cc(C(=O)C2CC2)c2ccccc21)NCc1cn2c(n1)SCC2 216004015 PYPQFGDWCOSZIX-UHFFFAOYSA-N 380.473 2.853 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccnc(N)c2)CCC(=O)N1Cc1ccc(F)cc1 71440149 XQYOLGYRRKFIIB-GOSISDBHSA-N 384.455 2.702 0 50 GFAA CC(=O)N/C(=C/c1ccccc1)C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 362167814 XLBDWGZRHVAOOS-LTGZKZEYSA-N 397.519 2.661 0 50 GFAA COc1cc(CC2CN(C(=O)NC[C@@H]3CCN(CC(C)C)C3)C2)cc(OC)c1 363969788 LEVGPRNHOOGLDC-KRWDZBQOSA-N 389.540 2.866 0 50 GFAA CCN(C(=O)Nc1ccccc1-n1nc(C)cc1C)[C@H]1CCS(=O)(=O)C1 181155113 AGRSSRDUEJQRBO-HNNXBMFYSA-N 376.482 2.530 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)[C@H]2CCOC2)CC1 12718430 HYYRUIGDLCMQNH-INIZCTEOSA-N 382.464 2.644 0 50 GFAA COC(=O)C1CCN([C@H](C)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)CC1 125987119 QDYQKAKENWXHBT-SSDOTTSWSA-N 380.313 2.594 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)N[C@@H]3CCc4nc(C(C)(C)C)cn4C3)cn21 333191574 SGFMQWCYKPVBPD-ZIAGYGMSSA-N 391.541 2.568 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)N2CC=C(c3ccc(F)cc3)CC2)CCC(=O)N1 220533881 NGRDABNBRVSJPL-NRFANRHFSA-N 388.439 2.735 0 50 GFAA O=C(Cc1ccc(O)cc1)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 82137676 SQQURUPQOYJSQW-UHFFFAOYSA-N 382.508 2.986 0 50 GFAA CN(C)c1nc(N)cc(-c2ccc(C(=O)NCCCOC3CCCC3)cc2)n1 426597431 RFNMGGNRFGGBGW-UHFFFAOYSA-N 383.496 2.871 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2ccc(-n3nc(C)cc3C)cc2)on1 95369920 QAMBFORIDIHYRT-XLIONFOSSA-N 380.448 2.773 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@H]3CCCCN3Cc3nncn3C)cc2)n1 95527452 CWHPZFVHZPBQPY-LJQANCHMSA-N 393.495 2.611 0 50 GFAA O=C(NCCCc1nc2ccc(F)cc2[nH]1)c1cnc(-c2cccnc2)nc1 95384168 SJNNOKQHPNKYDB-UHFFFAOYSA-N 376.395 2.917 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)CCn3nnc4ccccc43)C2)c1 95388731 PLFWHUJIMVSUKP-KRWDZBQOSA-N 378.432 2.926 0 50 GFAA Cc1ccncc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91693809 QMHVVEBSYBVUHV-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA COCC(=O)N(CC1CCN(C2Cc3ccccc3C2)CC1)C[C@@H]1CCCO1 95508673 KJJZXTYVXMVRLO-QFIPXVFZSA-N 386.536 2.520 0 50 GFAA CN1C(=O)N=C2[C@H]1[C@@H](c1ccc3c(c1)OCO3)CC(=O)N2c1ccc(F)cc1 253471127 MDBDCOKNMZIGQV-RDTXWAMCSA-N 381.363 2.907 0 50 GFAA CCOc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)C2)ccc1OCC(=O)O 299751853 RZIHAEMPLDTACZ-GFCCVEGCSA-N 375.343 2.963 0 50 GFAA CCOc1ccc(CCCNC(=O)N2C[C@@H]3CN(C)C[C@@H]3C2)cc1OCC 534649246 ZMOCRFJATJRMMY-HDICACEKSA-N 375.513 2.620 0 50 GFAA CN(C)C[C@@H]1COCCN(C(=O)NCC2(c3ccccc3F)CCCC2)C1 534583354 LSTIFRLVXAMIHG-KRWDZBQOSA-N 377.504 2.857 0 50 GFAA O=C(C[C@@H]1CCc2ccccc21)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 828003443 AQWDDAPMUKQTBG-AFPWGUCCSA-N 377.492 2.957 0 50 GFAA Cc1ccc(C)c(OCCNC(=O)N2CCCN(Cc3ccccn3)CC2)c1 584902456 NOBWDYCHYBKUSP-UHFFFAOYSA-N 382.508 2.995 0 50 GFAA COc1cccc(SCC(=O)NC2CCN(C(=O)N3CCCC3)CC2)c1 952984848 NYXJYTQHMXMNQS-UHFFFAOYSA-N 377.510 2.584 0 50 GFAA CC(C)(C)OC(=O)N1CCC2(CC1)CNCCN2C(=O)OCc1ccccc1 91302680 ATDGPGLBEKGNMQ-UHFFFAOYSA-N 389.496 2.998 0 50 GFAA in-vitro COc1ccccc1N1C[C@@H](C(=O)N2CCC(c3ccncc3)CC2)CC1=O 192273363 UWZJEKLYPSXNPE-SFHVURJKSA-N 379.460 2.849 0 50 GFAA COc1cccc2c1CCN(C(=O)c1cc(N3C[C@@H](C)O[C@H](C)C3)ccn1)C2 192462515 NUOAQXOQSHFJTN-HZPDHXFCSA-N 381.476 2.902 0 50 GFAA COc1cc(CNC(=O)[C@H]2Cc3cc(Br)ccc3O2)ccc1O 194475861 WOOUWZLTHDYWBD-MRXNPFEDSA-N 378.222 2.783 0 50 GFAA O=C1C[C@H](C(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)C2(CCCC2)O1 1506420121 VDHNGASIWUEJRU-RQJZOYDLSA-N 386.536 2.975 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCOc2ccc(Cl)cc2C1 1506429393 SJVHYJTUTXIHHN-UHFFFAOYSA-N 385.855 2.748 0 50 GFAA Cn1ccn2ncc(C(=O)N3CCCN(c4nc5ccccc5s4)CC3)c12 1506431744 XLOPNGOZBYVEBT-UHFFFAOYSA-N 380.477 2.635 0 50 GFAA CCc1nc(CN2CCCN(C(=O)CCc3ccc(Cl)cc3)CC2)n[nH]1 1772710075 OFHFWLVJCYFUAQ-UHFFFAOYSA-N 375.904 2.688 0 50 GFAA Cc1ccc(N2C(=O)C[C@@H](NC3CCN(Cc4ccccc4)CC3)C2=O)cc1 5111984 CBUPVGYWCGHUAN-OAQYLSRUSA-N 377.488 2.881 0 50 GFAA O=C(c1cc(COc2cncc(Cl)c2)on1)N(CCO)Cc1cccs1 12226837 BNKRPAPGNZEOEE-UHFFFAOYSA-N 393.852 2.998 0 50 GFAA Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@H](NCc1ccco1)C2 14744698 WMVYWLYIJLAOEY-SFHVURJKSA-N 390.487 2.859 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@H]2CCCN(C3CCCCCC3)C2)CC1 14966113 IVZXDWOUSMSWNU-SFHVURJKSA-N 378.561 2.683 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CNCC2(O)CCCCC2)cc1OC 15070835 ZYUVBEOPAWQWAH-IBGZPJMESA-N 394.556 2.562 0 50 GFAA O=c1c2cnc(N3CCOCC3)nc2ccn1-c1cc(Cl)cc(Cl)c1 19974170 FYVVKTULJRUVTQ-UHFFFAOYSA-N 377.231 2.924 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cccnc4)ccn3n2)cc1C 169775942 DIGXIMKEAFLWIN-UHFFFAOYSA-N 387.443 2.605 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCc2[nH]nc(C3CC3)c2CC1 1857677013 VJDKNSFFAQXPSH-UHFFFAOYSA-N 387.867 2.882 0 50 GFAA Cc1cc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4ccccn4)C3)C2)cc(C)n1 1857704049 BKCYLNZVPWCHCT-IFMALSPDSA-N 380.492 2.587 0 50 GFAA Cc1cc(C)c(CN[C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c(C)c1 112506100 YENPLBZLGCYNEW-HXUWFJFHSA-N 395.551 2.997 0 50 GFAA COc1ccc([C@H](CNC(=O)C[C@@H](CN)OC)c2c[nH]c3ccccc23)cc1 262971440 XQXBVTUBPDVUEG-HKUYNNGSSA-N 381.476 2.788 0 50 GFAA CO[C@H](C)c1nsc(N2CCC(c3nccc(-c4cnn(C)c4)n3)CC2)n1 952894373 NWSCGSWUMHSYBY-GFCCVEGCSA-N 385.497 2.820 0 50 GFAA Cc1ccsc1CN(C)C(=O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1nccn1C 952992973 JGZVIXPPXZOBFO-YJBOKZPZSA-N 386.521 2.891 0 50 GFAA COC(=O)[C@](C)(CNC(=O)c1c(C)nc2sccn12)c1ccccc1F 1875268636 BHYMEJGILJYDTD-GOSISDBHSA-N 375.425 2.704 0 50 GFAA Cc1nc([C@H]2CN(C)CC23CN(C(=O)c2ccc(-c4ccc(F)cc4)o2)C3)n[nH]1 1875269451 OUBSBEBHUJMFHV-MRXNPFEDSA-N 395.438 2.684 0 50 GFAA O=C1NCCCN1CCCNC(=O)N1CCC[C@H](c2c[nH]c3ccccc23)C1 1875296022 VRKPDQTZBGKNEW-INIZCTEOSA-N 383.496 2.862 0 50 GFAA COc1cccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1F 1875258689 WFXFCYVUWYZDFO-LBPRGKRZSA-N 398.481 2.935 0 50 GFAA CC[C@H](C)c1nc(CN2CC(=O)N(C)C2=O)n(-c2ccc(F)c(F)c2F)n1 1875324731 LGYQRIBZJGKCGP-VIFPVBQESA-N 381.358 2.592 0 50 GFAA CC(C)c1ncsc1C(=O)N(C)C1CC(NC(=O)[C@H](F)C(F)(F)F)C1 1875303198 AWSCBNVSGNIRAD-KWPJZBAWSA-N 381.395 2.886 0 50 GFAA C[C@H]1C[C@@H](CNC(=O)c2cc3cnccc3[nH]2)CN1C(=O)c1coc(C2CC2)n1 1875309658 HGCMECNOZMIRSK-STQMWFEESA-N 393.447 2.709 0 50 GFAA CC(C)Oc1ccccc1-c1cccc2c1CN([C@@H]1CCC(=O)NC1=O)C2=O 1875328562 YQWQRSIDJVTWAK-GOSISDBHSA-N 378.428 2.902 0 50 GFAA COc1ccc(-c2[nH]c3ccc(F)cc3c2CCC(=O)NS(C)(=O)=O)cc1 1875390763 HNUWJOCPPSCVRG-UHFFFAOYSA-N 390.436 2.991 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)Cc1cc(-c2ccccc2)on1 1875400908 CFCLRBXAYOPQCP-APWZRJJASA-N 393.447 2.718 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1 888101724 PUWPKNSJQAWATC-VXIBKDFQSA-N 394.537 2.950 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2ccc(-c3cc[nH]n3)cc2)CC[C@@H]1O 2100534571 OBWFJZZOUYYCLV-GHTZIAJQSA-N 385.464 2.791 0 50 GFAA CCc1cc(C(=O)N[C@H]2C[C@H](NC(=O)[C@H](CC)Cc3ccccc3)C2)c(C)nn1 2325794177 TXUBEDDDOFSBSP-MISYRCLQSA-N 394.519 2.993 0 50 GFAA NC(=O)c1c(NC(=S)NC(=O)c2ccc(F)cc2)sc2c1CCCC2 1156863 KGRDWVFUDUCBBM-UHFFFAOYSA-N 377.466 2.992 0 50 GFAA O=C(c1cccc2c1COC2)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356160052 ATZXDYUYXONMDS-QHCPKHFHSA-N 391.471 2.909 0 50 GFAA CC(=O)N1CCN(c2ccccc2NC(=O)c2ccc(Br)o2)CC1 6703187 RHRMEWKGGITYRL-UHFFFAOYSA-N 392.253 2.963 0 50 GFAA Cc1ccc(OCCN(C)Cc2ccc(CN(C)S(C)(=O)=O)o2)c(C)c1 55415106 GBLKEFQCNLBYBO-UHFFFAOYSA-N 380.510 2.799 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@H]1NCCOc1cc(Cl)cc(Cl)c1 225671684 NISVOVOKWOGNAV-HUUCEWRRSA-N 381.325 2.822 0 50 GFAA CCN1CCN(C2(C(=O)N[C@@H]3CCc4ccccc43)Cc3ccccc3C2)CC1 23359128 TTXDVGPKARZYGP-HSZRJFAPSA-N 389.543 2.965 0 50 GFAA O=C(C1CCN(Cc2cccc(OCc3ccccn3)c2)CC1)N1CCOCC1 179691513 JIWOTYBXCCPFKB-UHFFFAOYSA-N 395.503 2.731 0 50 GFAA CN(C(=O)CCc1nc(-c2ccco2)no1)[C@H]1CCCN(c2ccccc2)C1=O 115502843 JVMGJGBTKIUPMI-INIZCTEOSA-N 394.431 2.916 0 50 GFAA Cc1cc(C(=O)N2CCC(n3cc([C@@H](C)O)nn3)CC2)ccc1-n1cccc1 20560756 XYUAIAUJMMTRNI-MRXNPFEDSA-N 379.464 2.908 0 50 GFAA CN(C[C@H]1CCCN1C)C(=O)c1coc(COc2cccc3cccnc23)n1 67983504 FKFQTCLHINOFQH-MRXNPFEDSA-N 380.448 2.968 0 50 GFAA Cc1c(C(=O)N(C)C(C)C)sc2ncnc(NCCCN3CCOCC3)c12 23338655 BVDQZCVCFHZVGO-UHFFFAOYSA-N 391.541 2.614 0 50 GFAA O=C(N[C@@H]1CCc2c[nH]nc2C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1 468089825 ZIXHXLIDZCLQIH-QGZVFWFLSA-N 384.443 2.945 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)cc1 21795062 BDHFAMIADNCPOS-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA COc1cc(NC(=O)CN[C@@H]2CCCN(C(=O)c3ccco3)C2)ccc1Cl 65398900 UYXDPNUUCCSBIE-CQSZACIVSA-N 391.855 2.775 0 50 GFAA C[C@@H](Oc1cccc(F)c1)C(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1 120041415 LJAIMPUQDWLLJW-CYBMUJFWSA-N 392.452 2.920 0 50 GFAA Cn1c(=O)c(-c2nccn2Cc2nc3ccccc3c(=O)[nH]2)cc2ccccc21 71749132 QEUFTMVPEPCFAS-UHFFFAOYSA-N 383.411 2.687 0 50 GFAA COc1ccc(C(=O)N2C[C@@H](NC(=O)C3CC3)[C@H](c3ccc(C)cc3)C2)cc1O 77341862 GZEBMSWZAGLBSE-RBUKOAKNSA-N 394.471 2.844 0 50 GFAA Cc1c(CN(C)C(=O)CC[C@@]2(CCC(=O)O)CCC(=O)N2)[nH]c2ccccc12 218924847 FEPKWYFXKZLJME-OAQYLSRUSA-N 385.464 2.729 0 50 GFAA CC[C@H]1CN(C(=O)Nc2ccc(N3CCCC3)nc2C)CCN1CCOC 122550318 OYANOKBWFJZOPI-KRWDZBQOSA-N 375.517 2.565 0 50 GFAA CCC(CC)N1C[C@H](C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1=O 152780833 GZANEFWGTGZHIU-LJQANCHMSA-N 399.535 2.692 0 50 GFAA CN(Cc1ccccn1)Cc1ccccc1-c1nc([C@@H]2CCOC2)cc(=O)[nH]1 32573232 HTMCPHVVFLSBSS-QGZVFWFLSA-N 376.460 2.968 0 50 GFAA C[C@@H](C(=O)N(C)C1CCCCC1)[S@@](=O)Cc1nc(O)cc(C(F)(F)F)n1 155291571 CBFQDWNDMKVRSA-RSNKEIGGSA-N 393.431 2.629 0 50 GFAA COC(=O)c1cc2c(=O)n(Cc3ccc(OC)cc3)ccc2nc1/C=C/N(C)C 72406631 WUVWBLZJAVWYPI-PKNBQFBNSA-N 393.443 2.772 0 50 GFAA CCOC(=O)c1c[nH]c(=O)c([C@H](CC(=O)O)c2c(F)cccc2Cl)c1O 218203455 LXZNQIBYJUDPSA-MRVPVSSYSA-N 383.759 2.656 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 261858311 PKHISXPPSRZIQN-YGRLFVJLSA-N 385.247 2.531 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)cc1C 72442512 JMPZGIPQRSVPJN-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Nc1ncc(Cl)cc1S(=O)(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1 333873064 CAFSSTKGFJVHDA-INIZCTEOSA-N 393.896 2.860 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCCN2CCc3sccc3C2)cc1 173761091 YDKITJYPBFOEGX-IBGZPJMESA-N 397.544 2.722 0 50 GFAA CCCCN(C)C[C@H](C)NC(=O)C1CCN(C(=O)COc2ccccc2)CC1 242047863 VQSFSRMWTCGSFE-SFHVURJKSA-N 389.540 2.541 0 50 GFAA CCNc1nc(C)cc(NCCNS(=O)(=O)c2cc(C)c(C)cc2C)n1 82230718 CISNNJCLLMLTCX-UHFFFAOYSA-N 377.514 2.532 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)CN2CCc3ccccc3C2)n1 223750561 SQUQOUNDMHJWBL-UHFFFAOYSA-N 378.398 2.521 0 50 GFAA O=C(CCN1Cc2ccccc2C1)NCCc1csc(-c2ncccn2)n1 223035116 ZDFATVUDGYAPQI-UHFFFAOYSA-N 379.489 2.665 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 180308630 PRVJVMVBYYVSSH-QGZVFWFLSA-N 384.929 2.736 0 50 GFAA Cc1cc(C)c2oc(C(=O)N3CCN(CCc4ccncc4)CC3)cc(=O)c2c1 91401460 VUWCKYSQHZWBKV-UHFFFAOYSA-N 391.471 2.805 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1)c1ncc[nH]1 92022542 TWACOFSHGQXVJU-CYBMUJFWSA-N 376.482 2.512 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)Nc1c(C)ccc2nsnc12 96150789 YVZPXSIIQZRICJ-UHFFFAOYSA-N 377.499 2.833 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(C(=O)C3C(C)(C)C3(C)C)CC2)n1C 96163991 JLCZZXPOQVKSDA-UHFFFAOYSA-N 384.528 2.757 0 50 GFAA O=C(NCc1ccco1)c1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)c1 239165255 NTXAEMXTNHARBB-RPZLJYRGSA-N 388.423 2.767 0 50 GFAA CN(C)S(=O)(=O)N1C[C@@H]2CC[C@H](C1)N(Cc1ccc(Cl)cc1Cl)C2 95392322 HVXARLMSFRYIGQ-IUODEOHRSA-N 392.352 2.696 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(C(=O)Nc1cccc(F)c1)CC2 91526852 DNNZNYODVRUDSA-UHFFFAOYSA-N 376.476 2.624 0 50 GFAA COCc1noc([C@@H](C)N2CCN(Cc3cc(Cl)ccc3OC)CC2)n1 181499339 OPHLTGHCLCONPA-CYBMUJFWSA-N 380.876 2.757 0 50 GFAA CCNC(=O)COc1cccc(CNC(=O)N2CC[C@H](c3ccccc3)C2)c1 299315087 IIPRCNQKHMNDMH-IBGZPJMESA-N 381.476 2.901 0 50 GFAA Cc1ncsc1CCN(C)C(=O)NC1(CN2CCOCC2)CCCCC1 534592789 DWMYVFDEJOMBLJ-UHFFFAOYSA-N 380.558 2.671 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1ccc2c(c1)OCO2 1940196273 XEVLZFRKRAONQE-VQIMIIECSA-N 376.412 2.951 0 50 GFAA COc1cc(CC(=O)Nc2n[nH]c(-c3cccc(C)c3)n2)cc(OC)c1OC 1940197435 QJYXKGXAHZTTES-UHFFFAOYSA-N 382.420 2.987 0 50 GFAA COc1cccc(OCC(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccn2)C3)c1 1565516992 PGTKOTVLBHFANV-MJGOQNOKSA-N 381.476 2.592 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccnc(O[C@H]2CCOC2)c1 273330222 RAIWVJQXUFNTKS-KRWDZBQOSA-N 381.432 2.702 0 50 GFAA CC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)C1 185196732 GYTRPOOMYPBYPN-CABCVRRESA-N 383.414 2.659 0 50 GFAA CC(C)c1ccc(/C=C/C(=O)N[C@H]2CCO[C@]3(CCS(=O)(=O)C3)C2)cc1 170591864 RKKOTKLEDHZQIX-WQHZJRCTSA-N 377.506 2.676 0 50 GFAA CC(C)(C)c1noc(CCCC(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)n1 170594190 QPZBQYJSYXPYAU-KRWDZBQOSA-N 388.443 2.529 0 50 GFAA CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 170596163 RUCQOCCYDZRMGC-XLIONFOSSA-N 399.516 2.560 0 50 GFAA CN(C)c1cccc(S(=O)(=O)N2C[C@@H](n3ccnc3)Cc3ccccc32)c1 170606309 KZXUSTKEHUWNIN-SFHVURJKSA-N 382.489 2.942 0 50 GFAA COc1ccc(-c2oc3c(O)cc(-c4nnn(C)n4)cc3c2CC(=O)O)cc1 1776111753 OKQDRUDNOLLNEH-UHFFFAOYSA-N 380.360 2.632 0 50 GFAA COc1ncc(CN2CC[C@]3(CCCN(Cc4ccccc4F)C3=O)C2)cn1 11708288 CSHNIXZFSKWOKU-OAQYLSRUSA-N 384.455 2.639 0 50 GFAA CN(C(=O)CCN1CCCCCC1=O)[C@H]1CCCN(CCc2ccccc2)C1 12195811 GGIOMUQNJGQCEO-NRFANRHFSA-N 385.552 2.945 0 50 GFAA O=C1CCN(C(=O)C2(c3ccccc3)CC2)CCN1CCOc1ccccc1 15007793 ZBQONJLBIBQPDN-UHFFFAOYSA-N 378.472 2.858 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CCCN(CCCn3cccn3)C2)CC1 19217640 ZPLMXGIPUWWQJG-HXUWFJFHSA-N 383.540 2.568 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@H](n3cc(-c4nc(C5CC5)no4)nn3)C2)cc1C 169778238 QWIVGVGVIKEYJV-MRXNPFEDSA-N 378.436 2.910 0 50 GFAA COCCN[C@@H]1CCc2c(sc3ncn(CCc4ccccc4)c(=O)c23)C1 200562180 QOQRNKJXBWCCQR-MRXNPFEDSA-N 383.517 2.794 0 50 GFAA O=C(c1cc[nH]c1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857670401 MDLPCMHRDHCEMC-OAQYLSRUSA-N 375.432 2.693 0 50 GFAA COCCn1cnnc1[C@H](C)n1ccnc1-c1cc2ccc(OC)cc2nc1O 1857694390 ACUROAFSWIEPFT-ZDUSSCGKSA-N 394.435 2.660 0 50 GFAA O=C(O)c1n[nH]c2c1CN(C(=O)c1cc(-c3cccnc3)nc3ccccc13)CC2 1857711284 RFIWOAQEUOGDSI-UHFFFAOYSA-N 399.410 2.917 0 50 GFAA O=C1CCOC2(CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)CN1 1857734914 YQJPYYIUIUESKA-UHFFFAOYSA-N 378.472 2.794 0 50 GFAA NCC(=O)N1CCC2(CC1)OCCc1cc(-c3ccc4nc[nH]c4c3)sc12 1857739275 NPIINCHNESBNDE-UHFFFAOYSA-N 382.489 2.641 0 50 GFAA CS(=O)(=O)N1CC[C@H](CNC(=O)CC(c2ccccc2)c2ccccc2)C1 129893043 WYZHMVBEFUNROH-QGZVFWFLSA-N 386.517 2.606 0 50 GFAA C[C@@H](O)C[C@@H](C)NC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)ccc1F 831995632 JANSWPOMHOALPJ-VXGBXAGGSA-N 398.431 2.655 0 50 GFAA NC(=O)[C@@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)c1ccc(Cl)cc1 1875260123 BIZGSPWYMIXDEV-SFHVURJKSA-N 385.851 2.813 0 50 GFAA CCOc1cccnc1S(=O)(=O)N1CCC(OCc2ccccc2)CC1 1875298694 KLGOLWFWWNSYJO-UHFFFAOYSA-N 376.478 2.850 0 50 GFAA Cc1nc(C)c(CC(=O)NCC[C@@H]2CCN(C(=O)c3cc(Cl)c[nH]3)C2)s1 1875332485 UQECQANLOKWLFS-CYBMUJFWSA-N 394.928 2.953 0 50 GFAA Cc1cc(=NC[C@@H](O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[nH]c(CO)n1 1875305300 PFECRRIQBWCUPY-GFCCVEGCSA-N 395.303 2.882 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875402570 HMOCKNNIQBTVJA-DJIMGWMZSA-N 381.432 2.721 0 50 GFAA CC(C)c1ccc(C[C@@H](NC(=O)c2ccccc2)C(=O)N[C@@H](C)C(=O)O)cc1 4742769 MUBGUUXDHCFYLH-HNAYVOBHSA-N 382.460 2.740 0 50 GFAA O=C1NC[C@H]2CC[C@H]1N2C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 2325790479 OGRZWZLDUCNERK-SJLPKXTDSA-N 392.484 2.730 0 50 GFAA Cn1[nH]c(=NC(=O)c2cnc(-c3ccccc3)nc2C(C)(C)C)c2c1CCOC2 2325805055 MHTKUCVTVHBTOL-UHFFFAOYSA-N 391.475 2.922 0 50 GFAA O=C(O)c1cccc(S(=O)(=O)NC[C@@H](O)c2csc3ccccc23)c1 2325875526 VANUTSMIPWIUPB-OAHLLOKOSA-N 377.443 2.611 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)NCc2cc(Cl)c3c(c2)OCCCO3)C1 2325888626 LBZDZWIRDUFWCL-CQSZACIVSA-N 378.856 2.542 0 50 GFAA COc1ccc(OC)c([C@H]2C(C(=O)Nc3cccnc3)=C(C)Nc3ncnn32)c1 949752 IGYWUKXPORFHPS-SFHVURJKSA-N 392.419 2.618 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Br)cc2)CC1 1116019 JFBHYAQINHBNSR-LBPRGKRZSA-N 385.258 2.517 0 50 GFAA CCn1nc(CC(C)C)cc1C(=O)N1CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C1 2356142753 FYMZRYMJYNKBRO-WIYYLYMNSA-N 393.528 2.816 0 50 GFAA CCOC(=O)CNC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2ccccc12 2774050 NLRXIWCXVUDUMD-UHFFFAOYSA-N 378.384 2.923 0 50 GFAA CN(C)c1ccc(S(=O)(=O)Nc2cnc(Cl)c(Br)c2)cn1 225400469 VJSOFVOYAZYMJY-UHFFFAOYSA-N 391.678 2.759 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2C[C@@H](C)O[C@@H](C(=O)OC)C2)cc1OC 225766755 MHQGGCOIVBWXGF-IAQYHMDHSA-N 385.844 2.540 0 50 GFAA CC(C)CN(C)C(=O)C[C@@H]1C(=O)NCCN1Cc1cccc(C(F)(F)F)c1 55327991 JRMBHCNETVXVPV-MRXNPFEDSA-N 385.430 2.510 0 50 GFAA O=C([C@@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N1CCCCCC1 100768917 OHDRKYIAFNMZNY-JRSUCEMESA-N 392.499 2.807 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CC(=O)N(C3CC3)C2)ccc1NC(=O)c1ccco1 55109054 HVAWYFBOAWBPKU-CQSZACIVSA-N 381.432 2.581 0 50 GFAA Cc1nccc(-c2cccc(N3CCC(N[C@H](C)c4nncn4C)CC3)c2)n1 23581990 ZPIZQKMMOKAFND-OAHLLOKOSA-N 377.496 2.900 0 50 GFAA C[C@H](C(=O)N1CCC(n2nccc2NC(=O)C(C)(C)C)CC1)N1CCCC1 67878396 XOGROUCCZJBYAG-OAHLLOKOSA-N 375.517 2.516 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@]1(O)CNCc1nc2ccccc2o1 67881558 OWVXLIGTWGYMAI-QFIPXVFZSA-N 379.460 2.514 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccc(=O)[nH]c3)n1)CCN(c1ccccn1)C2 23581838 ZUJHMLOGFVJHRH-UHFFFAOYSA-N 386.415 2.753 0 50 GFAA Cc1nnc(CN(C)C(=O)c2cc(COc3cccc4cnccc34)on2)o1 67833933 VKJCANUTEZULPW-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA O=C(O)c1cccc(S(=O)(=O)N[C@H]2CCCN(C3CCCCCC3)C2)c1 72168583 DILIETQVWVAWAE-INIZCTEOSA-N 380.510 2.850 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@@H]1CCN(c2ccccc2)C1 363618359 BCYZSJNHWATJJP-SFHVURJKSA-N 376.464 2.593 0 50 GFAA COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1[C@H]2CCc3ccccc3[C@@H]21 154542004 FTYWNJYTBOLOBU-SUMDDJOVSA-N 386.473 2.509 0 50 GFAA CCN1CCN([C@H]2CCN(C(=O)N[C@H](C3CCCCC3)C(F)(F)F)C2)CC1 482306887 DSJQGSAOWUSUBE-DLBZAZTESA-N 390.494 2.919 0 50 GFAA Cn1c([C@@H]2CCCN2CC(=O)N2CCO[C@H]3CCCC[C@@H]32)nc2c1CCCC2 328621664 APUSNIQJYFUNBK-UFYCRDLUSA-N 386.540 2.606 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCC[C@H](N4CCCC4)CC3)ccc2N1 172610658 PHWFRCUZSWQCLD-KRWDZBQOSA-N 391.537 2.600 0 50 GFAA Cc1nc2cc(NC(=O)c3cnc(C(F)(F)F)nc3)ccc2n1[C@@H](C)CO 456716367 OIYPKCMWGIOHKJ-VIFPVBQESA-N 379.342 2.959 0 50 GFAA O=C1CC[C@@H](N2CCC3(CC2)Nc2ccccc2NC3=O)CCN1CC1CC1 82120019 VNKNIGLXQHWYJU-QGZVFWFLSA-N 382.508 2.676 0 50 GFAA O=C(CN1CCN(Cc2ccc3c(c2)OCO3)CC1)NCCC1=CCCCC1 20467069 AFVIWMVQMDYXFX-UHFFFAOYSA-N 385.508 2.540 0 50 GFAA Cc1cc(N2CCC(N[C@H](C)Cn3cncn3)CC2)nc(-c2ccccc2)n1 95520078 SXUFQICOVNJFNU-QGZVFWFLSA-N 377.496 2.691 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(-c3ccc4c(c3)OCO4)[nH]c2C1 95372835 CGHIBYVSRSUFPM-CYBMUJFWSA-N 377.400 2.884 0 50 GFAA COc1ccc([C@@H]2CN(Cc3cnc(N(C)C)nc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95367764 JLMFDPMKOVQYLJ-BHDDXSALSA-N 393.535 2.613 0 50 GFAA O=C1CC2(CCN(C(=O)C3CCOCC3)CC2)CN1C/C=C/c1ccccc1 91486279 CGQZGJSXTOXXNX-QPJJXVBHSA-N 382.504 2.968 0 50 GFAA O=C(Nc1ccc(-c2cn3c(n2)CCCC3)cc1)c1cn(C2CCNCC2)nn1 238122983 FDCKXQREIIQLOL-UHFFFAOYSA-N 391.479 2.655 0 50 GFAA COc1cc(CN2C[C@@H]3CC[C@H](C2)N(Cc2cscn2)C3=O)ccc1F 95528949 UKOVLRSJDWNRSN-GOEBONIOSA-N 375.469 2.914 0 50 GFAA CCCc1noc2nc(C3CC3)cc(C(=O)N3CCN([C@H](CC)CO)CC3)c12 179415177 ZFAIDWKYXRHFTI-OAHLLOKOSA-N 386.496 2.581 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)NCc1cccc(F)c1)CC2 91973768 ZERZRHRNFHAIRH-UHFFFAOYSA-N 391.487 2.776 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)Cc1sc(C)nc1C)CC2 91325995 GALHVVLCATYSBX-UHFFFAOYSA-N 393.553 2.570 0 50 GFAA COc1cc(N2CCN(C(=O)c3ccc(Cl)c4cccnc34)CC2)ncn1 183816172 GMHRIEHKFYXVLA-UHFFFAOYSA-N 383.839 2.649 0 50 GFAA CC[C@@H](C)Oc1cccc(CNC(=O)N2CCc3c(c(CO)nn3CC)C2)c1 534667734 BEVKSVFVZLLSKF-OAHLLOKOSA-N 386.496 2.841 0 50 GFAA C[C@H](NC(=O)c1cccc(-c2ccc(N3CCCC3)nn2)c1)c1cnn(C)c1 534589026 OMIOZHYKCQBPKX-HNNXBMFYSA-N 376.464 2.968 0 50 GFAA O=C(c1cccc(-c2ccccc2OCCn2ccnc2)c1)N1CCNCC1 534593089 CPPXXRQYMLBCJK-UHFFFAOYSA-N 376.460 2.675 0 50 GFAA CCNC(=O)c1ccc(NC(=O)NCc2cn3c(n2)SCC3)cc1Cl 299785068 QBAKGIXDZMRCRE-UHFFFAOYSA-N 379.873 2.714 0 50 GFAA CC(C)Oc1ccc(-c2nc(C(=O)N3CCO[C@@H](CC(=O)O)C3)cs2)cc1 269037085 PAKAHVHUYSZRNP-HNNXBMFYSA-N 390.461 2.913 0 50 GFAA COc1cc(S(=O)(=O)N2CCC[C@@H](C(=O)c3ccccn3)C2)c(C)cc1C 952991553 ZVXVJMGKXNBMCQ-MRXNPFEDSA-N 388.489 2.991 0 50 GFAA CN(C)CCOc1ccc(/C=C/C(=O)Nc2ccc3c(c2)CCN3C(N)=O)cc1 170600726 WDSJFRMSDNSHNF-BJMVGYQFSA-N 394.475 2.720 0 50 GFAA CN1CCN(C(=O)c2ccc(NCc3cnn(-c4ccccc4)c3)cc2)CC1 170616135 JIDWMWPOLSIKOV-UHFFFAOYSA-N 375.476 2.872 0 50 GFAA Cc1nn(C)c2ncc(CN3CCCN(C(=O)c4ccccc4F)CC3)cc12 194140426 PKPXGANAABMUBR-UHFFFAOYSA-N 381.455 2.764 0 50 GFAA Cc1ccc(N2CCC(N[C@@H](C)c3n[nH]c(CC(=O)O)n3)CC2)cc1Cl 1506399791 IVQRMIBKNNUYGB-LBPRGKRZSA-N 377.876 2.713 0 50 GFAA COc1cc(C)ccc1OCCN1CC[C@H](O)[C@@](Cc2ccccc2)(C(=O)O)C1 1704338756 YUNGRGRQZRRLDM-GMAHTHKFSA-N 399.487 2.763 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)CC3CCN(Cc4ccccc4)CC3)C[C@@H]2O)on1 1704305283 UWWQMYHBWQHNDU-IRLDBZIGSA-N 397.519 2.647 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CC(=O)N[C@@H](Cc3ccccc3)C2)cc1 1772706034 PXEZXVIJDBGCDC-SFHVURJKSA-N 386.517 2.716 0 50 GFAA O=C([C@@H]1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21)N1CCCN(c2nccc(C(F)(F)F)n2)CC1 1772818720 WWIHASHVWILELX-XLHUXQDVSA-N 380.414 2.826 0 50 GFAA O=C1NCCN(C(=O)c2cc(O)cc(OCC3CC3)c2)[C@@H]1c1cccc(F)c1 1772805440 KQSWTKRRENVTEQ-LJQANCHMSA-N 384.407 2.633 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1cccc(-n3cnnc3)c1)CC2 1857666907 WFPWHQXBJSDUSU-UHFFFAOYSA-N 398.470 2.909 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)COC[C@H]1CCCCO1)CC2 1857667165 FZHHEEIZFXKEBK-GOSISDBHSA-N 383.492 2.600 0 50 GFAA O=C(c1c(F)cccc1Cl)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857711842 GMEAOLNTVCPZSF-MIBOYBBPSA-N 375.827 2.688 0 50 GFAA Cc1cccc(C)c1C(=O)N1C[C@@H]2[C@H](CNC(=O)C3CCC3)[C@H]3CC[C@]2(C1)O3 1857733991 JADZLRUZZUEKED-RTXPOLOASA-N 382.504 2.839 0 50 GFAA COc1ccc([C@H]2CN(C(=O)Cc3c[nH]c4ccccc34)C[C@@H]2NC(C)=O)cc1 212052293 BGOIVCQVSPGXOD-IRLDBZIGSA-N 391.471 2.850 0 50 GFAA O=C(c1ncoc1C1CC1)N1C[C@@H]2OC(=O)N(CCCc3ccc(F)cc3)[C@@H]2C1 213251889 BAKGXGVGJPPDSZ-SJORKVTESA-N 399.422 2.969 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)cc1C(=O)O 120743161 APLCRQFSDMRNGI-CZUORRHYSA-N 384.432 2.854 0 50 GFAA COC(=O)c1ccc(-c2nc(CN3CCO[C@H]([C@H]4CCCO4)C3)cs2)cc1 247461492 UKHFRUPNCNPJJH-MSOLQXFVSA-N 388.489 2.977 0 50 GFAA Cc1c(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)nnn1-c1ccccc1Cl 363480165 WXUFDJUOVOYHKM-CQSZACIVSA-N 386.843 2.857 0 50 GFAA Cn1ncc(C(=O)NS(=O)(=O)Cc2cc(Cl)cc(Cl)c2)c1C1CC1 873582367 CVQMLRUXBVDSJO-UHFFFAOYSA-N 388.276 2.864 0 50 GFAA FC(F)(F)[C@@]1(c2nc(-c3ccncc3)no2)CCN(Cc2cnns2)C1 952891498 FHPKUVJQMNAHDL-AWEZNQCLSA-N 382.371 2.689 0 50 GFAA N=[S@]1(=O)CCC[C@]2(CCCN2C(=O)c2cnn(-c3ccccc3F)c2)C1 1875395351 BQFXEMYUIUEGQS-DWXRJYCRSA-N 376.457 2.827 0 50 GFAA CCN(Cc1ccoc1)C(=O)[C@]1(O)CC(=O)Nc2ccc(Br)cc21 1875323270 CZLGNRAUMHNBBF-KRWDZBQOSA-N 393.237 2.621 0 50 GFAA Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cn(C)nc2C2CC2)[C@@H](C)CO1 1875393198 JAXQZXMZSHVWCV-WMLDXEAASA-N 375.494 2.757 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)CCn1ccc2ccccc21 1875401270 HPPMPZKWIMTFGP-QFBILLFUSA-N 379.464 2.865 0 50 GFAA COc1ccccc1[C@H]1NC(=O)NC(C)=C1C(=O)OCCOc1ccccc1 4189483 LPCUQDDOSZTIGD-LJQANCHMSA-N 382.416 2.945 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=S)Nc3ccccc3)CC2)cc1 1171031 WCQYSYUHPCSBBM-UHFFFAOYSA-N 375.519 2.698 0 50 GFAA Cc1nc(N[C@@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@H]2O)cc(-c2ccccn2)n1 2325785850 QEBSYVZEUBTNKV-FSPWUOQZSA-N 384.871 2.949 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 798132 QZSWKBCIUCFHPP-UHFFFAOYSA-N 388.489 2.876 0 50 GFAA aggregator Cc1ccc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)c(O)n1 2356145068 ZFNFAVMCVLEEQM-JOCHJYFZSA-N 379.460 2.893 0 50 GFAA CSc1cccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)c1 2877648 KTKNTRYZJYWZQC-UHFFFAOYSA-N 379.507 2.660 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@@H]1c1cccc(Cl)c1 4108448 QRUWDFCYKJYGTR-NNFUDEMPSA-N 382.840 2.506 0 50 GFAA CCOC(=O)c1c(NC(=O)COc2cccc(C)c2)sc(C(N)=O)c1C 681589 WSCIPKWYMXBREW-UHFFFAOYSA-N 376.434 2.658 0 50 GFAA COc1cc2c(cc1OC)C(=O)C(C)(C)N(C[C@@H](O)COc1ccccc1)C2 55525039 RQMNZRBFBWCSRM-MRXNPFEDSA-N 385.460 2.921 0 50 GFAA biogenic O=C1NCCCC[C@@H]1Nc1ccc(-c2nc(CCc3ccccc3)no2)cn1 20542760 UWSVLGQXRZBWAB-KRWDZBQOSA-N 377.448 2.997 0 50 GFAA Cn1cc(Cl)c(-c2c(-c3ccccc3)ncn2[C@@H]2CCS(=O)(=O)C2)n1 65431241 YFFNEAFOYFTJLL-CYBMUJFWSA-N 376.869 2.964 0 50 GFAA Cc1nn(C)cc1[C@@H](C)Nc1ccc(C(=O)NCc2noc(C(C)C)n2)cn1 67674889 BAUBRLKJUFNSPS-GFCCVEGCSA-N 383.456 2.733 0 50 GFAA CCc1noc([C@H](C)NC(=O)c2cc(Cn3c(C)nc4ccccc43)[nH]n2)n1 67833432 SDEQHAPXEKGIJM-NSHDSACASA-N 379.424 2.553 0 50 GFAA CC(=O)Nc1ccc(CNC(=O)CNCc2cc(C)oc2C(F)(F)F)cc1 65531258 CGSMKCIETRPFEW-UHFFFAOYSA-N 383.370 2.971 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@H](c2cccnc2)N2CCCC2)s1 63871147 FLVRUMPWFXPRGR-HNNXBMFYSA-N 377.539 2.677 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)ccc1F 328618882 FCMXBZWUMTURAD-NSHDSACASA-N 391.390 2.890 0 50 GFAA CCc1nc(-c2ccc(C(=O)N(C)C3CCN(c4cnccn4)CC3)cc2)n[nH]1 364800701 AQEYSBAVRMLORF-UHFFFAOYSA-N 391.479 2.565 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@@H](C)c2nnc3n2CCCC3)CC1 373134751 DMMDFPBLCXAMLC-HNNXBMFYSA-N 384.484 2.632 0 50 GFAA Cc1c(F)cccc1NC(=O)N1CCN(c2ccnc(N3CCCC3)n2)CC1 72115943 PPAWWQSWHITRKW-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA COc1cccc(NC(=O)N2CCN(c3cc(N4CCCCC4)ncn3)CC2)c1 38528637 RLCMBVBOBVJWDU-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA COc1ccccc1O[C@H](C)C(=O)NCc1ccccc1CN1CCOCC1 72119190 RTIBSAQXOWSMSC-QGZVFWFLSA-N 384.476 2.611 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)n1 77134168 IJVSURLWDCUAMR-UHFFFAOYSA-N 399.926 2.930 0 50 GFAA O=C1[C@H](N2CCN(CCc3ccc4c(c3)CCO4)CC2)CCN1c1ccccc1 173739982 UARMHKMOYVCGGT-JOCHJYFZSA-N 391.515 2.587 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@@H]2CCC(=O)N(Cc3ccc(OC)cc3)CC2)C1 43135908 NBRMQKUOBROMCV-RTBURBONSA-N 388.508 2.851 0 50 GFAA Cc1nc(CNC(=O)N2CCC[C@H](c3nc(-c4cccnc4)no3)C2)cs1 426413069 YDTNQHYLKLPCEA-AWEZNQCLSA-N 384.465 2.986 0 50 GFAA CSc1ccc(NC(=O)N2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)cc1 91951783 GYMVQSUCACXSOQ-IBGZPJMESA-N 376.526 2.569 0 50 GFAA CN(C)C(=O)CC[C@@H]1CCCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)C1 95359320 PFIKJBRHELBEBN-INIZCTEOSA-N 381.476 2.763 0 50 GFAA CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cccnc1-n1cc(Br)cn1 294946488 IPOUNWFHYVELMB-DOMZBBRYSA-N 393.285 2.653 0 50 GFAA CC(C)C[C@@H]1C(=O)NCCCN1C(=O)c1ccc(-n2cnc3ccccc32)nc1 293886471 KEGBLSQDFFPHQE-LJQANCHMSA-N 391.475 2.797 0 50 GFAA Cn1cnn(-c2ccc(NC(=O)c3cnn(-c4ccc(Cl)cc4)c3)cc2)c1=O 180537546 NSPNYURAEUWZOK-UHFFFAOYSA-N 394.822 2.662 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)CCc1scnc1C)CC2 91381325 IDJYQZIAISOSLE-UHFFFAOYSA-N 393.553 2.652 0 50 GFAA Cc1nc(CCCNC(=O)c2ccc(C(=O)N3CCOCC3)cc2)sc1C 252502438 UQHJHWKFWGMOLO-UHFFFAOYSA-N 387.505 2.595 0 50 GFAA CC(C)[C@@H](NC(=O)c1cc(F)ccc1-n1cnnn1)c1nc2ccccc2[nH]1 252538998 NQSRUQSQPVXDEV-QGZVFWFLSA-N 379.399 2.805 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(N2C(=O)CCC2=O)c1 298442181 VUNYTNIKTLGLNT-LJQANCHMSA-N 391.471 2.734 0 50 GFAA O=C(c1cccnc1Cl)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 263617454 NWGRCUYDJQUIEV-UHFFFAOYSA-N 383.839 2.629 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)c2ccc(-n3ccnc3)cc2)c1C 824424253 BIIJNAXBWRIJDR-UHFFFAOYSA-N 378.432 2.809 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)N(C)C[C@@H]2CCN(c3ccccc3)C2)cc1 952966895 XVQBZCOTOVDLBV-IBGZPJMESA-N 390.491 2.628 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCC(Nc3cccnn3)CC2)ncn1 275574502 GLZBUGTXJPATLD-DYESRHJHSA-N 397.527 2.963 0 50 GFAA COc1ccccc1C(=O)N/C(=C/c1ccccc1)C(=O)NCCCOC(C)=O 5101323 MGDYPIIPJAALTM-XDJHFCHBSA-N 396.443 2.536 0 50 GFAA CC(=O)c1cn([C@H](C)C(=O)N2CCOC3(CCN(C)CC3)C2)c2ccccc12 1772814691 NYWPLWLKNGQIKT-MRXNPFEDSA-N 383.492 2.728 0 50 GFAA COc1ccccc1S(=O)(=O)Cc1ccc(C(=O)NCc2ccco2)o1 5042859 AQASZZWTNCKHEB-UHFFFAOYSA-N 375.402 2.785 0 50 GFAA CC[C@@H](C(=O)NCc1ccc(F)cc1)n1nc(C)n2c(cc3occc32)c1=O 5149792 XYLZASQNTACKRY-HNNXBMFYSA-N 382.395 2.957 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@@H]2CC23CCN(C[C@H]2CC=CCC2)CC3)CC1 11998262 QUSONGRXVQCWQT-OALUTQOASA-N 389.540 2.746 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN(C)Cc2cccnc2)cc1OC 12319398 OQQOVOWCAUMEFU-HXUWFJFHSA-N 387.524 2.804 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1nc(C)cs1 12421773 YRDDVJXJKPAEEZ-UHFFFAOYSA-N 395.506 2.887 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1C[C@@H](N1CCSCC1)CC2 14746468 ZWHBVKCVCVHRJM-KRWDZBQOSA-N 384.549 2.539 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@H](C(=O)c2ccc(SC)cc2)C1 15072151 KYQXRXCXHKDLDQ-HNNXBMFYSA-N 378.494 2.966 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2 1857677476 DHGXURPLWZLWNM-TUIFFPIZSA-N 386.473 2.720 0 50 GFAA CCOc1cc(CN2CC[C@@H]3NCCC[C@@H]3C2)ccc1OCCn1ccnc1 1857679680 QDBSHUXKMRGKJA-UXHICEINSA-N 384.524 2.935 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N(C)Cc2ccncc2C)C[C@H]1NC(=O)C1CC1 1857705349 DAIFURMQVHFDAN-DFQSSKMNSA-N 387.524 2.839 0 50 GFAA O=C([C@H]1CC[C@H](c2ccccc2)N1)N1CCC2(CC1)Nc1ccccc1NC2=O 1857712460 PDXZYBQGOMEZAA-YLJYHZDGSA-N 390.487 2.905 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cnc3ccccc3n2)[C@H]1c1ccccc1 1857720856 NPSZXHKRHZSZGT-SFTDATJTSA-N 376.460 2.774 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1875242868 FZTYDCUGHIJBMQ-KNKQGSTJSA-N 378.428 2.610 0 50 GFAA Cc1ccccc1-n1ncc2c(=O)n(CC(=O)N(C)CC3CCCCC3)cnc21 114993969 LOUCNVZJULNGIR-UHFFFAOYSA-N 393.491 2.929 0 50 GFAA O=C(Nc1ccccc1N1CCC(O)CC1)c1ccnc(OCC(F)F)c1 156735852 UDJYIZVHYMOZLA-UHFFFAOYSA-N 377.391 2.939 0 50 GFAA CN1C(=O)CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@H]1c1ccnn1C 906146515 MCNPVPRHFNDGSY-BBRMVZONSA-N 380.370 2.531 0 50 GFAA O=C(Nc1cccc2nn[nH]c12)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1875289440 SJMPAWMFHAKUSF-QVKFZJNVSA-N 391.431 2.945 0 50 GFAA C[C@H](NC(=O)CC(C)(C)CC(=O)O)c1cn([C@H]2CCCc3cccnc32)nn1 1875354453 WFWXWEGMEGVKHY-BBRMVZONSA-N 385.468 2.667 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(C[C@H]3CCc4ccccc4C3)C2)ccn1 886072105 RNBZODMIMFOBCU-FDDCHVKYSA-N 379.504 2.976 0 50 GFAA CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 888100113 LMNIVYREMDXOGS-UKRRQHHQSA-N 392.512 2.863 0 50 GFAA COCCOC(=O)Nc1cccc(NC(=O)C[C@@H](O)c2nc3ccccc3[nH]2)c1 2325853945 IUPZPIJTOXOEAH-QGZVFWFLSA-N 398.419 2.820 0 50 GFAA COC(=O)c1c(NC(=O)Cc2c(F)cccc2Cl)sc(C(N)=O)c1C 2730291 CRYGBGKMWXOWTJ-UHFFFAOYSA-N 384.816 2.916 0 50 GFAA O=C(N[C@]1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O)C1CCCCC1 3623094 BRMXWOOTFWLCNN-SFHVURJKSA-N 397.397 2.736 0 50 GFAA CCOC(=O)c1cc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc(C(=O)OCC)c1 4651244 MPIOXIQSKMNYNE-JKSUJKDBSA-N 389.404 2.646 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O 4763722 GTXSTEDIVHHJQL-CWRNSKLLSA-N 396.509 2.650 0 50 GFAA CCCc1cc(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3OC)C2)on1 12057214 SBVCRKWFIKOLEU-MRXNPFEDSA-N 385.464 2.691 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2cccc(F)c2)CN1Cc1c(F)cccc1F 12184913 GSNOLUJCIILFDF-KDOFPFPSSA-N 392.377 2.650 0 50 GFAA O=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)C3CCC3)CC2)C1 12199009 SICZXBHLQDTSLE-HXUWFJFHSA-N 383.536 2.806 0 50 GFAA CCOc1ccccc1CN1CCNC(=O)[C@@H]1CC(=O)NCCC1=CCCCC1 12314749 LNVUEJZDDYOLGD-FQEVSTJZSA-N 399.535 2.783 0 50 GFAA Cc1nnc(CCC(=O)N2CC[C@@]3(CCCN(Cc4ccccc4F)C3)C2)[nH]1 12718621 XBIVRRVLFBBMHT-OAQYLSRUSA-N 385.487 2.700 0 50 GFAA COc1cccc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)c1OC 19223578 WCHFCYRNVANFBK-NRFANRHFSA-N 384.520 2.815 0 50 GFAA COc1cccc(-c2ccc(N3CCC(N4CCO[C@@H](CN)C4)CC3)cc2)c1 20514014 MTZVIVOGKZDZON-QHCPKHFHSA-N 381.520 2.991 0 50 GFAA CCN(CC)CCNC[C@@H](O)CN1CCn2c3c(c4cc(C)ccc42)CCC[C@@H]31 22033694 WIWRJIZZYKIADD-XXBNENTESA-N 398.595 2.935 0 50 GFAA COC(=O)C1(NC(=O)OC(C)(C)C)CCN(C(=O)OCc2ccccc2)CC1 34316243 GVRQIMSOAHTWPB-UHFFFAOYSA-N 392.452 2.856 0 50 GFAA COc1cc(Cl)ccc1C(=O)N1CCC(Cn2cc(C(C)(C)N)nn2)CC1 48159197 FBRHCSLYFXGJHV-UHFFFAOYSA-N 391.903 2.686 0 50 GFAA Cc1nc(-c2cc(S(N)(=O)=O)ccc2F)n(-c2cccc3cccnc23)n1 63846117 MSLDYSJFYPGFJG-UHFFFAOYSA-N 383.408 2.577 0 50 GFAA COc1cc(NC(=O)CN[C@H]2CCCN(C(=O)c3ccco3)C2)ccc1Cl 65398901 UYXDPNUUCCSBIE-AWEZNQCLSA-N 391.855 2.775 0 50 GFAA COc1ccc(OCc2nc(C(=O)N3CC(N4CCCC[C@H]4C)C3)co2)cc1 67675869 GBZDWXMCNGLVNX-OAHLLOKOSA-N 385.464 2.961 0 50 GFAA Cc1onc(C(=O)NCc2cccnc2Oc2ccc(F)c(F)c2)c1CO 67758477 SGGVYAAXFYXKPO-UHFFFAOYSA-N 375.331 2.871 0 50 GFAA Cc1ccc(F)c(CN2CCC[C@]3(C(=O)O)CN(c4cnccn4)CC[C@@H]23)c1 72421370 ZBMDMJDTTIORHG-NQIIRXRSSA-N 384.455 2.870 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CCc3c(C)n[nH]c3C)CC2)OC1=O 72462665 BTCGKGMBJLGPQK-AWEZNQCLSA-N 376.501 2.961 0 50 GFAA CC(C)n1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)cn1 91746765 DFIPRGKVGNUBQB-UHFFFAOYSA-N 395.507 2.904 0 50 GFAA CN(CC(=O)N1CCC[C@@H](Cc2nc3ccccc3[nH]2)C1)Cc1ccccn1 91932385 DIJLZEXFSDSRNE-KRWDZBQOSA-N 377.492 2.871 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)CCn2ccnc2C)C3)cc1 95363894 GNGLUFKQYHBGBJ-VQTJNVASSA-N 382.508 2.713 0 50 GFAA O=C(c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)N1CCCNCC1 95500488 RKXXFMQARCWOSL-UHFFFAOYSA-N 394.519 2.561 0 50 GFAA Cc1ncccc1Oc1ncnc(N2CCC(NCc3ncc[nH]3)CC2)c1C 95526937 PUBBMULVCIDAMH-UHFFFAOYSA-N 379.468 2.762 0 50 GFAA CCn1nc(C)c(NC(=O)NCCn2nc(-c3ccccc3)ccc2=O)c1C 96150682 PPIWMNXKINESHW-UHFFFAOYSA-N 380.452 2.565 0 50 GFAA CN(C)Cc1nnc(C2CCN(Cc3coc(-c4ccccc4)n3)CC2)n1C 96153994 IPPNMRHMBNJMPX-UHFFFAOYSA-N 380.496 2.911 0 50 GFAA Nc1ncccc1CN1CCC2(CC1)CCN(Cc1ccccc1)C[C@H]2CO 97179404 NVEQHRHIDLDHGI-NRFANRHFSA-N 380.536 2.760 0 50 GFAA O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N2CCCC2)nc1 130753972 RHNVVMYLKDUXEV-QGZVFWFLSA-N 382.439 2.746 0 50 GFAA CC(C)C[C@H](CNC(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1CCOCC1 132237940 UAIMQLSFXVOVLC-RTBURBONSA-N 381.561 2.914 0 50 GFAA O=C(Nc1cccc(OCC(F)F)n1)N[C@H](CO)Cc1c[nH]c2ccccc12 133822711 WIRGZKXTWAVACE-ZDUSSCGKSA-N 390.390 2.932 0 50 GFAA CC(C)n1c(CCNC(=O)c2cnc3sccn3c2=O)nc2ccccc21 136484737 ZOJOVIFRMANEFK-UHFFFAOYSA-N 381.461 2.659 0 50 GFAA CN(C)Cc1ccc(C(N)=O)cc1NCc1cc(O)ccc1Br 151219404 YVUBVVNWYDESMX-UHFFFAOYSA-N 378.270 2.927 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NC(=O)NC2C3CC4CC(C3)CC2C4)cc1 170620665 HXAAMWDTQXADPP-UHFFFAOYSA-N 377.510 2.883 0 50 GFAA O=C(NCC1(N2CCCCC2)CCOCC1)c1cnc(-c2ccncc2)s1 172919160 PKCJVPQJHTUHGR-UHFFFAOYSA-N 386.521 2.970 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(Cc3ccncc3Cl)CC2)c(C)c1 173466245 ALEFANJEKVFSJP-UHFFFAOYSA-N 379.913 2.858 0 50 GFAA Cc1cc(NC(=O)CN2CCN(C(=O)[C@@H](C)c3ccc(Cl)s3)CC2)no1 175189553 VUHVNLWYECIFQZ-LBPRGKRZSA-N 396.900 2.584 0 50 GFAA Cc1nc(N2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c2cnn(C)c2n1 194272920 MIWGGXCTFPHMFK-GFCCVEGCSA-N 385.859 2.575 0 50 GFAA c1coc(CN2CCC(N[C@@H]3COCC[C@@H]3OCc3cscn3)CC2)c1 220350795 IYSKGTBMVRJBGG-MOPGFXCFSA-N 377.510 2.664 0 50 GFAA Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCCCN1CCC(O)CC1 237786752 LWTFSNJFKXMUAZ-UHFFFAOYSA-N 378.467 2.704 0 50 GFAA O=C(O)CN(C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)C1CCOCC1 238103190 YNSBYDVUYWOBQL-HUUCEWRRSA-N 382.254 2.645 0 50 GFAA CS[C@H]1CN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1N1CCCC1 242339395 ZHMJKCIAZFWUBK-MSOLQXFVSA-N 380.521 2.832 0 50 GFAA CCOc1ccc([C@H](C)NC(=O)c2cn([C@H]3CC[C@@H](N)CC3)nn2)cc1F 244794824 QUMRPAIVLCKDQV-AEGPPILISA-N 375.448 2.749 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](NC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)C2)c1 246972919 QAYGZZRVNNYYEF-FCLJQHQZSA-N 386.492 2.794 0 50 GFAA CC(=O)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1ccc2[nH]c(C(F)(F)F)nc2c1 247941877 NMJZSUVSMQVRHR-YPMHNXCESA-N 380.370 2.665 0 50 GFAA O=C(C1CCCCC1)N1CC[C@H](Nc2nc(C(F)(F)F)nc3[nH]cnc23)C1 252481868 CUFHVRNVZPYIPM-NSHDSACASA-N 382.390 2.965 0 50 GFAA C[C@@H](NC(=O)c1ccc(Cl)cc1-n1cnnn1)c1nc2ccccc2n1C 252490383 KSGNWLQSQYRXJP-LLVKDONJSA-N 381.827 2.693 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N[C@H]1c2ccccc2C[C@@H]1O 274836970 NNKVBJMSUCZBSX-HKUYNNGSSA-N 383.448 2.567 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@H]1c1nc(Cc2cscn2)no1 290255315 UJILDKGUDZRTLJ-AWEZNQCLSA-N 376.463 2.643 0 50 GFAA CN1CC[C@@H](CNS(=O)(=O)c2ccc3c(c2)CCCC3=O)[C@@H]1c1cccnc1 366576741 KCPZZFNWPIISRG-UWJYYQICSA-N 399.516 2.572 0 50 GFAA O=C(c1cnn(Cc2ccccc2Cl)c1)N1CCOC[C@H]1[C@H]1CCCO1 376170667 GOQMBSLSTPUUQE-ZWKOTPCHSA-N 375.856 2.605 0 50 GFAA O=C(N[C@H]1CCC[C@H]1Cc1ccc(F)cc1)N1CCN(c2cnccn2)CC1 426372267 OGCXHWFMAGVKCE-HKUYNNGSSA-N 383.471 2.859 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)N2CCCC[C@@H]2c2nc(C)no2)n1 426443123 YXTCGHQIARNWDP-GFCCVEGCSA-N 398.389 2.975 0 50 GFAA CC[C@H](CNC(=O)c1csc2c1CCN(Cc1c(C)noc1C)C2)N(C)C 426505969 XRMKGMDQJVXTTP-OAHLLOKOSA-N 390.553 2.981 0 50 GFAA COc1ccccc1C1CCN(C(=O)NC(C)(C)CN2CCOCC2)CC1 426727302 BMFNHJLJGSJQKD-UHFFFAOYSA-N 375.513 2.695 0 50 GFAA Cn1cnnc1C1CCN(C(=O)NCc2cc(-c3cccc(F)c3)no2)CC1 584902203 ADSGRFMAKGVIKM-UHFFFAOYSA-N 384.415 2.698 0 50 GFAA Cc1cc(S(=O)(=O)N(C)Cc2cc(Cl)n(C)n2)ccc1Br 863457883 ZCJWLCDTOZMWJB-UHFFFAOYSA-N 392.706 2.965 0 50 GFAA C[C@@H](NC(=O)NC[C@@H]1C[C@H](c2ccccc2)CO1)c1nnnn1-c1ccccc1 888101410 UATFYMDMBSEEJH-AYBZRNKSSA-N 392.463 2.595 0 50 GFAA CC(C)C(=O)N1CC[C@H]2[C@@H](C1)NC(=O)N2C1CCN(CC2CCCCC2)CC1 888103594 OMEBDLQBMYPZCO-UXHICEINSA-N 390.572 2.682 0 50 GFAA C[C@@H]1CN(C(=O)c2c(C(F)F)nc3cnccn23)CC[C@@H](C(F)(F)F)O1 893229450 GYEMBSABORCAEZ-BDAKNGLRSA-N 378.301 2.849 0 50 GFAA Brc1cnc2n1C[C@H](NCc1cnn(Cc3ccccc3)c1)CC2 898726770 MQHNJJHBKHALEI-MRXNPFEDSA-N 386.297 2.995 0 50 GFAA c1ccc(-n2cc(CCNCc3cnc(NC[C@@H]4CCCO4)nc3)cn2)cc1 952960378 OICQVXMLAXBTOJ-FQEVSTJZSA-N 378.480 2.586 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCC(c2nnc3ccccn23)CC1 952967753 MKIYWCQKYBWCSU-UHFFFAOYSA-N 379.464 2.938 0 50 GFAA CC(=O)Nc1cc(-c2nnc(-c3csc(N4CCOCC4)n3)o2)ccc1F 1322099333 INAMUADIQWTARW-UHFFFAOYSA-N 389.412 2.794 0 50 GFAA c1cncc(-c2nnc(CN3CCN([C@@H]4CCc5ccccc5C4)CC3)o2)c1 1506407348 NBMWJEJEWWYVPR-HXUWFJFHSA-N 375.476 2.807 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)CCCC2)cc1 1529118414 KIFAIVVPXMEWNS-NQIIRXRSSA-N 380.488 2.964 0 50 GFAA Cc1ccc(CNC(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)cc1 1565511598 RPIFBZGRIJYJOL-QUCCMNQESA-N 378.476 2.836 0 50 GFAA COc1ccc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cc1F 1857684308 ICSFYXJHDOLCDV-NRFANRHFSA-N 384.407 2.724 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3-c3ccc(NS(C)(=O)=O)c(C)c3)c2n1 1857695876 CEKZPRZTQSUDKK-UHFFFAOYSA-N 396.476 2.879 0 50 GFAA COc1ccc([C@@H](O)C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cc1 1857701341 SLOCIWKFZLNGJQ-JOCHJYFZSA-N 391.471 2.757 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ccn(C(C)(C)C)c3)C1)CC2 1857705967 DAZAGUKCSPPEHR-QFIPXVFZSA-N 397.523 2.925 0 50 GFAA COc1cccc(C(=O)N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)c1 1875245987 VXCMKVJCRIFIKM-NFBKMPQASA-N 397.471 2.996 0 50 GFAA C[C@H]1CN(c2cc(F)cc(NC(=O)N3CCc4cncnc4CC3)c2)C[C@@H](C)O1 1875266784 NNRHVNCWYLIZED-GASCZTMLSA-N 399.470 2.862 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCC[C@@H](CN(C)C(=O)c4cocn4)C3)n[nH]2)o1 1875341765 HABOCQXZUWZSED-AWEZNQCLSA-N 397.435 2.591 0 50 GFAA C=CC(=O)N(CC)CC(=O)N1CCC[C@]2(CCCCN2C(=O)OC(C)(C)C)C1 1875369611 YSJPECNVLZEGFT-OAQYLSRUSA-N 393.528 2.803 0 50 GFAA CN(C)CCn1cnc2cc(NC(=O)c3cc4c(cc3F)NC(=O)CC4)ccc21 2325783322 OOFIDCAXZYIHJX-UHFFFAOYSA-N 395.438 2.874 0 50 GFAA NCc1ccc(-c2ccc(C(=O)N3CCC(O)(c4cc[nH]n4)CC3)cc2)cc1 2325796106 UAAUFKKVZHXJLD-UHFFFAOYSA-N 376.460 2.659 0 50 GFAA O=C(c1cnc2cccnn12)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356141435 AOORRAFMMVGRRL-QFIPXVFZSA-N 389.459 2.527 0 50 GFAA COc1ccc(-c2onc(N[C@@H]3CCCN(C(=O)C4CC4)C3)c2C(=O)O)cc1 2356158858 CBXQPGITQUPRPT-CQSZACIVSA-N 385.420 2.861 0 50 GFAA COc1cccc(C(=O)Nc2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1 1124753 DHBQJGIEQQVMGI-MRXNPFEDSA-N 380.400 2.723 0 50 GFAA CSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 1158710 VJIHLWJOOVQXFN-UHFFFAOYSA-N 392.502 2.682 0 50 GFAA Cc1ccc(C(=O)Nc2c(C(=O)N3CCOCC3)cnn2-c2ccccc2)cc1 1219071 ZYZIPIXAVILZQH-UHFFFAOYSA-N 390.443 2.905 0 50 GFAA CCOC(=O)CN(c1ccccc1C(=O)OC)S(=O)(=O)c1ccc(C)cc1 1691735 BQRYIDLLMHALEC-UHFFFAOYSA-N 391.445 2.540 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C2CCN(Cc3ccccc3)CC2)C1 2356161461 WOOSMYBJFCDYRL-HSZRJFAPSA-N 377.536 2.834 0 50 GFAA COc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1Cl 2846306 HCUZXYKYJAQJKJ-LBPRGKRZSA-N 382.869 2.963 0 50 GFAA C/C=C/Cn1c(=O)c2c(nc3n([C@@H](C)c4ccccc4)c(C)cn23)n(C)c1=O 10233476 KGGVSLGVYGNHFW-NFAHFFEMSA-N 377.448 2.643 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCO[C@H](c2nccs2)C1)c1c(F)cccc1F 110883352 WCSAWRGXZAMTJR-GJZGRUSLSA-N 395.431 2.589 0 50 GFAA COc1ccc(Cc2nnc(SCC(=O)Nc3cccc(O)c3)n2C)cc1 9095816 RKWLWKLIPMAWAC-UHFFFAOYSA-N 384.461 2.851 0 50 GFAA CN1CCN(CCNC(=O)C2(c3ccc(Br)cc3)CC2)CC1(C)C 225671467 KTZYWBXSWLAQKA-UHFFFAOYSA-N 394.357 2.623 0 50 GFAA O=C(CSc1ccncc1)N1CCC[C@H](N2CCN(c3ccccc3)CC2)C1 55052770 FACHVKDWMXLWLA-FQEVSTJZSA-N 396.560 2.987 0 50 GFAA CN1CC[C@H](C(=O)N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1=O 113832669 RQXVBQGMCWYKKL-ZDUSSCGKSA-N 395.862 2.525 0 50 GFAA O=C(NCC1CCN(Cc2cccs2)CC1)c1cccc(-n2cccn2)n1 135421255 QIISNUQNQVBXSM-UHFFFAOYSA-N 381.505 2.971 0 50 GFAA Cc1cc(C)n([C@@H](C)CNC(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)n1 67973644 WGHVMBXINLFYHA-HNNXBMFYSA-N 377.452 2.612 0 50 GFAA C[C@H](NC(=O)c1cccs1)C(=O)N1CCC[C@H]1CN1CCc2ccccc21 140395763 XLZYGPLMODREGA-RDJZCZTQSA-N 383.517 2.920 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCc1ccccc1 20999900 VHVMTLXMBOXJDK-OAQYLSRUSA-N 382.504 2.569 0 50 GFAA O=C(O)c1ccc(C[C@H]2CCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)C2)cc1 72478616 XVITVZWNFUCZJQ-OAHLLOKOSA-N 376.416 2.875 0 50 GFAA C[C@@H]1CN(C2CCN(C(=O)Nc3nc(-c4cccnc4)cs3)CC2)CCO1 124362797 NZHMTEYKEAFGPU-CQSZACIVSA-N 387.509 2.922 0 50 GFAA CC(C)(NC(=O)C(=O)Nc1cccc(F)c1I)C1CC1 328596683 PJKWLBMMSVEGJC-UHFFFAOYSA-N 390.196 2.674 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(CCOc3ccccc3)CC2)C1)N1CCCC1 71760420 SSRBBINJZMQWJI-HXUWFJFHSA-N 385.552 2.864 0 50 GFAA CCc1ccc([C@@H]2COCCN2CCOc2cccc(S(C)(=O)=O)c2)o1 155176943 DBHHTCVLOABTJQ-SFHVURJKSA-N 379.478 2.698 0 50 GFAA CC(C)NC(=O)C(=O)N1CCO[C@H](CC(c2ccccc2)c2ccccc2)C1 71755293 VIRWOZLQNPAGHX-HXUWFJFHSA-N 380.488 2.961 0 50 GFAA COCc1nc2n(n1)C[C@H](NCc1c(-c3ccccc3)nc3ccccn13)CC2 124695248 YQXMQKFKJNWXSX-QGZVFWFLSA-N 388.475 2.844 0 50 GFAA C[C@@H](O)c1ncc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)s1 367369809 IAMJPGTYGZQTLI-OAHLLOKOSA-N 381.505 2.976 0 50 GFAA CC(C)CN(C)CCCN1CC2(CCN(C(=O)[C@H]3CC3(C)C)CC2)OC1=O 72454465 RPAIDUOUHZKYGH-QGZVFWFLSA-N 379.545 2.824 0 50 GFAA COc1ccc(NC(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c2cccnc12 333043625 AXBZGZKYGMPFBS-LJQANCHMSA-N 389.477 2.676 0 50 GFAA COc1ccc(CNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)c(OC)c1OC 241701793 QLDFWFQMTPGESQ-HUUCEWRRSA-N 379.501 2.775 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCc2c(nc(-c3ccncc3)nc2N(C)C)C1 72168177 HMESNJFLLZNNCA-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1cnc(O)c2ccccc12 241897383 TYGKIFLMPORFKQ-FQEVSTJZSA-N 377.444 2.744 0 50 GFAA COc1ccc2c(c1)c(C(=O)NC1CCN(c3cnccn3)CC1)c(C)n2C 426420015 GLLACFHJSZJMHE-UHFFFAOYSA-N 379.464 2.684 0 50 GFAA Cc1nc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)cs1 82114403 MCSWBXQTLFXKII-FQEVSTJZSA-N 384.505 2.892 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Cc4ccc(Cl)cc4)CC3)ncn2)n1 82230462 SGIQQPBWKYYVLM-UHFFFAOYSA-N 396.882 2.515 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)Cc3ccc(S(=O)(=O)C(C)C)cc3)C2)n1 180526925 DANSYKLMNVBKOZ-MRXNPFEDSA-N 391.493 2.509 0 50 GFAA COc1ccccc1NC(=O)N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)O)C1 95367210 CWODVVSNPSDLIN-YCRPNKLZSA-N 382.416 2.865 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@H]2C(=O)Nc2cccc(-n3cccn3)c2)cs1 95530012 SNEZAKBKHWPWAB-SFHVURJKSA-N 395.488 2.809 0 50 GFAA Cc1cccc(=O)n1CCC(=O)N(Cc1ccncc1)C[C@@H](O)c1ccccc1 97814921 BHUUMZDUGWRARA-OAQYLSRUSA-N 391.471 2.704 0 50 GFAA C[C@H](c1ccccn1)N(C)C(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C 95383249 PFJARKDPRXQYSB-OAHLLOKOSA-N 379.464 2.638 0 50 GFAA O=C(CCCc1ccccc1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 180296122 GESIZVWFPVTCJQ-LJQANCHMSA-N 378.538 2.862 0 50 GFAA COc1ccccc1-c1csc(NC(=O)c2cn(CC3(C)COC3)nn2)n1 184016918 INFBROVWYJZEAH-UHFFFAOYSA-N 385.449 2.699 0 50 GFAA Cc1nc2ccccc2n(CC(=O)N(C)Cc2nc3c(s2)CCCC3)c1=O 95505369 HUBBWJHPYNGNPL-UHFFFAOYSA-N 382.489 2.699 0 50 GFAA C[C@]1(c2ccccc2)CN(C(=O)c2cc(C(=O)O)nn2-c2ccccc2)CCO1 299746559 YDNANEJNJNEFAP-JOCHJYFZSA-N 391.427 2.958 0 50 GFAA COc1ccccc1N1CCN(C(=O)Nc2nc(Cc3ccccc3)n[nH]2)CC1 48501657 QIPGEYWQXBOLKP-UHFFFAOYSA-N 392.463 2.758 0 50 GFAA Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)NCCN=c1cc[nH]cc1C)O2 825253764 XXCUWZKSMLUHAO-QFIPXVFZSA-N 383.492 2.755 0 50 GFAA CC(C)C(=O)Nc1cccc(C(=O)NCCS(=O)(=O)c2ccc(F)cc2)c1 952972576 DIPSVHNMVXBOOH-UHFFFAOYSA-N 392.452 2.624 0 50 GFAA CC(=O)N1C[C@@H]2CN(Cc3ccc4c(c3)Cc3ccccc3-4)C[C@]2(C(=O)O)C1 1565528184 WKXSXFYAILELNG-CVDCTZTESA-N 376.456 2.623 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)C[C@H]2C[C@H]3CC[C@H]2O3)c(Br)c1 408496373 PIJGNVIDWXDNSA-NQBHXWOUSA-N 388.283 2.520 0 50 GFAA NC(=O)c1cccc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)n1 170593708 KWGWQGYMYFBFRX-LBPRGKRZSA-N 375.812 2.644 0 50 GFAA Cc1ccc([C@H](NC(=O)c2cccc[n+]2[O-])c2cccc(S(C)(=O)=O)c2)cc1 170643533 JQNYVAYNRHWAGN-FQEVSTJZSA-N 396.468 2.551 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2cn(Cc3ccccc3)nn2)CC1 194903218 ZNQZLWDCEBJABS-UHFFFAOYSA-N 391.475 2.734 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc(-n3cccn3)c2)o1 12053299 VJNWZNMTIRZQJM-INIZCTEOSA-N 380.404 2.717 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)C1 19111530 VDNFDWHREAWWGK-MRXNPFEDSA-N 384.480 2.886 0 50 GFAA COc1cc(NC(=O)c2ccc3c(c2)N(C)[C@@H]2CCCN2C3=O)cc(OC)c1 169765947 QFOQTRLUYFWGPL-IBGZPJMESA-N 381.432 2.968 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cccc5[nH]ccc45)nnc3c2)n1 169776188 LMKXMPQMKHNQLB-UHFFFAOYSA-N 387.403 2.753 0 50 GFAA OC[C@]12COCC[C@H]1CN(Cc1cn(-c3ccccc3)nc1-c1ccncc1)C2 1857669159 ZRUNTSUWWUGDIA-NZQKXSOJSA-N 390.487 2.765 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CCC4(CC3)CC(=O)NCCO4)coc2c1C 1857694503 CQYMEKOGYHYYSD-UHFFFAOYSA-N 384.476 2.798 0 50 GFAA COc1ccc(F)cc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857706437 RRWUMQYPGCPLMH-KPLVRAHFSA-N 396.418 2.749 0 50 GFAA C[C@H]1CN(C(=O)CCC(C)(C)C(=O)N2C[C@@H](C)OC(C)(C)C2)CC(C)(C)O1 408355215 QZOGXLUSRQICCQ-JKSUJKDBSA-N 382.545 2.845 0 50 GFAA COCCN(C)Cc1ccc(OC[C@@H](O)CN(C)C2CCCCC2)c(OC)c1 11844223 ZBLYNTVQTBSVGQ-FQEVSTJZSA-N 394.556 2.778 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCN[C@H](C)C3)cc2Br)on1 155010907 UBGXHUVYTAKIKO-GFCCVEGCSA-N 394.269 2.758 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2F)nc1)N1CCN2CCOC[C@@H]2C1 373234000 USOHGLUCENWOQP-AWEZNQCLSA-N 390.390 2.700 0 50 GFAA CCC(=O)Nc1cccc(CNC(=O)c2c(Br)nc3n2CCC3)c1 825275501 QTTIOSMMIYODBQ-UHFFFAOYSA-N 391.269 2.870 0 50 GFAA CN(Cc1nc(C(F)(F)F)no1)C(=O)[C@H]1CCCCN1C(=O)c1ccccc1 1875256000 CCDBFOKULDUSHL-CYBMUJFWSA-N 396.369 2.742 0 50 GFAA COc1cc(N2CCN(C(=O)c3n[nH]cc3-c3ccncc3)CC2)ccc1F 1875317180 PPMVAGSLWDGICA-UHFFFAOYSA-N 381.411 2.582 0 50 GFAA N=S1(=O)CCC2(CC1)CN(C(=O)c1ccc(-c3cscn3)cc1)CCO2 1875396183 YCYABMJCBPYRNE-UHFFFAOYSA-N 391.518 2.862 0 50 GFAA CC(=O)N[C@@H](CC(=O)Nc1ncc([C@H]2CCCCN2)cn1)c1ccc(C)cc1 1875325881 WOWQSOKRPRQSIM-MOPGFXCFSA-N 381.480 2.806 0 50 GFAA CCO[C@H](CC)C(=O)N1CCC(c2nc(C(F)(F)F)n3c2CNCC3)CC1 1875393535 NUFKIWRCNJWDSS-CQSZACIVSA-N 388.434 2.526 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)CCn1ccc2ccccc21 1875401271 HPPMPZKWIMTFGP-VQIMIIECSA-N 379.464 2.865 0 50 GFAA CCOc1ccccc1CNS(=O)(=O)c1cc2c3c(c1)c(C)cc(=O)n3CC2 12412478 PNTNRALOPBEQEB-UHFFFAOYSA-N 398.484 2.743 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N[C@@H]3C[C@@H](Cn4ccnc4)C[C@H]3O)nc2)c1 2325786177 MQPNJJSHGXZIHN-MAODMQOUSA-N 392.459 2.948 0 50 GFAA CC(C)(C)C12CC(C(=O)N3C[C@@H]4C[C@H]3CN4C(=O)[C@@H]3OC[C@@H]4CCC[C@@H]43)(C1)C2 2325794626 KVYOJBNPPQUWMB-OMHSZURESA-N 386.536 2.830 0 50 GFAA CC[C@@H]1[C@@H](NC(=O)c2cc(N(C)C)ccn2)CCN1C(=O)[C@H]1C[C@H]2[C@@H](C1)C2(C)C 2325871969 BYBXLVMCRSRZRF-IIEIJDNYSA-N 398.551 2.939 0 50 GFAA O=S(=O)(Nc1ccc(Cc2nn[nH]n2)cc1)c1csc2ccc(F)cc12 2332237424 HLNDGYYJMUIBMP-UHFFFAOYSA-N 389.437 2.945 0 50 GFAA O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ccc2c3c(cccc13)CC2 1133871 IDVVGYMDXPUZJV-UHFFFAOYSA-N 392.436 2.722 0 50 GFAA COCCn1c(SCC(=O)Nc2ccccc2OC)nnc1-c1ccncc1 2849643 YJDMOALNRCVMFJ-UHFFFAOYSA-N 399.476 2.726 0 50 GFAA Cc1ccc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c(C)c1 3482572 DEUXJPUMRYTUQZ-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA O=C(O)[C@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 6726486 NXXBTQPXCGPQEY-CVFPBCOCSA-N 382.504 2.981 0 50 GFAA O=C(Nc1cnccn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 10435163 UVRGGFKNWXQAKP-UHFFFAOYSA-N 394.884 2.947 0 50 GFAA Cc1cccc(O[C@@H](C)C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 20375067 VAQSBJOFSLANCM-KRWDZBQOSA-N 382.460 2.835 0 50 GFAA C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)O[C@H]2CCCCC2=O)cc1 248049817 ASAIBDGUWXOSIE-KDOFPFPSSA-N 379.478 2.918 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)C[C@H]3C(=O)Nc4ccc(C)cc43)CC2)nc1 67606030 ABUUTRDQAQXHNU-QGZVFWFLSA-N 379.460 2.634 0 50 GFAA O=C(c1cc(COc2c(F)cccc2F)on1)N1CCCN2CCC[C@H]2C1 67723456 BPTLCZSDHAFJFO-ZDUSSCGKSA-N 377.391 2.842 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)Cc3c[nH]c4ncccc34)CC2)oc1C 120161047 PCYDQGSEUCHTDK-UHFFFAOYSA-N 381.480 2.739 0 50 GFAA CC1=C(C(=O)N(C)Cc2nc3ccc(C)cc3[nH]2)[C@H](c2ccoc2)NC(=O)N1 67755224 GAOMZWNPWAABFA-SFHVURJKSA-N 379.420 2.751 0 50 GFAA O=C1CCCN1CCC1CCN(C(=O)c2c[nH]c3ccc(F)cc3c2=O)CC1 77344191 DSOPSRPGMUHBKM-UHFFFAOYSA-N 385.439 2.532 0 50 GFAA CCc1nc(C)c(CN2CCC[C@@H](CNC(=O)Cc3ccc(OC)cc3)C2)[nH]1 11936050 RBYMJAKWQQVZRY-SFHVURJKSA-N 384.524 2.860 0 50 GFAA Cc1cnc(NC(=O)C2CCN(c3ccc4nnc(C(C)C)n4n3)CC2)s1 32094018 XPGIDEKNPSVPOR-UHFFFAOYSA-N 385.497 2.868 0 50 GFAA O=C1COc2ccc(C(=O)N3CCOC[C@H]3c3nc4ccccc4s3)cc2N1 367065352 HYCDERBKXHZPFX-HNNXBMFYSA-N 395.440 2.841 0 50 GFAA COc1ccc2c(c1)CCCN2C(=O)CN1CCN([C@H](C)c2ccccn2)CC1 159238348 CMAAMQCODUBPNS-GOSISDBHSA-N 394.519 2.748 0 50 GFAA COc1ccc2c(c1)CCCN2C(=O)CN1CCN([C@@H](C)c2ccccn2)CC1 159238198 CMAAMQCODUBPNS-SFHVURJKSA-N 394.519 2.748 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2CCC(=O)N(C)C 77471412 WBMZESNAWJXKSE-ICSRJNTNSA-N 393.487 2.630 0 50 GFAA CCN(C)Cc1cc2n(n1)CCCN(Cc1cc3ccccc3n(C)c1=O)C2 72126564 ACKKMQXRNMRPNB-UHFFFAOYSA-N 379.508 2.593 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCC(CNS(C)(=O)=O)CC3)c2)cs1 287138060 XEOGBMTVGCYFKQ-UHFFFAOYSA-N 393.534 2.520 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3cnc[nH]3)csc2C1 426526878 NTJGYZCJGLOKJP-UHFFFAOYSA-N 385.493 2.607 0 50 GFAA NC(=O)C1CCN(c2nc3nccc(-c4ccc5ccccc5c4)c3c(=O)[nH]2)CC1 49551616 PSTFZJDWRDLOPZ-UHFFFAOYSA-N 399.454 2.840 0 50 GFAA O=C(O)[C@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)NCCC(c1ccccc1)c1ccccc1 225649654 GNMWHBAJTKJJEB-CGXNFDGLSA-N 377.440 2.979 0 50 GFAA Cc1c(CC(=O)N2CCC(N)CC2)c2c(n1Cc1ccccc1)CCCC2=O 95521404 LMKSFDOVQSEQLH-UHFFFAOYSA-N 379.504 2.856 0 50 GFAA CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N2CCNC(=O)[C@H]2C(C)C)c1 96139473 INSCQBBICGFKJM-OAHLLOKOSA-N 381.860 2.894 0 50 GFAA O=C(O)[C@@H]1Cc2[nH]cnc2CN1C(=O)CC(c1ccccc1)c1ccccc1 96167036 CHSBTFHWTXJOQL-FQEVSTJZSA-N 375.428 2.970 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)N[C@@H](C)c3nc4ccccc4[nH]3)CC2)n1 426615004 CFKNAXQPQIYPEO-AWEZNQCLSA-N 379.468 2.563 0 50 GFAA Cc1nc(CCNC(=O)[C@H](C)N2CCc3ccccc3C2)nc2c1CCCC2 95352367 LPNHGCSNMJOHBM-KRWDZBQOSA-N 378.520 2.769 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CC[C@@H](Cc4cccc(C(N)=O)c4)C3)[nH]n2)o1 95378421 ULSOUZHIBCWNFQ-HNNXBMFYSA-N 378.432 2.782 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2cccc(N(C)C)c2)C1 95529223 AWOZWCXESPPPBV-LJQANCHMSA-N 383.540 2.921 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(CC(=O)Nc3ccn(C)n3)CC2)C1 96166850 QMQSOYRYGZUIJA-LJQANCHMSA-N 381.524 2.560 0 50 GFAA O=C([C@H](c1cccnc1)N1CCCC1)N1CCN(c2nc3ccccc3o2)CC1 95359739 MSRACEHYPTUPRM-FQEVSTJZSA-N 391.475 2.709 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1C[C@H](CO)[C@H](CN2CCCCCC2)C1 91440851 QKVVREUNFWPGBE-HZPDHXFCSA-N 380.916 2.905 0 50 GFAA C[C@@H]1CN(C[C@H]2CCCN2C(=O)C2CCN(Cc3ccccc3)CC2)C[C@@H](C)O1 299447411 MUPVIXWWOOOTMF-TXTKFYIRSA-N 399.579 2.999 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCc1c(C)nc2c3c(F)cccc3nn2c1O 252522888 BIWJHTPQZMKHKZ-CQSZACIVSA-N 399.470 2.569 0 50 GFAA CN(Cc1ccc(C(=O)O)cc1)C(=O)COc1cccc(N2CCCC2=O)c1 298425144 LRAZMIZBGXBBJO-UHFFFAOYSA-N 382.416 2.549 0 50 GFAA O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)[C@H]1C[C@H](O)CN1 299749640 LCSFQADFZPXQBS-GQWAEJPESA-N 383.879 2.792 0 50 GFAA CCCOc1ccccc1CNC(=O)N1CCC[C@H](CN2CCN(C)CC2)C1 534660312 YUQMVZPQNOGWLE-LJQANCHMSA-N 388.556 2.644 0 50 GFAA Cc1ccc2c(c1)CN(CCNC(=O)c1cc(C(F)(F)F)n[nH]1)C[C@@H](C)O2 299788723 ZTTPMOWWXSYOQW-GFCCVEGCSA-N 382.386 2.750 0 50 GFAA COc1ncc(CN2CCC(N3CCc4cc(OC)c(OC)cc4C3)CC2)cn1 824851809 JFIASMQXPZHXAJ-UHFFFAOYSA-N 398.507 2.525 0 50 GFAA COc1cc(NC(=O)CN2CCC(c3ccnn3C)CC2)c(OC)cc1Cl 195502208 GKRPFEXJRPBVME-UHFFFAOYSA-N 392.887 2.909 0 50 GFAA COc1c[nH]c(C(=O)N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)cc1=O 1704338094 KVISTSYEAJNFPJ-UHFFFAOYSA-N 393.443 2.569 0 50 GFAA Cc1cc(C)cc(CSCC(=O)N2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)c1 1704300163 WMTMXVNXFOLAHD-NQIIRXRSSA-N 390.549 2.934 0 50 GFAA COC(=O)c1nc(-c2ccc(C)cc2)oc1S(=O)(=O)NCc1ccccc1 1775977830 XPFAVAJRHZXKPU-UHFFFAOYSA-N 386.429 2.915 0 50 GFAA Cc1nc(CN(C)C[C@@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)cs1 12072440 SBNJWAPFHJMIJT-IBGZPJMESA-N 395.475 2.715 0 50 GFAA CN(C(=O)CCC1=NNC(=O)CC1)[C@H]1CCCN(CCCc2ccccc2)C1 12576054 KZWWPZLLPZJZED-FQEVSTJZSA-N 384.524 2.588 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4ccc(Cl)s4)CC3)nn2)n1 169780288 WDCRZVRGMILELN-UHFFFAOYSA-N 378.845 2.829 0 50 GFAA CCc1[nH]nc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1C 1857697465 AUCXDPJYOMCOEJ-NRFANRHFSA-N 381.480 2.774 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1n[nH]c3c1CCCC3)CC2 1857701911 YEXVXHSWRGLJRH-UHFFFAOYSA-N 375.476 2.930 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(c4ncccc4F)C[C@]34CC[C@H]2O4)cc1 1857717674 SDKBBRCDPCNDDT-ODULNIPZSA-N 381.451 2.943 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)N1C[C@@H]2CNC[C@@H]2C1 1857728684 LXIMTQNHJLDTJZ-KFWWJZLASA-N 388.899 2.766 0 50 GFAA O=C(C[C@@H]1Oc2ccccc2NC1=O)OCc1ncc(Br)s1 785022032 ZGTKTIASURRJPJ-JTQLQIEISA-N 383.223 2.739 0 50 GFAA N[C@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)n(-c3ccccc3)n2)C12CCOCC2 1875277854 KASREXQFQYTVFE-LSDHHAIUSA-N 394.397 2.517 0 50 GFAA Cc1nc(-c2ccccn2)cc(=NC[C@H]2CCCCN2C(=O)C(F)(F)F)[nH]1 1875266453 SUBAAPGPBPCYSA-CYBMUJFWSA-N 379.386 2.624 0 50 GFAA Cc1cccc2nc(CNC(=O)N3CCC[C@@]34CCC[S@](=N)(=O)C4)cn12 1875393149 HTRXSKYWTJSEIV-QYBDOPJKSA-N 375.498 2.527 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCCNC(=O)[C@H]3CC(C)C)ccc21 1875371791 MCODWJHJHSKMDS-LJQANCHMSA-N 383.492 2.529 0 50 GFAA CCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)CCCN3C(C)=O)c1 1775996486 NVPVRZBBTIMBCG-UHFFFAOYSA-N 379.460 2.665 0 50 GFAA CCOC(=O)Cc1ccccc1CCOC(=O)c1cccc2c1OCC(=O)N2 2325737720 UYGCVEIAPXGEFB-UHFFFAOYSA-N 383.400 2.523 0 50 GFAA O=S(=O)(NC1CCN(Cc2ccccc2)CC1)c1cnn(-c2ccccc2)c1 109230017 PBVQMJMQVUMUMN-UHFFFAOYSA-N 396.516 2.815 0 50 GFAA Cc1ccc2c(-c3ccc(C(=O)N4CCNC(=O)[C@@H]4CCO)cc3)cccc2n1 2356151308 CKFBIZAGGWXAFD-NRFANRHFSA-N 389.455 2.533 0 50 GFAA Cn1cc(N2CCC[C@H](NC(=O)NCCc3csc(C(C)(C)C)n3)C2)cn1 133143478 SRCSBHFJQFEIEN-AWEZNQCLSA-N 390.557 2.685 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](Sc3nc(C)cc(C)n3)C2=O)cc1 100629640 JAHZNETYWDRHOA-HNNXBMFYSA-N 385.445 2.694 0 50 GFAA O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCc2ncnn2C1 112742462 UPVZBCBXCMSMRK-GOSISDBHSA-N 377.448 2.671 0 50 GFAA O=C(c1coc(COc2ccc(F)cc2Cl)n1)N1CC(n2cccn2)C1 67805146 RTRSUAUTYLKYRA-UHFFFAOYSA-N 376.775 2.940 0 50 GFAA c1csc(-c2noc(CN3CCN(Cc4ccc5c(c4)OCO5)CC3)n2)c1 22925376 ITVGGTVLEUKILX-UHFFFAOYSA-N 384.461 2.845 0 50 GFAA O=S1(=O)C=C[C@@H](Cc2nc(-c3ccccc3)nn2-c2ccc3c(c2)OCO3)C1 63870900 JVTWSZZGRYNXLO-AWEZNQCLSA-N 395.440 2.764 0 50 GFAA CCn1c(C)nnc1SCCNc1nc(CCN)nc2sc(C)c(C)c12 65410507 MKQNPNOUTOVYGG-UHFFFAOYSA-N 391.570 2.933 0 50 GFAA COc1ccc(-c2cn3c(C(=O)N4C[C@@H]5CC[C@H](C4)N5)csc3n2)cc1F 67755460 ADVZBKHPPZTMQF-BETUJISGSA-N 386.452 2.787 0 50 GFAA CCOC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)sc(=O)n3C)cc1 1425221 NBYGNZVICABQMO-UHFFFAOYSA-N 392.458 2.578 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)C(=O)Nc3ccccc3)C[C@H]21 230214495 DIHVVYGVJHFMOP-DJIMGWMZSA-N 387.480 2.777 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)Cc3ccc4c(c3)OCO4)C[C@H]21 230246093 XRAXHXIJSUSRBV-BZUAXINKSA-N 388.464 2.720 0 50 GFAA Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)[C@H]1CC12CCS(=O)(=O)CC2 281867324 ZYXOJWVJROJIGR-OAHLLOKOSA-N 393.896 2.988 0 50 GFAA c1cn(C2CCN(C[C@@H]3CCCO3)CC2)c(-c2cnc(N3CCCC3)nc2)n1 77320121 SFNFQIMWXMDKRH-IBGZPJMESA-N 382.512 2.756 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2 363408140 NFJRRUNQPQMTSO-KRWDZBQOSA-N 399.422 2.910 0 50 GFAA C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1cccc(NC(=O)CCn2ccnc2)c1 124106481 FVPXGRYXNVLIIZ-MAUKXSAKSA-N 396.447 2.747 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ncnc4c3CCC4)C2)CN1Cc1ccncc1 72475905 COMWFGNNDPKWKS-JOCHJYFZSA-N 377.492 2.770 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)N1CCC[C@@]2(CC1)CNC(=O)O2 72148570 JRSXXIUMSZBLCA-HXUWFJFHSA-N 386.427 2.733 0 50 GFAA Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@@H]1CCc2nnnn2CC1 333679693 FAINMTKTTYDOPH-QWHCGFSZSA-N 377.518 2.669 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CN2CCCCC2)CCC(=O)N1Cc1ccc(F)cc1 71765142 UHLNPFWCEKCEPC-FQEVSTJZSA-N 389.515 2.897 0 50 GFAA COc1ccc(CN2CCN(c3ccc4[nH]ncc4c3)C(=O)C2)c(OC)c1C 82121616 PYVGUSFOVXIOAY-UHFFFAOYSA-N 380.448 2.737 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2CCCCCC2)c1C(=O)OC(C)C 17077999 HRGYWAMBADCOBL-UHFFFAOYSA-N 381.498 2.535 0 50 GFAA Cc1nc(CCNC(=O)N2CC[C@](O)(c3ccccc3)C2)nc2c1CCCC2 426544753 JZRAPDHQFNGMIT-JOCHJYFZSA-N 380.492 2.509 0 50 GFAA O=C([C@H](O)c1ccccc1Cl)N1CCC2(CC1)Nc1ccccc1NC2=O 82083616 JZPOOWUEKYEXRR-QGZVFWFLSA-N 385.851 2.799 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)NCCc2noc(C3CCC3)n2)c1 97515032 SDUNOOAZSQNMLC-UHFFFAOYSA-N 387.440 2.595 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CC[C@H]1CCCN(C(=O)c2ncn[nH]2)C1 95498698 CTQJLKORATXBDK-GFCCVEGCSA-N 391.859 2.738 0 50 GFAA COc1ccccc1CN1CCC(CN(CC(C)C)C(=O)[C@H]2C=CCN2)CC1 95509765 TYBAOUYLMRPGKZ-OAQYLSRUSA-N 385.552 2.920 0 50 GFAA O=C(c1cccc(Cn2cccn2)c1)N1C[C@@H]2c3ccccc3OC[C@]2(CO)C1 95522249 BIUDIWDHDPXYPN-NFBKMPQASA-N 389.455 2.542 0 50 GFAA CCOc1ccc([C@@H](C)NC(=O)c2cn([C@H]3CC[C@@H](N)CC3)nn2)cc1F 244794825 QUMRPAIVLCKDQV-YUELXQCFSA-N 375.448 2.749 0 50 GFAA Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3ccc4c(c3)NC(=O)CNC4=O)C2)cc1 295378595 OWQIGVFMSHMSQS-RHSMWYFYSA-N 377.444 2.695 0 50 GFAA COc1ccc([C@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)[C@H]2C[C@H](O)C2)cn1 252550122 RZSAEZZCMBLUHY-NJSLBKSFSA-N 382.420 2.624 0 50 GFAA COc1cc(F)c([C@@H]2CC(=O)Nc3cc(N4CCNC4=O)ccc32)cc1OC 65497371 BTWGUSUJPMCDAY-CYBMUJFWSA-N 385.395 2.847 0 50 GFAA O=C(CCNC(=O)[C@H]1CCCN(Cc2ccco2)C1)Nc1cc(F)ccc1F 952982365 OVHZYBKJECANIA-AWEZNQCLSA-N 391.418 2.915 0 50 GFAA Cc1ccccc1[C@H](CNC(=O)CCC1=NNC(=O)CC1)N1CCC(C)CC1 952983370 KXLDSSYCPBGFCQ-FQEVSTJZSA-N 384.524 2.930 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)C(C)(C)NC(=O)c2cccs2)CC1 952976239 NJWYTIJYABSECP-UHFFFAOYSA-N 386.521 2.699 0 50 GFAA Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)[C@@H]2CCCN2Cc2ccccc2)cn1 269403676 DKUAXRBKBIIHFI-PMACEKPBSA-N 380.492 2.649 0 50 GFAA Cn1ccnc(N2CCC[C@@H](NCc3cccc(OC4CCCC4)c3)C2)c1=O 275543940 MVWLGLTVLBNPAB-GOSISDBHSA-N 382.508 2.860 0 50 GFAA CN(C)c1nccc([C@@H]2CN(C(=O)Nc3cccc(-c4ncco4)c3)CCO2)n1 275977952 NCWXOUYMVGRCSL-KRWDZBQOSA-N 394.435 2.803 0 50 GFAA CN1CCN(CCC(C)(C)NC(=O)Nc2cnn(-c3ccccc3F)c2)CC1 170598146 DYMTVDDMQGFERS-UHFFFAOYSA-N 388.491 2.549 0 50 GFAA C[C@](O)(C(=O)Nc1ccc(-c2nn[nH]n2)cc1)c1cccc(C(F)(F)F)c1 754847190 HUUJQBVBYWYVMM-MRXNPFEDSA-N 377.326 2.732 0 50 GFAA Cn1ccnc1[C@@H](NC1CCN(C(=O)c2ccncc2)CC1)c1ccccc1 1506412767 OLNYPZURDHSSIN-FQEVSTJZSA-N 375.476 2.799 0 50 GFAA Cc1nn(C)c(NC(=O)[C@H]2CC(=O)N(Cc3cccnc3)C2)c1-c1ccccc1 1529196716 FIPMUBDYVLBWSX-SFHVURJKSA-N 389.459 2.778 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@@H]2O)n[nH]1 1704277892 HZRFWVNPNRZXBQ-GCJKJVERSA-N 378.476 2.728 0 50 GFAA Cn1nncc1NS(=O)(=O)c1cc(Br)c(Cl)cc1Cl 225393301 BSYGIMXUTVVHQQ-UHFFFAOYSA-N 386.058 2.685 0 50 GFAA COC(=O)[C@@H]1CCCN1C(=O)CCc1nnc(CCCCc2ccccc2)o1 11816597 YAOGGQZFKVXFQF-KRWDZBQOSA-N 385.464 2.732 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN2CC(=O)N2CCc3ccccc32)cc1 12843551 LJMPAXLEMAFFPK-FQEVSTJZSA-N 379.460 2.687 0 50 GFAA CN(Cc1ccco1)C(=O)c1nn(C)c2c1C[C@@H](NCCc1ccccc1)CC2 14537666 UCCRBETWGCIHBI-SFHVURJKSA-N 392.503 2.975 0 50 GFAA COCCN1CCN(C(=O)c2ccc3nc(Cc4ccccc4F)oc3c2)CC1 14970801 URAKPKKQUVJFTL-UHFFFAOYSA-N 397.450 2.962 0 50 GFAA CC(C)Cn1cc(C(=O)NC(C)C)c(=O)c(C(=O)N(C)CCc2ccccc2)c1 14986517 GGZFYODXXWKFFW-UHFFFAOYSA-N 397.519 2.957 0 50 GFAA COc1ccc(CN2CCN(C(=O)Cc3ccccc3)CC2)c(OC)c1OC 19789902 QBNFMENWTTUJHO-UHFFFAOYSA-N 384.476 2.599 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)Nc1cccc(C(F)(F)F)c1 19924203 YLZWDGHLHJSYEU-UHFFFAOYSA-N 391.357 2.915 0 50 GFAA COc1cc(=O)n2c(c1C(=O)N1CCN(c3cc(C)ccc3C)CC1)CCCC2 169752842 LTNPJRGLCJJCOD-UHFFFAOYSA-N 395.503 2.772 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779711 TXHXWMMSDZBTLB-UHFFFAOYSA-N 380.423 2.648 0 50 GFAA Cn1nccc1C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857721697 BQGBXNDXZHPRJO-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA O=C(NCCO)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1ccncc1Cl 1857733482 MAUYOWGUWKBWBY-CZTZKLFOSA-N 399.922 2.809 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N(C)CC)C[C@H]1NC(=O)Cc1csc(C)n1 1875249832 DNPQAGJRWDRGFA-USXIJHARSA-N 381.542 2.552 0 50 GFAA CCc1nc2n(n1)C[C@H](NS(=O)(=O)c1ccc(-c3ccccc3)cc1)CC2 114874860 XFTFJVOOLZGUJK-QGZVFWFLSA-N 382.489 2.801 0 50 GFAA Cn1cc(-c2csc(CN3CCC(NC(=O)c4ccsc4)CC3)n2)cn1 240569409 HALGSGGPNNTXAG-UHFFFAOYSA-N 387.534 3.000 0 50 GFAA COc1ccc(C2(C(=O)N3CCc4nn(C)c(=O)cc4C3)CC3(CCC3)C2)cc1 367614070 FMHRPUKPQOCANV-UHFFFAOYSA-N 393.487 2.576 0 50 GFAA COc1ccc([C@H](NC(=O)CC2CCOCC2)C(=O)O)cc1Br 262978226 KKXBKPJKYZBROH-HNNXBMFYSA-N 386.242 2.516 0 50 GFAA Cc1cc(C)n(-c2ccc(F)cc2CN2CC[C@@]3(CO)CCCN(C)[C@@H]3C2)n1 1704298121 DOJCHQWQMMEZQG-FGZHOGPDSA-N 386.515 2.907 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H]2Cc3cccc(O)c3C2)(c2ccccc2)CC1 847905387 JMGUPVMYWUORBU-LJQANCHMSA-N 390.483 2.722 0 50 GFAA CON1CCC(CC(=O)Nc2c(C)n(C)n(-c3cc(C)ccc3C)c2=O)CC1 1875267665 TULPOYBHRNGTLI-UHFFFAOYSA-N 386.496 2.703 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCCN(C)C2)CC1 1875330400 QESPFIXXGDBHAL-OAQYLSRUSA-N 396.535 2.550 0 50 GFAA O=C([C@@H]1CNc2ccnn2C1)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1 1875323797 UNRZRJRVVBVATF-CYBMUJFWSA-N 382.855 2.553 0 50 GFAA CC1(C)[C@H](c2cccc(C(F)(F)F)c2)CCN1C(=O)c1cn(CCN)nn1 877256372 UHSMIEOKHYDYSZ-AWEZNQCLSA-N 381.402 2.664 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2C[C@H](C)N(C(=O)c3cc4cnccc4[nH]3)C2)cc1 2325806547 RQUIWISIESPYST-WMLDXEAASA-N 392.459 2.533 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(OCC)c(O)cc1Br 1124195 JXKPELVSQRSHES-CQSZACIVSA-N 399.241 2.744 0 50 GFAA CCOC(=O)C1=NN(C(=O)c2cccc(Br)c2)[C@](O)(C(C)(C)C)C1 1195174 LGTWTGYCOMSWCB-QGZVFWFLSA-N 397.269 2.949 0 50 GFAA O=C(N1CCO[C@H](c2nn[nH]n2)C1)C1(c2ccc(Cl)c(Cl)c2)CCCC1 2356160207 INRZNYQZRCHVJW-AWEZNQCLSA-N 396.278 2.918 0 50 GFAA CNC(=O)[C@@H]1CCCN(C(=O)c2nn(-c3ccccc3)cc2OCC(C)C)C1 110989067 UAHMGPYQMDIVSC-MRXNPFEDSA-N 384.480 2.505 0 50 GFAA CCSc1nccnc1C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1 225484293 HXEGMXAVCLWLPK-UHFFFAOYSA-N 399.564 2.656 0 50 GFAA CCN1CCCC[C@@H]1CNC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 111535686 NYWSMKNRGZDSTG-LJQANCHMSA-N 391.560 2.677 0 50 GFAA Cc1noc(C2CCN(C(=O)NCc3cccnc3OCC(F)F)CC2)n1 134622121 VKOFQTQOHPDGSG-UHFFFAOYSA-N 381.383 2.506 0 50 GFAA O=C(c1ncoc1C1CC1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCCc1ccc(F)cc1 67934821 BAKGXGVGJPPDSZ-DLBZAZTESA-N 399.422 2.969 0 50 GFAA Cn1nnc2cc(C(=O)N3CCC(c4[nH]ncc4-c4ccccc4)CC3)cnc21 67692277 ZJXIQXNOMUZQQG-UHFFFAOYSA-N 387.447 2.773 0 50 GFAA COCCN(C[C@H]1CCCN2CCCC[C@@H]12)C(=O)c1cc(CC(C)C)[nH]n1 409414170 OFLAYJUMVBZROV-XLIONFOSSA-N 376.545 2.961 0 50 GFAA O=C([C@H]1CCNC1)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67675841 VBJJXRQANXNJOE-ZDUSSCGKSA-N 395.484 2.999 0 50 GFAA O=C(Cc1cncn1Cc1ccccc1)NCCN1CCc2sccc2C1 431755112 QHFMICKRYHUTLY-UHFFFAOYSA-N 380.517 2.710 0 50 GFAA O=C(CC1CCCC1)NC1CCC(C(=O)N2CC[C@H](N3CCCC3)C2)CC1 171454785 POUUBLCYIDONKB-MHJFOBGBSA-N 375.557 2.938 0 50 GFAA O=C(c1cnn2ccccc12)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 72158530 DAYZCNMXPJWMAS-KSEOMHKRSA-N 388.471 2.742 0 50 GFAA O=C1CC2(CCN(S(=O)(=O)c3ccccc3)CC2)CN1Cc1ccccc1 77555664 HETWMKKTDJJQRS-UHFFFAOYSA-N 384.501 2.890 0 50 GFAA CCCC[C@@H]1C(=O)N(C)CCN1C(=O)c1cn(CCC2CCCCC2)nn1 72164408 PXUINJOWEWYWGR-GOSISDBHSA-N 375.517 2.722 0 50 GFAA Cc1cccc(CCNC(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)c1 71771702 LGPPIFPZKUFEKF-OAQYLSRUSA-N 397.563 2.767 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1O)N1CCC[C@@H](CCc2ccc(F)cc2)C1 71763282 WHNKHYLXEQKTOK-INIZCTEOSA-N 395.438 2.992 0 50 GFAA CC(C)c1cncnc1N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71712158 GUAXSIXJKBJDDM-SFHVURJKSA-N 385.556 2.903 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1cccc(OCC(F)(F)F)n1 172518032 SPGQJDCEBWIHNV-UHFFFAOYSA-N 394.397 2.812 0 50 GFAA CCNc1nc(C(=O)N2CCOC[C@@H]2c2nc(-c3cccs3)no2)cs1 282667517 VNNBCSYZMMHBJC-LLVKDONJSA-N 391.478 2.900 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)N1CCN(Cc2ccncc2Cl)CC1 173467169 PZIRKGYKXGGGIP-UHFFFAOYSA-N 386.304 2.895 0 50 GFAA O=C(Cc1ccccc1)NCCC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 174846949 IUCSJHXEQGSJSE-NHCUHLMSSA-N 380.488 2.850 0 50 GFAA COC(=O)N1CCCC[C@@H]1C(=O)NCc1c[nH]nc1-c1ccc(Cl)cc1 222669714 CGTPDLVKHMTDMM-OAHLLOKOSA-N 376.844 2.967 0 50 GFAA Cc1nnc(CNC(=O)c2cccc(-c3ccc(C(=O)NC4CC4)s3)c2)o1 426360404 PRQMRWDYMQJTEM-UHFFFAOYSA-N 382.445 2.929 0 50 GFAA Nc1ncccc1CN1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 95371699 YLEJWAZXEGLKCL-UHFFFAOYSA-N 379.508 2.506 0 50 GFAA COc1ccc(CN2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cc1 92046178 XBZUEHJERGJRLH-QFIPXVFZSA-N 382.508 2.866 0 50 GFAA CC(C)c1nnc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)o1 91644377 WTTBFPJHIOWAIY-UHFFFAOYSA-N 383.496 2.993 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(Cc2ccc3[nH]ccc3c2)C1 95385425 DCJDZCFIFWNSED-GOSISDBHSA-N 375.480 2.921 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)c2ccc(F)c(C)c2)CN1C1CCCCC1 97742827 UTWIPMOZNAXLRE-LPHOPBHVSA-N 375.488 2.776 0 50 GFAA CCCN1CCC(N2C[C@H](NCc3cccc(C)c3)C[C@H]2C(=O)NCC)CC1 23360016 UEPKEHOEXNSEBG-IRLDBZIGSA-N 386.584 2.538 0 50 GFAA CCOC(=O)N1CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC1 95499281 GMIXMEJNSLZMJX-UHFFFAOYSA-N 397.903 2.631 0 50 GFAA CN(C)c1ccc(C(=O)N2CC[C@@]3(CCCN(C4CCCCC4)C3=O)C2)cn1 91893983 RRLCLLFMFIRSIW-QFIPXVFZSA-N 384.524 2.935 0 50 GFAA COc1cccc(Cn2nc(-c3ccc(C(N)=O)cc3)nc2[C@@H]2CCOC2)c1 95524711 SJNCZRCMZOUIHW-QGZVFWFLSA-N 378.432 2.605 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1cnn(Cc3cccc(C(F)(F)F)c3)c1)[C@H]1CC[C@H]2O1 239439284 ZRRYLPVTISPRSX-KLHDSHLOSA-N 391.349 2.617 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4cnc(C)cn4)C3)C2)cn1 91391188 AVSIJVULTOUWGF-JOCHJYFZSA-N 393.491 2.533 0 50 GFAA Cc1cccc(OCC(=O)N2CCC[C@H](c3nccn3CCCN(C)C)C2)c1 95352581 DEUZTPMTRZLCTN-IBGZPJMESA-N 384.524 2.928 0 50 GFAA O=C(CCN1CCCN(C(=O)C2CCC2)CC1)NCc1cccc(Cl)c1 243893840 AURWTQBCOIHEDR-UHFFFAOYSA-N 377.916 2.681 0 50 GFAA COc1ccc(CN[C@@H]2CNC(=O)c3cc(-c4ccc(F)cc4)nn32)c(OC)c1 263615792 FFZJZYUPBGINQP-FQEVSTJZSA-N 396.422 2.738 0 50 GFAA COc1ccc(Cl)cc1-n1nc(CC(N)=O)nc1[C@H](C)N1CCCCC1 824746145 UVVHLQTXEDJTCG-LBPRGKRZSA-N 377.876 2.504 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)NC1CCN(C(=O)N2CCCC2)CC1 952979793 FYMOCZLAVAJBHW-UHFFFAOYSA-N 383.496 2.531 0 50 GFAA CN(C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)c1ccc(F)cn1 1460084153 UJBIEDNRXLQXFE-UHFFFAOYSA-N 390.374 2.902 0 50 GFAA Cn1ccnc1CCN1CCC[C@H](CNC(=O)c2cc3ccccc3cn2)C1 952981072 YWJSEQNPGLZTOY-QGZVFWFLSA-N 377.492 2.653 0 50 GFAA c1ccc(C23CN4CCN(CC(C4)[C@H]2NCc2ccc(-n4ccnc4)cc2)C3)cc1 952985291 UXMNKXOQZKJAKU-OOAAYMRMSA-N 399.542 2.530 0 50 GFAA O=C(Nc1cc(C(F)(F)F)ccc1-n1cccn1)N1CCO[C@@]2(CCOC2)C1 185359931 FOEMCGLBXCCTAB-KRWDZBQOSA-N 396.369 2.914 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)NC[C@@H]1CCOC1)CC2 276602588 VOLYSZAWROGJEG-FUHWJXTLSA-N 391.537 2.697 0 50 GFAA NC(=O)C1CCN(c2ncccc2CNc2ncc(C(F)(F)F)s2)CC1 276880745 KXBUPBCWUPQQDJ-UHFFFAOYSA-N 385.415 2.871 0 50 GFAA C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1Cc1nnc(S(C)(=O)=O)s1 170607427 AKLLKBQHOLGPKM-ZWNOBZJWSA-N 387.914 2.557 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1CCCN1S(=O)(=O)CCc1ccc2c(c1)CCO2 189598446 GASOEQIJAYMYBE-GOSISDBHSA-N 389.521 2.681 0 50 GFAA O=C(CCCc1cccs1)N1CC[C@H](O)[C@@](Cc2ccccc2)(C(=O)O)C1 1704357171 DENLVFHFTRNNRP-RXVVDRJESA-N 387.501 2.978 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3[nH]c4ccccc4c3Cl)C[C@@H]12 1704302994 VAOYLJRELQHUAE-KUHUBIRLSA-N 375.856 2.832 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCOCC2)c2c1CC[C@@H](N1CCC(C)CC1)C2 14753032 VLKBXGDHJKYMKU-GOSISDBHSA-N 388.556 2.601 0 50 GFAA COc1ncc(CN2CC[C@]3(CCCN(Cc4ccc(F)cc4)C3=O)C2)cn1 15070799 GVESYMGQGQSWAX-OAQYLSRUSA-N 384.455 2.639 0 50 GFAA COc1cc(/C=C/CN2CCN(Cc3ccc(C)o3)[C@@H](CCO)C2)ccc1O 19840226 KHIONHKZXZNJOE-RTLBZRNLSA-N 386.492 2.884 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4ccccc4C)nnc23)n1 169776054 DUABTSDCACYYNM-UHFFFAOYSA-N 376.420 2.970 0 50 GFAA O=C(O)[C@H]1CN(S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)C[C@@H]1C(F)F 1857530747 JSXZJYPWAWQKNJ-QWRGUYRKSA-N 388.219 2.721 0 50 GFAA Cc1ccn2ncc(-n3ccnc3-c3cnc(NC[C@@H]4CCCO4)nc3)c2c1 1857681690 CCQQWMRINKYNOO-INIZCTEOSA-N 375.436 2.876 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3[nH]c4c(c3C)C(=O)CCC4)C[C@H]21 1857708350 PHKONKLSDUAAQM-CTNYNGJSSA-N 384.476 2.916 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1857725169 LKAAMNVKLCUMHL-IEBWSBKVSA-N 390.439 2.691 0 50 GFAA CCc1nc(C)c(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)s1 1857727449 RPJDBRBQTLWWRC-ZOCZFRKYSA-N 397.500 2.929 0 50 GFAA CCn1cc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c(C)n1 1857730178 ZRPZHKQKBRFMON-ZIFCJYIRSA-N 388.899 2.809 0 50 GFAA O=C(CN1CCC[C@@H](Cc2nnc3ccccn23)C1)Nc1ccc(F)cc1F 225612597 PWPPVNGMQDPQGN-AWEZNQCLSA-N 385.418 2.901 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@H](CCC(=O)O)C1)c1c(F)cccc1F 236718424 ZTHXNQCHVPWCOL-CZUORRHYSA-N 382.407 2.636 0 50 GFAA CC1(C)CS(=O)(=O)N(c2ccc(Cl)c(C(=O)NC3CCCC3)c2)C1=O 12003548 JZHQLPJLKXCGAR-UHFFFAOYSA-N 384.885 2.715 0 50 GFAA CC(C)(C)c1nnc2n1CCN(C(=O)[C@@H](O)c1cccc(C(F)(F)F)c1)C2 856364968 FSEYXNMGDJWKEJ-AWEZNQCLSA-N 382.386 2.670 0 50 GFAA Cc1ccc2nc(C(=O)N3C[C@@H]4C[C@H]3CN4Cc3ncc(Cl)s3)cn2c1 1875309426 QRYUXYRVCHDIJY-STQMWFEESA-N 387.896 2.852 0 50 GFAA O=C(c1cc(Oc2ccccc2)ccc1O)N1CCCC[C@@H]1Cc1nn[nH]n1 1875336196 VKHHRBPCIYWTCZ-CQSZACIVSA-N 379.420 2.935 0 50 GFAA CC[C@@H](C)c1nc(CN2CC(=O)N(C)C2=O)n(-c2ccc(F)c(F)c2F)n1 1875324730 LGYQRIBZJGKCGP-SECBINFHSA-N 381.358 2.592 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1cnc2c(n1)CCCC2 1875401885 VAYAKGROQMGEQU-KSSFIOAISA-N 396.495 2.847 0 50 GFAA C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)N1CCC(c2ccncn2)CC1 886074536 LVOFVDDOGSJNCE-YLJYHZDGSA-N 394.523 2.671 0 50 GFAA CCc1ccc(N2CCN(S(=O)(=O)c3ccc(F)cc3OC)CC2)cc1 1421225 YSXGHJAYKLIVBB-UHFFFAOYSA-N 378.469 2.908 0 50 GFAA COc1ccc(N2C(=O)C[C@H](N3CCN(c4cccc(Cl)c4)CC3)C2=O)cc1 18123269 JLTNYZGRBNLCAA-IBGZPJMESA-N 399.878 2.803 0 50 GFAA O=C(Nc1cccc2cc(F)ccc12)N1CCN(S(=O)(=O)C2CC2)CC1 2325769530 RYSOKVYKTKUECT-UHFFFAOYSA-N 377.441 2.621 0 50 GFAA CC(C)NC(=O)Nc1ccc(NC(=O)C[C@H](O)c2ccccc2C(=O)O)cc1 2325850626 DAFKFDATASQHAD-KRWDZBQOSA-N 385.420 2.977 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)C(=O)NC[C@@H](N)c2ccccc2)s1 2325860140 ZCLNSKAFUUPOGI-OAHLLOKOSA-N 380.473 2.873 0 50 GFAA COc1cccc([C@H](C)CC(=O)N2CCN(c3ccc(C(=O)O)cn3)CC2)c1 911171766 KZCYVNAQHNGBCH-OAHLLOKOSA-N 383.448 2.631 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)c3ccc(-c4cccc(F)c4)cc3)CC2)[C@H]1O 2356134599 UGPLEMWTRUYBMA-FCHUYYIVSA-N 399.462 3.000 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2ccc(OC)c(C)c2OC)C1=O 2356138311 LTLHUWWUGRUDJG-NRFANRHFSA-N 376.497 2.616 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@@]2(CCN(C(=O)c3ccc[nH]3)C2)c2ccccc21 2356169988 PMSKMYIXRYGKMR-JOCHJYFZSA-N 390.443 2.950 0 50 GFAA O=C(O)[C@@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 6726489 NXXBTQPXCGPQEY-AZCNDBBASA-N 382.504 2.981 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)c1ccc(OC2CCC2)cc1Cl 136021859 VRTQLWHBNFNRMF-UHFFFAOYSA-N 384.841 2.995 0 50 GFAA CCNC(=O)[C@H](C)N1C(=O)C2(CCN(C[C@@H](C)CC)CC2)Nc2ccccc21 55119621 DZJZLEQTEHVITB-IRXDYDNUSA-N 386.540 2.850 0 50 GFAA O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)[C@H]1CCc2cn[nH]c2C1 134316549 AAZOLZAEBRUKNP-AVRDEDQJSA-N 391.471 2.943 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)Nc2ccccc2C(=O)NC(C)C)CC1 57054176 JMVDYDGYVPNTBR-UHFFFAOYSA-N 388.512 2.937 0 50 GFAA CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)Nc1ccc(-n2ccnc2C)nc1 134616261 VVHUSWTUAYLMFR-KSSFIOAISA-N 384.484 2.734 0 50 GFAA C[C@@H]1[C@@H](NC(=O)CN2C(=O)N[C@@](C)(c3cc(F)ccc3F)C2=O)CCC[C@H]1C 248166825 RXYOYKPUJVQAKL-WBYQLDIESA-N 393.434 2.673 0 50 GFAA Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)NCc1nc(C(C)(C)C)cs1 118333536 FTWKOKGBBUFCCS-HNNXBMFYSA-N 384.509 2.836 0 50 GFAA CN(C)CCN(Cc1ccccc1)C(=O)c1cn(Cc2ccc(F)cc2)nn1 11958487 SARJNDVAISFAEF-UHFFFAOYSA-N 381.455 2.670 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCc2ccncn2)(Cc2ccccc2)c2ccccc21 71754066 AXDDGWOBRMDEIU-HSZRJFAPSA-N 386.455 2.640 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)C[C@H]2CCCO2)C[C@H]1c1ccc(Br)cc1 425011293 QACKIDBGMOBALS-OWCLPIDISA-N 396.281 2.733 0 50 GFAA C[C@H]1C(=O)[C@H](C(=O)Nc2nc3ccccc3s2)C(=O)N1Cc1ccccc1 122035728 VTCDJGWJYSNJOQ-BLLLJJGKSA-N 379.441 2.851 0 50 GFAA O=C(/C=C/c1cccc(OC2CCCC2)c1)N[C@@H]1CCC(=O)N[C@H]1[C@H]1CCCO1 365993396 LTEXQBKNKPQPAZ-KZAPTZPXSA-N 398.503 2.964 0 50 GFAA CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)c3cc(C4CC4)on3)cc2)C1 172639071 KEXLGIVCBALWAR-QGZVFWFLSA-N 382.464 2.971 0 50 GFAA CC(=O)N(C[C@H]1CCCO1)c1nc(C)c(C(=O)N=c2[nH]c3ccccc3[nH]2)s1 44891783 DFEHUNIUAYWMEL-CYBMUJFWSA-N 399.476 2.534 0 50 GFAA CC(C)[C@@H](NC(=O)Cn1nc2c(cc1=O)CCCC2)c1nc2ccccc2n1C 223231386 FXOOFPBACDMRRC-OAQYLSRUSA-N 393.491 2.522 0 50 GFAA CC(C)N1CCC[C@@H](CNC(=O)N2CCn3c(nnc3-c3ccccc3)C2)C1 174743094 XJDYHHACSRGVQX-KRWDZBQOSA-N 382.512 2.591 0 50 GFAA OC[C@H](O)c1cc2n(n1)CCN(Cc1ccccc1OCc1ccccc1)C2 221273804 FQZYGRMMVWGQMI-NRFANRHFSA-N 379.460 2.504 0 50 GFAA O=C(c1ccnnc1)N1CCC(Cn2cc(-c3cccc(Cl)c3)nn2)CC1 48436052 GTQBBPNKFFGMCY-UHFFFAOYSA-N 382.855 2.941 0 50 GFAA CN1C(=O)COc2ccc(C(=O)N3Cc4cnc(-c5ccccc5)nc4C3)cc21 426527612 APKYORZSFGPFGH-UHFFFAOYSA-N 386.411 2.655 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(C(=O)CCCc2ccccc2)C1 95358277 VBHNTTOOYRVVEE-LJQANCHMSA-N 392.507 2.789 0 50 GFAA CC(C)c1cc(C(=O)NCc2cnn(-c3ccc(F)cc3)c2)nc2ncnn12 91519228 HDIQIVZUCLYZQR-UHFFFAOYSA-N 379.399 2.503 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(C)c(N3CCNC3=O)c2)C1 95508270 GCMYMHTZIYLLJB-QGZVFWFLSA-N 381.480 2.761 0 50 GFAA Cc1[nH]c(-c2ccccc2)nc1C(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)N(C)C)C2 95368775 QSXOTFJXFQEWAL-DOTOQJQBSA-N 381.480 2.603 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2cn(C)nc2C(F)(F)F)[C@@H](c2ccccc2)CO1 293629802 WSVVQRJHNPLPOT-DGCLKSJQSA-N 389.399 2.590 0 50 GFAA COc1cc(N2CCC3(CC2)CC(=O)N(Cc2ccc(F)c(F)c2)C3)ncn1 91664240 QBFWQJAYIDTQKZ-UHFFFAOYSA-N 388.418 2.783 0 50 GFAA Cc1cc(C)n2ncc(C(=O)NCCN3CCC(c4ccccc4)CC3)c2n1 97572237 GAFJEMBVKJSRRY-UHFFFAOYSA-N 377.492 2.956 0 50 GFAA Cc1cc([C@H](C)NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c(C)o1 163060234 DLLFDVCDGGUTLU-ZDUSSCGKSA-N 390.465 2.643 0 50 GFAA Cc1nc(-c2cc3c(s2)CCN(C[C@@H](O)CN2CCCC2=O)C3)cs1 180876876 SWYPUOUTPLOUNB-CQSZACIVSA-N 377.535 2.521 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccs2)cc1C(=O)O 299747198 CITYIHWEEQOJSU-CJNGLKHVSA-N 376.434 2.526 0 50 GFAA CC(C)N1C[C@]2(CCCN(C(=O)NCc3nccn3C(C)C)C2)CCC1=O 534644090 KLTQPWZGCBMLAC-HXUWFJFHSA-N 375.517 2.787 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4cccc(F)c4)c3CO2)cc1 263617401 NPFQLNCIUODEEK-SFHVURJKSA-N 382.395 2.627 0 50 GFAA CCN1CCN(CCOc2ccc(CN3Cc4ccccc4[C@@H](O)C3)cc2)CC1 823116385 OOYGXPUEAYIIQJ-DEOSSOPVSA-N 395.547 2.752 0 50 GFAA CC(C)c1ccc(N2C[C@H](C(=O)N(CCO)Cc3nccs3)CC2=O)cc1 828754190 MPHCAGSQUYAORV-MRXNPFEDSA-N 387.505 2.641 0 50 GFAA C[C@H](NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1)c1ccnn1C 192896673 ZPXSPJZSTNUXAF-AWEZNQCLSA-N 386.477 2.862 0 50 GFAA Cc1nc(N2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c2cnn(C)c2n1 194272905 MIWGGXCTFPHMFK-LBPRGKRZSA-N 385.859 2.575 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC1)OCC2 1704298386 GBBUAMPIWSMUTK-JCNLHEQBSA-N 389.492 2.645 0 50 GFAA O=C(c1ccns1)N1CC[C@H]2[C@@H](C1)CN2C(=O)Cc1c(F)cccc1Cl 1775982892 ZOQAZMRURCFESU-NHYWBVRUSA-N 393.871 2.851 0 50 GFAA Cc1cc(Cl)c(Cl)cc1S(=O)(=O)N1C[C@@H]2CCCN2C(=O)[C@@H]1C 1772712013 JYWIKXMYQJEEKM-QWRGUYRKSA-N 377.293 2.686 0 50 GFAA CCCC1=C(C(=O)OCC)[C@H](c2ccc(OC)c(OC)c2OC)NC(=O)N1 5019034 CXLZICTWUGZLHI-HNNXBMFYSA-N 378.425 2.684 0 50 GFAA COc1ccc(-n2nnc(C(=O)Nc3ccc(-n4nncc4C)cc3)c2C)cc1 11690357 LSJYKJDNFMWUPT-UHFFFAOYSA-N 389.419 2.726 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccnn1C 11818094 JRQCIYQSOJHOBU-LJQANCHMSA-N 384.524 2.846 0 50 GFAA O=C(N[C@H]1CCCCNC1=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 11879668 MYGCCCXFEIMPGS-ZDUSSCGKSA-N 397.353 2.671 0 50 GFAA Cc1ncsc1CCNC(=O)[C@@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12710500 MUOHCXUGDCAJMS-OAHLLOKOSA-N 375.469 2.688 0 50 GFAA COCCN1C(=O)N(CC(C)C)C(=O)C12CCN(C1Cc3ccccc3C1)CC2 14536964 PDNIGRBDGKBXFG-UHFFFAOYSA-N 399.535 2.555 0 50 GFAA O=C([C@@H]1COc2ccccc2O1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857672161 NOZLQBMDTLSJNZ-FQEVSTJZSA-N 375.428 2.844 0 50 GFAA CCNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)CCn1nccc1C 1857673717 SMLDXWYLDUXRHV-MIZPHKNDSA-N 394.519 2.710 0 50 GFAA CCc1nc(-c2ccc3nc(CC(C)C)n(CCCN)c3c2)n(C[C@@H](C)O)n1 1857677695 MVXITPCPUHJPCO-OAHLLOKOSA-N 384.528 2.785 0 50 GFAA Cc1nonc1C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857725827 OLBBMCRXAPQELA-UHFFFAOYSA-N 391.431 2.661 0 50 GFAA COc1ccc(NC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccn2)cc1 222318614 QZGMUPDXLLNBGO-QAPCUYQASA-N 380.448 2.745 0 50 GFAA O[C@H]1CNCC[C@@H]1CNc1ccc(-c2nc(CCCc3ccccc3)no2)cn1 215313396 WMBVLDURVBICCY-MJGOQNOKSA-N 393.491 2.689 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N[C@@H](CN)CC(C)C)cc1Cl 237076700 LVLMGDMUDUBHMA-SECBINFHSA-N 399.738 2.763 0 50 GFAA O=C1CC2(CN1)CN(C(=O)N[C@@H](c1cccc3ccccc13)C(F)(F)F)C2 1875254949 YOLJKKHPPSTARH-INIZCTEOSA-N 377.366 2.975 0 50 GFAA CC(C)(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1NCc2n[nH]cc21 1875392740 RHJGOLKNKZFKQN-NSISKUIASA-N 381.524 2.607 0 50 GFAA Cc1ccsc1CCCC(=O)N1CCC2(CC1)C[C@H](O)c1nn(C)cc1O2 1875394878 ZNVKSPKYVNXGJG-HNNXBMFYSA-N 389.521 2.990 0 50 GFAA C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)[C@@H]1CN 156631426 HGCRYQGRVRAIPS-UKRRQHHQSA-N 378.519 2.780 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)Nc2cnn(-c3ccccc3Br)c2)C1 263094160 SZGILBBFOWULMO-JTQLQIEISA-N 379.214 2.573 0 50 GFAA NCc1nc(C(=O)N2CCC[C@]3(CCc4cnc(-c5ccccc5)nc43)C2)co1 1704315586 LFNMABUDKLYLQG-QFIPXVFZSA-N 389.459 2.711 0 50 GFAA CN(Cc1nccn1CC(F)(F)F)S(=O)(=O)[C@@H]1C[C@H]1c1cccc(F)c1 914054874 LGKHDVZHYIRKSD-UONOGXRCSA-N 391.390 2.902 0 50 GFAA CSc1nnc(-c2noc([C@H]3CCc4nnn(C5CCC5)c4C3)n2)s1 952895922 XZXXOIVKXXNDQO-QMMMGPOBSA-N 375.483 2.899 0 50 GFAA Cc1cn(Cc2ccccc2)[nH]c1=NC(=O)c1cc2c(cc1F)NC(=O)CC2 1875336685 JQORUYRZRLPNSY-UHFFFAOYSA-N 378.407 2.938 0 50 GFAA C[C@@](O)(Cc1cn(C[C@H](O)CCOCc2ccccc2)nn1)c1cccs1 2325772821 OXVLHDVAWNXBQU-UYAOXDASSA-N 387.505 2.758 0 50 GFAA CN1CCc2nc(O)c(CNC(=O)c3cnn(-c4ccccc4Cl)c3)cc2C1 2325782042 QJNPCCLIKUQWAB-UHFFFAOYSA-N 397.866 2.544 0 50 GFAA COc1cncc(C(=O)N(C)C[C@@H](C)NC(=O)CC(C)(C)C(F)(F)F)c1C 2325794253 WCAASDTZTQGWOJ-LLVKDONJSA-N 389.418 2.954 0 50 GFAA CN1CCN(c2ccnc(NC(=O)Cc3ccc(-n4cccc4)cc3)c2)CC1 1454649231 JJJLBYZPVZJSSU-UHFFFAOYSA-N 375.476 2.805 0 50 GFAA COc1cc(NC(=O)c2nc3nc(C)cc(C(F)F)n3n2)cc(OC)c1OC 815226 YHNIHWCXNNLRGS-UHFFFAOYSA-N 393.350 2.648 0 50 GFAA CCOc1ccc(N([C@H](C)C(=O)Nc2ccc(OC)cc2)S(C)(=O)=O)cc1 1157560 ZHCDOYASASOTNJ-CQSZACIVSA-N 392.477 2.887 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2ccccc2Br)NC(=O)N1 1168299 HWXFJYJURNLLQO-XHDPSFHLSA-N 395.253 2.799 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCC[C@]4(CN(C)C(=O)O4)C3)cc2)ccc1O 2356140147 WGRSHTKZXPFOOJ-NRFANRHFSA-N 381.432 2.819 0 50 GFAA Cc1ccccc1S(=O)(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356142022 ACYKRBVBBNXMFK-FQEVSTJZSA-N 386.521 2.520 0 50 GFAA Cc1nc(C)c(CNC(=O)[C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)s1 2356148174 KMSQCTMALDTVIX-MOPGFXCFSA-N 387.505 2.753 0 50 GFAA COc1ccccc1-n1cc(CN2CCC[C@@]3(CCc4c[nH]c(=N)nc43)C2)cn1 2356154752 IMZRBNLIRMHUKU-JOCHJYFZSA-N 390.491 2.563 0 50 GFAA O=C(N[C@]1(C(F)(F)F)N=C(O)N(Cc2ccccc2)C1=O)c1cccs1 2863646 JAANGBYPFWYURS-HNNXBMFYSA-N 383.351 2.693 0 50 GFAA Cc1cc(C)n(S(=O)(=O)c2cc(C(=O)O)c(N3CCCC3)cc2Cl)n1 4165543 QQONDWBEXZDURE-UHFFFAOYSA-N 383.857 2.689 0 50 GFAA O=C(NCCc1cc(=O)[nH]cn1)c1cccc2c1C(=O)c1cc(Cl)ccc1-2 23431481 ZRNXBLIYKZHBMY-UHFFFAOYSA-N 379.803 2.607 0 50 GFAA Cc1ccc(-c2nc(NCCN3CCOCC3)ncc2-c2ccc(N)nc2)cc1 65508099 ZRQJHSFBCLILAH-UHFFFAOYSA-N 390.491 2.840 0 50 GFAA Cc1nonc1CC(=O)NCC1(N(C)Cc2ccccc2)Cc2ccccc2C1 23337798 IFZXMBSXCRLEDG-UHFFFAOYSA-N 390.487 2.706 0 50 GFAA CCn1ccc(CN(C)C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1 252494735 ODBIJJPPTBDLIP-UHFFFAOYSA-N 387.503 2.611 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)C[C@@H]2CCC(=O)N2)c(F)c1F 12434465 WXJXDCXMHSRKCZ-ZDUSSCGKSA-N 375.375 2.745 0 50 GFAA O=C1CS[C@]2(C(=O)N3CCCc4cccc2c43)N1c1ccc2c(c1)OCCO2 4771008 NTRCHTGZVDOZTA-OAQYLSRUSA-N 394.452 2.683 0 50 GFAA CC[C@@H](C(=O)N1N=CC[C@]1(O)C(F)(F)F)n1nc(C)c(Br)c1C 6488995 ZNAZRCMTGQELQR-CABZTGNLSA-N 397.195 2.683 0 50 GFAA CCc1nc(C)c(C(=O)N2CCn3nc([C@H](O)Cc4ccccc4)cc3C2)o1 219369940 ICJKCUIVVUAOIC-GOSISDBHSA-N 380.448 2.674 0 50 GFAA O=C(Nc1cn(Cc2ccccc2)nn1)N1CCCN2c3ccccc3C[C@@H]2C1 377821109 KWPKLQYAMXZFGB-LJQANCHMSA-N 388.475 2.995 0 50 GFAA COc1cc(-c2nc(C)cnc2C)cc2c1OCCN(C(=O)[C@H]1CCCO1)C2 15002771 NDVZGAMFDCKQGG-QGZVFWFLSA-N 383.448 2.669 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)CCn3ccccc3=O)CC2)C1 96166966 CVFBJSLWBNTZFC-NRFANRHFSA-N 393.531 2.967 0 50 GFAA CNC(=O)C1(NC(=O)NCC[C@H]2CCN(Cc3ccccc3)C2)CCCCC1 426677932 GKZKSFVTISUGDL-IBGZPJMESA-N 386.540 2.647 0 50 GFAA O=C(CCN1C[C@@H]2CC[C@H]1C2)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 92065050 FJZADPZBSHZESQ-NQIIRXRSSA-N 399.583 2.912 0 50 GFAA CNC(=O)c1cc2c(s1)CCN(C(=O)[C@H]1CCCN(C3CCCC3)C1)C2 91305884 AOSUPTHAPKWPHI-AWEZNQCLSA-N 375.538 2.647 0 50 GFAA O=C1CN(c2ccc(C(=O)N[C@@H]3CCC[C@H]3OCc3ccccc3)cc2)C(=O)N1 91616526 WYJHGYWIFZBMOB-RTBURBONSA-N 393.443 2.611 0 50 GFAA Cc1nc(-c2ncc(C(=O)N3CCO[C@H](c4ccccc4)C3)c(O)n2)cs1 91255361 UMTKMUCXUFLQJW-INIZCTEOSA-N 382.445 2.828 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)c1cnc(-c2cccnc2)nc1O 92020614 LNLDZVVESQVHHS-UHFFFAOYSA-N 378.436 2.508 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)N(C)Cc1cc(-c3cccnc3)no1)CO2 91445125 NFKUSBMBYLIPIJ-MRXNPFEDSA-N 379.416 2.955 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccccc2-c2ncc[nH]2)[C@H]2C[C@@H](O)C2)cn1 244595051 DNSPJQZMWOCSFP-ZRGWGRIASA-N 378.432 2.722 0 50 GFAA COc1ccc(CNC(=O)[C@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)cc1C(=O)O 299748716 HYGYHYWPPUBTTB-YOEHRIQHSA-N 396.443 2.619 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2Cl)C1=O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 252572451 ZJDGJCKOONIMED-GZIXRCOHSA-N 387.867 2.683 0 50 GFAA CN(C[C@H]1COc2ccccc2O1)C(=O)NC1CCN(Cc2ccco2)CC1 534587701 VFTZYZVFGGAFPK-SFHVURJKSA-N 385.464 2.725 0 50 GFAA CCn1ncc(C(=O)NC)c1NC(=O)[C@H](c1ccc(F)cc1)N1CCCCC1 1940196093 KACPJJBYTLWJIQ-KRWDZBQOSA-N 387.459 2.567 0 50 GFAA COc1cc(NC(=O)c2[nH]c(-c3ccccc3)nc2C)cc(-n2cnnn2)c1 952964252 CIJGFJUCMIXDQQ-UHFFFAOYSA-N 375.392 2.622 0 50 GFAA CS(=O)(=O)Nc1cc(C(=O)NC[C@H]2CCC3(CCCCC3)O2)ccc1F 276769583 SNRGKTHRJRWHQD-CQSZACIVSA-N 384.473 2.809 0 50 GFAA CCc1nc(C2CCN(C(=O)c3cnn(-c4ccccc4OC)c3C)CC2)n[nH]1 192674027 XPKNHLFRPNZRES-UHFFFAOYSA-N 394.479 2.890 0 50 GFAA CCCN(C(=O)[C@H]1OCC(=O)N[C@@H]1c1ccccc1)C1Cc2ccccc2C1 1529099183 SPPXYXKDYPYEFZ-YADHBBJMSA-N 378.472 2.649 0 50 GFAA O=C(Cc1cccs1)N1C[C@H]2CN(Cc3cc4ccccc4o3)C[C@]2(CO)C1 1772810315 FXUUJDZRYDNLRH-VGOFRKELSA-N 396.512 2.990 0 50 GFAA O=C(Cc1cccs1)N1CCC[C@H](CNS(=O)(=O)Cc2ccccc2)C1 11879600 VVNPKHWHHXJING-QGZVFWFLSA-N 392.546 2.649 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cc(=O)c4ccccc4o3)CCC2=O)c1 12039517 PWDUEXWXQDQCQD-UHFFFAOYSA-N 390.439 2.976 0 50 GFAA CO[C@@H](C(=O)NC[C@@H]1Cc2cc(-c3cnccn3)ccc2O1)c1ccccc1 12052654 JMMXOPQJNVNWPQ-GHTZIAJQSA-N 375.428 2.951 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CN4CCCCC4=O)C3)C2)c1 12073196 GYXWUSRIRGPXCY-QHCPKHFHSA-N 383.536 2.822 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccccc2F)C1)C(=O)CCc1cnccn1 12575178 YCNXCUCEARLRFD-SFHVURJKSA-N 384.499 2.961 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@@H](CNC(=O)c2cccc3ccccc23)C1 12613015 QLTCVVFDELBDDM-INIZCTEOSA-N 392.459 2.742 0 50 GFAA COc1ccc(S(=O)(=O)NCCC(C)C)cc1C(=O)N1CCC(C)CC1 14400727 OCOSFIXIPNFRMZ-UHFFFAOYSA-N 382.526 2.892 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)c3snnc3C)C2)cc1 14950589 PCGROZMGWXREOX-QGZVFWFLSA-N 388.537 2.882 0 50 GFAA Cc1cc(Br)ccc1OCC(=O)N1CCN(c2ccccn2)CC1 18220290 QZIGSUOXYPGXMV-UHFFFAOYSA-N 390.281 2.880 0 50 GFAA CN(Cc1nc(-c2ccco2)no1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 155575934 TUMMORFXQAUDGP-GFCCVEGCSA-N 379.825 2.943 0 50 GFAA CC1(C(=O)NC[C@@]23CCC[C@@H]2CN(c2ccc4nnnn4n2)C3)CCCCCC1 1857527044 OCPFTJAWSHOYGO-IIBYNOLFSA-N 397.527 2.603 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)CCCc2cn[nH]c2)CC1 1857707027 WRKPPCSWOVTFMJ-UHFFFAOYSA-N 389.477 2.583 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857738348 DBJLNHKBMNRVCV-CDXJDZJCSA-N 398.846 2.960 0 50 GFAA Cc1cncc(C(=O)N2C[C@@H]3OC(=O)N(CCc4cccc(Cl)c4)[C@@H]3C2)c1 213215017 YQXHQVUFIVCELH-MSOLQXFVSA-N 385.851 2.931 0 50 GFAA Fc1cc([C@@H]2CN(c3ccc(-c4nn[nH]n4)nn3)CCO2)c(Cl)cc1Cl 826372234 NPPBZBQXBWNHHG-ZDUSSCGKSA-N 396.213 2.681 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@H]2c2nccn2-c2cccc(F)c2)cccc1=O 952891021 SHEJZBSUUCYLFK-GOSISDBHSA-N 380.423 2.933 0 50 GFAA CC(=O)N1CCN(C(=O)[C@@H](C)Nc2ccc(Oc3ccccn3)cc2C)CC1 1875279199 BNMAYOAUCPANAQ-MRXNPFEDSA-N 382.464 2.673 0 50 GFAA CCOC(=O)[C@H]1CCN(C(=O)c2cc3ccc(C(C)=O)cc3[nH]2)C12CCOCC2 1875300443 CJLGVGMIFHAQET-QGZVFWFLSA-N 398.459 2.945 0 50 GFAA Cc1csc(C(=O)N(C)CCC2CCN(C(=O)c3[nH]c(O)nc3C)CC2)c1 1875310519 SVZKUETUWGOASE-UHFFFAOYSA-N 390.509 2.808 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@@H]2Cc3n[nH]cc3[C@@H](C(F)(F)F)C2)cc1 1875368900 DOPNHNUHGZEMAM-JSGCOSHPSA-N 378.354 2.925 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1c[nH]nc1O)OCc1ccccc1 1306848462 MNQHUNRDAYBHMF-INIZCTEOSA-N 380.404 2.592 0 50 GFAA C[C@@H](NC(=O)N1CCC[C@](O)(CC(=O)N(C)C)C1)[C@@H]1CCCc2ccccc21 888093861 ZYWSUPUYOJJZEF-NRJQMVOHSA-N 387.524 2.510 0 50 GFAA O=C(N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1)C1(CO)CC1 2100483930 SCMLNWPQGAEVFA-OAQYLSRUSA-N 380.488 2.723 0 50 GFAA Cn1nc(C(=O)N2CCC(Oc3ccc(Cl)cc3)CC2)c2c1CCOC2 2325782352 RORCFVZVIRGXLG-UHFFFAOYSA-N 375.856 2.830 0 50 GFAA O=C(CNS(=O)(=O)c1ccc(Br)cc1)NC1CCCCCC1 1141593 OCFDMYLRNWESCV-UHFFFAOYSA-N 389.315 2.566 0 50 GFAA CCc1ccc(-n2c(-c3ccccc3)cn3c4c(=O)n(C)c(=O)n(C)c4nc23)cc1 2418849 PBJFUMQURCQZJW-UHFFFAOYSA-N 399.454 2.905 0 50 GFAA COc1ccc(CCNC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1OC 2864708 YPNCXRLVSNGFGV-UHFFFAOYSA-N 376.840 2.963 0 50 GFAA O=S(=O)(NC[C@H](c1ccco1)S(=O)(=O)c1ccccc1)c1ccccc1 4519386 AQNZQKBRMKIMMH-GOSISDBHSA-N 391.470 2.773 0 50 GFAA CCC12CN(C(=O)c3ccco3)CC(CC)(CN(C(=O)c3ccco3)C1)C2=O 4840635 RMYBBRKKWGZHDI-UHFFFAOYSA-N 384.432 2.846 0 50 GFAA Cc1cc(C)n(CCC(=O)N[C@@H](CCn2ccnc2C)c2ccccc2)c(=O)n1 55568632 OVRGNEKLCVPRHH-FQEVSTJZSA-N 393.491 2.703 0 50 GFAA O=C(c1cccc(S(=O)(=O)NCCCOC2CCCC2)c1)N1CCCC1 60921483 WRGJMILBAKERDH-UHFFFAOYSA-N 380.510 2.550 0 50 GFAA Cn1cncc1[C@@H]1C[C@@H](NS(=O)(=O)/C=C/c2ccccc2Cl)CCO1 328625925 LDJKOPWESWEDBH-YCQIBGRGSA-N 381.885 2.884 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)c2ccnc(-n3ccnc3)c2)C1 154268289 MZDYMPCNJKNQOV-INIZCTEOSA-N 377.448 2.532 0 50 GFAA Cc1nc(-c2cccc(C(=O)N[C@@H]3CCC(=O)N[C@H]3c3ccnn3C)c2)cs1 240555669 GXCAPMUHFXYERB-DNVCBOLYSA-N 395.488 2.602 0 50 GFAA Cc1ncsc1CCC(=O)N1CCOC[C@H]1CC(=O)Nc1cccc(F)c1 72470492 IZADEYCPAUIFQR-MRXNPFEDSA-N 391.468 2.779 0 50 GFAA CN(C1CCN(CCn2cccn2)CC1)[C@H]1CCCN(c2ccccc2F)C1=O 157051522 CAVWZJKFROLMME-NRFANRHFSA-N 399.514 2.614 0 50 GFAA O=C(CN1CCN(C[C@@H](O)c2cccc(Cl)c2)CC1)N1CCc2ccccc21 174735792 RLNHBCDQBQJTIO-OAQYLSRUSA-N 399.922 2.580 0 50 GFAA O=C(NCCN1CCC[C@H](c2ccccc2)C1)c1ccc(-n2cnnc2)cc1 216220240 BQJARPDGHFIUMK-FQEVSTJZSA-N 375.476 2.877 0 50 GFAA COc1ccc([C@H](NC(=O)c2cccc(OC(F)F)c2)C2CC(O)C2)cn1 223427441 GYJLZHXBVDRENU-KVULBXGLSA-N 378.375 2.934 0 50 GFAA CCc1nn2c(nnc3c(=O)n([C@@H](C)C(=O)O)ccc32)c1-c1ccc(Cl)cc1 40395916 OZOSLSFSGKAJAQ-JTQLQIEISA-N 397.822 2.968 0 50 GFAA C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1nccc(C(F)F)n1 288900814 URBKFGMJKGKVST-LLVKDONJSA-N 391.426 2.950 0 50 GFAA CCc1n[nH]c(C(=O)N2CCc3[nH]c(-c4cccc(C(=O)O)c4)nc3C2)c1C 222559160 LZFLODZKFXHHLV-UHFFFAOYSA-N 379.420 2.567 0 50 GFAA CN(Cc1ccc2nonc2c1)C(=O)NCCN1CC[C@@H](c2ccccc2)C1 426546312 ZAQIXWKOMJEVBV-GOSISDBHSA-N 379.464 2.854 0 50 GFAA CN1CCN(C[C@@H]2CCCN(C(=O)c3ccc(-c4ccncc4)cc3)C2)CC1 426386849 DNMPOPAEDGECOA-IBGZPJMESA-N 378.520 2.848 0 50 GFAA CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(-c3cscn3)cc2)C1 95503740 QNHDFZKHXAWKNX-AWEZNQCLSA-N 379.507 2.810 0 50 GFAA CCO[C@H]1CN(C)C[C@@H]1NC(=O)Nc1ccc(C(=O)OC2CCCC2)cc1 95521981 IEHYUZTVGXYIII-ROUUACIJSA-N 375.469 2.627 0 50 GFAA Cn1c(=O)oc2ccc(NC(=O)N(Cc3ccccn3)C[C@@H]3CCCO3)cc21 96180310 ILTYNXDAAWKNRK-INIZCTEOSA-N 382.420 2.740 0 50 GFAA Cc1nc(C)n(CCCN2C[C@@](C)(Cc3ccc4c(c3)OCO4)CCC2=O)n1 91819208 BRBOHJNMGJEWGQ-OAQYLSRUSA-N 384.480 2.885 0 50 GFAA O=c1c2ccccc2c(Cc2ccccc2)nn1Cc1nc([C@H]2CCOC2)no1 96152314 HRQZTUNCYNKHKX-INIZCTEOSA-N 388.427 2.923 0 50 GFAA O=C1CCC2(CCN(c3ncnc4[nH]cnc34)CC2)CN1Cc1ccccc1 91931428 ROEWEABPBKYAFV-UHFFFAOYSA-N 376.464 2.762 0 50 GFAA Cc1cccc(N2CCN(CCC(=O)NCc3nc4ccccc4o3)CC2)c1 95356019 HDPJGEGXGKIWIT-UHFFFAOYSA-N 378.476 2.965 0 50 GFAA CCCCSc1nc(N)cc(N2CCC(N3CCN(CC)CC3)CC2)n1 95374186 VUANSIZXIUXXGD-UHFFFAOYSA-N 378.590 2.557 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(C(=O)c2ccccc2Cl)C1 95379519 ZBROELYWHIKAAJ-CQSZACIVSA-N 384.871 2.733 0 50 GFAA Cc1cccc2[nH]c(CCC(=O)NCc3ccnc(O[C@@H]4CCOC4)c3)nc12 163081009 VAWOQLBFTCTQOQ-MRXNPFEDSA-N 380.448 2.683 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(=O)NC)c1 298332282 WWRNHGJGSTVQAD-GOSISDBHSA-N 395.459 2.688 0 50 GFAA CCCCN1CCn2nc(CNC(=O)[C@@H](O)c3cccc(Cl)c3)cc2C1 299761643 YNQZJFYHFIJGAI-SFHVURJKSA-N 376.888 2.502 0 50 GFAA CN(Cc1nccn1C)C(=O)c1cccc(-c2cc(N3CCCC3)cnn2)c1 299769940 NIHPPSBNADETSQ-UHFFFAOYSA-N 376.464 2.750 0 50 GFAA O=C(c1ccccc1)N1CCC(C(=O)N2CC[C@H](Oc3ccccn3)C2)CC1 268676923 BZGAAYVFFBIVBN-IBGZPJMESA-N 379.460 2.614 0 50 GFAA CCc1cc(NC(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)n(C)n1 275594126 SQSQEWGUFDELNS-MRXNPFEDSA-N 384.484 2.663 0 50 GFAA CC(=O)NCc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)s1 188426929 CBTFEPJTNCHUJF-MRXNPFEDSA-N 380.416 2.876 0 50 GFAA O=C(NCC1(CO)CCOCC1)Nc1ccnn1Cc1ccc(Cl)c(F)c1 189604950 NRAXNHYORFVTAY-UHFFFAOYSA-N 396.850 2.635 0 50 GFAA C[C@@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)N1CCCCC1=O 193488326 KBCSQAQOEJSCCD-KRWDZBQOSA-N 387.524 2.621 0 50 GFAA Cc1ccc(N[C@](C)(C(=O)N2CCN(CC(=O)O)CC2)c2ccccc2)cc1 1506406815 JOTRRRFJJHZOHH-QFIPXVFZSA-N 381.476 2.551 0 50 GFAA O=C(Cc1ccc(Cl)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 5633654 GUXFLEGKXYCSBI-UHFFFAOYSA-N 394.880 2.542 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCCN(C(=O)c2ccc3c(c2)OCCO3)C1 11666640 NZMLCHDWJKXBTB-IBGZPJMESA-N 381.476 2.632 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)c2ccc(F)cc2)C1 12025629 GQXJOPTTXFNPOY-QGZVFWFLSA-N 384.455 2.896 0 50 GFAA O=C(N[C@@H](c1cccnc1)C(F)(F)F)c1cn(Cc2ccc(F)cc2)nn1 12192647 WDURZKZNSHDJSN-HNNXBMFYSA-N 379.317 2.894 0 50 GFAA COc1ccc(C(=O)N(C)[C@@H]2CCOC2)cc1OC1CCN(C(C)C)CC1 12314342 BQHNVCSYDSDMSD-QGZVFWFLSA-N 376.497 2.808 0 50 GFAA COCCN1CCC(CN(Cc2cnn(C(C)C)c2)C[C@H]2CCCO2)CC1 12758866 KBNVAZBUEHFOEO-OAQYLSRUSA-N 378.561 2.803 0 50 GFAA CCOCCc1nnc(NC(=O)C2CCN(C(=O)c3cccs3)CC2)s1 16625736 JEJZDKKUCUIIFO-UHFFFAOYSA-N 394.522 2.670 0 50 GFAA CN1CCN(C(=O)/C(=C/c2ccccc2Cl)NC(=O)c2ccccc2)CC1 19782162 JSGLUDGGHXXUQP-CYVLTUHYSA-N 383.879 2.885 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1CCC2(CC1)CC(=O)NCCO2 1857687648 XVBBLJPEXVSBKH-UHFFFAOYSA-N 383.492 2.533 0 50 GFAA COc1cccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1C 1857708954 WAXRYPDQOWKCCB-NOXFTYBFSA-N 392.455 2.918 0 50 GFAA CC(C)=CCN1CCC(C2CCN(c3nc(N)c4cnn(C)c4n3)CC2)CC1 1857717721 VGLAHMXMLUDDFV-UHFFFAOYSA-N 383.544 2.840 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)NC1CCN(c3cccc(C)n3)CC1)CO2 116670542 LDZYMQCIYIDJEM-KRWDZBQOSA-N 381.476 2.735 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)c3ccc(F)cc3)CC2)n1 17012329 WIWQGKUKQHUETI-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA CO[C@H](C(=O)N1CCC(n2c(O)nc3ccccc32)CC1)C1CC(F)(F)C1 1875280150 XCLWBDNJRRUZLV-INIZCTEOSA-N 379.407 2.966 0 50 GFAA COc1ccc(CN2CCC[C@@H]([C@@H](C)NC(=O)Cn3cc(Cl)cn3)C2)cc1 1875307062 JLGYNAQJNZLHNM-NVXWUHKLSA-N 390.915 2.962 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCCNC(=O)[C@@H]3CC(C)C)ccc21 1875371790 MCODWJHJHSKMDS-IBGZPJMESA-N 383.492 2.529 0 50 GFAA Cc1cc(-c2ccccc2)nc(NC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)n1 2100483732 KNZPHVOLUBIFKQ-KRWDZBQOSA-N 387.443 2.834 0 50 GFAA C[C@@H]1NCC[C@@H]1C(=O)N(Cc1ccccc1)Cc1nc(O)c2sccc2n1 2325738421 SYOXXLVYTSYLQH-ZFWWWQNUSA-N 382.489 2.924 0 50 GFAA Cc1cc(Cl)ccc1OC(C)(C)C(=O)NCc1cccc(S(N)(=O)=O)c1 2325772786 GNCAHUXNPMPGRO-UHFFFAOYSA-N 396.896 2.770 0 50 GFAA O=C(NC[C@H]1NCCc2ccccc21)c1cnc2cc(Br)ccn12 2325855926 VEQVPXPTOYUATC-OAHLLOKOSA-N 385.265 2.714 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NCCOc1cc(Cl)cc(Cl)c1 225671709 NISVOVOKWOGNAV-LSDHHAIUSA-N 381.325 2.822 0 50 GFAA CCc1csc([C@H]2CCCN(C(=O)c3c(C)oc4ncn(C)c(=O)c34)C2)n1 113202800 PIOPLSCLROCZBO-LBPRGKRZSA-N 386.477 2.874 0 50 GFAA CCOc1ccc(S(=O)(=O)N[C@H]2CCN(C(C)C)C2=O)c2ccccc12 114743688 JPVSGUIUVXEJCQ-INIZCTEOSA-N 376.478 2.526 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)N2CCC[C@H](c3nccs3)C2)cc1 114741389 UAQUXBJMXFHXMK-AWEZNQCLSA-N 391.518 2.838 0 50 GFAA Cc1oc(-c2cc(F)ccc2F)nc1CN1CCN(CC(=O)NC(C)C)CC1 22925737 CROMWACUBVIZBF-UHFFFAOYSA-N 392.450 2.570 0 50 GFAA CC(C)N1C(=O)CN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1(C)C 464375111 IQSOASMSRNMZMR-GOSISDBHSA-N 389.515 2.896 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)N[C@](O)(C(F)(F)F)[C@@H]1C(=O)c1ccccc1 22275914 MTWSQTLPVMNEGM-RLFYNMQTSA-N 394.349 2.799 0 50 GFAA CCN1CCN([C@@H]2CCc3c(sc4ncn(CCC(C)C)c(=O)c34)C2)CC1 23363036 ZGKCUQDZWWJNOT-MRXNPFEDSA-N 388.581 2.999 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccoc3)n1)CCN(C(=O)[C@@H]1CCOC1)C2 20916737 FBZZJLRNDFLTCZ-CQSZACIVSA-N 380.404 2.621 0 50 GFAA CCN1CCN(c2cc(C)nc3cc(-c4ccc(OC)c(OC)c4)nn23)CC1 21150336 GFUQSJIILUXLAT-UHFFFAOYSA-N 381.480 2.864 0 50 GFAA CC(C)NC(=O)c1nnc(N2CCC(c3ccccc3)CC2)n1C[C@@H]1CCCO1 253397781 KWAAJQWUXHMSNS-IBGZPJMESA-N 397.523 2.979 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCO[C@@H](c2ccc(Cl)cc2)C1 67673141 TUQUPDVMGWIUCJ-GOSISDBHSA-N 383.839 2.589 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccn4ccnc4c3)CC2)cn1 328631588 KRYRAIRJIJVVMA-QGZVFWFLSA-N 378.480 2.902 0 50 GFAA COC(=O)N[C@H](C)C(=O)N1CCOc2c(O)cc(-c3ccc(C)s3)cc2C1 67514105 NLLXLCRAMMAQTM-GFCCVEGCSA-N 390.461 2.895 0 50 GFAA CSc1ccc(-c2ccc(=O)n(CC(=O)Nc3nnc(C4CC4)s3)n2)cc1 71279162 UBHCNBLKWWMHPC-UHFFFAOYSA-N 399.501 3.000 0 50 GFAA CC[C@@H]1CN(C(=O)c2cnn3ccccc23)CCC(=O)N1Cc1ccccc1 71575191 QOUQYZBPJYWVMR-GOSISDBHSA-N 376.460 2.988 0 50 GFAA CCOc1ccc(C(C)(C)NC(=O)C[C@@H]2C(=O)NCCN2C2CCCC2)cc1 72165376 BOHCXIGIXNMRQL-LJQANCHMSA-N 387.524 2.570 0 50 GFAA C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCOC3(CCC3)C2)c1 127841157 XUSHQDRCHDLQGQ-MRXNPFEDSA-N 392.521 2.645 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)c2cccc(COc3ccccc3C(N)=O)c2)C1 237454107 LTYMWWLMUQOUNN-YJBOKZPZSA-N 381.476 2.564 0 50 GFAA CCCCN1CCN([C@@H](C(=O)NCC2CCCCC2)c2ccccc2)C(=O)C1=O 77553526 ZYEIPVKWKXPGIY-HXUWFJFHSA-N 399.535 2.895 0 50 GFAA COCCN(C)c1ccc(CNC[C@@H]2CCN(c3ccccc3OC)C2)cn1 239869305 CYAZSJDNAQCQLC-IBGZPJMESA-N 384.524 2.789 0 50 GFAA Cc1cccc(CN2CCN(c3noc(-c4ccccc4)n3)C[C@@H]2CCO)n1 72407038 SANYIYZWIWFENK-IBGZPJMESA-N 379.464 2.513 0 50 GFAA O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)[C@@H]1CCCN1Cc1ccccc1 173260158 KQBQXEZNGICBRL-KRWDZBQOSA-N 397.441 2.568 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1CCOC[C@@H]1c1nnc(-c2ccccc2)o1 286153308 UUMSOBQICMELAH-QGZVFWFLSA-N 381.436 2.609 0 50 GFAA O=C(c1ccnn1COc1ccc(Cl)cc1)N1CCN(c2ccccn2)CC1 18166617 CMUUWXCKJPQQQR-UHFFFAOYSA-N 397.866 2.930 0 50 GFAA CCCNC(=O)c1cccnc1-c1cccc(C(=O)N2CCCC[C@H]2CO)c1 426594813 JPXFNWOWYIZETR-SFHVURJKSA-N 381.476 2.875 0 50 GFAA C[C@H]1C[C@H](NC(=O)Nc2nc3c(s2)COCC3)c2ccsc2S1(=O)=O 289824804 DEOLKQGKWODCFY-KWQFWETISA-N 399.519 2.706 0 50 GFAA CC[C@H](C(=O)NC[C@H](C)Cn1cccn1)n1nc(C(F)(F)F)c2c1CCC2 20607693 HCIHGYDTZFOJCB-GXTWGEPZSA-N 383.418 2.991 0 50 GFAA COc1ccc(NC(=O)c2cnn(C)c2C(=O)Nc2ccc(OC)cc2)cc1 20617710 TVWNIKPMCSPWNZ-UHFFFAOYSA-N 380.404 2.942 0 50 GFAA CN(C)C(=O)CN1C[C@@H]2CC[C@H](C1)N(Cc1csc(-c3ccccc3)n1)C2 95390327 ZJKDMPYLCKZDRC-QFBILLFUSA-N 384.549 2.795 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NCCCc1nc3ccccc3n1C)C2 91519297 ZRYRXOAWIVASFW-INIZCTEOSA-N 379.460 2.882 0 50 GFAA Cn1c(O)nc(=O)c2cc(C(=O)N[C@@H]3CCCc4sc(Cl)cc43)cnc21 293802262 XTKDRVYGPYVJIA-LLVKDONJSA-N 390.852 2.556 0 50 GFAA COc1cncc([C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)[C@H]2C[C@@H](O)C2)c1 244842330 UOPWPFKBAPHKKH-GMBSWORKSA-N 378.432 2.722 0 50 GFAA CCN(Cc1ccc(F)cc1)C(=O)NCC1(N2CCN(C)CC2)CCCC1 534662703 VXBFLKZHTRPTDU-UHFFFAOYSA-N 376.520 2.917 0 50 GFAA CC[C@H](NC(=O)N1CCN(Cc2cccc(OC)c2)C(=O)C1)c1cccnc1 534578493 RIAWSWXTAPZUNZ-IBGZPJMESA-N 382.464 2.595 0 50 GFAA O=C1CO[C@@H](CNc2nc3ccccc3o2)CN1CC1CCN(CC2CC2)CC1 299780027 SLNGXWOEDXXLMN-SFHVURJKSA-N 398.507 2.589 0 50 GFAA CCCCc1ccc(CN2CC[C@@H](NC(=O)c3cc(C)on3)[C@H](O)C2)s1 299757500 IENMOMVZAUXNLR-SJLPKXTDSA-N 377.510 2.752 0 50 GFAA Cc1ccc(NC(=O)N2CCC[C@]3(CN(C)C(=O)O3)C2)cc1N1CCCC1=O 299755336 AKHADEJVAIOBLR-FQEVSTJZSA-N 386.452 2.570 0 50 GFAA Cc1cc(C)cc(-c2nn3c(C4CCN(S(C)(=O)=O)CC4)nnc3s2)c1 825132064 RGXFEVNQUSGHTR-UHFFFAOYSA-N 391.522 2.609 0 50 GFAA Cc1nn(CCNC(=O)N2CCn3cccc3[C@@H]2c2cccnc2)c(C)c1C 584894964 GOEOSYFWMGFFFP-FQEVSTJZSA-N 378.480 2.820 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccc2)C3)c(O)c1 1565514700 FUOKCMZMWZXNOL-WBVHZDCISA-N 380.444 2.778 0 50 GFAA O=C(c1ccc2nn[nH]c2c1)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565517042 HHYAPSHEGNSAGS-BEFAXECRSA-N 387.487 2.662 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)N1CCC[C@H](N2CCNCC2=O)C1 186599735 ANAYRIZGINRFFV-CWRNSKLLSA-N 396.318 2.520 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1nc2cccnc2s1 193984805 HOALKVWOTQBLJG-OAHLLOKOSA-N 380.473 2.655 0 50 GFAA Cc1c(-c2cc(CN3CC[C@H](CN(C)Cc4cccnc4)C3)on2)cnn1C 195282451 YUHBDGLEMLJYCG-GOSISDBHSA-N 380.496 2.732 0 50 GFAA CCc1oc(C(=O)N[C@H]2COC[C@@H]2Cc2ccncc2)cc1CN1CCCC1 1616082000 HGVSQAWGEVJUCA-OALUTQOASA-N 383.492 2.820 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H]3CC[C@@H](O)CC3)CC1)OCC2 1704336083 GBBUAMPIWSMUTK-WOVMCDHWSA-N 389.492 2.645 0 50 GFAA COc1cc(-c2onc(NCCCn3nc(C)nc3C)c2C(=O)O)ccc1F 1704316374 NUPXJLWWDSFFMO-UHFFFAOYSA-N 389.387 2.898 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCc4c[nH]nc43)C2)cc1Cn1cncn1 1775984282 MTGDVCNXXDWHTC-OAQYLSRUSA-N 378.480 2.538 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cncnc4)C[C@@H]2CN(Cc2cc[nH]n2)C3)cc1 1772814022 FSOFNJICPYFMQK-GGAORHGYSA-N 388.519 2.767 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(Cc3ccoc3)CC2)C1 11820674 IJXNXNFNNGRLQF-LJQANCHMSA-N 382.508 2.667 0 50 GFAA COCCCNC(=O)[C@@H]1C[C@H](COc2cccnc2)CN(Cc2ccccc2)C1 14733164 CHPDNNFZDATIFH-LEWJYISDSA-N 397.519 2.751 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)c4cnccn4)C3)C2)c1 15062900 JJVWDEFIXLYKFB-OAQYLSRUSA-N 384.455 2.753 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccc(F)cc3)CC2)C(=O)N1c1ccc(Cl)cc1 18091128 IEPRAQQDOXGHSW-GOSISDBHSA-N 387.842 2.933 0 50 GFAA Cc1noc(C)c1CCCNC(=O)c1ccc(N2CCN(C(C)C)CC2)nc1 19221889 CLODZDWAEABECJ-UHFFFAOYSA-N 385.512 2.579 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)c(F)c1 19789746 LPCAHEBDDVVJSR-FQEVSTJZSA-N 393.547 2.576 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)C4(c5ccccc5)CC4)C3)nn2)n1 169778150 DJTKCAKECGTDRN-MRXNPFEDSA-N 392.463 2.957 0 50 GFAA CC(C)[C@H](NC(=O)c1cc(-c2ccccc2)on1)c1nc(-c2nnc[nH]2)no1 154444414 LRAWDJVUMRHSBR-AWEZNQCLSA-N 379.380 2.637 0 50 GFAA CSc1ncc(C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cn1 1857673367 QRKGFGJKVDVOHA-UHFFFAOYSA-N 379.489 2.840 0 50 GFAA COC(=O)c1cccc(CN2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1 1857687891 KMMAWSUHNUXAAA-QFIPXVFZSA-N 380.444 2.723 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(C(=O)c2ccn4nccc4c2)C3)cc1 1857715797 IVBCDAAXZVIGPA-UHFFFAOYSA-N 385.427 2.880 0 50 GFAA Cc1cn2cccc(C(=O)N3C[C@H](O)[C@H](Cc4ccnc5ccccc45)C3)c2n1 1857722713 LPOTZGVGXIKJCK-UTKZUKDTSA-N 386.455 2.867 0 50 GFAA O=C(CC1CCCC1)N1CCC2(CC1)CN(C[C@H]1CCCOC1)C(=O)CCO2 1857724745 BBMKWFLGIBRGCK-LJQANCHMSA-N 392.540 2.603 0 50 GFAA CNC[C@@H]1CCCN1S(=O)(=O)c1c(Cl)cc(F)cc1Br 237155930 TWJNURNPMCKXFZ-VIFPVBQESA-N 385.686 2.614 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCC(=O)O)C[C@@H]1CCCO1 237728551 YFMHPUXJLTZJEY-INIZCTEOSA-N 391.855 2.930 0 50 GFAA CN1CCC[C@@H](COc2cccc(CN(C(=O)Cn3ccnc3)C3CC3)c2)C1 11785111 XLZVKXBKGNOHAP-LJQANCHMSA-N 382.508 2.795 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)[C@H](O)c3ccc(Cl)cc3F)CC2)s1 813418815 UUJIYYJDHHFBAE-MRXNPFEDSA-N 396.871 2.867 0 50 GFAA O=C([C@H](c1cccc(F)c1)N1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1 862803275 KOISSFMVYLPCNP-JTHBVZDNSA-N 398.478 2.709 0 50 GFAA O=C(NC[C@H]1CNCc2ccccc21)[C@@H]1CCCN1c1ncnc2sccc12 1875268128 FZCNLFUTZATVQT-QAPCUYQASA-N 393.516 2.663 0 50 GFAA CCOc1cccnc1S(=O)(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 1875298850 POMMTFGNTIUJHN-FUHWJXTLSA-N 376.478 2.927 0 50 GFAA CCOc1ncccc1S(=O)(=O)NC(=O)c1cc(Cl)cc2ccncc12 1875313716 XYTYITPTULOHPH-UHFFFAOYSA-N 391.836 2.801 0 50 GFAA CCc1cccnc1[C@@H](C)N[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397834 PUVVUPPQJWXION-SJLPKXTDSA-N 396.539 2.682 0 50 GFAA COCCCn1nc(-c2nc[nH]n2)nc1-c1cc2c(nc1O)CC[C@H](C(C)C)C2 1875335995 OPNHUWBIUGXDEM-ZDUSSCGKSA-N 397.483 2.628 0 50 GFAA O=C(O)[C@]1(CCCc2ccccc2)CN(Cc2ccc3c(c2)CNC3)CC[C@H]1O 2100482165 BUEPGOPUKQZFHH-ISKFKSNPSA-N 394.515 2.950 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)Cc3cn4cc(F)ccc4n3)cn2)CC1 2325760142 XTILTFOXHQYLSK-UHFFFAOYSA-N 383.427 2.523 0 50 GFAA CCc1nnc(NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)s1 909567 STFYHAVBUWELEZ-UHFFFAOYSA-N 380.495 2.527 0 50 GFAA Cc1ccnc(S[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2=O)n1 921860 PHMQTEFASBURGQ-GFCCVEGCSA-N 378.251 2.972 0 50 GFAA Cn1ccnc1C(=O)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2356136830 LLHBQKYYUKGWDP-NRFANRHFSA-N 390.487 2.998 0 50 GFAA COc1cc(C)ccc1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356160126 DXTUBMBHTUKXEC-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA O=C(c1cncc(O)c1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356168426 CYBCPCHICKZOQI-JOCHJYFZSA-N 379.460 2.627 0 50 GFAA COc1cc([C@@H]2N[C@@H](C(=O)O)Cc3c2[nH]c2ccccc32)cc(OC)c1OC 4012201 SAADZRJBOQGELC-QAPCUYQASA-N 382.416 2.882 0 50 GFAA biogenic,in-vitro O=C1CCCN1c1ccc(CN[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 4691227 ZKDRQHHNBNOWSM-SFHVURJKSA-N 397.862 2.889 0 50 GFAA O=C1NC(=O)C2(CCN(CC(Cc3ccccc3)Cc3ccccc3)CC2)N1 225422700 JNGQFKFEHLQGCL-UHFFFAOYSA-N 377.488 2.762 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCC[C@@H](O)C4)nc3)n2)c1OC 20406260 PZYMTBHUUNYAOR-CQSZACIVSA-N 382.420 2.777 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)Nc3ccc4[nH]cnc4c3)CC2=O)c(OC)c1 170625400 GUUOIHJUSNIHQE-LBPRGKRZSA-N 380.404 2.572 0 50 GFAA CN(C)C(=O)c1ccc([C@H]2CCCN2C(=O)CSc2nccn2C)s1 20860387 CRDXLDWFWIKUON-GFCCVEGCSA-N 378.523 2.639 0 50 GFAA CC(C)(C)OC(=O)N1CC[C@H](NC(=O)CCCCN2CCOCC2)C(C)(C)C1 253392231 NMFXHMHCBGCVRY-KRWDZBQOSA-N 397.560 2.641 0 50 GFAA Cc1cccn2c(CN3CCc4n[nH]cc4C3)c(C(=O)N3CCCCC3)nc12 71524651 ICBOMEUAUYCGEQ-UHFFFAOYSA-N 378.480 2.550 0 50 GFAA CCCCC(=O)N1CCC(N2CCC[C@H](C(=O)NCc3cccnc3)C2)CC1 71746002 WFTCGEDGYXGQOL-IBGZPJMESA-N 386.540 2.591 0 50 GFAA O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)N[C@H]1COC[C@H]1n1ccnn1 285259720 RTLQCMZTPCFCSC-NWDGAFQWSA-N 375.738 2.712 0 50 GFAA COc1cccc(CN(C)C2CCCCC2)c1OC[C@@H](O)CN1CCOCC1 39371737 SZPPXEZYQUSNOD-FQEVSTJZSA-N 392.540 2.532 0 50 GFAA C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)[C@@H]1CN 156813376 HMBYRNYOSSYKBC-OXQOHEQNSA-N 386.517 2.860 0 50 GFAA Cc1cccc([C@H](C)NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)c1 333744769 YQBBJWLYIUKPCF-INIZCTEOSA-N 379.526 2.656 0 50 GFAA C[C@@H](C(=O)NC(=O)NC(C)(C)C)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 241969535 UXENSPPBZGRRTI-HOCLYGCPSA-N 389.496 2.998 0 50 GFAA Cc1ccccc1NC(=O)c1c(NC(=O)COCC(=O)O)sc2c1CCC2 17079292 HAEPMCWFHWAGSG-UHFFFAOYSA-N 388.445 2.837 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)N(Cc2ccncc2)C2CCN(C)CC2)n1 426634085 CXGUBTGGCDCSEV-KRWDZBQOSA-N 384.528 2.589 0 50 GFAA Cn1cnnc1CCNC(=O)c1cccc(OC2CCN(CC(C)(C)C)CC2)c1 95501883 VGUQZNRMVWLJBZ-UHFFFAOYSA-N 399.539 2.677 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1 91304474 QGOFCMWSRQMUGS-QGZVFWFLSA-N 386.492 2.724 0 50 GFAA CCc1nn(C)c(NC(=O)N2CCN(Cc3csc(C)n3)CC2)c1CC 95505443 SUCMZBVTWYJGJY-UHFFFAOYSA-N 376.530 2.660 0 50 GFAA Cc1cccc2ncc(C(=O)NCCN3CCC[C@H](c4ccccc4)C3)c(=O)n12 97301387 UUOVRPMGZTVZAW-IBGZPJMESA-N 390.487 2.612 0 50 GFAA O=C(Nc1cccnc1OCC(F)F)N1CCCN(c2ccccn2)CC1 184139457 KCJDGDGGEAYIKP-UHFFFAOYSA-N 377.395 2.865 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2 263618361 SOTSAQVJMONQLS-GOSISDBHSA-N 396.378 2.712 0 50 GFAA COC(=O)c1nn(C)cc1-c1ccc(C(=O)N(C)Cc2c(C)noc2C)cc1 534666945 NPGWJVLWDOFGFF-UHFFFAOYSA-N 382.420 2.751 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@H]2CC(=O)N(c3cccc(Cl)c3)C2)c(C)n1 584886802 VXBQKNMLOIQJCA-INIZCTEOSA-N 389.887 2.812 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCc2nc[nH]c2[C@@H]1c1ccccn1 952984960 DCFOABFNFPWXLF-NRFANRHFSA-N 376.464 2.514 0 50 GFAA COc1ccc(CN2CCCN(c3ccncc3C)CC2)cc1Cn1cncn1 952975364 MZQRLKIKUNCAEK-UHFFFAOYSA-N 392.507 2.751 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)NCC(F)(F)CO)[C@@H]1c1ccccc1OC 170597371 IWOFWSFAIXMDDZ-YJBOKZPZSA-N 398.450 2.519 0 50 GFAA Cc1nc2cc(C(=O)N3CCOC[C@]34CCOC4)ccc2n1-c1ccccc1 194428214 QNXQOZBSIHVXGD-JOCHJYFZSA-N 377.444 2.965 0 50 GFAA COc1cc2nc(N[C@H]3CCCN(C(=O)c4ccco4)C3)nc(N)c2cc1OC 1529139798 UUOODZDXDLAMJA-LBPRGKRZSA-N 397.435 2.539 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@H](C(=O)N3CCCCCCC3)C2)CC1 12747150 SJGSICZFIBGPCP-IBGZPJMESA-N 375.557 2.892 0 50 GFAA Cc1nc(-c2cccc(N3CCCC3=O)c2)n(-c2nc(C(F)(F)F)nn2C)n1 1857680967 SWYXVYLNZVAAKR-UHFFFAOYSA-N 391.357 2.517 0 50 GFAA O=C(c1ccncc1)N1CCC[C@]2(C1)CN(c1nc3ccccc3o1)CC[C@H]2O 1857684181 BWSCJHPTPHUDNJ-KNQAVFIVSA-N 392.459 2.716 0 50 GFAA COc1cc(-c2nc(CNC(=O)CCn3nc(C)cc3C)c(C)o2)ccc1O 1857691941 HKYGOYFKVCEKAY-UHFFFAOYSA-N 384.436 2.884 0 50 GFAA N=c1cc(CN2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cc[nH]1 1857727375 PUYQGWOOURIMKY-QFIPXVFZSA-N 388.475 2.532 0 50 GFAA Cc1nn(C)c(Cl)c1CN1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857731715 YDNHZHYATYHYDX-QKLQHJQFSA-N 386.883 2.656 0 50 GFAA O=C(O)[C@]1(CC2CC2)CN(C2CCN(CCc3ccccc3)CC2)CC[C@H]1O 1875246556 BLBGOEWXDDYQTC-FYYLOGMGSA-N 386.536 2.631 0 50 GFAA O=C1NCc2cccc(NCc3nnc(-c4ccc(Br)o4)o3)c21 133133859 RTOLIIMCJKKODH-UHFFFAOYSA-N 375.182 2.948 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)c2nc(-c3ccn(C)n3)no2)cc1 864097587 XJSFQMRYGWCDLQ-INIZCTEOSA-N 389.481 2.844 0 50 GFAA COc1ccc(-c2ccnc(C3CCN(C[C@H](O)CN(C)C4CC4)CC3)n2)cc1 952892566 OQBARBIFFKTGIE-HXUWFJFHSA-N 396.535 2.787 0 50 GFAA FC(F)COCCN1CC[C@@](c2nc(-c3ccccn3)no2)(C(F)(F)F)C1 952891161 BHYBWRPQLAYTBZ-OAHLLOKOSA-N 392.328 2.919 0 50 GFAA Cc1sc(-c2nc[nH]n2)nc1C(=O)NC1CCN(c2ccc(F)cc2)CC1 1875282609 LMHQVHKVZUMRQE-UHFFFAOYSA-N 386.456 2.775 0 50 GFAA Cn1c([C@H](NC(=O)NC23CC(C(=O)O)(C2)C3)c2ccccc2)nc2ccccc21 1875276959 RHDBSXBAJCMDJT-PPNDLDFTSA-N 390.443 2.969 0 50 GFAA C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Cn2cc(-c3cncc(C(=O)O)c3)nn2)C1 1875355202 CVSNJJKGJMYVEI-KUHUBIRLSA-N 391.431 2.648 0 50 GFAA CCc1ccc(C2CCN(c3cc(N4C[C@@H](OC)C[C@H]4CN)ncn3)CC2)cc1 1875394313 DWQWCTLOBTZZHV-SFTDATJTSA-N 395.551 2.975 0 50 GFAA CC(C)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)c1 1875399025 LZPQMGYRUJHUCQ-KBRIMQKVSA-N 397.928 2.778 0 50 GFAA FCCn1nc(-c2cn(CC3CCCCC3)nn2)nc1COC1CCOCC1 1875335713 DIGPVUZAXFTVGH-UHFFFAOYSA-N 392.479 2.782 0 50 GFAA CCc1c(C(=O)N=[S@]2(=O)CCC[C@]3(CCCN3)C2)cnn1-c1ccccc1 1875393341 KTDMZVAADZWJFF-HRFSGMKKSA-N 386.521 2.959 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1cnccc1Oc1ccccc1 1875403276 RVEOJGNTTLDTCR-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCCc2noc(C)n2)CC[C@H]1NC1CCCC1 2100534880 YHJMHLYECUTYSP-CGTJXYLNSA-N 378.517 2.533 0 50 GFAA Cc1ccc(O[C@@H](C)C(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c(C)c1 2325772363 GUVRZMKLGLOKID-CABCVRRESA-N 376.478 2.596 0 50 GFAA COC[C@H](NS(=O)(=O)C[C@H]1CCC2(CCC2)O1)c1ccc2[nH]ccc2c1 2325783953 NUTMBXJYJDJRAR-AEFFLSMTSA-N 378.494 2.877 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)c3ccccc3S(=O)(=O)N(C)C)cc2)c1C 2325824537 FWNPVJOSEAWYNW-UHFFFAOYSA-N 398.488 2.992 0 50 GFAA Cc1ncc(Cc2noc([C@@H]3CCCN(S(=O)(=O)c4ccccc4)C3)n2)o1 2325850011 JDZHZCGXOCNMFW-CQSZACIVSA-N 388.449 2.525 0 50 GFAA CCOC(=O)N1CCC(NC(=O)c2ccc(-c3cncc4nc[nH]c34)cc2)CC1 2356138735 GMVGNVSCQLYKON-UHFFFAOYSA-N 393.447 2.976 0 50 GFAA COc1ccc(CCCC(=O)N2CCC[C@@]3(CCc4c[nH]c(=N)nc43)C2)cc1 2356146595 MPNHAEIDTLMFID-JOCHJYFZSA-N 380.492 2.727 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN[C@@H]1CCOC1 20136766 HNJWANYCJATMBX-MRXNPFEDSA-N 384.505 2.589 0 50 GFAA CCc1ccc(-c2cn3c(C(=O)N[C@@H]4C=CS(=O)(=O)C4)csc3n2)cc1 67965578 TZQFHTOVZLMYTJ-CQSZACIVSA-N 387.486 2.666 0 50 GFAA O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)Nc1nc2ccccc2s1 170625602 MMGDQJOPSKCFRS-ZDUSSCGKSA-N 384.417 2.729 0 50 GFAA Cc1cnccc1N1CCCN(Cc2ccc(Sc3nncn3C)o2)CC1 65461089 MNIKNBMRFVOYIR-UHFFFAOYSA-N 384.509 2.975 0 50 GFAA Cc1ccc2oc(C(=O)NC[C@H](c3ccccc3)N3CCOCC3)cc(=O)c2c1 28292266 GWFQGFQQRHJPKH-LJQANCHMSA-N 392.455 2.905 0 50 GFAA O=C(NCc1nnc2n1CCN(Cc1cccc(F)c1)CC2)c1cccc(F)c1 20779721 GFNAXDQSRBVZOP-UHFFFAOYSA-N 397.429 2.545 0 50 GFAA Cc1ccc(-n2cccn2)cc1NC(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 252493935 NGSLZSJQDXUUMH-INIZCTEOSA-N 379.468 2.705 0 50 GFAA O=C(NCCNC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccccc1Cl 171607814 JEANCOUWOXLJAH-INIZCTEOSA-N 392.931 2.730 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(c3ccc(C(C)=O)cc3)CC2)cc1 6830916 IPVYQBKHXYTUSO-UHFFFAOYSA-N 388.489 2.799 0 50 GFAA CCN1CCC[C@@H](CN(C)C(=O)Cc2csc(C)n2)[C@@H]1c1cnn(C)c1 328630065 PLVFZOQAOOZTIQ-HNAYVOBHSA-N 375.542 2.659 0 50 GFAA CCn1ccnc1CN(C(=O)[C@H]1COc2ccccc21)[C@@H]1CC12CCNCC2 328642117 QVTRJOJZGQITIH-PKOBYXMFSA-N 380.492 2.550 0 50 GFAA COc1ccccc1[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1 363415821 KDVJXPCSGJZOIL-KRWDZBQOSA-N 377.448 2.975 0 50 GFAA CC(C)[C@@](C)(O)CNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363421879 FCVYAKQJKZJYKS-AVRDEDQJSA-N 384.476 2.673 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](CNC(=O)c3ccc(NC=O)cc3)C2)c1 363958534 HKZFNXUBSYQXHF-OAHLLOKOSA-N 383.448 2.528 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@@H](C)N2CC[C@H](c3nc(C4CC4)no3)C2)c1 375466286 SURHEKQGXXTDHH-DOMZBBRYSA-N 383.452 2.722 0 50 GFAA CCN(C(=O)Nc1ccccc1-n1nc(C)cc1C)[C@@H]1CCS(=O)(=O)C1 181155103 AGRSSRDUEJQRBO-OAHLLOKOSA-N 376.482 2.530 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)c1cc[nH]n1 77485585 MYZVUKYLWWVUAN-LPHOPBHVSA-N 388.427 2.715 0 50 GFAA O=C(c1ccccc1)[C@@H]1CCCN(C(=O)c2cc(=O)n(-c3ccccc3)[nH]2)C1 77520531 RQBYOQPNAQBMRR-QGZVFWFLSA-N 375.428 2.901 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCC[C@@H](Cc2nnc3ccccn23)C1 373355400 VBRWXLHWLFAQFY-HNNXBMFYSA-N 391.475 2.804 0 50 GFAA C[C@H](C(=O)O)[C@@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1 237543731 OIKRWSKRYDJDAW-SWLSCSKDSA-N 388.855 2.922 0 50 GFAA Cc1nn(Cc2ccccc2)c(Cl)c1CNCCCN1CCC(O)CC1 237655049 UKGQBGPSNMZYNB-UHFFFAOYSA-N 376.932 2.830 0 50 GFAA C[C@H](C(=O)Nc1cccc(F)c1)N1CCn2c(Cc3ccccc3)nnc2C1 377854956 IFUCOZXLIKPZCU-OAHLLOKOSA-N 379.439 2.851 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1cscn1)c1cccc(-c2ncc[nH]2)c1 219192744 FVAFBTQKFRGBIO-IAGOWNOFSA-N 384.461 2.637 0 50 GFAA CC(=O)N(c1nc(CN2CCC(CN3CCCCC3=O)CC2)cs1)C1CC1 173439480 NSJNUHMJNOPGIV-UHFFFAOYSA-N 390.553 2.883 0 50 GFAA CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N1CCC[C@@H](C2CC2)C1 288944464 WZSNADSFDQGLQO-OAHLLOKOSA-N 394.541 2.657 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)o2)c1 426597310 XPYWQDUAQALCSE-CQSZACIVSA-N 377.462 2.852 0 50 GFAA CC(C)NC(=O)N1CCC(n2cc(CN3CC[C@H]3c3ccccc3)nn2)CC1 82039439 MFOUMSCOGXYDND-FQEVSTJZSA-N 382.512 2.980 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@H]2CN(C2=NC=N[C@H]3c4cc(Cl)ccc4N[C@@H]23)C1 148638228 TYFADLFYBVKNDX-USEHDAJUSA-N 393.878 2.897 0 50 GFAA CC(C)N(CCO)Cc1ccccc1OC[C@H](O)CN1CCc2ccccc2C1 95515167 YWOVDFZDLYUGBU-HSZRJFAPSA-N 398.547 2.687 0 50 GFAA O=C(NCCSc1nc2ccccc2o1)c1coc(CN2CCOCC2)c1 97766339 OLSBJQAJRSXDCA-UHFFFAOYSA-N 387.461 2.775 0 50 GFAA COc1cccc(CN2CC3(CCN(Cc4nnc(C5CC5)o4)CC3)CC2=O)c1 95506316 YEBPTTLCMAATDO-UHFFFAOYSA-N 396.491 2.970 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)cn1 237996541 IEBNHVAOHLWUES-OAHLLOKOSA-N 391.221 2.756 0 50 GFAA COc1cccc2[nH]cc(CC(=O)NCC3(N4CCCCC4)CCOCC3)c12 181783195 ARFFPNGWHMBBQZ-UHFFFAOYSA-N 385.508 2.870 0 50 GFAA COCCN1C[C@H](c2nc(-c3ccccc3)nn2-c2ccccc2OC)CC1=O 63845645 ZUDGDDAZYSFOPD-QGZVFWFLSA-N 392.459 2.905 0 50 GFAA Cc1sc2nc(CCNC(=O)C[C@@H]3NC(=O)c4ccccc43)nc(O)c2c1C 827811406 KGFPMDJPEOIHMV-AWEZNQCLSA-N 396.472 2.547 0 50 GFAA CN(C(=O)NCCSCc1cccc(Cl)c1)C1CCS(=O)(=O)CC1 584888619 FORUPWQGBJJERM-UHFFFAOYSA-N 390.958 2.792 0 50 GFAA N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCCN(Cc2cccs2)CC1 1506399902 KMHLZLMLKRNQAV-LJQANCHMSA-N 382.533 2.834 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCC(N2CCc3ccccc3C2)CC1 1506420940 DXDXDQRGYNNGLK-UHFFFAOYSA-N 387.487 2.930 0 50 GFAA OC1CCN(c2cc(N3CCC(c4nc5ccc(F)cc5[nH]4)CC3)ncn2)CC1 1529098867 NGGKUAKPYPLZMB-UHFFFAOYSA-N 396.470 2.837 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2c(F)c(F)c(OC)c(F)c2F)C[C@@H]1O 1704309978 USFIXWQBWMAZMH-BTDLBPIBSA-N 379.350 2.689 0 50 GFAA COc1ccc(OCC2CCN(c3nccc(N4CCC[C@H](O)C4)n3)CC2)cc1 1704358601 PDUDXKIVJDIVLB-SFHVURJKSA-N 398.507 2.742 0 50 GFAA COc1ccc(-c2noc([C@H](C)Nc3cncc(C(=O)N4CCCC4)n3)n2)cc1 1704278299 RNEFUUUKZAWNHX-ZDUSSCGKSA-N 394.435 2.944 0 50 GFAA CCn1cc(C(=O)N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)cn1 1704330014 SUNCIUWTMWWHEG-UHFFFAOYSA-N 385.464 2.624 0 50 GFAA O=C(c1ccc(F)cc1)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697933 AALCMLQDRPWZPW-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA COc1ccc(-c2noc(CN(C)C[C@@H]3CCCCO3)n2)c(OC)c1OC 12057967 BKUAYMMTEASFBE-ZDUSSCGKSA-N 377.441 2.763 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)c1cn(Cc2ccccc2F)nn1 12572984 TWHYMCDTXKDZMH-LJQANCHMSA-N 393.466 2.860 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccccc1OC 13125218 PCUARVUBRMJYMD-GOSISDBHSA-N 392.419 2.618 0 50 GFAA COc1ccc(/C=C/C(=O)N[C@H]2CCCN(Cc3ccccn3)C2)cc1OC 15066198 BRLKAFZGBPNKQW-JARZOMNASA-N 381.476 2.893 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1ccccc1-c1nn[nH]n1)CC2 1857671990 BFQZYKUAHMNQTF-UHFFFAOYSA-N 399.458 2.508 0 50 GFAA COc1ccc2cc(-c3nccn3CCN3CCCC[C@H]3CO)c(O)nc2c1 1857692296 XYVHXPHLPCJIGE-INIZCTEOSA-N 382.464 2.659 0 50 GFAA COc1ccccc1-n1nc(-c2c[nH]nc2C)nc1[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857715261 JHPZJPXYLDKRMB-YXJHDRRASA-N 394.479 2.599 0 50 GFAA O=C(N[C@@H]1C[C@H]2OCC[C@@H]12)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857718962 AHOYXGOFZDDBIP-NUEKZKHPSA-N 375.856 2.991 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CC[C@@]45OCCCN4C(=O)C[C@@H]35)coc2c1C 1857729346 DRCZEHVZGMJZBW-VGSWGCGISA-N 382.460 2.850 0 50 GFAA CC1(C)CN(Cc2cnn([C@@]3(C)CCS(=O)(=O)C3)c2)CC[C@H]1C(F)(F)F 408349897 VUTWXYKQKCVGMH-ZBFHGGJFSA-N 393.475 2.827 0 50 GFAA CCN(CC)CCN(C)[C@H]1CCc2c(c(C(=O)N3CCCCC3)nn2CC)C1 23251412 OYBLXSWGCYDIMP-SFHVURJKSA-N 389.588 2.660 0 50 GFAA COc1cc(CCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)cc(OC)c1 262200152 VWFSBEFQKHWRGZ-FQEVSTJZSA-N 396.443 2.930 0 50 GFAA O=C(N[C@H]1CCc2c[nH]nc2C1)N1CC[C@@](O)(c2cccc(C(F)(F)F)c2)C1 1875288815 FEEUPQAIISAMFR-YJBOKZPZSA-N 394.397 2.589 0 50 GFAA CCN1CCN(C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)[C@H](C)C1=O 1875263490 LIDHVRHXQPSNKM-MRXNPFEDSA-N 380.492 2.969 0 50 GFAA CN(Cc1cc(C(=O)O)n[nH]1)C(=O)CSCc1coc(-c2ccccc2)n1 1875349417 WIINHBWXZRHFNS-UHFFFAOYSA-N 386.433 2.655 0 50 GFAA CCn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3cnc(C)nc3C(C)C)CC1)O2 1875394610 PGOTUDVZGBYUBJ-INIZCTEOSA-N 399.495 2.616 0 50 GFAA Cc1ccc(C)c(NC(=O)NC(=O)CN2CC[C@](O)(Cc3ccccc3)C2)c1 1875309127 SKXZJYIRHDGIBW-QFIPXVFZSA-N 381.476 2.631 0 50 GFAA CN(C)C[C@H](NC(=O)N=c1[nH]nc2ccc(C(F)(F)F)cn12)c1ccccc1 2325858313 IGEDSENYRLTDES-AWEZNQCLSA-N 392.385 2.594 0 50 GFAA C[C@H](CONC(=O)c1ccc(-c2csnn2)cc1)NC(=O)OC(C)(C)C 863901956 IVSMCTXNZSEUFW-LLVKDONJSA-N 378.454 2.780 0 50 GFAA COc1cccc(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2ccccc2)c1 880066 IFSKSLOHJMBJET-UHFFFAOYSA-N 397.456 2.924 0 50 GFAA COc1cccc(NC(=O)Cc2nnc(SCC(=O)c3ccccc3)n2C)c1 1074941 YTPADNBBXOIFMD-UHFFFAOYSA-N 396.472 2.980 0 50 GFAA O=C(CN(c1ccccc1F)S(=O)(=O)c1ccccc1)NCc1ccco1 1100086 KNAHHYMPIITOQO-UHFFFAOYSA-N 388.420 2.930 0 50 GFAA Cc1cccc(OCC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356142583 YSIFMOGEKWUTGM-JOCHJYFZSA-N 380.492 2.736 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3nnc4n3CCCCC4)CC1)OCC2 2356157271 IGTFDLSXJGQPAP-UHFFFAOYSA-N 396.491 2.717 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc(Cl)cc2)cc1OC 2869017 CDHHSMDMBJXXSS-UHFFFAOYSA-N 385.825 2.637 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccc(F)c(Cl)c2)cc1 4838317 YRWTUULJAWITQU-SNVBAGLBSA-N 386.832 2.793 0 50 GFAA Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NCCc1csc(=O)[nH]1 225614220 BBOPDQLCEMJKMB-UHFFFAOYSA-N 377.466 2.904 0 50 GFAA CCOC(=O)c1cnn(-c2ccc(NC(=O)N[C@H](C)CN)cc2)c1C(F)(F)F 414875502 UNVBHNQNMWOFFU-SNVBAGLBSA-N 399.373 2.537 0 50 GFAA CN1CCC(N(C)[C@@H]2CCCC[C@H]2N(C)S(=O)(=O)c2cccs2)CC1 246467100 JIQYLUJAPCZVLK-IAGOWNOFSA-N 385.599 2.706 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)c(OC)c1 20777097 UJYZNKCNCSRQJL-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 100594424 WIXMQYGUYSUFSZ-FQEVSTJZSA-N 379.460 2.539 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](NCc1ccc(-c3noc(C)n3)cc1)C2 67879954 YKUHQHYTAISICS-OAHLLOKOSA-N 381.436 2.607 0 50 GFAA Cc1ccc(Nc2cc(N3CCN(C(=O)[C@H]4CCCO4)CC3)nc(C)n2)cc1 67622486 WAVGOWTWKXOQDX-GOSISDBHSA-N 381.480 2.665 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCCN(Cc2ccc(F)cc2)CC1 77355720 SBNCJXFDJKVSMQ-UHFFFAOYSA-N 375.488 2.653 0 50 GFAA Cc1nnc(CNC(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)o1 71767986 UWRGUSGKGLEXIY-JOCHJYFZSA-N 390.443 2.541 0 50 GFAA CCNC(=O)[C@@H]1CCN(C(=O)c2csc3nc(-c4cccc(OC)c4)cn23)C1 67804604 YNBOVNVQYFQUOV-CQSZACIVSA-N 398.488 2.670 0 50 GFAA CN(Cc1nccn1C)C(=O)c1coc(COc2cccc3cccnc23)n1 67560100 NAPVIXOMJLTHCF-UHFFFAOYSA-N 377.404 2.808 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)O)sc2c1 2503180 SUINWZINFPLMBA-QWRGUYRKSA-N 382.463 2.529 0 50 GFAA C[C@H]1CN(c2c(F)c(F)c3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)C[C@@H](C)N1 3882891 QIPQASLPWJVQMH-DTORHVGOSA-N 395.381 2.639 0 50 GFAA biogenic,world Cc1ccc(N[C@H]2CCCN(C(=O)c3ccnc(-n4cnnc4)c3)C2)cc1C 72157546 PCVBKWJBCASEEZ-IBGZPJMESA-N 376.464 2.996 0 50 GFAA CN1CCCC[C@H]1CN1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1 424664390 OZPLPHSWMKTDIL-SFHVURJKSA-N 395.494 2.849 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1)N1CCC(F)CC1 71777208 UWTWNVHYWJUGAY-LJQANCHMSA-N 388.531 2.719 0 50 GFAA O=S(=O)(N1CCCCCC1)N1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 155264304 BFEBWZWIPOBUFE-HZPDHXFCSA-N 392.443 2.934 0 50 GFAA Cn1cc2c(n1)CCC[C@H]2C(=O)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 329817104 FFKVFWPUVUCSMC-HZPDHXFCSA-N 382.512 2.564 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cc2n1 216483071 WIBMGMBMTMJAAG-LLVKDONJSA-N 378.358 2.799 0 50 GFAA Cc1nn(-c2cccc(C(=O)N3CCC[C@@H](N)CC3)c2)c(=O)c2ccccc12 72168031 PVQRQNJSYOCMAL-QGZVFWFLSA-N 376.460 2.648 0 50 GFAA CN(Cc1nc(-c2cccs2)no1)C(=O)c1ccc(N2CCOCC2)cc1 72436858 JUZFHWWFZLIMOX-UHFFFAOYSA-N 384.461 2.907 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N2CCN(c3ncnc4sccc34)CC2)cc1 127566540 PIEUCDKRVTWWTH-AWEZNQCLSA-N 397.504 2.849 0 50 GFAA CC(C)CNC(=O)CN1CCC[C@]2(CCC(=O)N(CCc3ccccc3)C2)C1 77378346 JPZUHNFHGBHRNX-QHCPKHFHSA-N 385.552 2.706 0 50 GFAA COCCN1C(=O)c2ccccc2[C@H](C(=O)N2CCSCC2)C12CCCC2 49550743 CMBAJZIUZVIBCT-GOSISDBHSA-N 388.533 2.761 0 50 GFAA Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@@H]1CCc2nnnn2CC1 333679685 FAINMTKTTYDOPH-CHWSQXEVSA-N 377.518 2.669 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCCC3=CCCCC3)n2)cc1OC 44890195 WTWNLUABCUIRIR-UHFFFAOYSA-N 397.475 2.934 0 50 GFAA O=C(NCc1nccn1CCc1ccccc1)N[C@@H]1c2ccccc2C[C@@H]1O 175922658 IFDVYNGPPJVYFI-PZJWPPBQSA-N 376.460 2.583 0 50 GFAA COc1cc(F)c(CN2C(=O)C3(CCNCC3)Nc3ccccc32)cc1OC 82107092 SZVCVBVLFLFJJL-UHFFFAOYSA-N 385.439 2.924 0 50 GFAA CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1CC[C@H](C(=O)O)C1 263302314 XAFRYDVKFGPXQO-JKOKRWQUSA-N 385.258 2.641 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2C(=O)Cc2cccnc2)s1)N1CCOCC1 82039314 FODNJIJADSPFTO-INIZCTEOSA-N 385.489 2.522 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3cn(C(F)F)nc3C)C[C@H]2C)cc1 229907934 RLESKMPORYJLOO-CYBMUJFWSA-N 384.452 2.794 0 50 GFAA Cc1nc(Cn2cc(C(=O)N[C@@H]3CCCc4sc(Cl)cc43)nn2)no1 292110104 NIMSRZCIKUHJKA-SNVBAGLBSA-N 378.845 2.540 0 50 GFAA CCc1c(C)nn(CCNC(=O)Nc2cc(S(C)(=O)=O)ccc2C)c1C 97759205 DUKXBCAFHJPYIH-UHFFFAOYSA-N 378.498 2.596 0 50 GFAA CNC(=O)c1cc2c(s1)CCN(C(=O)c1cc(-c3cccc(OC)c3)n[nH]1)C2 91746172 DLWBNVPXCFMSIN-UHFFFAOYSA-N 396.472 2.705 0 50 GFAA Cc1cccc(=O)n1CCC(=O)N1CCC(c2nccn2CC2CCC2)CC1 91664723 BIGQVZCDPLTUPX-UHFFFAOYSA-N 382.508 2.950 0 50 GFAA CNC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3cccnc3)C2)c(C)c1 97679703 MSYCSPLFIBVCLP-GOSISDBHSA-N 381.480 2.536 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCc1nc(-c3ccccc3)no1)C2 91860591 GTAMCWNREFCXSB-MRXNPFEDSA-N 379.416 2.655 0 50 GFAA COc1ccc(O[C@@H]2C(=O)N(C[C@H]3CCCO3)[C@H]2c2ccc3c(c2)OCO3)cc1 248146298 XDGXKYVFNMZNRW-QMMLZNLJSA-N 397.427 2.934 0 50 GFAA Cc1ccc(CNC(=O)N2CC[C@@H](Oc3ccc(Cl)cc3)C2)c(=O)n1C 296725616 FGZOGFHXRBCKGH-QGZVFWFLSA-N 375.856 2.710 0 50 GFAA O=C(Cn1c(=O)[nH]c2ccccc21)N1CCO[C@H](c2ccc(F)cc2Cl)C1 184249861 JKBSYQXGYUDKSX-KRWDZBQOSA-N 389.814 2.722 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCC[C@]2(CN(C)C(=O)O2)C1 952973075 REWZTKPZCQKLLK-SFHVURJKSA-N 379.844 2.745 0 50 GFAA COc1ccccc1-c1ncc(CN2CCN(c3ncnc(C)c3C)CC2)cn1 952977480 KABZAXPARORSET-UHFFFAOYSA-N 390.491 2.881 0 50 GFAA CCNc1nc(C)c(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)s1 952987700 KQLVTHVXGUCADF-UHFFFAOYSA-N 383.477 2.537 0 50 GFAA Cc1cc(C(=O)NCC2CCN(c3ncccn3)CC2)c2cnn(C(C)C)c2n1 170607789 LYXKBNJDNWRSCQ-UHFFFAOYSA-N 393.495 2.757 0 50 GFAA NC(=O)[C@H]1CC(C(=O)OC[C@H]2CCCc3ccccc32)=NN1c1ccccc1 170621440 XZSRAIHDFOVYBK-OXQOHEQNSA-N 377.444 2.770 0 50 GFAA CCc1nccn1CCC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529098469 GNDSRHROYLTGPZ-YLJYHZDGSA-N 378.476 2.758 0 50 GFAA C[C@@H](C(=O)N1CCCN(c2noc(C3CC3)n2)CC1)n1cnc2ccccc21 1772817205 MCGNTCJPPALPKJ-AWEZNQCLSA-N 380.452 2.597 0 50 GFAA OC[C@]12CNC[C@@H]1CN(Cc1nc3ccccc3n1Cc1ccccc1Cl)C2 1772700428 ARSKLWAWYBXBMK-VGOFRKELSA-N 396.922 2.752 0 50 GFAA CCCCOC(=O)c1ccc(NC(=O)C(=O)NCCN(CCC)CCC)cc1 5590943 YYULTWGKZWIUEK-UHFFFAOYSA-N 391.512 2.820 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@@H](NC(=O)CN2CCCC2=O)C1 12572497 VAHVVFSOVJHJBE-KRWDZBQOSA-N 384.455 2.764 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12712630 QDBKCDZUOFJTGA-SFHVURJKSA-N 386.464 2.518 0 50 GFAA CC[C@H](C)N1CCC2(CC1)C(=O)N(Cc1ccccn1)C(=O)N2CCCOC 14536364 JUSJPSLSIYQKKE-KRWDZBQOSA-N 388.512 2.515 0 50 GFAA CC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccccn1)C2 14752441 IGTWRYIMKZKRBM-UHFFFAOYSA-N 395.507 2.805 0 50 GFAA CCC(C)(C)NC(=O)c1ccc([C@H]2CCCN2C(=O)CN2CCOC2=O)s1 19635428 VQBKOCHLHVPZSN-CYBMUJFWSA-N 393.509 2.782 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(C[C@@H]3CCOC3)CC1)OCC2)N1CCCC1 1857690195 FITIEIBKDDSHRB-INIZCTEOSA-N 390.549 2.884 0 50 GFAA Oc1nc(-c2cccnc2)nc2c1CC[C@@]21CCCN(c2ncnc3[nH]ccc23)C1 1857697731 KHEOZOYLVMQGEJ-JOCHJYFZSA-N 399.458 3.000 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3ccc4sc(=N)[nH]c4c3)C[C@H]21 1857739230 FOYLPCGOHHOQOZ-HVOFVXBASA-N 385.489 2.782 0 50 GFAA CCCc1nnc(N2C[C@@H](C(=O)NCc3ccc(SC)cc3)CC2=O)s1 1857741589 ZQLSOTOAYCTYKC-ZDUSSCGKSA-N 390.534 2.882 0 50 GFAA CC(C)(C)c1nc(N2CC(O)C2)c2c(n1)[C@@]1(CCCN(C(=O)C3CCC3)C1)CC2 1875240105 IJKLHTBCIYVUGF-QHCPKHFHSA-N 398.551 2.562 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CC[C@]3(CC(=O)c4ccccc4O3)C2)c(O)n1 334028118 IYBSHMNJFWRTAV-NRFANRHFSA-N 381.432 2.724 0 50 GFAA CC(C)NC(=O)c1ccc(Sc2nnnn2-c2ccc(C(C)C)cc2)nn1 1875261571 SQIHOMGUMKDRFQ-UHFFFAOYSA-N 383.481 2.865 0 50 GFAA N[C@@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)[C@@H]2COC[C@@H]12 1875292859 VEGLWVOYGPDNQH-RRFJBIMHSA-N 397.422 2.556 0 50 GFAA C[C@@H]1CCCCN1c1cc(C(=O)N2CC[C@H](NC(=O)CC(F)(F)F)C2)ccn1 1875259079 DBJCEXWVEKKJCT-HIFRSBDPSA-N 398.429 2.744 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)N1CC[C@H]2[C@H](O)C[C@H]21 1875329261 NFTCCGSJNSOQQW-RBSFLKMASA-N 384.436 2.730 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2C[C@H]3CC[C@@H](C2)[C@@H](C(=O)O)C3)cc1F 1875305380 BXHQEQMWSAHVJL-QEJZJMRPSA-N 377.412 2.757 0 50 GFAA O=C(NC1(CN2CCN(c3ccc(F)cc3)CC2)CC1)c1cc(C2CC2)no1 888100730 LRDYPNZACDKNGK-UHFFFAOYSA-N 384.455 2.776 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)c2ccc3nc[nH]c3c2)CCCCN1 2100533624 BGMPKTXVDXUHHW-GOSISDBHSA-N 397.523 2.550 0 50 GFAA O=S(=O)(Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccc2nn[nH]c2c1 2325718947 ZREMFXGLSFNGIN-UHFFFAOYSA-N 392.347 2.746 0 50 GFAA COc1cccc(N2C(=O)C[C@H](SCC(=O)Nc3ccc(F)cc3)C2=O)c1 971002 JLCGOHYNMBMVSG-INIZCTEOSA-N 388.420 2.838 0 50 GFAA O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NC1CCCCC1 2499717 BJCTVUADMPXWLI-UHFFFAOYSA-N 389.315 2.566 0 50 GFAA O=C(COc1cccc(Br)c1)N1CCN(c2ccccn2)CC1 7309015 TTZWIHWUXVBLAI-UHFFFAOYSA-N 376.254 2.572 0 50 GFAA COc1ccccc1CN(C)C(=O)CN(C[C@H]1CCCO1)[C@H]1CCSC1 245882541 NJCXSYULYIWQIH-ZWKOTPCHSA-N 378.538 2.640 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@H]1NCCOc1cc(Cl)cc(Cl)c1 225671624 NISVOVOKWOGNAV-CABCVRRESA-N 381.325 2.822 0 50 GFAA CC(=O)N[C@@H](CC(=O)N(CCC(N)=O)c1ccc(F)cc1)c1ccc(C)cc1 115441080 PGZAMLZUUBSODQ-IBGZPJMESA-N 385.439 2.610 0 50 GFAA Cc1ccc(C2(O)CCN(Cc3ccc(Sc4nncn4C)o3)CC2)nc1 67982476 FHGFNURHVCQMRH-UHFFFAOYSA-N 385.493 2.746 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)c4c[nH]nc4C)C3)C2)c1 11664751 DATZDRHNMRVWJN-OAQYLSRUSA-N 386.471 2.994 0 50 GFAA CN(C)[C@@H](Cc1ccccc1)C(=O)N1CCC(C(=O)N2CCCCCC2)CC1 171605994 AHIVBKXTWQWSDH-NRFANRHFSA-N 385.552 2.801 0 50 GFAA CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cncs3)CC2)cc1 330494957 PTSAYBXLAYZXSU-AWEZNQCLSA-N 393.534 2.803 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(CCc3c(F)cccc3Cl)C2=O)nn1 328615236 YCOJEAUFYLPVIV-HNNXBMFYSA-N 379.823 2.562 0 50 GFAA CC(C)Oc1ccc2c(NC(=O)Cn3cncn3)nn(CC(F)(F)F)c2c1 77421637 PDPMYSDNLOQZFR-UHFFFAOYSA-N 382.346 2.616 0 50 GFAA O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)[C@H]1CC12CCS(=O)(=O)CC2 328881008 LZOPBQKTQLLIJQ-GOSISDBHSA-N 399.516 2.978 0 50 GFAA O=C(c1ccccc1)N1CCC(C(=O)N2CCC[C@H](N3CCCCC3=O)C2)CC1 363266681 UTULLPXBPURNNA-FQEVSTJZSA-N 397.519 2.542 0 50 GFAA CC1([C@@H]2CCCN(C(=O)[C@H]3CCCCN3C(=O)c3ccccc3)C2)OCCO1 363722533 KZLTWIVRIXVLCE-RTBURBONSA-N 386.492 2.683 0 50 GFAA O=C(NCC[S@](=O)Cc1ccccc1)NC[C@@H](O)c1ccccc1Cl 127148405 OSBDLIQTKBCSCC-CRICUBBOSA-N 380.897 2.622 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CCO[C@H](CC(=O)O)C3)ccc21 236701322 FDFFAQSNJOEDGD-GFCCVEGCSA-N 399.369 2.952 0 50 GFAA Cn1c(CN2CCC(O)CC2)nnc1[C@H]1CCCN(CC2CCCCC2)C1 426374409 QSROMEHQZYYCSI-SFHVURJKSA-N 375.561 2.532 0 50 GFAA Cc1ocnc1C(=O)N1CCC(Oc2ccccc2C(=O)N2CCCC2)CC1 95529791 HBQAKZHJCXMWCI-UHFFFAOYSA-N 383.448 2.903 0 50 GFAA C[C@H](O)C(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 95528439 ZCBGTOWEZSSREC-ZDUSSCGKSA-N 386.414 2.721 0 50 GFAA CCOc1ccc(CN2CCC3(CCC(=O)N(CCO)C3)CC2)cc1Cl 91256002 LQBOWJVGOLXHDP-UHFFFAOYSA-N 380.916 2.936 0 50 GFAA C[C@H](Cc1cccnc1)NC1CCN(c2cccc(N3CCNC3=O)c2)CC1 142803517 COXLFNDTECQCNW-QGZVFWFLSA-N 379.508 2.801 0 50 GFAA Cc1cc(F)ccc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95504211 XIXKUVAOKUNYAX-UHFFFAOYSA-N 396.466 2.783 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)Nc3cccnc3N3CCCC3)CC2)n1 184128916 SADCCWQEKISFGF-UHFFFAOYSA-N 395.511 2.949 0 50 GFAA CCc1c(C(=O)N2CCN(Cc3cc(C)on3)CC2)cnn1-c1ccccc1C 183995552 WBICREMPCFOITN-UHFFFAOYSA-N 393.491 2.998 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)C2(C(=O)N3CCC[C@@H]([C@@H](C)N)C3)CCCC2)c1 299738471 BFRVHFVTDLQKSN-QZTJIDSGSA-N 392.565 2.976 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](c2nnc3ccccn23)C1 363449619 LQJYIONGTOZTGS-KRWDZBQOSA-N 391.475 2.586 0 50 GFAA CCOCc1nc(CC(=O)NC)nn1-c1cc(C)c2ccc(SC)cc2n1 1940196165 PFBQYCJHLIFZCX-UHFFFAOYSA-N 385.493 2.671 0 50 GFAA CC(C)c1nc(C(=O)N2CCC[C@@H](CCC(=O)N3CCN(C)CC3)C2)cs1 42992854 ROAJZYQLUBMIKL-INIZCTEOSA-N 392.569 2.673 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1)NC1CCCCC1 55357740 RDPLCSBXMSHCRI-KRWDZBQOSA-N 381.879 2.619 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)NCc1coc(-c2ccccc2)n1 827831142 YECCMZUARIXJPQ-SFHVURJKSA-N 375.428 2.974 0 50 GFAA CCn1nc(C)c([C@@H](C)NS(=O)(=O)c2cc(Cl)sc2C(=O)O)c1C 670441490 ZWYKGVULVODLMP-MRVPVSSYSA-N 391.902 2.972 0 50 GFAA CC(C)C(=O)Nc1cccc(C(=O)N2CCN(Cc3cccc(O)c3)CC2)c1 952983605 PXZCMRRHHGTIKE-UHFFFAOYSA-N 381.476 2.945 0 50 GFAA COc1cc(NC(=O)Cc2nc(-c3ccccc3)oc2C)cc(-n2cnnn2)c1 952969977 TVQMZHGNIZQOTM-UHFFFAOYSA-N 390.403 2.816 0 50 GFAA O=C(Nc1cccc(Oc2ccccc2)c1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 167432579 XYTCRFXVZXFYPE-MRXNPFEDSA-N 376.416 2.814 0 50 GFAA CC(=O)N1CCN(c2cc(C(F)(F)F)nc3ncnn23)CC12CCCCC2 270774361 HVXGUQKQTNGOLZ-UHFFFAOYSA-N 382.390 2.515 0 50 GFAA O=C(N[C@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1)N1CCOCC1 409580014 IZJCQOFBNPHGPC-INIZCTEOSA-N 381.432 2.626 0 50 GFAA O=C1C[C@H](Cc2ccc(C(=O)Nc3csc(-c4ccncc4)n3)cc2)C(=O)N1 170596476 SIDUDTZKDQQWFF-HNNXBMFYSA-N 392.440 2.663 0 50 GFAA COCCC1(CNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)CCCCC1 170599331 SWXOEBVTIICEHT-CALCHBBNSA-N 378.513 2.655 0 50 GFAA Cc1oc(-c2cc[nH]n2)cc1S(=O)(=O)N1CCC[C@H](C(=O)CC(C)C)C1 1506414689 SIYNAWDFISDALI-AWEZNQCLSA-N 379.482 2.994 0 50 GFAA O=C1CC[C@@H](NCc2noc(-c3c(F)cccc3F)n2)CCN1CC1CC1 1506420218 YQFPSDPSHZTXHQ-CYBMUJFWSA-N 376.407 2.896 0 50 GFAA CCC1=NO[C@H](CNC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704309157 NDAMAUFYVQLYOO-ZDUSSCGKSA-N 390.415 2.840 0 50 GFAA c1ccc(CC[C@]23CN(Cc4ncc[nH]4)C[C@@H]2CN(C2CCOCC2)C3)cc1 1772804221 JLOOBSNRFYNVIB-NFBKMPQASA-N 380.536 2.955 0 50 GFAA Cc1cc(F)ccc1NC(=O)CC[C@H]1CCCN(C(=O)CN2CCCC2=O)C1 12076409 PMUWFEJSHXMCMX-MRXNPFEDSA-N 389.471 2.714 0 50 GFAA CCOc1ccc(-n2nnc(C(=O)NCCc3ccccc3)c2COC)cc1 12274806 NKEGCEPICOMKEY-UHFFFAOYSA-N 380.448 2.785 0 50 GFAA COc1cccc(CN2CCC[C@@H](NC(=O)Cn3cnc4ccccc43)C2)c1 12308852 NZQTXICOYBXGIJ-GOSISDBHSA-N 378.476 2.826 0 50 GFAA CCOC(=O)c1nn(Cc2ccccn2)c2c1CN(C(=O)c1ccsc1)CC2 14538521 NDTFNSOYSAQSME-UHFFFAOYSA-N 396.472 2.763 0 50 GFAA O=C(NCC1CCOCC1)c1cccc(OC2CCN(C(=O)C3CC3)CC2)c1 14961584 DZSYRSMSJRWLFZ-UHFFFAOYSA-N 386.492 2.623 0 50 GFAA COc1ccccc1Cn1nccc1NC(=O)Cn1nc(C)c(C(C)=O)c1C 19794838 DLGJDNBVNNDUOB-UHFFFAOYSA-N 381.436 2.595 0 50 GFAA O=C(N[C@H]1CO[C@@H]2[C@H](O)CO[C@H]12)c1[nH]c2ccc(Cl)cc2c1-c1ccccc1 1875249545 ABHKIAALOAPTPS-LNKGRISISA-N 398.846 2.745 0 50 GFAA CC(=O)[C@@]1(O)CC[C@@H]2[C@@H]3C[C@H](C)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C 3977975 FAOZLTXFLGPHNG-ICFXWSODSA-N 376.468 2.923 0 50 GFAA biogenic CN(CCCC(=O)O)C(=O)C1(c2cccc(Br)c2)CCOCC1 237253353 RGSSMJOUNHKXSP-UHFFFAOYSA-N 384.270 2.821 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@H](Cc3ccccc3)C(=O)O)cc2)C[C@H](C)O1 237628745 SBLKRDVGJWVIPQ-XGHQBKJUSA-N 396.487 2.722 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1nc(-c2cccs2)no1 237969411 NPRUJWGNLPAVCD-AVGNSLFASA-N 375.450 2.975 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)CCc3ccc(O)cc3)C1)CC2 1704332141 PWRRIFQYDFXGLX-QFIPXVFZSA-N 380.492 2.687 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(C(=O)c3cn(C)c(O)n3)CC2)n1 952894537 RMRGEJHVMASELX-UHFFFAOYSA-N 393.447 2.611 0 50 GFAA Cc1cc(C(C)C)nc(N2CCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)n1 1875394035 RWXDKNSQFIZKMU-LSDHHAIUSA-N 398.511 2.616 0 50 GFAA O=C([C@H]1CCCCO1)N1CCC(n2ncc3c2CN(c2ccccn2)C3)CC1 888103620 QFCMXDCUDMZESX-LJQANCHMSA-N 381.480 2.531 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCN(C4CC4)C[C@@H]3C)c2)o1 2100482332 RHDRMOUQTQIROF-AWEZNQCLSA-N 375.494 2.816 0 50 GFAA O=C([C@H]1Cc2ccccc2CN1)N1CCCN(c2nc3ccccc3o2)CC1 2100534733 WGQGVSJYITUWEU-LJQANCHMSA-N 376.460 2.581 0 50 GFAA Cc1c(C)c2nnc(C(F)(F)F)n2[nH]c1=NCc1ncc(C(F)(F)F)[nH]1 2325775449 LZZHBGOCWWNYOR-UHFFFAOYSA-N 379.268 2.536 0 50 GFAA O=C(C1CC2(CC(OCc3ccccc3)C2)C1)N1CCCC[C@@H]1Cc1nn[nH]n1 2325781121 MVSADSXKDWIPGS-XVFYDKGOSA-N 395.507 2.899 0 50 GFAA CC(C)NC(=O)Nc1ccc(C(=O)N[C@H]2c3cccc(O)c3C[C@@H]2C(=O)O)cc1 2325820992 GNIIMSGFFQRDIB-WMZOPIPTSA-N 397.431 2.650 0 50 GFAA NS(=O)(=O)c1cccc(Cc2noc(-c3cc(F)cc4cnccc34)n2)c1 2325869740 ZGPQVMLBTONQFQ-UHFFFAOYSA-N 384.392 2.662 0 50 GFAA O=C(Oc1cccc(NC2=NS(=O)(=O)c3ccccc32)c1)c1ccncc1 787352 PKBJLGFENZADNW-UHFFFAOYSA-N 379.397 2.862 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCC3(CC2)OCCc2cccc(OC)c23)nc1 2356137259 VEPNUTYVRFZJKQ-UHFFFAOYSA-N 396.443 2.581 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=S)Nc2cc(OC)c(OC)c(OC)c2)C1 6700939 OTKAFMXBTFTYSN-GFCCVEGCSA-N 382.482 2.684 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@H]3CC(C)=C(C)C[C@H]3C(=O)O)CC2)c1 6727040 NMRKHYOCKIUMBD-VQTJNVASSA-N 386.492 2.787 0 50 GFAA Cc1cccc(CN2CCN(C3CCN(Cc4ccco4)CC3)C[C@H]2CCO)n1 104498486 SQTBQJKUNWOLDG-JOCHJYFZSA-N 398.551 2.516 0 50 GFAA Cc1cccc(-n2c(C)nc3cc(C(=O)NCCN4CCOCC4)ccc32)c1 20664951 VVVFIFLITSJZNS-UHFFFAOYSA-N 378.476 2.704 0 50 GFAA C[C@H](C1CCN(Cc2cc3c(cc2Cl)OCO3)CC1)N1CCN(C)CC1 65387791 PYWWAYAXEGRYJV-OAHLLOKOSA-N 379.932 2.917 0 50 GFAA CC[C@@H]1C=CCN1C(=O)c1coc(CN2CCN(Cc3ccccc3)CC2)n1 67457800 SDEDBSUVRPXYTA-LJQANCHMSA-N 380.492 2.783 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(C)c(C)c3)CC2)C1 67434234 SLGGNQHMQAUNDY-NRFANRHFSA-N 387.568 2.742 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)cc1F 328618941 FGKALWBQKSCGCW-NSHDSACASA-N 391.390 2.890 0 50 GFAA CC(C)c1noc([C@]2(O)CCN(S(=O)(=O)/C=C/c3ccccc3Cl)C2)n1 328610293 HGBJNUQERBELTC-JEJOPICUSA-N 397.884 2.740 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4cccc(C)c4C)CC3)nn2)n1 72441385 JBXAXLCHHFZMQT-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)cc1 363347791 BCQOJPOSLOEJFS-QGZVFWFLSA-N 386.517 2.827 0 50 GFAA Cc1nccn1CCN(C)C(=O)C1(Oc2ccc(Cl)cc2)CCNCC1 77554905 VVAXNFQJIDVZIT-UHFFFAOYSA-N 376.888 2.505 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)CCCn3cnnn3)C2)cc1 77376766 CTACDFVBKHWHMS-QGZVFWFLSA-N 379.468 2.558 0 50 GFAA COc1cc([C@H]2CC(=O)Oc3c2c(=O)oc2ccccc32)ccc1OCC(=O)O 217912523 VHNSWJFYSRONMX-CYBMUJFWSA-N 396.351 2.706 0 50 GFAA biogenic O=C(NCc1ccc(-n2ccnc2)c(F)c1)Nc1cnn(C[C@@H]2CCCO2)c1 127645781 LODYMUNHNCQRRK-INIZCTEOSA-N 384.415 2.709 0 50 GFAA CCCc1c(C(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)cnn1C1CCCC1 333977341 YYRRKHPHOPYEFK-HXUWFJFHSA-N 393.553 2.992 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(C(=O)C3CCCC3)CC2)C1 71721457 QCUIBYSADYPGCU-HXUWFJFHSA-N 398.551 2.591 0 50 GFAA COc1c(O)nc(O)nc1C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 416243278 OMNWTVUJTAUZPS-LLVKDONJSA-N 397.353 2.935 0 50 GFAA CCc1nn2c(ncc3c(=O)n(NC(N)=O)ccc32)c1-c1ccc(Cl)cc1 40397529 CNPMTLUSIFYWRO-UHFFFAOYSA-N 382.811 2.549 0 50 GFAA CCOc1ccc(CN2CCC3(CC2)Nc2ccccc2NC3=O)cc1CO 82093716 ZVUWNJPCJGBWGH-UHFFFAOYSA-N 381.476 2.976 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N2CC[C@]3(OC)CC[C@@H](O)C[C@H]23)cc1C 426530749 GBFAHNGBYACPRK-PIPMEXSNSA-N 389.492 2.888 0 50 GFAA CC(C)n1ncc(NC(=O)Cn2ccc(-c3cccc(N4CCCC4)c3)n2)n1 48187977 VTAYXODIUYCPAS-UHFFFAOYSA-N 379.468 2.961 0 50 GFAA COc1cc(OC)c(C(=O)N2CCC[C@](O)(C(F)(F)F)CC2)cc1OC 287869157 NHQIFINAXYHLAI-MRXNPFEDSA-N 377.359 2.632 0 50 GFAA O=C(NCc1csc(Cc2ccccc2)n1)N1CCC(c2nc[nH]n2)CC1 426643076 WZQFEBVQDRRKOG-UHFFFAOYSA-N 382.493 2.941 0 50 GFAA CO[C@@H](C)c1nc(CS(=O)(=O)c2nnc(C)n2Cc2ccccc2)cs1 176945840 LVZUIFWZUZPAKE-LBPRGKRZSA-N 392.506 2.773 0 50 GFAA O=C(N[C@@H]1COCC[C@@H]1OCc1cscn1)c1ccc2ncsc2c1 222410682 FHYPYMYYGSDNJZ-CABCVRRESA-N 375.475 2.857 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c(C)o1 91451985 VXSHEKGNUKYHFS-NRFANRHFSA-N 384.480 2.707 0 50 GFAA CN(C)c1ncc(CN2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)cn1 91780186 YKYUJDMPEGOTFP-UHFFFAOYSA-N 393.535 2.947 0 50 GFAA CCOc1ccc(Br)cc1S(=O)(=O)NCCCN(CC)CC 231416572 TZTJCSJMTLYCFZ-UHFFFAOYSA-N 393.347 2.858 0 50 GFAA Cc1noc(C)c1CCC(=O)NCc1cc2n(n1)CCN(C1CCCCC1)C2 92037232 BGYNXFLFLRVACJ-UHFFFAOYSA-N 385.512 2.885 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@@H](NS(=O)(=O)N2CCCC2)C1 92077070 PVLQRKBYYRSEQV-KRWDZBQOSA-N 392.500 2.955 0 50 GFAA COCc1nnc(NC(=O)[C@H]2N3C(=O)c4ccccc4[C@H]3SC2(C)C)s1 253414578 XWPFPLCLEDAUJE-IUODEOHRSA-N 390.490 2.672 0 50 GFAA COC(=O)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(O)CC(=O)CC[C@]5([C@@H]3CC[C@@]21C)[C@H](OC)O4 253596736 VLMLLACKDSNIAO-WYRYKVNWSA-N 392.492 2.608 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N(C)Cc2cc(C(=O)O)c(C)o2)cc1 299751906 SGKOSTBOJBMJHW-SFHVURJKSA-N 384.432 2.744 0 50 GFAA O=C(CCc1ccc(-c2cccs2)o1)N1CC[C@@H]2OCc3cnnn3[C@H]2C1 299798785 UQIMIRVOAKPTTL-HOTGVXAUSA-N 384.461 2.905 0 50 GFAA Cc1ccc(CN2CCN(C(=O)Cn3ccnc3-c3ccccc3)CC2=O)cc1 825175505 MVEUJCWEJBBYOF-UHFFFAOYSA-N 388.471 2.730 0 50 GFAA CC(C)=CCN1CCC2(CC[C@@H](CNC(=O)N(C)Cc3ncc[nH]3)O2)CC1 584884437 JSFKCAFMTPFRJT-KRWDZBQOSA-N 375.517 2.531 0 50 GFAA Cn1cnnc1CC1CCN(c2ccc3nnc(-c4ccc(F)cc4)n3n2)CC1 1336724652 SRMURZMJNYYHJZ-UHFFFAOYSA-N 392.442 2.518 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)CC[C@H](C)N1CCN(C)CC1 952986028 CUIMLUAVKJJSGC-SFHVURJKSA-N 386.540 2.586 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H]1CN(C(=O)c1cnccn1)C3)CCC2 1565506247 WURKBJXKGFCDIE-JXFKEZNVSA-N 392.503 2.711 0 50 GFAA CC(=O)N1CC[C@H](NS(=O)(=O)c2c(F)cccc2F)c2ccc(F)cc2C1 185935858 ALRXNKWOVBBJDH-KRWDZBQOSA-N 398.406 2.876 0 50 GFAA CN(C)c1noc(C2CCN(C(=O)Cc3ccc(OC(F)F)cc3)CC2)n1 186750988 SPORLDNPMMXBAG-UHFFFAOYSA-N 380.395 2.686 0 50 GFAA COC(=O)c1cncc(S(=O)(=O)Oc2ccc(C(=O)c3ccccc3)cc2)c1 170618026 IDKWUKSNRUMTGE-UHFFFAOYSA-N 397.408 2.867 0 50 GFAA C[C@@H](NC(=O)NC(C)(C)C)[C@@H]1CCCN(c2ncc(Br)cn2)C1 170634098 OKQNLQSJAURHRV-VXGBXAGGSA-N 384.322 2.942 0 50 GFAA Cc1ccc(C)c(-n2cnc3cc(C(=O)N4CCS(=O)(=O)CC4)ccc32)c1 191818762 MMFXQKGVFBAWNW-UHFFFAOYSA-N 383.473 2.513 0 50 GFAA C[C@H](CNC(=O)c1cccc(CN(C)Cc2ccccc2)c1)c1nncn1C 194249581 CHEJGRFIWLXCNH-QGZVFWFLSA-N 377.492 2.981 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)NC[C@@H](c3ccco3)N(C)C)o2)c1C 1506425072 CCSRXCRIALCBPV-ZDUSSCGKSA-N 379.438 2.726 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CN(Cc2ccccn2)C(=O)CCO3)c(C)o1 1704308410 QMFIHLPJSIDQBV-UHFFFAOYSA-N 397.475 2.715 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)cc1C(C)C 1704299133 NXAOQMVARIBXEV-VQIMIIECSA-N 390.505 2.750 0 50 GFAA CCOCCCN1C(=O)CC[C@@H]2CN(Cc3ccc(OC)c(O)c3)CC[C@@H]21 11870396 MJDOLEUMLWFRAD-MSOLQXFVSA-N 376.497 2.640 0 50 GFAA CC(C)N(Cc1nccn1C)c1nc2nonc2nc1NCc1ccccc1 11936645 YNNAPGDERDPJBM-UHFFFAOYSA-N 378.440 2.773 0 50 GFAA CC(=O)N[C@H](CC(C)C)c1nnc2n1CCN(CCCc1ccccc1)CC2 12158976 NFGMZWKPRVJIIJ-HXUWFJFHSA-N 383.540 2.992 0 50 GFAA Cc1nnc(SCCNC(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)s1 12203273 BOLIIJWHZBDVDD-OAHLLOKOSA-N 396.582 2.874 0 50 GFAA C[C@@H]1CCCN(C(=O)c2cn(C3CC3)cc(C(=O)NCc3ccccc3)c2=O)C1 14973273 JOQSHJXDHNVNGS-MRXNPFEDSA-N 393.487 2.985 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)CCc2ccccn2)CCC1=O 15072756 YOUMUUBQHWBTQB-SFHVURJKSA-N 381.476 2.530 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)c4ccccn4)C3)C2=O)c1 15079503 NYXJXEINBNFRGG-QFIPXVFZSA-N 397.450 2.884 0 50 GFAA CC(C)CCn1c(CN(C)C[C@@H]2CCCN2C)cnc1S(=O)(=O)C(C)C 19300868 IGFHDAVOWLCMLD-KRWDZBQOSA-N 384.590 2.637 0 50 GFAA O=C1NCCN1c1ccc(CN[C@@H]2CCCN(C3Cc4ccccc4C3)C2)cc1 19840188 VKCYXQMCMSWJLQ-OAQYLSRUSA-N 390.531 2.938 0 50 GFAA Cc1nc2c(O)nc(SCC(=O)Nc3ccc(Cl)cc3)nc2nc1O 1857530142 WIVCBRALLLTNEB-UHFFFAOYSA-N 377.813 2.524 0 50 GFAA COc1cc(-c2nc(CNC(=O)c3onc4ncccc34)c(C)o2)ccc1O 1857666926 CWBVBXYEIQHVQJ-UHFFFAOYSA-N 380.360 2.830 0 50 GFAA O=C1CC2(CCN(Cc3ccsc3)CC2)OCCN1CC[C@H]1CCOC1 1857684360 KYAXWQVJSRBWIL-KRWDZBQOSA-N 378.538 2.758 0 50 GFAA COCC(=O)N1CCC[C@@]2(CCc3c2nc(C(C)(C)C)[nH]c3=NC2CCC2)C1 1875243284 ZMHKBNALEQQXBA-JOCHJYFZSA-N 386.540 2.613 0 50 GFAA CC(=O)NCc1ccc(C(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)s1 236672495 SHSHKQDEFRITRT-UHFFFAOYSA-N 386.473 2.643 0 50 GFAA COCC(=O)N1CCN(C(=O)Nc2ccc(OCC3CCCCC3)cc2)CC1 498931434 UJHJEGHMPUQFBV-UHFFFAOYSA-N 389.496 2.968 0 50 GFAA CC(C)C(=O)NC[C@H]1CCCN(C(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)C1 266969679 LGIJGCNFWOUNKW-QUCCMNQESA-N 389.515 2.801 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H]2CCc3ncsc3C2)(c2ccccc2)CC1 910843669 WLVDTPMZOFAFTC-KRWDZBQOSA-N 395.528 2.863 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(-c2csc(-c3nnsc3N)n2)cc1 1875267400 MUPYEBRTBCZNJD-UHFFFAOYSA-N 395.535 2.941 0 50 GFAA N[C@H](CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCCC1)Cc1ccccc1 1875263857 WIWMSPQIMJQPIK-FCHUYYIVSA-N 393.531 2.687 0 50 GFAA CNC(=O)[C@@H]1C[C@H](C)CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 1875288984 OJFKZAUDSLGGFZ-CMPLNLGQSA-N 375.366 2.758 0 50 GFAA CC(C)C[C@H](CNC(=O)[C@H](C)n1cncn1)NC(=O)CC1(C)CCCCC1 1875329417 VEWIQNYYRDIUBF-DLBZAZTESA-N 377.533 2.847 0 50 GFAA Cc1cncc(C(=O)N2CC[C@]3(CCCCN(C(=O)c4n[nH]c(C)c4C)C3)C2)c1 1875322013 FOYRONNERWYSGV-QFIPXVFZSA-N 395.507 2.889 0 50 GFAA CCCCOCC(=O)NC[C@@H]1CN(C(=O)c2occc2C)C[C@H]1C(F)(F)F 1775989241 HVOCDMKOHIQHQS-ZIAGYGMSSA-N 390.402 2.771 0 50 GFAA COCCCN1C(=O)[C@@]2(CCN(C(=O)c3cc(O)ccc3C)C2)c2ccccc21 2100540258 GHWLPKCESNOMQF-HSZRJFAPSA-N 394.471 2.868 0 50 GFAA Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3Cc2nc3c(s2)CCCC3)on1 2100555523 VGLADJZQPOTBJM-IRXDYDNUSA-N 386.521 2.736 0 50 GFAA COc1ccc(-c2oc3cc(C)oc(=O)c3c2CC(=O)NCCN(C)C)cc1 2049513395 OMCSOPLBOUPXFA-UHFFFAOYSA-N 384.432 2.590 0 50 GFAA CN1CCC[C@H](CNC(=O)c2ccc(-n3cnnn3)cc2)[C@H]1c1cccs1 246494786 ARMXHMAGTYBRNU-QAPCUYQASA-N 382.493 2.537 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@@H]1c1ccc(Br)cc1 623035 NJZGOXQVZHMHFC-CQSZACIVSA-N 381.226 2.899 0 50 GFAA CCOC(=O)c1ccc(NC(=O)[C@@H](CC)Sc2nc(C)cc(=O)[nH]2)cc1 818403 CFNDEWOSIJUMLA-CQSZACIVSA-N 375.450 2.764 0 50 GFAA CCN(CC(=O)Nc1cccc(C(C)=O)c1)S(=O)(=O)c1ccc(OC)cc1 1069788 CJEBCYYVVGGVKM-UHFFFAOYSA-N 390.461 2.547 0 50 GFAA CC(C)c1nc(CCNC(=O)c2ccc3nnc([C@H](O)C(C)C)n3c2)cs1 2356151915 GOLGJNVRZVSEFN-MRXNPFEDSA-N 387.509 2.971 0 50 GFAA COc1ccc(CCN2C(=O)C[C@@H](Nc3ccc(N(C)C)cc3)C2=O)cc1OC 4317726 DFJANFGJRJGXAO-GOSISDBHSA-N 397.475 2.552 0 50 GFAA CCCCN1C[C@H](C(=O)Nc2ccc(C(=O)Nc3nccs3)cc2)CC1=O 10461851 MNYRBVSXYVIBDC-CQSZACIVSA-N 386.477 2.983 0 50 GFAA CCC(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(c3cc(CC)ncn3)C2)c1 112500651 OIUDTTVTAXMBBR-GOSISDBHSA-N 381.480 2.786 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)n1 21795066 LAXMBUCZBXUBOA-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@H]2C[C@H]1/C(=C\OC)C(=O)OC 105021924 DAXYUDFNWXHGBE-CLRXTCFYSA-N 384.476 2.700 0 50 GFAA biogenic C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@H]1CCN1CCCC1=O 20861183 CRWJBJOYWYRKSA-HOTGVXAUSA-N 388.464 2.576 0 50 GFAA Cn1cc(N2CC[C@@H](N3CCO[C@@H](c4ccccc4C(F)(F)F)C3)C2=O)cn1 248431447 CCWDEVSRABLSKR-IAGOWNOFSA-N 394.397 2.618 0 50 GFAA Cc1noc(C)c1COc1ccc(Cc2nc(-c3cncnc3N)no2)cc1 350819846 NXEPUSFRXABGOE-UHFFFAOYSA-N 378.392 2.883 0 50 GFAA CCn1ccc(CN(C)C(=O)[C@H](Cc2cccnc2)NC(=O)c2ccccc2)c1 252491593 LOEFHHNDIBUVGJ-NRFANRHFSA-N 390.487 2.903 0 50 GFAA NC(=O)c1cccc(C[C@@H]2CCN(C(=O)Cc3ccc(F)c(F)c3F)C2)c1 72143093 ANABPQYTFYATJH-ZDUSSCGKSA-N 376.378 2.837 0 50 GFAA COc1ccc([C@@H](CNCc2cnc(C(C)(C)C)nc2)N2CCOCC2)cc1 253416742 OMUIBCRLEHWOPL-HXUWFJFHSA-N 384.524 2.946 0 50 GFAA O=C1CCCN1CC(=O)N1CC[C@]2(CCCN(CCCc3ccccc3)C2)C1 12715589 WNRMSRXBJMBCHQ-QHCPKHFHSA-N 383.536 2.556 0 50 GFAA Cc1nc2ccc(C(=O)N3CC[C@@H](c4ccc5c(c4)OCO5)[C@H](O)C3)cc2o1 216199845 BPXLWJZQLPZBLC-DOTOQJQBSA-N 380.400 2.856 0 50 GFAA CN(C)C(=O)CNC(=O)c1ccc2c(c1)n(CC1CC1)c(=O)n2C1CCCCC1 77321177 HQBWRNKKMJAFKD-UHFFFAOYSA-N 398.507 2.536 0 50 GFAA Cc1nc(CN2CCc3c(c(C(=O)NC4CCCC4)nn3CC(C)C)C2)c[nH]1 14741702 ZSORMBQFINCZKG-UHFFFAOYSA-N 384.528 2.801 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](N(C)Cc1cc(-c3cccnc3)no1)C2 71278810 FWDKJACTMCBGKA-AWEZNQCLSA-N 381.436 2.641 0 50 GFAA Cc1cc2cc(NC(=O)N3CCC[C@H](N4CCCS4(=O)=O)C3)ccc2[nH]1 378206135 ZABQXNJDUGLNEA-INIZCTEOSA-N 376.482 2.508 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@@H]1CCOC2(CCCC2)C1 178162079 IKANFQUQEINRRB-QGZVFWFLSA-N 396.491 2.681 0 50 GFAA CCN(C[C@@H](O)COc1ccccc1)C(=O)c1cccc(-c2cnn(C)c2)c1 426526554 YMOJJLYGAVPJDQ-HXUWFJFHSA-N 379.460 2.989 0 50 GFAA COc1ccc(-c2cnnc(N3CCCC[C@H]3CCN3CCOCC3)n2)cc1 19300988 NTQZKYMCRCMOMA-SFHVURJKSA-N 383.496 2.628 0 50 GFAA Cc1nc(CCNC(=O)N2CC[C@@](O)(c3ccccc3)C2)nc2c1CCCC2 426544756 JZRAPDHQFNGMIT-QFIPXVFZSA-N 380.492 2.509 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)cc1 291117047 FUWMXAJTYNYAQQ-NRFANRHFSA-N 387.501 2.548 0 50 GFAA CCc1nn2c(ncc3c(=O)n(-n4cnnc4)ccc32)c1-c1ccc(Cl)cc1 40397473 RGJFXUIBDJHUQE-UHFFFAOYSA-N 391.822 2.830 0 50 GFAA Cc1cccc(-c2ncc(C(=O)N(C)CC[C@H](O)c3ccccc3)c(=O)[nH]2)c1 82107039 RAIMHWNRPPIYRJ-IBGZPJMESA-N 377.444 2.941 0 50 GFAA COCCCn1c(=S)[nH]c(=O)c2c(C(F)F)cc(-c3ccn(C)n3)nc21 20605517 YWDSEYSSJXZUSU-UHFFFAOYSA-N 381.408 2.829 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)NCc3c(C)nn(C)c3C)c2n1 20602210 YPNCGJGPXQUWHQ-UHFFFAOYSA-N 394.401 2.734 0 50 GFAA O=S(=O)(c1cnn(C2CCOCC2)c1)N1CCC[C@H]1c1cccc(F)c1 178784000 NYSAFFWCTAGQMB-SFHVURJKSA-N 379.457 2.900 0 50 GFAA Cn1ccnc1-c1cccc(C(=O)NC2CCN(Cc3cccnc3)CC2)c1 426590052 XHVZPEBXIRKYKT-UHFFFAOYSA-N 375.476 2.877 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)no1 97602516 YJIVZWSVRZDQPU-MRXNPFEDSA-N 383.408 2.750 0 50 GFAA CC(C)C(=O)Nc1cc(NC(=O)NCC2(N(C)C)CCOCC2)ccc1F 95510072 QNWGEXBQEIMPCS-UHFFFAOYSA-N 380.464 2.653 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)C1CCN(C2CCCCC2)CC1 95389306 KAIGEZZLWPOMTI-UHFFFAOYSA-N 379.574 2.859 0 50 GFAA O=C(CSc1ncccn1)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95374705 IEKIESNEUOSFAL-QGZVFWFLSA-N 394.504 2.615 0 50 GFAA COCC(=O)N1CCC(C(=O)N(C)Cc2nc(-c3ccccc3)cs2)CC1 95361789 FIIKQEOJXSDXAO-UHFFFAOYSA-N 387.505 2.654 0 50 GFAA CC(C)=CCN1CCc2nc[nH]c2C12CCN(C(=O)[C@@H](C)n1cccn1)CC2 97636725 YHSZVAICABWFDR-QGZVFWFLSA-N 382.512 2.509 0 50 GFAA Cc1noc2ncnc(N[C@@H]3CC(C)(C)Cc4nc(N5CCOCC5)ncc43)c12 92098249 VVMLFEYXIJHONQ-CQSZACIVSA-N 395.467 2.678 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(C(=O)c3ccn(C(C)(C)C)c3)C2)CC1 95504739 OTXCWIMZYDPMFT-SFHVURJKSA-N 388.556 2.650 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@H](C(=O)Nc2cccc(-n3cccn3)c2)C1 95509553 FVVFUQVCLDGGAV-INIZCTEOSA-N 377.448 2.702 0 50 GFAA CNc1ncc(C(=O)N(C)CC2CCN(CCc3ccccc3F)CC2)cn1 95504574 FSIPAFGEMPXLKS-UHFFFAOYSA-N 385.487 2.684 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)cc1 95518165 GUCQXNSYYIDQGZ-QGZVFWFLSA-N 386.463 2.686 0 50 GFAA Cn1ccnc1SCC(=O)NC[C@H](c1ccc(F)cc1)N1CCCCC1 299799218 QJXVXHCEMFEJRX-QGZVFWFLSA-N 376.501 2.995 0 50 GFAA CS(=O)(=O)N1CCC(c2nnc3sc(-c4ccc(Cl)cc4)nn23)CC1 825554397 NHVRKIFHPLCENX-UHFFFAOYSA-N 397.913 2.645 0 50 GFAA CC(C)c1cnn2c(NCc3ccccc3)cc(NC[C@H]3CCNC[C@@H]3O)nc12 584905775 YCVGLKWJKIKVBI-MJGOQNOKSA-N 394.523 2.847 0 50 GFAA in-vitro CCc1ccc(S(=O)(=O)N2CCC[C@@H](CNC(=O)c3cscn3)C2)s1 952978055 RWBGJSJIMVKGIR-LBPRGKRZSA-N 399.563 2.598 0 50 GFAA O=S(=O)(c1cccnc1)N1C[C@@H]2CC[C@H]1CN(CCCc1ccccc1)C2 1565525354 VYKZBFCWOJYSQT-UXHICEINSA-N 385.533 2.799 0 50 GFAA Oc1nc(NC[C@@H](O)c2c(F)cccc2F)nc2c1cnn2-c1ccccc1 301402964 RNZANFNHVDUZKT-OAHLLOKOSA-N 383.358 2.945 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@@H](Cn3cncn3)C2)ncn1 275653560 KRWBHQVFLOWEEA-UWVAXJGDSA-N 385.516 2.600 0 50 GFAA CCC(CC)(CNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1)C(=O)O 170066858 FJVIJUGSNNCVNH-GOEBONIOSA-N 380.872 2.867 0 50 GFAA C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(C(N)=O)cc1 186273907 CYMJKYMAOPJVPO-HNNXBMFYSA-N 387.505 2.518 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1C(F)(F)F 170596463 GQHKJTJZRFWSQH-QWHCGFSZSA-N 379.404 2.687 0 50 GFAA C[C@@H]1CCc2ccccc2N1S(=O)(=O)NC(=O)[C@@H]1CCC(=O)c2ccccc21 793141518 OEABNPSLQULDES-RDTXWAMCSA-N 398.484 2.949 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1C[C@H]2CCC[C@](O)(c3ccccc3)[C@H]2C1 1704299110 MRZJTOZJRYMJGZ-AYBZRNKSSA-N 376.478 2.600 0 50 GFAA CCC1=NO[C@@H](CNC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704308856 NDAMAUFYVQLYOO-CYBMUJFWSA-N 390.415 2.840 0 50 GFAA CC[C@]12C[C@@H]1CN(C(=O)C1CCN(C(=O)c3cc(OC)cc(OC)c3)CC1)C2 1772819089 PNZAZYCMVKTKPZ-VGOFRKELSA-N 386.492 2.815 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4ncc[nH]4)C[C@@H]2CN(C2CCOCC2)C3)cc1 1772804223 JLOOBSNRFYNVIB-OFNKIYASSA-N 380.536 2.955 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)CC3CC3)CC2)C1 11661861 XMOMOBOWHMAHQU-OAQYLSRUSA-N 397.563 2.848 0 50 GFAA CC(=O)NCC[C@@H]1CCCCN1C(=O)c1cn(Cc2ccccc2Cl)nn1 11814972 JNEISBXLLYJUED-INIZCTEOSA-N 389.887 2.501 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@@H]1CCCN(CCc2ccccc2OC)C1 11954883 JQUGQUAYCRSNOA-SFHVURJKSA-N 390.524 2.751 0 50 GFAA CCn1ncc(CN(CC2CCN(CCOC)CC2)C[C@H]2CCCO2)c1C 12439387 YDWYADXWTMFMGW-OAQYLSRUSA-N 378.561 2.551 0 50 GFAA CN(Cc1ccccc1)Cc1cc(C(=O)NCc2cn3c(n2)SCC3)no1 12445333 WGMWHIIPNFXCJF-UHFFFAOYSA-N 383.477 2.539 0 50 GFAA CCCn1c(C)c(CC(=O)N[C@H](C(N)=O)C(C)C)c2c1CC(C)(C)CC2=O 12744290 COPYKEZHNKZWKD-IBGZPJMESA-N 375.513 2.530 0 50 GFAA CCN1C(=O)N(CCc2ccccc2)C2(CCN(Cc3cccnc3)CC2)C1=O 14753212 GQPUIJHGTGBDFG-UHFFFAOYSA-N 392.503 2.943 0 50 GFAA O=C1C[C@@H](N2CCN(Cc3ccccc3)CC2)C(=O)N1c1ccc(Cl)cc1 19229339 FERSUGIDTMEMBO-LJQANCHMSA-N 383.879 2.790 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccc5ccccc5n4)nnc23)n1 169780320 LDMJHMUMKIVLML-UHFFFAOYSA-N 399.414 2.820 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(c3nccc(C(F)(F)F)n3)C1)CC2 1857672165 AFTIYZKVMPUHKH-KRWDZBQOSA-N 394.401 2.541 0 50 GFAA COc1cc(CC(=O)Nc2n[nH]c3cccc(N(C)C)c23)cc(OC)c1OC 1875242940 ITYVTDPEPARGND-UHFFFAOYSA-N 384.436 2.836 0 50 GFAA Cc1nc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCc3ccccc3)C2)c(C)o1 216795420 GZNHPGLAIODXCB-MOPGFXCFSA-N 381.476 2.987 0 50 GFAA C[C@H](C(=O)N(CC(=O)O)C1CCOCC1)c1ccc(Br)s1 237400633 NBFSHYADPUUEGN-VIFPVBQESA-N 376.272 2.706 0 50 GFAA COc1ccc(-c2ccc3c(c2)C[C@H](CNC(=O)c2csc(C)n2)O3)nn1 12040311 SEIWYWZMUFEGJV-CQSZACIVSA-N 382.445 2.651 0 50 GFAA C=CC(=O)N(CC)CC(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F 900542440 PUOFDTJEORILNU-UHFFFAOYSA-N 385.443 2.784 0 50 GFAA Cc1noc(COCC(=O)N2CC(C)(C)[C@H]2c2nccn2-c2ccc(F)cc2)n1 952890549 CKXZQXALIIJKCU-GOSISDBHSA-N 399.426 2.829 0 50 GFAA COC1(c2cccc(C(=O)N=c3[nH]n(Cc4ccccc4)cc3C)c2)COC1 1875295554 JPFLTGQGNHIIKL-UHFFFAOYSA-N 377.444 2.786 0 50 GFAA CC(C)[C@H]1C[C@@H](C(=O)NS(=O)(=O)c2ccccc2Br)CCO1 1875283733 CSBSTWUPGSJQAC-WCQYABFASA-N 390.299 2.705 0 50 GFAA COc1ccc(Nc2cc(N3C[C@H](O)C[C@@H]3CN)ncn2)cc1-c1ccccc1 1875397342 WRVHKFFBCIVQTJ-QZTJIDSGSA-N 391.475 2.794 0 50 GFAA CCN(Cc1cccc(Cl)c1)C(=O)c1nc(C)c(C)c(N2CC[C@@H](N)C2)n1 1875400886 BWNXVOJOSNNWRR-QGZVFWFLSA-N 387.915 2.947 0 50 GFAA CCOC(=O)c1[nH]c(C)c(CN(CCc2ccccc2)S(C)(=O)=O)c1C 1080763 CDFKWRVIHPLOSQ-UHFFFAOYSA-N 378.494 2.813 0 50 GFAA NC(=O)[C@H]1CC[C@H]2OCCN(C(=O)c3cccc4c5c([nH]c34)CCCC5)[C@@H]2C1 2100477073 BZIQLULTBPPUSD-MJXNMMHHSA-N 381.476 2.542 0 50 GFAA Cc1ccc(NC2CCN(C)CC2)cc1NC(=O)c1cc(-c2cnn(C)c2)[nH]n1 2325798031 IBGUSUSNNHAUQW-UHFFFAOYSA-N 393.495 2.877 0 50 GFAA NCCCc1ccc(NC(=O)C(=O)N2CCc3c([nH]c4ccc(F)cc34)C2)cc1 2325817501 JOUNGYNABVBROG-UHFFFAOYSA-N 394.450 2.722 0 50 GFAA Cn1cc(-c2ncccc2C(=O)N=c2[nH][nH]c3ccc(Br)cc23)cn1 2325840182 SKEARQQRPCCMFO-UHFFFAOYSA-N 397.236 2.795 0 50 GFAA O=C(NCCN1CCc2c(Cl)cccc2C1)c1ccc(-c2cn[nH]c2)cn1 2325857184 SCOCXRCFGKXULQ-UHFFFAOYSA-N 381.867 2.913 0 50 GFAA CCOC(=O)N[C@H](C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)C(C)C 225446657 CGRIRXFRWAPVDJ-BBTUJRGHSA-N 394.487 2.786 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2S(=O)(=O)c2ccc3ccccc3c2)O1 225831356 XGRRCLPTJQVYEO-BPQTVZERSA-N 389.473 2.712 0 50 GFAA Cc1ccc(CC(=O)N2CCN([C@@H](C)c3nc(-c4cccs4)no3)CC2)cn1 112678503 XEALYNOXHMFLIA-HNNXBMFYSA-N 397.504 2.949 0 50 GFAA COc1ccc(-n2ccnc2CN2CCN(CCC(C)C)[C@H](CCO)C2)cc1 104636232 KPEDHAPTJMPOKC-HXUWFJFHSA-N 386.540 2.796 0 50 GFAA Cn1cc([C@H]2CCN(C(=O)Cc3csc(-c4ccc5c(c4)OCO5)n3)C2)cn1 116116887 GFKSKNGSUPBVJK-AWEZNQCLSA-N 396.472 2.831 0 50 GFAA CC(C)(C)NC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613229 LDLOJENIXSCVRT-UHFFFAOYSA-N 390.908 2.936 0 50 GFAA CN(C)CCCNc1ccc(C(=O)N2CCC(Oc3cccnc3)CC2)cn1 67855636 JWIJSAWWBJAUND-UHFFFAOYSA-N 383.496 2.524 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NS(=O)(=O)c3cn(C)cn3)C2)cc1 72128199 ZHHMUYIEABLXKI-IBGZPJMESA-N 390.553 2.562 0 50 GFAA Cc1nn(C)c(Cl)c1CNCc1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 121864952 TTYCBBNAXMNRKB-KBPBESRZSA-N 390.915 2.921 0 50 GFAA CN(C)c1noc(CNC(=O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)n1 365793793 ITPWHJPCOPJSOI-LBPRGKRZSA-N 390.513 2.560 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H]1CCN(C(C)C)C1=O 172118114 DJZVXEWICDVCJO-HNNXBMFYSA-N 391.468 2.909 0 50 GFAA Cc1cnc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 71764242 GXAZYEMZZZSTKJ-CWFSZBLJSA-N 384.430 2.766 0 50 GFAA CCN1CCC[C@H]1CN1Cc2ccc(C(=O)NCc3nccs3)cc2C1=O 72448120 QSSLQQJKQPBOSF-INIZCTEOSA-N 384.505 2.513 0 50 GFAA O=C1CCc2cc(-c3csc(NC(=O)N4CC[C@@H]5CNC[C@@H]5C4)n3)ccc2N1 333108580 GAIJSNIPUAWWIQ-HUUCEWRRSA-N 397.504 2.768 0 50 GFAA C[C@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1c2ccccc2C[C@@H]1C 456625592 JYFQUMWOOVDHSJ-DCGLDWPTSA-N 395.434 2.734 0 50 GFAA CCc1nsc(N2CCCN(C(=O)N[C@H]3CCOc4ccccc43)CC2)n1 175323906 JHQWETSKDPRELI-HNNXBMFYSA-N 387.509 2.846 0 50 GFAA CNC(=O)OC[C@H]1CCCCN1C(=O)c1ccc(-n2cnc3ccccc32)nc1 288845557 AWUMLXUJGFCKPU-MRXNPFEDSA-N 393.447 2.771 0 50 GFAA O=C(NCCNC(=O)c1cccnc1)N[C@H]1CCC[C@H]1Cc1ccc(F)cc1 426691158 HGYSFOVBFOWRKB-LPHOPBHVSA-N 384.455 2.661 0 50 GFAA Cc1nccn1CCC(=O)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95378432 JJDCHQTWKSDJNA-LJQANCHMSA-N 378.480 2.628 0 50 GFAA C[C@]1(c2ccccc2)CCCN(C(=O)c2ccc(N3CC(=O)NC3=O)cc2)C1 95500040 NNWZBEBLXYHDRT-QFIPXVFZSA-N 377.444 2.937 0 50 GFAA CCCc1cc(N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)nc(C)n1 91746301 ZCXUAXWVSICKMA-UHFFFAOYSA-N 396.539 2.912 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc(CO)cc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95373989 VYNYYLSFQWLKAQ-YTFSRNRJSA-N 392.499 2.890 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)[C@@H](C)n2cnc3ccccc32)CC1 95528445 HAYILCRECTXXBN-MRXNPFEDSA-N 381.480 2.846 0 50 GFAA CCCn1ccnc1CN1CCC(c2nnc(CN3CCCCC3)n2C)CC1 96138916 KRKNZVGFEAHTFT-UHFFFAOYSA-N 385.560 2.787 0 50 GFAA CCc1nnc(CN(CC)C(=O)[C@@H]2CCC(=O)N(Cc3ccccc3F)C2)o1 91526544 PWSJWIJPADBQGF-OAHLLOKOSA-N 388.443 2.558 0 50 GFAA Cc1nn(C)c(C)c1CN1CCC[C@@]2(CCC(=O)N(Cc3cccnc3)C2)C1 91656115 KMYCZHIYPKEGJI-JOCHJYFZSA-N 381.524 2.837 0 50 GFAA O=C1C[C@H](Cc2ccc(NC(=O)Nc3c[nH]nc3-c3ccccc3)cc2)C(=O)N1 180529532 HMWNVBOZAWYWGF-HNNXBMFYSA-N 389.415 2.926 0 50 GFAA O=C1CC[C@@H](CN2CCCN(C[C@H]3CCNC(=O)CC3)c3ccccc32)CCN1 294837866 AWSXVBMATXSTMF-RTBURBONSA-N 398.551 2.536 0 50 GFAA COc1cc(NC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)cc(OC)c1 263615199 BCCLCKUXTFXGLH-GOSISDBHSA-N 398.394 2.958 0 50 GFAA CCc1c(-c2cccc(C(=O)N3CCN(C4CCCC4)C(=O)C3)c2)cnn1C 299797399 ABCZTYHIAUWACK-UHFFFAOYSA-N 380.492 2.877 0 50 GFAA Cn1nccc1CCNC(=O)Nc1cc(C(=O)N2CCCC2)ccc1Cl 299776204 LFQAQPXZJMRXSN-UHFFFAOYSA-N 375.860 2.674 0 50 GFAA CCc1ccc2nc(C)cc(C(=O)N3CC[C@@H]4OCc5cnnn5[C@@H]4C3)c2c1 1076137967 WOCLGWALUHLJRB-UXHICEINSA-N 377.448 2.683 0 50 GFAA Cc1cccnc1CN(Cc1ccccc1)C(=O)Cc1c(C)nc(O)nc1O 952965448 FISTXRCPBBZPQC-UHFFFAOYSA-N 378.432 2.671 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCC(c4ccnc(N)n4)CC3)cc2)n1 952988159 MOYJHGCZZNERFD-UHFFFAOYSA-N 390.491 2.940 0 50 GFAA Cn1cnnc1Sc1ccc(CNCc2csc(-c3cnccn3)n2)o1 952976323 FCVOGPYGARYQSP-UHFFFAOYSA-N 385.478 2.763 0 50 GFAA C[C@@H]1CCCCN1C(=O)CN1CCN(c2ncc(C(F)(F)F)s2)CC1 302792429 ZLJPXCAPOUGGKH-GFCCVEGCSA-N 376.448 2.685 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)CC1 278905920 RULZIOPBAGYSTE-MRXNPFEDSA-N 398.511 2.673 0 50 GFAA Cn1ccnc1N1CCN(C(=O)c2cc(CCc3ccccc3)ccc2O)CC1 170644329 YYLLFHRZLAHTHI-UHFFFAOYSA-N 390.487 2.873 0 50 GFAA CCCN(c1cc(C(F)(F)F)n[nH]1)S(=O)(=O)c1ccc2c(c1)OCCO2 170600112 CRYCCXHXZSBJLI-UHFFFAOYSA-N 391.371 2.805 0 50 GFAA CCN(CCNC(=O)c1ccc2c(c1)NC(=O)CS2)CCC(F)(F)F 170612931 FXWBSUAOUFVCSV-UHFFFAOYSA-N 375.416 2.735 0 50 GFAA CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=S)NCC1CCN(C)CC1 760505221 XUPJTTWHYKMBES-KRWDZBQOSA-N 398.617 2.924 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NCCS(=O)(=O)CC3CC3)c12 766621231 GFMUQJVMBKSUKG-UHFFFAOYSA-N 399.472 2.753 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3c(C)cc(C)n(C)c3=O)CC1)OCC2 1704344543 SJALEKWIOVEKEY-UHFFFAOYSA-N 396.487 2.715 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCC3(CC2)C[C@](C)(O)CCO3)n[nH]1 1704344939 QSJSIEKWDPJXBA-HXUWFJFHSA-N 385.464 2.622 0 50 GFAA CC1(C)CNC(=O)C2(CCN(C(=O)C3(c4ccccc4)CCCCC3)CC2)NC1 1772819752 RYKBLGBOEZGMKF-UHFFFAOYSA-N 397.563 2.995 0 50 GFAA O=C(NCc1cccc(F)c1)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772818336 QLNZPTYCOVTLCM-AWEZNQCLSA-N 375.469 2.540 0 50 GFAA COc1ccc(-n2ccnc2CN2CC[C@@H](N3CCCCCC3)[C@H](O)C2)cc1 11664526 IOHPCRFFQRSYKU-NHCUHLMSSA-N 384.524 2.692 0 50 GFAA COc1ccc(-c2noc(CN3CCC[C@H](CCCO)C3)n2)c(OC)c1OC 11774642 SBJHCNOWHSITOT-CQSZACIVSA-N 391.468 2.747 0 50 GFAA COCCN1CCC(CN(C[C@@H]2CCCO2)C(=O)CCC(F)(F)F)CC1 11948586 KKNQVBLXTQQLIH-INIZCTEOSA-N 380.451 2.695 0 50 GFAA COc1ccccc1OCc1cc(C(=O)N(C)Cc2cc(C3CC3)[nH]n2)n[nH]1 12306085 PAJSEFXQSLTDAS-UHFFFAOYSA-N 381.436 2.870 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@H](C(=O)c2ccc3c(c2)OCO3)C1 12589253 YTIGUIGTEFPQQT-KRWDZBQOSA-N 397.475 2.820 0 50 GFAA CC(C)OCCNCc1cccc(OC[C@H](O)CN2CCc3ccccc3C2)c1 14980775 JJFGTRHDMPMKDD-HSZRJFAPSA-N 398.547 2.999 0 50 GFAA Cc1n[nH]c([C@H](C)NC(=O)C2(N(C)Cc3ccccc3)Cc3ccccc3C2)n1 15062186 ZHAZIDGFOHBNMF-INIZCTEOSA-N 389.503 2.960 0 50 GFAA Cc1noc(-c2cn([C@H]3CCN(C(=O)c4cc(Cl)ccc4F)C3)nn2)n1 169777915 RDKHHARNKRWDMG-NSHDSACASA-N 376.779 2.516 0 50 GFAA COc1cc(-c2nc(-c3cnc[nH]3)[nH]c2-c2oc(C)cc(=O)c2O)ccc1O 1857526515 KCHFAQYOHIDPAR-UHFFFAOYSA-N 380.360 2.815 0 50 GFAA COc1ccc(-c2ccc(C(=O)N[C@H]3C[C@H]4CO[C@@H](C5CC5)CN4C3)o2)cc1 1857684148 AQTIEIPKTYIXNY-XGHQBKJUSA-N 382.460 2.937 0 50 GFAA Cc1ncc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4ccsc4)C3)C2)nc1C 1857690172 DFRPBYZNAQDDGV-YLJYHZDGSA-N 386.521 2.649 0 50 GFAA O=C(c1cccc(-c2cn[nH]c2)c1)N1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1 1857717226 NSNZSGGLJRCAOU-GGAORHGYSA-N 391.471 2.505 0 50 GFAA C[C@H]1CN(c2ncc(Cn3cc(Br)cn3)s2)C[C@@]2(CCOC2)O1 366487944 DQUJSGKGFCEMDF-XHDPSFHLSA-N 399.314 2.535 0 50 GFAA CN1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H](CC(=O)O)C1=O 1857782988 HJOBHLVCGNOWDX-IBGZPJMESA-N 394.427 2.553 0 50 GFAA COc1cc(OC)cc(S(=O)(=O)NC[C@]2(c3ccccc3)CC2(F)F)c1 1875323095 WVFWBPSOAUYVMC-KRWDZBQOSA-N 383.416 2.959 0 50 GFAA O=C(c1cncs1)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1875396096 VKEFEJDAQLJIGK-UHFFFAOYSA-N 391.518 2.948 0 50 GFAA Cc1cccc2nc(CNC(=O)N3CCC[C@]34CCC[S@@](=N)(=O)C4)cn12 1875393150 HTRXSKYWTJSEIV-WXTAPIANSA-N 375.498 2.527 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)N[C@@H](C)c1cc(C)ccn1)CCO2 1875395323 AQYDWJYOBLQSLQ-IWKOHUFWSA-N 394.541 2.513 0 50 GFAA C[C@H](COc1ccccc1F)NC(=O)c1ccc(N2CCOCC2)c(F)c1 1318315525 FCLDJQZTSBMSLP-CQSZACIVSA-N 376.403 2.999 0 50 GFAA CN(C[C@H](O)c1ccc(F)cc1)C(=O)c1nc(N2CCCC2)ncc1Cl 2325708924 HCZKOKCFXYHEDO-HNNXBMFYSA-N 378.835 2.675 0 50 GFAA O=S(=O)(c1cccc(-c2nc(Cc3ccno3)no2)c1)N1CCCCCC1 2325735967 MWABSJHKBJUIHR-UHFFFAOYSA-N 388.449 2.880 0 50 GFAA CCOCc1nnc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)n1C 2325770576 BWFBKGMNAKWKSR-UHFFFAOYSA-N 379.455 2.699 0 50 GFAA CN(C)CCn1ccc(=NC(=O)c2coc3c(Br)cccc23)[nH]1 2325772022 MQCQPWYEPGSDPK-UHFFFAOYSA-N 377.242 2.628 0 50 GFAA CN(Cc1ccc(CO)cc1)[C@@H]1CCCN(C(=O)c2cc3cnccc3[nH]2)C1 2325812090 KIULQLBFRXJODV-LJQANCHMSA-N 378.476 2.792 0 50 GFAA CC1CCN(C(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 798684 BWWMDYLIBGTLAF-UHFFFAOYSA-N 379.309 2.872 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCC(OC)CC2)CC[C@H]1Nc1nccc(C)n1 2356155426 GLNPLKWIMDDGCD-QXAKKESOSA-N 390.528 2.798 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(c2cc(C(=O)O)c3ccccc3n2)C1 2356161158 JDLKOLHGYCUSGL-NRFANRHFSA-N 375.432 2.620 0 50 GFAA O=C(O)CCCNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccco1 2950172 PQJAKUJXHNAVQN-SDNWHVSQSA-N 376.796 2.685 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2ccccc2)S(C)(=O)=O)cc1 2981932 IGDYHNQFGNDSSG-UHFFFAOYSA-N 378.519 2.670 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)N1CCCCCC1 100768919 OHDRKYIAFNMZNY-SXYSDOLCSA-N 392.499 2.807 0 50 GFAA Cc1nc2sccn2c1CN1CCN(CCc2ccccc2)[C@H](CCO)C1 22851555 JYCYWVVUZMNXRS-LJQANCHMSA-N 384.549 2.816 0 50 GFAA C[C@H]1CCC[C@@H](C)[C@]12NC(=O)N(CCCS(=O)(=O)c1ccccc1)C2=O 247882445 RLVQVPDRFIKRMW-QWHZDKJVSA-N 378.494 2.597 0 50 GFAA C[C@@H]1c2nc(N)nc(-c3ccncc3)c2CN1C(=O)c1cn2ccsc2n1 65536666 QYRPZCHHTPAZKQ-SNVBAGLBSA-N 377.433 2.547 0 50 GFAA CCOc1ccc(CC(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)cc1OCC 653092 HTNDAALRCHWYLT-KRWDZBQOSA-N 392.349 2.834 0 50 GFAA O=C(Cc1nc2ccc(Cl)cc2[nH]1)NCc1csc(-c2ncccn2)n1 214998094 ZZURELCVOKDLDG-UHFFFAOYSA-N 384.852 2.989 0 50 GFAA C[C@H](O)C1CCN(c2cc(N3CCC([C@@H](C)O)CC3)c3ccncc3n2)CC1 328590372 FDENFUXPAXJACV-CVEARBPZSA-N 384.524 2.824 0 50 GFAA O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N(CCc1ccccc1)C1CCCC1 476229336 AXXQHSCMMKUFCD-OAQYLSRUSA-N 399.535 2.963 0 50 GFAA CC(C)(C)n1ncc(C(=O)N2CCC[C@@H](c3ccnc(N)n3)C2)c1C(F)(F)F 331482558 ADNZFLMIPZGJFV-LLVKDONJSA-N 396.417 3.049 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCC(C(=O)N2CCCCC2)CC1 363274361 KNVIVIQIGAYDIM-GOSISDBHSA-N 391.556 2.665 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN[C@H]1CCO[C@@]2(CCSC2)C1 151354316 HLSPSFNTYGPQFF-WFASDCNBSA-N 379.448 2.814 0 50 GFAA CCOc1ccnc(N2CCN(C(=O)CCc3cn(C)c4ccccc34)CC2)n1 152358756 ZDASUYLBNHMWGC-UHFFFAOYSA-N 393.491 2.648 0 50 GFAA COc1ncc(CN2CC[C@@]3(CCCN(Cc4cccc(C)c4)C3=O)C2)cn1 12715713 UNNZIQHYSYMSOE-QFIPXVFZSA-N 380.492 2.808 0 50 GFAA NC(=O)c1cccc(NC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)n1 152803465 SXMUFUGNMKLOFD-UHFFFAOYSA-N 376.203 2.925 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)C2(C(=O)N3CCC[C@H]([C@H](C)N)C3)CCCC2)c1 237428940 BFRVHFVTDLQKSN-ROUUACIJSA-N 392.565 2.976 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@H]1CCO[C@H](C2CC2)C1 157030272 XTNREYIMKPIGFL-GJZGRUSLSA-N 392.912 2.961 0 50 GFAA Cc1cc(C(=O)NCCCN2CCc3ccccc3C2)cc(C)c1OCC(=O)O 237864279 OCPVOAIIXRWLJS-UHFFFAOYSA-N 396.487 2.945 0 50 GFAA CC(C)[C@H](NC1CCOCC1)C(=O)NCc1cc(N(C)C)nc2ccccc12 173354109 SNCWRGVZPSBXQY-NRFANRHFSA-N 384.524 2.710 0 50 GFAA O=C(NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1cnc(OCC2CC2)c(Cl)c1 242263442 XZEXWJRVTHPPNJ-RHSMWYFYSA-N 394.899 2.821 0 50 GFAA CN(CCC(=O)OCc1ccccc1)CCN1CCN(Cc2ccccc2)CC1 225795742 XNSZNIVEWXMUTE-UHFFFAOYSA-N 395.547 2.870 0 50 GFAA CC(=O)CCc1ccc(O[C@@H](C)C(=O)Nc2cccc3c2OCC(=O)N3)cc1 290717642 XHETZXTZRCEPDW-AWEZNQCLSA-N 382.416 2.945 0 50 GFAA COc1ccc([C@@H]2CN(c3cc(C)nc(N(C)C)n3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95373187 GEWFRDAEXGMXHD-KSEOMHKRSA-N 393.535 2.926 0 50 GFAA Cc1nc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)cs1 91326525 ZRBQMOSJEMINLN-UHFFFAOYSA-N 384.505 2.892 0 50 GFAA CCN(C(=O)c1ccoc1COc1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1 91845997 VHCYSQZVTAWWLL-OAHLLOKOSA-N 377.462 2.816 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(CSc2nnc[nH]2)o1 244795260 RCSNKZKRWRZHOU-AWEZNQCLSA-N 383.477 2.946 0 50 GFAA Cc1ccc(CNC(=O)CCN2CCN(C3Cc4ccccc4C3)CC2)cc1 244874558 XDDPLBSCGFZTHJ-UHFFFAOYSA-N 377.532 2.786 0 50 GFAA O=C1CCCc2occ(C(=O)N3CCOC[C@@H]3c3ncnn3-c3ccccc3)c21 295815714 BWUGAXDSNMCCRJ-MRXNPFEDSA-N 392.415 2.593 0 50 GFAA Cc1cccc(C[C@H](CNC(=O)c2ccc3c(c2)NC(=O)CS3)C(=O)O)c1 299753291 XQFZWGIHKRTQHY-OAHLLOKOSA-N 384.457 2.713 0 50 GFAA C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CCCN3Cc3ccccc3)cn2)CCO1 299152707 NJEQFOVTBTUYPL-GHTZIAJQSA-N 394.519 2.588 0 50 GFAA CCn1ncc(-c2ccc(C(=O)NC[C@@H](O)CN3CCCCCC3)cc2)c1C 534675312 SWRWGNSTKJSGRF-HXUWFJFHSA-N 384.524 2.845 0 50 GFAA C[C@@](O)(CCCO)CNC(=O)c1cccc(-c2cccc3c(=N)cc[nH]c23)c1 534590012 ZOICSUCVUBUKTG-JOCHJYFZSA-N 379.460 2.568 0 50 GFAA O=C(C[C@H](Cn1cccc1)c1ccc(Cl)cc1)NC[C@@H]1CCS(=O)(=O)C1 263586959 AFHVIUQCIYXSAS-DOTOQJQBSA-N 394.924 2.866 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2)c1ccc(CN2CCCC2)o1 952966584 XHEBMMXCIXAALB-RGMRCXJASA-N 395.507 2.945 0 50 GFAA Cn1ccnc1[C@H](NC(=O)c1ccccc1N1CCOCC1)c1ccccc1 952964635 ONKHWIXDMXPZGC-HXUWFJFHSA-N 376.460 2.776 0 50 GFAA O=C(c1cccnc1N1CCCCC1)N1CCS(=O)(=O)C2(CCCCC2)C1 268009003 ULDYVQRZGVYYEL-UHFFFAOYSA-N 391.537 2.645 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)Cn1c(C)cc(=O)c2ccccc21 952965723 AEAIFFBAUPFXKV-UHFFFAOYSA-N 377.444 2.627 0 50 GFAA COCc1cc(F)ccc1NC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O 186817275 KFMQPBAVOXEXCD-UHFFFAOYSA-N 386.427 2.735 0 50 GFAA O=C(N[C@H]1COC[C@@H]1Cc1ccncc1)c1ccc(-c2noc(C3CC3)n2)cc1 1615964411 GPJOQRBTDGDBPJ-OALUTQOASA-N 390.443 2.997 0 50 GFAA Cc1cc(C[C@H]2CN(Cc3cccc(OCCN4CCCCC4)c3)C[C@@H]2O)on1 1616085299 ZYTQIKLTMBROKR-REWPJTCUSA-N 399.535 2.883 0 50 GFAA COc1ccc([C@H](O)C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 1506395915 JOHWCWWXFZKLJS-QFIPXVFZSA-N 382.504 2.896 0 50 GFAA COc1cc(-c2onc(N3CCC[C@@](C)(C(=O)O)C3)c2C(=O)O)ccc1F 1704331220 PSJWKDCBSGUDEC-GOSISDBHSA-N 378.356 2.879 0 50 GFAA COC(=O)c1cc(CNC(=O)c2ccnn2C)cc(NC(=O)C2CCCCC2)c1 11882130 ZDJJZPLYBYZTAB-UHFFFAOYSA-N 398.463 2.656 0 50 GFAA CCN1CCC(N2C[C@H]3[C@@H](C2)OC(=O)N3CCc2cccc(Cl)c2)CC1 11934518 KYZDFLUAHFOMJD-RBUKOAKNSA-N 377.916 2.872 0 50 GFAA CSc1ncc(CN2CCC[C@@H](CNC(=O)c3n[nH]c4ccccc34)C2)cn1 12305489 XFMBINYWLIDUGC-AWEZNQCLSA-N 396.520 2.717 0 50 GFAA COC(=O)CCC(=O)N1CCc2[nH]nc(-c3ccc(C(F)(F)F)cc3)c2C1 12314584 KOZAILHMOPRISF-UHFFFAOYSA-N 381.354 2.933 0 50 GFAA NC(=O)C1(C(=O)N2CCO[C@H](CC(c3ccccc3)c3ccccc3)C2)CC1 12475855 COFAQRJGNOPEFI-LJQANCHMSA-N 378.472 2.702 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@@H](NCc1cccnc1)C2 14733307 CQSMCCOSSKZTQN-QGZVFWFLSA-N 393.491 2.810 0 50 GFAA COc1ccccc1N1CCN(c2ncccc2CNc2ncccn2)CC1 19113780 QHVJPBPKUQOHDQ-UHFFFAOYSA-N 376.464 2.819 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccoc4)ccn3n2)cc1C 169775945 WUMLUGGUVDOWGI-UHFFFAOYSA-N 376.416 2.803 0 50 GFAA CC(C)Cc1nc(-c2ccc3sc(=N)[nH]c3c2)n([C@H]2CCS(=O)(=O)C2)n1 1857670981 JQNJZRUOQZMVLY-LBPRGKRZSA-N 391.522 2.525 0 50 GFAA Cc1c(C(=O)N(CC(=O)O)C2CC2)cnn1-c1cccc(Br)c1 237726597 RUMDWSCCIKELDP-UHFFFAOYSA-N 378.226 2.632 0 50 GFAA C/C=C(\C)CN1CCC([C@]2(CCC)NC(=O)N(C[C@@H]3CCCO3)C2=O)CC1 12037906 JZYMWOSJBQOJSQ-YIFMKKJRSA-N 377.529 2.934 0 50 GFAA COc1cc(CN2CC[C@H](N3CCCCCC3)[C@@H](O)C2)cc(OC)c1OC 247894591 NYSMRDMLEXXHHQ-ROUUACIJSA-N 378.513 2.524 0 50 GFAA O=C(NCC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccc(-c2ccccc2)cc1 155564279 KFZUNWZLMJPQKQ-LJQANCHMSA-N 389.459 2.955 0 50 GFAA O=C1NCCN1[C@H]1CCCN(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1 374681917 WXNVSUMIDORWPM-AWEZNQCLSA-N 395.294 2.564 0 50 GFAA O=C(O)[C@H]1C[C@H](O)CN1C(=O)CCc1c(-c2ccccc2)[nH]c2ccccc12 1875312880 DUZANTULFOFQDE-HNAYVOBHSA-N 378.428 2.814 0 50 GFAA NCCc1ccc(OCC(=O)Nc2ccc(-n3nnc4ccccc43)cc2)cc1 1875349928 TVEVTJQCWQTVQJ-UHFFFAOYSA-N 387.443 2.939 0 50 GFAA CCn1ccnc1[C@@H]1CCCCN1S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 1322498942 XUPDBXTYDZOJBD-KRWDZBQOSA-N 388.493 2.704 0 50 GFAA O=C(c1ncccc1O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100480623 KSBBTCJLRLCRAN-JOCHJYFZSA-N 379.460 2.627 0 50 GFAA COc1cc(/C=C/C(=O)N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)ccc1OC(C)C 2325785593 FQWOPJBMCDECEB-SNBWLZMPSA-N 399.491 2.648 0 50 GFAA COc1cnc(C(=O)N(C)CC(C)(C)CNC(=O)C2CC3(CC3)C2)c(F)c1 2325794130 RJBLXIVOQDBRCU-UHFFFAOYSA-N 377.460 2.634 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@H]3Cc4ccccc4S3(=O)=O)cc2)c1C 2325840839 STHJOUKXWJIWMV-LJQANCHMSA-N 381.457 2.826 0 50 GFAA C[C@H]1C[C@@H](C)C[C@H](C(=O)N2CCCC[C@H](NC(=O)c3cccc(C(N)=O)c3)C2)C1 2325864552 SLFLNYWWRYVDKW-FIYPYCPBSA-N 399.535 2.969 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)cc1OC 785736 KSOJQCYDHTYHFL-UHFFFAOYSA-N 390.461 2.741 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1cc2c(=O)n3ccccc3nc2s1 1064001 OZWYAHGFFNJOLH-UHFFFAOYSA-N 379.397 2.933 0 50 GFAA O=C(c1cnc2c(c1)CCCC2)N1CCc2nc(Cc3ccccc3)nn2CC1 2356134929 IZWHCHVFICPDNZ-UHFFFAOYSA-N 387.487 2.841 0 50 GFAA O=C(c1ccn2ncnc2c1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356157989 UZLMZOUMNRSQSW-QFIPXVFZSA-N 389.459 2.527 0 50 GFAA CC[C@H](C)Nc1nc(OC)nc(N(C#N)CC(=O)N(c2ccccc2)C(C)C)n1 2922631 TYFJWPKOGHQGIN-HNNXBMFYSA-N 397.483 2.820 0 50 GFAA O=C1N[C@H](c2cccc(Cl)c2)[C@@H](C(=O)c2cccnc2)[C@](O)(C(F)(F)F)N1 4086340 JMWAGBGINOXEHS-ZENOOKHLSA-N 399.756 2.839 0 50 GFAA COC(=O)c1cc(NCc2cccc(OC)c2OC)ccc1N1CCOCC1 4386331 OSQSDECMGQATCJ-UHFFFAOYSA-N 386.448 2.939 0 50 GFAA CO[C@@H]1CC[C@H]2OCCN(C(=O)c3ccc4c(c3)[nH]c(=O)n4C3CCCC3)[C@H]2C1 245674773 FSKNPEBFMBFIMO-LSTHTHJFSA-N 399.491 2.853 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@@H](c3cc(OC)cc(OC)c3)C2)c1 225498159 HULWTOSTXRLYSA-LJQANCHMSA-N 390.461 2.823 0 50 GFAA O=C(CCn1cccn1)OCc1ccc(Br)cc1N1CCOCC1 225689241 GNVJKENPSCGUKD-UHFFFAOYSA-N 394.269 2.616 0 50 GFAA CCOc1ccc(CN2CCN(C3CSCCSC3)C[C@H]2CCO)cc1 104483693 LSMUWNANQPBERN-GOSISDBHSA-N 396.622 2.803 0 50 GFAA C[C@@H](c1ccco1)N(C)C(=O)Cn1ncc(N(C)Cc2ccccc2)cc1=O 20149200 XLGMTFCGGPPQTL-INIZCTEOSA-N 380.448 2.692 0 50 GFAA NC(=O)c1cc(NC(=O)CN(Cc2cccnc2)c2ccccc2)ccc1F 118312210 ZFJFABSBZLFESH-UHFFFAOYSA-N 378.407 2.965 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(c2nccc(N)n2)CC1 67514551 DEXFKCHRHVAWHN-UHFFFAOYSA-N 377.452 2.658 0 50 GFAA Cn1nccc1C(=O)N1CCC[C@H]1c1ccc(C(=O)Nc2cnns2)s1 20993865 ACELTTURNTYDCR-JTQLQIEISA-N 388.478 2.563 0 50 GFAA NC(=O)[C@H]1CCCN(c2nccc(-c3cnn(-c4cccc(Cl)c4)c3)n2)C1 20999894 BBDMEGVYIZMOQJ-ZDUSSCGKSA-N 382.855 2.684 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)[C@H]2CC(Cc3cccc(F)c3)=NO2)C1 11787862 NZKWDACZBCHERY-QFBILLFUSA-N 389.471 2.620 0 50 GFAA Cc1nnc([C@@H]2CN(S(=O)(=O)c3cc(Cl)sc3Cl)CCO2)o1 328609482 DKDPFMCKGZUISH-ZETCQYMHSA-N 384.266 2.509 0 50 GFAA CN(C)[C@H]1CCN(CCCN2CC3(CCN(C4CCCCC4)CC3)OC2=O)C1 72410111 KKUMVYSJMPMILE-FQEVSTJZSA-N 392.588 2.632 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2cn3c(C)cc(C)nc3n2)n1C 328626712 FJFHHVJGAQKPLU-GOSISDBHSA-N 380.496 2.771 0 50 GFAA C[C@](O)(CNC(=O)NC1CCN(CCc2ccccc2)CC1)c1ccccc1 172025175 VZGZSOUQKFTMRG-QHCPKHFHSA-N 381.520 2.900 0 50 GFAA O=C(O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H]1CCOc2ccccc21 238209202 QSPPYEOQIHMNSL-SJLPKXTDSA-N 382.391 2.985 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@@H](O)C[C@@H]3c3nc(C)no3)CC3(CCC3)C2)cc1 376102297 KKTRCJOCLZDHDS-FUHWJXTLSA-N 397.475 2.923 0 50 GFAA COc1cccc(-c2nc(=NC(=O)N3CCOc4cc(O)ccc4C3)s[nH]2)c1 370692860 VHQZKKGQNPXXNK-UHFFFAOYSA-N 398.444 2.768 0 50 GFAA O=C([C@@H](Cc1c[nH]cn1)n1cccc1)N1CCC2(CC1)C(=O)Nc1ccccc12 72143056 JEBDKZMSXHVILC-LJQANCHMSA-N 389.459 2.508 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCC(C)(C)CO)(Cc2ccccc2)c2ccccc21 71721299 ODDADJOEWKORFP-HSZRJFAPSA-N 380.488 2.668 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1 237969234 PTUGXVVFWKSSJS-AEFFLSMTSA-N 384.407 2.506 0 50 GFAA CCCn1cc(C(=O)N2CCn3nc([C@@H](O)c4ccccc4)cc3C2)c(C)n1 219205154 UCAKVXMQEUCEBF-FQEVSTJZSA-N 379.464 2.536 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CCC[C@H]2c2cn(C)nc2C)c1 378095454 DCQONXSIGVCOIW-KRWDZBQOSA-N 380.456 2.771 0 50 GFAA O=C(c1cc2ccccc2c(=O)[nH]1)N1CCC(C(=O)O)(c2ccccc2)CC1 238071116 CRAODXFWBGURRP-UHFFFAOYSA-N 376.412 2.787 0 50 GFAA Cc1nn(C)cc1-c1ccn(CC(=O)Nc2cc(-c3ccccc3)nn2C)n1 48179382 FJIBMSGGMDCFHK-UHFFFAOYSA-N 375.436 2.631 0 50 GFAA CC(C)[C@H]1CN(c2cc(NCCO)ncn2)CCCN1Cc1ccc(F)cc1 71763340 NOKVZHWKRZVZQS-LJQANCHMSA-N 387.503 2.757 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)o1 82097468 NJAFDYREKJUCBW-OAQYLSRUSA-N 382.464 2.731 0 50 GFAA O=C1[C@H](N2CCN(c3ncccc3Cl)CC2)CCN1c1c(F)cccc1F 176157868 XTGUTPJTSJBUTG-MRXNPFEDSA-N 392.837 2.941 0 50 GFAA C[C@H]1CCc2n[nH]c(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)c2C1 82109253 DHEHAELNOXWMSA-ZDUSSCGKSA-N 379.464 2.574 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@](NC(=O)OCc2ccccc2)(C(=O)O)C1 44136947 WFJMNSIPYXEIJT-LJQANCHMSA-N 378.425 2.767 0 50 GFAA CC(C)Cc1ccc(CN2CCn3nc(CNC(=O)N(C)C)cc3C2)s1 82166572 ZJJTWVSAHDGNGG-UHFFFAOYSA-N 375.542 2.930 0 50 GFAA COCc1cccc(S(=O)(=O)N(CCCO)[C@@H]2CCc3ccccc32)c1 178755861 XVJQWLYWGNCRJA-HXUWFJFHSA-N 375.490 2.894 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(c3ncccn3)C2)c(OC)c1 95497939 HRIGXSCRSZBTCN-INIZCTEOSA-N 384.480 2.807 0 50 GFAA COc1ccc([C@@H]2CN(CCn3c(=O)oc4ccccc43)C[C@H]2N(C)C)cc1 95504218 OJXLHUBFRQFOCW-AZUAARDMSA-N 381.476 2.633 0 50 GFAA CCn1nccc1S(=O)(=O)N1CCC[C@](C)(Cc2ccc3c(c2)OCO3)C1 91288632 RSCGCXBLMHAPJZ-LJQANCHMSA-N 391.493 2.665 0 50 GFAA Cc1scnc1CSc1nnc(C2CCNCC2)n1C[C@@H]1CCCO1 426495896 YEBNJPWRHQMEQQ-AWEZNQCLSA-N 379.555 2.981 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1cccn1C 95498696 CKBKSLDPHADYSX-IBGZPJMESA-N 395.547 2.993 0 50 GFAA CCS[C@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1 95356103 YYPZOIHYZUUFHS-MRXNPFEDSA-N 390.553 2.658 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CC[C@@](O)(C4CCC4)[C@H](C)C3)n2)c1 91603413 SOZZRBVBDPNZBA-VFNWGFHPSA-N 382.512 2.879 0 50 GFAA O=C(O)[C@H]1CCN1C(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1 95517959 FZMOMGQBJDEFGV-HXUWFJFHSA-N 378.472 2.906 0 50 GFAA CN1CCC(O)(c2nc(-c3ccc(F)c(F)c3)nn2CC(F)(F)F)CC1 96154154 QMXTYJADYVNKHO-UHFFFAOYSA-N 376.329 2.699 0 50 GFAA CCn1c(NC(=O)C2=NN(c3ccccc3)C(=O)[C@H](C)N2)nc2cc(C)ccc21 182463218 DDHVRGNELWTMFL-AWEZNQCLSA-N 390.447 2.642 0 50 GFAA O=C(NCC1CCN(Cc2sccc2Cl)CC1)[C@H]1CC(=O)N(C2CC2)C1 827693219 ACRWPGJKGNQGMA-AWEZNQCLSA-N 395.956 2.741 0 50 GFAA CC[C@@H]1CN(S(=O)(=O)c2cc(-n3cccn3)ccc2C)CCN1C(C)C 952984846 BZTGZWRWYGJJFN-QGZVFWFLSA-N 376.526 2.674 0 50 GFAA Cn1c([C@H]2CCCN2C(=O)CCC(=O)Nc2nncs2)nc2ccccc21 952988594 OMFRXXVRXZIMTA-CQSZACIVSA-N 384.465 2.507 0 50 GFAA CN(C[C@H]1CCN(c2ccccc2)C1)C(=O)Cn1ccc(=O)c2ccccc21 952976187 HXGQPAQPUNDSKG-GOSISDBHSA-N 375.472 2.986 0 50 GFAA C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 170612378 FQRRTYMNAIHMFX-ZIAGYGMSSA-N 377.485 2.805 0 50 GFAA COC(=O)c1ccc(CNc2ncnc3c2c(Br)nn3C)cc1 170620859 RVTGCIURDZMKLB-UHFFFAOYSA-N 376.214 2.525 0 50 GFAA Cc1cc(C)c2c(OCC(=O)N[C@@H]3C[C@H]3c3ccc(F)cc3F)nn(C)c2n1 170626419 WFIDQCXZSKRFEZ-GOEBONIOSA-N 386.402 2.914 0 50 GFAA O=C(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1cccc(Cc2nn[nH]n2)c1 738143911 GKECLPWDSSZFRT-UHFFFAOYSA-N 386.419 2.705 0 50 GFAA COc1cc(NC(=O)CN2CCCN(c3ccc(F)cc3)CC2)cc(OC)c1 1529172800 OXDAYMAGBMUDBF-UHFFFAOYSA-N 387.455 2.994 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(c3ncc(F)c(N4CCCC4)n3)C1)CC2 1704303302 GPOHPDQXPCFAKD-NRFANRHFSA-N 397.502 2.556 0 50 GFAA CO[C@@H]1C[C@H](C(=O)N2CCC(CCC(=O)Nc3ccccc3)CC2)CC[C@@H]1O 1704353304 MKRZNNDIFAYCTH-YZGWKJHDSA-N 388.508 2.820 0 50 GFAA CCC[C@H](NC(C)=O)C(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704303304 GSCKPAUQSMPKTA-IBGZPJMESA-N 383.492 2.863 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)cc1 5683686 NQUVGZINHYSSAM-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA O=C(Nc1nnc([C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)s1)[C@H]1CCCO1 12862854 OBYZZRVZLAMFDR-GXFFZTMASA-N 392.868 2.830 0 50 GFAA CCCS(=O)(=O)N1CCC[C@@](Cc2ccc(F)cc2F)(C(=O)OCC)C1 14950439 UPNUICQUWTYHQN-SFHVURJKSA-N 389.464 2.892 0 50 GFAA COc1cc(CNCC(C)(C)OC)ccc1OC[C@H](O)CN1CCCCCC1 15073188 ALMPANGZQVJYNR-LJQANCHMSA-N 394.556 2.826 0 50 GFAA O=C(Cc1ccc(F)cc1)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169780305 GMNYLJIKRISTIU-UHFFFAOYSA-N 382.361 2.962 0 50 GFAA CCn1c(C)ccc(C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)c1=O 1857710741 MXTQAPWPNGBZMV-UHFFFAOYSA-N 390.487 2.818 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(O)c3)C[C@]23CC[C@H]1O3)c1ccccc1 1857720094 DLSNLQOVQFNQHC-ZZLPTCMGSA-N 378.472 2.802 0 50 GFAA CCn1ccnc1CN(C(=O)c1ccc2c(c1)CCN2)[C@H]1CC12CCNCC2 435575302 QKKKEJIFICSFGG-IBGZPJMESA-N 379.508 2.656 0 50 GFAA CCN(CC)C(=O)c1cn([C@H]2CCCN(Cc3ccc(NC(C)=O)cc3)C2)nn1 14976839 KYYJNJCKBCKUGO-IBGZPJMESA-N 398.511 2.556 0 50 GFAA CCCn1ncc(CN2C[C@@H]3OC(=O)N(CCc4ccc(F)cc4)[C@@H]3C2)c1C 247813529 BBRWLWYPWXJVGW-UXHICEINSA-N 386.471 2.988 0 50 GFAA C[C@@H]1C[C@H](NC(=O)c2cc(Cl)nn2-c2ncccc2Cl)c2ncnn21 1875294080 MCTJRCZLWGQTME-SCZZXKLOSA-N 378.223 2.601 0 50 GFAA O=C(N[C@H]1CCNC1)c1ccc(N2CCc3c(cccc3C(F)(F)F)C2)nc1 1875319121 ZRGHMTHQNCJDCH-HNNXBMFYSA-N 390.409 2.755 0 50 GFAA O=S(=O)(NCCc1cccc(OCc2ccccc2)c1)c1ccc(O)cn1 1875323019 SATQAHDRAPIPHD-UHFFFAOYSA-N 384.457 2.887 0 50 GFAA C[C@H]1CN(C(=O)c2cnc3cc[nH]c3c2)CC[C@H]1NC(=O)c1coc(C2CC2)n1 1875333658 GLSBMFSATUDKBC-SWLSCSKDSA-N 393.447 2.709 0 50 GFAA CCc1nc(CN2CCC[C@@H](NC(=O)NCc3cccc4occc34)C2)no1 888101297 HPDOGPXGWWRFKU-OAHLLOKOSA-N 383.452 2.842 0 50 GFAA NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)c1cc2cc(C(F)(F)F)ccc2c(=O)o1 2325797329 AINBSFMEHRKFSL-FMSQNYNMSA-N 394.349 2.538 0 50 GFAA COc1cccc(NC(=O)Cn2cnc3ccc(Br)cc3c2=O)c1 630052 DMURTUVZNSJSGC-UHFFFAOYSA-N 388.221 2.806 0 50 GFAA CN(c1ccc(C(=O)NCc2ccncc2)cc1)S(=O)(=O)c1ccccc1 969716 UGHNACFBQXPGGD-UHFFFAOYSA-N 381.457 2.837 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@@H]1c1cccc(OC)c1OC 1057772 LXBUQFNLBKQEEU-OAHLLOKOSA-N 376.434 2.527 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)NC2CCOCC2)CC[C@H]1NC(=O)Nc1ccccc1C 2356163739 PECWBUBBJCLLOI-KFKAGJAMSA-N 389.496 2.595 0 50 GFAA COCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(Cl)c3)C2)s1 4975660 CAAHBLRWGAXZKE-JTQLQIEISA-N 380.857 2.638 0 50 GFAA C[C@H](C(=O)N1CCC[C@@H](c2nncn2C)C1)N1CCC(Cc2ccccc2)CC1 110627563 ZBAUGVKVBCALNK-WIYYLYMNSA-N 395.551 2.864 0 50 GFAA Cc1ccc(NC(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)c(Cl)c1 9875238 OWILCHVONOSBDJ-UHFFFAOYSA-N 378.904 2.986 0 50 GFAA COC[C@@H](C)NC(=O)C1CCN(Cc2cnc(-c3cccc(C)c3)nc2)CC1 55309112 CXGXOAACLGPFKM-QGZVFWFLSA-N 382.508 2.815 0 50 GFAA COc1ccc2c(C)cc(N3CCC[C@H](Cn4cc(C(=O)O)nn4)C3)nc2c1 67955848 ZAVISBILIDDGKQ-AWEZNQCLSA-N 381.436 2.758 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3csc(C(C)=O)c3)C2)CC1 20209481 DYRFTDKXQKFLSB-QGZVFWFLSA-N 379.526 2.689 0 50 GFAA CC(C)(CNC(=O)c1csc2nc(-c3ccccc3)cn12)N1CCOCC1 20202996 MDXZQAYWXJXZIB-UHFFFAOYSA-N 384.505 2.903 0 50 GFAA O=C(NCCc1ccccn1)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252497773 QPKDASHLIJWGRZ-UHFFFAOYSA-N 388.493 2.667 0 50 GFAA CCO[C@H]1[C@H](NC(=O)c2cnn(C(C)C)c2)c2ccccc2C12CCNCC2 72120654 ZNFBVZMQHYABTM-UXHICEINSA-N 382.508 2.975 0 50 GFAA Cn1ccnc1-c1cccc(NC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1 150898464 DNMIMWWVPSPNCZ-UHFFFAOYSA-N 384.461 2.812 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)CC1 367641537 DLTFPOYIHYSTDB-QGZVFWFLSA-N 389.544 2.892 0 50 GFAA CNC[C@H]1CCCN(C(=O)c2cnn(-c3cccc(Br)c3)c2)C1 237084684 XZEZNQDPXNQUGA-CYBMUJFWSA-N 377.286 2.706 0 50 GFAA CC(C)N1C(=O)[C@@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C(=O)N=C1S 229811265 OWICDEKJFINHEP-KBXCAEBGSA-N 377.897 2.914 0 50 GFAA COc1ccc(CCC(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)c(OC)c1OC 240540874 GPWLENJHLDOFTK-OAGGEKHMSA-N 391.464 2.889 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)N2CCC[C@H](n3cncn3)C2)C[C@@H](C)O1 175287349 CITIFVOLDHOWJS-BBWFWOEESA-N 384.484 2.761 0 50 GFAA CCOc1cc(NC2CCN(C(=O)c3ccnc4ccncc34)CC2)ncn1 287757456 GOLIZLJMHKVBKR-UHFFFAOYSA-N 378.436 2.535 0 50 GFAA Cc1cc(O)nc(CCNC(=O)N2CCC[C@H](COc3ccccc3C)C2)n1 426405785 UOZPINCWABWMGK-KRWDZBQOSA-N 384.480 2.842 0 50 GFAA C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)Nc1ccccc1N(C)S(C)(=O)=O 288820102 NXDCTSCGTPGQSI-YVEFUNNKSA-N 375.450 2.726 0 50 GFAA NC(=O)c1cccnc1N1CCC(Oc2ccc3ccccc3c2)(C(=O)O)CC1 82108233 QAPBBQNCQVIBQM-UHFFFAOYSA-N 391.427 2.836 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N(C)Cc3cnn(C)c3C)c2n1 20602218 APZLOANXRQJTTQ-UHFFFAOYSA-N 394.401 2.767 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(c2ncc(C(=O)O)cc2Cl)C1 95525172 PFOUSISZANIZGL-ZDUSSCGKSA-N 377.876 2.575 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)C2CC2)C1)N1CCN(Cc2ccccc2)CC1 95508052 HIYVVPVUEKEHQE-FQEVSTJZSA-N 383.536 2.760 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC(=O)C2CCCCCC2)CN1Cc1ccc(C)o1 95520394 CCSPDLLSHZMOLQ-MJGOQNOKSA-N 375.513 2.754 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1 92066609 DHSHGBFVEIECQE-FQEVSTJZSA-N 384.520 2.948 0 50 GFAA O=C1N[C@@H]2c3ccc(I)cc3C(=O)N2c2ccccc21 252498164 QVPUQBUYBIBJDE-ZDUSSCGKSA-N 376.153 2.694 0 50 GFAA COC(=O)C[C@@H](c1cc(OC)c2c(c1)OCO2)c1oc2ccccc2c(=O)c1O 253399928 DLLBXQDCBXWOEV-ZDUSSCGKSA-N 398.367 2.931 0 50 GFAA biogenic CN1C(=O)COc2cc(NC(=O)N3CCO[C@@H](c4ccc(F)cc4)C3)ccc21 374181661 COYZGJZOSMMEPC-GOSISDBHSA-N 385.395 2.786 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N(C)Cc3n[nH]c4c3CCCCC4)cn12 1940195806 OAXQFMBKVQSSEU-IBGZPJMESA-N 396.495 2.683 0 50 GFAA Cc1cccc2[nH]c(C3CCN(C(=O)c4cc5n(n4)CCCN(C)C5)CC3)nc12 67513480 TVVRXEJVRMQDIE-UHFFFAOYSA-N 392.507 2.923 0 50 GFAA CC(C)=CCN1CCC2(CC[C@H](CNC(=O)N(C)Cc3ccon3)O2)CC1 584888857 PECVOYXAFJMIHT-GOSISDBHSA-N 376.501 2.796 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)cc1N1CCNC1=O 670472378 ACYCOYMBZFDSON-QGZVFWFLSA-N 398.532 2.981 0 50 GFAA O=C(Nc1ccccc1CN1CCCC1)c1cn(CC[C@H]2CCCCN2)nn1 952991535 UEPREHKBVLSNFP-GOSISDBHSA-N 382.512 2.658 0 50 GFAA C[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H](CC(=O)O)C(=O)N1 958528070 TXUUSELCFZFGJP-ORAYPTAESA-N 394.427 2.599 0 50 GFAA Cc1c(Cl)c(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2cscn2)C3)nn1C 1565511631 ZFJUXRISOKTUDT-OCCSQVGLSA-N 379.917 2.575 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)N(C)c3ccccc3C(=O)O)cc2C[C@@H]1C 274962625 VEOTWDBNCVDAOF-LBPRGKRZSA-N 388.445 2.507 0 50 GFAA Cc1ccc2c(CC(=O)N3CC[C@@H](N(C)Cc4nccc(N)n4)C3)coc2c1C 275698243 NGTBBHUEJDEQSC-QGZVFWFLSA-N 393.491 2.697 0 50 GFAA C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NCc2ccc(CN3CCOCC3)o2)c1 170595045 FJTNXWLLSIWFJC-QRWLVFNGSA-N 397.475 2.636 0 50 GFAA CCN(CC(=O)N1CCC(S(=O)(=O)CC)CC1)Cc1ccc(Cl)cc1 170614949 LZCLXAVCMQTCJR-UHFFFAOYSA-N 386.945 2.588 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cccc2c1OC(C)(C)C2 192640924 WZCLGIACAPETNA-CQSZACIVSA-N 390.509 2.928 0 50 GFAA CCCN(CC)c1ccc(C(=O)N2CCC[C@@H](c3nc(N(C)C)no3)C2)cn1 194446221 WMASSIOBZVSVHA-MRXNPFEDSA-N 386.500 2.787 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCN(CCc3ccccc3)CC2)CC1 1506417115 NTNWROUEGWMXJL-UHFFFAOYSA-N 378.520 2.547 0 50 GFAA O=C(Nc1ccccc1I)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 219628502 JHFKWZDIPKUACZ-WTTBSCSTSA-N 383.185 2.753 0 50 GFAA CCc1ccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)s1 1529189119 HEIGIQQZXFPRHM-IEBWSBKVSA-N 391.489 2.902 0 50 GFAA Cc1ncc(CN(CCO)C(=O)c2cc3c(-c4ccccc4)nn(C)c3s2)[nH]1 1704305580 LQBUMIUFZBCVSZ-UHFFFAOYSA-N 395.488 2.968 0 50 GFAA COc1cc(CN2C[C@@H]3CNC(=O)C[C@@H]3C2)ccc1OCc1cccc(F)c1 1800410708 ZHPWORUBZICAMN-MSOLQXFVSA-N 384.451 2.981 0 50 GFAA Cc1cc2occ(CC(=O)N3C[C@@H]4COCC[C@]4(C(=O)O)C3)c2cc1Cl 1772710818 PKFZHPNIWOYWCB-YJYMSZOUSA-N 377.824 2.887 0 50 GFAA COCCc1nc2ccc(C(=O)NCCc3nc(C)c4c(n3)CCC4)cc2o1 12223889 BTUKUBPGCFVEMI-UHFFFAOYSA-N 380.448 2.576 0 50 GFAA COc1ccccc1CCC(=O)NCc1nnc(SCc2ccccn2)n1C 12243597 CCJODYFBSQPCQC-UHFFFAOYSA-N 397.504 2.760 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@H](C(=O)c2ccccc2SC)C1 13595546 XLQYAEQWOWJONN-AWEZNQCLSA-N 378.494 2.966 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@H]1C(=O)Nc1cccc(-n2cccn2)c1 15068849 AJBDMQOMLDFGSC-KRWDZBQOSA-N 379.420 2.720 0 50 GFAA COc1cc(CNC(=O)c2ccc3c(c2)N(C)[C@H]2CCCN2C3=O)cc(OC)c1 169766048 LXIDZPQMTZJRIF-HXUWFJFHSA-N 395.459 2.646 0 50 GFAA CCn1ccnc1CN1CCC2(CC1)CN(Cc1ccccc1)C[C@H]2C(=O)O 1857686159 KGGRGNYMSMHLBF-IBGZPJMESA-N 382.508 2.702 0 50 GFAA COc1ccc(N2CCN(CC(=O)Nc3ccc(Cl)cc3F)CC2)cn1 1857689558 SITCWZVOALLTFB-UHFFFAOYSA-N 378.835 2.643 0 50 GFAA Cn1cc(CC(=O)N[C@@H]2[C@H]3CC[C@@H]2CN(C[C@H]2CCOC2)C3)c2ccccc21 1857694784 XKEWLGLKXPKKIV-ZHSNQQFMSA-N 381.520 2.584 0 50 GFAA O=C(O)CCN(C(=O)c1cnn(Cc2ccccc2Cl)c1)C1CCOCC1 238080136 AKBJGOKLEUPLRL-UHFFFAOYSA-N 391.855 2.681 0 50 GFAA Cc1cc(Br)cc(C)c1NC(=O)C(=O)N1CCOC2(CCC2)C1 161643628 CAYRZDOOZDYNHM-UHFFFAOYSA-N 381.270 2.786 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)[C@@]1(C)CC1(F)F 817731168 WRMMGFSKIHJZIV-YMTOWFKASA-N 397.827 2.604 0 50 GFAA C[C@H](c1ccccn1)N(Cc1ccccc1)C(=O)CNC(=O)c1ncccc1O 1875254642 FBDSARPZSBHCGN-MRXNPFEDSA-N 390.443 2.702 0 50 GFAA Cc1cc(CCC(=O)N[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)no1 1875402434 GMLYGIPANNBVPH-PWIZWCRZSA-N 394.475 2.735 0 50 GFAA Nn1c(COc2ccccc2)nnc1SCc1cc(=O)[nH]c2ccccc12 8762911 OWQGYUUOWNNYSN-UHFFFAOYSA-N 379.445 2.705 0 50 GFAA COc1cccc(-c2cnc(NC(=O)CCS(=O)(=O)c3ccccc3)[nH]2)c1 2100482802 ZWTDYWIFONNLFV-UHFFFAOYSA-N 385.445 2.888 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Sc1cnn2c1CNCC2 2325777153 IGDPECMUKVKWKR-OAHLLOKOSA-N 396.520 2.908 0 50 GFAA Cc1ccccc1C(=O)Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1 1214557 SGLKCAQXQAFCPO-UHFFFAOYSA-N 390.443 2.905 0 50 GFAA O=C(NCc1cccc(F)c1)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 1345750 DTFGSJBJTWHAIO-UHFFFAOYSA-N 390.480 2.684 0 50 GFAA CCCN1CCC[C@@]2(CCCN2Cc2cc(=O)n3cc(Cl)ccc3n2)C1=O 2356134950 JVWVUFYTIJJVJF-HXUWFJFHSA-N 388.899 2.715 0 50 GFAA O=C(c1cnc2cccnn12)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356153074 QAKYRRPGJHFRIV-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C(=O)c2c[nH]nc2C2CCCCC2)C1 2356159603 IUAHEUKIJKZWBK-OAQYLSRUSA-N 380.496 2.780 0 50 GFAA O=S(=O)(Nc1nc2ncccn2n1)c1cc(C(F)(F)F)ccc1Cl 225550303 AOLWHGFBYFPEIR-UHFFFAOYSA-N 377.735 2.597 0 50 GFAA COCc1nnc(NC(=O)C2CCN(C(=O)c3ccc(Cl)cc3)CC2)s1 9426655 RLPFMMOBNKUNRG-UHFFFAOYSA-N 394.884 2.829 0 50 GFAA CN(Cc1nc(-c2ccc3c(c2)OCO3)no1)C[C@H]1COc2ccccc2O1 55166158 WFDWZUDETMIYGL-AWEZNQCLSA-N 381.388 2.737 0 50 GFAA COc1ccc([C@@H]2CC(=O)Nc3cc4c(cc32)oc(=O)n4C)c(OC)c1OC 65407972 MWVYEOGHZOOBNU-NSHDSACASA-N 384.388 2.631 0 50 GFAA Cn1c(CNC(=O)c2cc(COc3cccc(F)c3)[nH]n2)nc2ccccc21 67820287 HOCURIPKRPSUNI-UHFFFAOYSA-N 379.395 2.945 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN(C)CCc3cn[nH]c3)C2=O)cc1 67981737 YUGCANHZBLLZKN-QFIPXVFZSA-N 384.524 2.561 0 50 GFAA CN1C(=O)C[C@@H](c2nc(-c3nc[nH]n3)no2)[C@H]1c1ccc(Cl)c(Cl)c1 350191234 NHKUEHYIOREKBM-PRHODGIISA-N 379.207 2.849 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(OC)cc3F)[C@H](CCO)C2)o1 39421084 OHWOUXUCIKGUEQ-QGZVFWFLSA-N 392.471 2.643 0 50 GFAA CS(=O)(=O)Nc1ccc2c(c1)NC(=O)C[C@H]2c1ccc2cccc(O)c2n1 65369990 PSAHTYCLCNXQPU-CQSZACIVSA-N 383.429 2.786 0 50 GFAA CCOC(=O)c1sc(NC(=O)/C=C/c2cnn(C)c2)c(C(=O)OCC)c1C 656649 UZOJHFYKOJSPPI-BQYQJAHWSA-N 391.449 2.795 0 50 GFAA COc1cc(C(=O)N2N=C(C3CC3)C[C@@]2(O)C(F)(F)F)cc(OC)c1OC 1011983 YKBOURJNDBIUSA-MRXNPFEDSA-N 388.342 2.575 0 50 GFAA Cc1nn(CC(=O)Nc2ncc(Br)s2)cc1Br 2782510 WLQWLJAQPIOZSE-UHFFFAOYSA-N 380.065 2.812 0 50 GFAA COCCN(C)c1ccc(CN[C@@H](CN2CCCC2=O)c2ccccc2)cn1 252482759 DNFQILXJUIVHIV-FQEVSTJZSA-N 382.508 2.618 0 50 GFAA CCn1c([C@H]2OCC[C@H]2c2ccccc2)nn(Cc2noc(C(C)C)n2)c1=O 328649330 UYYXDQVQXHKPST-RDJZCZTQSA-N 383.452 2.865 0 50 GFAA Cc1n[nH]c(C)c1CNc1ccc(C(=O)N2CCC(Cn3cccn3)CC2)cn1 71589713 IWDCKIHJSZIBAJ-UHFFFAOYSA-N 393.495 2.783 0 50 GFAA C[C@H](C(=O)N1C[C@@H]2CCCN(C(=O)[C@H](C)c3cccnc3)[C@@H]2C1)c1cccnc1 330066378 SUUVORBJYSYJRP-KJNZLNQQSA-N 392.503 2.833 0 50 GFAA C[C@H]1CN(Cn2nc(-c3cccs3)n(C[C@H]3CCCO3)c2=S)CCO1 242140860 WPXAPKQUKKRRNY-UONOGXRCSA-N 380.539 3.000 0 50 GFAA O=C(Nc1ccc(CN2CCCC2=O)cc1)[C@@H]1CC(=O)N(c2ccccc2F)C1 363370662 NLQZYHLJIGJMRQ-MRXNPFEDSA-N 395.434 2.940 0 50 GFAA O=C(Nc1ccc(-n2cccn2)c(F)c1)[C@@H]1CCCN(C(=O)c2ccncc2)C1 172840637 IIJQZGFXPMKXDZ-MRXNPFEDSA-N 393.422 2.897 0 50 GFAA O=C1CCCc2nc(O)c(C(=O)N3CCNC[C@@H]3c3ccccc3Cl)cc21 261702890 DDLUDLWEYKRQEL-QGZVFWFLSA-N 385.851 2.746 0 50 GFAA CC[C@@H]1CCCCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 13545231 ISCJFBDBTWHHTC-MRXNPFEDSA-N 394.537 2.894 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@H]1CCCN(Cc2cc(=O)[nH]c(=O)[nH]2)C1 71681372 GGRPJYMXTSQYHO-IBGZPJMESA-N 389.455 2.825 0 50 GFAA Cc1cnn(C[C@@H]2CN(C(=O)c3ccccc3NCc3cccnc3)CCO2)c1 176145164 ILJWOQSEGOXPJX-IBGZPJMESA-N 391.475 2.740 0 50 GFAA O=C(NCc1cccc(CN2CCCC2)c1)Nc1cccc(-n2cnnn2)c1 43524466 DHGIEOPGSQNASW-UHFFFAOYSA-N 377.452 2.580 0 50 GFAA COCc1nc(C2CC(N)C2)cc(N(C)CCc2nc3c(C)cccc3[nH]2)n1 223863116 VBFDUKRGQABRJZ-UHFFFAOYSA-N 380.496 2.691 0 50 GFAA CN(C(=O)c1cccc(-c2nc3ccccc3n2CCO)c1)C1CCOCC1 426361853 XGGMPMDRTIXFMV-UHFFFAOYSA-N 379.460 2.947 0 50 GFAA CC(C)CN1CCc2[nH]cnc2C12CCN(C(=O)c1ncc(F)cc1F)CC2 95518705 CNXOXIUYFHSKSD-UHFFFAOYSA-N 389.450 2.729 0 50 GFAA COC[C@@H](NC(=O)N1CCN(c2cccc(O)c2)CC1)c1ccc(F)c(F)c1 179954029 ATNOMSBTVAQYGX-LJQANCHMSA-N 391.418 2.890 0 50 GFAA Cc1ccc2[nH]c([C@H]3CCCN(S(=O)(=O)CC4CCOCC4)C3)nc2c1 182495695 HTNYFXSIEHZUKJ-INIZCTEOSA-N 377.510 2.807 0 50 GFAA CNC[C@H]1CCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 299738860 HJXMNYDKKVXNGY-CQSZACIVSA-N 381.314 2.565 0 50 GFAA CCN(C(=O)NCCc1cccc(C(N)=O)c1)[C@H]1CCN(Cc2ccccc2)C1 184610771 LEDOBYCIFAZTEU-NRFANRHFSA-N 394.519 2.634 0 50 GFAA Cc1c(CNC2CCN(Cc3ccccn3)CC2)c2ccccc2n1CC(N)=O 55404711 QKUOKGDXOJXYJG-UHFFFAOYSA-N 391.519 2.584 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)[C@H]2CCCN2c2nc(C)c3ccccc3n2)C1 299784750 HLUUTIVYPMHBQQ-QFBILLFUSA-N 396.491 2.709 0 50 GFAA COc1ccc(NC(=O)c2cc3ccccc3c(=O)s2)cc1-c1nn[nH]n1 824745573 LWWGHJPAMYAFBF-UHFFFAOYSA-N 379.401 2.703 0 50 GFAA Cc1cnc2c(C(=O)N3CCN(c4nsc5ccccc45)CC3)cnn2c1 670458255 QTJQNDPOGXZEHS-UHFFFAOYSA-N 378.461 2.610 0 50 GFAA Cc1nccn1Cc1ccccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 952968670 NYVDGZLADYOFJA-GOSISDBHSA-N 389.459 2.622 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCC(N2CCSCC2)CC1 1506428113 WTWWCDHBLMIBJW-UHFFFAOYSA-N 384.567 2.514 0 50 GFAA O=C1NC(=O)/C(=C\c2ccc(OS(=O)(=O)c3ccc(F)cc3)cc2)S1 2099425 GMZIDDFNZLDBGC-NTEUORMPSA-N 379.390 2.917 0 50 GFAA COc1ccc(-c2noc([C@@H](C)Nc3cncc(C(=O)N4CCCC4)n3)n2)cc1 1704278298 RNEFUUUKZAWNHX-CYBMUJFWSA-N 394.435 2.944 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H]1COC[C@H]1Cc1ccncc1 1704352212 VJNBUCCHLTXNSX-QUCCMNQESA-N 377.444 2.961 0 50 GFAA O=C(CCC1CCN(C(=O)c2n[nH]c3ccccc23)CC1)NCc1cccnc1 12438747 ZMPMKRAESFLOLS-UHFFFAOYSA-N 391.475 2.907 0 50 GFAA CN(Cc1ccco1)[C@@H]1CCc2c(c(C(=O)NCCc3ccccc3)nn2C)C1 14733296 DQUNUUFZNAEGAM-GOSISDBHSA-N 392.503 2.975 0 50 GFAA Cc1cccc2nc(C(=O)N3CCN4C(=O)OC[C@@]4(Cc4ccccc4)C3)cn12 1857671616 LNPNGYDFRQWCJI-JOCHJYFZSA-N 390.443 2.532 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(Cc3nc(-c4ccco4)no3)CCN12 1857682666 LKMIEGKZBGOGJR-HXUWFJFHSA-N 380.404 2.579 0 50 GFAA CC(C)SCC(=O)N1CCC2(CC1)CN(Cc1ccccc1)C[C@H]2C(=O)O 1857691299 DUTDWJPSFGNHCY-SFHVURJKSA-N 390.549 2.953 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1857721987 BFOSJYVXPZHNGY-IERDGZPVSA-N 399.454 2.696 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCN(C)C(C)C)C3)nc2c1 1857728489 DDSNJUZJPANMRU-MRXNPFEDSA-N 388.512 2.899 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1F)N1CCC[C@H](C(=O)N2CCOCC2)C1 366174903 RJHOPHXICIRKIE-LBPRGKRZSA-N 388.361 2.556 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)[C@H](C)Oc2cccc(CO)c2)CC1 161684044 RXAIHSICZPSZBP-KRWDZBQOSA-N 396.487 2.676 0 50 GFAA O=C1CCCN1CC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704306015 ZFDJBAHNPCTUPH-HSZRJFAPSA-N 390.487 2.572 0 50 GFAA Cc1sc2nc(CCC(=O)N3Cc4ccccc4[C@H](N)C3)nc(O)c2c1C 1875292427 HYHFANADFQXDKS-OAHLLOKOSA-N 382.489 2.989 0 50 GFAA CC[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)OCc1nnc2c(=O)[nH]ccn12 1875270164 DYLDEXOJPCHOHT-HNNXBMFYSA-N 384.436 2.616 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccccc1COC)C[C@H](C)O[C@@H]2C 1875315768 GSRQKMBHKZDHNC-LSDHHAIUSA-N 387.480 2.628 0 50 GFAA CC(=O)N1C[C@@H]2CCC[C@@H](NC(=O)c3cc(C(F)(F)F)nn3C3CC3)[C@H]2C1 1875311226 QVBACEYKSSYMSE-FPMFFAJLSA-N 384.402 2.614 0 50 GFAA CC12CC(C(=O)O)(C1)C1(CCN(C(=O)[C@]3(c4ccccc4)CCCO3)CC1)O2 1875392895 YVOBJJDGPHVZCN-QETWGEEDSA-N 385.460 2.707 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)NCCCc1c(C)noc1C 1875392990 CFSJKPMALLODCP-NBHGPNQESA-N 386.496 2.551 0 50 GFAA O=C(CCc1ccccc1OC(F)(F)F)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875402468 HNJSQBOKZQNJNH-FVQBIDKESA-N 397.397 2.670 0 50 GFAA Cn1c(=O)cc(N2CCC(c3ccccc3)CC2)n(Cc2ccccc2)c1=O 1775988949 TYCPPJUDPZIGBY-UHFFFAOYSA-N 375.472 2.979 0 50 GFAA Cc1c(C(=O)O)cccc1S(=O)(=O)N1CCN(Cc2ccccc2)[C@@H](C)C1 396362715 JXBCLWDSHLWVKC-HNNXBMFYSA-N 388.489 2.588 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccccc2NC(=O)c2ccc(F)cc2)CC1 4580105 UBQPWAVBBPMWLE-UHFFFAOYSA-N 399.422 2.992 0 50 GFAA CN1C(=O)N(c2cnn(C3COC3)c2)C(=O)[C@H]1c1cccc(Cl)c1Cl 2325791992 QWWNBLCJBVJATJ-CQSZACIVSA-N 381.219 2.901 0 50 GFAA O=C(O)[C@H](Cc1csc(Br)c1)NC(=O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 2325875919 FTEPQQCFVSEAMR-QXMWZZNTSA-N 384.295 2.915 0 50 GFAA O=C(NCc1ccc(-c2nn[nH]n2)cc1)[C@H](Cc1cccnc1)C1CCCC1 865592810 BUSDUOUOHOZRBN-LJQANCHMSA-N 376.464 2.927 0 50 GFAA COc1ccc(NC(=O)C2CCC(N3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)CC2)cc1 100619299 YSUCNGMRMPFCKW-QAIBAJANSA-N 394.471 3.000 0 50 GFAA O=C(c1cc(C2CC2)n[nH]1)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67946244 ZWOXCZXHNCMLNY-UHFFFAOYSA-N 378.388 2.869 0 50 GFAA CCc1ccc(-c2cn3c(C(=O)NCCc4cc(=O)[nH]cn4)csc3n2)cc1 67789736 PNQOKMHFYSHOGX-UHFFFAOYSA-N 393.472 2.681 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 32095572 XHXRQSMUABFFEO-GOSISDBHSA-N 395.478 2.959 0 50 GFAA CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1cccc(OC)c1O 623392 VUWKVKXVCUAYAR-UHFFFAOYSA-N 375.421 2.762 0 50 GFAA biogenic COCc1nc2ncc3c(=O)n(-c4cccc(Cl)c4Cl)ccc3n2n1 71376169 URZLXWYVQRWWLA-UHFFFAOYSA-N 376.203 2.882 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@@H]1CCCN(Cc2c[nH]c(=O)[nH]c2=O)C1 71439949 ILEOKZYYGBHKGP-LJQANCHMSA-N 389.455 2.825 0 50 GFAA CC(C)c1nc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)c2cnn(C)c2n1 72144467 FFOUOYLYHOTPQE-UHFFFAOYSA-N 394.479 2.538 0 50 GFAA O=C(c1nc2ccccn2c1-c1ncc[nH]1)N1CCN(C2CCCCC2)CC1 71746376 NYVNOCGDAPQCHV-UHFFFAOYSA-N 378.480 2.815 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@@H](C)C[C@H](O)C[C@H]1C)c1ccc2c(c1)OCCCO2 241644367 PQESKIOZKOMVCP-UTAOTPEMSA-N 390.524 2.895 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCc1cnn(-c2ccccc2)c1 238027403 JFZLRGIZSAYXNZ-HXUWFJFHSA-N 375.428 2.843 0 50 GFAA CC(=O)N1CCc2cc(C(=O)Cn3nc(-c4cccs4)ccc3=O)ccc21 44893367 PNGGUBKINKWLBK-UHFFFAOYSA-N 379.441 2.764 0 50 GFAA Cc1cc(C)n2c(C(=O)N3CCC[C@@H]3c3nc4ccccc4n3C)nnc2n1 222928341 CWIXFZLKHAGXPN-MRXNPFEDSA-N 375.436 2.605 0 50 GFAA Cc1cc(O)nc(NCCNC(=O)NC(C)(C)C23CC4CC(CC(C4)C2)C3)n1 426596434 FAPSFIRZJBCLNA-UHFFFAOYSA-N 387.528 3.197 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@@H]3CCCOc4ccccc43)CC2)n1 176172568 BGZDXENSHMAUMK-OAHLLOKOSA-N 387.509 2.846 0 50 GFAA Cc1cc(N2CCC(NC(=O)NCCc3ccc4c(c3)CCO4)CC2)nc(C)n1 176219696 WABAYCHMGKDLIM-UHFFFAOYSA-N 395.507 2.539 0 50 GFAA CCN1CCN(S(=O)(=O)c2ccc(Br)c3ccccc23)CC1 230553887 SHXDNZCARAJPHK-UHFFFAOYSA-N 383.311 2.929 0 50 GFAA C[C@H](Cn1cccn1)C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95511705 XAVVZFXZVHZDJL-QGZVFWFLSA-N 378.480 2.565 0 50 GFAA Cc1ccc(-c2nnc(CN3CCC4(CC3)CC(=O)N(CC(C)C)C4)o2)n1C 92039024 MFVVJRJSFDPGCS-UHFFFAOYSA-N 385.512 2.854 0 50 GFAA CN(C)c1cccc(CNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1 179182058 PGYJFGLPZSYKFX-UHFFFAOYSA-N 381.524 2.859 0 50 GFAA Cc1cccc(N2CCN(C(=O)Nc3cc(-c4cccnc4)nn3C)CC2)n1 95510837 GGIQPMKKLYACPO-UHFFFAOYSA-N 377.452 2.540 0 50 GFAA CS(=O)(=O)c1cc(C(=O)NCC2CCN(Cc3ccccc3)CC2)cs1 179794280 URKNVPGFJXTCFL-UHFFFAOYSA-N 392.546 2.794 0 50 GFAA CCc1nnc(CNC(=O)Nc2ccc3c(c2)CCCN3C(=O)OC)s1 299776935 FZMYGLOHCOIZFK-UHFFFAOYSA-N 375.454 2.941 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)CCn2c(C)nc3ccccc32)CC1 827948427 MGOIIOFQKHCLMF-UHFFFAOYSA-N 377.492 2.783 0 50 GFAA CC(C)[C@@H](CNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F)N1CCCC1 670453641 CAAJOBOOXMPDGV-CQSZACIVSA-N 392.880 2.576 0 50 GFAA CN(Cc1nc(O)c2sccc2n1)C(=O)[C@@H]1CCCN(Cc2ccco2)C1 952976070 ULALLFOCXNHHSQ-CYBMUJFWSA-N 386.477 2.861 0 50 GFAA CC(C)N1CCN(C2CCN(C(=O)[C@H](C)Oc3cccc(F)c3)CC2)CC1 270958248 UPSILMPAIUOUNY-KRWDZBQOSA-N 377.504 2.610 0 50 GFAA NCCCOC1CCN(C(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)CC1 170677270 WDBYFGQCRCTTLM-UHFFFAOYSA-N 398.385 2.725 0 50 GFAA CCS(=O)(=O)NC1CCN(C(=O)NCCc2csc3ccccc23)CC1 193373202 PBNDPLCOIASWCN-UHFFFAOYSA-N 395.550 2.557 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3cnn4cc(C)cnc34)CC1)OCC2 1704297896 ALXMVWVZMVTAOI-UHFFFAOYSA-N 392.459 2.751 0 50 GFAA O=C(COc1ccccc1Cl)N[C@@H]1CC(=O)N(Cc2ccc(F)cc2)C1 12072770 MBTJKYUBGMHDII-OAHLLOKOSA-N 376.815 2.775 0 50 GFAA C[C@@]1(C2CCN(C(=O)c3ccco3)CC2)NC(=O)N(Cc2ccc(F)cc2)C1=O 12245627 YCIYUDBFRJRCCY-NRFANRHFSA-N 399.422 2.782 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C3CCN(C(C)=O)CC3)CC2)cc1 12437451 AOXUKNMXIHANMR-UHFFFAOYSA-N 387.568 2.892 0 50 GFAA Cc1ccc2oc(C(=O)N3CCC(C(N)=O)(N4CCCCC4)CC3)c(C)c2c1 12439520 INDAOJMAGSFCIA-UHFFFAOYSA-N 383.492 2.996 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2)CN(C(=O)c2cccnc2)CC1=O 14535026 NQCSXHJUSMLCLS-FQEVSTJZSA-N 381.476 2.607 0 50 GFAA Cn1c(CCNC(=O)/C=C/c2cccs2)nnc1SC[C@@H]1CCCO1 14995283 TUKGHLBLVOQDGL-YBJDMEARSA-N 378.523 2.520 0 50 GFAA Cc1nc(N2CCCCCCC2)ncc1[C@@H](C)NC(=O)CCN1CCCC1=O 14970112 QAVDOVYIIQYQFO-MRXNPFEDSA-N 387.528 2.745 0 50 GFAA Cc1ncsc1CCNC(=O)[C@@H]1CCCN(C2CCN(C(C)C)CC2)C1 19229351 DHMCSSWTNFXDHO-QGZVFWFLSA-N 378.586 2.695 0 50 GFAA Cc1ccc(OC[C@@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c(C)c1 19363149 GBONNEDZOONZNC-FQEVSTJZSA-N 398.503 2.590 0 50 GFAA CN1CCC(N2CCN(Cc3ccccc3-c3ccco3)C[C@@H]2CCO)CC1 19635447 RXGPNCQDPIHIMH-NRFANRHFSA-N 383.536 2.909 0 50 GFAA Cc1ccccc1[C@@H]1CC(=O)c2c(C)nc(N3CCC(C(N)=O)CC3)nc2C1 19957386 KTFJUNJSALZAGN-INIZCTEOSA-N 378.476 2.708 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@@H]1CC(=O)N(c2nccs2)C1 1857710832 ROBMEVNGTOLVLT-CQSZACIVSA-N 382.445 2.810 0 50 GFAA Cc1cc(C)c2nc(C)cc(C(=O)N3CC[C@@]45OCCCN4C(=O)C[C@@H]35)c2c1 1857723545 KONFMJDZIKZXSR-GCJKJVERSA-N 379.460 2.723 0 50 GFAA COc1ccc([C@H]2CCNC[C@H]2NC(=O)N2CCOC3(CCCCC3)C2)cc1 333730374 VZNSLLARKNZYHZ-WOJBJXKFSA-N 387.524 2.885 0 50 GFAA CC(C)CC(=O)N[C@@H](C(=O)NCCc1ccccc1C(=O)O)c1ccccc1 923117993 AQKDDTLQKMECNX-HXUWFJFHSA-N 382.460 2.947 0 50 GFAA Fc1cnc(N2CC[C@@](c3nc(-c4ccncc4)no3)(C(F)(F)F)C2)cn1 952894740 QCHHMKUVJIFYKJ-OAHLLOKOSA-N 380.305 2.771 0 50 GFAA C[C@H](NC(=O)Nc1ccc(F)c(N2CCOCC2)c1)[C@@H]1C[C@H](C(=O)O)C1(C)C 952853113 KWVWYRKVCRWNMI-AEGPPILISA-N 393.459 2.919 0 50 GFAA CSc1nnc(-c2noc([C@@H]3CCc4nnn(C5CCC5)c4C3)n2)s1 952895921 XZXXOIVKXXNDQO-MRVPVSSYSA-N 375.483 2.899 0 50 GFAA CNC(=O)c1cccc(CNC(=O)N2CCC(CN3CCC(C)CC3)CC2)c1 1875253415 HXQRPDLDPXKDSS-UHFFFAOYSA-N 386.540 2.700 0 50 GFAA O=C(c1cc2n(n1)CCCC2)N1CCN(Cc2noc(C3CCCCC3)n2)CC1 885739178 UIIOOKYKYINVOG-UHFFFAOYSA-N 398.511 2.608 0 50 GFAA O=C(c1ccn2nnnc2c1)N(CC(F)(F)F)[C@@H]1CCCc2cccnc21 888092874 MLKOTDWDFCXUST-CYBMUJFWSA-N 376.342 2.601 0 50 GFAA O=S(=O)(NCc1cnn(Cc2ccccc2)c1)c1cccc(Cl)c1O 1309057083 WJWISDOJXGUAMQ-UHFFFAOYSA-N 377.853 2.769 0 50 GFAA CCCCNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1 1803450 IBLOHOLPRDSVNW-INIZCTEOSA-N 378.519 2.780 0 50 GFAA Cc1ccccc1CN1CCC2(CCc3c(O)nc(N4CCOCC4)nc32)CC1 2100543123 MEXSEQXKKZMVRK-UHFFFAOYSA-N 394.519 2.807 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N[C@]1(C(=O)O)COc2ccccc2C1 2325756400 NHNWFGWJVAGFPT-FQEVSTJZSA-N 398.440 2.829 0 50 GFAA O=C(Cc1c[nH]c2cnccc12)N[C@@H]1CCCN(c2ccc(F)c(F)c2)C1=O 2325781866 WQUQMTHKRRTCDC-QGZVFWFLSA-N 384.386 2.695 0 50 GFAA NCc1nn2c(c1C(=O)NCc1cc3cc(Br)ccc3o1)CCC2 2325789556 XPVUUTIXJMUIPQ-UHFFFAOYSA-N 389.253 2.727 0 50 GFAA O=C(c1ccc(F)cc1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 893190 GNAMWIXIOBQXKG-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA COc1ccc(NC(=S)NC(=O)c2ccc(OC)c(OC)c2)c(OC)c1 1263287 BPNYZSOIBVJMGE-UHFFFAOYSA-N 376.434 2.848 0 50 GFAA COc1cc2c(cc1CN1CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C1)OCCO2 2356135132 QPOYHMGKSCYVEY-TZIWHRDSSA-N 393.480 2.540 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)cn1 2356151775 YQDLZXCZJOLGKE-QHCPKHFHSA-N 393.487 2.930 0 50 GFAA CC(=O)N1CCN(c2ccc(NC(=O)Cn3c(C)nc4ccccc43)cc2)CC1 7344431 UXNFQAKTLHMQAA-UHFFFAOYSA-N 391.475 2.652 0 50 GFAA COc1ccccc1CC(=O)Nc1nc2ccc(S(C)(=O)=O)cc2s1 8972168 RAWDKRSMRQHUDM-UHFFFAOYSA-N 376.459 2.890 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)NCc1ccc(C(=O)N2CCCCC2)cc1 52614652 HAQUJFLYOWPHDC-UHFFFAOYSA-N 393.443 2.537 0 50 GFAA COc1cccc([C@@H]2CCN2C(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)c1 55370745 LMFFBVIOKROMFM-IBGZPJMESA-N 388.489 2.743 0 50 GFAA O[C@H]1CN(C/C(Cl)=C/c2ccccc2)C[C@@H]1N1CCN(c2ccccn2)CC1 23358505 RQIHCANSYCXIHK-DFKIOILLSA-N 398.938 2.529 0 50 GFAA CCn1ccnc1CN(C)C[C@]1(O)CCCN(CCC2CCCCC2)C1=O 67674463 DVIUEPLTSRHYTE-OAQYLSRUSA-N 376.545 2.659 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)c3cc4ccccc4n3C)CC2)cc1 20728086 ADDNOGWNDYQATA-UHFFFAOYSA-N 377.444 2.785 0 50 GFAA COc1ccc(-c2cc(=O)[nH]c(-c3ccc(CN4CC[C@@H](O)C4)cc3)n2)cc1 23505002 HWLQGUIWURBTHA-GOSISDBHSA-N 377.444 2.679 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN2CC[C@@](O)(c3ccccc3C)C2)cc1 65529333 ZNUFHHJXBYEZSR-QFIPXVFZSA-N 381.476 2.510 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3cc(OCC(=O)O)ccc32)cc(Cl)c1O 65422850 YIWCKBMGQSKOAM-GFCCVEGCSA-N 377.780 2.992 0 50 GFAA O=C(N[C@@H](Cc1ccn(Cc2ccccc2)n1)C(=O)O)OCc1ccccc1 25761688 DHUVTQUENUPYMW-IBGZPJMESA-N 379.416 2.854 0 50 GFAA Cc1ccccc1-n1ncc([C@@H](C)NC(=O)c2ccc(-n3cnnn3)cc2)c1C 12468445 YLKXOZWXFRIEAY-OAHLLOKOSA-N 387.447 2.956 0 50 GFAA CCc1ccc(S(=O)(=O)N2CCC[C@@H](CNC(=O)c3cccnc3)C2)s1 12479437 NFDWXGGCAPNLQK-AWEZNQCLSA-N 393.534 2.536 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)/C=C/c4c[nH]cn4)C3)C2)c1 12445976 MLEXAJKTJCPWLJ-WMWRJIBUSA-N 380.492 2.946 0 50 GFAA COCCn1ccc2c(OCC(=O)Nc3nc(-c4ccco4)n[nH]3)cccc21 409415092 SUQOXCYIUMDYRS-UHFFFAOYSA-N 381.392 2.683 0 50 GFAA CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1 7054920 LIVBLANDAOXWDA-CYBMUJFWSA-N 382.507 2.909 0 50 GFAA C[C@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)Cc2cc(Cl)ccc2O1 11964136 SIOUCCGPXJLUGT-ZDUSSCGKSA-N 388.851 2.968 0 50 GFAA O=C(c1ccn2cncc2c1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328626930 MEZZIPAMKBKYLI-GOSISDBHSA-N 377.448 2.623 0 50 GFAA CCN1CCN(c2ccc(C(=O)N3CCC(OCC4CC4)CC3)cc2F)CC1 363573817 XGTBBHFKHXFBLA-UHFFFAOYSA-N 389.515 2.999 0 50 GFAA Cc1cccc(CN(C)c2ncc(S(C)(=O)=O)c([C@H]3CCCNC3)n2)c1C 72430609 UPBAHMDJDITHHI-INIZCTEOSA-N 388.537 2.600 0 50 GFAA C[C@H]1CN(C(=O)c2ccc(CNCc3cnc4ccccn34)cc2)C[C@H](C)O1 237762613 ZUASCHWZXLNWRL-IRXDYDNUSA-N 378.476 2.874 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccccc2)C1)Nc1ccn(Cc2ccncc2)n1 172368215 IHZCSFMXTCSJLV-SFHVURJKSA-N 376.464 2.974 0 50 GFAA NCC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CC1 237839884 ARTXIZUCUDUOIU-LJQANCHMSA-N 389.499 2.808 0 50 GFAA O=C(c1ccc(NC[C@H]2CCOC2)nc1)N1CCC(Oc2cccnc2)CC1 71748381 AFSMCWDEPXPJQA-MRXNPFEDSA-N 382.464 2.609 0 50 GFAA COc1ccc(CN2CCC([C@@H](C)N3CCCC3)CC2)cc1OCC(=O)O 72447167 SUZIISGYFQFACP-MRXNPFEDSA-N 376.497 2.855 0 50 GFAA Cc1nc(CN2CCc3ccc(S(C)(=O)=O)cc3CC2)nc2ccccc12 374808062 DIQFLLLFSAFWHF-UHFFFAOYSA-N 381.501 2.943 0 50 GFAA O=C(C[C@@H]1C(=O)Nc2c(-c3ccccc3)cnn21)Nc1ccc2c(c1)OCCO2 71375463 DBLRYYPXGJZOGW-MRXNPFEDSA-N 390.399 2.843 0 50 GFAA C[C@@H](C(=O)Nc1cccc(F)c1)N1CCn2c(Cc3ccccc3)nnc2C1 377854955 IFUCOZXLIKPZCU-HNNXBMFYSA-N 379.439 2.851 0 50 GFAA COc1ccccc1N1CCN([C@H]2CCCN(C(=O)c3cc(C)c[nH]3)C2)CC1 72162518 QDGGTNYZSHYOJV-SFHVURJKSA-N 382.508 2.759 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)c1nc(-c2cccnc2)nc2c1CNC2 72171543 XGJOKHNJGHWZFM-UHFFFAOYSA-N 375.480 2.770 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@H](Cn3cncn3)C2)nn1-c1ccccc1F 173856683 OZYKBCKTHDTNEQ-HNNXBMFYSA-N 397.458 2.503 0 50 GFAA COc1ccccc1-c1noc(CCC(=O)N2CCC[C@H](c3ccn[nH]3)C2)n1 221216557 PYAAXTPGEIALOK-AWEZNQCLSA-N 381.436 2.807 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC([C@H](O)Cc2ccccc2)CC1 82087622 ATLVWRKPKZROOF-HXUWFJFHSA-N 379.460 2.980 0 50 GFAA CC(C)Cn1cncc1CN1CC[C@@]2(O)CCN(C(=O)C3CCCC3)C[C@H]2C1 95375051 MHPIUADSOVIBEN-DENIHFKCSA-N 388.556 2.515 0 50 GFAA CCCOc1ccc(Cl)cc1CNC(=O)c1cnc2c(O)cccn2c1=O 97698829 SNAICWNCYKUNOE-UHFFFAOYSA-N 387.823 2.772 0 50 GFAA CC(C)c1nc(C2CCN(c3cc(N4CCCC[C@H]4CO)ncn3)CC2)no1 291794462 DJWLCDRNKNVMBC-INIZCTEOSA-N 386.500 2.718 0 50 GFAA Cc1noc([C@@H](NC(=O)c2cc(-c3ccc4c(c3)OCCO4)on2)C(C)C)n1 334162358 NDPKYLGCBXSFTR-KRWDZBQOSA-N 384.392 2.931 0 50 GFAA CCn1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)c(C)n1 95528741 PRLZYBMDZOTMDO-OAHLLOKOSA-N 384.509 2.933 0 50 GFAA O=C1OCCN1Cc1nc([C@H](O)c2ccccc2)nn1CCc1ccccc1 95506501 HNROANFQPRTFHM-LJQANCHMSA-N 378.432 2.555 0 50 GFAA Cn1cnnc1SCCN1C[C@@](C)(Cc2ccc3c(c2)OCO3)CCC1=O 91724610 OAKUKSAGXQRVFN-LJQANCHMSA-N 388.493 2.507 0 50 GFAA COc1ccc(-n2cc(O)c(C(=O)N3CCC[C@H](n4cc(C)cn4)C3)n2)cc1 180759347 CFPLLXNPYQRRSW-INIZCTEOSA-N 381.436 2.569 0 50 GFAA Cc1ccc(CN2CCN(Cc3nnc(-c4cccnc4)o3)[C@@H](C)C2=O)cc1 244811739 SKHKHOGOSODMIX-INIZCTEOSA-N 377.448 2.673 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N(C)C[C@@H]3CCCN4CCCC[C@H]34)CC2=O)cc1 257199038 PXMAICBDTVDHQB-WAOWUJCRSA-N 399.535 2.771 0 50 GFAA biogenic COC(=O)c1cn([C@@H]2C[C@H](C(F)(F)F)Oc3ccccc32)cc2c(=O)[nH]nc1-2 263588870 ZJBIPBGXBCBAMV-TZMCWYRMSA-N 393.321 2.766 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)CCn1cnc2ccccc2c1=O 299754392 HGHIKYSUAQJXSW-PXNSSMCTSA-N 382.508 2.510 0 50 GFAA biogenic Cc1cccc(-c2cccc(CNC(=O)c3cccc(-n4[nH]nnc4=N)c3)c2)c1 1442962677 LQCKEAKNVXCFQJ-UHFFFAOYSA-N 384.443 2.980 0 50 GFAA CN(C[C@H]1CCN(c2ccccc2)C1)C(=O)CCS(=O)(=O)c1ccccc1 952980214 YOGVTUOSKBHIOC-GOSISDBHSA-N 386.517 2.835 0 50 GFAA CC(=O)Nc1ccc(C2=N/C(=C/c3ccc(-n4cncn4)c(C)c3)C(=O)O2)cc1 170644106 HSXDFSVWRCDAPH-VCHYOVAHSA-N 387.399 2.879 0 50 GFAA CCN(CCNC(=O)CCc1c(C)nc2cc(C)nn2c1C)CC(F)(F)F 170607749 BJBGHOLJEBZUTF-UHFFFAOYSA-N 385.434 2.588 0 50 GFAA Nc1nccc([C@@H]2CCCN(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)n1 192756267 IHILSTXMIGHCSO-LLVKDONJSA-N 386.399 2.736 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2CCCN(c3nc(C)cnc3C)C2)c(OC)c1 1506416527 JZAURSLSERUJOP-INIZCTEOSA-N 384.480 2.757 0 50 GFAA C[C@@H](C1CCN(CCC(=O)NC2CCCCCC2)CC1)N1CCN(C)CC1 1529125691 WZGBDUBSCOPJOO-IBGZPJMESA-N 378.605 2.563 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(Cc3ccc(CC(=O)O)cc3)C1)CC2 1704314701 RTMAJIPRZLSBIF-QFIPXVFZSA-N 380.492 2.650 0 50 GFAA O=C(O)[C@H]1CN(Cc2cccc(OCc3ccccn3)c2)CC12CCOCC2 1775978023 OJFZVOXJWZGPAQ-HXUWFJFHSA-N 382.460 2.974 0 50 GFAA CCOC(=O)C[C@H]1CCCCN1C(=O)c1cn(Cc2ccccc2Cl)nn1 12439178 HXKIDEWEBBWDQR-OAHLLOKOSA-N 390.871 2.928 0 50 GFAA O=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3ccco3)CC2)C1 12583585 RUFMQHPTSNUSOZ-LJQANCHMSA-N 395.503 2.913 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCc3cccc(F)c3)CCC2=O)cc1 12585526 JQNYPWXCVBQEHP-GOSISDBHSA-N 384.451 2.932 0 50 GFAA CS(=O)(=O)Nc1cccc(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1 13683291 VMLUPRHWGDHQFW-UHFFFAOYSA-N 387.461 2.546 0 50 GFAA CC(C)OCCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccco3)nn2C)C1 14538553 QJQAPHHMMDYPRY-INIZCTEOSA-N 388.512 2.547 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@@H](CNS(=O)(=O)Cc3ccccc3)C2)o1 14973389 YHNZWNBYOUYTLT-SFHVURJKSA-N 390.505 2.868 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3ccc(F)cc3)CC2)cc(OC)c1OC 19608263 VBRFAILFKONBGA-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA C[C@H](SCc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)CC(=O)NCCO2 1857688144 VNXPDHFFNNXBJS-AWEZNQCLSA-N 396.940 2.859 0 50 GFAA O=C(C[C@@H]1CC1(F)F)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)CCO2 1857689439 DHIXDZNIKUTJNV-QGZVFWFLSA-N 392.446 2.842 0 50 GFAA Cc1nc(N2CCOCC2)c2c(n1)C1(CC2)CCN(c2cnc(C)c(C)n2)CC1 1857699287 LCHVYMNIYOYYAO-UHFFFAOYSA-N 394.523 2.513 0 50 GFAA Cc1ncnc(N2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)c1C 1857723339 BCQCFUCWJHIIHI-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)CC3CC3)C[C@]23CC[C@H]1O3)c1ccc(F)c(F)c1 1857738843 AYFXEOQJEIDNDG-JTQINKHRSA-N 390.430 2.501 0 50 GFAA CCOc1ccc(CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@@H](O)C2)cc1OC 1875250058 UVPYJLNDGXBTSZ-JTHBVZDNSA-N 399.487 2.974 0 50 GFAA O=C(N[C@H]1CCN(c2ccccc2)C1)c1ccc(S(=O)(=O)C(F)F)cc1 264500586 MCXOXOAXNQJQDU-AWEZNQCLSA-N 380.416 2.692 0 50 GFAA COCCOCCC(=O)Nc1ccnc(-c2cccc(Br)c2)n1 864097266 ODGFBEUEWWBEPV-UHFFFAOYSA-N 380.242 2.898 0 50 GFAA O=C(CCc1ccc2c(c1)OCCO2)N[C@H](CO)c1cc(F)c(F)c(F)c1 1875255971 WAALGXBBNZFCRF-OAHLLOKOSA-N 381.350 2.658 0 50 GFAA CSC[C@@H](Cc1ccc(F)cc1F)NC(=O)[C@@H](N)CCc1ccccn1 1875326994 VKUXBXNIHFWPAR-AEFFLSMTSA-N 379.476 2.710 0 50 GFAA Cc1cnc(N2CCN(C(=O)c3nn(C(C)C)c(=O)c4ccccc34)CC2)s1 956942385 GXPIDBNWDGCILU-UHFFFAOYSA-N 397.504 2.705 0 50 GFAA CC(=O)NC(C)(C)c1noc([C@]2(O)CCc3cc(Br)ccc3C2)n1 888100152 QYVUMJACXOULFA-KRWDZBQOSA-N 394.269 2.580 0 50 GFAA CC(=O)CCCC(=O)N[C@H]1CCN(C(=O)C(C)(C)c2cnc[nH]2)CC(C)(C)C1 1775997245 YPEPZWMEYYJPDN-INIZCTEOSA-N 390.528 2.580 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3nc(-c4ccccc4Cl)oc3c2)C(=O)N1 1857797982 HRARBFAMUXBXSU-CQSZACIVSA-N 383.791 2.683 0 50 GFAA CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccccc1Br 857889 NFCSWIXLVWEWGM-UHFFFAOYSA-N 389.315 2.664 0 50 GFAA CCNC(=S)N(CCc1ccccc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O 1211543 NKCBHPCLDNKURB-SFHVURJKSA-N 399.491 2.897 0 50 GFAA CCOC(=O)[C@@H](C)Oc1cc2oc(=O)c(CC(=O)OC)c(C)c2cc1Cl 2858562 DGACKCBDSXIVDK-SNVBAGLBSA-N 382.796 2.801 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1 2869547 BDRWISXYBKMPEU-UHFFFAOYSA-N 393.490 2.545 0 50 GFAA O=C(O)c1ccc(N2C(=O)C[C@H](N3CCC(Cc4ccccc4)CC3)C2=O)cc1 4101169 QNXAGDJPTCGKDF-FQEVSTJZSA-N 392.455 2.971 0 50 GFAA CC1CCN(C(=O)CCN2C(=O)c3ccc(Br)cc3C2=O)CC1 6700954 ACMWMFOQBUAUJJ-UHFFFAOYSA-N 379.254 2.694 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)cc1 110597749 NLHHZCUKJIZYCB-HZPDHXFCSA-N 398.406 2.773 0 50 GFAA Cc1cnc([C@@H](NC(=O)N2C[C@@H](C(=O)O)[C@H](C(F)(F)F)C2)C2CC2)s1 414625681 JQFCQWGFQVAIHM-MXWKQRLJSA-N 377.388 2.807 0 50 GFAA O=C1N[C@@H]2CN(Cc3ccc(-c4ccccc4F)o3)CC[C@@H]2N1C1CCNCC1 415143258 SLNRWKWWNHXFHO-UXHICEINSA-N 398.482 2.806 0 50 GFAA COc1ccc(CN2CCN(c3ncccc3Cl)C[C@H]2CCO)c(F)c1 106986251 OLFDFEDIZZZTPY-OAHLLOKOSA-N 379.863 2.956 0 50 GFAA COc1cc(OC)c(CN2CCN(C3CCCCC3)[C@H](CCO)C2)c(OC)c1 22851369 PEGYMLLXHLOHCT-GOSISDBHSA-N 392.540 2.914 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC[C@H](Cn3cc(CC4CCCCC4)nn3)C2)c[nH]1 20207867 MOFBJMDYCAXVEU-SFHVURJKSA-N 397.523 2.950 0 50 GFAA c1ccc(CCc2nc(CCN3CCCO3)n(-c3ccc4c(c3)OCO4)n2)cc1 65403369 LSUJFZGLOIBZKL-UHFFFAOYSA-N 392.459 2.961 0 50 GFAA Cc1nn(Cc2ccc(F)cc2Cl)c(C)c1NS(=O)(=O)c1cnn(C)c1 2804961 FQPAMGZQOJVALC-UHFFFAOYSA-N 397.863 2.875 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccn4cncc4c3)CC2)cn1 328647536 UAIRVEMTMNVFMQ-QGZVFWFLSA-N 378.480 2.902 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3cc(N4CCCC4)ncn3)CC2)c1 72437761 JHAJQHKMNYZMBY-UHFFFAOYSA-N 380.496 2.993 0 50 GFAA O=C(c1cccc2nccn12)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328614519 AHDFAOHJYBKTRU-MRXNPFEDSA-N 377.448 2.623 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2CCCNCC2)Cc2ccccc2C1 72146950 NULGNHSUMBNBRI-UHFFFAOYSA-N 377.532 2.520 0 50 GFAA CNC(=O)c1cccc(NC(=O)[C@H](C)N2CCC(N(C)c3ccccc3)CC2)c1 126205266 FIPQYHYJDQDOBE-KRWDZBQOSA-N 394.519 2.974 0 50 GFAA Fc1c(F)c(F)c(-[n+]2cn3c(n2)CO[C@@H]2Cc4ccccc4[C@@H]23)c(F)c1F 34662593 QYCVUBRNHFACFR-QGHHPUGFSA-N 380.296 2.900 0 50 GFAA CCn1c(CC2CCNCC2)nn(Cc2nc(-c3ccc(C)cc3)oc2C)c1=O 71708109 UOGVULDUVANLSA-UHFFFAOYSA-N 395.507 2.927 0 50 GFAA CC(C)(C)OC(=O)COCCOCCOCCOCCOCc1ccccc1 214943390 USXLULCFEHFJGM-UHFFFAOYSA-N 398.496 2.611 0 50 GFAA O=C(N[C@H]1CCc2nnnn2CC1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 333675213 DGQFALCKYJYWCP-YJBOKZPZSA-N 379.468 2.796 0 50 GFAA Cc1cccc(Cn2cccc(C(=O)N3CCC[C@@H](CCC(=O)O)C3)c2=O)c1 237708549 GROYVYIZWFNXBX-KRWDZBQOSA-N 382.460 2.922 0 50 GFAA Cn1ncc2c(N3CCC(N4CCCCC4)CC3)nc(-c3ccncc3)nc21 72119577 YAWWNDXVMGPKTR-UHFFFAOYSA-N 377.496 2.880 0 50 GFAA Cc1cccc2c1OC[C@@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)C2 289711777 FJJGNERQJXTHBW-KRWDZBQOSA-N 393.443 2.769 0 50 GFAA CC(C)c1nc(C2CCN(c3cc(N4CCCC[C@@H]4CO)ncn3)CC2)no1 291794473 DJWLCDRNKNVMBC-MRXNPFEDSA-N 386.500 2.718 0 50 GFAA COCCN1CCN(C(=O)NCCc2c(C)[nH]c3ccc(Cl)cc23)CC1 426707117 BYJZWTAHRLEHMA-UHFFFAOYSA-N 378.904 2.646 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](CN)C2)c2c(n1Cc1ccccc1)CCCC2=O 95500289 YXOQSBXOSLRTSR-GOSISDBHSA-N 379.504 2.714 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(NCc3cnn(CC)c3)nc2)CCN1C(C)C 91477007 NUNIBDRLQNTCDF-LJQANCHMSA-N 384.528 2.855 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1n[nH]c3ccc(C)cc13)CC2 91974308 SUVCPMATDZKREL-UHFFFAOYSA-N 378.480 2.604 0 50 GFAA O=C1NCCc2c1sc1ccc(C(=O)N3CCC(c4ncc[nH]4)CC3)cc21 95524895 WIVYRGLYAJPGKR-UHFFFAOYSA-N 380.473 2.930 0 50 GFAA CCc1nn(C)c(NC(=O)N2[C@H]3CC[C@@H]2CC(=O)NC3)c1-c1ccc(F)cc1 95498681 FQGUITYHDCFNGP-CABCVRRESA-N 385.443 2.673 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)N(C)C[C@@H]3CCCN4CCCC[C@H]34)CC2=O)cc1 253412112 PXMAICBDTVDHQB-BBTUJRGHSA-N 399.535 2.771 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)cc1 299388308 ZHGFCSFVZRVFJJ-OIISXLGYSA-N 379.478 2.727 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)N1CCc2nc[nH]c2[C@H]1c1cccc(F)c1)C(=O)OC 252517469 JEHJXCVOKBAXCT-BJOOFOGMSA-N 388.443 2.794 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)CC[C@@H](C)N1CCN(C)CC1 952986025 CUIMLUAVKJJSGC-GOSISDBHSA-N 386.540 2.586 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3ccc(-c4nnn(C)n4)cc3)cc2)CC1 952972184 OIRPNWRSUCGLAY-UHFFFAOYSA-N 392.463 2.602 0 50 GFAA Cc1cc(C(=O)NCC2CCN(C(=O)[C@H](O)c3ccc(F)cc3)CC2)c(C)o1 952990864 IXFQUDIVLDZXSO-LJQANCHMSA-N 388.439 2.738 0 50 GFAA O=C(NC1CCN(C[C@@H]2CCCO2)CC1)C1(N2CCCCC2)CCCCC1 952983608 PZIRMVPLKIUHJR-FQEVSTJZSA-N 377.573 2.935 0 50 GFAA O=C(NCCc1csc(-c2cnccn2)n1)c1ccc(CN2CCCC2)o1 952987993 PLOUDJXDGWWZEB-UHFFFAOYSA-N 383.477 2.761 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)COc1ccccc1Cl 1565515730 QFTAXHIMFDRILZ-ZBFHGGJFSA-N 376.884 2.968 0 50 GFAA Cn1cc(C(=O)C[C@H]2CCCN2C(=O)C2CCN(Cc3ccccc3)CC2)cn1 269460922 RYSCYIMBKZREMS-OAQYLSRUSA-N 394.519 2.896 0 50 GFAA C[C@@H](C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccc(Cl)s1 275867456 ZRDBLMDTRWVIPA-NEPJUHHUSA-N 379.917 2.610 0 50 GFAA CC(C)c1nnc2n1C[C@H](NC(=O)N1CC(C)(C)OC3(CCCC3)C1)CC2 190818036 NKRPMQGNYWTTLA-OAHLLOKOSA-N 375.517 2.850 0 50 GFAA COc1ccc(CN2CCOC[C@@H](C(=O)O)C2)cc1OCc1cccc(F)c1 1772808716 ZLFPXDJIWGDBLX-KRWDZBQOSA-N 389.423 2.946 0 50 GFAA CCCn1ncc(CN2C[C@H]3COC[C@@H]2CN(Cc2scnc2C)C3)c1C 1772706302 IQIYQRYGLXTLGP-HKUYNNGSSA-N 389.569 2.699 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697497 RHBIZZUMEWFZHS-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA COc1cccc(N2C(=O)CN(C(=O)COc3ccc(C(C)=O)cc3)C[C@H]2C)c1 11871655 RSEQLXPJEXQXCZ-OAHLLOKOSA-N 396.443 2.541 0 50 GFAA CN(C)C(=O)CCC(=O)N1CCC[C@H](C(=O)c2ccc(C(F)(F)F)cc2)C1 12193591 DNNHEARXHBCDKP-AWEZNQCLSA-N 384.398 2.995 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccco4)C3)C2=O)c1OC 12431318 JNLQWVXITIDSFA-JOCHJYFZSA-N 398.459 2.952 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@@H](NCC(F)(F)F)CC2 14531011 AYYPCZVTHGMUHN-AWEZNQCLSA-N 380.414 2.702 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCC2CCC2)C[C@H]1NC(=O)c1ccncc1F 1875246764 MGYDJCDLMPWBMI-KFKAGJAMSA-N 391.487 2.831 0 50 GFAA O=C(CS(=O)(=O)Cc1nnc(-c2ccccc2)s1)NC1CCCCC1 122424296 BJJWRJCMRYQKOW-UHFFFAOYSA-N 379.507 2.569 0 50 GFAA O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1cc(-c2ccccc2Cl)[nH]n1 238095587 KHASCCADGYAPJG-LBPRGKRZSA-N 377.828 2.826 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cnc4c(c3)CCCC4)C1)CC2 1704341998 BDSCUWWZMPXXDU-QHCPKHFHSA-N 391.519 2.937 0 50 GFAA Fc1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(Cc4cnon4)C3)n2)cc1 952893753 VIKVLGRHWCGEJN-OAHLLOKOSA-N 383.305 2.965 0 50 GFAA O=C(O)CC1(CC(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)CC1 1875279261 KFBABCNFYVEFKG-AWEZNQCLSA-N 382.254 2.994 0 50 GFAA CCn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3cnc(C)nc3C(C)C)CC1)O2 1875394611 PGOTUDVZGBYUBJ-MRXNPFEDSA-N 399.495 2.616 0 50 GFAA CN(C(=O)Nc1cnc2ccnn2c1)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1875334879 JBGGJFDVHJAEGV-KRWDZBQOSA-N 394.435 2.604 0 50 GFAA CONC(=O)C1CCN(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)CC1 878443866 UIRPHFBWXDODBP-INIZCTEOSA-N 391.468 2.556 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)Cn3ccnc3C(C)C)C3(CCC3)C2)o1 1775997468 KBNYHTCNCBFNAO-UHFFFAOYSA-N 384.480 2.815 0 50 GFAA Cc1ccnc2ccc(C(=O)N[C@@H]3CN(C(=O)[C@@]4(C)CCCOC4)C[C@H]3C)cc12 2325793972 MUZBHEZVZGYKHW-LQNXUBFPSA-N 395.503 2.937 0 50 GFAA N[C@]1(c2ccccc2)CCN(C(=O)NCc2c(F)cccc2-n2cccn2)C1 2325860124 YGHNWNGIGNSULQ-OAQYLSRUSA-N 379.439 2.781 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)[C@H]1CCCN1C1CCOCC1 245638849 XZTVJGAVVYZKNP-QFBILLFUSA-N 377.916 2.678 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)COc2ccc(C(C)C)cc2)cc1 1004666 AQIVPSVSVZFJBT-UHFFFAOYSA-N 390.461 2.652 0 50 GFAA CN1C(=O)[C@@](O)(CC(=O)c2ccccc2O)c2cc(Br)ccc21 1134927 FAWNAWWXDKDNAS-QGZVFWFLSA-N 376.206 2.592 0 50 GFAA O=C(c1ccc(O)nn1)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356135949 ZPNCJSBCQYTXTE-QFIPXVFZSA-N 387.443 2.759 0 50 GFAA O=C(NC[C@H](O)c1cccc(O)n1)c1cc(-c2cccnc2)nc2ccccc12 2356157911 RUEVNNBLEBBLRF-FQEVSTJZSA-N 386.411 2.861 0 50 GFAA COc1ccc(OC)c(NC(=O)CCN2CCN(c3ccccc3F)CC2)c1 2760702 KDCDVCULFXHIFH-UHFFFAOYSA-N 387.455 2.994 0 50 GFAA COCCNC(=O)CN(c1ccc(C(C)C)cc1)S(=O)(=O)c1ccccc1 2962576 WRGRRUUTHHEAQI-UHFFFAOYSA-N 390.505 2.768 0 50 GFAA C[C@H]1CN(C(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)CCCO1 171267641 PLOCKKPTMQWEGY-INIZCTEOSA-N 394.537 2.891 0 50 GFAA O=C1C[C@H](Sc2nnnn2-c2ccccc2)C(=O)N1c1cccc(Cl)c1 100537711 GCLCRIOQVGXDQE-AWEZNQCLSA-N 385.836 2.740 0 50 GFAA O=C1NC[C@H](c2ccccc2)Cc2[nH]c(Cc3nc(-c4cccnc4)no3)nc21 65526850 JNQASCJDDVLFCH-OAHLLOKOSA-N 386.415 2.515 0 50 GFAA Cc1ccccc1CN1CCN(Cc2ccc3c(c2)OCCO3)C[C@@H]1CCO 20998571 AAWCAHDAUPAGLA-NRFANRHFSA-N 382.504 2.835 0 50 GFAA COc1ccc([C@H](C)NC(=O)c2cccc(N(C)S(C)(=O)=O)c2C)cc1 65363737 HDQAGGYQUWZQCM-AWEZNQCLSA-N 376.478 2.890 0 50 GFAA Fc1ccc(-c2n[nH]cc2CNC[C@@H](c2ccncc2)N2CCOCC2)c(F)c1 20601430 YPCXKEMNCIBNIR-FQEVSTJZSA-N 399.445 2.913 0 50 GFAA C[C@@H]1CNC(=O)CCN1C(=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 67473363 GYKGGESCQIERSO-LLVKDONJSA-N 397.353 2.623 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(C(=O)[C@@H](O)c2ccccc2)C3)cc1 67675824 XAXJJILNJPMCPU-NRFANRHFSA-N 375.428 2.652 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@H]1CCCN(C(=O)c2ccncc2)C1 12308343 SGBXCAXBQDSSML-GOSISDBHSA-N 380.492 2.810 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 67604515 IITCNQBCFMZQFM-UHFFFAOYSA-N 397.498 2.806 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)N2CCC(Cc3ccccn3)CC2)CC1=O 171612329 FGGFKWBDBOXXQF-GOSISDBHSA-N 393.487 2.924 0 50 GFAA Cn1cc(CCCN[C@@H]2CCOC[C@H]2[C@H]2CCCN2C(=O)OC(C)(C)C)cn1 252510774 BHLNBJBFWSGADB-GUDVDZBRSA-N 392.544 2.747 0 50 GFAA CCn1c(SCC(=O)NCC(C)C)nnc1-c1cc(C(F)(F)F)n(C)n1 2793592 UTUCGUSYCJBCNU-UHFFFAOYSA-N 390.435 2.582 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2nc(SC)ncc2Cl)CC1 4811106 TXNZHGFLTLLFGX-UHFFFAOYSA-N 378.885 2.823 0 50 GFAA CC(C)c1cc(C(=O)N2CCOCC2)c(NC(=O)c2c(Cl)cnn2C)s1 6390002 RRZOLNLFHIECSQ-UHFFFAOYSA-N 396.900 2.983 0 50 GFAA Cc1nc(CN2CCC3(CC2)CN(CCCN(C)CC(C)C)C(=O)O3)co1 72419041 QDPSHSRFWKWTQN-UHFFFAOYSA-N 378.517 2.748 0 50 GFAA Cc1noc([C@@H]2CCCN(c3nccc(N[C@H]4CCCO[C@H]4C(C)C)n3)C2)n1 328635078 NDIOLGRBYICMAC-RYRKJORJSA-N 386.500 3.168 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCCN(C)C)CCC(=O)N1Cc1ccc(F)cc1 71745794 ARXFALRSSFLGSJ-IBGZPJMESA-N 377.504 2.753 0 50 GFAA COc1ccc([C@@H]2CCCN2CCC(=O)Nc2ccc(C(N)=O)cc2)cc1OC 363343913 BJFZFUYEOVDYOS-SFHVURJKSA-N 397.475 2.968 0 50 GFAA CCN1CCN([C@@H]2CCN(C(=O)N[C@@H](C3CCCCC3)C(F)(F)F)C2)CC1 482306905 DSJQGSAOWUSUBE-SJORKVTESA-N 390.494 2.919 0 50 GFAA CC[C@H]1CCc2nc(NC(=O)[C@H]3COCCN3CC(F)(F)F)sc2C1 332216182 WUVPVYWDHSVPMK-CMPLNLGQSA-N 377.432 2.860 0 50 GFAA O=C(N[C@H]1c2ccccc2C[C@H]1O)C1CCN(C(=O)CCc2ccccc2)CC1 130832997 YQHJDMSHJBGVKW-GGAORHGYSA-N 392.499 2.632 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(CO)o2)CCC(=O)N1Cc1ccc(F)cc1 71730623 NBEWFNRLEYOGIN-GOSISDBHSA-N 388.439 2.810 0 50 GFAA CCn1c(C)ccc(C(=O)N2CCC[C@H](N3CCc4ccccc4C3)C2)c1=O 72144536 JGIDMCAVZJXKPC-FQEVSTJZSA-N 379.504 2.840 0 50 GFAA COc1c(C)cc(C(=O)[C@@H]2CCCN(CC(=O)Nc3cnn(C)c3)C2)cc1C 71767746 VUEOPLKWHQUISP-MRXNPFEDSA-N 384.480 2.579 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)N3CCc4ccccc4C3)n2)cc1 44900564 KMMZSIMJMVIVNR-UHFFFAOYSA-N 375.428 2.504 0 50 GFAA Cc1ccc(O[C@H]2COCC[C@H]2NC(=O)c2ccc(-c3cc[nH]n3)cc2)cn1 220106872 PRNSMPMZLLHQIJ-UXHICEINSA-N 378.432 2.746 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCc3cccnc3N)csc2C1 426514908 SZCZSUKVJKTSMV-UHFFFAOYSA-N 397.504 2.818 0 50 GFAA Cc1ccc(-c2cccc(C(=O)NCc3cc4n(n3)CCCNC4)c2)c(C)n1 426433560 FQHKQHFLDFESSY-UHFFFAOYSA-N 375.476 2.985 0 50 GFAA Cc1ccc(OCCN2CCn3nc(CCC(=O)NC4CC4)cc3C2)cc1C 82096467 XXWZLMYMQSFXIC-UHFFFAOYSA-N 382.508 2.606 0 50 GFAA CN(CCCO)Cc1cc(Cl)ccc1OC[C@@H](O)CN1CCCCCC1 95519374 SUXDUQWDNOAUGN-IBGZPJMESA-N 384.948 2.770 0 50 GFAA O=C(NC1CCN(CCc2ccccc2)CC1)N[C@@H]1CCN(c2ccccn2)C1 178705274 YFDQGPAHUBTJTD-OAQYLSRUSA-N 393.535 2.667 0 50 GFAA COCc1cccc(S(=O)(=O)N(CCCO)[C@H]2CCc3ccccc32)c1 178755873 XVJQWLYWGNCRJA-FQEVSTJZSA-N 375.490 2.894 0 50 GFAA COCCN(Cc1c(C)nn(C)c1C)C(=O)Nc1ccc(-n2cccn2)cc1 96140857 QIGGXCVTNBEYSX-UHFFFAOYSA-N 382.468 2.903 0 50 GFAA O=C(O)c1cccc(C[C@@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)c1 95362397 PHXJZIWSROISEF-INIZCTEOSA-N 376.416 2.670 0 50 GFAA COc1ccc(CN(C[C@H]2CCCO2)C(=O)NCc2n[nH]c3c2CCC3)cc1 426711237 GFRIDFULULYCEK-QGZVFWFLSA-N 384.480 2.798 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)c1cccc(F)c1F)CC2 95372616 ROWXALUVWNCNGN-UHFFFAOYSA-N 393.478 2.761 0 50 GFAA CC(C)(C)OC(=O)N1CC(S(=O)(=O)c2ccccc2Br)C1 90635734 UZWSTXZVMHSKLY-UHFFFAOYSA-N 376.272 2.842 0 50 GFAA O=C(NC[C@H]1CCCN(c2ncccn2)C1)Nc1ccc(-n2ccnc2)cc1 95505319 RREVEDUBWHSGDY-MRXNPFEDSA-N 377.452 2.700 0 50 GFAA COc1ccc(F)c(CN2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)c1 95378639 RRLTZVAAZRBJJF-HNNXBMFYSA-N 384.459 2.587 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@H]3NC(=O)c2n[nH]c(N)n2)cc1 91780035 KQQVKRYHCOVVGF-OAHLLOKOSA-N 379.468 2.678 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)N(C)Cc1noc(C2CCC2)n1 96133059 FFHWNAYTUYJZMJ-UHFFFAOYSA-N 378.454 2.713 0 50 GFAA NC(=O)Cn1ccnc1[C@@H]1CCCN(C(=O)CCCc2ccc(Cl)cc2)C1 95510590 SVJOAUSQYJNUCX-MRXNPFEDSA-N 388.899 2.751 0 50 GFAA O=C(O)C[C@@H](NC(=O)C[C@H]1Sc2ccccc2NC1=O)c1ccc(F)cc1 299746462 XOYKZURYRWKWBL-GDBMZVCRSA-N 388.420 2.961 0 50 GFAA O=C(NCC(=O)N1CCc2ccccc21)N1CCO[C@@H](CCc2ccccc2)C1 183293561 HFOSHWGWNYSLMZ-FQEVSTJZSA-N 393.487 2.619 0 50 GFAA O=C(NCc1ccccn1)C1CCN(Cc2cc(-c3ccncc3)no2)CC1 252509860 YXBCLVQZKUIWJY-UHFFFAOYSA-N 377.448 2.660 0 50 GFAA Cc1n[nH]c([C@H]2CCCN(C(=O)Nc3ccc(C(=O)NC(C)C)cc3C)C2)n1 299772396 VXEDTCRNTJTMNU-INIZCTEOSA-N 384.484 2.971 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2CCN(Cc3cncn3CC(C)C)CC2)n1 299774334 HBSWQPRPUPWIFU-UHFFFAOYSA-N 382.434 2.979 0 50 GFAA O=C(NCc1cccc(C(F)(F)F)c1F)[C@@H]1CC(=O)N(Cc2ccncc2)C1 827696393 KSQCOIWDJIILNB-CQSZACIVSA-N 395.356 2.904 0 50 GFAA Cc1nc(O)c(Cl)c(-c2cccc(C(=O)NCCCc3cnn(C)c3)c2)n1 584902490 ZUZHYYYOYMTFKE-UHFFFAOYSA-N 385.855 2.907 0 50 GFAA C[C@@H](NC(=O)Cc1ccc(NC(=O)C2CC2)cc1)c1nc(-c2ccccn2)no1 670470554 PASKERSDIICSJI-CYBMUJFWSA-N 391.431 2.900 0 50 GFAA COc1cccc(CN2CCN(C(=O)N[C@H]3C[C@@H]3c3ccccc3)CC2=O)c1 1565527336 XYLRCAFDTLZYGF-UXHICEINSA-N 379.460 2.605 0 50 GFAA CC(C)Nc1ncc(C(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)cn1 1704300639 ZRTZPUXQAHGLBF-UZLBHIALSA-N 391.475 2.521 0 50 GFAA CCc1nccn1C[C@H](C)N1CCCN(C(=O)c2ccc(C(C)=O)s2)CC1 1772812967 SFMIYVORYKRWGZ-HNNXBMFYSA-N 388.537 2.946 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)o1 11817775 RREJTKCEOMBEGW-HNNXBMFYSA-N 386.452 2.545 0 50 GFAA Cc1ccc2c(c1)CN(CCNC(=O)[C@@H]1COc3ccccc3C1)C[C@@H](C)O2 11964063 LMDATTPZGPLQJT-XLIONFOSSA-N 380.488 2.945 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2cccn2-c2cccnc2)C1)N1CCOCC1 12436263 JBAKRERPBXXYMU-LJQANCHMSA-N 382.508 2.723 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCC([C@@H](O)c2ccccn2)CC1 12449301 WLNDMROHLJTMAA-OAQYLSRUSA-N 391.475 2.502 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)CCc2cnccn2)C1 12590700 COVHKFPDMQLSHG-IBGZPJMESA-N 396.535 2.831 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)CCc3cccs3)CC2)C1 14973610 YQIHBOJAZHJEOI-MRXNPFEDSA-N 389.565 2.662 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCc4ccncc4)CC3=O)sc2c1 1857714552 DTCVALBKMCXNSE-HNNXBMFYSA-N 380.473 2.712 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4occc4C)[C@H]4CC[C@]3(C2)O4)n1 1857719284 IFMMLHMXNHEQNC-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3CCSCC3)C[C@]23CC[C@H]1O3)c1ccsc1 1857732309 LIJPDBNBTJFKCF-DODZYUBVSA-N 378.563 2.853 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2ncccc2C)CC[C@H]1NC(=O)C1CCC1 1875248868 UINAXBQXMXJZNA-NLWGTHIKSA-N 387.524 2.886 0 50 GFAA COC(=O)[C@@H](C)N(C)C(=O)c1ccc(OCc2c(C)noc2C)c(OC)c1 328591366 REJDFUCIBHBANA-GFCCVEGCSA-N 376.409 2.513 0 50 GFAA CN(Cc1cccc(-c2nc(C3CCNCC3)cc(=O)[nH]2)c1)C[C@@H]1CCCO1 23429182 ZISJTBJCAMRGBX-IBGZPJMESA-N 382.508 2.515 0 50 GFAA CC[C@H](C)NC(=O)[C@H](C)NC(=O)N1CCC[C@H]1c1cccc2c1OCCO2 263857206 GSEBYPACXOOUJX-DZKIICNBSA-N 375.469 2.608 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)C1 266969676 LGIJGCNFWOUNKW-ICSRJNTNSA-N 389.515 2.801 0 50 GFAA CCCCCS(=O)(=O)Cc1cc(OCC)n2nc(C(F)(F)F)nc2n1 864097745 RSAKCSHXPIXHCT-UHFFFAOYSA-N 380.392 2.647 0 50 GFAA Cc1nccn1-c1cc(C(=O)N=[S@@](C)(=O)[C@@H]2CCOC2)c2ccccc2n1 1875392315 QQBDUTRQAVXBPA-ASHKIFAZSA-N 384.461 2.756 0 50 GFAA C=CC(=O)NC[C@H](NC(=O)c1ccc2c(c1)CNC2=O)c1ccc2ccccc2c1 1875386095 IUVDPWYRWZBBBD-NRFANRHFSA-N 399.450 2.857 0 50 GFAA O=C(N=[S@@]1(=O)CCC[C@@]2(CCCN2)C1)c1cccc(CN2CCCC2)c1 1875393414 MYCSMQKRURUFAG-RXFWQSSRSA-N 375.538 2.807 0 50 GFAA O=C(CCc1cccc(C(F)(F)F)c1)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875403318 SQOOGUPXAYHDCC-DJIMGWMZSA-N 381.398 2.790 0 50 GFAA OCC1(CCNc2nc(NCCC3(CO)CC3)nc(C3CCCC3)n2)CC1 888095519 PEACWYHXMMXISN-UHFFFAOYSA-N 375.517 2.678 0 50 GFAA Cn1ccc(C(=O)N2CCN([C@@H](COc3ccccc3)c3ccccc3)CC2)n1 2100555278 OXJKVYDPBBCCQW-QFIPXVFZSA-N 390.487 2.998 0 50 GFAA COc1ccc(CC2=NO[C@H](C(=O)NCC[C@@H]3COc4ccccc4O3)C2)cc1 11998505 LGRPCQFRFNZSII-NQIIRXRSSA-N 396.443 2.729 0 50 GFAA CC(C)c1n[nH]c(COC(=O)c2cnn(-c3cccc(Br)c3)n2)n1 2325745590 RHQKKGHMRKLALX-UHFFFAOYSA-N 391.229 2.628 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CC[C@@](O)(c3cccc(C(F)(F)F)c3)C2)C1 2325889524 VBWZUBVQCOBWNJ-LIRRHRJNSA-N 396.409 2.550 0 50 GFAA CN(C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2)[C@@H]1CCCc2ccccc21 880985785 YKIALTIKECFHTK-QGZVFWFLSA-N 399.472 2.954 0 50 GFAA CC(C)CCn1c(SCCc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C 634523 FUAUPSGEFSBIIZ-UHFFFAOYSA-N 386.521 2.815 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)Nc2ccc3c(c2)OCO3)cc1 2861276 CLOUCNZXTWSNCN-UHFFFAOYSA-N 390.461 2.630 0 50 GFAA CC[C@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763994 ITQJMWBMKOWEGP-LPHOPBHVSA-N 398.459 2.940 0 50 GFAA COCCNC(=O)c1ccccc1NS(=O)(=O)c1c(C)cc(C)cc1C 6269259 ISXGJYOMWHRFND-UHFFFAOYSA-N 376.478 2.789 0 50 GFAA CCN(CCOc1ccccc1F)C(=O)[C@@H](C)Sc1nc(C)cc(=O)[nH]1 55282430 OEDOVCQJZAFFOP-CYBMUJFWSA-N 379.457 2.626 0 50 GFAA COc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)NC2CCCCCC2)cc1C 11933418 OJTCALGJHQDKHD-IBGZPJMESA-N 387.524 2.533 0 50 GFAA COc1ccc(N2C(=O)C[C@H](SCC(=O)Nc3ccccc3F)C2=O)cc1 100277520 IUKJRHZKYZEIGG-INIZCTEOSA-N 388.420 2.838 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3ccc(-n4cccn4)cc3)C2)CC1 23358018 MYUVTGXKMYNOJW-NRFANRHFSA-N 397.523 2.611 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@H](C(=O)NCc4ccccn4)C3)CC2)o1 67805553 OJLHVQUPKUOTCJ-IBGZPJMESA-N 396.535 2.976 0 50 GFAA COC[C@@H](NC(=O)c1csc2nc(-c3ccccc3)cn12)c1ccnn1C 67821850 VXQHVSHDOLLCSQ-OAHLLOKOSA-N 381.461 2.914 0 50 GFAA CC(C)(O)[C@H]1CCCN1c1nc2c(c(N3CCC[C@@H]3C(C)(C)O)n1)SCC2 328852004 ZWKFAEUMRSCVGS-HUUCEWRRSA-N 392.569 2.604 0 50 GFAA O=C(c1coc(C2CCOCC2)n1)N1CCC(OC[C@H]2CCCCO2)CC1 328826307 SSNVCTVHYGFBKF-QGZVFWFLSA-N 378.469 2.759 0 50 GFAA COc1cccc(OC)c1CC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 119065606 CFGFUGJYAQTSQC-IBGZPJMESA-N 382.504 2.927 0 50 GFAA Cc1cc(C(=O)N2CCC(c3cc(Cc4ccccc4)n[nH]3)CC2)nc(N)n1 67675877 AOFOWBNACCNRAL-UHFFFAOYSA-N 376.464 2.701 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ccc(NCc3csnn3)nc2)CC1 281255230 UUSNEMOSVGENQN-UHFFFAOYSA-N 376.486 2.602 0 50 GFAA Cc1nn(C)c(Cl)c1CNCc1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)cc1 121864773 TTYCBBNAXMNRKB-OKILXGFUSA-N 390.915 2.921 0 50 GFAA CCOC(=O)[C@@H](CNC(=O)CCc1nc(C)no1)C1C2CC3CC(C2)CC1C3 253430399 YUYIWUFLSOAFKS-ITNKIWFMSA-N 389.496 2.678 0 50 GFAA C[C@H](C(=O)N1CCCc2c(Cl)ccc(Br)c21)S(C)(=O)=O 332707131 XHCMKUHYIJOKEE-MRVPVSSYSA-N 380.691 2.815 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)N[C@H]3CCc4nc(C(C)(C)C)cn4C3)cn21 333191571 SGFMQWCYKPVBPD-KBPBESRZSA-N 391.541 2.568 0 50 GFAA CCN(CC)CCc1ccc(NC(=O)NC2CCN(CCOC)CC2)cc1 241657618 PXUDJBXWXZMFPE-UHFFFAOYSA-N 376.545 2.803 0 50 GFAA O=C([C@@H]1CCCO1)N1CCC(c2nn3c(C4CCCC4)nnc3s2)CC1 71747761 BXEBJMXSUOTUMM-AWEZNQCLSA-N 375.498 2.728 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1ccc(F)c(C(=O)O)c1 218288078 RABJTDWCRGLIBA-CQSZACIVSA-N 389.335 2.781 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(C)c(C)c1)CC2 95501443 CAMAAVRZORVSHN-UHFFFAOYSA-N 380.492 2.953 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)n[nH]1 91468386 TVJGUIXJBLQSFJ-CQSZACIVSA-N 394.397 2.792 0 50 GFAA Cc1ccc(N2C[C@@H](NC(=O)N3CC(Oc4cccc(C)c4)C3)CC2=O)cc1 584895944 MFIMXQUEIUDPHP-KRWDZBQOSA-N 379.460 2.882 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCO2)N1CCC([C@@H](O)c2cccs2)CC1 952986974 CRSJIYFEPDNHEP-GOSISDBHSA-N 395.502 2.654 0 50 GFAA CCCOc1c(Cl)cccc1NC(=O)c1cn(C[C@@H]2CCCNC2)nn1 952986479 IXUSOEXSCCCRFQ-CYBMUJFWSA-N 377.876 2.972 0 50 GFAA O=C(Nc1ccc2c(c1F)CCNC2=O)C(=O)N1CCCC2(CCCCC2)C1 408022080 VCLOICXNYJMEHZ-UHFFFAOYSA-N 387.455 2.623 0 50 GFAA Cc1ccc2c(CCNC(=O)c3cccc(NS(C)(=O)=O)c3)cn(C)c2c1 170602393 DIBXHNVGOXZCHE-UHFFFAOYSA-N 385.489 2.831 0 50 GFAA Cc1nsc(N2CCCN(C(=O)N[C@H]3CCOc4c(F)cccc43)CC2)n1 188326505 OTRYVIKLHWIWKW-HNNXBMFYSA-N 391.472 2.731 0 50 GFAA CCN(Cc1nc(C(C)C)no1)C(=O)COCc1nc2ccc(F)cc2[nH]1 1506425890 FEMIYSWMTUNDCX-UHFFFAOYSA-N 375.404 2.774 0 50 GFAA Cc1ncsc1C(=O)N1CCCN(C(=O)Cc2nc3ccccc3o2)CC1 1529168076 VETLHADRAAZIDE-UHFFFAOYSA-N 384.461 2.510 0 50 GFAA O=C(Cc1ccc(CO)cc1)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1704338325 QWJDOJJWQIOYBD-KNQAVFIVSA-N 376.456 2.644 0 50 GFAA Cc1cccc(NC(=O)CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@@H](O)C2)c1C 1704324972 BDRZXTCFXFYHCF-NZQKXSOJSA-N 396.487 2.622 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)[C@H]2CCCCO2)CC1 11754037 ZKYPCOMDGYSFOR-OAQYLSRUSA-N 394.519 2.902 0 50 GFAA O=C1CC[C@@H](C(=O)N2CCC(c3ccncc3)CC2)CN1Cc1ccccn1 11822172 KXQBJOGLLUEIHP-LJQANCHMSA-N 378.476 2.621 0 50 GFAA O=C1CC[C@@H](C(=O)N(CCO)Cc2ccccc2)CN1CCc1cccc(F)c1 11879212 XLJYYYWUCLSELI-HXUWFJFHSA-N 398.478 2.628 0 50 GFAA Cc1c(C(=O)N(C)C)sc2ncnc(NC[C@@H]3COc4ccccc4O3)c12 12031547 NNVWKPNWYYWNBA-GFCCVEGCSA-N 384.461 2.953 0 50 GFAA c1ccc(CN(C[C@@H]2CCCO2)c2nc3nonc3nc2NC2CCCC2)nc1 12306052 YRAYTZVUMNDFDQ-INIZCTEOSA-N 395.467 2.948 0 50 GFAA C[C@H](NC(=O)c1cc(Cl)ccc1OC1CCN(C2CCCC2)CC1)C(N)=O 12718265 JRNYYCLHTXWIML-ZDUSSCGKSA-N 393.915 2.729 0 50 GFAA COc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3F)C2)c(OC)n1 15070248 LJZDQFRYRMRMKG-INIZCTEOSA-N 387.455 2.975 0 50 GFAA CC(C)c1noc(-c2cn(C3CCN(C(=O)COc4ccccc4)CC3)nn2)n1 169778630 JZJJSCSUXOAQEI-UHFFFAOYSA-N 396.451 2.694 0 50 GFAA CCc1nc(C)sc1CNC(=O)[C@H]1CC(=O)N(c2nnc(C(C)C)s2)C1 1857720829 MPBBKVZHBFTEJA-NSHDSACASA-N 393.538 2.658 0 50 GFAA O=C(CCc1nc2ccccc2n1-c1ccccc1)NCC1(CO)CCOCC1 151624306 VVQBZDYCWRDRTM-UHFFFAOYSA-N 393.487 2.863 0 50 GFAA CN1CCN(C)[C@H](CNC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 264675156 BSYPPWLEXDNSAV-LJQANCHMSA-N 393.487 2.987 0 50 GFAA CN(C)C(=O)c1cccc(CCNC(=O)C2CCN(Cc3ccccc3)CC2)c1 265926444 NTNQOSAULDDBRN-UHFFFAOYSA-N 393.531 2.959 0 50 GFAA CC1(C)[C@@H](c2ccc(F)c(F)c2)CCN1C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 916014784 HYWWXURKTDHSOG-CSMYWGQOSA-N 376.407 2.660 0 50 GFAA CNC(=O)[C@H]1C[C@@H](C)CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 1875288986 OJFKZAUDSLGGFZ-PWSUYJOCSA-N 375.366 2.758 0 50 GFAA O=C([C@@H]1OC[C@H]2COCC[C@@H]21)N(Cc1ccc2c(c1)OCCO2)C1CCCC1 885703028 IBQJLQQIYJHJPV-PLMTUMEDSA-N 387.476 2.781 0 50 GFAA Cc1nc(N2CCC([C@@H](C)NC(=O)[C@@]34CCC[C@@H]3C4)CC2)c2cnn(C)c2n1 1775992943 VJEDUMFXOUSAJA-NZCGUCNHSA-N 382.512 2.583 0 50 GFAA COc1ccc2[nH]cc(CCN[C@H]3CC(=O)N(c4ccc(F)cc4)C3=O)c2c1 4728059 WIZBQZWWHWFZPW-IBGZPJMESA-N 381.407 2.780 0 50 GFAA O=C(c1ccncc1Cl)N1CCc2nc(CCc3ccccc3)nn2CC1 2100483244 FCBOERYLQRPQPQ-UHFFFAOYSA-N 381.867 2.810 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C 4867080 CLJQWQMNTFSHPW-ADLMAVQZSA-N 387.388 2.657 0 50 GFAA CC(C)(C)[C@@H]1CC[C@@H](NC(=O)C2CCN(c3ccc(-c4nn[nH]n4)cn3)CC2)C1 2325807367 UTUJKQRFARUEON-IAGOWNOFSA-N 397.527 2.809 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)C3(c4nn[nH]n4)CC4(CCC4)C3)cc2)c1C 2325840675 LAHRSWUOHPANIC-UHFFFAOYSA-N 377.452 2.843 0 50 GFAA COC(=O)C1=C(C)N=C2S[C@H](C)C(=O)N2[C@@H]1c1ccc(OC)c(OC)c1 2254235 MMELZDSVMIBFNE-MEBBXXQBSA-N 376.434 2.525 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)CCCc2ccc(OC)cc2)C1=O 2356144622 GKERGIKTGASSGU-JOCHJYFZSA-N 388.508 2.648 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@]23CCCN(c2ccc(C)cc2)C3=O)cc1=O 2356168693 BCWZDETVUNROAV-HSZRJFAPSA-N 393.487 2.978 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC[C@H](c3ccco3)N3CCN(C)CC3)no2)cc1 22938355 LWUYNNGWANCEQR-LJQANCHMSA-N 394.475 2.962 0 50 GFAA O=C(O)c1nn(CCCc2ccccc2)c2c1CN(C(=O)c1ccc[nH]1)CC2 67886046 KIAVBMHEAHFDCO-UHFFFAOYSA-N 378.432 2.741 0 50 GFAA C[C@@H](c1cccs1)N(C)CC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 247985481 YZOLQFXLZPFNOJ-GJZGRUSLSA-N 396.534 2.550 0 50 GFAA C[C@@H](c1ncnc(Cl)c1F)[C@@](O)(Cn1cncn1)c1ccc(F)cc1F 21298430 BQDLXFABVRRDFU-FVMDXXJSSA-N 383.761 2.830 0 50 GFAA in-vitro CC1(C)CC(NC[C@@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)CC(C)(C)N1 67770881 YSFDBUMIUZDRGA-QFIPXVFZSA-N 391.531 2.578 0 50 GFAA CC(C)Cn1c(CN(C)[C@@H]2CCOC2)cnc1S(=O)(=O)Cc1ccccc1 20256579 WVVVJBSOCOFQRU-GOSISDBHSA-N 391.537 2.734 0 50 GFAA COc1cc(N2CCN(C(=O)[C@H](C)Oc3cccc4ccccc34)CC2)ncn1 469801723 SIXUFXFEZMEGCD-INIZCTEOSA-N 392.459 2.755 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3cccc4cnccc34)CC2)c1 77287576 ZLIQSJLPJQCTBE-UHFFFAOYSA-N 375.428 2.842 0 50 GFAA C[C@@H](Cc1cc(C(=O)N2CCN(c3cnccn3)CC2)on1)c1ccccc1 12036415 IESKGMUZPVXOOA-INIZCTEOSA-N 377.448 2.773 0 50 GFAA O=C(Nc1cccc(Oc2ccccc2)c1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252536073 HOEKOBCQHGDROR-MRXNPFEDSA-N 376.416 2.814 0 50 GFAA C[C@H]1CN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)CCN1C 72171233 GGNCPIPLLDZMTL-FQEVSTJZSA-N 391.559 2.861 0 50 GFAA CN(C)CCN(C)C(=O)CC[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71763930 KLRPMNWRTDWZSJ-DEOSSOPVSA-N 393.531 2.944 0 50 GFAA CC(C)NC(=O)C[C@H](C)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 253428266 JCQBMZBAHZETHD-JTQLQIEISA-N 384.358 2.788 0 50 GFAA CCCn1cc(C(=O)N2CCn3nc([C@H](O)c4ccccc4)cc3C2)c(C)n1 219205219 UCAKVXMQEUCEBF-HXUWFJFHSA-N 379.464 2.536 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc(C)c(C)c3)[C@H]3CS(=O)(=O)C[C@H]32)o1 72426231 AGJVSIUNUZZIRD-LEWJYISDSA-N 388.533 2.688 0 50 GFAA CCc1n[nH]cc1C(=O)N[C@H]1CC[C@H](Nc2nccc(-c3ccccn3)n2)C1 72164966 JPACSFJPCYFHMY-KBPBESRZSA-N 377.452 2.587 0 50 GFAA CCc1noc([C@]2(O)CCN(C(=O)Nc3cc(C)c(OC)cc3Cl)C2)n1 377364907 ZIDJOJTYDXTJQB-KRWDZBQOSA-N 380.832 2.728 0 50 GFAA O=C([C@H]1CCCN(C2CCN(CCOc3ccccc3)CC2)C1)N1CCCC1 71760419 SSRBBINJZMQWJI-FQEVSTJZSA-N 385.552 2.864 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)s1 82091196 XCKKRWXBXODYMG-QGZVFWFLSA-N 389.565 2.996 0 50 GFAA Cc1ccc(CN2CCN(C(=O)NCCc3ncccc3C)CC2=O)cc1C 426535420 HWBATFNNXGXKJD-UHFFFAOYSA-N 380.492 2.603 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCCC4)C2)c1 95354802 ZMBZEOXBKRBYTD-KRWDZBQOSA-N 380.444 2.972 0 50 GFAA COc1ccc(CN(C)Cc2ccncc2C)c(OC[C@H](O)CN2CCCC2)c1 95528268 KXVTWCNPNKINHH-OAQYLSRUSA-N 399.535 2.866 0 50 GFAA CCCOc1ccc(-c2cccc(C(=O)N[C@@H]3CCCNC3=O)c2)cc1CO 426549908 KDBNJEVROXZMLK-LJQANCHMSA-N 382.460 2.643 0 50 GFAA CCCOC(=O)[C@H]1[C@H]2C=C[C@@]3(CN(c4ccccc4Br)C(=O)[C@H]13)O2 239433252 XKSAJNGWGQWNCX-LLDVTBCESA-N 392.249 2.689 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)CCCc1cccs1)CCN2C 95353940 PQUSLJHJQHOUQH-HXUWFJFHSA-N 377.554 2.616 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)CCc3nc4ccccc4[nH]3)CC2)CC1=O 91724940 SCAXUOAHVACKBK-UHFFFAOYSA-N 382.508 2.993 0 50 GFAA CSc1ncc(CN2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95379604 IQPGBYWFMHQRKF-XUVXKRRUSA-N 382.533 2.966 0 50 GFAA COc1ccc(P2C[C@@H]3C[C@H]2CN3S(=O)(=O)c2ccc(C)cc2)cc1 98042894 RMFZMNUGIFSNIE-YPAHSFBSSA-N 375.430 2.956 0 50 GFAA CCSc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCO)C3)C2)s1 92065334 QVSBICWATMUYJT-GOSISDBHSA-N 382.551 2.697 0 50 GFAA COCCCN1CC[C@H](CNC(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)C1 534588934 CGVAPXDZZGCIPN-OAHLLOKOSA-N 376.476 2.807 0 50 GFAA O=C(CCC(F)(F)F)N[C@@H]1C[C@H](C(=O)NCc2cccc(Cl)c2)C[C@H]1O 1940195913 VXLYCFBDWRSGOZ-IACUBPJLSA-N 392.805 2.554 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)N[C@@H](CO)c1ccc(F)cc1 584892913 VUOKKYXYSUVEQN-SFHVURJKSA-N 381.517 2.518 0 50 GFAA COc1cccc([C@@H]2CNCCN2C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c1 883552968 GIPABBNROGQRNY-IBGZPJMESA-N 392.463 2.669 0 50 GFAA Cc1cc(CC(C)C)nc(N2CC[C@@H](NCC3CCN(C(=O)C4CC4)CC3)C2)n1 952984069 ZKQJFROFKFQNHL-HXUWFJFHSA-N 399.583 2.800 0 50 GFAA CCOc1cc(N2CCN(C(C)C)CC2)ccc1NC(=O)c1cn(C)nc1C 170606065 JSVNBXDJZIAMKP-UHFFFAOYSA-N 385.512 2.910 0 50 GFAA COc1nc2ccc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)cc2s1 170617708 JWFCHRXFXHQVSU-UHFFFAOYSA-N 391.474 2.808 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](c2cccc(F)c2)C1 171158778 VCPYGVXPZLCURN-OAQYLSRUSA-N 398.482 2.968 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CCO2)cn1 189224633 ALRKURJJKLHHNG-SFHVURJKSA-N 377.510 2.899 0 50 GFAA CN1CCN(C(=O)Cc2cccc(NC(=O)c3cc4sccc4[nH]3)c2)CC1 192144296 STCLAVQEATUFPU-UHFFFAOYSA-N 382.489 2.798 0 50 GFAA c1ccc([C@@H]2COC[C@@H]3CN(Cc4cnc(-c5ccco5)nc4)CCN32)cc1 1615734585 ZBAJFSDULYDQLE-PMACEKPBSA-N 376.460 2.994 0 50 GFAA COc1ccc(F)cc1[C@@H](C(=O)O)N1CCN(c2ncnc3ccccc23)CC1 1506413665 STRLOHJZSQDVCP-IBGZPJMESA-N 396.422 2.725 0 50 GFAA Cc1nnn(C23C[C@H]4C[C@@H](CC(NC5CCN(Cc6ccco6)CC5)(C4)C2)C3)n1 1506418204 VNYAQCLWFWUZKI-HTAFUYNTSA-N 396.539 2.877 0 50 GFAA Cc1ccccc1-c1ncc(CN2CCC3(CC2)C[C@](O)(CO)CCO3)s1 1704342034 CPAKERSMDVCLJI-FQEVSTJZSA-N 388.533 2.987 0 50 GFAA CCC1(C(=O)NC)CCN(c2noc(-c3ccc(OC)cc3)c2C(=O)O)CC1 1704309275 MKKYXUJRFMLBNP-UHFFFAOYSA-N 387.436 2.791 0 50 GFAA Cc1cc(C(N)=O)c(N2CCCN(C(=O)[C@H]3CCc4ccccc43)CC2)nc1C 1772814430 YUZOXJXNROICRQ-IBGZPJMESA-N 392.503 2.566 0 50 GFAA COCCN1C[C@@H](C(=O)NCC2(c3ccc(OC)cc3)CCCC2)CCC1=O 11951467 ORSWSPJCAYAXHD-KRWDZBQOSA-N 388.508 2.508 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@@]2(CCCN(CC3CCCCC3)C2=O)C1 12072397 DMCXKXIZHADZPL-NRFANRHFSA-N 378.513 2.751 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CNCCn1cccn1)C1CCCCC1 12303354 GGJQXMUREDHOME-OAQYLSRUSA-N 386.540 2.677 0 50 GFAA COC[C@@H](O)CNC(=O)c1csc2nc(-c3ccc(C(F)(F)F)cc3)cn12 12317181 MPVBTHOBMYLKIY-LBPRGKRZSA-N 399.394 2.819 0 50 GFAA CC(=O)Nc1ccnn1C1CCN(C(=O)c2ccccc2-n2cccn2)CC1 12431831 VNIYVDLZVKTNEI-UHFFFAOYSA-N 378.436 2.505 0 50 GFAA CCOC(=O)[C@]1(Cc2cccc(OC)c2)CCCN(C(=O)c2cnsn2)C1 12437499 DFKPUFGCGAPRTI-IBGZPJMESA-N 389.477 2.575 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCCC[C@@H]1CCn1cccn1 12457965 UTTUSCQRXLBUTR-LJQANCHMSA-N 378.480 2.802 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCc1cccc(C)n1)C2 14732925 BFKJGTYYEKULIU-QGZVFWFLSA-N 381.524 2.880 0 50 GFAA C[C@@H]1CCN(C(=O)C2=CC(c3ccco3)=NS(=O)(=O)N2C)[C@@H]2CCCC[C@@H]12 15673642 RERZDHKTOIPMBG-IJEWVQPXSA-N 391.493 2.570 0 50 GFAA CC(=O)Nc1cc(-c2ccc(=O)n(CC(=O)Nc3cccc(F)c3)n2)ccc1C 16650517 OPVVAGSQVJXTBE-UHFFFAOYSA-N 394.406 2.955 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(Br)cc2F)CC1 154483112 ZKOCRNWPUNMKMY-UHFFFAOYSA-N 394.262 2.552 0 50 GFAA O=C(CCC(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1)NC1CCCC1 1857677499 FEYITXSGMAENGD-UHFFFAOYSA-N 380.492 2.843 0 50 GFAA Cc1nnc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)CC4=CCCC4)C3)C2)s1 1857683507 VQXNTAQATGTOPD-APWZRJJASA-N 376.526 2.527 0 50 GFAA OCc1csc(N2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)n1 1857695361 GKYWBTKDODIOFD-HXUWFJFHSA-N 395.488 2.677 0 50 GFAA COc1c(Cl)cc(Cl)cc1C(=O)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857718611 MVXYWQWGGGZUCE-DYVFJYSZSA-N 385.247 2.565 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1C 1857719288 IJZONKJVPVNIBP-NOXFTYBFSA-N 392.455 2.918 0 50 GFAA CCCc1cnc(N2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)nc1 1875243955 FXCSBUQXWWGNBA-JZJXAQOMSA-N 386.540 2.965 0 50 GFAA O=C1CCCC[C@H](C(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)N1 332920600 PADQKVAXFZJJSV-KGLIPLIRSA-N 398.290 2.664 0 50 GFAA COC(=O)[C@@H](NC(=O)[C@@H]1CCCN(c2nc(C)c3ccc(C)cc3n2)C1)C(C)C 11977760 ZNHXJMFKUMUJMN-APWZRJJASA-N 398.507 2.777 0 50 GFAA Cn1cc(CC(=O)N2CCC[C@]3(CCc4cnc(N)nc43)C2)c2ccccc21 1704300907 BFHUFKULYURHPP-QFIPXVFZSA-N 375.476 2.600 0 50 GFAA COCC[C@@H](CO)NC(=O)COc1cc2sc(C)nc2c2sccc12 1875261268 DWQCGEFDKFRNFC-NSHDSACASA-N 380.491 2.712 0 50 GFAA C[C@@]1(NC(=O)c2c[nH]c3nccc-3c2)CCN(C(=O)c2coc(C3CCC3)n2)C1 1875333802 MCZQGOPIKBTXOP-OAQYLSRUSA-N 393.447 2.805 0 50 GFAA CNC(=O)CN(C[C@@H]1CSc2ccccc21)C(=O)CN1CCc2ccccc21 1875379572 WSHWIYHMXZRDOQ-QGZVFWFLSA-N 395.528 2.513 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2cccc(-c3noc([C@H]4CCCO4)n3)c2)cn1 1875385131 NFRDQIMCHPMDOA-BXZDMCNWSA-N 381.436 2.585 0 50 GFAA C[C@@H](O)C[C@@H](NC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)C(=O)O 1875313908 XJTOVGNOFFREGG-ZWNOBZJWSA-N 380.441 2.567 0 50 GFAA CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(=O)c3ccc(Cl)cc3o2)n1 1875359989 VSXIECZYOMMELY-VIFPVBQESA-N 377.784 2.809 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cncc(-c2ccoc2)c1 1875402459 HKSCPVDSBFJAFM-NXOUGTEYSA-N 386.839 2.761 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)[C@@H]3CCCc4n[nH]cc43)CC2)cn1 886055017 GSJWSCNZSLCCMN-NVXWUHKLSA-N 382.512 2.784 0 50 GFAA Cc1c(F)cccc1NS(=O)(=O)c1ccc2c3c1CCCN3C(=O)CO2 6668178 GMEIQFRMLGTAOS-UHFFFAOYSA-N 376.409 2.607 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)c2cc(C3CC3)no2)CCCCN1 2100533091 ZVPXEEPYXBIMBI-QGZVFWFLSA-N 388.512 2.539 0 50 GFAA Cc1cccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC[C@@H](C)C3)n2)c1 1857797715 CWCJUMWWFLNQMZ-WBVHZDCISA-N 393.491 2.905 0 50 GFAA COc1ccc(CC2=NO[C@@H](C(=O)NCC[C@@H]3COc4ccccc4O3)C2)cc1 11998501 LGRPCQFRFNZSII-WIYYLYMNSA-N 396.443 2.729 0 50 GFAA CC[C@H](C)CC(=O)N1CCc2c(ncn2C)[C@]12CCN(C(=O)Cc1ccco1)C2 2325776821 CKJRZMPXXSWKHW-KSFYIVLOSA-N 398.507 2.504 0 50 GFAA O=C(O)C[C@H]1CN(c2ncnc3[nH]c4ccccc4c23)C[C@H](C(F)(F)F)O1 2325809016 SKLFTKCPJNZFHT-JOYOIKCWSA-N 380.326 2.722 0 50 GFAA CN(C)CCN(C(=O)c1cn2c(Br)cccc2n1)c1ccccn1 2325860147 ZOSDBXMIRDIPSS-UHFFFAOYSA-N 388.269 2.700 0 50 GFAA COc1cccc(CN2CC[C@@H](c3ccccc3)[C@H](O)C2)c1OCCN(C)C 2356142908 MRBNKPUOBJMYSO-LEWJYISDSA-N 384.520 2.986 0 50 GFAA O=C(c1cc(-n2cccn2)ccc1Cl)N1CCc2nc(C3CC3)nn2CC1 2356150984 LNUQTUHVLSVFPS-UHFFFAOYSA-N 382.855 2.693 0 50 GFAA CN([C@@H]1C[C@@H]2CNC(=O)C[C@@H]2C1)S(=O)(=O)c1ccc(-c2ccccc2)cc1 2356159543 GFVDWOSFXGGVMS-OTWHNJEPSA-N 384.501 2.889 0 50 GFAA CCc1c(C(=O)Nc2cccc(S(=O)(=O)CC)c2)cnn1-c1ccccn1 118352444 KWPIVLFZKRSHIW-UHFFFAOYSA-N 384.461 2.876 0 50 GFAA CCC(=O)c1ccc(OCC(=O)N(C)Cc2nc(-c3ccncc3)no2)cc1 55244379 BRLVYWXALNDBMC-UHFFFAOYSA-N 380.404 2.762 0 50 GFAA O=C1NCCN(Cc2ccc(F)cc2Cl)[C@H]1CC(=O)N1CCCCCC1 55153396 ZMQYUZWHZFHPPV-KRWDZBQOSA-N 381.879 2.572 0 50 GFAA Cc1cnc(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)cn1 55211404 PANXZAMGMKEXKC-LJQANCHMSA-N 379.508 2.520 0 50 GFAA O=C(c1ccc(NCCc2ccncc2)nc1)N1CCC(Cn2cccn2)CC1 20778841 ZIGRWEYJLCYJAN-UHFFFAOYSA-N 390.491 2.880 0 50 GFAA Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@@H](N2CCNC2=O)C1 139374525 PLRDSMLKXREYOA-GFCCVEGCSA-N 376.507 2.810 0 50 GFAA O=C(CC[C@H]1NC(=O)N(c2ccccc2)C1=O)NCCc1c[nH]c2ccccc12 409413977 HPDGXJPAANCGOI-LJQANCHMSA-N 390.443 2.732 0 50 GFAA COc1ccc(CN(Cc2ccc3cn[nH]c3c2)[C@@H]2CCS(=O)(=O)C2)cc1 119150662 VAHLZBQLZLDOSS-GOSISDBHSA-N 385.489 2.761 0 50 GFAA Cc1ccnn1CC(=O)N1CC[C@@H]2[C@@H](CCC(=O)N2CCC2=CCCCC2)C1 72411600 RKMREKMYBLGVPY-VQTJNVASSA-N 384.524 2.922 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1CC[C@@H](Cc2cnn(C)c2)C1 363589732 PDZFGMMOKMURQN-AWEZNQCLSA-N 376.888 2.975 0 50 GFAA CC(C)c1ncc2c(n1)CN(C(=O)NCc1ccccc1N1CCOCC1)CC2 369879841 FSIITZHDKHQIOH-UHFFFAOYSA-N 395.507 2.705 0 50 GFAA COc1ccc(-n2ccc(C(=O)NC3CCN(c4ccc(C)cn4)CC3)n2)cc1 157930649 NLSBTAGZLAVUKL-UHFFFAOYSA-N 391.475 2.983 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N2C[C@@H](C3CC3)[C@H]2C2CC2)s1 333969017 UGNAMSDTFMFGSK-LZLYRXPVSA-N 394.562 2.857 0 50 GFAA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)CC1(N2CCOCC2)CCCC1 283619421 OOUHPYHWSQCWAY-MOPGFXCFSA-N 384.524 2.602 0 50 GFAA O=C(Nc1ccc(F)cc1F)Nc1ccc(N2CCOCC2)c2nonc12 17076752 XJCHYPFQWIMMGM-UHFFFAOYSA-N 375.335 2.982 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCC4(CO)CC4)csc3C2)nc1 426440215 CQZAGROOMADBJO-UHFFFAOYSA-N 385.533 2.766 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCCO[C@@H](Cn2cccn2)C1 82137624 VNXCARZZHXPHBY-QGZVFWFLSA-N 382.489 2.862 0 50 GFAA CCN(C(=O)Nc1ccc(Oc2cccnc2)cc1)[C@@H]1CCS(=O)(=O)C1 96148937 UNWZWAYUYMUWMM-OAHLLOKOSA-N 375.450 2.915 0 50 GFAA Cc1cccc(Cn2cccc(C(=O)N3CCC[C@H](CCC(=O)O)C3)c2=O)c1 237708767 GROYVYIZWFNXBX-QGZVFWFLSA-N 382.460 2.922 0 50 GFAA O=C(O)CN1CCC[C@H](C(=O)OCC2c3ccccc3-c3ccccc32)C1=O 95079048 MGRKRIDEUOZPNJ-SFHVURJKSA-N 379.412 2.665 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2c(C)noc2C)CC3)cn1 91877121 ZVTSIMAMUBLEQU-UHFFFAOYSA-N 383.496 2.795 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1CCn2nc(Cc3ccccc3)cc2C1 97259308 CYVLTIZCFXGCHL-UHFFFAOYSA-N 384.443 2.915 0 50 GFAA C[C@H](c1cc(-c2ccccc2)n[nH]1)N(C)C(=O)NCC1(CN2CCOCC2)CC1 534636234 KHQNOQDUANXYJY-QGZVFWFLSA-N 397.523 2.892 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)NCc1nncn1C1CCCCC1 828032284 OFYTUBAHMXTTMD-UHFFFAOYSA-N 394.479 2.590 0 50 GFAA COCCn1ccnc1CN1CCC[C@H](CNC(=O)c2ccc3c(c2)CCC3)C1 824466565 VUVALUJSPPXLST-GOSISDBHSA-N 396.535 2.660 0 50 GFAA CC(C)c1noc([C@H](C)NS(=O)(=O)c2ccc3c(c2)NC(=O)CCS3)n1 670439127 SQEIELPHTJMJSZ-JTQLQIEISA-N 396.494 2.667 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)c2cnc(-c3ccccn3)nc2)c1 952987412 HUJUGSYEPBACAW-UHFFFAOYSA-N 377.404 2.684 0 50 GFAA O=C(c1ccc(NC[C@H]2CCN(c3ccccc3F)C2)nc1)N1CCOCC1 882388763 UFVIUVRYEAZLER-MRXNPFEDSA-N 384.455 2.632 0 50 GFAA O=C(COc1cccc(F)c1)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 1565513458 FSVIYWHTQQEPLN-PBHICJAKSA-N 375.469 2.784 0 50 GFAA NC(=O)N1CCC(C(=O)/N=c2/sccn2Cc2cccc3ccccc23)CC1 170092754 IQHMGAVHIVOSJJ-XTQSDGFTSA-N 394.500 2.969 0 50 GFAA Cc1ccc(-c2nnn(CC(=O)N3CC[C@@H](c4c(F)cccc4F)C3)n2)cc1 186190791 SIDLJDBXWHJJKX-OAHLLOKOSA-N 383.402 2.943 0 50 GFAA C[C@@](O)(CN1CCc2c(F)cc(F)cc2C1)c1ccc(S(C)(=O)=O)cc1 777605276 OFUSCTQTWBQVDX-LJQANCHMSA-N 381.444 2.634 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)NCC1(Cn2cccn2)CC1 1506400729 WQPZMFNUBUSPNQ-UHFFFAOYSA-N 378.479 2.667 0 50 GFAA CCc1cc(NCc2cnn(Cc3ccccc3)c2)nc(N2CCOCC2)n1 1529192572 XVMUCULOBBGXKC-UHFFFAOYSA-N 378.480 2.733 0 50 GFAA O=C(N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1)C1(c2ccccc2)CC1 1704302440 LAOFSDFICWGVMC-AUSIDOKSSA-N 379.456 2.625 0 50 GFAA CC(=O)c1cn([C@@H](C)C(=O)N2CCOC3(CCN(C)CC3)C2)c2ccccc12 1772814690 NYWPLWLKNGQIKT-INIZCTEOSA-N 383.492 2.728 0 50 GFAA C[C@H](CCN(C)CCn1cc(C(=O)NCc2ccncc2)nn1)c1ccccc1 12243402 CDWQIQYFOXNJDT-GOSISDBHSA-N 392.507 2.729 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@H]3NC(=O)CCn2cnnn2)cc1 12301725 CRDRZYQCPVSPSI-GOSISDBHSA-N 393.495 2.740 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 12456429 AOSLNEFHHIQCGW-SFHVURJKSA-N 397.450 2.806 0 50 GFAA O=C(c1c[nH]cn1)N1CC(=O)N(C2CCCCC2)C[C@H](OCc2ccccc2)C1 14543168 JZOBMTFPBWSWBT-LJQANCHMSA-N 396.491 2.612 0 50 GFAA CN(C(=O)CCN1CCCCC1=O)[C@@H]1CCCN(CCCc2ccccc2)C1 14969112 FDRQIDVQMPZQJB-OAQYLSRUSA-N 385.552 2.945 0 50 GFAA Cc1cccn2c(CNCCCn3ccnc3)c(C(=O)N3CCCCC3)nc12 15065862 HILLTQCXXZHJKQ-UHFFFAOYSA-N 380.496 2.645 0 50 GFAA COc1ccc(CN2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)c(C)c1C 15072805 JTXVPSQLFNJAOZ-UHFFFAOYSA-N 383.496 2.633 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3nnc(C)s3)CC2)c1 16607413 JBKCLMXNDUEWEY-UHFFFAOYSA-N 394.522 2.503 0 50 GFAA O=C(c1ccc(I)cc1)N1CCN(c2ccccn2)CC1 18106219 UOAJVTCMXDKTAE-UHFFFAOYSA-N 393.228 2.649 0 50 GFAA COc1cc(CN2CCN(C3CCCC3)[C@@H](CCO)C2)cc(OC)c1OC 19790724 DARFYJFEXIDJBX-SFHVURJKSA-N 378.513 2.524 0 50 GFAA O=C(CCc1ccccc1)N1CCC2(CC1)NC(=O)N(c1cccc(F)c1)N2 169779862 DXTXWUHKFSGHQX-UHFFFAOYSA-N 382.439 2.811 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCCCc1ccccc1)CCCC3 169780652 ZLVPHQLLEUVYMW-UHFFFAOYSA-N 378.476 2.592 0 50 GFAA COc1ccccc1Cc1nc(-c2cccnc2N(C)C)n([C@@H]2CCOC2)n1 1857683225 YLWAQRPTIQZVPC-MRXNPFEDSA-N 379.464 2.967 0 50 GFAA CCOCCC(=O)N1CCC2(CC1)CN(CC1CCCCC1)C[C@H]2C(=O)O 1857691160 XDEQNDXAIVJSFC-SFHVURJKSA-N 380.529 2.619 0 50 GFAA Cc1ccc([C@H](NC(=O)c2cn3c(n2)CCNCC3)c2cccnc2)cc1C 1857718695 ORJZZEHHXPIRII-NRFANRHFSA-N 375.476 2.560 0 50 GFAA COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC[C@H]2c2ccnn2C)c1 241466007 NTUZDIKCZVSPBD-HNNXBMFYSA-N 397.884 2.776 0 50 GFAA CCOc1ccc(C2C(C(=O)OC)=C(C)NC(C)=C2C(=O)OC)cc1OC 19973636 MUXRQEBELKFHHI-UHFFFAOYSA-N 375.421 2.675 0 50 GFAA N=[S@]1(=O)CCC[C@]2(CCCN2C(=O)NCc2ccc(N3CCCC3)nc2)C1 1875393095 GDPPYJINVSQJEV-WINIVTDRSA-N 391.541 2.567 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cn(C2CC2)cn1 1875403356 UIPISFJKZDDDHV-XFQXTVEOSA-N 391.475 2.651 0 50 GFAA C[C@]1(O)N(CCN2C(=O)OC3(CCCCC3)[C@@]2(C)O)C(=O)OC12CCCCC2 3668498 HICUHVBHPGWBEU-QZTJIDSGSA-N 396.484 2.714 0 50 GFAA COc1cccc(N2CCN([C@@H]3CC(=O)N(c4ccc(Cl)cc4)C3=O)CC2)c1 100128973 BYKBNSVCPGZRGU-LJQANCHMSA-N 399.878 2.803 0 50 GFAA CN(C[C@@H](O)CN1CCc2ccccc2CC1)c1cnc2cc(F)c(F)cc2n1 2325708714 QEZCDTNBONTUAD-QGZVFWFLSA-N 398.457 2.806 0 50 GFAA CC[C@H](NC(=O)[C@@H]1C[C@@H]2CNC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 2325780314 XPYBIUPHQZZUGI-GNBUJSLZSA-N 399.535 2.501 0 50 GFAA CN=c1[nH]cnc2cc(C(=O)N3CCNC[C@@H]3c3ccccc3Cl)ccc12 2325856863 GJANTFZNPYZXJX-GOSISDBHSA-N 381.867 2.534 0 50 GFAA Cn1cnc(C(=O)N[C@@H]2CC[C@H](CCNC(=O)c3ccc4ccccc4n3)C2)c1 2325879705 DTSFMVGOFGZRRU-NVXWUHKLSA-N 391.475 2.687 0 50 GFAA Cc1sc(CC(=O)N[C@H]2CCCN3CCSC[C@H]23)nc1-c1ccco1 928082971 YFRPUZZLEHPRTK-UONOGXRCSA-N 377.535 2.950 0 50 GFAA Cc1ccc(SCC(=O)Nc2nnc(CC(=O)N3CCCC3)s2)cc1 1130242 NFANGJKJFIHCGE-UHFFFAOYSA-N 376.507 2.742 0 50 GFAA COc1ccc(-c2noc(-c3ccccc3C(=O)N3CCN(C)CC3)n2)cc1 2231751 GLDBFBNEYQLMOP-UHFFFAOYSA-N 378.432 2.800 0 50 GFAA CN(C)S(=O)(=O)N[C@H]1CCC[C@@H](CN2CCC(c3ccccc3)CC2)C1 2356139955 NRDFAFKOCKTKFS-XLIONFOSSA-N 379.570 2.821 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2c[nH]nc2-c2ccc(F)cc2)C1=O 2356151905 GAOIYQUYALXKFA-OAQYLSRUSA-N 386.471 2.819 0 50 GFAA COc1cccc(CN2C[C@H]3[C@@H](C2)OC(=O)N3Cc2ccc(OC)c(OC)c2)c1 55254142 MGOHISRQNHDNFT-GHTZIAJQSA-N 398.459 2.918 0 50 GFAA O=C(CCc1ccccc1)N1CCCN(C(=O)[C@@H]2CCCc3[nH]ncc32)CC1 134479827 XXXLQWYNIZEYJE-GOSISDBHSA-N 380.492 2.523 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)N[C@H]4CCCN(C)C4)co3)ccc2s1 67869383 XBUBRSPJZXNLDA-ZDUSSCGKSA-N 386.477 2.996 0 50 GFAA Cc1cccc(NC(=O)Cn2c(=O)n(CC(C)C)c3ncc(C(=O)O)cc32)c1C 55074317 QAXGSYDOVFXXPK-UHFFFAOYSA-N 396.447 2.808 0 50 GFAA CC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613222 RXHBHVDHWKQFJG-GFCCVEGCSA-N 390.908 2.936 0 50 GFAA Cc1ccccc1OCC(=O)Nc1nc2ccccc2n1CCN1CCOCC1 22590363 GEDLLTIAURIHHJ-UHFFFAOYSA-N 394.475 2.694 0 50 GFAA Oc1cc(-c2cccnc2)cc2c1OCCN(c1nnnn1-c1ccccc1)C2 67489923 KVDFBOUCTCNGDZ-UHFFFAOYSA-N 386.415 2.829 0 50 GFAA COc1cccc(OC)c1-c1noc(CCN2C(=O)COc3ccccc32)n1 32581066 WHJIFHNVMHBZII-UHFFFAOYSA-N 381.388 2.722 0 50 GFAA COc1cccc(-c2cn[nH]c2C2CCN(C(=O)C[C@@H](C)NC(C)=O)CC2)c1 67881094 NEBRUGHSSQPGPL-CQSZACIVSA-N 384.480 2.706 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H]1CCc2ncnn2C1 172002127 MQBPAIHCNVMJKZ-ZDUSSCGKSA-N 387.440 2.506 0 50 GFAA Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2C(=O)[C@@H](C)N=C2O)C1=O 328594801 BZADYDRBHYCKEB-DGCLKSJQSA-N 394.269 2.706 0 50 GFAA O=C(O)C[C@H]1CSCCN1C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 262610684 BCDBXBAOMGQJAB-KRWDZBQOSA-N 384.457 2.716 0 50 GFAA CN1CCN(c2ccc(-c3cc(O)cc(CC[C@H]4CCCCN4)c3)nn2)CC1 71764011 HBZPPZFRFWPAER-LJQANCHMSA-N 381.524 2.676 0 50 GFAA CCc1cc(C(=O)N2CCc3c(nc(-c4ccccc4)nc3N(C)C)C2)on1 71754742 BJVQFTHHPAGBTG-UHFFFAOYSA-N 377.448 2.959 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(c1ncnc3[nH]cnc13)CC2 377150348 MLUVUKCYEJETQQ-HNNXBMFYSA-N 382.493 2.822 0 50 GFAA Cc1cccc(C)c1Oc1ncccc1CNC(=O)C[C@@H]1CN(C)CCN1C 39533074 CVTGOJIZUOJODF-LJQANCHMSA-N 382.508 2.743 0 50 GFAA CCN(CC)CCOc1ccccc1NC(=O)N1CCC[C@H]1c1nncn1C 159164581 CRMUCPBNZINLHL-KRWDZBQOSA-N 386.500 2.905 0 50 GFAA CCCCNC(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72143099 USIPALWADDRLKA-OAQYLSRUSA-N 379.504 2.960 0 50 GFAA CCc1nccn1CCC(=O)N1CCC(=O)N(Cc2ccccc2)[C@@H](CC)C1 71711963 SNSQFEXWXYPTHR-IBGZPJMESA-N 382.508 2.875 0 50 GFAA Clc1cc2c(cc1-c1nccn1Cc1nnnn1-c1ccccc1)OCO2 82114916 KDFWGBHWCSDUQA-UHFFFAOYSA-N 380.795 2.956 0 50 GFAA O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 177288088 IMUBIZZOTQWMFU-OAHLLOKOSA-N 391.431 2.942 0 50 GFAA COc1ccc(CN2CCN(Cc3cc(C(C)C)[nH]n3)C[C@H]2CCO)c(F)c1 42986319 TXWXHOQTGWBSGJ-GOSISDBHSA-N 390.503 2.750 0 50 GFAA COc1ccc2[nH]c(=O)c(CN3C[C@@H]4c5ccccc5OC[C@]4(CO)C3)cc2c1 95527571 PCWWONBKATZFOA-AUSIDOKSSA-N 392.455 2.507 0 50 GFAA CC[C@H](C(=O)N1CCC(c2nccn2Cc2cscn2)CC1)n1cccn1 95518545 NRSPWIIJOKRKGT-QGZVFWFLSA-N 384.509 2.942 0 50 GFAA C[C@@H](C(=O)N1CCCC1)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91474579 WAWADARTSBAUMZ-FQEVSTJZSA-N 397.563 2.945 0 50 GFAA CCc1nn(C)cc1CN1CCN(Cc2nc(-c3ccc(C)cc3)no2)CC1 179657881 RHGKBYADIALNFV-UHFFFAOYSA-N 380.496 2.659 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(-c2ccc(C(=O)N3CCCC3)cn2)c1 426404351 QWXFPOBBJGXCFI-IBGZPJMESA-N 379.460 2.893 0 50 GFAA COc1cccc(CC(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3=O)c1 91655994 WQWXQCRWLWCVFK-VQTJNVASSA-N 378.472 2.887 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)nc1 91770111 KJBHWMHJDDTWFE-UHFFFAOYSA-N 378.476 2.830 0 50 GFAA O=C(O)c1cc2n(n1)CCN(C[C@@H](c1ccc(Cl)cc1)N1CCCC1)C2=O 1940198125 PFUUNEWQVPUYCY-KRWDZBQOSA-N 388.855 2.528 0 50 GFAA C[C@H](NC(=O)Cn1c(=O)oc2ccccc21)c1cnn(-c2ccc(F)cc2)c1 827861857 WOZQEJYFFKFXKX-ZDUSSCGKSA-N 380.379 2.797 0 50 GFAA O=C(O)[C@@H](NC(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1)C1CC1 670441988 JSBUDMUUXRGECE-AWEZNQCLSA-N 386.370 2.562 0 50 GFAA CC(C)c1nc(N2CCC(N3C[C@H](C(=O)O)CC3=O)CC2)cc(C(C)(C)C)n1 1349523524 TWWAIBJWUFIOCQ-CQSZACIVSA-N 388.512 2.799 0 50 GFAA O=C(c1ccccn1)N1CCC(N2CCN(c3ncccc3Cl)CC2)CC1 952870106 UZDBKFHDWRHTSA-UHFFFAOYSA-N 385.899 2.557 0 50 GFAA CCNC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1Cl 952988229 MWTAXMDRIYEZRQ-GFCCVEGCSA-N 377.872 2.819 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCN(C(=O)c4ccc[nH]4)CC3)o2)cc1 952968862 PXHFCUIWVPVJPX-UHFFFAOYSA-N 379.416 2.882 0 50 GFAA COc1ccc(-n2ccnc2CN(Cc2ccncc2)C[C@@H]2CCC(=O)N2)cc1 952971483 UGTWINGSDJOCJV-SFHVURJKSA-N 391.475 2.557 0 50 GFAA CC(C)=CCO[C@H]1COCC[C@@H]1NC(=O)C1CCN(Cc2ccco2)CC1 1565512548 KFDUGFMIEQDZON-PMACEKPBSA-N 376.497 2.748 0 50 GFAA NC(=O)Nc1ccc(-c2noc([C@@H]3CCCN(C(=O)N4CCCC4)C3)n2)cc1 273667317 GAZPBTMDZGRHTL-CQSZACIVSA-N 384.440 2.622 0 50 GFAA CNC(=O)c1ccc(CNC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 170620669 OMTYWNAFJXWNQR-SFHVURJKSA-N 389.402 2.608 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CCN(c3nc(C)cs3)[C@H](C)C2)cc1 736580430 IZUCWSMUZLVOJM-OAHLLOKOSA-N 384.505 2.605 0 50 GFAA O=C(NS(=O)(=O)c1ccc2c(c1)OCO2)c1cccc(OC2CCCC2)c1 775311516 ZTYBPLGSJIASBE-UHFFFAOYSA-N 389.429 2.855 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1C[C@H](Cc3ccccn3)[C@@H](O)C1)c(C)n2C 1616079458 UVAPDKHJMUJFSC-YWZLYKJASA-N 379.460 2.566 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1529152557 USXGYPGHOUBYKU-TZIWHRDSSA-N 377.488 2.992 0 50 GFAA CC(C)n1cc(CN2CCC3(CC2)CN(Cc2ccccn2)C(=O)CCO3)cn1 1704312650 HCTMMGQMAQYWPP-UHFFFAOYSA-N 397.523 2.643 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3C[C@H](C)[C@@](O)(C4CCC4)C3)c2n1 222510853 ASGSCYRKFQDJDG-DYZYQPBXSA-N 382.386 2.680 0 50 GFAA Oc1cc(I)c(Br)nc1Br 35270329 ROFLBQPJOBJFTH-UHFFFAOYSA-N 378.789 2.917 0 50 GFAA in-vitro O=C(Cc1cccnc1)N1CCCN(Cc2c[nH]nc2-c2ccccc2)CC1 1775978353 RRYMYMNILDPUMF-UHFFFAOYSA-N 375.476 2.749 0 50 GFAA CC(C)/C=C/C(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCN(c2ccccn2)CC1 12186074 CPHLPXMWPNNSFV-GHOSXJJBSA-N 396.535 2.571 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2ccc(C)cc2)C(=O)N2CCOCC2)cc1 12655955 FKNCDSCUTUXZRV-HKWRFOASSA-N 380.444 2.633 0 50 GFAA Cc1ccc(OCC(=O)Nc2ccc3c(c2)nc(CN2CCOCC2)n3C)cc1 16626448 ZVHKWTLEMZFHBR-UHFFFAOYSA-N 394.475 2.731 0 50 GFAA C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19899639 WNIDJZPMTZKYGD-QGZVFWFLSA-N 393.487 2.511 0 50 GFAA O=C(CC(F)(F)F)N[C@@H]1CCN(C(=O)c2cc(O)cc(C(F)(F)F)c2)C1 1875268302 PGGDWCFPEMFIEF-SNVBAGLBSA-N 384.276 2.694 0 50 GFAA Cc1oc2ncnc(O)c2c1C(=O)N1C[C@@H](CO)[C@H](c2ccc(Cl)cc2)C1 367756481 GBHNHLWTQZSLAV-JSGCOSHPSA-N 387.823 2.738 0 50 GFAA O=C(NC[C@H]1CS(=O)(=O)c2ccccc21)N1CC[C@@]2(CCc3ccccc32)C1 873027106 MLJFXIYNXPCKMV-JTSKRJEESA-N 396.512 2.857 0 50 GFAA Cn1ccc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cc1=O 952895942 YGRAMULFQRIRTR-KRWDZBQOSA-N 391.353 2.541 0 50 GFAA CCO[C@@H]1CN(C(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)C[C@H]1CO 1875268114 XOFRIHGHBDSHAZ-XJKSGUPXSA-N 392.887 2.514 0 50 GFAA CC(=O)Nc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)ccn1 1875268566 HFOKSXNRUCMLOQ-CHWSQXEVSA-N 376.457 2.510 0 50 GFAA N[C@@H]1CCO[C@H](C(=O)N2C[C@@H](c3ccccc3)O[C@H](c3ccc(F)cc3)C2)C1 1875276952 PWQSXBADQCMPAK-ANULTFPQSA-N 384.451 2.973 0 50 GFAA CC(C)c1ccc(-n2cnnc2SCC(=O)N2CCC3(CC(O)C3)C2)cc1 1875312073 RSJXPYLSAZALLJ-UHFFFAOYSA-N 386.521 2.856 0 50 GFAA O=C(O)c1nn(-c2cccc(-c3cccc(CN4CC(O)C4)c3)c2)c2c1CCC2 1875303690 IRPSJJRVUNPAJJ-UHFFFAOYSA-N 389.455 2.903 0 50 GFAA CN=c1[nH]cnc2cc(C(=O)N[C@@H]3CN(Cc4ccccc4)C(C)(C)C3)ccc12 2325856455 QCZKMPJAAGBXFI-SFHVURJKSA-N 389.503 2.876 0 50 GFAA C[C@H]1CN(c2ccncc2)CCN1C(=O)c1cnnn1-c1ccccc1Cl 1462850454 DEBJMNFFLVQJMP-AWEZNQCLSA-N 382.855 2.667 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cc(C(=O)N3CCOCC3)ccc2C)cc1C 1076488 XNUQZJWIJZXKGC-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA CCOc1cc(Br)ccc1S(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 3105214 SMBZALNWEANWTM-GHMZBOCLSA-N 378.288 2.646 0 50 GFAA CC(=O)N[C@@H](NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl 4017712 XWORNBALBISVMB-JTQLQIEISA-N 384.672 2.504 0 50 GFAA CCN(CC)CCn1c(=N)n(C[C@@H](O)COc2ccccc2)c2ccccc21 4859507 GYKBQIPGEJYPNV-GOSISDBHSA-N 382.508 2.704 0 50 GFAA CN(C(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)C1CCN(Cc2ccccc2)CC1 113093595 CLTVOMCCDPAJKK-HXUWFJFHSA-N 383.536 2.758 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(C)c(F)c3)CC2)cc(-n2cccn2)n1 65362449 OCPOYQGGCDBMFP-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA COCCCCN1CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC1 67589094 HHZKIKLARRIZDO-UHFFFAOYSA-N 379.508 2.941 0 50 GFAA O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCN(C/C=C/c2ccccc2)CC1 69348616 BLLBKPMERQHLBQ-AQDCRGGLSA-N 381.520 2.635 0 50 GFAA O=C(Nc1cccnc1)C1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1 24607610 FZOJZBAFVXIBSR-UHFFFAOYSA-N 393.896 2.916 0 50 GFAA O=C(Nc1ncns1)c1cccc(CN2CCC[C@@H](Cn3ccnc3)C2)c1 67981849 DZSZRDGAOMKLQT-MRXNPFEDSA-N 382.493 2.899 0 50 GFAA COc1ccccc1NC(=O)CSc1nc(O)c(Cc2ccccc2)c(=O)[nH]1 8671447 ZALWOAAPDZKCRL-UHFFFAOYSA-N 397.456 2.806 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)N2CCNC[C@H]2C)cc1 124415764 BKGQWPZWVIVDMF-QGZVFWFLSA-N 390.487 2.911 0 50 GFAA c1ccc2oc(CN3CCC[C@@H](c4n[nH]cc4CN4CCOCC4)C3)nc2c1 328656171 ZBOKRHLIPCPPMH-MRXNPFEDSA-N 381.480 2.763 0 50 GFAA Cc1c(C(=O)NCC2(N3CCCCC3)CCN(C)CC2)cnn1C1CCCC1 122953258 XFRIRNBQKBOQIH-UHFFFAOYSA-N 387.572 2.987 0 50 GFAA O=C1CC[C@]2(CCCN(c3ncnc4c3CCC4)C2)CN1CCc1ccccn1 77390678 LROLNNBWGQONHX-HSZRJFAPSA-N 391.519 2.812 0 50 GFAA O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@@H](N2CCCC2)C1 363099259 FOUUFXLIMINOEW-WEOJZSAUSA-N 399.579 2.891 0 50 GFAA CC1(C)CN(CC2(CN3CC(C)(C)[C@@H]3[C@@H]3CCCO3)COC2)[C@H]1[C@@H]1CCCO1 368076388 VCNOIJRLNLJAHM-MUGJNUQGSA-N 392.584 2.782 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(c3ncccn3)CC2)C1 71708074 LFTASKBVQQVBEC-FQEVSTJZSA-N 393.535 2.516 0 50 GFAA COCCN(C)C(=O)[C@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 71524746 IVYMXKDMGKDSBB-NRFANRHFSA-N 387.568 2.510 0 50 GFAA O=C(O)c1ccc(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)c(F)c1 262450496 UQWORARODSAVMM-UHFFFAOYSA-N 388.370 2.698 0 50 GFAA OCc1cc2n(n1)CCCN(Cc1cnc(SCc3ccccc3)nc1)C2 221252076 XYUHOUFNXFBFJD-UHFFFAOYSA-N 381.505 2.864 0 50 GFAA CCn1c(SC[C@H](O)CN2C[C@H](C)O[C@@H](C)C2)nnc1-c1ccccc1 229647528 MRMKAPCPAJWCRP-YQQAZPJKSA-N 376.526 2.527 0 50 GFAA COCCn1ccc2ccc(C(=O)N3C[C@@H]4C[C@H](C3)Cn3c4cccc3=O)cc21 225420456 BMAYHEAWGFJRBB-APWZRJJASA-N 391.471 2.709 0 50 GFAA biogenic Cc1cccc(-c2noc(CN(C)C(=O)NCCc3nc(C)cc(C)n3)n2)c1 426699873 FSJCFHSEDJHRHJ-UHFFFAOYSA-N 380.452 2.836 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@H]4CCN(C)C4)csc3C2)nc1 426369445 WPJOKVUTEGNNRN-KRWDZBQOSA-N 384.549 2.698 0 50 GFAA Cc1nc2c(c(NCCCN3CCC[C@H](CO)C3)n1)Cc1ccccc1OC2 96149137 NAGAEPXSIWKOIA-KRWDZBQOSA-N 382.508 2.775 0 50 GFAA CC(C)=CCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1cc(=O)n(C)c3ccccc13)C2 91745953 PTXYWZJZNVULCH-DLBZAZTESA-N 393.487 2.568 0 50 GFAA COc1ccc(F)cc1[C@H](NC(=O)c1ccc2c(c1)ncn2C)[C@H]1C[C@@H](O)C1 252540164 OUKMRNOMEVSVIK-IAMHBRQHSA-N 383.423 2.963 0 50 GFAA C[C@@H](NC(=O)NCc1ncc(-c2ccccc2)cn1)c1nnc2n1CCCC2 184561154 RZKAOLAZLHWDCV-CQSZACIVSA-N 377.452 2.632 0 50 GFAA Cc1sc(-n2cnnn2)c(C(=O)NCCN2CCCc3ccccc32)c1C 670452069 FWYXKHGQVIPCLH-UHFFFAOYSA-N 382.493 2.523 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 268954472 XADAODQYMITSKY-QGZVFWFLSA-N 387.457 2.597 0 50 GFAA CC[C@]1(C)NC(=O)N(NC(=O)[C@@H](C)Sc2nc3ccccc3s2)C1=O 278629023 GIAXHKDCTLPHBD-ABKXIKBNSA-N 378.479 2.529 0 50 GFAA CCCCN1CCOC[C@@H]1C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1 170597863 KLFQGUNXOHLNLQ-GOSISDBHSA-N 396.553 2.839 0 50 GFAA Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCC[C@H]4C(=O)NC[C@@H]43)cc12 170609904 ARRRYDQWBYPUPZ-ZBFHGGJFSA-N 380.473 2.746 0 50 GFAA Cc1nc(-c2cccc(C(=O)NC3CCC(Oc4cnccn4)CC3)c2)no1 188243925 JZFKMTQQAIDNDE-UHFFFAOYSA-N 379.420 2.955 0 50 GFAA CCCCS(=O)(=O)N1CCC(CNC(=O)c2cn(C)c3ccccc23)CC1 1506400624 GGTAFKOJJJPMOA-UHFFFAOYSA-N 391.537 2.750 0 50 GFAA Cc1cc(N2CCC[C@@H](CNC(=O)c3cc(-c4ccccc4)no3)C2)nc(N)n1 1506418599 SYFCMFIIMRJIPM-HNNXBMFYSA-N 392.463 2.669 0 50 GFAA COc1ccc(F)c(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)c1 1529189741 WRBIAYYNGBAQDY-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA Cc1cc(N2CCN(c3ncnc4[nH]ccc34)CC2)nc(-c2ccccc2O)n1 1529107089 WFJJGFSGKHACQT-UHFFFAOYSA-N 387.447 2.756 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(Cc3cc(=O)n4cc(Cl)ccc4n3)C1)CC2 1704324692 DFCBHYAEZHDEFS-NRFANRHFSA-N 395.894 2.926 0 50 GFAA O=C(c1cccc(OCCc2ccccc2)c1)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772708449 BIJYYCIZNBDWDC-XXBNENTESA-N 395.455 2.871 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3cnccn3)no2)c(Cl)c1 12459069 QICAHZXXUFBVIA-UHFFFAOYSA-N 388.811 2.978 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)C1)NC1CC1 12702846 FUHMKRAJUWOKEB-GOSISDBHSA-N 380.492 2.842 0 50 GFAA CN1CCCN(C(=O)c2cnn(-c3nccc(-c4ccco4)n3)c2C2CC2)CC1 15002139 AYWLPCHDQPQIEG-UHFFFAOYSA-N 392.463 2.577 0 50 GFAA COc1ccc(OC)c(C(=O)NCCc2nnc(SCC(C)C)n2C)c1 19883806 UFKUFEDNXRDGOJ-UHFFFAOYSA-N 378.498 2.553 0 50 GFAA CNC(=O)[C@@]12CCCN(Cc3ccc4cc(OC)ccc4c3)[C@H]1CN(C)CC2 1857683137 DCAGKCPTZWHSND-JTHBVZDNSA-N 381.520 2.881 0 50 GFAA O=C(c1cnc2c(c1)CCCC2)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857707780 JRLSCLPUWKFWJC-HSZRJFAPSA-N 391.471 2.850 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCCNC3=O)[C@@H]2C)cc1Cn1cccn1 1875245620 IMECQHPUHDEIGD-JTSKRJEESA-N 382.508 2.821 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]2N(C)C)cc1 222425796 CJVQCYRKSZIXMU-XLIONFOSSA-N 378.476 2.533 0 50 GFAA O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(OCC(F)F)nc1 123330795 SWWZZFHVSMCWES-GFCCVEGCSA-N 382.798 2.783 0 50 GFAA Cn1ncc2c(O)nc(CCC(=O)N[C@H]3CCC(C)(C)c4ccccc43)nc21 745807240 YQZYCFKVYUOKHK-INIZCTEOSA-N 379.464 2.930 0 50 GFAA Cc1nc2ccc(NC(=O)[C@@H]3CCCN3S(=O)(=O)c3cccs3)cc2o1 155999710 ABAQRKGYVJLXLR-AWEZNQCLSA-N 391.474 2.990 0 50 GFAA COc1cccn2ncc(C(=O)N[C@H](C)c3cccc(N4CCCC4=O)c3)c12 930781993 PGPYCNWBIZIUSC-CQSZACIVSA-N 378.432 2.961 0 50 GFAA O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NCC1(OCCO)CCCC1 1875274824 IDDDVCHRNNLQCG-HNNXBMFYSA-N 398.912 2.581 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCC([C@H](CN)c2ccccc2)CC1)c1ccccc1 1875302006 WLXMOKHLTSWJGP-YADHBBJMSA-N 379.504 2.845 0 50 GFAA CCC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccccc3F)CC2)cc1 20406650 VZNAGXYFCCGBFQ-SFHVURJKSA-N 386.467 2.980 0 50 GFAA O=C(c1cc(Br)ccc1Br)N1CCN[C@@H](CF)C1 2325792163 HIGJBXIOAXBWHX-VIFPVBQESA-N 380.055 2.595 0 50 GFAA Cc1[nH]nc(CCC(=O)N2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)c1C 2356169360 ZEOUVKCHPIVVDW-JOCHJYFZSA-N 395.507 2.538 0 50 GFAA CC(=O)Nc1ccc(NC(=S)N[C@@H](NC(C)=O)C(Cl)(Cl)Cl)cc1 3130805 SJLXJVPUWXTQJU-LLVKDONJSA-N 397.715 2.764 0 50 GFAA CCOc1ccccc1N1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1 3259420 QYPWPNOSEXYASH-UHFFFAOYSA-N 382.432 2.874 0 50 GFAA Cc1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c(C)c1 3598408 AOXVMYLZCLVDMU-UHFFFAOYSA-N 392.452 2.716 0 50 GFAA NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 4725616 OZSQEXWJFGWJHY-UHFFFAOYSA-N 380.469 2.974 0 50 GFAA COc1ccc(NC(=O)N[C@@H]2c3ccccc3O[C@H]2C)cc1S(C)(=O)=O 417350844 QRZFJDDGYAXNTO-GTNSWQLSSA-N 376.434 2.742 0 50 GFAA Cc1ccc(-c2n[nH]cc2CNCCc2ccc(S(N)(=O)=O)cc2)cc1C 20536342 BFWZPABCSGMFKR-UHFFFAOYSA-N 384.505 2.673 0 50 GFAA CC(C)Nc1ncccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 469671521 IXFTZFKKVZLGTK-UHFFFAOYSA-N 381.480 2.856 0 50 GFAA CC[C@H](O)CN1CCC(n2nccc2NC(=O)Nc2ccccc2OC)CC1 67983224 QBXXDNPJNWFHKI-INIZCTEOSA-N 387.484 2.944 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 67803389 RLTYYQWBPGZELX-JOCHJYFZSA-N 378.520 2.827 0 50 GFAA Cc1cc(O)n2nc(Cc3nc(-c4ccccc4C(F)(F)F)no3)nc2n1 32576439 BIHKZOVJTNXWKY-UHFFFAOYSA-N 376.298 2.798 0 50 GFAA Cc1nc(CN2CCC(C(=O)Nc3cnn(Cc4ccncc4)c3)CC2)cs1 171923695 OMTUTAWUIFXMDP-UHFFFAOYSA-N 396.520 2.942 0 50 GFAA O=S(=O)(Nc1cccc2cn[nH]c12)c1ccc(I)cc1 1427075 QPZROZJGHPWUBI-UHFFFAOYSA-N 399.213 2.968 0 50 GFAA Cn1nc(C(F)F)c2cc(C(=O)N3CCOCC4(CCOCC4)C3)sc21 329956773 PTSZXAQWSYZZLN-UHFFFAOYSA-N 385.436 2.842 0 50 GFAA COc1cccc(C2=NO[C@H](C(=O)Nc3cc(OC)c(OC)c(OC)c3)C2)c1 4076336 NGCBEKFBQMYJMY-SFHVURJKSA-N 386.404 2.853 0 50 GFAA c1ccc(Cc2nnc(N3CC[C@H](C4CCOCC4)C3)n2C[C@@H]2CCCO2)nc1 328855919 UCVARPXBYSHWLQ-ICSRJNTNSA-N 397.523 2.696 0 50 GFAA Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(c2cncc(-n3cccn3)n2)C1 328947236 KDWNMVOLSVNQOC-GFCCVEGCSA-N 377.374 2.799 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCO[C@H](C(F)(F)F)C3)c2)o1 71419205 TUIYGAKOCSKGDH-HNNXBMFYSA-N 390.383 2.910 0 50 GFAA CN1C(=O)[C@](CCC(=O)NCCC(=O)O)(Cc2ccccc2)c2ccccc21 71422238 QERAALPNGAQVTE-JOCHJYFZSA-N 380.444 2.515 0 50 GFAA Cn1cnc(-c2ccc(C(=O)N[C@@H]3CCN(c4ccc(F)cc4F)C3)cc2)n1 361682224 PGHCANWMTIDGHV-MRXNPFEDSA-N 383.402 2.769 0 50 GFAA COc1ccc2cc([C@H]3CN(Cc4cc5n(n4)CCNC5)CCO3)ccc2c1 72145077 LNLVOKGIPTWDQZ-JOCHJYFZSA-N 378.476 2.722 0 50 GFAA CCc1ccc(C(=O)Nc2sccc2C(=O)N2CCN3CCOC[C@@H]3C2)cc1 371870457 QFSYBWFJBTYPEK-KRWDZBQOSA-N 399.516 2.719 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCC2CCNCC2)(Cc2ccccc2)c2ccccc21 71404026 KHLCSWFBBZTFIZ-XMMPIXPASA-N 391.515 2.649 0 50 GFAA CC(=O)NC[C@H]1CCC2(CCN(c3nccc(CCC(F)(F)F)n3)CC2)O1 71776940 UHUFSMQURIFPEY-OAHLLOKOSA-N 386.418 2.626 0 50 GFAA Cc1ccc([C@H]2CN(Cc3cn(CCO)nc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72144777 PKECWJZUAZJKPE-DNVJHFABSA-N 380.536 2.554 0 50 GFAA CCS(=O)(=O)Nc1ccc(NC(=O)Nc2cnn(CC(F)F)c2)cc1C 174816944 KTZWPSOWUPICSY-UHFFFAOYSA-N 387.412 2.862 0 50 GFAA O=C(NC1CCN(c2ccccc2F)CC1)N1CCN(Cc2ccco2)CC1 426429086 RGCJKGBYVSROHD-UHFFFAOYSA-N 386.471 2.915 0 50 GFAA CCN1CCC(N(c2ccccc2)S(=O)(=O)c2ccc(N(C)C)nc2)CC1 291031351 YTRMXMOOEIWUCZ-UHFFFAOYSA-N 388.537 2.827 0 50 GFAA Cc1nccn1CC1(CNC(=O)c2c(Cl)c(C(F)(F)F)nn2C)CC1 97742684 SJNVJKKTIDTRQW-UHFFFAOYSA-N 375.782 2.807 0 50 GFAA CC(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1ccc3[nH]c(C(F)(F)F)nc3c1)C2 97713493 NMJZSUVSMQVRHR-WCQYABFASA-N 380.370 2.665 0 50 GFAA O=C(c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)cc1)N1CCCCC1 239439156 ZMTXTZVBIWXYBD-YDRVBMSGSA-N 376.456 2.870 0 50 GFAA CCOc1cccc(-c2ccc(C(=O)N3C[C@H]4C[C@H](O)[C@H](O)C[C@H]4C3)cc2)c1 426594872 NGEVSUQZLYGVOE-KNGAYFSHSA-N 381.472 2.956 0 50 GFAA CC(C)CCn1cc([C@@H](C(=O)O)N2CCN(C3CCCCC3)C(=O)C2)cn1 95379736 HPMNKNSGTKNGRQ-IBGZPJMESA-N 376.501 2.532 0 50 GFAA COc1cncc([C@H](NC(=O)c2c[nH]nc2-c2ccccc2)[C@H]2C[C@@H](O)C2)c1 244842331 UOPWPFKBAPHKKH-SIXWZSSISA-N 378.432 2.722 0 50 GFAA COc1ccc(CNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)cc1C(=O)O 299753510 YJHMVCQGBOTIGM-KRWDZBQOSA-N 385.416 2.881 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)C[C@H]1Sc2ccccc2NC1=O 299748708 HXQQINASEQHVOX-DOTOQJQBSA-N 382.441 2.528 0 50 GFAA COc1cc2c(cc1OC)CC(=O)N(CCC(=O)Nc1ccc(O)cc1)C=C2 253408986 LGTBEOQKDWLBPL-UHFFFAOYSA-N 382.416 2.794 0 50 GFAA biogenic O=C(Nc1cccnc1N1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O 299337543 MLPDTQQKSTWFAB-SFHVURJKSA-N 379.464 2.604 0 50 GFAA COc1cc(C(=O)Nc2ccnn2Cc2ccc(OC)c(OC)c2OC)ccn1 1115962499 JBLNVKBFAQLLLJ-UHFFFAOYSA-N 398.419 2.613 0 50 GFAA O=C(CC[C@]1(Cc2ccccc2)CCC(=O)N1)NC[C@@H]1COc2ccccc2O1 299788397 SCRQRMMRQJALJV-WZONZLPQSA-N 394.471 2.614 0 50 GFAA Cc1cc(C)n([C@H]2CCN(C(=O)c3ccc(Cl)cc3OCCCN)C2)n1 299768053 IGCVIQFXHPQFKD-INIZCTEOSA-N 376.888 2.968 0 50 GFAA Cc1ccccc1N1CC[C@H](CNC(=O)CCn2cnc3ccccc3c2=O)C1 827822507 XQFYVSONGGFAJS-GOSISDBHSA-N 390.487 2.738 0 50 GFAA Cc1cccc(N2CCC(NC(=O)[C@H]3CC(=O)N(Cc4ccncc4)C3)CC2)c1 670454183 JDUWMMUCMUWDKZ-IBGZPJMESA-N 392.503 2.524 0 50 GFAA CN1CC[C@](C)(CNC(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)C1 670435774 OMVIHFTXTJOMNL-OAQYLSRUSA-N 386.517 2.732 0 50 GFAA CN1CC[C@@H](NC(=O)N2CCc3ccnc(O)c3C2)[C@H]1c1ccc(F)c(F)c1 277101032 OZQFWZKIQMFLHD-QZTJIDSGSA-N 388.418 2.579 0 50 GFAA COc1ccsc1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 277617966 URIZNBOQOCVGGV-BLLLJJGKSA-N 390.509 2.608 0 50 GFAA CC(=O)c1c(C)cc(C)c(CS(=O)(=O)Cc2nnc(C3CC3)n2C)c1C 170591578 DOMBJRALFPBLQI-UHFFFAOYSA-N 375.494 2.935 0 50 GFAA CCOc1cc(NC2CCN(C(=O)C[C@](C)(O)c3ccccc3)CC2)ncn1 186209617 SPCVIPVPPLVUDL-NRFANRHFSA-N 384.480 2.576 0 50 GFAA Cc1ccncc1C(=O)N1CCCN(Cc2ccnn2-c2ccccc2)CC1 1529138529 FCGGAGDBMUPBLW-UHFFFAOYSA-N 375.476 2.924 0 50 GFAA O=C(Cc1ccc(F)cc1Cl)N1CC[C@H](O)[C@](CO)(Cc2ccccc2)C1 1529125948 COEVBNUWFWRLOL-PZJWPPBQSA-N 391.870 2.836 0 50 GFAA O=C(c1cnccn1)N1CCC(N2CCC3(CC2)OCCc2ccsc23)CC1 1704298633 JHGRVTKGEMCUCA-UHFFFAOYSA-N 398.532 2.707 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC1CCNCC1 1704303597 LCMQXTDQOCEGJB-UHFFFAOYSA-N 378.860 2.535 0 50 GFAA CN(CC1(CO)CCCC1)C(=O)c1c(N2CCOCC2)noc1-c1ccccc1 1704308020 CLNSGFCWKJXXRX-UHFFFAOYSA-N 399.491 2.803 0 50 GFAA Cc1ccn2c(CNCCn3cccn3)c(C(=O)N3CCCCCC3)nc2c1 12305595 JSIFRYGOPOKALU-UHFFFAOYSA-N 380.496 2.645 0 50 GFAA CN(C)CCCn1ccc2c(cnc3nc(-c4ccccc4Cl)nn32)c1=O 12409734 JNAFRXPGUKZGCZ-UHFFFAOYSA-N 382.855 2.711 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(Cc3cc(O)c4ccccc4n3)C2)CC1 12448314 IUNHCLKUYPJIET-GOSISDBHSA-N 396.535 2.707 0 50 GFAA Cc1c(CN2CC(=O)N(C(C)C)C[C@@H](OCc3ccc(F)cc3)C2)cnn1C 14731556 KOWYZEKAUVMUOC-FQEVSTJZSA-N 388.487 2.506 0 50 GFAA CN1C(=O)N(Cc2ccccc2)C(=O)C12CCN(Cc1ccc(O)cc1)CC2 14733331 WFPWCRPOTJKNJE-UHFFFAOYSA-N 379.460 2.821 0 50 GFAA CC(C)CCn1cnc2sc3c(c2c1=O)CC[C@H](NCc1cnn(C)c1)C3 14996015 FFXGVEXLDFIDDG-HNNXBMFYSA-N 385.537 2.885 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc4ccccc4[nH]3)C[C@@H]2CCO)CC1 19299754 ZAJXISKBHLXDGR-QFIPXVFZSA-N 384.568 2.909 0 50 GFAA CCOc1cccc(CNC(=O)c2cc3c(N4CCCC4)nc(C)cn3n2)c1 169770754 OGGHSVVOTPRSRY-UHFFFAOYSA-N 379.464 2.967 0 50 GFAA O=C1N[C@H](CCC(=O)N2CCC(c3ccccc3)CC2)C(=O)Nc2ccccc21 206232089 KQVXOJBKROWRPT-HXUWFJFHSA-N 391.471 2.924 0 50 GFAA COc1cccc(-c2ncc(-c3nccn3C[C@@H]3CN(C)C(=O)CO3)s2)c1 1857689668 UWVSGTBWOGCNEU-HNNXBMFYSA-N 384.461 2.539 0 50 GFAA N=c1[nH]c2cc(C(=O)NCc3noc(-c4c(F)cccc4F)n3)ccc2s1 1857721309 JMQGYSIDLJWZFH-UHFFFAOYSA-N 387.371 2.967 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1ccn(C(F)F)n1 1857727323 OLGJXBLJWCTNLY-IJEWVQPXSA-N 396.825 2.876 0 50 GFAA CNC(=O)CCCn1cc(NC(=O)Cc2csc(-c3ccccc3)n2)cn1 1875242951 JMCXSDTZWJVJHC-UHFFFAOYSA-N 383.477 2.714 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)c1ccc(Cl)c(Cl)c1 239248147 YEFCTMCIJSAHED-XQLQCCRHSA-N 377.227 2.691 0 50 GFAA CN(Cc1ccc(Cl)s1)C(=O)CN1CCC[C@H]1c1nc(N(C)C)no1 374538657 RNDYMIWLWLPKKR-LBPRGKRZSA-N 383.905 2.646 0 50 GFAA NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CCN(c2ccccc2F)C1 378132764 WXEFSQURADWXMQ-PBHICJAKSA-N 389.858 2.518 0 50 GFAA CCCS(=O)(=O)N1CCC(NC(=O)N2CC3(CC=CC3)[C@H]2C(C)C)CC1 825686768 QXEUDMXNVMKNJY-QGZVFWFLSA-N 383.558 2.577 0 50 GFAA CCOc1cccnc1S(=O)(=O)N1CC[C@@H](Oc2ccc(Cl)cc2)C1 1875313725 YHWOSINTYNNOEP-OAHLLOKOSA-N 382.869 2.976 0 50 GFAA CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)N2CC[C@H](O)C(F)(F)C2)cc1 888101931 PPEBQZMCXKJYTD-AWEZNQCLSA-N 390.452 2.634 0 50 GFAA O=C1C[C@@H](N2CCN(C3CCCCC3)CC2)C(=O)N1c1ccc(Cl)cc1 100150312 QHQNUURBBSFXLV-GOSISDBHSA-N 375.900 2.922 0 50 GFAA O=C(c1ccccc1F)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697496 BGVVPHZZBJIJSS-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA Cc1noc(C)c1C(=O)N1C[C@H](CC(=O)NC2C3(CC3)C23CC3)OCC12CCC2 2325785224 KVCQEEHFJBVDDE-HNNXBMFYSA-N 399.491 2.504 0 50 GFAA CCc1nnc(NC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)s1 1057923 NKCCDXILJGGSDB-UHFFFAOYSA-N 380.495 2.527 0 50 GFAA CNC(=O)CN(Cc1ccc(Cl)cc1Cl)S(=O)(=O)c1ccccc1 1146260 HTIQBCNAQHOVFD-UHFFFAOYSA-N 387.288 2.930 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)Cn2nc(C)c3ccccc3c2=O)CC1 2356153239 XZWLFNAZIKAUFG-UHFFFAOYSA-N 391.471 2.869 0 50 GFAA COc1nc2c(cc1CN1CCC[C@]3(CCc4c[nH]nc43)C1)C(=O)N(C(C)C)C2 2356161750 IFHGDCGMEQOZSE-QFIPXVFZSA-N 395.507 2.658 0 50 GFAA COCCn1c(Cc2ccccc2)nnc1SCC(=O)NCc1ccccc1 2631167 COHNTKQDPIXMON-UHFFFAOYSA-N 396.516 2.924 0 50 GFAA COc1cc([C@H]2N[C@H](C(=O)O)Cc3c2[nH]c2ccccc32)cc(OC)c1OC 3882107 SAADZRJBOQGELC-MAUKXSAKSA-N 382.416 2.882 0 50 GFAA biogenic,in-vitro O=S(=O)(Cc1ccccc1)N1CCC(N2CCN(c3ccccc3)CC2)CC1 4703413 KVQMWSXFCLILRY-UHFFFAOYSA-N 399.560 2.803 0 50 GFAA CCN1CCC[C@H](C(=O)NCc2cccnc2N2CCc3ccccc3C2)C1 67514251 LCGFLSJHWJHFAF-NRFANRHFSA-N 378.520 2.992 0 50 GFAA COc1c(C)cnc(Cn2c(=O)n(CC(C)C)c3ncc(C(=O)O)cc32)c1C 55042188 OLKMCGRDQKALQM-UHFFFAOYSA-N 384.436 2.621 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc4c(c3)OCCO4)C[C@H]2CCO)c1 104396077 PBVVYKOKRQMYKM-HXUWFJFHSA-N 398.503 2.535 0 50 GFAA Cc1ncc(CN2CCN(S(=O)(=O)c3cccc4cnccc34)CC2)s1 111346007 OTFUNWSCZHJLRO-UHFFFAOYSA-N 388.518 2.506 0 50 GFAA CC(C)(Oc1cccc(Cl)c1)C(=O)Nc1cnn(CCN2CCOCC2)c1 112635276 HMTZTRJSYQCUSI-UHFFFAOYSA-N 392.887 2.665 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3cc4ccccc4n3C)C2)CC1 55133431 HMKSDAAVBZVNAA-GOSISDBHSA-N 398.507 2.557 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](N(C)Cc1ccc(-n3cccn3)cc1)C2 67982235 UMGUJRNVDFVCEA-KRWDZBQOSA-N 379.464 2.776 0 50 GFAA O=C1NC[C@H](c2ccc(F)cc2)Cc2[nH]c(-c3noc(-c4ccco4)n3)nc21 65404464 VSBRDSOOBANOIK-LLVKDONJSA-N 379.351 2.929 0 50 GFAA C[C@@H](NC(=O)CN1CCSC[C@H]1C(=O)OC(C)(C)C)c1ccc(F)cc1 253370489 RKEFOGGRFSFQAZ-CJNGLKHVSA-N 382.501 2.762 0 50 GFAA CN(C)CC1CCC(NC(=O)c2ccc3c(c2)[nH]c(=O)n3CC(F)(F)F)CC1 119958699 CLOMJILIBBRKFM-UHFFFAOYSA-N 398.429 2.742 0 50 GFAA CCCOc1ccc(CNC(=O)N2CCO[C@H](Cn3cc(C)cn3)C2)c(C)c1 252494980 OJVSPZDYXSJBHH-FQEVSTJZSA-N 386.496 2.899 0 50 GFAA O=C(N[C@@H]1CC(=O)N(C2Cc3ccccc3C2)C1)c1cc2cc(F)ccc2[nH]1 72153861 OOMFKAHYECXXJL-QGZVFWFLSA-N 377.419 2.805 0 50 GFAA CCOC(=O)c1ccc(NC(=S)NC(=O)c2c(Cl)c(C)nn2C)cc1 5584421 ZSSCCBXOZUYQRJ-UHFFFAOYSA-N 380.857 2.685 0 50 GFAA Cc1noc([C@H]2COCCN2C(=O)[C@@H]2C[C@]23CCOc2ccc(Cl)cc23)n1 328607725 WUJRGGQQMZSTTE-KHYOSLBOSA-N 389.839 2.672 0 50 GFAA Cc1ccc(C(=O)N[C@H]2CCCN(C)C2=O)cc1NC(=O)c1ccccc1F 480146294 RKAARRSZEUDKJF-KRWDZBQOSA-N 383.423 2.737 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@H]2NC(=O)N1CCC2(C1)Oc1ccccc1O2 367470728 VSGCJYGMTWABLP-CQSZACIVSA-N 383.452 2.819 0 50 GFAA Cc1nnc(SCC(=O)Cn2cnc3ccccc3c2=O)n1-c1ccccc1 30947919 XQHPDZTXMYLUPH-UHFFFAOYSA-N 391.456 2.647 0 50 GFAA O=C(NCC(F)F)[C@@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 71758975 JXXIFXLNFZMQNQ-GOSISDBHSA-N 391.506 2.712 0 50 GFAA C[C@H](NC(=O)c1cc(C(=O)O)nn1-c1ccccc1)[C@H]1COc2ccccc21 237582001 WRZUACKPQQCZIU-XJKSGUPXSA-N 377.400 2.865 0 50 GFAA CN1CCC(NC(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71754439 BPCRUKXNYDPHMZ-DEOSSOPVSA-N 391.515 2.744 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc(CN(C)C)cc2)c1 71747162 LAATYYGAUMCUTO-UHFFFAOYSA-N 376.478 2.800 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)CCO1 238200584 NWDMFEIVVQCRAO-MRXNPFEDSA-N 383.448 2.592 0 50 GFAA C[C@]1(CNC(=O)CCn2c(S)nnc2-c2cccs2)CCCC[C@H]1O 129924214 LLEIHDPQRYREGH-CXAGYDPISA-N 380.539 2.743 0 50 GFAA FC(F)Oc1ccc(-n2nnnc2CN2CCOC3(CCCCC3)C2)cc1 173844286 QVQQIZDGOLSROX-UHFFFAOYSA-N 379.411 2.799 0 50 GFAA CC(C)N(C)Cc1ccc(CNC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 241316723 LUIYIUHNIKGPGR-YLJYHZDGSA-N 375.538 2.597 0 50 GFAA Cc1cc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)no1 16130422 XFJRGLPNAMAFIB-UHFFFAOYSA-N 399.475 2.646 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@@H](F)C[C@H]1CNC(=O)CC1CCCC1 82137063 MTGDIGOESAMICA-IRXDYDNUSA-N 379.476 2.860 0 50 GFAA Cc1cc(C)c(C(=O)N[C@H](c2cnc3ccccc3c2)C2CC(O)C2)c(=O)[nH]1 220134780 PWSYUPBFIGKUNI-LAGYLCCXSA-N 377.444 2.782 0 50 GFAA O=C1N(Cc2nc(-c3ccccc3)no2)c2ccccc2NC12CCNCC2 82091994 YOEMECYONVROGM-UHFFFAOYSA-N 375.432 2.818 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)N(C)[C@@H](C)c2ccc3c(c2)OCCO3)cc1 426445682 VDBZHCNNDLXYKY-AWEZNQCLSA-N 393.447 2.504 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(C)c(Cl)c3)CC2)c2cnn(C)c2n1 179419147 CSLNQKKCGRAOLB-UHFFFAOYSA-N 399.886 2.988 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@@H](NCc3ccc4c(c3)OCO4)C2=O)cc1 96471176 ZNEZTAFSRUJVJQ-QGZVFWFLSA-N 382.416 2.626 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(N(C)C)cc2)C1 95504155 GSKJBCSBKXXMLO-IBGZPJMESA-N 383.540 2.921 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCc3[nH]c(-c4ccccc4)nc3C2)nc(=O)[nH]1 96151195 FOLQGBFONOSWOJ-UHFFFAOYSA-N 377.448 2.557 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(C(=O)c1cn(C)c3ccccc13)CC2 91625990 PKNQFGQDNLNUTP-UHFFFAOYSA-N 377.492 2.911 0 50 GFAA CCn1ncc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)c1C 95386227 OCJHOVVQJQTMNU-PWRODBHTSA-N 380.492 2.619 0 50 GFAA Cc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)[C@H]2C[C@@H](O)C2)cc1N1CCNC1=O 244724291 MRHNKCVMAOHNQM-HQRMLTQVSA-N 397.450 2.906 0 50 GFAA CCn1cc(NC(=O)c2cc(NC(=O)C(C)C)ccc2Cl)c(C(N)=O)n1 298155239 ZIUXKGXMRMLMDX-UHFFFAOYSA-N 377.832 2.502 0 50 GFAA CC(C)[C@H](CNS(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F)N1CCCC1 670453640 CAAJOBOOXMPDGV-AWEZNQCLSA-N 392.880 2.576 0 50 GFAA C[C@@H]1Oc2ccc(NC(=O)c3cnc(-c4ccccn4)nc3)cc2N(C)C1=O 952978671 SMJODSVBQYAHEW-LBPRGKRZSA-N 375.388 2.535 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCCC[C@H]1CO 170590994 GBYQFLLILXWCIC-GXTWGEPZSA-N 380.901 2.555 0 50 GFAA CS[C@@H]1CCC[C@H]1N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 170690279 LQRLJCKJYVPJTI-WOJBJXKFSA-N 390.597 2.860 0 50 GFAA COc1ccc([C@@H]2CC(c3ccc(F)cc3)=NN2S(C)(=O)=O)c(OC)c1 170614097 GIYXFTZEFMXQSK-KRWDZBQOSA-N 378.425 2.954 0 50 GFAA Cc1cccc(S(=O)(=O)CCCN2CCN(c3cccs3)C(=O)C2)c1 186062448 AFIYIFKFSOWNCE-UHFFFAOYSA-N 378.519 2.569 0 50 GFAA COC[C@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)C1CC1 191610593 RQKUMUXGVCOJST-AWEZNQCLSA-N 397.353 2.744 0 50 GFAA COc1cccc([C@H]2CCN(C(=O)CSc3nnc(C)s3)C2)c1OC 1506407035 LQINYLNIBFCALD-LBPRGKRZSA-N 379.507 2.972 0 50 GFAA CCn1c(N(C)C[C@H]2Cc3ccccc3CN2C)nc2cc(C(=O)O)cnc21 1529090380 HWCSLZINLSKHBO-QGZVFWFLSA-N 379.464 2.642 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)Cc3ccc(CO)cc3)CC1)OCC2 1704316166 YOZCJCUCAXFYEV-UHFFFAOYSA-N 381.472 2.821 0 50 GFAA O=C(NCCCOC1CCCC1)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772819156 GENLOMCVHPUQIJ-HNNXBMFYSA-N 393.553 2.550 0 50 GFAA O=C(O)[C@H]1CCCC[C@H]1C(=O)OCCCCOC(=O)[C@H]1CCCC[C@H]1C(=O)O 5101348 CAOCATZETDLGIH-SYMSYNOKSA-N 398.452 2.635 0 50 GFAA COC[C@H]1CCCN(C(=O)c2cc(Cn3cnc4cc(C)c(C)cc43)[nH]n2)C1 12299739 GWIDHPLPBSKUKX-INIZCTEOSA-N 381.480 2.923 0 50 GFAA Cc1c(CN(C)C(=O)C[C@@H]2C(=O)NCCN2CCC(C)C)[nH]c2ccccc12 12442777 FOBJQKJHBOWIAT-HXUWFJFHSA-N 384.524 2.671 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@@H](C(=O)Nc2cccc(-c3ccc(F)cc3)c2)C1 12456427 AOSLNEFHHIQCGW-GOSISDBHSA-N 397.450 2.806 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(C)o3)C2)cc1 13545275 FTUXJDNCSVUYSV-INIZCTEOSA-N 378.494 2.787 0 50 GFAA O=C1CN(Cc2cc[nH]n2)C[C@@H](OCc2ccccc2)CN1C1CCCCC1 14741178 DHHHKDCVKDDIGB-OAQYLSRUSA-N 382.508 2.972 0 50 GFAA CC[C@H](COC)NC(=O)[C@H]1CCCN(c2nc(C)c3ccc(OC)cc3n2)C1 14879454 JOSMUJFDSMSULG-JKSUJKDBSA-N 386.496 2.704 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@H](CCC(=O)N3CCN(C)CC3)C2)o1 19742304 XNTVTYXQGNIOPZ-MRXNPFEDSA-N 393.553 2.549 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4ccccc34)C2)c1 169772766 USNBDTNPMJOFES-CYBMUJFWSA-N 377.404 2.513 0 50 GFAA COCCn1cnnc1CCn1ccnc1-c1cc2cccc(C)c2nc1O 1857688270 ZSGZNQZWJOTVJQ-UHFFFAOYSA-N 378.436 2.593 0 50 GFAA O=C(O)[C@@H]1CC[C@H](NC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 262683398 BMFIPDRGRIEFOC-WKPIXPDZSA-N 399.274 2.968 0 50 GFAA CCCOc1c(CN2CCC[C@@H](CN(C)S(C)(=O)=O)C2)cccc1OCC 809688255 FWXKFZMCNNFWQO-KRWDZBQOSA-N 398.569 2.978 0 50 GFAA COCCn1cc(CN2CCC(O)(c3cccc(OC(F)(F)F)c3)CC2)cn1 827898082 DZKNJPOFYZGCQC-UHFFFAOYSA-N 399.413 2.912 0 50 GFAA O=C(C[C@@H]1COc2ccccc2O1)NS(=O)(=O)Cc1ccc(Cl)c(F)c1 1875289485 VWNCQRXYRJTKPU-GFCCVEGCSA-N 399.827 2.655 0 50 GFAA O=C(c1ccc2c(c1)CCS2(=O)=O)N1CCC[C@H](c2cccc(O)c2F)C1 1875299318 HNETXYCSJMQDBM-HNNXBMFYSA-N 389.448 2.881 0 50 GFAA O=C(NCC12CC(CN1C(=O)[C@@H]1CCCC[C@H]1O)C2)c1cscc1Cl 1875332802 LMKPCGWXMYSCNO-XOFPWGPXSA-N 382.913 2.673 0 50 GFAA COCC1(CNC(=O)C[C@@H](C)CC(C)(C)C)CCN(C(=O)[C@@H](C)OC)CC1 1775989083 CHEFZXVZPIUOCW-IAGOWNOFSA-N 384.561 2.855 0 50 GFAA CCCN(C(=O)COc1ccc(-n2cnnn2)cc1)[C@@H]1CCc2ccccc21 2325731524 QCSKIKIQBNVSNU-HXUWFJFHSA-N 377.448 2.967 0 50 GFAA Cc1c(C(=O)N2CCN(C(=O)Nc3cccc(Cl)c3)CC2)cnc2ccnn12 2325815497 QBEMEHDPDSFYLD-UHFFFAOYSA-N 398.854 2.681 0 50 GFAA C[C@]1(C2CC2)NC(=O)N(c2ccc(CNCc3ccc(C(=O)O)s3)cc2)C1=O 903686286 GVQJYQHLYCGMJL-HXUWFJFHSA-N 399.472 2.961 0 50 GFAA Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c1C 651234 MHAPMVYMVMXMGQ-UHFFFAOYSA-N 376.478 2.660 0 50 GFAA CCN1C(=O)[C@](O)(CC(=O)c2ccccc2O)c2cc(Br)ccc21 1129639 VCTFKZQQSHHTSE-SFHVURJKSA-N 390.233 2.982 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cccc4[nH]c(=N)sc34)C1)CC2 2356154277 PMFLJJLWAJNSMR-FQEVSTJZSA-N 379.489 2.927 0 50 GFAA COc1cc(Cl)ccc1S(=O)(=O)N1CCN(c2ccc(F)cc2)CC1 4139773 LZTGRAPVJGYRSK-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA CCOC(=O)[C@@H](OC(=O)c1cc(OC)c(OC)c(OC)c1)c1ncccc1C 225526274 ROOIAZPFMOABQI-SFHVURJKSA-N 389.404 2.877 0 50 GFAA C[C@@H](C1CC1)N(Cc1ccccc1)C[C@@H](O)CN1C(=O)c2ccccc2C1=O 229590987 YXEGSHQRRDHKTP-QFBILLFUSA-N 378.472 2.944 0 50 GFAA CC(C)(O)CCc1ccc(CN2CCC(C(N)=O)(N3CCCCC3)CC2)cc1 72473466 JJJWONMHIBTOQD-UHFFFAOYSA-N 387.568 2.696 0 50 GFAA O=C(Cn1nc(C(F)F)c(Cl)c1C1CC1)N1N=CC[C@]1(O)C(F)(F)F 6317287 OMRRNGMHHQBDIY-LBPRGKRZSA-N 386.708 2.821 0 50 GFAA OC1(Cc2ccccc2)CCN(c2nc(-c3ccncc3)nc3c2CNC3)CC1 72155949 BYSDBQPHONLEIJ-UHFFFAOYSA-N 387.487 2.716 0 50 GFAA CC(C)(C)n1cc(C(=O)N2CCO[C@H](C(=O)O)C2)c(-c2ccc(F)cc2F)n1 236775791 FDZVCVJWUDMGHR-HNNXBMFYSA-N 393.390 2.509 0 50 GFAA COC(=O)[C@@H]1Cc2ccccc2CN1[C@H]1CC(=O)N(c2cc(C)ccc2C)C1=O 239433793 YMIGHRTTYJDODZ-PMACEKPBSA-N 392.455 2.535 0 50 GFAA COc1ccc(NC(=O)N2CCCC[C@@H]2CS(C)(=O)=O)c2cccnc12 454610087 LPTUAHRDNJYPBH-CYBMUJFWSA-N 377.466 2.674 0 50 GFAA Cc1cc(C(F)(F)F)nn1CCNC(=O)c1n[nH]c(N)c1-c1ccccc1 220335558 JAEKOFLIORJDMU-UHFFFAOYSA-N 378.358 2.613 0 50 GFAA COc1ccc(C(C)(C)C(=O)N2CCN(CC3CCOCC3)CC2)cc1OC 176534902 XNMYBKAWIQDGOK-UHFFFAOYSA-N 390.524 2.552 0 50 GFAA CN(CC1(CO)CCOCC1)C(=O)NC[C@@H](c1ccccc1)N1CCCCC1 426536593 ZMXWSYJKNFIJAV-FQEVSTJZSA-N 389.540 2.644 0 50 GFAA O=S(=O)(NC[C@@H]1CN(C2CC2)CCO1)c1cc2cc(Cl)ccc2s1 176929998 JDGYHFHUCREDLA-CQSZACIVSA-N 386.926 2.696 0 50 GFAA Cc1cc(N2CCN(C(=O)NCc3ccc4nsnc4c3)CC2)cc(C)n1 426658575 VDWJHDFDUXAEPA-UHFFFAOYSA-N 382.493 2.735 0 50 GFAA CC[C@H](Cn1ccnc1)NC(=O)N1CCC(c2nnc3n2CCCCC3)CC1 426698494 VOLQPXHEAIMSDZ-QGZVFWFLSA-N 385.516 2.569 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)NCCn2ccc3ccccc32)CC1 426415320 JDEHBJRKGTVUMG-UHFFFAOYSA-N 377.492 2.872 0 50 GFAA Cc1[nH]c2c(F)cccc2c1CC(=O)N1CCNC(=O)[C@H]1Cc1ccccc1 91619917 UAVUDJWUDARZGY-LJQANCHMSA-N 379.435 2.728 0 50 GFAA O=C(NCc1ccccn1)c1ccc(OC2CCN(c3cnccn3)CC2)cc1 96149494 HIVOLOVGOXQHMN-UHFFFAOYSA-N 389.459 2.849 0 50 GFAA O=C(c1c[nH]nc1-c1ccccc1)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95363034 ZMCLVMJTPNUMBB-QFBILLFUSA-N 380.492 2.792 0 50 GFAA CC[C@H](NS(=O)(=O)c1cccc(C(=O)N(C)CC)c1)c1ccc(O)cc1 95366923 SAWGENMEKNQATM-SFHVURJKSA-N 376.478 2.914 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cccc(O)c3)CC2)CN1CCc1ccncc1 91575248 XSEDCLUVYYEEHL-UHFFFAOYSA-N 393.487 2.875 0 50 GFAA Cc1csc2nc(CNC(=O)C[C@H]3CN(Cc4ccccc4)CCO3)cn12 244873595 WSQMYFCCTQKHOZ-SFHVURJKSA-N 384.505 2.612 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccccc1-n1cnnn1)c1nc2ccccc2n1C 252501003 UBIYSBFRSPLWAV-GOSISDBHSA-N 375.436 2.676 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@H]1C[C@@H](c2cc(O)ncn2)C1 253535616 JGMHQACNJWNYHP-OKILXGFUSA-N 377.466 2.539 0 50 GFAA Cc1csc(NC(=O)CC[C@H]2N=C(O)N(CCc3cccc(F)c3)C2=O)n1 252570372 WOHGNXDUZOAARV-CQSZACIVSA-N 390.440 2.677 0 50 GFAA Cn1cc(NC(=O)[C@H](Cc2cn(C)c3ccccc23)NC(=O)OC(C)(C)C)cn1 263587478 HKDLMSSDJUQOOX-KRWDZBQOSA-N 397.479 2.986 0 50 GFAA Cn1c(=O)oc2cc(NC(=O)N3CCC(OCc4cccnc4)CC3)ccc21 299763132 YREOUVFGAHYPSI-UHFFFAOYSA-N 382.420 2.740 0 50 GFAA O=C(NCc1cccnc1)C(=O)Nc1nc2ccc(Br)cc2s1 299738272 PRVDYZWTOJSWDY-UHFFFAOYSA-N 391.250 2.709 0 50 GFAA O=C(Nc1ccc2c(c1)OC(F)(F)O2)NC1CCN(C[C@@H]2CCCO2)CC1 299783943 KPUCBLKWYUJQEE-AWEZNQCLSA-N 383.395 2.773 0 50 GFAA CNC(=O)[C@@H]1CCCN(C(=O)c2ccc(-c3cc(C)c4nccn4c3)cc2)C1 584893509 NQMURGAWMDNKFR-GOSISDBHSA-N 376.460 2.908 0 50 GFAA CC(C)c1nc(N2CCC(N3C[C@@H](C(=O)O)CC3=O)CC2)cc(C(C)(C)C)n1 1349523523 TWWAIBJWUFIOCQ-AWEZNQCLSA-N 388.512 2.799 0 50 GFAA C[C@@H](C(=O)NCCC(=O)Nc1ccc(F)cc1)c1nnc(O)c2ccccc12 952988783 SGEBBHASGKZDHM-GFCCVEGCSA-N 382.395 2.723 0 50 GFAA CC(=O)N1CCC(CC(=O)N2CCC(C)CC2)(N2Cc3ccccc3C2=O)CC1 952963805 KGHUYXVDPNFFFO-UHFFFAOYSA-N 397.519 2.672 0 50 GFAA COc1ccc(OCCN2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)cc1 1565507343 DPHHXZGJOWAUBM-HKUYNNGSSA-N 381.476 2.706 0 50 GFAA C[C@H]1Oc2ccccc2N(CCC(=O)N[C@H](CCC(=O)O)c2ccccc2)C1=O 268889914 IXSNPVPWPQDZIH-NVXWUHKLSA-N 396.443 2.913 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)Cc2cccc(C(=O)O)c2)CC1 170067742 QUPRVKXTNFRRHT-UHFFFAOYSA-N 380.444 2.657 0 50 GFAA NS(=O)(=O)c1ccc(CCNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)cc1 278157789 BXKAPOXTJGJHLF-CHWSQXEVSA-N 384.910 2.511 0 50 GFAA CSc1cccc(NC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c1 170616462 XQQYNFVPBKLLPF-UHFFFAOYSA-N 398.531 2.743 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)nc(O)n1 1506406786 OOEJLLRECZQQGM-CYBMUJFWSA-N 388.855 2.569 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3csc(Cc4ccccc4)n3)C[C@H]2O)on1 1529134341 XSVLITOVINUABE-CRAIPNDOSA-N 383.473 2.706 0 50 GFAA CCCCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(F)cc1 5027674 LBWXPSRCPHWVKV-UHFFFAOYSA-N 376.457 2.513 0 50 GFAA Cc1nc(CN(C)C[C@]2(O)CCCN(Cc3ccccc3F)C2=O)cs1 12205986 POCWMSOBWXTNNV-LJQANCHMSA-N 377.485 2.576 0 50 GFAA CCOc1ccc(CN2CCC[C@@H](CNC(=O)c3cccnc3)C2)cc1CO 12315212 CYSWPNQVNKMCQH-SFHVURJKSA-N 383.492 2.615 0 50 GFAA CCOc1ccc(CN2CCC(n3nccc3NC(=O)C3CC3)CC2)cc1CO 12711276 DXBKFAWFGDQAQT-UHFFFAOYSA-N 398.507 2.960 0 50 GFAA COc1cccc(CN2C[C@@H]3C[C@@H](c4ccc(CO)o4)N4CCC[C@@]34C2=O)c1 12754170 MMDABGBGEJOTTA-BPXKWBHBSA-N 382.460 2.719 0 50 GFAA O=C(NCCCN1CCCC1)c1cccc(NS(=O)(=O)c2ccccc2)c1 13671033 HSNUSZLBGUYIOU-UHFFFAOYSA-N 387.505 2.703 0 50 GFAA COc1cccc(CN[C@H]2CCc3c(c(C(=O)N(C)C)nn3CC(C)C)C2)c1 14533716 LEKSIODLHVIVRJ-KRWDZBQOSA-N 384.524 2.897 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2)CN(C(=O)c2cccnc2)CC1=O 14535025 NQCSXHJUSMLCLS-HXUWFJFHSA-N 381.476 2.607 0 50 GFAA COc1ccc(C(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)c(OC)n1 1857677109 XMWDFLWUOKJNRP-CECAUBDESA-N 382.460 2.697 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857681073 XBXFIDFICHVNEY-YYDVJCTNSA-N 380.488 2.600 0 50 GFAA COc1nc2ccccc2cc1-c1ccc(S(=O)(=O)N2CCNCC2)cc1 1875241021 LPXUVSYCTJFUPN-UHFFFAOYSA-N 383.473 2.504 0 50 GFAA NS(=O)(=O)c1cccnc1NCC1(c2cccc(Cl)c2)CCOCC1 301276406 OYOQMUUGXYDMHM-UHFFFAOYSA-N 381.885 2.543 0 50 GFAA Cc1ccc(N2CCCN([C@H]3CCCN(c4ccccc4F)C3=O)CC2)nn1 245786898 NABIVNGEABECFE-IBGZPJMESA-N 383.471 2.632 0 50 GFAA O=C(c1cnc2n(c1=O)CCS2)N1CCc2c(Cl)cc(Cl)cc2C1 132911008 RGHMLIQLTPXCRD-UHFFFAOYSA-N 382.272 2.854 0 50 GFAA Cc1ccccc1-c1noc(CN2CCC[C@]3(CCc4cnc(N)nc43)C2)n1 1704360433 YFJDCIIOQLSHBU-NRFANRHFSA-N 376.464 2.897 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)c3ccc(C(N)=O)c(Cl)c3)cn2)C[C@H](C)O1 1875280437 JMBYYZHXAZHMKC-RYUDHWBXSA-N 388.855 2.700 0 50 GFAA COc1ccc(-c2cc(NC(=O)c3cccc(CS(C)(=O)=O)c3)ncn2)cc1 1875356921 RWDFWTRHJUQAED-UHFFFAOYSA-N 397.456 2.949 0 50 GFAA CN(C)C(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)CCCc1ccc(F)cc1)C2 1875394456 JKMZTHZTGQCJFM-LESCRADOSA-N 385.439 2.853 0 50 GFAA O=C1CCc2cc(S(=O)(=O)Nc3cccc(Oc4cnccn4)c3)ccc2N1 1317849962 QTCNPMFTCJTKCS-UHFFFAOYSA-N 396.428 2.954 0 50 GFAA O=S(=O)(NCc1ccco1)c1ccc(-n2cc(Br)cn2)cc1 40456687 BYVLTOZSKNDWGC-UHFFFAOYSA-N 382.239 2.706 0 50 GFAA in-vitro Cc1ccc2[nH]c(C(=O)NC[C@@](C)(N)Cn3cccn3)cc2c1Br 2325774910 FIJMPMAQMYLUAO-QGZVFWFLSA-N 390.285 2.583 0 50 GFAA Cc1cc(C)c(CCN2C(=O)CCN(CCCc3ncn(C)n3)C2=O)c(C)c1 2325779482 IWUJKHNAIRZLRR-UHFFFAOYSA-N 383.496 2.570 0 50 GFAA COc1cccc(OC)c1[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)C1 2325786690 RZLLRTNILRMLFS-INIZCTEOSA-N 378.432 2.914 0 50 GFAA O=C(c1ccccc1NCCO)N1CCc2cc(O)c(Br)cc2C1 2325804882 ZZMKHAWAFZPUFI-UHFFFAOYSA-N 391.265 2.757 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@H]1CCCN1C1CCOCC1 245666453 BJQDXBQYWUPSBC-IFXJQAMLSA-N 395.906 2.817 0 50 GFAA CC(=O)N1CCN(c2ccc(NC(=O)c3ccc(Br)o3)cc2)CC1 1004365 QXPQKGPUEJVDCK-UHFFFAOYSA-N 392.253 2.963 0 50 GFAA CS(=O)(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCC2)cc1 1051414 XQWSAHMEILIQOA-UHFFFAOYSA-N 387.461 2.546 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)Nc1ccccc1 1119140 XIYXPFIMEQXFHA-LLVKDONJSA-N 383.267 2.755 0 50 GFAA COc1cc(Cl)cc2cc(C(=O)N3C[C@H]4[C@@H](CO)[C@@H]5CC[C@@]4(C3)O5)oc12 2356136974 NREAUQYYISGTSU-BZIRYSOJSA-N 377.824 2.707 0 50 GFAA CC[C@H](C)C(=O)NCc1ccnc(CNC(=O)c2cn3cc(Cl)ccc3n2)c1 2356141473 CQTSCRSZCDEWBM-ZDUSSCGKSA-N 399.882 2.975 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356147411 VBJIMERBODCANH-NRFANRHFSA-N 383.496 2.587 0 50 GFAA CCn1nccc1C(=O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356165268 AMNLMRLERJQZJW-JOCHJYFZSA-N 380.492 2.743 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc(SC)c2)cc1C 2871272 UIXCWYBKEUTWJP-UHFFFAOYSA-N 394.518 2.985 0 50 GFAA COc1cccc(-c2cc(C(=O)N3CCN(C(=O)c4ccco4)CC3)on2)c1 6872390 DKBAPWYZIWZJNE-UHFFFAOYSA-N 381.388 2.541 0 50 GFAA Cc1ccc(CNC(=O)c2c(C)oc3nc(C)nc(N4CCOCC4)c23)cc1 8596944 BQQOZBCGFYVULM-UHFFFAOYSA-N 380.448 2.915 0 50 GFAA C[C@@](O)(CNC(=O)[C@H](C1CC1)N1CCCC1)c1ccccc1Br 225623083 YIUUSSPKVBATOI-FUHWJXTLSA-N 381.314 2.647 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(O)c(Cl)c3)C[C@@H]2CCO)CC1 20599735 UVSQEFISMDOTDA-IBGZPJMESA-N 395.975 2.787 0 50 GFAA Cc1nc([C@H](C)NC(=O)c2cc(COc3cccc4cccnc34)on2)n[nH]1 67878345 JVKLAJKDZNXOGP-NSHDSACASA-N 378.392 2.719 0 50 GFAA CC[C@H](C(=O)NCCc1cc(=O)[nH]c(C)n1)n1cc(C(C)=O)c2ccccc21 65405315 XPKKWQXMXMPJJP-GOSISDBHSA-N 380.448 2.546 0 50 GFAA Cc1cnn(CCNC(=O)C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)c1 118132825 LUWMBKIZVAHRAS-UHFFFAOYSA-N 382.395 2.878 0 50 GFAA COc1ccc(CNC(=O)C2CCN(C(=O)NCc3ccc(C)nc3)CC2)cc1 472951244 JLERPVXJHUCJFX-UHFFFAOYSA-N 396.491 2.637 0 50 GFAA Cc1cc(S(=O)(=O)NCCc2cccc(C(=O)N(C)C)c2)sc1Cl 252499905 SIOCIUYBNFKRQU-UHFFFAOYSA-N 386.926 2.933 0 50 GFAA O=C(CCOC[C@H]1CCCO1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 230231991 ONXRLYRXNBGDQJ-WOJBJXKFSA-N 398.507 2.854 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(Cc3c(Cl)ccc4cccnc34)C2=O)nn1 328608483 AOMUKOUIWNNSTK-MRXNPFEDSA-N 398.854 2.928 0 50 GFAA CC(C)(C)C1CCN(c2nnc([C@H]3COCCO3)n2C[C@H]2CCOC2)CC1 328805043 CVEDFVMOOADCKD-NVXWUHKLSA-N 378.517 2.665 0 50 GFAA CN(C)C[C@]1(O)CCCN(S(=O)(=O)c2ccc(-c3ccccc3)cc2)CC1 72161900 NAIXTNDEMJVVIO-NRFANRHFSA-N 388.533 2.821 0 50 GFAA CCN(CC)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72143635 HOCRAURYVMHLIG-OAQYLSRUSA-N 379.504 2.913 0 50 GFAA CCN(CC)CC(=O)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 72151870 GVXHCKDHKUOPJP-OAQYLSRUSA-N 375.488 2.509 0 50 GFAA O=C(NCCc1cnccn1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1 369931037 RMAYFBNLSBJIBM-INIZCTEOSA-N 380.370 2.821 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1Cc2ccccc2C[C@H]1C(=O)O 237734168 LBJXQBBHSBTJND-HNNXBMFYSA-N 382.445 2.504 0 50 GFAA Cc1nn(C)cc1CN1CCc2c(c(C(=O)NC3CCCC3)nn2CC(C)C)C1 14745133 UTGQZQAOWSUDOK-UHFFFAOYSA-N 398.555 2.812 0 50 GFAA O=C(NCCC1(O)CCOCC1)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 376533088 SPEKYRUYUPQHER-OAHLLOKOSA-N 393.553 2.843 0 50 GFAA Cc1nnc(NS(=O)(=O)c2ccc3c(c2)CN(C(=O)OC(C)C)CC3)s1 77453286 PQIGEHCEPJXALB-UHFFFAOYSA-N 396.494 2.550 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2[C@H]3C=C(c4ccnn4C)C[C@H]2CC3)cc1 283774867 QBSXSXZZBCMSAV-RTBURBONSA-N 379.464 2.637 0 50 GFAA C[C@H]1OCC(=O)N(Cc2ccccc2)[C@@H]1C(=O)N(C)c1nc2ccccc2o1 284898139 SXPFKOXXGPCOHI-KUHUBIRLSA-N 379.416 2.607 0 50 GFAA Cn1c(=O)c(C(=O)N2CCC([C@H](O)Cc3ccccc3)CC2)cc2ccccc21 82099692 WSCULNXGVHKMQU-JOCHJYFZSA-N 390.483 2.994 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(CCCOc1ccc(F)cc1)CCN2C 95361369 BLVAJMIBSLCRCT-OAQYLSRUSA-N 377.504 2.613 0 50 GFAA Cc1cccnc1C[C@@H](C)N(C)C(=O)Nc1cccc(N2C(=O)CNC2=O)c1 95524816 BHSVYUHKTFNLRR-CQSZACIVSA-N 381.436 2.541 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N(C)C[C@@H](C)O)cc3o2)cc1OC 95526105 JSAZUBIZEJCKSZ-CYBMUJFWSA-N 384.432 2.889 0 50 GFAA COc1ccc(CC(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)cc1OC 238955699 XXWHPPZCGGTQKU-UHFFFAOYSA-N 378.432 2.588 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 239159663 MOOIWKWMSIFBDR-CWLKWCNXSA-N 376.884 2.731 0 50 GFAA Nc1ncccc1CN1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91586399 BITRKLVPODWBHT-JOCHJYFZSA-N 379.508 2.506 0 50 GFAA CC(C)(C)S(=O)(=O)CC(=O)N1CCO[C@H](c2ccccc2C(F)(F)F)C1 183482240 JSKHANVISIRGKY-AWEZNQCLSA-N 393.427 2.819 0 50 GFAA Cn1nc(-c2ccc(C(=O)NCCN3CCCOC3=O)cc2)c2ccccc21 534590796 KCZBIYHKEPRHRK-UHFFFAOYSA-N 378.432 2.812 0 50 GFAA CC[C@H](O)CNC(=O)CC/C(C)=C/Cc1c(O)c2c(c(C)c1OC)COC2=O 294096292 IUEAFVOFARKHOJ-CYIWUNGXSA-N 391.464 2.536 0 50 GFAA O=C1C[C@H](C(=O)NC[C@H]2Cc3cccc(-c4cncnc4)c3O2)c2ccccc21 299759957 REAUDBHKDYAPCM-UZLBHIALSA-N 385.423 2.934 0 50 GFAA CCN(CC1CCOCC1)C(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 584889264 IECAXLVQPCCRLU-MRXNPFEDSA-N 379.888 2.903 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@H](CNC(=O)c3cc4ncccn4n3)C2)c1 824629402 RERURHZIGWJGDX-HNNXBMFYSA-N 397.454 2.519 0 50 GFAA CC(C)C(=O)N1CCC[C@H](NS(=O)(=O)c2cc(Cl)ccc2Cl)C1 825527262 CSQVSLYKVMJLIZ-LBPRGKRZSA-N 379.309 2.919 0 50 GFAA O=C(NCc1cccc(OCC(F)(F)F)c1)c1cn(-c2cccnc2)nn1 1350556288 VCICLXUKWWPWDT-UHFFFAOYSA-N 377.326 2.533 0 50 GFAA COc1cccc(CCN(Cc2ccc(F)cc2)C(=O)[C@@H]2CCCN2C(N)=O)c1 952989575 WJCRHRDFRHNZQX-FQEVSTJZSA-N 399.466 2.949 0 50 GFAA CC(=O)c1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(CCCc2ccccc2)C3)n[nH]1 1565507145 MKVQRRMDVBWHPU-MOPGFXCFSA-N 380.492 2.782 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OC(C)C)c(Cl)c3)C(=O)[C@@H]2C1 277948517 CJEMQBWHXRPTRT-RISCZKNCSA-N 380.828 2.847 0 50 GFAA COc1cccc2c1OC[C@@H](NC(=O)NCCOc1ccc(F)c(F)c1)C2 170622279 RQGOZTFXXAKRHS-ZDUSSCGKSA-N 378.375 2.655 0 50 GFAA CCOc1ccc(Oc2cc(CNC(=O)c3[nH]nc4c3CNCC4)ccn2)cc1 188716549 GXKRFLPRBZGBAW-UHFFFAOYSA-N 393.447 2.571 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCC[C@H](N)C3)cc2)c(C)c1Br 195118214 HKBYNQRHAXUDKC-AWEZNQCLSA-N 377.286 2.815 0 50 GFAA COc1ccccc1-n1cc(CN2CC[C@H](N3CCCCCC3)[C@@H](O)C2)cn1 1615633292 XRUZVWGCGFXSES-FPOVZHCZSA-N 384.524 2.692 0 50 GFAA Cc1cc(C[C@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@@H]2O)on1 1616077991 LIXIWYZEGGGFLW-AVRDEDQJSA-N 379.460 2.992 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCC2(c3ccc(OC)cc3)CCCC2)C1 1506414580 GERUNWMMBHBFIM-QGZVFWFLSA-N 396.553 2.700 0 50 GFAA O[C@@H]1CCCN(c2ccnc(NCCN3CCC(c4ccccc4)CC3)n2)C1 1704298841 DZJGELGCCDFIKI-HXUWFJFHSA-N 381.524 2.729 0 50 GFAA O=C1CCOC2(CCN(c3cnccn3)CC2)CN1Cc1ccc(Cl)cc1 1704303606 LSJBSSJUXVZUAW-UHFFFAOYSA-N 386.883 2.918 0 50 GFAA O=C1CCCN1CCN1C[C@H]2CN(CC3CC3)C[C@@]2(CCc2ccccc2)C1 1772809239 PZVFKQWABYPPAK-LADGPHEKSA-N 381.564 2.885 0 50 GFAA O=C(Cc1cn2ccsc2n1)NC[C@@H]1Cc2cccc(-c3cnccn3)c2O1 11784765 MRPUNSSHOSSQCW-HNNXBMFYSA-N 391.456 2.515 0 50 GFAA COc1ncccc1C(=O)N[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 12072721 WQMXVXIGTQTUMH-ZDUSSCGKSA-N 380.370 2.903 0 50 GFAA COc1ccc(-n2c(CNC(=O)Cc3csc(C)n3)nnc2SC)cc1 12243070 BLMZXZSXQLPSQI-UHFFFAOYSA-N 389.506 2.622 0 50 GFAA COc1ccc2nc(CNC(=O)c3cn(Cc4ccc(Cl)cc4)nn3)[nH]c2c1 12306567 FLSVPCCPHQXTKS-UHFFFAOYSA-N 396.838 2.795 0 50 GFAA CCN(CC)C[C@@H](O)COc1cc(CNCCc2cccnc2)ccc1OC 12448945 IXARNTWZBWBHEA-HXUWFJFHSA-N 387.524 2.504 0 50 GFAA CCOCc1nnc(NC(=O)C2CCN(C(=O)c3cccs3)CC2)s1 12864689 UPOPMBQDRLUTNH-UHFFFAOYSA-N 380.495 2.627 0 50 GFAA O=C(C/N=c1\snnn1-c1ccccc1)Nc1cccc(C(F)(F)F)c1 4531375 MLAYVYVMALVUFG-HKWRFOASSA-N 379.367 2.887 0 50 GFAA c1ccc(Cn2nc([C@@H]3CCOC3)nc2-c2ccc(N3CCOCC3)nc2)cc1 1857667757 UTCAFPMCJCRHGH-LJQANCHMSA-N 391.475 2.729 0 50 GFAA CCn1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)c(C)n1 1857714243 NRKIODCZTLSRCG-BWKHYTDRSA-N 394.519 2.621 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)c2ccc(N3CCCC3)c(Cl)c2)C[C@@H]1O 1857721612 YDGQBCYDMKYZBN-AZUAARDMSA-N 380.916 2.926 0 50 GFAA CCCc1cc(C(=O)N2C[C@@H]3OC(=O)N(CCc4ccccn4)[C@@H]3C2)cs1 213321736 BJHOUDKYZBGSIR-MSOLQXFVSA-N 385.489 2.984 0 50 GFAA CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O 4763714 GTXSTEDIVHHJQL-BPUTZDHNSA-N 396.509 2.650 0 50 GFAA in-vitro O=C(O)C1CCN(C(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)CC1 238028043 VXJDWBISRMAGPY-LBPRGKRZSA-N 385.247 2.670 0 50 GFAA NC[C@H]1CCCC12CCN(C(=O)[C@@H](Cc1ccccc1)N1CCCOC1=O)CC2 1875277780 FWIVFQHDMXHJHV-WOJBJXKFSA-N 399.535 2.808 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2c(F)cccc2F)C1)C1CC2(C1)C[C@H]2C(=O)O 1875277554 QLTQYTTVYNVJOV-POPMDCJUSA-N 378.419 2.546 0 50 GFAA NC(=O)[C@@H]1CC[C@H](C(=O)NCc2ccc(-c3cccc(C(F)(F)F)c3)o2)O1 1875268584 ZPNIALMFEVHOHI-LSDHHAIUSA-N 382.338 2.615 0 50 GFAA CC(=O)Nc1cc(NC(=O)Nc2nnn(Cc3cc(C)no3)c2C)ccc1C 1875257919 KTRNBZNUMSWGDQ-UHFFFAOYSA-N 383.412 2.842 0 50 GFAA Cc1nc(C(N)=O)nc(N2CC[C@@H](N[C@H](C)c3ccc4ccccc4n3)C2)c1C 1875397574 FJGNNZMJEBWWHO-NVXWUHKLSA-N 390.491 2.670 0 50 GFAA Cc1ccccc1CC1(O)CCN(C(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)CC1 1875396901 WWBXQKAOHLAOMC-CVEARBPZSA-N 383.492 2.950 0 50 GFAA CCNc1ncc(C(=O)N[C@@H]2C[C@H](Cn3cc(Cl)cn3)C[C@H]2O)cc1Cl 1875403547 WFPTWGJGWDUZPR-COLVAYQJSA-N 398.294 2.586 0 50 GFAA CO[C@@H](Cc1ccc(F)cc1)Cn1cc(S(=O)(=O)N(C)C)nc1C(C)C 2325762794 DKEYAKDGCSEINM-INIZCTEOSA-N 383.489 2.654 0 50 GFAA Brc1cc(-c2nc(-c3cc(O[C@@H]4CCNC4)ccn3)no2)co1 2325772973 CNYUWGJLTSYLRG-LLVKDONJSA-N 377.198 2.895 0 50 GFAA CC[C@H](CC(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2)CC(F)(F)F 2325781058 HEBJABURORTPRB-SECBINFHSA-N 378.372 2.720 0 50 GFAA COc1ccccc1[C@@H](CNc1ncc(F)cn1)NC(=O)CC1(OC)CCC1 2325793026 CNWZAUWDRHEBCG-MRXNPFEDSA-N 388.443 2.853 0 50 GFAA Nc1ncnc2c1ncn2[C@H]1CCN(Cc2csc(Br)c2)C1 2325803850 GMXIEZQNZCEEMP-JTQLQIEISA-N 379.287 2.680 0 50 GFAA O=C(NC[C@H]1CCCCN1C(=O)c1cc2cccn2c(O)n1)Nc1ccccc1 2325805605 VSILGDWFTOYILI-QGZVFWFLSA-N 393.447 2.856 0 50 GFAA O=C(Nc1ccc(F)cc1N1CCOCC1)N1CCOc2cc(O)ccc2C1 459697324 MKHSBCCZDVQGPL-UHFFFAOYSA-N 387.411 2.794 0 50 GFAA COc1ccc(OCC(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 783715 NZIQDSJWGNAYTL-UHFFFAOYSA-N 392.458 2.726 0 50 GFAA Cn1cc(NC(=O)c2ccccc2COc2ccc(F)cc2F)c(C(N)=O)n1 2787928 FNJJJJKQCCMTMZ-UHFFFAOYSA-N 386.358 2.629 0 50 GFAA CCn1c([C@H]2CCCN(C(=O)CCCc3c[nH]c4ccccc34)C2)n[nH]c1=O 67802898 WSAPMFIFMVBNTO-INIZCTEOSA-N 381.480 2.802 0 50 GFAA O=C1[C@H](NC(=O)N2CCCC[C@@H]2CCc2ccccc2)CCN1C1CCOCC1 119079036 CYDGFTGUWLNCSO-TZIWHRDSSA-N 399.535 2.963 0 50 GFAA CCc1cccc(NC(=O)CNC(=O)NC[C@H](CO)Cc2ccc(C)cc2)c1 252487237 HTIKVCUZYIPOIC-LJQANCHMSA-N 383.492 2.646 0 50 GFAA CN(C)[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CCC(=O)NCCCn1ccnc1 11789512 PRMFMKMYMDGSKC-FCHUYYIVSA-N 397.567 2.622 0 50 GFAA CN1CCC[C@@H](CNS(=O)(=O)CCC2CCOCC2)[C@@H]1c1cccs1 330305387 QPOOLSYIYJCYQB-FUHWJXTLSA-N 386.583 2.867 0 50 GFAA Cc1ccn(-c2cc(NCCNC(=O)c3ccc(C(F)(F)F)cc3)ncn2)n1 72441507 GDJGIPUXBNIEGI-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA CN1C[C@@H](C(=O)N(C)C(C)(C)c2ccc3c(c2)OCO3)c2ccccc2C1=O 365837677 XFJKMIUSUUMQAT-QGZVFWFLSA-N 380.444 2.978 0 50 GFAA O=C(O)c1ccc(C[C@@H]2CCN(C(=O)c3cc4ccccc4[nH]c3=O)C2)cc1 72426795 LAPDPDHYDXYXEJ-HNNXBMFYSA-N 376.412 2.931 0 50 GFAA O=C(N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1ncccc1OCC(F)(F)F 156610339 IZMRZJGLSQNYFJ-AWEZNQCLSA-N 399.413 2.934 0 50 GFAA Cc1ncc(CC(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)c(=O)[nH]1 71681295 OADJOYXCTHCGRX-HNNXBMFYSA-N 382.247 2.528 0 50 GFAA CCCN(Cc1ccccc1F)C(=O)C[C@H]1C(=O)NCCN1CC(C)(C)C 72156199 ALZSWBOBMCUPRH-SFHVURJKSA-N 377.504 2.801 0 50 GFAA Cc1nc(C)n(-c2ccc(C(=O)Nc3cc(S(C)(=O)=O)ccc3F)cc2)n1 225432466 TZCBHVHWRBFXCE-UHFFFAOYSA-N 388.424 2.679 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)N3CC(=O)N(c4ccccc4)C[C@H]3C)oc2c1 82107670 ZFLRNCWEDPRMMP-OAHLLOKOSA-N 376.412 2.979 0 50 GFAA CC(=O)NCC1CCN(Cc2ccccc2-c2nc(C(C)C)cc(=O)[nH]2)CC1 48356921 WUPIHEYCDPJMBA-UHFFFAOYSA-N 382.508 2.908 0 50 GFAA CC(C)(NS(C)(=O)=O)c1noc([C@@H]2CCN(c3ccccc3Cl)C2)n1 289770772 LFCHJIQKEBOMLM-LLVKDONJSA-N 384.889 2.501 0 50 GFAA CC(C)CN1CCCn2nc(CNC(=O)[C@H](C)N3CCCCCC3)cc2C1 82087876 RDMFABRGCPQCMM-SFHVURJKSA-N 375.561 2.626 0 50 GFAA CN(C[C@@H]1COc2ccccc2O1)C(=O)CCCc1nc(-c2cccnc2)no1 426505601 BSKXGVWIYUUQMF-MRXNPFEDSA-N 394.431 2.753 0 50 GFAA CO[C@@]12CC[C@H](Oc3ccccn3)C[C@@H]1N(Cc1cnn3cccnc13)CC2 426387857 WDDJXZMEYUSOML-BBTUJRGHSA-N 379.464 2.715 0 50 GFAA O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)C1CCN(C(=O)CCO)CC1 95521037 JLDCJEXBZZGMKF-UHFFFAOYSA-N 392.459 2.789 0 50 GFAA COCCN1CCC[C@@]2(CCN(c3ccc(-c4ccc(F)cc4)nn3)C2)C1=O 95382439 KHZWPOAEJHALMV-NRFANRHFSA-N 384.455 2.748 0 50 GFAA CCc1nnc(CNC(=O)Nc2cc(N3CCOCC3)ccc2Cl)s1 95527845 PVIHIMRONYACGI-UHFFFAOYSA-N 381.889 2.912 0 50 GFAA NC(=O)C1(N2CCCCC2)CCN(C(=O)Nc2ccc3ncccc3c2)CC1 95528814 NFNYZAUDHYWPOU-UHFFFAOYSA-N 381.480 2.573 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CC[C@@H](CN)C3)cc2Br)on1 299740406 ZHXSYHUVUVHOTE-LBPRGKRZSA-N 394.269 2.745 0 50 GFAA COC(=O)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(O)CC(=O)CC[C@]5([C@@H]3CC[C@]21C)[C@H](OC)O4 253596737 VLMLLACKDSNIAO-ZOCMJNGNSA-N 392.492 2.608 0 50 GFAA COc1ccc(C(C)=O)cc1CC(=O)N1CCC(CC(=O)N2CCCC2)CC1 298590162 LABVYUXMEQFCBP-UHFFFAOYSA-N 386.492 2.691 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3cccc(-c4ncc[nH]4)c3)cc2C1 299795489 MDISDFKYJZBXGJ-UHFFFAOYSA-N 378.480 2.819 0 50 GFAA COc1ccc(/C=C/CN2CCC(CNC(=O)Cn3ccnc3C)CC2)cc1 824646610 IMISJMSAOOVCQD-ONEGZZNKSA-N 382.508 2.742 0 50 GFAA Cc1cc(-c2nc(C3CC3)nn2-c2cc(S(N)(=O)=O)ccc2F)c(C)o1 670456847 IGQKTDJHPXDGCE-UHFFFAOYSA-N 376.413 2.808 0 50 GFAA O=C(NCCNC(=O)c1c(F)cccc1F)c1cnc(Oc2ccccc2)cn1 170591577 JWJKEDNCFUEQND-UHFFFAOYSA-N 398.369 2.707 0 50 GFAA COc1cc(OC)c(CN2CCN(c3nccc(C(C)C)n3)CC2)c(OC)c1 185658636 ZNOVUBLGGYBFRW-UHFFFAOYSA-N 386.496 2.948 0 50 GFAA COc1cccc2c1OC[C@@H](NC(=O)Nc1cc(C)nn1-c1ccccn1)C2 170875269 LYRJKNVKZFPKFT-HNNXBMFYSA-N 379.420 2.710 0 50 GFAA Cn1c(CN2CCC[C@H](C(=O)NCC3CC3)C2)nnc1-c1ccc(Cl)cc1 186277820 OGQXUDQDZFDIMD-INIZCTEOSA-N 387.915 2.874 0 50 GFAA COCc1cccc(S(=O)(=O)N2CCN(c3cncc4ccccc34)CC2)c1 193994178 KMQVBHWAJKMHBN-UHFFFAOYSA-N 397.500 2.892 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N1CCCN(Cc2cccs2)CC1 1506407029 IIPPOVXYQVJCLW-UHFFFAOYSA-N 392.546 2.646 0 50 GFAA Cc1ccc(-c2nc(CN3CCC4(CC3)OCC[C@@](C)(O)[C@@H]4O)c(C)o2)cc1 1704343609 KCOMBXLOANBJTJ-LEWJYISDSA-N 386.492 2.825 0 50 GFAA COc1ccc(Cn2cc(C)c(Oc3cc(C)nc4ncnn34)n2)cc1OC 5379406 WAUQLBFDMGDRDN-UHFFFAOYSA-N 380.408 2.795 0 50 GFAA CN(CC(=O)N(C)[C@@H]1CCCN(CCc2ccccc2)C1)Cc1cccnc1 11664941 UPCHRLIPQPNYAB-JOCHJYFZSA-N 380.536 2.679 0 50 GFAA CCOc1ccc(NC(=O)c2cccc(N3C(=O)[C@@H](C)CS3(=O)=O)c2)cc1 12003954 PSJQERKZMKERJD-ZDUSSCGKSA-N 388.445 2.650 0 50 GFAA O=C1C[C@@H](C(=O)NCc2ccccc2)Cc2nc(NC(=O)C3CCC3)sc21 12040958 TUQQKUYZTYMCHL-AWEZNQCLSA-N 383.473 2.943 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@@H]1CCCN(C(=O)CCn2cnnn2)C1 12474824 VWTBLOZVXUURBT-HXUWFJFHSA-N 389.459 2.852 0 50 GFAA O=C(Nc1nnc([C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)s1)[C@@H]1CCCO1 12862848 OBYZZRVZLAMFDR-MFKMUULPSA-N 392.868 2.830 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1ccccn1)CC2 14540849 IDLXHNSAMKCANV-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA Cn1nc(C(=O)NCc2ccccc2F)c2c1CC[C@H](NCc1cccnc1)C2 14740347 IDSGQXWDHMHNLW-KRWDZBQOSA-N 393.466 2.531 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)c1cn(Cc2ccc(F)cc2)nn1 15068410 HGDNIUFQCXPSFL-UHFFFAOYSA-N 393.422 2.522 0 50 GFAA CC(=O)Oc1cccc(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)c1 16731677 QIPVOGIXQOVZBC-GZTJUZNOSA-N 377.425 2.599 0 50 GFAA CCOC(=O)c1nn(CCC(F)(F)F)c2c1CN(C(=O)c1ccco1)CC2 19110703 BGNVCUSDRBUMQL-UHFFFAOYSA-N 385.342 2.804 0 50 GFAA c1ccc(-c2nnc(CN3CC[C@@]4(CN(Cc5cnsc5)CCO4)C3)o2)cc1 1857686165 KNBJIDMMQHZOTP-FQEVSTJZSA-N 397.504 2.670 0 50 GFAA COc1ccccc1CCN1C(=O)C[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(F)cc1 1857687532 XPYLSDYFCJAJBG-PMACEKPBSA-N 396.462 2.821 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(-c4ccc(O)cc4)cc3)C[C@H]2O)n[nH]1 1857720241 KTGHHHKRRWJTRK-WIYYLYMNSA-N 377.444 2.766 0 50 GFAA CC1(CCC(=O)N2CCO[C@@H](CN3CCC(O)CC3)[C@@H]2c2ccccc2)CC1 1857721138 BCJKWEXYDCZWJV-UNMCSNQZSA-N 386.536 2.992 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N4CC(c5ccncc5)C4)CC3=O)sc2c1 1875250214 GNVGIPWUJBPYQF-HNNXBMFYSA-N 392.484 2.979 0 50 GFAA CS(=O)(=O)c1cc(S(=O)(=O)Nc2ccc(F)c(F)c2F)ccc1Cl 328596111 SODJCPWLSRTQME-UHFFFAOYSA-N 399.799 2.962 0 50 GFAA COc1ccccc1N1CCC(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)CC1 138733275 WPTWUPLMPHEQLG-MRXNPFEDSA-N 385.508 2.571 0 50 GFAA COc1ccc(C)cc1CCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1O 363314948 PJKRBCJBTKHSHT-GOSISDBHSA-N 382.460 2.673 0 50 GFAA CN(CC(C)(C)CN1CCOCC1)C(=O)c1c[nH]nc1-c1c(F)cccc1F 159628194 VGTNZHUNWDZSPX-UHFFFAOYSA-N 392.450 2.785 0 50 GFAA O=C(O)c1csc(C[C@@H]2CCCN(Cc3ccc(-n4cccn4)nc3)C2)n1 1875298760 MIXOEQIEDXSPBK-AWEZNQCLSA-N 383.477 2.877 0 50 GFAA Cc1cc(CC(=O)N[C@@H](Cc2cc(Cl)ccc2F)C(=O)O)ccc1CO 1875312878 DTXUFRNKXGYVDP-KRWDZBQOSA-N 379.815 2.634 0 50 GFAA C=CC(=O)N1C[C@H](NC(=O)[C@H]2C[C@H]2c2cnn(C(C)C)c2)Cc2ccccc21 1875389602 UWNDWPJMTYQYQI-QYZOEREBSA-N 378.476 2.828 0 50 GFAA NC(=O)[C@@H](CNC(=O)CC[C@@H]1CCc2ccccc2C1=O)Cc1ccc(F)cc1 1875316134 WSPNROZVXJFASN-ZWKOTPCHSA-N 396.462 2.811 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(F)c(COCC2CC2)c1 1875403128 QNVFKPHGGPCYFP-CDHQVMDDSA-N 387.455 2.518 0 50 GFAA COc1cc(NC(=O)NC2(c3nc(C)no3)CCOCC2)ccc1OC(F)F 888100354 CHMIMTXZDUKIFK-UHFFFAOYSA-N 398.366 2.815 0 50 GFAA CN(Cc1nc2c(n1C)CCCC2)C(=O)NC[C@H]1CC(=O)Nc2ccccc21 2325776144 SRUYPWFVAUEOBT-CQSZACIVSA-N 381.480 2.566 0 50 GFAA O=C(c1ccc(-c2nc(-c3cnn4ccccc34)no2)cc1)N1CCOCC1 2325776704 NCORVXYPBDKRJK-UHFFFAOYSA-N 375.388 2.524 0 50 GFAA C/C=C/C[C@H](CC)C(=O)N1[C@H]2CC[C@@H]1CN(C(=O)c1cc(N(C)C)ccn1)C2 2325872866 PTXDHLFTAHFXKQ-ZALUGJFXSA-N 384.524 2.955 0 50 GFAA CCOC(=O)C1=NN(C(=O)Cc2ccccc2)[C@@](O)(c2ccc(Cl)cc2)C1 1214852 CXEMHOIHPJJOES-FQEVSTJZSA-N 386.835 2.879 0 50 GFAA O=C(/C=C/c1ccccc1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356139387 QICINYGYZYMJCT-UWPLLCTKSA-N 382.504 2.987 0 50 GFAA COc1ccc([C@H]2N[C@H](C(=O)O)Cc3c2[nH]c2ccccc32)c(OC)c1OC 4012431 NEEYWOPERFZLCV-DOTOQJQBSA-N 382.416 2.882 0 50 GFAA biogenic COc1ccc(CCNC(=O)c2cc3cccc(OC)c3oc2=O)cc1OC 4838369 LJAFPQYISYCEMC-UHFFFAOYSA-N 383.400 2.791 0 50 GFAA biogenic COc1ccccc1C(=O)Nc1cccc(NC(=O)C(=O)NC2CCCC2)c1 55225647 NWSVSYJYLMYZTM-UHFFFAOYSA-N 381.432 2.945 0 50 GFAA CCNc1cc(C)nc(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)n1 67603428 GCFQPVYBRSUQKZ-UHFFFAOYSA-N 378.480 2.589 0 50 GFAA COc1cccc(OC)c1-c1cnnc(N(C)C[C@H]2Cc3ccccc3O2)n1 12074551 SCJWSYZHXZIGQJ-OAHLLOKOSA-N 378.432 2.996 0 50 GFAA Cc1cc(NC(=O)C(=O)N[C@H]2CCc3cn[nH]c3C2)ccc1Oc1cccnc1 252537025 KEOXKKCZIYBYGT-INIZCTEOSA-N 391.431 2.518 0 50 GFAA CC1(C)[C@H](NC(=O)C(=O)Nc2ccccc2N2CCCCCC2)[C@@H]2CCO[C@H]21 230217625 JJDDNUKJIZUXGE-KFKAGJAMSA-N 385.508 2.935 0 50 GFAA CN(C[C@H]1CCCCO1)C(=O)c1cc2n(n1)CCCN(Cc1ccccc1)C2 65433462 LIHYLWAZJJJSDS-HXUWFJFHSA-N 382.508 2.930 0 50 GFAA Cc1ncc(-c2cc(C(=O)N3CCN(C)C(=O)[C@H]3C)c3cccc(C)c3n2)cn1 63845246 RDCTWVRKGHOTHX-CQSZACIVSA-N 389.459 2.611 0 50 GFAA CC(C)CC(=O)Nc1ccnn1C1CCN(C(=O)[C@H](N)CC(C)(C)C)CC1 67489721 NNFGOWIFWNMWCI-MRXNPFEDSA-N 377.533 2.795 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC1 2804354 RQKJBICWLHGUDV-UHFFFAOYSA-N 382.816 2.552 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC2(CC1)C(=O)Nc1ccccc12 72162511 ILTPWUZUODXMEC-UHFFFAOYSA-N 376.416 2.651 0 50 GFAA CCOc1ccc2cc(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)[nH]c2c1 152124450 ICMONPIFYQGXMQ-ZDUSSCGKSA-N 383.370 2.850 0 50 GFAA CN(Cc1cccc(N(C)C)c1)C(=O)NCc1ccnc(O[C@H]2CCOC2)c1 152341010 NDVXCCABMMSWCZ-IBGZPJMESA-N 384.480 2.657 0 50 GFAA CC(C)N1CCN(c2ccc(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc2)CC1 363201236 YEJCIDAABRRVFO-NRFANRHFSA-N 397.523 2.845 0 50 GFAA O=C(NC[C@H]1CCCS1(=O)=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 124477554 ODUBJPLDKHHERO-CRAIPNDOSA-N 375.494 2.982 0 50 GFAA COC[C@H](O)CN1CCC(Nc2nc3ccccc3nc2N2CCCCC2)CC1 153005456 ZKJVSCIIDIOQSZ-GOSISDBHSA-N 399.539 2.504 0 50 GFAA NC1(c2noc([C@@H]3CC(=O)N(Cc4cccc(C(F)(F)F)c4)C3)n2)CCC1 261644550 DNEUTHFWHITPPO-GFCCVEGCSA-N 380.370 2.942 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)n(C)n1 215419993 BGMLIAZWLONUHN-LBPRGKRZSA-N 377.452 2.805 0 50 GFAA O=C(c1ccc(-n2cncn2)c(F)c1)N1CCC(C(=O)N2CCCCCC2)CC1 172976571 IIWIYSKJOHKKCZ-UHFFFAOYSA-N 399.470 2.661 0 50 GFAA CC[C@H]1CN(S(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)c2ccccc2O1 172902803 ZGQHCGKRLNPDCJ-INIZCTEOSA-N 386.473 2.962 0 50 GFAA CCc1nnsc1C(=O)N1CCC[C@@H](Nc2ccc(OC)c(OC)c2)C1 72153822 PLZOTRPYPNAWQF-CYBMUJFWSA-N 376.482 2.834 0 50 GFAA COc1c(C)cc(C(=O)N[C@@H]2CC(=O)N(C3Cc4ccccc4C3)C2)cc1C 72165951 UOYGEZXWACCWMD-LJQANCHMSA-N 378.472 2.810 0 50 GFAA CN(C[C@@H](c1cccs1)N1CCOCC1)C(=O)Cc1noc2ccccc12 177965655 QNRVBJMSTWMKCN-KRWDZBQOSA-N 385.489 2.964 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)cn1 91656341 RNYYRWUHFDSUBO-SFHVURJKSA-N 385.508 2.722 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)c(C)o1 91906556 KAAREMJUYOXNQP-UHFFFAOYSA-N 384.480 2.707 0 50 GFAA Cc1ccc(-c2nc(-c3ncoc3C(C)C)n([C@@H]3CCS(=O)(=O)C3)n2)o1 96140668 KQYCMVGDKQINAY-GFCCVEGCSA-N 376.438 2.985 0 50 GFAA O=C(CCc1ccccc1)NCc1cc2n(n1)CCCN(C(=O)C1CCC1)C2 91475467 DKJJAPFSELSOAB-UHFFFAOYSA-N 380.492 2.665 0 50 GFAA O=C(Cc1cccnc1)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95368703 UKNMDYXHEUNHTC-MTNREXPMSA-N 383.442 2.991 0 50 GFAA COc1cccc(N2CCN(CCC(=O)Nc3cccc(C)c3C)CC2=O)c1 244723900 MJPVMHOQNUGYQC-UHFFFAOYSA-N 381.476 2.989 0 50 GFAA O=C(NCC1(CO)CCOCC1)Nc1cccnc1Oc1ccc(F)cc1 299774430 HCGNHSBIGMAGLJ-UHFFFAOYSA-N 375.400 2.924 0 50 GFAA CC(=O)N1CCN(C(=O)c2ccccc2-c2nc(-c3ccccc3)no2)CC1 820569507 VTJFWAJDKFJCNJ-UHFFFAOYSA-N 376.416 2.708 0 50 GFAA COc1cc(CCC(=O)N2CC[C@](C)(C(=O)O)C2)ccc1OCC(F)(F)F 269048456 UKHXKEJWVCJVAI-KRWDZBQOSA-N 389.370 2.892 0 50 GFAA CCc1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(OC)cc2)C3)cn1 1565514378 MXKPGTACANKYRW-MJGOQNOKSA-N 380.492 2.784 0 50 GFAA CCS(=O)(=O)c1cc(Cl)cc(CNS(=O)(=O)c2cccs2)c1 1463889844 VNRPKFRDZXKXJD-UHFFFAOYSA-N 379.912 2.674 0 50 GFAA O=S1(=O)CC[C@H](n2cc(CNc3ccccc3OC(F)(F)F)cn2)C1 170679457 LGDRISZMHATADM-LBPRGKRZSA-N 375.372 2.753 0 50 GFAA COc1ccc(C(=O)N2CCC(C(=O)N3CCn4cccc4[C@@H]3C)CC2)cc1 1506406950 KXYAYPCPUMIGMW-INIZCTEOSA-N 381.476 2.952 0 50 GFAA CN(C)CCc1nnc(NC(=O)COc2ccc(Cl)cc2Cl)s1 1529106417 OKNTWPHDCYFQGU-UHFFFAOYSA-N 375.281 2.967 0 50 GFAA COc1cc(-c2onc(N3CCC[C@H](CNC(C)=O)C3)c2C(=O)O)ccc1F 1704310532 ZVDCLUPMIWSVTR-GFCCVEGCSA-N 391.399 2.540 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3cncc(N(C)C)n3)CC1)OCC2 1704325262 KPOAMEAMFOZFGO-UHFFFAOYSA-N 384.480 2.628 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1cnc(C2CC2)nc1O 1704303795 OPHKXEULRHUJNZ-DNVCBOLYSA-N 390.443 2.595 0 50 GFAA CCCN1C[C@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)C[C@@]2(CCC(=O)O)C1 1772819347 KBPSDTRIUGXMRZ-KSFYIVLOSA-N 398.507 2.531 0 50 GFAA CCCCN(C)C(=O)C[C@@]1(c2ccccc2Cl)CC(=O)N(CCOC)C1=O 11813285 JGQVMLMIUPZIEP-FQEVSTJZSA-N 394.899 2.632 0 50 GFAA Cc1cccc(CCNC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)n1 11821938 VURCQNUUYOEIGD-UHFFFAOYSA-N 381.388 2.658 0 50 GFAA CCOC(=O)C[C@@H]1CCCCN1Cc1nc(-c2ccc(C(=O)OC)cc2)no1 11841337 HRBJIJYBUZGRHL-INIZCTEOSA-N 387.436 2.831 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CNC1CCOCC1 12300285 QMDCIHPRUXBOKU-UHFFFAOYSA-N 378.476 2.875 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(Cc3ncc[nH]3)CC2)c1 12302562 KJPMKAHGZRXNAH-UHFFFAOYSA-N 384.480 2.698 0 50 GFAA Cc1nc(-c2cnccn2)n(CC(=O)Nc2ccc(F)c(Cl)c2)c(=O)c1C 169755667 MUYCIVHAHUIIBS-UHFFFAOYSA-N 387.802 2.748 0 50 GFAA CCCOCC(=O)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1857527992 QRZUUJFGNAWQID-UHFFFAOYSA-N 380.510 2.604 0 50 GFAA Cc1cc(N2CCO[C@@]3(CCN(C(=O)C4CCOCC4)C3)C2)c2ccccc2n1 1857688114 UONHZPBCFNGRFD-QHCPKHFHSA-N 395.503 2.778 0 50 GFAA Cc1ccc(CC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1F 1857716598 DNQVGJNDUSESGA-VIZSFHNOSA-N 394.446 2.978 0 50 GFAA COc1cc2c(cc1CNC(=O)c1sc(N3CCOCC3)nc1C)CCC2 1857724493 YKNGJWXORBPOGJ-UHFFFAOYSA-N 387.505 2.715 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c(C)n1 1857731021 IAEXKUWVIOQXQM-KNKQGSTJSA-N 377.444 2.613 0 50 GFAA O=C(CCc1ccsc1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 112622698 CDFKWDRGAYQBHA-LJQANCHMSA-N 383.517 2.630 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3C[C@@H](CO)C[C@@H](CN(C)C)C3)c2)c1 247963543 FWLYGHLHRIRTPP-ROUUACIJSA-N 382.504 2.994 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O)c1cnn(C)c1 164169558 POERQIHEEDXADC-IFXJQAMLSA-N 392.459 2.761 0 50 GFAA COCCCOCC(=O)N1Cc2cnn(-c3ccc(F)cc3)c2CC(C)(C)C1 952893157 SJTUWMUUGAXWTC-UHFFFAOYSA-N 389.471 2.975 0 50 GFAA C=CC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)c2cccc3c2CCOC3)C1 1875383454 VIBXWYOUWRRYHV-DQMBHMMVSA-N 390.483 2.892 0 50 GFAA Cc1noc2nc(-c3ccccc3C(F)(F)F)cc(C(=O)NS(C)(=O)=O)c12 1875390315 SQSNEWSCNVRZJZ-UHFFFAOYSA-N 399.350 2.906 0 50 GFAA CC[C@@H]1CCO[C@@H]1C(=O)Nc1ccc(Oc2ccc(S(N)(=O)=O)cc2)cc1 888102435 YYYRUARIOFCLGB-ACJLOTCBSA-N 390.461 2.880 0 50 GFAA Cc1[nH]nc2ccc(NC(=O)C(=O)N[C@@H](CN3CCCC3)c3ccccc3)cc12 2325767240 PDTZJEQJTMFCJF-FQEVSTJZSA-N 391.475 2.763 0 50 GFAA O=C(Cc1nc(-c2ccc(F)cc2)cs1)N=c1cc(C2CCNCC2)[nH][nH]1 2325774942 JOEQSMMADMYIMC-UHFFFAOYSA-N 385.468 2.742 0 50 GFAA O=C(c1cn2c(n1)COCC2)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1 2325791095 RZKXGSRVWGUWHW-UHFFFAOYSA-N 383.839 2.655 0 50 GFAA COc1ccc(C)c2[nH]c(C(=O)NCCN3C(=O)COc4ccccc43)cc12 2325853783 BIKGRDUEIGBQAD-UHFFFAOYSA-N 379.416 2.640 0 50 GFAA C[C@@]1(C2CC2)NC(=O)N(c2ccc(CNCc3ccc(C(=O)O)s3)cc2)C1=O 903686284 GVQJYQHLYCGMJL-FQEVSTJZSA-N 399.472 2.961 0 50 GFAA COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1cc(OC)ccc1OC 808730 USWJYIPJJGVAOJ-UHFFFAOYSA-N 375.421 2.627 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@H]1c1cc2c(cc1Br)OCO2 831840 JJFXFBJLWNSDMU-JTQLQIEISA-N 382.210 2.618 0 50 GFAA COc1cc(NC(=O)CSc2nnc(C3CCCCC3)n2N)cc(OC)c1 1049767 JDQYFULOKYKTFV-UHFFFAOYSA-N 391.497 2.788 0 50 GFAA COc1cccc2c1C1(CCN(c3ccc(-c4nccn4C)nn3)CC1)OCC2 2356156660 LYUPHNOHBKTAFE-UHFFFAOYSA-N 391.475 2.954 0 50 GFAA O=C(Cc1ccc(-c2ccccc2)cc1)N1CCC[C@@]12CCCN(CCO)C2=O 2356167539 RNDRZGZLYCAKOS-XMMPIXPASA-N 392.499 2.872 0 50 GFAA Cc1nnc(NC(=O)[C@@H](C)Sc2nnc(-c3cccc(F)c3)n2C)s1 4993600 AMTRUONYQUGERW-MRVPVSSYSA-N 378.458 2.900 0 50 GFAA O=C(NCCC1=CSC2=NCCCN12)[C@@H]1CCCN1C(=O)C1CCCCC1 102354720 WLLPOFSDWPDHFM-KRWDZBQOSA-N 390.553 2.714 0 50 GFAA COc1cccc(-c2cnnc(N3CCN(Cc4csc(C)n4)CC3)n2)c1 55072174 FANIHXSJPGZNBR-UHFFFAOYSA-N 382.493 2.634 0 50 GFAA CO[C@]1(C)CCCN(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cn2)CC1 281126364 UTFLYKUHNHTUGZ-GOSISDBHSA-N 398.529 2.581 0 50 GFAA O=C(c1coc(COc2cccc3cccnc23)n1)N1CCN2CCC[C@@H]2C1 71315005 CBZYJDPBLGQCKP-MRXNPFEDSA-N 378.432 2.722 0 50 GFAA C[C@H](C(=O)NCc1ccc(F)cc1)N1CCN(c2ncnc3ccsc23)CC1 124356886 OSAOUPMYPDTPIY-CQSZACIVSA-N 399.495 2.657 0 50 GFAA NC[C@@H]1CCN(C(=O)/C=C/c2ccc(-n3cc(Br)cn3)c(F)c2)C1 328596432 PIPGUORJQDZWLL-OHVSUOQFSA-N 393.260 2.594 0 50 GFAA Cc1nn(C)c(C)c1C(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72164152 YMUJIODNVOVQPA-CEWLAPEOSA-N 382.483 2.878 0 50 GFAA Cc1cccc2ncc(C(=O)N3CCC[C@@H](Nc4ccc(F)cc4)C3)c(=O)n12 72133107 SFANCGGUWQFZHV-QGZVFWFLSA-N 380.423 2.859 0 50 GFAA Cc1cc(C)cc(N2CCN(C(=O)CCn3cnc4ccccc43)CC2=O)c1 77520335 RLUBHRNLLDZVLC-UHFFFAOYSA-N 376.460 2.919 0 50 GFAA CCNc1nc(C)cc(NCCNC(=O)c2ccccc2Br)n1 72117369 AYSATLHKYMUUNU-UHFFFAOYSA-N 378.274 2.821 0 50 GFAA CC(C)=C[C@H]1[C@H](C(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)C1(C)C 159041723 TYZXZUYETJRMTI-LSDHHAIUSA-N 375.450 2.780 0 50 GFAA O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H]1CCOc2ccccc21 237936478 QSPPYEOQIHMNSL-AEFFLSMTSA-N 382.391 2.985 0 50 GFAA O=S(=O)(N[C@H]1CCN(c2ccccn2)C1)c1ccccc1OC(F)(F)F 159349833 IWBPKFNDMAVERN-LBPRGKRZSA-N 387.383 2.537 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(C)cc(C)[nH]c2=O)CCC(=O)N1Cc1ccccc1 71753301 KGOIWEZDSJGBAP-GOSISDBHSA-N 381.476 2.645 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(NC)c(NC(=O)c2cc(Cl)c[nH]2)c1 132456413 MDRMBNMMLFAEMC-UHFFFAOYSA-N 384.889 2.993 0 50 GFAA O=C(NCc1ccco1)c1ccsc1NC(=O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 225755622 KJDXXVXBZRNICE-LWWSYDQCSA-N 386.429 2.733 0 50 GFAA O=C(Cn1ccc(-c2ccccn2)n1)Nc1ccnn1Cc1cccc(F)c1 48205495 LYZBNCYHQJCTBO-UHFFFAOYSA-N 376.395 2.968 0 50 GFAA O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CCC[C@H](c2ccn[nH]2)C1 177288072 IMUBIZZOTQWMFU-HNNXBMFYSA-N 391.431 2.942 0 50 GFAA CN(C)[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(-c4nn[nH]n4)cc3)cc2)C1 426374210 MOIISTBYSDKSSB-LJQANCHMSA-N 376.464 2.700 0 50 GFAA CC(C)(C)NC(=O)CN1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 426419943 ATPBWWYTBQBJMI-OAQYLSRUSA-N 375.488 2.555 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N(C)Cc4ncon4)csc3C2)nc1 426589728 FWESVDCKQBKAFB-UHFFFAOYSA-N 397.504 2.919 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2ccc(-c3noc(C4CC4)n3)cc2)on1 96148406 HAAIIDBTVTVDDU-AEFFLSMTSA-N 394.431 2.898 0 50 GFAA CC(C)OCC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91781548 UUZSEQFHGOACLE-UHFFFAOYSA-N 380.435 2.731 0 50 GFAA CCn1ccnc1[C@H]1CCCN(S(=O)(=O)CCOc2ccc(C)cc2)C1 91460565 ZEIGSZVVGPDJOP-KRWDZBQOSA-N 377.510 2.800 0 50 GFAA O=C(CCc1cccnc1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91745757 WHLIQTWYSRBLAM-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)c1cc(-c2ccccc2O)[nH]n1 97657347 QFCQFVPWEDDELC-UHFFFAOYSA-N 386.521 2.872 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(Cc1ccc(F)cc1F)CC2 95498565 HUYTXFURNDGVTC-UHFFFAOYSA-N 386.446 2.974 0 50 GFAA COC(=O)c1ccc(OC)c(NC(=O)NCC2(O)C3CC4CC(C3)CC2C4)c1 96147766 UIIHSSJMILGZMW-UHFFFAOYSA-N 388.464 2.791 0 50 GFAA CC(C)(CN1C[C@@](C)(Cc2ccc3c(c2)OCO3)CCC1=O)N1CCOCC1 91818572 IANLOHSNLBJIRH-JOCHJYFZSA-N 388.508 2.697 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N1CCO[C@H](Cc2ccccc2)C1 180520780 VPCFCJSWNFOWRG-OAHLLOKOSA-N 395.381 2.886 0 50 GFAA CC(C)c1cccc(NC(=O)N2CCN(CC(=O)Nc3cccnc3)CC2)c1 97698916 UJPTYFNNQTYTTJ-UHFFFAOYSA-N 381.480 2.993 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4cccs4)C3)CCC2=O)cn1 92065153 BFEVBWGTCLMRCB-FQEVSTJZSA-N 384.505 2.892 0 50 GFAA Cc1nc(-c2ncc(C(=O)NC[C@H](C)N(C)c3ccccc3)c(O)n2)cs1 91663864 VGZVLIQKYHANFU-LBPRGKRZSA-N 383.477 2.869 0 50 GFAA CC[C@H](C)N1C(=O)[C@@H]2[C@H](C(C)C)N[C@@]3(C(=O)Nc4c(Cl)cccc43)[C@@H]2C1=O 245325701 HLJFSDOUDBCMRB-WQWSPGPQSA-N 389.883 2.515 0 50 GFAA CC(=O)[C@@H]1[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]2[C@H]2c3ccccc3C=CN12 245312823 XNWFJPNYSLRIKF-GXRSIYKFSA-N 386.451 2.829 0 50 GFAA CCOc1cc(C=c2sc3nc4ccccc4n3c2=O)ccc1OC(C)=O 252671123 MSXXSGFJMFSFIR-UHFFFAOYSA-N 380.425 2.781 0 50 GFAA CC[C@H](Sc1nc2ccccc2o1)C(=O)NCCn1c(C)cc(C)nc1=O 822555073 ICSOZMDTWBAHTJ-INIZCTEOSA-N 386.477 2.688 0 50 GFAA Cc1cc(F)ccc1N1CCC(NCc2ccc(S(N)(=O)=O)cc2)CC1 952966205 FCGQIWPJZBXMKV-UHFFFAOYSA-N 377.485 2.540 0 50 GFAA Cn1c(-c2ccccc2F)nnc1S(=O)(=O)Cc1ccc(-n2ccnc2)cc1 170617130 HBVDKJUFGHBBCW-UHFFFAOYSA-N 397.435 2.781 0 50 GFAA CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)CC1OCCO1 170610231 QPEXYNICUHRGAF-UHFFFAOYSA-N 375.252 2.934 0 50 GFAA Cn1ncc2c(N)nc(N3CCC[C@@]4(CCCN(Cc5ccccc5)C4)C3)nc21 1506396397 FOYLTGIFORGLJW-JOCHJYFZSA-N 391.523 2.828 0 50 GFAA Cc1cc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc2sc(N)nc12 1529113755 IJFCLWAWMOBSRA-CRAIPNDOSA-N 383.473 2.762 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC2(O)CCCCC2)ccc1F 1704325736 MPZBXQOXFCHZKX-UHFFFAOYSA-N 391.443 2.980 0 50 GFAA CC(C)c1nc(CN2C[C@@H]3CN(C(=O)Cc4n[nH]c5ccccc45)CC[C@@H]32)co1 1775982914 UVMOJKMHHDBQND-YWZLYKJASA-N 393.491 2.950 0 50 GFAA CCn1ncc(C(=O)N2CCCN(Cc3cnn(-c4ccccc4)c3)CC2)c1C 1775977068 GRPYUBDSZVQYFT-UHFFFAOYSA-N 392.507 2.745 0 50 GFAA COc1cc(CNCCc2ccncc2)ccc1OC[C@@H](O)CN(C)C(C)C 12305243 QJCVLEYMNJBZBZ-FQEVSTJZSA-N 387.524 2.502 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@H]1CCCN(C2Cc3ccccc3C2)C1 12573935 BFDCBEPYPHGTBF-FQEVSTJZSA-N 380.536 2.718 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN([C@H](C)CSC)CC1 14950977 LJVABRPDKDOMFF-OAHLLOKOSA-N 396.553 2.666 0 50 GFAA CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCc2cccnc2)c1 15434442 RRUPJICVWPBPTE-UHFFFAOYSA-N 381.457 2.837 0 50 GFAA O=c1/c(=C/c2ccc(F)cc2)sc2nc3cc(Br)cnc3n12 16676033 PNGQACYVXTZFQB-XGICHPGQSA-N 376.210 2.754 0 50 GFAA Cn1ccn2ncc(C(=O)N3CCC4(CC3)C[C@@H](O)C[C@H](c3ccccc3)O4)c12 1857714941 UDRCYNFSUVZWPU-PKOBYXMFSA-N 394.475 2.560 0 50 GFAA CCCn1ncc(CN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1C 1857731092 KBZXHTZNUJRDEX-VWPQPMDRSA-N 380.492 2.876 0 50 GFAA CC(C)(C(=O)NC[C@H]1[C@H]2CN(C3CCCCC3)C[C@]23CC[C@H]1O3)N1CCCC1 1857739347 ORXLQGRAYCHQHM-DZCCDHAISA-N 389.584 2.789 0 50 GFAA CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)N1CCC(c2ccn[nH]2)CC1 125070568 PQFPODRHMQMUSD-GOSISDBHSA-N 390.434 2.849 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)cc1Cl)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 249515215 IWVVWAVDNJYPHA-OJPGXSPBSA-N 381.803 2.749 0 50 GFAA O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCC[C@@H](c2ncc[nH]2)C1 263961624 XRFPLBGWAWMDOD-GFCCVEGCSA-N 387.383 2.723 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N3C[C@H]4COC[C@@H](C3)C(=O)N4C)cc2)c1 1704315245 YQHNUPWRDFQDAD-MSOLQXFVSA-N 380.444 2.717 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)c2n[nH]c3ccc(Br)cc23)CC1(F)F 1875266292 FGNCJQILRULFAU-VIFPVBQESA-N 388.168 2.507 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOCc3cc(C(F)(F)F)ccc32)CC1 1875382441 BECJKQJYAJMFKF-UHFFFAOYSA-N 382.382 2.993 0 50 GFAA CC12COC(C(=O)Nc3ccc4c(c3)CC[C@H]4NC(=O)C34CC(C)(CO3)C4)(C1)C2 1875392674 NLEMOWXUJRTVCO-SQTDQOLMSA-N 396.487 2.867 0 50 GFAA CCn1cc(S(=O)(=O)NC(=O)[C@@H](c2cccs2)C2CCCCC2)nn1 1875393437 FGALMJFEQJPLBY-OAHLLOKOSA-N 382.511 2.529 0 50 GFAA CCc1c(C(=O)N[C@H]2CCc3nc(C)[nH]c3C2)cnn1-c1ccc(OC)cc1 2325781339 GZVYGRZTNWFFNX-AWEZNQCLSA-N 379.464 2.762 0 50 GFAA NC[C@H](CC(=O)N[C@H]1CCCc2n[nH]cc21)c1ccc(Br)s1 2325808294 MXNOCUQDRIIIBR-ONGXEEELSA-N 383.315 2.860 0 50 GFAA Cc1ncn(CCNC(=O)c2cc3cc(Br)cnc3n2C)c1C 2325810593 SYRULZXSVTUHJZ-UHFFFAOYSA-N 376.258 2.579 0 50 GFAA Cc1ccc2c(c1)[C@@H](NC(=O)[C@@H]1CO[C@H](CNC(=O)c3cc(C)on3)C1)CCC2 2332237752 KHDUGDCATULXRU-LNLFQRSKSA-N 397.475 2.620 0 50 GFAA NC(=O)CN(CCc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1161860 SRJOKWGXVACBIE-UHFFFAOYSA-N 387.288 2.712 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1cccc(OC)c1 2827647 QGSSYNWKXIHVLH-QGZVFWFLSA-N 390.461 2.535 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cnccn3)CC2)cc1OCC(F)F 171322940 WROCZHPTMZEAPU-UHFFFAOYSA-N 377.395 2.783 0 50 GFAA CCN(CC)Cc1cc(CN2CCN(C(C)C)[C@@H](CCO)C2)ccc1OC 105901232 HQKLKTLCLDBSDK-NRFANRHFSA-N 377.573 2.814 0 50 GFAA c1ccc(N2CCN(Cc3nnc4sc(-c5cccnc5)nn34)CC2)cc1 65362328 VUOUNYVMJRPTJX-UHFFFAOYSA-N 377.477 2.570 0 50 GFAA Cc1ccc2[nH]c(C(=O)N3CCC[C@H](Cn4cc(C(=O)O)nn4)C3)c(C)c2c1 67673144 DBDFHEFLMGVWNT-AWEZNQCLSA-N 381.436 2.627 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3cc(OCC(=O)O)ccc32)cc(Cl)c1O 65422847 YIWCKBMGQSKOAM-LBPRGKRZSA-N 377.780 2.992 0 50 GFAA COC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@@H](C)C2)sc2c1CC[C@@H](C)C2 229996244 RRHGPTPKUSBNTC-AGIUHOORSA-N 380.510 2.707 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(F)cc1F)[C@H]1SCCc2ccccc21 121426821 OHPUYYWJUPUTPA-INIZCTEOSA-N 383.441 2.941 0 50 GFAA CN1CC2(CCN(Cc3ccc(OCCCn4ccnc4)cc3)CC2)OC1=O 216236039 IEKAAQGBLSGJDE-UHFFFAOYSA-N 384.480 2.769 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 363728014 VUWHIYCXTFKJLI-XIGKFDRGSA-N 395.503 2.815 0 50 GFAA O=C(NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)[C@H]1CCCc2cccnc21 375865689 CIJFMLQMEOJOMF-INIZCTEOSA-N 386.883 2.904 0 50 GFAA CN1C(=O)CCc2cc(C(=O)NC3CCN(Cc4ccccc4)CC3)ccc21 121924323 LCSALKQSQANONN-UHFFFAOYSA-N 377.488 2.990 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3CC[C@](O)(c4ccccc4)C3)c2n1 426511720 QLQYXSPXJNZVDP-GOSISDBHSA-N 390.365 2.790 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccc(-c4cccc(CO)c4)cc3)CC2)CN1 426549201 SEWKPKDJKFXDPE-UHFFFAOYSA-N 378.472 2.978 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)s1 95375261 DTAXTHZESJQUCQ-AWEZNQCLSA-N 384.509 2.704 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CCN3CCC(C)CC3)[nH]c2C1 95518516 YHRUICXZKSKQQD-MRXNPFEDSA-N 382.508 2.762 0 50 GFAA CN1C(=O)C[C@H](C(=O)O)C12CCN(Cc1ccccc1OC1CCCC1)CC2 95387250 MQLXLFNMUMJNNW-GOSISDBHSA-N 386.492 2.906 0 50 GFAA O=C(C1CCC1)N1CCc2[nH]cnc2C12CCN(Cc1cccc(O)c1)CC2 91820357 VMKOIKMJFFFXKK-UHFFFAOYSA-N 380.492 2.791 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cccc(N3CCOCC3)c2)C[C@H]1c1ccc(F)cc1 91725493 YYMDILBNLFZWGG-LEWJYISDSA-N 384.451 2.963 0 50 GFAA CN(Cc1ncc[nH]1)C(=O)[C@@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 91619899 KYEDYBRNNICIME-CQSZACIVSA-N 394.397 2.826 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(c2nc(C)cc(C)n2)CC3)cn1 95374136 DEECTAWTJSQFGL-UHFFFAOYSA-N 380.496 2.601 0 50 GFAA O=C(Nc1ccc(-c2ccn[nH]2)cc1)[C@H]1CCCN(C(=O)Cc2ccncc2)C1 95509278 YSJOFDTUOUFKIE-SFHVURJKSA-N 389.459 2.892 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)[C@H](C)n2cnc3ccccc32)CC1 95528444 HAYILCRECTXXBN-INIZCTEOSA-N 381.480 2.846 0 50 GFAA C[C@@H](C(=O)O)N1CC2(CCC1=O)CCN(Cc1ccnc3ccccc13)CC2 91651310 BOOIXWOYVNNODS-INIZCTEOSA-N 381.476 2.913 0 50 GFAA COc1cccc(N2CCN(CC3=Cc4cccc(OC)c4OC3)CC2=O)c1 670448423 JQHGYCVLAOIOPQ-UHFFFAOYSA-N 380.444 2.828 0 50 GFAA Cc1ccc(F)c2[nH]c(C(=O)Nc3cccc([C@@]4(C)NC(=O)NC4=O)c3)cc12 1441371475 NLXSFVWGDYEQIS-HXUWFJFHSA-N 380.379 2.922 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)NCCNC(=O)c1ccccc1Cl 952969138 BJVBBULSPFKSBU-IBGZPJMESA-N 385.895 2.633 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1 269195848 PTINJAPPWQFZOV-KRWDZBQOSA-N 387.457 2.516 0 50 GFAA O=C(CN1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21)Nc1ccc(Br)cn1 274715136 AWPZCEMQTYBTFZ-DRZSPHRISA-N 382.258 2.500 0 50 GFAA COC(=O)C[C@H](NC(=O)C(=O)Nc1nc(C(C)(C)C)cs1)c1ccccc1 170609833 OYXUGRNCJAAPJB-ZDUSSCGKSA-N 389.477 2.800 0 50 GFAA COc1cccc2c1OC[C@H](NC(=O)NCCOc1ccc(F)c(F)c1)C2 170622277 RQGOZTFXXAKRHS-CYBMUJFWSA-N 378.375 2.655 0 50 GFAA NC(=O)c1cccc2c1CCCN2C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 170996960 PEQNQMRPIILCHK-KRWDZBQOSA-N 391.471 2.617 0 50 GFAA Cc1ccc([C@H](O)CNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1 193239216 FWSWFHICCBXGMA-ZTLYHTANSA-N 384.520 2.867 0 50 GFAA Fc1cnc(NC[C@H]2CCCN(CCc3ccccc3)C2)nc1N1CCOCC1 1529089627 QTOWPZKXZGMAEU-LJQANCHMSA-N 399.514 2.819 0 50 GFAA CCc1ocnc1C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704358385 JPWKZTBHKLCDEV-UHFFFAOYSA-N 386.448 2.958 0 50 GFAA O=C(C1CCN(C2CCN(Cc3nc4ccccc4[nH]3)CC2)CC1)N1CCCC1 11663584 CBUNFRNDCVMHKX-UHFFFAOYSA-N 395.551 2.862 0 50 GFAA CN(C[C@@H]1COc2ccccc2O1)C(=O)c1cn(CCCc2ccccc2)nn1 11720020 JAHIQHOUAXOSLK-GOSISDBHSA-N 392.459 2.823 0 50 GFAA CCN(CC)C(=O)C1CCN(C(=O)[C@@H]2CC(Cc3ccc(F)cc3)=NO2)CC1 11975772 YUQQAEYGXJTPTJ-IBGZPJMESA-N 389.471 2.620 0 50 GFAA COc1cc(CNCC2(O)CCCCC2)ccc1OC[C@@H](O)CN(C)C(C)C 12298330 LTNUXFRRSQHSBJ-IBGZPJMESA-N 394.556 2.560 0 50 GFAA CN1CCC[C@@H](CN(CCc2ccccc2)C(=O)CCN2CCCCC2=O)C1 12712123 PLPOWXNAEVLUCY-OAQYLSRUSA-N 385.552 2.802 0 50 GFAA CC[C@@H]1NC(=O)[C@@H]2C[C@H](NCc3sc4ccccc4c3Cl)CN2C1=O 14749406 SCBHAPBJMMIZEW-DRZSPHRISA-N 377.897 2.522 0 50 GFAA COc1ccc(C(=O)NCc2nnc(SCC(C)C)n2C)c(OC)c1OC 15006020 XDAZNMXLGXXQCN-UHFFFAOYSA-N 394.497 2.519 0 50 GFAA Cc1ccc(SCCNC(=O)c2ccccc2N(C)S(C)(=O)=O)cc1 16310985 CTOWTARRSPFWKS-UHFFFAOYSA-N 378.519 2.913 0 50 GFAA C[C@H](NC(=O)C1(N(C)Cc2ccccc2)Cc2ccccc2C1)c1ncn[nH]1 19836669 IHPPBXRJYCGURC-INIZCTEOSA-N 375.476 2.652 0 50 GFAA O=C(NCCc1ccccc1)c1cc2n(n1)C[C@H](c1ccc3c(c1)OCO3)OC2 169759883 SUEWVHLSDSJKSY-OAQYLSRUSA-N 391.427 2.856 0 50 GFAA O=C1C[C@H]2[C@H](CCN2Cc2cc(Cl)ccc2Cl)N1CCN1CCOCC1 1857688519 NSENWZNOMPHEKV-ROUUACIJSA-N 398.334 2.501 0 50 GFAA CN(C)C(=O)C[C@H]1CN2C[C@H](n3ccnc3-c3ccccc3Cl)C[C@H]2CO1 1857720499 WXJFWOWKQNJFFO-PMPSAXMXSA-N 388.899 2.696 0 50 GFAA Cc1ccc2nc(C)c(C)c(C(=O)N3CCC4(CC3)CNC(=O)CCO4)c2c1 1857733232 AMTUUNPOIRPKJU-UHFFFAOYSA-N 381.476 2.671 0 50 GFAA O=C(C[C@H]1COc2ccccc2O1)N1C[C@@H]2Oc3c(F)ccc(F)c3O[C@@H]2C1 333607384 RIWIRFSEPMRRHL-MZPVMMEZSA-N 389.354 2.546 0 50 GFAA Cc1nc(CC(=O)N2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)cs1 132223319 CESUOKZDRFYNIY-HNNXBMFYSA-N 383.395 2.713 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 247969855 SDIPHIPJJZEBEU-HKUYNNGSSA-N 380.492 2.635 0 50 GFAA N[C@H]1CC[C@@H](C(=O)Nc2cc3c(cc2NC(=O)c2cccs2)OCCO3)C1 262610148 ARPLZXSENRSXJO-NEPJUHHUSA-N 387.461 2.838 0 50 GFAA O=C(CS(=O)(=O)C1CC1)Nc1ccc2nc(Cc3ccc(F)cc3)[nH]c2c1 864096427 FNUDAPVMTAKDKN-UHFFFAOYSA-N 387.436 2.809 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2nn(C)c3c2C[C@H](C)O[C@@H]3C)CC1 1875301796 VKRJKRHGZUTCFR-LSDHHAIUSA-N 398.507 2.850 0 50 GFAA C[C@@H](NC(=O)Cn1c(Cc2ccc(F)cc2)noc1=O)c1ccc(F)cc1F 1875317763 CXMABYIFBIEHSK-LLVKDONJSA-N 391.349 2.722 0 50 GFAA C[C@]12CN(C(=O)c3cc(-c4cccs4)on3)C[C@H]1CN(c1ncccn1)C2 1875315000 DOAMBFKKJLKFEP-ORAYPTAESA-N 381.461 2.792 0 50 GFAA Cc1ccc(C(=O)N[C@]23CCC[C@@H]2N(C(=O)[C@@H](C(C)C)N(C)C)CC3)s1 1775993393 ZUFWYMJLJXUDEF-QKLQHJQFSA-N 377.554 2.896 0 50 GFAA CC1(C)CN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)C[C@@H](C(=O)O)O1 1776562160 UBDQZBRQNGLTDZ-LBPRGKRZSA-N 385.342 2.819 0 50 GFAA Oc1nncc(N2CC[C@@H](NCc3ccc(Oc4cnccn4)cc3)C2)c1Cl 898364859 RAGOQJXPROIMOC-CQSZACIVSA-N 398.854 2.786 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N2CCc3ccccc3CC2)OCC(=O)N1C 2100482606 LOTZIUXZJXWBGO-YADHBBJMSA-N 378.472 2.521 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCCCc3nc4ccccc4[nH]3)cn12 2100483370 OSPKJOLVOFDSDW-IBGZPJMESA-N 392.463 2.658 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CCN[C@@H](Cc4ccc(F)cc4)C3)cc2)n1C 2325774009 RCKUCGCVRMNODS-FQEVSTJZSA-N 393.466 2.586 0 50 GFAA Cc1ccc([C@@H](C)C(=O)N2CCC3(CCN(C(=O)Cc4cncn4C)CC3)C2)o1 2325793737 GIKGYUSKVZFNIZ-QGZVFWFLSA-N 398.507 2.509 0 50 GFAA CO[C@@H]1COCC[C@H]1Cn1nnnc1N1CCC[C@@H](CCCc2ccccc2)C1 2325842336 VDJMIJUIBMMUDF-QHAWAJNXSA-N 399.539 2.964 0 50 GFAA O=C(NCCOc1ccccc1)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356139177 DJFVGPRRMFHFQT-HFXUHXBXSA-N 391.471 2.514 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@]12CCCN2Cc1ccc2c(c1)OCO2 2356142002 ZLGJYLUCHLDKJG-JBYIUTFZSA-N 386.492 2.676 0 50 GFAA CCCN=c1ncc(CN2CCC[C@]23CCCN(Cc2ccccc2)C3=O)c[nH]1 2356166923 OYXCYNABBXRDEO-QHCPKHFHSA-N 393.535 2.878 0 50 GFAA CCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCSC)cc1OC 4536232 AFJGIJMFROEVOD-MRXNPFEDSA-N 380.466 2.628 0 50 GFAA COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC[C@@H]2CCCO2)cc1Cl 4986965 GRYJWVHRWRGSAA-LRDDRELGSA-N 380.828 2.699 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 6702870 XCBPTCWWAOZUEF-FQEVSTJZSA-N 395.484 2.704 0 50 GFAA COc1ccc(CCNC(=O)CCC(=O)N2CCOc3ccccc32)cc1OC 6798408 WPVNLDPAMGCUQN-UHFFFAOYSA-N 398.459 2.568 0 50 GFAA biogenic O=C(Nc1ccc(S(=O)(=O)NCc2ccccn2)cc1F)c1ccccc1 7499818 SMTAKUFLZHQBOS-UHFFFAOYSA-N 385.420 2.952 0 50 GFAA CCOC(=O)CCCCC(=O)c1[nH]c(O)nc1CSc1nc(C)cc(O)n1 8584552 VYXKATGJKODPQR-UHFFFAOYSA-N 394.453 2.518 0 50 GFAA O=C1CCCN1C1CCN(Cc2nc3ccccn3c2Br)CC1 225420927 FJXYNBOZKWFHFH-UHFFFAOYSA-N 377.286 2.684 0 50 GFAA O=C1C[C@@H](c2ccccc2)N(C(=O)CCCc2ccc3c(c2)CC(=O)N3)CCN1 225547883 MLIWDBVDYZSHJG-FQEVSTJZSA-N 391.471 2.594 0 50 GFAA O=C(COc1ccc(N2CCCC2=O)cc1)OCCCO[C@@H]1CCCCO1 225842829 IGNVAVFKROYUQW-HXUWFJFHSA-N 377.437 2.669 0 50 GFAA c1cncc(CN2CCC[C@@H](n3cc(-c4ccc5c(c4)OCCO5)nn3)C2)c1 67771026 HWIFIAIFGVTCBR-GOSISDBHSA-N 377.448 2.948 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)CC1 67602043 QQYZWNOAGJFLCR-QGZVFWFLSA-N 394.537 2.775 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)[C@H](c3cccnc3)N3CCOCC3)cc2c1C 67872421 PDDVLMBOTXDUBH-NRFANRHFSA-N 378.476 2.869 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCO2)c1)[C@H]1CCCN1c1ncnc2ccccc12 229971083 SWPIWCWFTSRGNS-VQIMIIECSA-N 392.463 2.613 0 50 GFAA CCOc1ccc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)cc1CO 39445435 PXNBNBWUKVPWIR-HSZRJFAPSA-N 398.547 2.689 0 50 GFAA COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2c(C)nn(C(F)F)c2C)c1 2804165 VLPAXMVTXDCZOL-SECBINFHSA-N 389.424 2.952 0 50 GFAA CCOC(=O)C(=CNc1cn(C)c(C)c1C(=O)c1ccccc1)C(=O)OCC 3469656 VAEAFQHAHZMQMG-UHFFFAOYSA-N 384.432 2.987 0 50 GFAA O=C([C@@H]1C[C@@H]1c1cccnc1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328636890 VSYZIVSKNKNLMW-IPMKNSEASA-N 378.476 2.860 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2)C1 328623608 BYQKKAFWPWVZJU-AWEZNQCLSA-N 380.279 2.712 0 50 GFAA O=C(c1c[nH]c(=O)[nH]1)N1CCc2onc(-c3ccc(C(F)(F)F)cc3)c2C1 71422231 LWFXHLNSSJFNDL-UHFFFAOYSA-N 378.310 2.575 0 50 GFAA CCOC(=O)[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc3c(c2)OCCO3)C1 12713992 LVAHDOZFNVPGEY-MRXNPFEDSA-N 385.464 2.633 0 50 GFAA CC(C)N1C[C@]2(CCCN(CC(=O)NCc3ccccc3F)C2)CCC1=O 77380300 NRVTWLCXQNCECD-OAQYLSRUSA-N 375.488 2.555 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CCCNC1)c1ccccc1 238140060 IGCFUOWWCOPLJM-PZJWPPBQSA-N 379.504 2.534 0 50 GFAA CC(C)N(C)c1ccc(NC(=O)N2CCN(C[C@@H]3CCOC3)CC2)cc1F 176880385 NEELRQJIFWHRFX-INIZCTEOSA-N 378.492 2.856 0 50 GFAA CC(C)c1nc(-c2ccc(C(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)cc2)no1 426428465 YXNAEKOUJWLBSR-CQSZACIVSA-N 391.493 2.757 0 50 GFAA Cc1cccc2cc(CN(CCN(C)C)C(=O)[C@@H]3CCCO3)c(N(C)C)nc12 20451957 JMAPGCRITNQSNO-IBGZPJMESA-N 384.524 2.678 0 50 GFAA Cn1cc(-c2nn(CC(=O)Nc3ccccc3)c(-c3cnn(C)c3)c2Cl)cn1 20617873 YJWGRKLNXICGNZ-UHFFFAOYSA-N 395.854 2.976 0 50 GFAA CC(C)C[C@@H](O)C(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91625782 IRBKFVHFDIPDTD-HXUWFJFHSA-N 386.536 2.867 0 50 GFAA CCN(C(=O)c1ccc(NC(=O)N2CCOC[C@@H]2CO)cc1)c1ccccc1 95527390 SOMUJLYWZCHUKW-IBGZPJMESA-N 383.448 2.578 0 50 GFAA CN(C)CCN(C[C@@H]1CCCN(Cc2ccccc2F)C1)C(=O)c1ccnnc1 95526482 YTSYTOOZNFDFIZ-GOSISDBHSA-N 399.514 2.532 0 50 GFAA CN(Cc1n[nH]c(C(C)(C)C)n1)[C@@H](C(N)=O)c1cccc(Br)c1 292959669 PBTSCMYOECYMDA-CYBMUJFWSA-N 380.290 2.523 0 50 GFAA Cc1nonc1OCCNC(=O)C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2 95525067 WUDLLPAOJUNYQH-KRWDZBQOSA-N 395.415 2.824 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1 97743605 VWQYNWKGMWTFAT-HXUWFJFHSA-N 380.492 2.761 0 50 GFAA O=C(CCC1CCN(Cc2ncccn2)CC1)Nc1ccc2c(c1)OCCO2 95501469 LFBJTXSCQMEZHO-UHFFFAOYSA-N 382.464 2.879 0 50 GFAA CCN(CC)CCNC[C@H](O)CN1CCn2c3c(c4cc(C)ccc42)CCC[C@H]31 252633966 WIWRJIZZYKIADD-WMZHIEFXSA-N 398.595 2.935 0 50 GFAA CO[C@@H]1[C@H](Sc2ccccc2)OC[C@@H](OC)[C@H]1O[C@H]1OCCC[C@H]1OC 257357706 PMVNXXXRJLDLRS-KSCVBYKOSA-N 384.494 2.702 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3nc4c(s3)CCCC4)cn12 1940195379 POGFYNKIJKFPGT-QGZVFWFLSA-N 385.493 2.684 0 50 GFAA O=C1C[C@@H](C(=O)NCC2(c3cccc(F)c3)CCOCC2)C2(CCCC2)O1 299759154 ABSIRKLBHIWTJA-KRWDZBQOSA-N 375.440 2.866 0 50 GFAA COc1ccccc1-c1cc(CNC(=O)N(C)Cc2nncn2C(C)C)on1 584885192 REOAAKGGGRPZHL-UHFFFAOYSA-N 384.440 2.864 0 50 GFAA O=C(Nc1ccccn1)c1ccc(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)cc1 584904496 YKGYWCBMHTVTLT-LBTBCDHLSA-N 377.400 2.795 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12 952868548 ACSWNGQNIHXBFH-OAQYLSRUSA-N 389.499 2.946 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)N2CCc3ccnc(O)c3C2)n(-c2ccccc2)n1 277160675 XKTHXDPAONBYDE-HNNXBMFYSA-N 391.475 2.980 0 50 GFAA Cc1c([C@H]2OCC[C@@H]2C(=O)NCCc2cn(C)c3cc(F)ccc23)cnn1C 275303126 BAALAPXYGVIJDG-PXNSSMCTSA-N 384.455 2.796 0 50 GFAA O=C1NCCN(C(=O)c2coc(C3CCOCC3)n2)[C@@H]1c1ccccc1Cl 170600425 AGFJUIDYNHNAGA-MRXNPFEDSA-N 389.839 2.535 0 50 GFAA O=C(Nc1nc(-c2cccnc2)cs1)C(=O)N[C@@H]1CCOc2ccccc21 170609831 RGCCBDKJAZOVAN-CQSZACIVSA-N 380.429 2.784 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCCN(Cc3cscn3)CC2)[nH]n1 171020944 KFGDADLVUKSWOK-UHFFFAOYSA-N 397.504 2.890 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)ccc1F 729421037 ILLHTYXQKMHIDJ-MRXNPFEDSA-N 394.443 2.850 0 50 GFAA Cc1cccn2cc(C(=O)N3C[C@H](Cc4ccc5ccccc5n4)[C@@H](O)C3)nc12 1616084484 YEIWOZPVIQNVME-UWJYYQICSA-N 386.455 2.867 0 50 GFAA OC1(c2cccnc2)CCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 1506406720 OBHZLCRZPAHCFH-JOCHJYFZSA-N 381.520 2.656 0 50 GFAA COc1ccccc1[C@H]1CN(C(=O)Cc2ccc(F)cc2F)C[C@@H]1C(=O)O 216419404 JSWPHCUULDXWOC-CVEARBPZSA-N 375.371 2.843 0 50 GFAA CNC(=O)c1ccc(CN2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)cc1 1704312338 IXTIYPDCZJMZHA-DENIHFKCSA-N 375.472 2.630 0 50 GFAA COCCCNS(=O)(=O)c1cc(Br)cc(C(F)(F)F)c1 16159714 CYVCCTWSYFXOMU-UHFFFAOYSA-N 376.194 2.783 0 50 GFAA in-vitro COc1ccccc1-c1ccc(C(=O)N2C[C@@H]3COCC[C@]3(C(=O)O)C2)cc1 1772706330 NMRRSGYGRILBSV-VGSWGCGISA-N 381.428 2.926 0 50 GFAA COCCc1nc2ccc(C(=O)N3CCN(c4ccccc4OC)CC3)cc2o1 11664940 CDFCIVTWEIDNTH-UHFFFAOYSA-N 395.459 2.988 0 50 GFAA COC(=O)[C@@H](CCSC)NC(=O)c1cc(COc2ccc(C)c(C)c2)on1 12058043 CXSMZDDYVYRPRL-MRXNPFEDSA-N 392.477 2.895 0 50 GFAA O=C(CN1CCCCC1=O)N[C@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1 12581280 WZHYDEYPAQDOKO-KRWDZBQOSA-N 388.418 2.657 0 50 GFAA COc1ccc([C@H]2Cn3nnc(-c4noc(-c5ccccn5)n4)c3CO2)cc1 169769091 AAMDDGFWWCWRDE-MRXNPFEDSA-N 376.376 2.670 0 50 GFAA COc1ccccc1CCC(=O)N1CCC2(CC1)NC(=O)N(c1ccccc1)N2 169779835 UNWODCJAKKPQNC-UHFFFAOYSA-N 394.475 2.681 0 50 GFAA O=C1CCCCN1CCCC(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857676649 WCZMFEFFHXCZHC-UHFFFAOYSA-N 380.492 2.797 0 50 GFAA COc1c(C)cnc(CNC(=O)[C@]2(Cc3cscn3)C[C@@H]3CC[C@H]2N3)c1C 1857678219 IVYDOSNZDLDDCE-NQYLQCIDSA-N 386.521 2.533 0 50 GFAA CCCCc1nc(C)cc(=NCCn2ccnc2-c2cnn3cccnc23)[nH]1 1857693395 VKNQIWKYDTZZJQ-UHFFFAOYSA-N 376.468 2.568 0 50 GFAA O=C(c1cc[nH]n1)N1CCCOc2cccc(c2)CC[C@@H]2CCCCN2C(=O)C1 1857707230 JKIYARGAJZZYPT-SFHVURJKSA-N 396.491 2.648 0 50 GFAA O=C(Cc1cc(F)cc(Cl)c1)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857716304 GJVPYFBSHQDFPD-KOUHRCEDSA-N 389.854 2.617 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1857716458 NCJGYDRLFAVKPN-WIYYLYMNSA-N 390.487 2.780 0 50 GFAA CCC(CC)C(=O)NC[C@H]1[C@H]2CN(Cc3c(C)nn(C)c3C)C[C@]23CC[C@H]1O3 1857732999 QDBUNUBKLLSDHV-RJJVWVDVSA-N 388.556 2.569 0 50 GFAA C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccnc(N3CCCCC3)c2)C1=O 126754781 FXNZUXFXBQNVFD-MRXNPFEDSA-N 394.475 2.502 0 50 GFAA O=C(CN1CCCCC1)NC[C@H]1Cc2cc(-c3cncnc3)cc(Cl)c2O1 12167707 BJXPWMMKVFAGNT-QGZVFWFLSA-N 386.883 2.703 0 50 GFAA O=C(OCc1cc(Br)c2c(c1)OCO2)c1cccc2nn[nH]c12 800206683 GZHFHKLGBFXEEU-UHFFFAOYSA-N 376.166 2.806 0 50 GFAA CC1(C)[C@H](c2ccc(F)c(F)c2)CCN1C(=O)c1cn([C@@H]2CC[C@H]2O)nn1 916014785 HYWWXURKTDHSOG-JCURWCKSSA-N 376.407 2.660 0 50 GFAA CCc1nc(CN2CC[C@@](c3nc(-c4cccnc4)no3)(C(F)(F)F)C2)n[nH]1 952894215 XMYBWLBGVDMECK-MRXNPFEDSA-N 393.373 2.518 0 50 GFAA O=C(N[C@H]1CCc2c[nH]nc2C1)N1CC[C@](O)(c2cccc(C(F)(F)F)c2)C1 1875288813 FEEUPQAIISAMFR-MAUKXSAKSA-N 394.397 2.589 0 50 GFAA CCn1nc2c(c1C(=O)NCc1cnc(OC)c(Cl)c1)C[C@H](C)O[C@@H]2C 1875314160 KGUZALWAFMZZHJ-WDEREUQCSA-N 378.860 2.912 0 50 GFAA C[C@@H]1CCNC(=O)[C@@H]1CNC(=O)NCc1c(F)cc(C(F)(F)F)cc1F 1875313131 HVHWPRGPZGKTOK-PSASIEDQSA-N 379.329 2.555 0 50 GFAA COCC[C@H]1CNCCN1C(=O)c1cc(-c2ccccc2C(F)(F)F)no1 1875315588 AHCMEMBMUYZENX-LBPRGKRZSA-N 383.370 2.811 0 50 GFAA CN(C[C@@H](O)COCc1ccc2c(c1)OCO2)C(=O)Nc1cc(F)cc(F)c1 888093365 YDLWSZGUXUIKTJ-MRXNPFEDSA-N 394.374 2.735 0 50 GFAA C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1cnc(C2CC2)s1 888101356 LLELYYZMYPESGT-MFKMUULPSA-N 377.491 2.577 0 50 GFAA N[C@H]1CC2(CCN(C(=O)c3ccc4nc(Cl)nn4c3)CC2)Oc2ccccc21 2325795073 BEVZLPQNPHIJBN-HNNXBMFYSA-N 397.866 2.840 0 50 GFAA OCC1(CO)CCC(NCc2cc(Cl)ccc2OC[C@@H]2CCCO2)CC1 2325805893 BSKUXPOUXZXHJP-SFHVURJKSA-N 383.916 2.901 0 50 GFAA C[C@H]1CN(c2cccc3cnccc23)CCN1C(=O)c1ccc(CN(C)C)[nH]1 2325816596 GHDQQTLZAMVLTR-INIZCTEOSA-N 377.492 2.975 0 50 GFAA COc1cc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc(OC)c1OC 626946 RXCPZVOWGQUCLV-UHFFFAOYSA-N 397.431 2.763 0 50 GFAA CCOC(=O)C1=C(c2ccccc2)NC(=S)N[C@@H]1c1ccc2c(c1)OCO2 1111798 RYCRCHGBIHEQSL-GOSISDBHSA-N 382.441 2.909 0 50 GFAA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc(Br)cc(OC)c1OC 1136718 BZGFFOHPYLPPOL-ZDUSSCGKSA-N 399.241 2.609 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)N[C@@H](C)c2ccccc2)cc1 1142070 IOPVVMWPTRIOSQ-HNNXBMFYSA-N 376.478 2.630 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2ccc(OC)c(C)c2OC)C1=O 2356138313 LTLHUWWUGRUDJG-OAQYLSRUSA-N 376.497 2.616 0 50 GFAA CCOCCn1nc(CC(C)C)nc1-c1ccc2nnc([C@H](O)C(C)C)n2c1 2356145153 DGLJSZDXNRPDCF-GOSISDBHSA-N 386.500 2.912 0 50 GFAA CC(C)(C)C1=CCN(CCNC(=O)COc2ccc3ccc(=O)oc3c2)CC1 225401997 HVMBVPORLHUPHS-UHFFFAOYSA-N 384.476 2.966 0 50 GFAA COC[C@H](NC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CCCO1 469090471 QOOUXLNHRVRJFC-HOTGVXAUSA-N 394.269 2.763 0 50 GFAA O=C1C[C@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c1ccccc1 22780748 SIRNIAHSLIDDIC-CLNPQZTCSA-N 375.472 2.650 0 50 GFAA O=C(Cc1cn2ccsc2n1)N1CCc2[nH]nc(Cc3ccccc3)c2C1 23429672 ORLPEMNSYATFDR-UHFFFAOYSA-N 377.473 2.837 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnn(CC)c2C)C[C@@H]1CCO 23373652 ITLMIEHTMDEJOW-NRFANRHFSA-N 386.540 2.679 0 50 GFAA Cc1ccc2c(C(=O)N[C@H](C)Cn3cncn3)cc(-c3cncnc3)nc2c1C 63846773 FYICTUGDIVYNIO-CQSZACIVSA-N 387.447 2.719 0 50 GFAA Cc1ccc(C(=O)N2C[C@H]3[C@@H](C2)OC(=O)N3CCc2cccc(Cl)c2)cn1 67655103 IRWRWZVHTPMENU-ZWKOTPCHSA-N 385.851 2.931 0 50 GFAA Cn1ccnc1[C@H](O)C1CCN(Cc2ccn(-c3ccc(F)cc3F)n2)CC1 252499165 RWJQQKXSJPGMFV-LJQANCHMSA-N 387.434 2.830 0 50 GFAA O=C(CN1CCc2c([nH]c3ccccc23)C1)Nc1nnc([C@H]2CCCO2)s1 67895690 FWFSQSSEEADTLQ-MRXNPFEDSA-N 383.477 2.868 0 50 GFAA Cc1cc(CN2C(=O)[C@H](Cc3cn(C(C)C)nn3)N=C2O)c2ccccc2n1 328612466 OSFBLQQQIWLFMG-SFHVURJKSA-N 378.436 2.583 0 50 GFAA COc1ccc(NC(=O)c2nn(-c3ccc(F)cc3)c(OC)cc2=O)cc1F 253405824 RCBMWWFIJLYVIR-UHFFFAOYSA-N 387.342 2.780 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(Cc1cc(F)ccc1-n1cccn1)C2 72422804 XSLWBCZWHGDKNV-UHFFFAOYSA-N 383.427 2.631 0 50 GFAA Cc1nc(-c2cccc(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)c2)no1 130003576 JEZIHPMUGDBUKN-IBGZPJMESA-N 390.443 2.966 0 50 GFAA Cc1noc([C@H]2CN(C(=O)Nc3cccnc3-c3ccccc3)CCN2C)n1 286128774 WZHPMKTUELVCTE-QGZVFWFLSA-N 378.436 2.961 0 50 GFAA C[C@@H](C(=O)N(C)CC(=O)Nc1cccc(Oc2ccccn2)c1)n1cccn1 225426203 BVAJCIJVTBEHEL-HNNXBMFYSA-N 379.420 2.729 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCCN(C(=O)c3ccoc3)CC2)cs1 426534446 LKBJVRAKBDTVFC-UHFFFAOYSA-N 376.482 2.917 0 50 GFAA Cc1cc(-c2ccc(C(=O)NCCCOC3CCN(C)CC3)cc2)cnc1N 426544649 DXCXGTLNTOXVPA-UHFFFAOYSA-N 382.508 2.870 0 50 GFAA COc1cc(CN(C)CC(C)C)ccc1OC[C@H](O)CN1CCSCC1 95529583 TVXLLPZKSCWDAK-GOSISDBHSA-N 382.570 2.572 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cnc(-c3ccncc3)nc2)CC1 97772701 XCZXMYJEYJPODU-UHFFFAOYSA-N 375.432 2.510 0 50 GFAA CCN(CC)S(=O)(=O)N[C@@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1 91620517 CMICLMFXZFMOQS-MRXNPFEDSA-N 384.452 2.704 0 50 GFAA CCOC(=O)[C@@H](C)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95503128 UIJBSUXGEAPMSV-CQSZACIVSA-N 380.435 2.731 0 50 GFAA O=C(Nc1sc2c(c1C(=O)N1CC[C@@H](CO)C1)CCCC2)c1cccnc1 179678824 PZXYXEIZRAWOMB-CYBMUJFWSA-N 385.489 2.729 0 50 GFAA Cc1[nH]c2c(F)cccc2c1CC(=O)N1CCNC(=O)[C@@H]1Cc1ccccc1 91619914 UAVUDJWUDARZGY-IBGZPJMESA-N 379.435 2.728 0 50 GFAA O=C(NC[C@H](c1ccc(F)cc1)N1CCCC1)c1ccccc1-c1nnn[nH]1 97179409 NPEAIOKVEZCQCH-GOSISDBHSA-N 380.427 2.573 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC[C@H](c3ccc(C(=O)O)cc3)C2)cn1 95380551 SSAJFCZOZZIDTO-INIZCTEOSA-N 377.466 2.560 0 50 GFAA CSCCc1nc(-c2ccnc(-n3cnnc3)c2)n(Cc2ccccc2)n1 96180209 KDPOANBVEZKEAO-UHFFFAOYSA-N 377.477 2.875 0 50 GFAA CCn1c(CCNC(=O)[C@H]2COc3c(cccc3OC)C2)nc2ccccc21 95388561 FPOCHKGQTJJMER-MRXNPFEDSA-N 379.460 2.975 0 50 GFAA NC(=O)c1cccnc1N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95522305 ALUJDIMICXVXCK-UHFFFAOYSA-N 398.894 2.853 0 50 GFAA Cc1cccc(Cl)c1OCCNC(=O)c1coc(CN2CCOCC2)c1 97698962 GZCXLNYWOORIEW-UHFFFAOYSA-N 378.856 2.882 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@@H]4CC[C@@H]3[C@H]42)[C@@H]2CC[C@@H]3CC[C@H]1[C@@H]32 248042635 OQPJCJPJPNWQBN-UQNJAGADSA-N 379.504 2.873 0 50 GFAA COc1cc(-c2ccccc2)ccc1CN[C@H]1CCN(c2cnn(C)c2)C1=O 183060805 CCRFIUNIDRNWGG-FQEVSTJZSA-N 376.460 2.991 0 50 GFAA C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)c1 299422257 USNWMHLMDRXRED-UIAACRFSSA-N 391.471 2.812 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NCC1(c2cccc(F)c2)CCOCC1 952973884 PBHKHIPSSVFQID-UHFFFAOYSA-N 398.478 2.885 0 50 GFAA Cc1noc(C)c1CN1CCOC2(CCN(Cc3nc(C)c(C)n3C)CC2)C1 952976360 RKDCHDLBGDUCDE-UHFFFAOYSA-N 387.528 2.509 0 50 GFAA Cc1cccc(Cl)c1C(=O)N1C[C@@H]2CN(CC3CCC3)C[C@]2(C(=O)O)C1 1565530555 YEWZAKDAMXIUEQ-YWZLYKJASA-N 376.884 2.907 0 50 GFAA CC(=O)[C@H]1CC(C(=O)NCc2ccc3c(c2)OCCCO3)=NN1c1ccccc1 170620604 OGIYGBNQHMNPMU-LJQANCHMSA-N 393.443 2.688 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2cc(F)ccc2C)cc1OC 1529187000 NTAZIWXBXMWSIB-WOJBJXKFSA-N 389.423 2.726 0 50 GFAA COCCC(=O)N1C[C@H]2CN(C(=O)c3cc[nH]c3)C[C@]2(CCc2ccccc2)C1 1772707090 YIXFYWRFUGWSSW-REWPJTCUSA-N 395.503 2.585 0 50 GFAA Cn1cccc1-c1cc(C(=O)N[C@@H]2CCCN(CCc3ccccc3)C2)[nH]n1 12445837 PFPWVCBYCUAACJ-GOSISDBHSA-N 377.492 2.852 0 50 GFAA COC(=O)c1c(NC(C)=O)c2cc(NCc3ccc(O)c(OC)c3)cnc2n1C 14539560 GTIBAKDTIADUON-UHFFFAOYSA-N 398.419 2.645 0 50 GFAA Cc1cc(CN2CC[C@@H](N3CCN(CCc4ccccc4)CC3)[C@H](O)C2)oc1C 19838155 TVJMHWOCIANSJP-DNQXCXABSA-N 397.563 2.692 0 50 GFAA Cc1nc(-c2cn([C@@H]3CCCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)no1 169777792 VLBMYVFUJNHIBQ-GFCCVEGCSA-N 390.806 2.906 0 50 GFAA O=C(Nc1nc(-c2cccnc2)cs1)[C@@H](Cc1ccccc1)n1cnnn1 206228892 ZWIAIBXVBAIGKB-MRXNPFEDSA-N 377.433 2.614 0 50 GFAA Cc1cccc(N2C[C@@H]3[C@H](CNC(=O)CSC(C)C)[C@H]4CC[C@]3(C2)O4)n1 1875250113 YPJLQYMCQWNPSP-TVKQPGBESA-N 375.538 2.632 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCC([C@@H]2CCN(CC(C)(C)C)C2)CC1 14948889 XAAPWOVWGWTHQK-QGZVFWFLSA-N 382.574 2.795 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H](C3=CC(=O)OC3)[C@H](O)C[C@@]12O 253530239 PVAMXWLZJKTXFW-YVRCYKNQSA-N 390.520 2.575 0 50 GFAA biogenic C[C@@H]1CN(c2ncc(Cn3cc(Br)cn3)s2)C[C@@]2(CCOC2)O1 366487942 DQUJSGKGFCEMDF-IAQYHMDHSA-N 399.314 2.535 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)NC2CCC(c3nc(C)no3)CC2)C12CCOCC2 369650213 VRXCWBYKMUUQRE-BHUNQDJPSA-N 392.500 2.678 0 50 GFAA CC(C)Oc1ncc(Cl)cc1NC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 263146325 OWHGIYOSDHUHOW-AWEZNQCLSA-N 398.891 2.925 0 50 GFAA CNC(=O)[C@@H](C)SCc1cc(OC)c(C(=O)OC)cc1Br 1875272324 IFLRFELQTVTACK-MRVPVSSYSA-N 376.272 2.612 0 50 GFAA Cn1cc(-c2cccc(C(=O)N3CC[C@H](C4CC4)[C@H]3c3nc(O)n[nH]3)c2)cn1 1875401097 FIOZORPRHMFFDT-SJORKVTESA-N 378.436 2.524 0 50 GFAA O=C(Nc1ccc2ncsc2c1)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@H]3C2)C1 888102289 PAFPWZRFHWKHRO-BMFZPTHFSA-N 399.520 2.646 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2C[C@@H]3[C@H](C2)CN(C)[C@H]3c2ccccc2)cc1 1775996522 AOGJJDLBSYGZPT-ZEYPLWLESA-N 392.503 2.818 0 50 GFAA O=C(Nc1nccc(-c2ccccn2)n1)c1cccc(NC(=O)[C@H]2CCCO2)c1 2100482836 CAZDAFUVJKIHCT-GOSISDBHSA-N 389.415 2.908 0 50 GFAA Nc1ncc(C(=O)N[C@H]2CCS(=O)(=O)c3ccc(Cl)cc32)cc1Cl 2325739202 DKWMKGJFMJRRRB-LBPRGKRZSA-N 386.260 2.619 0 50 GFAA COc1cnn2c1CN(C(=O)N[C@H](C)c1cnn(-c3ccc(F)cc3)c1C)CC2 2325795961 IFPFUDYXMBGCSC-CYBMUJFWSA-N 398.442 2.811 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCC2)cc1)NCCC1=CCCCC1 798594 KMUBSBRXJPSFBE-UHFFFAOYSA-N 392.521 2.857 0 50 GFAA CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CC1 805028 WCGPAZGHEHBRLK-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA CCOc1cc([C@H]2CC(=O)NC(C)=C2C(=O)OC)cc(Br)c1OC 1107197 VZAABJAGVCPPNU-LLVKDONJSA-N 398.253 2.907 0 50 GFAA CC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2cccs2)cc1 2052457 VMICRFRXGRNIIB-UHFFFAOYSA-N 378.504 2.708 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)no1 2356152036 NPKMUFYMBWEJOX-WHSLLNHNSA-N 389.496 2.699 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)CCc2nc3ccccc3s2)C[C@@H]1O 2356163510 GTHRPTFRCJXKOP-KXBFYZLASA-N 376.478 2.693 0 50 GFAA CC(C)CC(=O)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 6693182 GYJGNYFULBAFSI-UHFFFAOYSA-N 379.309 2.872 0 50 GFAA COc1ccc(CN2CCN(CCOc3ccccc3)CC2)c(OC)c1OC 20272192 XQQPEIMONLOOHQ-UHFFFAOYSA-N 386.492 2.909 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1O 67803129 AHMOQETXAJRUPS-LJQANCHMSA-N 399.535 2.640 0 50 GFAA Cc1nc([C@@H](C)NC(=O)c2coc(COc3cccc4cnccc34)n2)n[nH]1 67804181 HEYXPEAJWHXEBF-LLVKDONJSA-N 378.392 2.719 0 50 GFAA NC(=O)[C@H]1CCN(C(=O)c2cc(N3CCCC3=O)ccc2F)c2ccccc21 119851059 ZHBKDNXYTLNFIU-HNNXBMFYSA-N 381.407 2.572 0 50 GFAA Cc1cc(N(C)C[C@@H]2CCC[C@@H]2O)nc([C@H](C)N(C)C[C@H]2CCC[C@H]2O)n1 252477720 UPDBJVBVCQAZNM-APAFKAMOSA-N 376.545 2.536 0 50 GFAA Cc1nc(C)c(CCNC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)s1 171767753 VNMFHDUORQKYIE-UHFFFAOYSA-N 399.520 2.992 0 50 GFAA CCN(CC)C(=O)Nc1ccc(OC[C@H](O)CNC(C)(C)C)c(C(C)=O)c1 3813069 JOATXPAWOHTVSZ-MRXNPFEDSA-N 379.501 2.891 0 50 GFAA biogenic,world CCOC(=O)c1cc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc(C(=O)OCC)c1 4651238 MPIOXIQSKMNYNE-CVEARBPZSA-N 389.404 2.646 0 50 GFAA c1cncc(-c2noc([C@@]34CCC[C@@H]3CN(Cc3nc(C5CC5)n[nH]3)C4)n2)c1 328602344 BEKZWWKFYVJTFH-FOIQADDNSA-N 377.452 2.681 0 50 GFAA CCN1CCC[C@@H]1CN(C)C(=O)N[C@@H](c1ccccc1OC)c1nccn1C 363592788 LDWIXMYFRNGWQT-APWZRJJASA-N 385.512 2.644 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@@H](C(=O)NCc4cccnc4)C3)CC2)o1 71774730 AMUAAZWBVJMCQM-HXUWFJFHSA-N 396.535 2.976 0 50 GFAA COC(=O)c1cncc(N2CCC[C@@]3(CCC(=O)N(Cc4ccccc4)C3)C2)n1 72419098 XHYIPOUZMZZBIQ-JOCHJYFZSA-N 394.475 2.672 0 50 GFAA C[C@@H](c1noc(C2(N3CCCCC3)Cc3ccccc3C2)n1)N1CCOCC1 72147785 VMZNXWFOFNCNKP-KRWDZBQOSA-N 382.508 2.943 0 50 GFAA Cc1cnc(C2CCN(C(=O)NC3CCN(C[C@@H]4CCOC4)CC3)CC2)s1 370446564 FJAAXENQCKXDPS-INIZCTEOSA-N 392.569 2.841 0 50 GFAA CN1CCc2cc(-c3nc(C(=O)N4CCC5(CC4)OCCO5)cs3)ccc21 376910805 MCJTUGGBMALBGW-UHFFFAOYSA-N 385.489 2.782 0 50 GFAA c1ccc(Cc2cc(C3CCN(Cc4cc5n(n4)CCNC5)CC3)[nH]n2)cc1 72151632 SRHSHSHPUJAWMD-UHFFFAOYSA-N 376.508 2.680 0 50 GFAA CC[C@@H](NC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1cccs1 374398904 CSWRDBMFLXIIPX-OAHLLOKOSA-N 385.555 2.799 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)c3ccc4cc[nH]c4c3)CC2)C1 71759163 OUAUUPVWFLCTSV-SFHVURJKSA-N 394.519 2.763 0 50 GFAA Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)Nc1cnn([C@H]2CCOC2)c1C 451100134 QGGKIHAAEHHICS-LBPRGKRZSA-N 399.856 2.614 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc3sc(N)nc3c2)CCC(=O)N1CC1CC1 71639295 LXUWPMCZWNEPTQ-MRXNPFEDSA-N 386.521 2.988 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccc(-n3cccn3)cc2)C2CC(O)C2)cn1 223601321 QAMFQJQLGUXSNJ-NLPFYKDJSA-N 378.432 2.518 0 50 GFAA N=c1cc[nH]cc1-c1cccc(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1 426581359 XKOBSPGKKZPWPC-LJQANCHMSA-N 380.492 2.534 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cc1 92046179 XBZUEHJERGJRLH-JOCHJYFZSA-N 382.508 2.866 0 50 GFAA CCN1CC2(CCN(C(=O)c3cccnn3)CC2)C[C@@H](c2ccccc2)C1=O 91645648 JRDABVGDSVFSLQ-SFHVURJKSA-N 378.476 2.735 0 50 GFAA COc1cc(-n2cnnn2)ccc1NC(=O)N[C@H]1CCCc2sc(C)nc21 97475104 RKONEBCXBSWHTQ-ZDUSSCGKSA-N 385.453 2.635 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(C(=O)c1ccnc3ccccc13)CC2 91656849 SJIPLJLRWQKGOG-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA Cn1ncc(-c2ccccc2)c1NC(=O)NC1(CN2CCOCC2)CCCC1 96140961 IEFNWVJCKYESEA-UHFFFAOYSA-N 383.496 2.854 0 50 GFAA O=C(NC[C@@H]1CNCCO1)c1cccc(-c2ccc(OC(F)(F)F)cc2)c1 426642876 JLQNLOJUIKHVIY-KRWDZBQOSA-N 380.366 2.970 0 50 GFAA CCc1oc2c(NC(=O)N3CCN(CCn4cncn4)CC3)cccc2c1C 96164080 SQGSZSDWQFMBAM-UHFFFAOYSA-N 382.468 2.745 0 50 GFAA CN(C)c1cc(C(=O)N2C[C@H]3CCC[C@@]3(CNC(=O)OC(C)(C)C)C2)ccn1 293820218 QKGIWCDUQJODRK-IIBYNOLFSA-N 388.512 2.915 0 50 GFAA CC1(C)CCN(S(=O)(=O)N2CCC[C@H](c3cccc(C(=O)O)c3)C2)CC1 95353548 LOMASRQRINGQJM-KRWDZBQOSA-N 380.510 2.931 0 50 GFAA O=C(Nc1ccc2c(c1)COC2)N(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 96151765 XLWBTKRZMVLOEQ-LJQANCHMSA-N 386.473 2.938 0 50 GFAA COCC(=O)N1CCc2cc(NC(=O)c3scnc3C(F)(F)F)ccc21 298043279 PHPZLPCPPXHBSH-UHFFFAOYSA-N 385.367 2.950 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)C2CCN(C(=O)C(C)C)CC2)CC1 298778171 XWESBTQHBKJYDJ-UHFFFAOYSA-N 385.552 2.970 0 50 GFAA CN(C)[C@H](CNC(=O)c1cccc(-c2ccc(=O)n(C)n2)c1)c1cccs1 534592718 NGAHQSKCAOOJOA-QGZVFWFLSA-N 382.489 2.542 0 50 GFAA COc1cccc(-n2cc([C@H](C)NC(=O)N3CCN(CC4CC4)CC3)cn2)c1 534660490 KTGNTVUHBLDNTO-INIZCTEOSA-N 383.496 2.679 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NC1CCN(Cc2cccs2)CC1 827836886 RAVMSJKUNVKSEN-UHFFFAOYSA-N 385.533 2.723 0 50 GFAA O=C(c1cc2ccccc2c(=O)s1)N1CCn2c(nnc2C(F)(F)F)C1 828147311 MQWVDNPCJFJLPV-UHFFFAOYSA-N 380.351 2.528 0 50 GFAA O=C(c1cncc(NCC[C@@H]2CCCCN2C2CCCC2)n1)N1CCOCC1 670435312 UOTXYYDUGWNIMB-SFHVURJKSA-N 387.528 2.548 0 50 GFAA CN(C)[C@@H](C(=O)NC12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2)c1ccccc1F 952985192 QKHGAFADKIMCJC-LTWUZEEKSA-N 397.498 2.884 0 50 GFAA CCc1ccc(CN2CCN(C(=O)c3cc(OC(F)F)n(C)n3)CC2)s1 185627237 VNOFUYAXQXBIQX-UHFFFAOYSA-N 384.452 2.603 0 50 GFAA CCC[C@@H]1CCc2nc(NC(=O)c3cc(N4CCNC(=O)C4)ccn3)sc2C1 190736829 QPYYKLWHLGCCNZ-CYBMUJFWSA-N 399.520 2.632 0 50 GFAA Cn1nc(C(F)(F)F)c(CS(=O)(=O)c2ccc3c(c2)OCCO3)c1Cl 782192729 UTKOJPWVVAZZAE-UHFFFAOYSA-N 396.774 2.837 0 50 GFAA Cc1nc[nH]c1CN(CCO)C(=O)c1ccccc1OC(F)(F)C(F)F 1704312733 XVSNHPMRDIUCMC-UHFFFAOYSA-N 375.322 2.590 0 50 GFAA O=C(NCCCN1CCCCC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704311966 HQIFTCGQXRZTMD-UHFFFAOYSA-N 398.507 2.784 0 50 GFAA Cc1ccc(C(=O)N2CCCN(C(=O)c3cnn(C(C)C)c3)CC2)n1C(F)F 1772701982 ISLLYFJFQSPSOE-UHFFFAOYSA-N 393.438 2.957 0 50 GFAA CC[C@H]1C[C@@H](O)CCN1S(=O)(=O)c1ccc(-c2cc(C(F)(F)F)on2)o1 1772804968 VRVVPMHPXVOMBH-UWVGGRQHSA-N 394.371 2.877 0 50 GFAA CC[C@@H](CO)NCc1ccc(OCC(=O)N[C@@H](C)c2ccccc2)c(OC)c1 5027774 AVRKSDIAESDLTH-LPHOPBHVSA-N 386.492 2.812 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@H]2CC23CCN(C[C@H]2CC=CCC2)CC3)CC1 11998263 QUSONGRXVQCWQT-RBUKOAKNSA-N 389.540 2.746 0 50 GFAA CC(=O)N[C@H](CC(C)C)c1nnc2n1CCN(Cc1ccc(F)cc1F)CC2 14987921 TZMUMDANZYWFNJ-GOSISDBHSA-N 391.466 2.838 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cccc(C(F)(F)F)n2)C[C@H]1C(=O)O 169725724 OIYGWURMCMMDJW-JTQLQIEISA-N 375.347 2.611 0 50 GFAA COc1cnc(N2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)nc1 1857682642 YCXJLXDVQZSIHK-OAQYLSRUSA-N 390.447 2.527 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CCC(C3(O)CC3)CC2)s1 1857704996 NWUDIBOYEYEPTC-UHFFFAOYSA-N 382.507 2.946 0 50 GFAA Cc1ccsc1C(=O)N1C[C@@H]2[C@H](CNC(=O)c3cccnc3)[C@H]3CC[C@]2(C1)O3 1857721619 YNCJPIJWWORTBL-BIZBXSGISA-N 397.500 2.501 0 50 GFAA O=C1CCO[C@H]2CN(c3ncc(Cl)cc3F)C[C@@H]2N1Cc1ccccc1 1857729439 ATWDJDXPUWUEDU-IRXDYDNUSA-N 375.831 2.880 0 50 GFAA COc1c(C(=O)O)cc(-c2cccc(O[C@@H](C)C(=O)O)c2)c(OC)c1OC 1875250779 GUJALQIYDDBYLW-JTQLQIEISA-N 376.361 2.930 0 50 GFAA COC(=O)Nc1ccc(NC(=O)C(=O)N[C@@H]2C[C@@]23CCc2ccccc23)cc1 1875276043 GOSAHJFQNMIZBP-DYESRHJHSA-N 379.416 2.576 0 50 GFAA C=CC(=O)N[C@@H](CNC(=O)c1cnn2cc(C)cnc12)c1ccc(C(C)C)cc1 1875386386 OYAGDKPSFWXTME-IBGZPJMESA-N 391.475 2.934 0 50 GFAA Cn1c(CN2CC(N3C[C@H](c4nc(C5CC5)no4)CC3=O)C2)cc2ccccc21 877780430 QCUSAABQPDFSMR-MRXNPFEDSA-N 391.475 2.639 0 50 GFAA CC[C@H](c1ccccc1)c1nnc(N2CCO[C@@H](C)C2)n1CCCNC(C)=O 1764009231 KHFQCWCLCIZYEJ-QFBILLFUSA-N 385.512 2.571 0 50 GFAA O=C([C@@H]1OC[C@@H]2COCC[C@@H]21)N(Cc1ccc2c(c1)OCCO2)C1CCCC1 885703025 IBQJLQQIYJHJPV-DJPFJPOOSA-N 387.476 2.781 0 50 GFAA O=C(C[C@H]1CCNC[C@H]1F)Nc1nccn1Cc1ccc(Br)cc1 888101819 PFDBIXJKERLJDM-UKRRQHHQSA-N 395.276 2.970 0 50 GFAA COc1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)C(=O)Nc3ccncc32)c1 1775962016 NUHRVTGCNZLTIS-SNVBAGLBSA-N 381.841 2.527 0 50 GFAA COc1cc(NC(=O)[C@@H]2CC(=O)Nc3nc4ccccc4n32)cc(OC)c1OC 8996387 NRMJSMJPZKRXPX-AWEZNQCLSA-N 396.403 2.584 0 50 GFAA Cc1nn[nH]c1C(=O)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100482887 FCDBUQXRHLGYLJ-HXUWFJFHSA-N 391.475 2.691 0 50 GFAA COCCn1c([C@@H]2C[C@@H]2C)nnc1N1CCN(c2ncc(C)c(C(C)C)n2)CC1 2325769228 ZJBNVMYPKLFKTA-DOTOQJQBSA-N 399.543 2.596 0 50 GFAA Cc1ocnc1CS(=O)(=O)N[C@@H](C)c1nnc(-c2cccc(F)c2)s1 2325804100 VGYVOKHKSXQWAP-VIFPVBQESA-N 382.442 2.821 0 50 GFAA CS(=O)(=O)N(CC(=O)NCc1ccco1)c1cc(Cl)ccc1Cl 793307 HTJAAKAEVZUVOD-UHFFFAOYSA-N 377.249 2.669 0 50 GFAA Cc1ccnc(NC(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)c1 1124783 TXAJEDYEIZDWRR-UHFFFAOYSA-N 388.276 2.956 0 50 GFAA O=C(c1c(N2CCOCC2)noc1-c1ccccc1)N1[C@H]2CCC[C@@H]1C[C@H](O)C2 2356134922 IVKNQKXTQZLLQU-PIIMJCKOSA-N 397.475 2.696 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC[C@@](O)(CN(C)C)C3)ncnc21 2356152888 FZTXSNQYKZVMSK-OAQYLSRUSA-N 388.560 2.718 0 50 GFAA CC(=O)Nc1ccc(NC(=O)[C@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 2882330 JVQMJSIXZBPIAE-AWEZNQCLSA-N 389.477 2.747 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C(=O)c4csc(Cc5ccccc5)n4)C[C@@H]13)O2 2356166912 ORDJQRNJYRNJOV-PPULILFRSA-N 397.544 2.915 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)C(=O)c3c(C)[nH]c4ccccc34)CC2=O)cc1 4497215 QIFQYFPQGFSNPO-CQSZACIVSA-N 391.427 2.589 0 50 GFAA CCc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(OC)c(C)c1 4867649 UIIRJGDJNGQTIY-AWEZNQCLSA-N 376.478 2.872 0 50 GFAA CN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1ccc2c(c1)OCCO2 6580945 XITZPIXICJOKTF-UHFFFAOYSA-N 380.322 2.586 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)CN1CCN(C)c3ccccc31)CC2 109823951 SGRUDVZXWBZZRW-UHFFFAOYSA-N 381.476 2.545 0 50 GFAA Cn1ccnc1CCNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 225432007 AKSXFMUEDWECNL-UHFFFAOYSA-N 399.838 2.558 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)Nc1nn(Cc2ccccc2F)cc1Cl 2804737 VOVHYSQBIPOCMG-UHFFFAOYSA-N 383.836 2.865 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)c(F)c3)C[C@H]2CCO)CC1 104527098 RKHRELRYMJGRHN-LJQANCHMSA-N 381.511 2.706 0 50 GFAA COc1cc([C@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N(C)C(=S)N32)ccc1O 22204849 GVCLBNUGPADGCM-KXBFYZLASA-N 393.468 2.955 0 50 GFAA CCn1cc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@@H](CCO)C2)c(C)n1 20600338 MEGWZDFNTLAYJO-NRFANRHFSA-N 386.540 2.597 0 50 GFAA Cc1cc(CNC(=O)c2cccc(-c3noc(C4CC4)n3)c2)nc(N(C)C)n1 252508268 XIRSGMVRUZWPHY-UHFFFAOYSA-N 378.436 2.708 0 50 GFAA Cc1cn(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCCCC3)c2)c(C)n1 72121744 URPGUWVXJMKNTH-UHFFFAOYSA-N 377.466 2.752 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(c3ccnc4ccccc34)CC2)CN1C(=O)C1CC1 72432481 HUSILKQVOOJPLN-IBGZPJMESA-N 379.460 2.917 0 50 GFAA COc1cc(CN2CCCCCC2)ccc1OC[C@H](O)CN1CCSCC1 15065394 MLRPYTAYOQQFIQ-LJQANCHMSA-N 394.581 2.860 0 50 GFAA O=C(NCC[S@@](=O)Cc1ccccc1)NC[C@H](O)c1ccccc1Cl 127148195 OSBDLIQTKBCSCC-GKVSMKOHSA-N 380.897 2.622 0 50 GFAA C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 332849104 RZMMRCQKFMGUDZ-YASPSYONSA-N 383.536 2.890 0 50 GFAA O=C(NC1CCC(C(=O)O)CC1)c1ccc(S(=O)(=O)C2CCCC2)cc1 262685239 YDJKRABIXPUGPN-UHFFFAOYSA-N 379.478 2.776 0 50 GFAA COc1cccc(C2(C(=O)N3CCC(NC(=O)c4scnc4C)CC3)CC2)c1 370575121 FPARYJGLSBGMQA-UHFFFAOYSA-N 399.516 2.913 0 50 GFAA Cc1nc(NCCNC(=O)c2ccc(C(F)(F)F)cc2)cc(-n2cccn2)n1 72140698 ZXRMSMHJIHORTJ-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)N3CC(=O)N(c4ccccc4)C[C@@H]3C)oc2c1 82107669 ZFLRNCWEDPRMMP-HNNXBMFYSA-N 376.412 2.979 0 50 GFAA COc1ccccc1N1CCC(NC(=O)[C@H](C)NC(=O)c2cccs2)CC1 138718059 CSOXZSCCJUKWNH-AWEZNQCLSA-N 387.505 2.660 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Nc3ccc(C(C)=O)cc3)C2)CCC1=O 91873266 JPGBHZYBQAGJBY-NRFANRHFSA-N 387.480 2.772 0 50 GFAA CC(=O)c1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cs1 95505799 SSDXHCRDYXHWMW-UHFFFAOYSA-N 398.532 2.960 0 50 GFAA CN(C)C(=O)CCN1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2 91997224 IPLXTKMDBGGLHH-HXUWFJFHSA-N 383.536 2.725 0 50 GFAA CCc1nn(C)c(NC(=O)N[C@@H](c2ccccc2)c2nnc(N)s2)c1CC 95496589 MZNOJZPSCVJRDN-AWEZNQCLSA-N 385.497 2.890 0 50 GFAA CCN(Cc1ccccc1)C1CCN(c2cc([C@H]3C[C@@H](N)C3)nc(N)n2)CC1 244811764 SKRKSISBGJJZSQ-HDICACEKSA-N 380.540 2.754 0 50 GFAA CNC[C@@H]1CCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 299738859 HJXMNYDKKVXNGY-AWEZNQCLSA-N 381.314 2.565 0 50 GFAA CCn1ncc(-c2ccc(C(=O)NC[C@H](O)CN3CCCCCC3)cc2)c1C 534675311 SWRWGNSTKJSGRF-FQEVSTJZSA-N 384.524 2.845 0 50 GFAA Cc1ccnc(C[C@H](C)N(C)C(=O)c2ccc(-c3ccc(=O)n(C)n3)cc2)c1 534643550 YGRHPBMSKDETFT-INIZCTEOSA-N 376.460 2.854 0 50 GFAA COC(=O)Cn1cc(CN[C@@H]2COc3c(cccc3OC)C2)c2ccccc21 39360031 AXGDFXIKTARJCZ-KRWDZBQOSA-N 380.444 2.916 0 50 GFAA COc1ccc2[nH]c(CNC(=O)c3ccc(OC)c(N4CCOCC4)c3)cc2c1 670450036 XWIQHOFWLSELDW-UHFFFAOYSA-N 395.459 2.952 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cc1ccc(O)c(Cl)c1 1565511339 ZYLAOJCFCKBFGZ-ZBFHGGJFSA-N 376.884 2.838 0 50 GFAA CC(C)=CCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1ccc(Cn3ccnc3)o1)C2 1565514693 AEVIJBPABMGXAN-SJORKVTESA-N 382.464 2.554 0 50 GFAA CC(C)Oc1ccc(-c2nc(C(=O)N3CCOC[C@H]3C(=O)O)cs2)cc1 268970198 GMLRLCFTAGYLTQ-HNNXBMFYSA-N 376.434 2.523 0 50 GFAA CC(C)(C)OCc1cc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)no1 186473896 RWQCQYOTSDHMDR-AWEZNQCLSA-N 375.473 2.601 0 50 GFAA CCc1nn(C)c(CC)c1CC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1 188250381 ULOXVTRSKGPSEX-GFCCVEGCSA-N 395.500 2.507 0 50 GFAA O=C(Cn1ccc(=O)cc1)N1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 1506428608 RHDUJMLNGAZRCQ-QHCPKHFHSA-N 379.504 2.753 0 50 GFAA Cc1ccc(NC2(C(=O)N3CCC[C@H]3C(=O)N3CCOCC3)CCCCC2)cc1 1506403017 NJIKQZYDAYOOKN-FQEVSTJZSA-N 399.535 2.960 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)[C@H](O)c3cccc(Cl)c3)CC2)c(C)o1 1529114589 QMMLHHDSKDGVQK-GOSISDBHSA-N 390.867 2.958 0 50 GFAA O=C(c1[nH]c2ccccc2c1Cl)N1CC[C@@H](O)[C@@](CC2CC2)(C(=O)O)C1 1704338507 DWENENUZPWSOAG-KUHUBIRLSA-N 376.840 2.899 0 50 GFAA COc1cccc(/C=C2\SC(=N)NC2=O)c1OS(=O)(=O)c1ccccc1 5123234 HKWLGVLYCAEAMJ-UVTDQMKNSA-N 390.442 2.602 0 50 GFAA CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(N3CCCCC3=O)cc2)cc1 11906596 NQKGFDPNLWJRHH-UHFFFAOYSA-N 387.461 2.963 0 50 GFAA CCN(CC)CCN(C)C(=O)c1cc(-c2ccccc2)cc(-n2cnnn2)c1 12097848 UITVVUVQCXPODD-UHFFFAOYSA-N 378.480 2.743 0 50 GFAA CNC(=O)c1nn(CC2CCCCC2)c2c1C[C@@H](NCCOC(C)C)CC2 14531970 SZZQGHBYIXFYJR-KRWDZBQOSA-N 376.545 2.695 0 50 GFAA O=C(NCc1ccon1)[C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 14954804 VBESBNIJKFZCCF-IBGZPJMESA-N 382.508 2.667 0 50 GFAA O=C(c1cn(C[C@H]2CCCN(CCCc3ccccc3)C2)nn1)N1CCCC1 15000843 UMPHGOWNFZQSGU-FQEVSTJZSA-N 381.524 2.859 0 50 GFAA CSCC(=O)NC[C@@H]1Cc2cccc(-c3ccc(S(C)(=O)=O)cc3)c2O1 15071844 RLWWRXGVEWQJSY-HNNXBMFYSA-N 391.514 2.540 0 50 GFAA Cc1cccc(NC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 16504024 FZKKLYPCSLJBGR-UHFFFAOYSA-N 388.489 2.587 0 50 GFAA COc1cccc(NC(=S)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 19841149 BOHJCIYWJAMVBH-UHFFFAOYSA-N 385.489 2.939 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(O)c3)C[C@]23CC[C@H]1O3)c1ccsc1 1857715710 DRLIDCQJEQHAMT-QEUVDIPISA-N 384.501 2.863 0 50 GFAA COc1ccc(-c2nccn2C2CCS(=O)(=O)CC2)cc1CN1CCCC1 1857732506 UBVRJEAJPAJDHY-UHFFFAOYSA-N 389.521 2.904 0 50 GFAA CCCO[C@H]1C[C@@H](c2nc(CC(=O)NC)nn2-c2cccc(C)c2C)CC[C@@H]1N 1857738546 NAHYMCRWDCUKDO-LNLFQRSKSA-N 399.539 2.563 0 50 GFAA COC[C@H](NCc1nc(N)nc(=Nc2ccccc2C)[nH]1)c1cccc(Cl)c1 411761598 YDTZEQYNHCVVMQ-KRWDZBQOSA-N 398.898 3.058 0 50 GFAA CCc1oc(C(=O)N2CCC[C@@H](N(Cc3cncnc3)C(C)=O)CC2)cc1C 328629838 IRTNJLBICOFJCV-GOSISDBHSA-N 384.480 2.984 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)cc1Cl)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 249515217 IWVVWAVDNJYPHA-VLQBMKARSA-N 381.803 2.749 0 50 GFAA O=C1CC[C@@H](OC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)CN1 860765589 FMROUCCUTWCCAE-GFCCVEGCSA-N 380.326 2.674 0 50 GFAA C[C@H](O)CN1CCN(C[C@@H](CN(C)Cc2ccccc2)c2ccccc2)CC1 864097582 XCCOOLFQKFXATP-XUZZJYLKSA-N 381.564 2.901 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)CC3CCN(c4ccncc4)CC3)n[nH]c21 1875394106 VRWLAQPBLIUCJA-CABCVRRESA-N 383.496 2.816 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2cn[nH]c2)cc1 1875401304 IEBYUVHNQBFPSU-IRXDYDNUSA-N 378.436 2.524 0 50 GFAA COc1ccc(NC(=O)c2cn(C)nc2C(=O)Nc2ccc(OC)cc2)cc1 20617156 AQSKCYLYWWGXEU-UHFFFAOYSA-N 380.404 2.942 0 50 GFAA COc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCC3)cs2)c(OC)c1 6680548 MFUFMDJJXLBDCE-UHFFFAOYSA-N 396.490 2.802 0 50 GFAA CCc1ccc(N2C[C@@H](C(=O)N3CCN(c4ccccc4)CC3)CC2=O)cc1 7452275 WTRSGMARIIOLHK-IBGZPJMESA-N 377.488 2.951 0 50 GFAA O=C(NC1CCCC1)C1CCN(S(=O)(=O)Cc2cccc(Cl)c2)CC1 24610380 YIRKWGDXSMPZNH-UHFFFAOYSA-N 384.929 2.941 0 50 GFAA CCOc1ccc([C@H]2CC(=O)Nc3c2c(C)nn3CC(=O)O)c(OCC)c1C 65528371 BZBDFMKLGYZGSW-CQSZACIVSA-N 387.436 2.856 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)C[C@@H]2CCCO2)C[C@H]1c1ccc(Br)cc1 425011291 QACKIDBGMOBALS-HRCADAONSA-N 396.281 2.733 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 67965448 VUXXMOAVAXOQNE-UHFFFAOYSA-N 378.432 2.594 0 50 GFAA COC(=O)[C@H]1Cc2cc(OC)c(OC)cc2CN1CC(=O)Nc1ccc(C)cc1 35146730 CVJAAUBSOABKGD-GOSISDBHSA-N 398.459 2.551 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)O)c(C(=O)NCC(C)C)n1 5962257 AYLKFRZVXMXFIJ-CABCVRRESA-N 390.484 2.675 0 50 GFAA c1ccc(Cc2nnc(N3CC[C@H](C4CCOCC4)C3)n2C[C@H]2CCCO2)nc1 328855918 UCVARPXBYSHWLQ-AZUAARDMSA-N 397.523 2.696 0 50 GFAA O=C(CCn1ccccc1=O)N1CC[C@@](O)(c2ccccc2)[C@H]2CCCC[C@@H]21 72433060 WNHNCMSPMGDSDE-SXWKCWPCSA-N 380.488 2.917 0 50 GFAA Cn1cc([C@H](NC(=O)c2ccc(CN3CCCCC3)cc2)C2CC(O)C2)cn1 218982942 YYXNIKSQVDIFHW-DQVLVPHSSA-N 382.508 2.648 0 50 GFAA CCOC[C@@H](NC(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1)C(C)C 242048068 VSLBKIJJNNRTAY-LJQANCHMSA-N 386.496 2.696 0 50 GFAA CC(=O)NCCNC(=O)c1ccc2c(c1)n(CC1CC1)c(=O)n2C1CCCCC1 77521953 DSKOLGKJAHJYCR-UHFFFAOYSA-N 398.507 2.584 0 50 GFAA C[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1ccc(-n2cccn2)cc1 173337659 XFRJGUWXPKURBI-INIZCTEOSA-N 376.464 2.756 0 50 GFAA O=C(c1ccccn1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72157234 XADGJFGXZVULIG-ZLGUVYLKSA-N 377.444 2.513 0 50 GFAA Cc1nc(C(=O)N2CCC(C(=O)O)(n3ccc(-c4ccco4)n3)CC2)cs1 72422605 WWTQGJQAXPAYHU-UHFFFAOYSA-N 386.433 2.624 0 50 GFAA C[C@@H](c1cccnc1)N1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)CC1 175936317 XIRZZBPAWWJTCD-KRWDZBQOSA-N 391.479 2.632 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2ccccc2F)CC1 96138622 RYHKDRAJWVPLOM-UHFFFAOYSA-N 382.443 2.702 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](NC(=O)C2CCCC2)CN1Cc1ccc(C)o1 96142295 SHTCFQSCWDSXBT-HKUYNNGSSA-N 375.513 2.706 0 50 GFAA COc1cc(NC(=O)N2CCCO[C@@H](CN3CCCC3)C2)c2ncccc2c1 95522695 YRDQPZUUWBUFQT-SFHVURJKSA-N 384.480 2.962 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)c2c[nH]c(=O)c3ccccc23)s1 97785589 RKEAFQJJJHZUHK-HNNXBMFYSA-N 381.457 2.927 0 50 GFAA Cc1[nH]cnc1CN1C[C@@H]2CC[C@H](C1)N(Cc1cnc(-c3ccco3)nc1)C2 91441768 WYTKKAFGDFQXKI-FUHWJXTLSA-N 378.480 2.865 0 50 GFAA COc1ccccc1CN1CCN(C(=O)Nc2ccc3cnn(C)c3c2)CC1 96140117 LVBFYXCFJLXPHP-UHFFFAOYSA-N 379.464 2.932 0 50 GFAA COc1ccc(CN2CC(c3cccnc3)C2)cc1OC[C@H](O)CN(C)C(C)C 95496995 KSMHENKRTHWBAZ-OAQYLSRUSA-N 399.535 2.770 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3cc(C)no3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95370708 QBKHWGACDDKOEL-KSEOMHKRSA-N 381.476 2.623 0 50 GFAA O=C1CCC2(CCN(C(=O)NCCc3ccccc3)CC2)CN1C[C@@H]1CCCO1 91462139 ZMOLGGMQFKWQCT-FQEVSTJZSA-N 399.535 2.822 0 50 GFAA O=C(N1CCCC1)N1CC[C@]2(O)CCN(Cc3cccc4ncccc34)C[C@@H]2C1 95382283 QIMASAUMONVVMO-AUSIDOKSSA-N 394.519 2.709 0 50 GFAA O=S(=O)(N[C@@H]1CCOc2ccccc21)c1ccc(OCC(F)(F)F)nc1 182581695 LZOGMJMTPKQZKA-CYBMUJFWSA-N 388.367 2.825 0 50 GFAA C[C@@H]1CN2c3cc(Cl)ccc3CC3(C(=O)OC(C)(C)OC3=O)[C@H]2[C@@H](C)O1 251781044 MXUWHMHCDMMPKV-UEKVPHQBSA-N 379.840 2.701 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)Nc1n[nH]c(C3CCC3)n1)CC2 184571742 MOOUMDUIENPSKS-SNVBAGLBSA-N 380.374 2.933 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)CN3CCOc4ccccc4C3)cc2)CC1 952979625 OQRVZYKMZMTYEW-UHFFFAOYSA-N 395.503 2.993 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(c3nnc4n3CCCCC4)CC2)C2(CCCC2)O1 952963085 FLYIJWFFPWZCPX-MRXNPFEDSA-N 386.496 2.586 0 50 GFAA O=C1O[C@H]2CN(Cc3c(F)cccc3Cl)C[C@H]2N1CCN1CCCCC1 1565511111 ANCGFPBLWXHZGE-MSOLQXFVSA-N 381.879 2.970 0 50 GFAA O=C1OCCN1c1ccc(S(=O)(=O)N2CC[C@@H](Nc3ccccc3)C2)cc1 170637272 QMXFVFZFUDFVHE-MRXNPFEDSA-N 387.461 2.518 0 50 GFAA CC(C)COC(=O)N1CCC(C(=O)N[C@@H](Cc2nnc[nH]2)c2ccccc2)CC1 170601782 LFGYTRRDRVIQCF-SFHVURJKSA-N 399.495 2.709 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCC[C@@H]4C(=O)NC[C@H]43)cc12 170609927 YIXOMQOITNMJMP-DOTOQJQBSA-N 394.500 2.805 0 50 GFAA COc1cc(CNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)ccc1O 194475845 WOOUWZLTHDYWBD-INIZCTEOSA-N 378.222 2.783 0 50 GFAA Cc1c(CC(=O)N[C@H](C(N)=O)C(C)C)c2c(n1Cc1ccccc1)CCCC2=O 11879491 DERREOCOSVNMQP-QFIPXVFZSA-N 395.503 2.532 0 50 GFAA O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1 12002605 YPVXFWGFFKIITB-UHFFFAOYSA-N 382.800 2.933 0 50 GFAA COCCN1CCC(CN(Cc2cnc(N(C)C)s2)C[C@@H]2CCCO2)CC1 12076347 GMLAJMZNJIIKFU-SFHVURJKSA-N 396.601 2.549 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCN(C)[C@@H](C)C3)nc2)cc1 12714865 WIZCHKGSKCVKOS-KRWDZBQOSA-N 382.508 2.593 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2F)CN(C(=O)c2ccco2)CC1=O 14531396 HUHMHRTWPNJFNE-QGZVFWFLSA-N 388.439 2.945 0 50 GFAA COCCSc1nnc(C2CCN(Cc3ccc(COC)o3)CC2)n1C 14991934 QWIBJTLGNSNIBS-UHFFFAOYSA-N 380.514 2.673 0 50 GFAA C[C@@H](Oc1ccc(Br)cc1)C(=O)N1CCN(c2ccccn2)CC1 5059744 GDJBOBHRRBPJPD-CQSZACIVSA-N 390.281 2.960 0 50 GFAA Nc1cc(N)nc(S[C@H](C(=O)NCc2ccc(F)cc2)c2ccccc2)n1 19926861 RAXUVRKQYAUBFI-KRWDZBQOSA-N 383.452 2.930 0 50 GFAA O[C@H](c1ccccc1)c1nn(CN2CCOCC2)c(=S)n1-c1ccccc1 19973429 TVAOMLLMSGUXRG-GOSISDBHSA-N 382.489 2.775 0 50 GFAA CCOc1ccc(NC(=O)Cn2ccn3nc4c(c3c2=O)C[C@H](C)CC4)cc1 169760101 CVVASLVJMGTAHX-CQSZACIVSA-N 380.448 2.658 0 50 GFAA COC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(S(N)(=O)=O)cc2)n1 2243957 YYMGYENEYKIXFZ-UHFFFAOYSA-N 391.836 2.627 0 50 GFAA COc1ccc(N2C(=O)N(c3ccccc3Cl)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 4172199 GBNNYSMKJRWEBL-IAGOWNOFSA-N 392.864 2.961 0 50 GFAA COc1ccc(CCN[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC 4679147 JZYXCOZMMBSEMN-INIZCTEOSA-N 388.851 2.821 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)NCc2nccn2C)cc1OC 1857694951 MMQDLNTWONYRCT-UHFFFAOYSA-N 396.447 2.618 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCC(C)(C)N(C)C)C3)nc2c1 1857740529 RIGBRWMAZKHGLJ-OAHLLOKOSA-N 388.512 2.899 0 50 GFAA C[C@H](N)[C@@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 237478502 FGLUKKMWZYHERX-VHSXEESVSA-N 381.723 2.850 0 50 GFAA Cc1ccccc1-c1nc(CN2CCN(CC(=O)N3CCCC[C@@H]3C)CC2)no1 122274636 CNNCVSIMGBFHMW-SFHVURJKSA-N 397.523 2.564 0 50 GFAA O=C(c1cn(C2CCN(Cc3c(F)cccc3F)CC2)nn1)N1CCCC1 12330556 QWGXAYYVHOBGJQ-UHFFFAOYSA-N 375.423 2.629 0 50 GFAA COc1ccc(-c2cncc(C(=O)NCC3CCN(CCN(C)C)CC3)c2)cc1 135539327 UQMLDUCFSGQMDB-UHFFFAOYSA-N 396.535 2.761 0 50 GFAA O=C(CCOCC(F)F)N1CC[C@](c2nc(C3CC3)no2)(C(F)(F)F)C1 952895643 VCIZQLPHXLSBGO-AWEZNQCLSA-N 383.317 2.651 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)N[C@]3(C(N)=O)CCCOC3)cs2)cc1 1875254040 RUJAALIKTITLFH-HXUWFJFHSA-N 387.505 2.627 0 50 GFAA N=[S@]1(=O)CCC[C@]2(CCCN2C(=O)c2ccnn2CCC(F)(F)F)C1 1875395614 GWHLALSZTAOAJX-PWECECGKSA-N 378.420 2.651 0 50 GFAA C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)NCc1ccccc1CN(C)C(=O)C1CC1 1775996892 MAHJRGYJZCFYNS-VBKZILBWSA-N 380.492 2.760 0 50 GFAA C[C@@H](Cn1cccn1)OC(=O)[C@H]1CC(=O)Nc2ccc(Br)cc21 2325750150 ZFANNUDTFCZNTL-GWCFXTLKSA-N 378.226 2.703 0 50 GFAA O=C(NC[C@H]1CCC[C@H]1N1CCCS1(=O)=O)c1ccc(-c2ccccc2)nc1 2325768135 QHIUVXJTEIGMBI-YLJYHZDGSA-N 399.516 2.683 0 50 GFAA Cn1ncc2nc(C(F)F)c(C(=O)N[C@H]3CCCC[C@]34CCCNC4)cc21 2325779206 OENATDZUFKEHNR-HNAYVOBHSA-N 377.439 2.948 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)c1cc2n(n1)CCC[C@H]2N 2325795982 JPJDTXZCAJOZEU-LLVKDONJSA-N 392.385 2.844 0 50 GFAA CC(C)N1CCc2onc(C(=O)N(C)Cc3cnn(-c4ccccc4)c3)c2C1 2325805137 RGAYDTZUVNWSNQ-UHFFFAOYSA-N 379.464 2.899 0 50 GFAA Cc1nc(-c2cccc(C(=O)NCCN3CCOCC3)c2)c2sccc2n1 2356152327 YWMZXJXLKUNAGD-UHFFFAOYSA-N 382.489 2.729 0 50 GFAA Cc1ccnc(NC(=O)CN(C)C(=O)c2c(C)nn(-c3ccccc3)c2C)c1 110381421 UVKFWGRBSJRZFP-UHFFFAOYSA-N 377.448 2.903 0 50 GFAA CSc1nnc(NC(=O)CS(=O)(=O)c2ccc3ccccc3c2)s1 8335030 BVMIHPAHKVLUQE-UHFFFAOYSA-N 379.488 2.826 0 50 GFAA C[C@@H](C(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1)c1cc2ccccc2o1 225716141 HVWAKAABCONMBQ-ZBFHGGJFSA-N 376.478 2.563 0 50 GFAA CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1 247500636 XOJHDLHMFQVEQD-KSZLIROESA-N 387.524 2.675 0 50 GFAA Cc1cccc(CN2CCN(Cc3ccc(O)c(Cl)c3)C[C@@H]2CCO)n1 20781299 ZLVUAVNLUMZKME-SFHVURJKSA-N 375.900 2.818 0 50 GFAA CCn1ncc(-n2c(S)nnc2CCn2nc(C(F)(F)F)cc2C)c1C 8339745 MNPWQKPFYNMIPZ-UHFFFAOYSA-N 385.419 2.847 0 50 GFAA Cc1cccc(CN2CCN(Cc3cnn(-c4ccccc4)c3)C[C@@H]2CCO)n1 20993715 RLYFFBXUGMCBMZ-QHCPKHFHSA-N 391.519 2.645 0 50 GFAA Cc1ccc2nsnc2c1NC(=O)CN1CCN(c2ccc(F)cc2)CC1 55242737 TUXUNIYSIRVMCX-UHFFFAOYSA-N 385.468 2.900 0 50 GFAA Cc1nc(N2CCCCC2)cc(N2CCN(C(=O)c3ccccc3F)CC2)n1 33318281 XGXVXHLIXCTBQL-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA Cn1ncc(NC(=O)c2ccccc2COc2ccc(F)cc2F)c1C(N)=O 2787752 IMAHEJCTCYONMY-UHFFFAOYSA-N 386.358 2.629 0 50 GFAA Cn1ncc2c(N3CCN(Cc4cccnc4)CC3)nc(C3CCCC3)nc21 72468052 MMYWCDHGEDMNIK-UHFFFAOYSA-N 377.496 2.738 0 50 GFAA Cn1cc(I)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)n1 6828029 WWIPDVNHUINMPA-UHFFFAOYSA-N 399.276 2.971 0 50 GFAA O=C(O)CC1(CNC(=O)CCS(=O)(=O)c2ccc(F)cc2)CCCCC1 218397746 SEJPYEHWNGDUCB-UHFFFAOYSA-N 385.457 2.531 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@H]1CCN(c2c(F)cccc2F)C1 152694692 OUNWJKUCIKGSPS-HNNXBMFYSA-N 398.417 2.624 0 50 GFAA COc1ccc2cc(C(=O)[C@H]3CCCN(CCn4cc[nH]c4=O)C3)ccc2c1 71524312 UQLWDCGIUQWQRA-IBGZPJMESA-N 379.460 2.933 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)Cn3nc(C)c(Cl)c3C)CC2)oc1C 363512276 RSGJBDRJUGJLOQ-UHFFFAOYSA-N 393.919 2.787 0 50 GFAA CC(=O)c1cn(CC(=O)N2CCC[C@]3(CC2)CN(C)C(=O)O3)c2ccccc12 72158855 DTNYWDHXFRSHII-NRFANRHFSA-N 383.448 2.677 0 50 GFAA OCc1csc(N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n1 72151378 NOKOFBXDFDBZQS-ZTFGCOKTSA-N 377.460 2.980 0 50 GFAA C[C@H](C1CCN(C(=O)c2c[nH]nc2-c2ccccc2)CC1)N1CCN(C)CC1 77321346 GUGHMTJHGDCWKF-QGZVFWFLSA-N 381.524 2.565 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4cccc(C)c4C)CC3)ncn2)n1 72441266 HZHUAJHBQLAMTB-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cccc(-n2cccn2)c1 174086504 GLRHWXAWKIIPIE-MRXNPFEDSA-N 376.464 2.756 0 50 GFAA COc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)c(OCC2CC2)c1 239352402 ACAHTYXFMMGXCI-UHFFFAOYSA-N 396.491 2.883 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cnn(Cc2cccc3ccccc23)c1 225747402 NGEGGVYNURDQQT-YSTOQKLRSA-N 389.411 2.677 0 50 GFAA CN1CCN([C@H]2CCCCN(C(=O)c3cccn3Cc3cccs3)C2)CC1 175994193 RTVWRCXPOYMVRK-SFHVURJKSA-N 386.565 2.840 0 50 GFAA O=C(CCN1C(=O)C2(CCNCC2)Nc2ccccc21)NC1CCCCCC1 82115935 VXWQWNOAENMSDW-UHFFFAOYSA-N 384.524 2.796 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CCCn2nc([C@@H](O)CO)cc2C1 220352209 NBQCKXWJRULJDR-NRFANRHFSA-N 377.444 2.622 0 50 GFAA Cc1cc(=O)n(CC(=O)N(C)C[C@@H]2Cc3ccccc3CN2C)c2ccccc12 426490034 HUTUKMLULVCAIC-FQEVSTJZSA-N 389.499 2.825 0 50 GFAA CCC[C@@H]1C=CCN1S(=O)(=O)c1cccc(C(=O)N(C)CCCOC)c1 97675207 JPRFCKXALRPEEP-QGZVFWFLSA-N 380.510 2.524 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)NCc1scnc1-c1ccccc1 91793303 TVZLOKGBMIWOBW-UHFFFAOYSA-N 376.441 2.836 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)C(C)C)C2)c(OC)c1 95519781 UPVZBTUTKVAZAW-INIZCTEOSA-N 376.497 2.995 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNC(=O)c2cnc(N3CCCC3)nc2)C1 97730021 FUDGIBFOXGSGRV-GOSISDBHSA-N 379.508 2.605 0 50 GFAA CN(C)c1nc(N2CCC[C@H](c3nccn3Cc3ccccn3)C2)ncc1F 95508840 OLROASKDSPDBCI-HNNXBMFYSA-N 381.459 2.706 0 50 GFAA O=C(O)CC[C@@H]1CN(C(=O)Nc2cccc(Cl)c2)CC[C@@H]1N1CCOCC1 91907161 JRLPYCAYRUKSOS-PBHICJAKSA-N 395.887 2.759 0 50 GFAA Cc1ccccc1NC(=O)N1CCC[C@H](c2nnc(Cn3ccnc3)n2C)C1 95364632 VYTLAIGFZNDANR-INIZCTEOSA-N 379.468 2.780 0 50 GFAA Cc1cc(NC(=O)CN2CCC[C@H](c3nncn3C3CC3)C2)n(C(C)(C)C)n1 180878099 JDKQWLBJPIXNDE-HNNXBMFYSA-N 385.516 2.691 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@@H]1Sc2ccccc2NC1=O)c1ccc(F)cc1 299746464 XOYKZURYRWKWBL-HOCLYGCPSA-N 388.420 2.961 0 50 GFAA C[C@H](O)CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(F)(F)F)nc1 182936330 YYTBTPLGGSIDMM-LBPRGKRZSA-N 396.431 2.727 0 50 GFAA O=C(c1cc(Cl)ccc1-n1cnnn1)N1CCO[C@H](CCc2ccccc2)C1 183339105 MLFUTGJZILJHEN-QGZVFWFLSA-N 397.866 2.790 0 50 GFAA O=C(NC[C@H]1CCCN(CCO)C1)N1CCC(Oc2ccccc2Cl)CC1 534651029 WUZYWADYKNCEPV-MRXNPFEDSA-N 395.931 2.597 0 50 GFAA O=C1CO[C@H]2C[C@@H](C(=O)Nc3nc4c(s3)-c3ccccc3CC4)CC[C@@H]2N1 1940197195 YKFLJBYZZRBUQD-NOLJZWGESA-N 383.473 2.531 0 50 GFAA O=C(c1ccc(N2CCCC2)c(Cl)c1)N1CC[C@@H]2OCc3cnnn3[C@H]2C1 299784294 OUWWUOBEGHDAEV-ROUUACIJSA-N 387.871 2.518 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2ccccc2OC[C@H]2CCCO2)CC1 827758243 ZTGCBZWELRGHPE-MRXNPFEDSA-N 375.469 2.577 0 50 GFAA Cn1cccc1C(=O)N1CCOC2(CCN(C(=O)CCC3CCCC3)CC2)C1 827921360 POQLYKYJMFVMGV-UHFFFAOYSA-N 387.524 2.829 0 50 GFAA CCc1nc(C)c(C(=O)N2CCC(C(=O)NCc3ccc(OC)cc3)CC2)o1 952984516 XBVOJDSWXTWBHH-UHFFFAOYSA-N 385.464 2.723 0 50 GFAA CCOc1ccnc(N2CCCN(C(=O)N[C@@H]3C[C@H]3c3cccc(F)c3)CC2)n1 195201806 BGTBGFOJTUWDEH-ZWKOTPCHSA-N 399.470 2.792 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)c1)C1CCC1 1529159132 OTTWQASLDFFSRS-NHCUHLMSSA-N 394.471 3.000 0 50 GFAA CCOc1ccc(Br)cc1S(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 714124 UGHMAMGUUPUDOA-GHMZBOCLSA-N 378.288 2.646 0 50 GFAA O=C(CC1CCN(Cc2ccccc2)CC1)N1C[C@H](O)[C@H](Cc2ccncc2)C1 1704351694 QLYPHCSJZVAHTJ-PKTZIBPZSA-N 393.531 2.746 0 50 GFAA CCCOc1ccccc1C(=O)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704316192 ZVPFBZIFVRQPPX-NFBKMPQASA-N 397.471 2.996 0 50 GFAA CNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1154365 WJZDFUUZXIXGSW-UHFFFAOYSA-N 387.288 2.930 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@](Cc2ccccc2)(C(=O)OCC)C1 11753653 LTVHAZWWXDSLLP-JOCHJYFZSA-N 399.491 2.974 0 50 GFAA CCN(CCn1cccn1)C(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12438463 VISAZECBLLMMOD-UHFFFAOYSA-N 392.385 2.704 0 50 GFAA CC(C)OCCNCc1cccc(OC[C@@H](O)CN2CCc3ccccc3C2)c1 14980773 JJFGTRHDMPMKDD-QHCPKHFHSA-N 398.547 2.999 0 50 GFAA CC(C)N1CCC(N2CCC[C@@H](C(=O)NCc3cn4ccsc4n3)C2)CC1 15066932 IHXQJMOEUVHKKQ-MRXNPFEDSA-N 389.569 2.597 0 50 GFAA COc1ccc(-c2ccccc2)cc1NC(=O)Cn1ncc(N(C)C)cc1=O 19224530 VPRYYYRQYXCPPX-UHFFFAOYSA-N 378.432 2.624 0 50 GFAA Cc1n[nH]c(C)c1-n1ccnc1-c1ccc(OCC(=O)NC[C@@H]2CCCO2)cc1 1857691858 ZAQOOPCKGLORED-SFHVURJKSA-N 395.463 2.553 0 50 GFAA CCn1c(CNc2ncccc2CO)nc(Br)c1Br 922291392 YYLXCBBGIBHTAW-UHFFFAOYSA-N 390.079 2.927 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NC[C@H]3C[C@H](CO)CO3)cc12 1875298479 BXICFMRCDNZBHP-IUODEOHRSA-N 389.452 2.662 0 50 GFAA c1cc2c(cc1Nc1nc3nonc3nc1Nc1ccc3c(c1)OCO3)OCO2 780563 KYWPWFFDSSCXSI-UHFFFAOYSA-N 392.331 2.957 0 50 GFAA CN1CCN(CCc2ccc(NC(=O)c3cccc4ncn(C)c34)cc2)CC1 2325758932 JYEVEGOXMQREQM-UHFFFAOYSA-N 377.492 2.616 0 50 GFAA CC(C)c1nocc1C(=O)N1C[C@H](C)[C@@H](NC(=O)COCC2CCCC2)C1 2325793690 DIEPXXJTIDXFTQ-YOEHRIQHSA-N 377.485 2.582 0 50 GFAA NCc1ncc(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)c(C(F)F)n1 2325857948 VRSJXJZWPLUEQF-UHFFFAOYSA-N 378.770 2.964 0 50 GFAA COc1cc(Cl)ccc1C[C@@H](NC(=O)[C@H](CC(C)C)n1ccnc1)C(=O)O 2325876110 KVTPOULOIRCMFR-CVEARBPZSA-N 393.871 2.944 0 50 GFAA O=C(NN1C(=O)[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C1=O)c1cccnc1 840294 BLZFNNJHAMBXRO-TZWRJOPASA-N 395.418 2.619 0 50 GFAA O=C(COc1ccc2ccccc2c1)N1CCN(C(=O)c2cccnc2)CC1 893076 YUAIFVXBZCIYFO-UHFFFAOYSA-N 375.428 2.598 0 50 GFAA Cc1ccc(NC(=O)CC(=O)N2CCc3nc[nH]c3[C@@H]2c2ccccn2)cc1 55359291 PKRHMUCYBLUFRI-NRFANRHFSA-N 375.432 2.616 0 50 GFAA CCSc1nccnc1-c1noc(CCn2ncc(=O)c3ccccc32)n1 225515552 JTVUPSRDIFMQJQ-UHFFFAOYSA-N 380.433 2.591 0 50 GFAA Cc1ccc(CC(=O)N2CCN([C@H]3CCN(c4ccccc4)C3=O)CC2)s1 112623089 MRQPXVCEFXAGBC-IBGZPJMESA-N 383.517 2.549 0 50 GFAA CCCn1nc2c(c1C)[C@@H](c1ccc(OCC(N)=O)c(Cl)c1)CC(=O)N2 65406234 LFOJNLIWXBVZBM-GFCCVEGCSA-N 376.844 2.593 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN(C)Cc3ccsc3)C2=O)c1 67974535 QSSYXIQABBENID-HXUWFJFHSA-N 392.496 2.881 0 50 GFAA CN1CCNC(=O)C12CCN(c1ccnc3c(C(F)(F)F)cccc13)CC2 67881144 XEAMHGYPPGJKPI-UHFFFAOYSA-N 378.398 2.654 0 50 GFAA CC(C)Cc1noc([C@@H](C)Nc2nc(-c3cccnc3)nc3c2CCNC3)n1 67965656 CWMNPZLGNPWJKV-CYBMUJFWSA-N 379.468 2.939 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)CCC3CCCCC3)CC2)ncn1 67613890 SQZFNTDJVOMQFM-UHFFFAOYSA-N 382.512 2.980 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N1CCc2c(F)cc(F)cc21 171963755 JGEGNVFVALEHAQ-UHFFFAOYSA-N 396.397 2.940 0 50 GFAA CCOC(=O)c1ccc(-n2cc(C(=O)c3ccc(-n4ccnc4)cc3)nn2)cc1 1403869 FRFUNOOCBJGWCZ-UHFFFAOYSA-N 387.399 2.861 0 50 GFAA Cn1nc(C(=O)Nc2ccccc2)c2c1CCN(Cc1ccc(C(=O)O)cc1)C2 32919083 FHLPYIJCVKQPRA-UHFFFAOYSA-N 390.443 2.929 0 50 GFAA C[C@@H]1Cc2cc(Br)cc3c(=O)c(C(=O)NC[C@H]4CCCO4)cn1c23 33089174 YUWZOTCGDOVTOW-ZWNOBZJWSA-N 391.265 2.790 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)N4CC[C@H](N(C)C)C4)co3)ccc2s1 71747767 SFKFLKRUGPYZDF-ZDUSSCGKSA-N 386.477 2.948 0 50 GFAA O=C(c1ccc(NC(=O)N2CCC[C@H]2Cn2cncn2)cc1)N1CCCCCC1 363527778 MPXGYUTVKQMBBJ-IBGZPJMESA-N 396.495 2.991 0 50 GFAA CCCCC(=O)N1CCC(N2CCC[C@@H](C(=O)NCc3ccccn3)C2)CC1 71498269 CFASILGBFKJTOQ-GOSISDBHSA-N 386.540 2.591 0 50 GFAA CCCn1c(=O)n(CCC(=O)N2CCC[C@@H](CCC(=O)O)C2)c2ccccc21 237013520 OSUMMBLICSNKKN-INIZCTEOSA-N 387.480 2.707 0 50 GFAA CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)C1=O 239338739 LDFNPLDMEUZCKT-DDBGFLLRSA-N 389.471 2.924 0 50 GFAA Cn1cc(C(=O)NC[C@@H]2CCCN(Cc3ccco3)C2)c(=O)c2ccccc21 216208669 RLWAIOQGGHXMQS-INIZCTEOSA-N 379.460 2.774 0 50 GFAA Cc1cc(C(=O)NCCn2c(=O)[nH]c3ccccc32)nn1-c1c(F)cccc1F 240569336 GZSJTTQXFUWYMW-UHFFFAOYSA-N 397.385 2.532 0 50 GFAA CC(C)[C@@H]1CN(c2cc(N(C)C)ncn2)CCC(=O)N1Cc1ccc(F)cc1 71760203 VXPMHRLLPAWGQH-SFHVURJKSA-N 385.487 2.945 0 50 GFAA NC(=O)[C@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(F)cc1 132257252 RMSXKAKOOSFTOX-QGZVFWFLSA-N 387.411 2.969 0 50 GFAA Cc1ccc(Cn2nccc2NC(=O)Cn2nc(C)c(-c3cnn(C)c3)c2C)o1 48441256 AAVAHSIFONTKLO-UHFFFAOYSA-N 393.451 2.685 0 50 GFAA C[C@H](C1CCN(C(=O)c2ccc(N3CCCC3)cc2)CC1)N1CCN(C)CC1 82120226 ULBLEVAMUJESPA-LJQANCHMSA-N 384.568 2.775 0 50 GFAA Cn1cc(SCC(=O)N2CCCO[C@H](Cn3cccn3)C2)c2ccccc21 426388125 GXEPRCBZAAMAJX-INIZCTEOSA-N 384.505 2.785 0 50 GFAA O=C(N[C@H]1CCNC1)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 95511833 AAWJTSAONOUKKS-NRFANRHFSA-N 393.531 2.864 0 50 GFAA CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1coc(CN2CCOCC2)c1 91830366 DQQKQBHHGQQMSP-UHFFFAOYSA-N 380.448 2.570 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1C[C@@H]2CC[C@H](C1)N(CC1CCC1)C2 95388193 RIAIDWMTYISWNE-YLJYHZDGSA-N 377.492 2.875 0 50 GFAA CNC[C@H]1CCN(C(=O)c2nnn(-c3ccc(-c4ccccc4)cc3)c2C)C1 179002423 MSTTULPRZNUAHB-QGZVFWFLSA-N 375.476 2.924 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCn4cncc4C3)csc2C1 426401899 OXCBRYCDUBVAQN-UHFFFAOYSA-N 397.504 2.764 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3cnc(C)cn3)C2)c1 95496883 RCHJIYQEVGZNCT-QGZVFWFLSA-N 396.491 2.742 0 50 GFAA Cc1nc(CN2CCC(C(=O)Nc3cccc(-n4ccnn4)c3)CC2)cs1 162692542 LEQNLAPSOWVGFT-UHFFFAOYSA-N 382.493 2.883 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccn2)C3)cc1F 92107255 CDJPBMJSZCGOOA-GOEBONIOSA-N 383.423 2.606 0 50 GFAA Cc1cc(-n2nc(-c3ccncc3)nc2C[C@H]2CN(C(C)C)CCO2)ccn1 97551354 FMYUZNZANZEGRR-IBGZPJMESA-N 378.480 2.684 0 50 GFAA COCc1nnc(NC(=O)[C@H]2N3C(=O)c4ccccc4[C@@H]3SC2(C)C)s1 253414577 XWPFPLCLEDAUJE-DOMZBBRYSA-N 390.490 2.672 0 50 GFAA O=C(CN1C(=O)N[C@H](c2ccccc2)C2=C1COC2=O)NCCC1=CCCCC1 263618631 URPKOQGFFFLZLD-HXUWFJFHSA-N 395.459 2.571 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)N[C@@H](C)c1cnn(-c2ccccc2OC)c1 534657479 QLFMBHIUKMJVDF-HNNXBMFYSA-N 382.468 2.907 0 50 GFAA Cc1ccc(C)c([C@H](NC(=O)N(C)CCN2CCOCC2)c2cccnc2)c1 584893792 FVDWGBKSMJVPGJ-OAQYLSRUSA-N 382.508 2.761 0 50 GFAA COCCN1CC[C@H](CNC(=O)c2cc(OC)c(OC(C)C)cc2Cl)C1 670461235 LHTXTSVHFWQZHY-CQSZACIVSA-N 384.904 2.834 0 50 GFAA O=C(NC[C@@H]1CCCN(S(=O)(=O)c2cccnc2)C1)c1sccc1Cl 952983722 VETSFLHZJYVDKI-LBPRGKRZSA-N 399.925 2.627 0 50 GFAA CC(C)[C@H](CC(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276496863 PEEXBKYXVIASEW-OALUTQOASA-N 381.524 2.921 0 50 GFAA Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1c(C)nn(C)c1-n1cccn1 188783075 MWOVXDDIBYKEAQ-UHFFFAOYSA-N 392.463 2.615 0 50 GFAA Cc1ccc(CN2CC[C@H](NC(=O)COc3ccc4c(c3)CCC4)C2=O)cc1 191627136 IYAXXWYLLZXZQL-NRFANRHFSA-N 378.472 2.780 0 50 GFAA O=C([C@@H]1CC12CCNCC2)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704300397 SUNYOVDQUQJTBW-SFHVURJKSA-N 379.504 2.948 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)CCn3nccc3C)CC1)OCC2 1704339237 GUAIFXYJGVKZFA-UHFFFAOYSA-N 399.491 2.689 0 50 GFAA Cc1cccc(CN2C[C@H]3CN(C/C=C/c4ccc(F)cc4)C[C@@]3(CO)C2)n1 1772815914 COVCMUDJCZLBFC-VSZQMLKKSA-N 381.495 2.969 0 50 GFAA O=C(CCc1cccnc1)N1CCCN(Cc2cccc(-n3cccn3)c2)CC1 1772706039 OHCBSMYXTDYXRL-UHFFFAOYSA-N 389.503 2.934 0 50 GFAA Cc1cc(OCC(=O)N(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)ccc1Cl 5163272 ORCVDDOPLQDAAY-CQSZACIVSA-N 397.880 2.836 0 50 GFAA Cn1nccc1C(=O)NC[C@@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1 12078398 QVDHWDWYRISOSX-KRWDZBQOSA-N 386.471 2.503 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NCc1cccnc1N1CCCCCCC1 12702241 CCWMGRQDNOVTOD-UHFFFAOYSA-N 378.498 2.935 0 50 GFAA Cc1cccc(C)c1C(=O)N1CCC(N2CCC[C@H](C(=O)NC3CC3)C2)CC1 14978888 BUOVIOTZEPYDPC-SFHVURJKSA-N 383.536 2.899 0 50 GFAA C[C@@H](NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1)c1nc[nH]n1 15073653 WRJXJCBPKVJQMN-QGZVFWFLSA-N 389.503 2.694 0 50 GFAA CSCC(=O)N1CCc2c(cnc(C)c2-c2noc(CN(C)C(C)C)n2)C1 19144779 TXIIJPGGEVNIFT-UHFFFAOYSA-N 389.525 2.528 0 50 GFAA CCOc1ccccc1C(=O)N1CCC2(CC1)NC(=O)N(c1ccccc1)N2 169779840 WGQXGSUTRVRQBJ-UHFFFAOYSA-N 380.448 2.752 0 50 GFAA CCOC(=O)c1s/c(=N\c2ccc(C)cc2)n(CCN2CCOCC2)c1C 2546751 JVJAKFZVIHNNGW-MRCUWXFGSA-N 389.521 2.908 0 50 GFAA Cc1ccc(-c2nc(-c3nc4ccccn4c3C)n(C[C@@H]3COCCO3)n2)o1 1857666875 XJTMVKUVRQHIKY-OAHLLOKOSA-N 379.420 2.885 0 50 GFAA Cn1cc(CC(=O)N[C@@H]2[C@H]3CC[C@@H]2CN(C[C@@H]2CCOC2)C3)c2ccccc21 1857694783 XKEWLGLKXPKKIV-VOLVWJTLSA-N 381.520 2.584 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)CCOC21CCN(c2cnccn2)CC1 1857703212 YFVSNVMLCNMLPD-UHFFFAOYSA-N 384.505 2.889 0 50 GFAA CC1(C(=O)N2C[C@H](C(=O)O)C3(CCN(Cc4cccnc4)CC3)C2)CCCC1 1857706139 BELGMCZRQXMQBS-GOSISDBHSA-N 385.508 2.787 0 50 GFAA CO[C@@H]1CCOC[C@H]1NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857718744 QXZQKQVJBIRXDU-HZPDHXFCSA-N 393.871 2.618 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857730243 NVYMGUWNIIXDBG-NRFANRHFSA-N 389.496 2.629 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC2(CC1)C[C@@H](O)C[C@H](c1ccccc1)O2 1857731011 HQHHEZLSROHMAR-RBUKOAKNSA-N 381.476 2.981 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)Nc2c(C)ccn(C)c2=O)cc1Cl 126381987 ANALGKBFVPIKPD-UHFFFAOYSA-N 377.249 2.810 0 50 GFAA CN1CCN(C(=O)c2ccc(CNC(=O)c3ccc(F)c(Cl)c3)cc2)CC1 486828219 TUNVPEIUSBFMGO-UHFFFAOYSA-N 389.858 2.797 0 50 GFAA Cc1ccc2occ(CC(=O)N3C[C@@H](C(=O)O)C[C@H](c4cnn(C)c4)C3)c2c1 902496860 YJPFKVVCGDJLNC-GJZGRUSLSA-N 381.432 2.734 0 50 GFAA Cc1cccc(CC(=O)N2C[C@H](C(=O)O)C[C@H](c3cnn(C)c3)C2)c1Cl 868457654 ZVTGYBJDRMBQGV-LSDHHAIUSA-N 375.856 2.641 0 50 GFAA CCOc1ccc([C@H]2CCCN2C(=O)COC(=O)c2ccc3cnnn3c2)cc1 1875295715 OOYXDWBABAGEAE-LJQANCHMSA-N 394.431 2.649 0 50 GFAA Cc1cccc([C@H](CNC(=O)[C@@H]2CCCC23CCNCC3)N2CCOCC2)c1 1875277118 IUTCGYYBVDAXGL-SFTDATJTSA-N 385.552 2.654 0 50 GFAA NC(=O)CO[C@@H]1CCN(C(=O)N[C@H](CCc2ccc(F)cc2)c2ccccc2)C1 1875304275 FVTJZRZZDCPQQM-WOJBJXKFSA-N 399.466 2.785 0 50 GFAA CC[C@H](O)[C@H](C)C(=O)N[C@H](CNC(=O)[C@H](C)c1ccco1)C1CCCCC1 1875344653 OIEDRSZWDYQWMF-IDCNUPLLSA-N 378.513 2.971 0 50 GFAA Cc1c([C@@H]2[C@@H](C(=O)N3CC(c4ccc(F)cc4)C3)CC(=O)N2C2CC2)cnn1C 888100701 ICCABVQYJQQIIN-RXVVDRJESA-N 396.466 2.546 0 50 GFAA CCOC(=O)C1([C@@H](C)NC(=O)[C@@H]2CC[C@H](C(=O)OC(C)(C)C)C2)CCOCC1 888337498 AERTWQVGDAHKDM-OAGGEKHMSA-N 397.512 2.609 0 50 GFAA CCCCOCC(=O)NC[C@H]1CN(C(=O)c2occc2C)C[C@H]1C(F)(F)F 1775989240 HVOCDMKOHIQHQS-UONOGXRCSA-N 390.402 2.771 0 50 GFAA Cc1ccccc1-n1cc(CN(C)C(=O)CCC[C@@H]2NC[C@@H]3CNC[C@H]2C3)cn1 2100482962 IZYNRQBYLLYYOD-TYPHKJRUSA-N 395.551 2.507 0 50 GFAA CCS(=O)(=O)c1ccc(CN2C(=O)CCN(C[C@@]34CCC[C@@H]3C4)C2=O)cc1 2325779804 DKWZMKWCDBOHTM-UZLBHIALSA-N 390.505 2.825 0 50 GFAA CN(C)c1ncnc2cc(C(=O)N3CC[C@](N)(c4cccc(F)c4)C3)ccc12 2325796366 LDIHXJJHKRANFH-OAQYLSRUSA-N 379.439 2.535 0 50 GFAA Cc1nnc([C@H](C)N2CCC[C@@](C)(CNC(=O)c3nccc4[nH]ccc34)C2)o1 2325812129 VJMZPIMTRFQTDW-RBZFPXEDSA-N 382.468 2.847 0 50 GFAA CCOc1cc2ccccc2cc1C(=O)Nc1cnc(N2CCNCC2)cn1 2325859784 KKTWLBYROVHVPA-UHFFFAOYSA-N 377.448 2.690 0 50 GFAA CCN(CCCOCc1ccccc1)C(=O)Cn1nc(O)c2ccccc2c1=O 2325864615 UEFHQTFYZUSETL-UHFFFAOYSA-N 395.459 2.558 0 50 GFAA O=C(c1ccccc1)N1CCN(C(=O)c2ccc(Br)c(O)c2)CC1 132833910 GHJGUBMUIWCJBC-UHFFFAOYSA-N 389.249 2.753 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c(OC)c1 2356143709 SYCIPNUYJJLYNP-QFIPXVFZSA-N 396.491 2.680 0 50 GFAA COC(=O)c1coc(CN2CCC[C@]23CCCN(c2ccc(C)cc2)C3=O)n1 2356153013 MXSQOPLJPGDBAG-OAQYLSRUSA-N 383.448 2.931 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(C)cc2)CN1Cc1c(F)cccc1F 55036757 KMEIXRVZZDGQDS-BEFAXECRSA-N 388.414 2.819 0 50 GFAA COc1ccc(C2=NO[C@H](CNC(=O)c3cnn(-c4ccccc4)c3)C2)cc1 225768753 IZVBAMLXABFNPT-IBGZPJMESA-N 376.416 2.804 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)C[C@H]2CCO)cc1C 104551681 CHMMNXLHWLVRNA-JOCHJYFZSA-N 389.584 2.745 0 50 GFAA O=C(c1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3cnccn3)CC2)C1 67787033 AZZKQRQNIZSCMG-GOSISDBHSA-N 378.476 2.676 0 50 GFAA CC(C)c1ccc(NC(=O)CSc2nnc(CN3CCOCC3)n2C)cc1 20029312 ICWPUNAVKYBGBL-UHFFFAOYSA-N 389.525 2.502 0 50 GFAA Cc1oc(C)c(C(=O)O[C@H](C)C(=O)N2C[C@H](C)O[C@@H](C)C2)c1Br 229730619 ZAGCLOIJYNRPCE-HOTUBEGUSA-N 388.258 2.840 0 50 GFAA C[C@@H](C1CCN(C(=O)c2c[nH]nc2-c2ccccc2)CC1)N1CCN(C)CC1 77321344 GUGHMTJHGDCWKF-KRWDZBQOSA-N 381.524 2.565 0 50 GFAA Cn1cc([C@@H]2CCN(C(=O)NC3CCN(CCc4ccccc4)CC3)C2)cn1 172113446 AKKSJEWHWFPYSK-LJQANCHMSA-N 381.524 2.626 0 50 GFAA O=S(=O)(c1cc(Cl)cc2c1OCC2)N1C[C@H](CO)[C@H](c2ccsc2)C1 328615720 YXHARBWHWOJXQX-HIFRSBDPSA-N 399.921 2.733 0 50 GFAA CC(C)(O)[C@@H]1CCCN1c1nc2c(c(N3CCC[C@H]3C(C)(C)O)n1)SCC2 328852003 ZWKFAEUMRSCVGS-GJZGRUSLSA-N 392.569 2.604 0 50 GFAA C[C@H](CCNC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[S@@](C)=O 477194389 PBMHFVGDZDCTHI-QFDBLCPBSA-N 391.459 2.740 0 50 GFAA CC(C)(C)CN1C[C@]23C=C[C@H](O2)[C@H](C(=O)N2CCc4ccc(F)cc4C2)[C@H]3C1=O 77505892 PYEMTYMZCINUMD-KGYLXKDPSA-N 398.478 2.539 0 50 GFAA Cc1cc(NC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc(N2CCN(C)CC2)c1 241653356 PULFKLCKXJDOFI-OAHLLOKOSA-N 399.461 2.505 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)c2c(C)noc2n1 130682129 LZOCBDDFPCYQNJ-OAHLLOKOSA-N 382.395 2.904 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 376819362 NDTIEMIWGOWJPD-QRVBRYPASA-N 390.447 2.699 0 50 GFAA O[C@H](COc1cccc(CNC2CCOCC2)c1)CN1CCc2ccccc2C1 14950927 DUHOQBOHBJTLMU-QHCPKHFHSA-N 396.531 2.753 0 50 GFAA CS(=O)(=O)Cc1ccccc1NC(=O)NC1CCN(C2CCCC2)CC1 175292867 SMTLCIZCLIUFAL-UHFFFAOYSA-N 379.526 2.760 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)N(CC)C(=O)N[C@H]1c1ccccc1 20045794 URTRDOCGVZYUSW-SFHVURJKSA-N 389.521 2.639 0 50 GFAA COc1cccc(-n2cc(CNC(=O)N(C)CCN3CCCCCC3)cn2)c1 426545049 KQUFLQKXCYOWQN-UHFFFAOYSA-N 385.512 2.898 0 50 GFAA Cc1ccc(C(=O)N2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)cc1 96154072 SDSZKOONPFILCA-UHFFFAOYSA-N 378.480 2.697 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3cnc(N)nc3-c3ccccc3)CC2)nc1 97604246 DZOAMEGGJXCFIB-UHFFFAOYSA-N 389.459 2.553 0 50 GFAA Cc1c(C(=O)NC[C@H]2CCOc3ccccc3C2)sc2ncn(C)c(=O)c12 95385330 WCCCHRJRHRGGPW-ZDUSSCGKSA-N 383.473 2.675 0 50 GFAA CN(Cc1nc2ncccn2n1)C[C@H]1CCCN(CCc2ccccc2F)C1 95523472 NCQNYNJNUWCELB-QGZVFWFLSA-N 382.487 2.650 0 50 GFAA CC1(C)CC(n2cc(-c3cnc(NC[C@H]4CCCO4)nc3)nn2)CC(C)(C)N1 91693589 PCMWKOXQGGTLBO-MRXNPFEDSA-N 385.516 2.808 0 50 GFAA COc1cccc(-c2cc(CNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)no2)c1 91425018 QTNOGKWIMDUYRU-OAHLLOKOSA-N 383.448 2.758 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)nc(N)n1 244796017 RRKNUJNFBCYIGW-UHFFFAOYSA-N 382.493 2.754 0 50 GFAA Cc1noc([C@@H]2CCCCN2C(=O)c2cccc(-c3ccc(=O)n(C)n3)c2)n1 534664715 FCQDLIHIOSXHMH-KRWDZBQOSA-N 379.420 2.506 0 50 GFAA O=C(CC1(n2cccc2)CCOCC1)N1CCN(CCOc2ccccc2)CC1 263588536 VKJJDHRFLIWIKY-UHFFFAOYSA-N 397.519 2.607 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCc4ccc(F)cc4)c3CO2)cc1 263618539 UGLOYGIVNKPXLY-GOSISDBHSA-N 382.395 2.627 0 50 GFAA COc1cc(F)c(-c2cccc(C(=O)NCCN3CCOCC3)c2)cc1F 299796718 PHWVXNJIBWCCTA-UHFFFAOYSA-N 376.403 2.702 0 50 GFAA CN(C)C[C@@H]1COCCN(C(=O)c2cccc(N3Cc4ccccc4C3)c2)C1 299789518 WJGNUUFQZWVMDX-SFHVURJKSA-N 379.504 2.857 0 50 GFAA O=C1NC[C@@]2(CCCN(C(=O)NCCCSCc3ccccc3)CC2)O1 584888409 FRYIGORHANVQQS-IBGZPJMESA-N 377.510 2.984 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)C)C(C)C)[C@H]1Oc1ccccc1 409948581 BSSGKOHVPZVPCR-ZSYWTGECSA-N 390.524 2.915 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)Cc2csc3nccn23)C1 170669723 JENPHWRAIJHQFZ-ZDUSSCGKSA-N 378.498 2.796 0 50 GFAA COc1ccc(C(=O)NC[C@H]2CCCN(c3nc(C)cnc3C)C2)c(OC)c1 1506416533 JZAURSLSERUJOP-MRXNPFEDSA-N 384.480 2.757 0 50 GFAA O=C(CN(c1ccccc1)S(=O)(=O)c1ccc(F)cc1)NCc1ccncc1 1064107 LYIGPPIFTSMQAQ-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA COc1ccc(OCc2nnc(SCC(=O)Nc3cccc(C)c3)n2N)cc1 807953 ZOIKZOTYWMZSNE-UHFFFAOYSA-N 399.476 2.619 0 50 GFAA C[C@H](CN1CCc2nnc(CCNC(=O)c3ccoc3)n2CC1)c1ccccc1 12002408 FSMXPQYXAAULFD-QGZVFWFLSA-N 393.491 2.505 0 50 GFAA O=C(c1cc(COc2ccc3c(c2)OCO3)[nH]n1)N1CCc2ccccc2C1 12316969 MMHFYCQBMCRLEH-UHFFFAOYSA-N 377.400 2.916 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)c1ccc(Cl)cc1Cl 19924272 TWQYFHLGSGMVEH-UHFFFAOYSA-N 377.235 2.811 0 50 GFAA CCOc1ccccc1N1CCN(S(=O)(=O)c2cc(C)ccc2OC)CC1 2982528 HEYCRCGXZANZHI-UHFFFAOYSA-N 390.505 2.913 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)N1CC[C@H]2C[C@@H]2C1 1857527650 ZSAJVIGHSYXNOV-YWPYICTPSA-N 383.370 2.742 0 50 GFAA O=C1CC2(CCN(Cc3cccc(O)c3)CC2)OCCN1C[C@@H]1CCCCO1 1857685900 ZJNQHOZFMPXJQH-FQEVSTJZSA-N 388.508 2.545 0 50 GFAA O=C(Cn1ccc2ccccc21)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857724873 QOUSTRBOAOFFRG-RZUBCFFCSA-N 375.472 2.972 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cc(=O)c4ccccc4o3)C1)CC2 1857731314 PKACOCIICKKIPQ-QFIPXVFZSA-N 391.427 2.717 0 50 GFAA Cc1cccc2nc(C(=O)N3CC[C@H](c4ccc5c(c4)OCO5)[C@@H](O)C3)c(F)n12 210066379 VTMUMGAOVYVFFD-CABCVRRESA-N 397.406 2.501 0 50 GFAA O=C(O)[C@H]1CN(C(=O)CCc2n[nH]c3c2CCCC3)C[C@@H]1c1ccc(F)cc1 216836001 QKLABPVKJNWNFT-SJORKVTESA-N 385.439 2.687 0 50 GFAA O=C(O)CCN(C(=O)Cc1ccc(OC(F)(F)F)cc1)C1CCOCC1 408513367 ZALVHNSPLUSCAE-UHFFFAOYSA-N 375.343 2.610 0 50 GFAA COc1ccc(-c2c(C)nn3c(N4CCN(C)CC4)cc(C)nc23)cc1OC 5241133 QQSWFQDSGSIMIS-UHFFFAOYSA-N 381.480 2.782 0 50 GFAA CC(C)Cn1nc(C(=O)NCc2cccnc2)c2c1CCN([C@H]1CCSC1)C2 19745979 UHQHRHRVPXHPMC-KRWDZBQOSA-N 399.564 2.728 0 50 GFAA COc1cccc(CNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)c1 35310550 QEOBPALCHUMXMN-ICPLQIHGSA-N 391.471 2.643 0 50 GFAA O=C(CCCn1c(O)nnc1O)N1CCC[C@H]1c1ccccc1Br 906954297 KQQUZNQFQULXRR-ZDUSSCGKSA-N 395.257 2.596 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@H]12 910239210 FMOPREHMNBKVJJ-KLHDSHLOSA-N 385.382 2.711 0 50 GFAA Cc1ccc(N2CC[C@@H](NC(=O)c3ccc4c(c3)[C@H](CN)CCC4)C2=O)cc1 851626640 FUKADRUAXVRWGN-GHTZIAJQSA-N 377.488 2.909 0 50 GFAA CN1CCc2[nH]c3ccc(C(=O)Nc4cc(S(C)(=O)=O)ccc4O)cc3c2C1 952886729 HMSYRZIJAJGZGV-UHFFFAOYSA-N 399.472 2.517 0 50 GFAA O=C(NCCCCc1ccccc1)[C@H]1CCCN1S(=O)(=O)c1ccccc1 2999450 VYSMTOZAAFQCCN-HXUWFJFHSA-N 386.517 2.979 0 50 GFAA COc1ccc([C@H]2CCN(C(=O)CN3C(=O)CCCc4ccccc43)C2)cn1 2325750878 QCLJRVMZBPMIIN-SFHVURJKSA-N 379.460 2.776 0 50 GFAA CCOC(=O)c1cnc(CNc2ccc(CCN3CCOCC3)cc2)s1 2325761960 KKNIXWCAUXHEFN-UHFFFAOYSA-N 375.494 2.807 0 50 GFAA O=C(C[C@@H]1CN(CC2CC=CC2)C2(CCC2)CO1)NC[C@@H]1CCCc2nccn21 2325785252 MACVGBYORCFCTO-VQTJNVASSA-N 398.551 2.857 0 50 GFAA COc1ccccc1[C@H](CNc1ncc(F)cn1)NC(=O)CC1(OC)CCC1 2325793025 CNWZAUWDRHEBCG-INIZCTEOSA-N 388.443 2.853 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC2=NC[C@@H]3CC[C@@H](C)CN23)cc1 2325863705 ULYWITCEURDXOG-RYRKJORJSA-N 392.569 2.838 0 50 GFAA Cc1ccc([C@H](CC(=O)O)NC(=O)c2nn(-c3ccccc3F)ccc2=O)cc1 2325876789 BLXFOAZWWPHBDW-INIZCTEOSA-N 395.390 2.626 0 50 GFAA Cc1c(C(=O)NCc2ccc(S(N)(=O)=O)cc2)oc2ccc(Cl)cc12 1051680 YLMYLOXWRQSETH-UHFFFAOYSA-N 378.837 2.972 0 50 GFAA COC(=O)CCC(=O)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67907878 HAQQIUSARGABHJ-UHFFFAOYSA-N 390.823 2.782 0 50 GFAA O=C(c1ccc(NC[C@@H]2CCCOC2)nc1)N1CCC(Cn2cccn2)CC1 20912406 USCQENCKLZQIMR-SFHVURJKSA-N 383.496 2.669 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CC[C@@H](c2ccnc(-c3ccccc3)c2)C1 65508914 ZCTOXKVNEVPFTR-LJQANCHMSA-N 384.501 2.889 0 50 GFAA Cc1cc(N2CCN(C(=O)Nc3ccccc3F)CC2)nc(N2CCCC2)n1 64800348 QTVXEOBOHXQTMX-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA CCc1cc(CNC(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)on1 12299032 CVEWFUIBMFEUFC-UHFFFAOYSA-N 397.475 2.947 0 50 GFAA Cc1nc(C)n(C[C@@H](C)C(=O)N2CCc3[nH]nc(-c4ccccc4F)c3C2)n1 67965410 QEIIFFZWQLKQCX-GFCCVEGCSA-N 382.443 2.645 0 50 GFAA Cn1cc(-c2csc(CNc3ccc(CC(=O)N4CCOCC4)cc3)n2)cn1 252570398 WQYQLXSAQVIJAX-UHFFFAOYSA-N 397.504 2.557 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)NCCc3cc4ccccc4[nH]3)CC2=O)cc1 119931414 AHWLVUMEPKHXKE-INIZCTEOSA-N 377.444 2.888 0 50 GFAA CCc1nn(C)c(OC)c1CN(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1 328628248 HBICZMAVDWUKAZ-OXJNMPFZSA-N 388.560 2.630 0 50 GFAA Cc1ccccc1CNC(=O)CN1C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]1C 230109616 KNNXOVNYLSQPBB-IAGOWNOFSA-N 375.513 2.846 0 50 GFAA CON1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 216048742 MIUSIGVYOUEARI-NACLEJNASA-N 399.872 2.995 0 50 GFAA CCOC(=O)c1nn(Cc2cccc(OC)c2)c2c1CN(C(=O)C(C)C)CC2 14534214 LJDWUVWCPQKBNO-UHFFFAOYSA-N 385.464 2.657 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(Cc3ccc(O)c(Cl)c3)CC2)CN1C(=O)C1CC1 72470745 FORWFIRDXDRKDI-INIZCTEOSA-N 392.883 2.723 0 50 GFAA O=C(CN1CCOC[C@H]1c1nc(-c2cccs2)no1)N1CCc2ccccc21 366901381 QVPRDQCQGCJACT-INIZCTEOSA-N 396.472 2.761 0 50 GFAA CCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1ccc(Cl)c2ncccc12 157050047 TVCAKXVTTWCKFK-ZDUSSCGKSA-N 391.884 2.856 0 50 GFAA CNC(=O)[C@@H]1CCCCN1CC(=O)Nc1ncc(Cc2cccc(C)c2)s1 173207125 XUFOATWRQQLHJX-KRWDZBQOSA-N 386.521 2.581 0 50 GFAA CCCSc1ncc(CN2CCC[C@H](c3nnc(CN(C)C)n3C)C2)cn1 72480769 HQBYYRPINCIJKP-INIZCTEOSA-N 389.573 2.548 0 50 GFAA O=C(CCn1cnc2ccccc21)NC[C@@H]1CN(Cc2ccccc2)CCCO1 192229624 JDYXIHHZNFUUPK-HXUWFJFHSA-N 392.503 2.834 0 50 GFAA O=C1Cc2cc(S(=O)(=O)Nc3cccc(-c4noc(C5CC5)n4)c3)ccc2N1 176206395 JWKNGYJRZNASON-UHFFFAOYSA-N 396.428 2.909 0 50 GFAA Cn1cnc2c(C(=O)N3C[C@@H](COc4ccccc4)OC(C)(C)C3)ccnc21 288023111 NALRWGVTVYFKLB-INIZCTEOSA-N 380.448 2.667 0 50 GFAA O=C1[C@H](N2CCCN(c3nccs3)CC2)CCN1c1c(F)cccc1F 176923261 RPQXGNVUCRWVDW-OAHLLOKOSA-N 378.448 2.739 0 50 GFAA O=C(c1ccccc1)[C@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 82126125 XMORHRCGZCZHHF-SFHVURJKSA-N 382.460 2.847 0 50 GFAA O=C(Nc1cccc(-n2cnnc2)c1)N(Cc1ccccn1)C[C@@H]1CCCO1 97743204 DFDGOKHNFGYKGJ-IBGZPJMESA-N 378.436 2.875 0 50 GFAA COc1cc2c(cc1-c1cn(C3CCN(Cc4ccccn4)CC3)nn1)OCO2 91656581 WJAFRZRQXKUNDU-UHFFFAOYSA-N 393.447 2.915 0 50 GFAA CCc1nccn1CCC(=O)N1CCC[C@@H](CNC(=O)c2ccc(F)cc2)C1 95511413 ZDOBEYRWMBSKCJ-INIZCTEOSA-N 386.471 2.643 0 50 GFAA Cc1nnnn1-c1cccc(C(=O)N2CCC[C@@H](c3nccn3C(C)C)C2)c1 95522120 QJMQUVXORVXSOI-QGZVFWFLSA-N 379.468 2.768 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(C(=O)c2ccn(C(C)(C)C)c2)C1 95384087 WLVIUQKKBDUPIM-MRXNPFEDSA-N 395.511 2.636 0 50 GFAA O=C(c1c(F)cccc1Cl)N1C[C@@H]2CN(C3CCCC3)C[C@]2(C(=O)O)C1 96150779 DAHNUGIALDZKML-BUXKBTBVSA-N 380.847 2.880 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)[C@H](O)c2ccccc2F)C3)c1 96166520 PIBJXEKZQGUFOE-LJQANCHMSA-N 381.407 2.843 0 50 GFAA Cc1ncncc1C(=O)N1CCC[C@@H](CCC(=O)NCc2ccccc2F)C1 95518684 DVVXVNWIBVDSAS-INIZCTEOSA-N 384.455 2.873 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](CNC(=O)Nc2ccc(-c3ccco3)cc2)C1 96140577 GXOIDOOZBWJVQV-AWEZNQCLSA-N 377.466 2.740 0 50 GFAA COCCN(Cc1ccsc1)C(=O)Nc1cc(-c2nnn(C)n2)ccc1C 96153941 PGVOTBFNXUHJEZ-UHFFFAOYSA-N 386.481 2.928 0 50 GFAA CC(C)=CCN1C[C@H](NC(=O)c2ccc(C)c(F)c2)C[C@H]1C(=O)NC(C)C 96132589 ATVIGQPCXNYSHQ-MJGOQNOKSA-N 375.488 2.798 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)C3(c4ccccc4)CCCC3)C2)CN1CCO 91998050 DENUQADBKXCHRV-QFIPXVFZSA-N 384.520 2.722 0 50 GFAA Cc1cccc2ncc(C(=O)NCCN3CCC[C@@H](c4ccccc4)C3)c(=O)n12 97301388 UUOVRPMGZTVZAW-LJQANCHMSA-N 390.487 2.612 0 50 GFAA CC(C)c1nccn1[C@H](C)C(=O)N1CCc2nnc(-c3ccccc3)n2CC1 95523362 IBJFFLWJFVGKAT-MRXNPFEDSA-N 378.480 2.911 0 50 GFAA O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCCN(c2ccccc2)CC1 95505836 PVAVZNCKGDQECK-UHFFFAOYSA-N 379.382 2.606 0 50 GFAA Cc1ccc(C)c(-n2nc(-c3ccncc3)nc2C[C@H]2CN(C)CCN2C)c1 96153194 WJYXYLVGOFVFNY-IBGZPJMESA-N 376.508 2.734 0 50 GFAA NC(=O)c1cccc2c1CCCN2CC(=O)Nc1ccc(N2CCCCC2)nc1 182524581 LKTJJHIEQHHIBY-UHFFFAOYSA-N 393.491 2.562 0 50 GFAA O=C(O)C[C@@H](NC(=O)CN1C(=O)CSc2ccccc21)c1cccs1 299739690 ABDBDQAIGRLZFD-LLVKDONJSA-N 376.459 2.519 0 50 GFAA C[C@H](c1cnn(C)c1)N(C)C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 182730140 PHLMSTDZUMJRMM-CYBMUJFWSA-N 399.520 2.680 0 50 GFAA COC(=O)c1cn(CCC(=O)Nc2ccc3ccccc3c2)cc2c(=O)[nH]nc1-2 263588330 RXJXEJMXGRPHIQ-UHFFFAOYSA-N 390.399 2.645 0 50 GFAA COc1cccc(CNC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)c1 263619197 XKXIFXUAHSTNBB-SFHVURJKSA-N 382.395 2.627 0 50 GFAA COC[C@H](NC(=O)N(C)CCc1nc2ccc(Cl)cc2[nH]1)c1ccnn1C 534634363 ZPWNAMRYROBWIC-HNNXBMFYSA-N 390.875 2.521 0 50 GFAA COc1ccc([C@H](O)Cn2cc(C(=O)NCc3cccc(Cl)c3)nn2)cc1 1775973243 NQSVRXRVXMUXHU-GOSISDBHSA-N 386.839 2.604 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCC(Oc4cccnc4)CC3)c2)nn1C 299793596 HWPLOSGNOXZLNS-UHFFFAOYSA-N 377.448 2.869 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)NC[C@H]1Cc2cccc(-c3ncccn3)c2O1 299781843 UWZHYWBZRPVCOJ-MRXNPFEDSA-N 377.448 2.536 0 50 GFAA O=C([C@@H]1CCCCn2nnnc21)N1CCC(Oc2cccc(Cl)c2)CC1 299783828 VBXQSJBYXWTLJE-MRXNPFEDSA-N 375.860 2.664 0 50 GFAA COc1cc(C)c(S(=O)(=O)N[C@@H]2CCCN(C(=O)C(C)C)C2)c(C)c1C 824539692 QVZAYZWXVJRJFE-MRXNPFEDSA-N 382.526 2.546 0 50 GFAA O=S(=O)(c1ccccc1)n1c(CN[C@@H]2C[C@H]3CC[C@@H]2O3)cc2cccnc21 1335074347 YGDKFYBJKXWMQH-QRQLOZEOSA-N 383.473 2.683 0 50 GFAA CCc1nnc(N2CCC(CNC(=O)c3nn(C)c4ccccc34)CC2)s1 952979519 IXHZVLBVOIEVQM-UHFFFAOYSA-N 384.509 2.634 0 50 GFAA O=C(Nc1cccc(CN2CCCC2)c1)[C@@H]1CC(=O)N(Cc2cccnc2)C1 952972175 WMKCKPDCHFLOPT-LJQANCHMSA-N 378.476 2.665 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1ccc(CO)cc1)c1cc2ccccc2cn1 1565525372 VRLNDLOUVHMIDA-FPOVZHCZSA-N 378.428 2.693 0 50 GFAA COc1ccnc(N2CCN(Cc3ccn(-c4ccc(F)cc4F)n3)CC2)c1 190217246 XFIBOPSFFZTFTH-UHFFFAOYSA-N 385.418 2.876 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cccs1 788418508 ZZHRNNIQDDDZHB-JTQLQIEISA-N 389.882 2.934 0 50 GFAA COCCN1C[C@H](CNC2CCN(c3ccc(C)c(Cl)c3)CC2)CC1=O 1506411001 GUXMCFHLFOVSHU-INIZCTEOSA-N 379.932 2.702 0 50 GFAA c1cc2c(cc1-c1n[nH]cc1CN1CCC(N3CCSCC3)CC1)OCO2 12300091 HDWGPXCNHWHXMA-UHFFFAOYSA-N 386.521 2.819 0 50 GFAA Cc1c[nH]c(C(=O)N2CC[C@@]3(CCCN(Cc4ccc(F)c(F)c4)C3=O)C2)n1 12446348 REYUBJHUZHMUKA-FQEVSTJZSA-N 388.418 2.651 0 50 GFAA O=C(CCc1cnccn1)N1CCO[C@@H](Cc2cccc(C(F)(F)F)c2)C1 12578061 VJPUCWXOBJQBEW-KRWDZBQOSA-N 379.382 2.898 0 50 GFAA CC[C@H](C(=O)NCc1ccccn1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712270 ZFTLRCPCSUONIH-MRXNPFEDSA-N 381.885 2.596 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@H]2[C@@H]1c2cc3c(cc2CCN1C)OCO3 19703148 JZUTXVTYJDCMDU-RBUKOAKNSA-N 383.400 2.873 0 50 GFAA biogenic,in-vitro COc1ccc(CCN(C)[C@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1OC 19807935 WGGZYHVAZPZHQG-KRWDZBQOSA-N 386.423 2.649 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cc(C)cc(C)c4)nnc3c2)n1 169776187 WDECKGSOWFKEAE-UHFFFAOYSA-N 376.420 2.889 0 50 GFAA CCOC(=O)c1ccc(CNC(=O)CSc2nnc(-c3ccncc3)o2)cc1 1472268 XEIVXYKEKFHHCB-UHFFFAOYSA-N 398.444 2.717 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccc(Cn3ccnc3)o2)[C@H]1c1ccccc1 1857683075 AZZXOKRORWKGJP-SFTDATJTSA-N 394.475 2.668 0 50 GFAA O=C(O)[C@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc(Cl)s1)CC2 1857689674 UXUUJLUWXHQBRE-CQSZACIVSA-N 394.928 2.923 0 50 GFAA CC(C)CN1CCOC2(CCN(C(=O)c3ccc(Cl)cn3)CC2)CC1=O 1857707219 JDDCVZXFGIVJNR-UHFFFAOYSA-N 379.888 2.615 0 50 GFAA Cc1cccc(-n2nc(-c3ccc(C)nn3)nc2[C@H]2CC[C@H]3OCCN[C@@H]3C2)c1 1857712889 VYXCWFGOCHARNI-PWIZWCRZSA-N 390.491 2.966 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NCc3ccc(F)c(Cl)c3)CC2=O)s1 1857724783 CPECYTURPQLAND-JTQLQIEISA-N 382.848 2.562 0 50 GFAA O=C(N[C@H]1CCC[C@H]1CO)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857739563 VWLREMPRZAVXCP-ZFWWWQNUSA-N 377.872 2.975 0 50 GFAA CCCCN1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NCCn2cncn2)C1 1875244424 JQRGXMBJLBYOET-JOCHJYFZSA-N 395.555 2.559 0 50 GFAA CCCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 247981896 XKKYCIFJNFUUPQ-MSOLQXFVSA-N 378.476 2.925 0 50 GFAA CCc1ccc([C@@H]2CNCCN2C(=O)c2nc(-c3cnn(C)c3)oc2C)cc1 261681342 IKLXASYZFHHUDM-SFHVURJKSA-N 379.464 2.733 0 50 GFAA Cn1nnc2c1C[C@@H](C(=O)N1CCN(c3c(Cl)cccc3Cl)CC1)CC2 377984887 MKTAYTGSYMIAKG-LBPRGKRZSA-N 394.306 2.576 0 50 GFAA O=C1CCCN1CC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704306018 ZFDJBAHNPCTUPH-QHCPKHFHSA-N 390.487 2.572 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1sccc1F 815998059 DISZNKJZPOEOEA-UHFFFAOYSA-N 393.845 2.685 0 50 GFAA C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cc(C(F)(F)F)n(C)n1 1875276062 IUVRIJAJIRIFJW-SNVBAGLBSA-N 379.342 2.850 0 50 GFAA Cn1c([C@H](O)C2CC2)nnc1N1CCCN(Cc2ccccc2)CC(F)(F)C1 1875392362 CVXPZNVBSBYFLO-QGZVFWFLSA-N 391.466 2.606 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)N2CC3(CCCCC3)C[C@@H]2C(=O)OC)c1 1875370212 GFARSJGLOMKTTR-MRXNPFEDSA-N 386.448 2.855 0 50 GFAA O=C(CNC(=O)c1ccccc1)OCC(=O)c1ccc(Br)cc1 1598714 WAZLICIMDYSWGL-UHFFFAOYSA-N 376.206 2.605 0 50 GFAA O=C(O)COc1ccc(NC(=O)COc2ccc(Br)cc2)cc1 2837058 QPWAYOOEIVLBJJ-UHFFFAOYSA-N 380.194 2.930 0 50 GFAA O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)NCc1ccccc1 4327731 DVQWAHLVEQYUNF-UHFFFAOYSA-N 376.445 2.595 0 50 GFAA CCOc1cc(-c2noc(CCCC(=O)NC[C@H]3CCCO3)n2)ccc1OC 4868167 DKZYBZBRSFHANI-OAHLLOKOSA-N 389.452 2.762 0 50 GFAA Cc1nn(Cc2ccccc2F)c(C)c1NS(=O)(=O)c1c(C)n[nH]c1C 2804560 OLWPRPNYJBDKEB-UHFFFAOYSA-N 377.445 2.828 0 50 GFAA Cc1ccccc1[C@@H]1CC(=O)c2c(C)nc(NCCN3CCOCC3)nc2C1 20101128 KBAODRCBGKUVTE-KRWDZBQOSA-N 380.492 2.750 0 50 GFAA COc1cc(OC)cc([C@H]2CC(c3ccccc3OC)=NN2S(C)(=O)=O)c1 225495854 OILFGJPGDLQGQR-GOSISDBHSA-N 390.461 2.823 0 50 GFAA CN(Cc1nc2ccccc2[nH]1)C[C@@]1(O)CCCN(CC2CCCCC2)C1=O 53523811 RPXQREWGGHHZFA-QFIPXVFZSA-N 384.524 2.929 0 50 GFAA c1ccc(N2CCN(Cc3nnc4sc(-c5ccncc5)nn34)CC2)cc1 65362050 SHWWTTAVERXREE-UHFFFAOYSA-N 377.477 2.570 0 50 GFAA O=C(c1cc2n(n1)CCCN(Cc1cccc3nsnc13)C2)N1CCCC1 65375849 UCQSBFJAZPUZCA-UHFFFAOYSA-N 382.493 2.530 0 50 GFAA O=C(CCC1CCN(C(=O)c2[nH]nc3c2CCCC3)CC1)NCc1cccnc1 23215123 GSOXKRWZKFHVEN-UHFFFAOYSA-N 395.507 2.632 0 50 GFAA CN(Cc1cc(C2CC2)[nH]n1)C(=O)c1cc(Cn2cnc3ccccc32)on1 67513933 PEJMLQPXNWKORP-UHFFFAOYSA-N 376.420 2.945 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2CCCOCC2)Cc2ccccc2C1 72167825 LVPJQLSOKPHQPB-UHFFFAOYSA-N 378.516 2.947 0 50 GFAA O=C(Nc1ccccc1Oc1cccc(F)c1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252519098 AXNYTEOMOKJDAQ-OAHLLOKOSA-N 394.406 2.953 0 50 GFAA O=C(NC(=S)Nc1ccc(I)cn1)c1ccccc1 1389482 QFCKEIWBBNTIDP-UHFFFAOYSA-N 383.214 2.813 0 50 GFAA Cn1cc2c(n1)CCC[C@@H]2C(=O)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 329817100 FFKVFWPUVUCSMC-CVEARBPZSA-N 382.512 2.564 0 50 GFAA Cc1c(C(C)C)c(=O)n(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)n1C 1423907 MZXCQGFZIAGBLN-UHFFFAOYSA-N 377.510 2.782 0 50 GFAA Cc1cc(F)cc(S(=O)(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)c1 328617242 CNWXLGQVIFDBPE-NSHDSACASA-N 391.390 2.890 0 50 GFAA Cc1nn(C)c(Oc2cccnc2)c1CN1CCN(c2ccccc2O)CC1 158561066 SDHNDBVSIYQMDD-UHFFFAOYSA-N 379.464 2.944 0 50 GFAA C[C@@H](NC(=O)c1cc(C(=O)O)nn1-c1ccccc1)[C@H]1COc2ccccc21 237494258 WRZUACKPQQCZIU-CZUORRHYSA-N 377.400 2.865 0 50 GFAA Cc1c(C(=O)N2CCO[C@@H](CC(=O)O)C2)cnn1-c1cccc(C(F)(F)F)c1 237760279 KESTUDJPQXXUCF-AWEZNQCLSA-N 397.353 2.515 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1cc(Cl)cc(Cl)c1)CCN2CC1CC1 72456712 RXNFZXMCCSDUOH-SJORKVTESA-N 389.348 2.687 0 50 GFAA COc1ccc(N2C[C@@H](C)N(C(=O)c3nc4ccc(F)cc4[nH]3)CC2=O)cc1 77320136 LGBCJTTUYHQNCS-GFCCVEGCSA-N 382.395 2.588 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(NCCc4nnc(C)[nH]4)CC3)cc2)n1 82039413 COZGNAGHFBLBDS-UHFFFAOYSA-N 379.512 2.717 0 50 GFAA Cn1nc(-c2ccccc2)c2c(NC(=O)C3CCN(CC(F)F)CC3)n[nH]c21 287994792 MJUWNJOJNKNSML-UHFFFAOYSA-N 388.422 2.879 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)N1CCC(Oc2ccncc2)CC1 426515463 CDNDBLICHBWHSI-UHFFFAOYSA-N 384.484 2.931 0 50 GFAA C[C@](O)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1 179004597 LYOJITPXGSMFIX-QFIPXVFZSA-N 399.466 2.637 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)[C@@H]3CCN(C)C3)csc2C1 426737545 TUJNCYXFEBNIAE-OAHLLOKOSA-N 388.537 2.687 0 50 GFAA CN(C)C(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)CCSCc1ccccc1)C2 92045524 ZKHBNHWKGLBQIE-ZWKOTPCHSA-N 375.538 2.914 0 50 GFAA CCc1noc(-c2ccc(NC(=O)N3CCC[C@@]4(CC3)CNC(=O)O4)cc2)n1 97468203 TUCHJLHSLXNPGD-LJQANCHMSA-N 385.424 2.795 0 50 GFAA COc1cc2c(cc1Cl)CN(Cc1nn3c(=O)cc(C)nc3s1)CC2 293274688 VDUAEYZGPLICBR-UHFFFAOYSA-N 376.869 2.680 0 50 GFAA Cc1nccn1CCC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 95385475 NLBIJPRPHPGCQB-KSEOMHKRSA-N 382.483 2.810 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@H](c3nccn3Cc3ccccn3)C2)cc1 95518164 GUCQXNSYYIDQGZ-KRWDZBQOSA-N 386.463 2.686 0 50 GFAA CNC(=O)c1cccnc1N1CCC[C@H](c2nccn2Cc2cscn2)C1 95526819 LVVQVVFQMBTVBN-AWEZNQCLSA-N 382.493 2.527 0 50 GFAA Cn1cc(CN(C(=O)c2c(OCc3ccccc3)c(=O)ccn2C)C2CC2)cn1 1940195108 MADHTOYEJXRPCT-UHFFFAOYSA-N 392.459 2.503 0 50 GFAA Cc1cc(-n2cnnn2)cc(NC(=O)NC[C@@H]2OCCc3ccccc32)c1C 299793275 HXWUBNGWZQMPGI-IBGZPJMESA-N 378.436 2.715 0 50 GFAA CNc1ccc(-c2cccc(C(=O)N(C)Cc3nncn3CCOC)c2)cc1 299771764 WWWMQFIODHPDCA-UHFFFAOYSA-N 379.464 2.905 0 50 GFAA Cc1nn(C)cc1-c1cccc(C(=O)N[C@H]2CCCN(c3cnccn3)C2)c1 299790375 AXZSEESOWLBLLL-SFHVURJKSA-N 376.464 2.584 0 50 GFAA CCNC(=O)N1CCc2cc(S(=O)(=O)N[C@@H](C)c3ccccc3)ccc2C1 77298347 XOSFXNXJDOWLAA-HNNXBMFYSA-N 387.505 2.814 0 50 GFAA C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)c1cc(S(=O)(=O)N(C)C)cn1C 408156951 FIBLZTSOCCHKMK-CQSZACIVSA-N 389.521 2.992 0 50 GFAA CC[C@H](C)[C@@H](C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276621541 WQLKTVJEPOBBHA-DJPFJPOOSA-N 381.524 2.921 0 50 GFAA Cn1cc(N2CCC[C@H](NC(=O)NC3(Cc4cccc(F)c4)CCC3)C2)cn1 185527267 LQCOPICSALYTIJ-SFHVURJKSA-N 385.487 2.993 0 50 GFAA COc1cccc2c1CCN(C(=O)c1cc(N3C[C@H](C)O[C@@H](C)C3)ccn1)C2 192462506 NUOAQXOQSHFJTN-HOTGVXAUSA-N 381.476 2.902 0 50 GFAA CNC(=O)c1cccc(NC(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)c1 192793589 VTSNBOLLWOROBF-UHFFFAOYSA-N 398.438 2.565 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CCC[C@H](OCc3ccccn3)C2)CC1 1506415137 MATQISAMDRBICZ-NRFANRHFSA-N 380.492 2.762 0 50 GFAA CCn1c(N2CCCN(Cc3cccs3)CC2)nc2cc(C(=O)O)cnc21 1529172061 FDYHNETYZMWGBT-UHFFFAOYSA-N 385.493 2.923 0 50 GFAA O=C(NCCC1(O)CCCC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704335042 KBDJHMSVMYSGNX-UHFFFAOYSA-N 385.464 2.603 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H](C)Cn3cccn3)CC1)OCC2 1704338109 KYRZIYIPZDOOAK-MRXNPFEDSA-N 399.491 2.627 0 50 GFAA Cc1ccc(CC(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@@H](O)C2)cc1C 1704299861 MBRAVKWSBPBYIX-NZQKXSOJSA-N 381.472 2.753 0 50 GFAA CCn1cc(Br)c(C(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1 1142480 GWKHGSUZTOGEGD-UHFFFAOYSA-N 397.298 2.957 0 50 GFAA Cc1ccc(-c2c(C)sc3ncn(CC(=O)N4CCOCC4)c(=O)c23)cc1C 812668 RHQGNJUCSSQVLQ-UHFFFAOYSA-N 397.500 2.909 0 50 GFAA CC1(C(=O)Nc2nc(C(F)(F)F)c(I)s2)COC1 864096782 FPEIDVIALIJTJG-UHFFFAOYSA-N 392.140 2.742 0 50 GFAA Cc1c(NC(=O)[C@H]2CC(c3ccc(F)cc3)=NO2)c(=O)n(-c2ccccc2)n1C 5029724 ZHEHKKQLIQFSFK-GOSISDBHSA-N 394.406 2.755 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)CCn2cccn2)C1 12094289 KVPDHVBXBPXDMP-LJQANCHMSA-N 384.524 2.695 0 50 GFAA CCNC(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2OC)CC1 12301883 DRRDSWOXKKOFOE-UHFFFAOYSA-N 386.456 2.902 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCc3cccc(F)c3)CCC2=O)cc1 12585519 JQNYPWXCVBQEHP-SFHVURJKSA-N 384.451 2.932 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@@H](NCc1cccs1)C2 14741949 WVGBHVXGVPDULC-MRXNPFEDSA-N 395.532 2.937 0 50 GFAA CS(=O)(=O)N(CC(=O)NC1CCCC1)Cc1ccc(Cl)c(Cl)c1 4855977 MNPOUQRIBUCRIG-UHFFFAOYSA-N 379.309 2.814 0 50 GFAA Cc1csc2ncc(C(=O)N3CCN(c4cccc(Cl)c4)CC3)c(=O)n12 6815415 ABKWROODLDFLPL-UHFFFAOYSA-N 388.880 2.680 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3[nH]c4c(c3C)C(=O)CCC4)C1)CC2 1857698223 JAXFMYAHNRWPKI-QFIPXVFZSA-N 394.475 2.766 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCN[C@@H](c2ccccc2)C1 1857713037 AOLZYQMALDCUEY-MRXNPFEDSA-N 379.489 2.949 0 50 GFAA Cc1cccn2ncc(C(=O)N3C[C@@H](O)[C@H](Cc4ccc5ccccc5n4)C3)c12 1857716455 MYNOFMKMRCIECR-DYESRHJHSA-N 386.455 2.867 0 50 GFAA COc1ccc2cc(CN3CC[C@@]45OC[C@@H](C(C)C)N4C(=O)C[C@@H]35)c(O)nc2c1 1857726308 LCJVRGGQBYIFOW-JQVVWYNYSA-N 397.475 2.507 0 50 GFAA Cc1c(C(=O)N2CC[C@@H](N)C[C@@H]2C)cnn1-c1cccc(Br)c1 237628306 JHEZJMHQFSVDED-SMDDNHRTSA-N 377.286 2.895 0 50 GFAA CC(C)[C@@H](C(=O)N1CC[C@H]1CN(C)C(=O)c1ccc(O)nc1)c1ccccc1 1875328761 LQJPDKZYMUOCDK-AZUAARDMSA-N 381.476 2.900 0 50 GFAA O=C(c1cc(F)c2nc(O)ccc2c1)N1CCC[C@@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 1875307809 LNGINRMEXIJCOE-LXZKKBNFSA-N 397.450 2.943 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)N[C@H]3[C@@H]4c5ccc(F)cc5C[C@H]43)CC2=O)c1 888101832 PIAGIEXYRFAJGG-CVDLLHPYSA-N 395.434 2.577 0 50 GFAA Cc1ccc(Cc2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)cn1 1775960560 SKHJOODOWVQLEF-HNNXBMFYSA-N 380.452 2.579 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OCC(F)(F)F)cc(Cl)c1O 706335 LZURMMBFDNROIH-LLVKDONJSA-N 394.733 2.788 0 50 GFAA CCCNC(=O)[C@H]1CC[C@@H](NC(=O)c2ccnc(C(C)C)n2)[C@H](OCCC)C1 2100545587 XXNGVBXUJVRJDK-LZLYRXPVSA-N 390.528 2.820 0 50 GFAA C[C@H](Cc1nccn1C)NC(=O)Nc1cccc(-c2n[nH]c3c2COCC3)c1 2325782108 ZAMYHBCHPPKUGD-CYBMUJFWSA-N 380.452 2.636 0 50 GFAA COCCn1cc(C(=O)N2CCC(Oc3ccc(Cl)cc3)CC2)ccc1=O 2325782178 AUKDVIWSACQWJR-UHFFFAOYSA-N 390.867 2.832 0 50 GFAA CCc1ccccc1O[C@@H](C(=O)N1Cc2[nH]c(=N)nc(O)c2C1)c1ccccc1 2325841373 RGDMXCDEJNNSQX-LJQANCHMSA-N 390.443 2.820 0 50 GFAA NC(=O)N1CC[C@H](NC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)C1 114366100 NFUYBRMPIBGAKG-HNNXBMFYSA-N 378.407 2.924 0 50 GFAA CC[C@@H](C)[C@@H](C(=O)N1CCN(c2ccc3nncn3n2)CC1)c1ccccc1 136401486 XILJZJZQFIBARW-OXQOHEQNSA-N 378.480 2.603 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2cc(C)cc(C)c2)S(C)(=O)=O)c1 817121 NKSGIPBXFOJOQI-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA O=C(N=c1nc2nccc(C3CC3)n2[nH]1)c1cc(-n2cccn2)ccc1Cl 2356135898 XROJTXARPMCFQJ-UHFFFAOYSA-N 379.811 2.515 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CC(N4CCOCC4)C3)cc2)c2sccc2n1 2356164480 USEPIAYCWLTIMW-UHFFFAOYSA-N 394.500 2.823 0 50 GFAA O=C(Nc1cccc(C(F)(F)F)c1)N1CCC(Cn2cc(CO)nn2)CC1 23232244 JEXCAWCZDNKUMX-UHFFFAOYSA-N 383.374 2.733 0 50 GFAA CCOC(=O)N1CCN(Cc2nc(-c3cc(OC)ccc3OC)oc2C)CC1 20454764 OXOOZUQKHRZMNH-UHFFFAOYSA-N 389.452 2.941 0 50 GFAA CC(C)NC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613201 LQEMUTRGATVDSO-UHFFFAOYSA-N 376.881 2.546 0 50 GFAA COC[C@H]1CCCN(Cc2cnc(S(=O)(=O)C(C)C)n2CCC(C)C)C1 20450381 XAVIXUQZTBXCQO-KRWDZBQOSA-N 385.574 2.970 0 50 GFAA Cn1ccc(C(=O)N2CCOc3c(O)cc(-c4ccc(Cl)cn4)cc3C2)n1 67724983 WDNKAGAGFBCGEX-UHFFFAOYSA-N 384.823 2.876 0 50 GFAA O=C(Cn1cc(I)cn1)Nc1nc2ccccc2s1 1432984 RXEAXBDGIODPQA-UHFFFAOYSA-N 384.202 2.736 0 50 GFAA Cc1nc(SCC(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)n[nH]1 477376747 UQVJRFSMEGUCQF-UHFFFAOYSA-N 383.433 2.735 0 50 GFAA O=C(CN1CCC[C@H](c2nnc3ccccn23)C1)NCCc1ccc(Cl)cc1 172556475 KHMLAXIAFLNLMS-KRWDZBQOSA-N 397.910 2.921 0 50 GFAA COc1ccccc1N1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2Cl)C1=O 153074910 MCJOYUQBMCYLGL-CQSZACIVSA-N 394.880 2.741 0 50 GFAA O=C(CN1CCC(Oc2cnccn2)CC1)Nc1ccccc1C(F)(F)F 369724214 UJMREWODVJPWGY-UHFFFAOYSA-N 380.370 2.977 0 50 GFAA CCN1CCC[C@@H](c2nc3cc(S(=O)(=O)N4CCCC4)ccc3n2C)C1 82161077 KCRQTJTYVBOVQZ-OAHLLOKOSA-N 376.526 2.557 0 50 GFAA Cc1cc(NC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)ncc1Br 176075030 PAGUVZCCWCPDAP-MRVPVSSYSA-N 380.164 2.502 0 50 GFAA O=C([C@@H](O)c1cccc(Cl)c1)N1CCC2(CC1)Nc1ccccc1NC2=O 82100284 IFORTLLIHXHVDG-KRWDZBQOSA-N 385.851 2.799 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@@H](Cn4cc(C5CC5)nn4)C3)c(C)nc2c1 48121825 AAMRNNBESAPXGX-MRXNPFEDSA-N 378.480 2.972 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCC[C@@H](C)CO)csc2C1 426530403 KDKQMNFXCLOWBD-GFCCVEGCSA-N 377.510 2.660 0 50 GFAA CC(C)c1nnc(CCC(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)o1 290539555 HDFRJMMEPCHZIJ-HXUWFJFHSA-N 375.444 2.718 0 50 GFAA Cn1nnnc1SCCN1CC(c2ccccc2)(c2ccccc2)CCC1=O 91708056 GVNUFVMTNJGODM-UHFFFAOYSA-N 393.516 2.911 0 50 GFAA CN(Cc1nccn1Cc1ccccc1)C(=O)c1cnc(C(C)(C)C)[nH]c1=O 91781628 XJLZBVQLVFYXNN-UHFFFAOYSA-N 379.464 2.584 0 50 GFAA CCSCCC(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91915170 BQYWOZXWGZRAAV-UHFFFAOYSA-N 389.565 2.999 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4cccnc4C)C3)CCC2=O)cn1 95499187 DESUBDZCFNDLII-QFIPXVFZSA-N 393.491 2.533 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)CSCCN3CCCC3)C2)cc1 95370727 WZUACITUPKPCRR-GOSISDBHSA-N 376.522 2.920 0 50 GFAA CC/C=C/CC(=O)N[C@@H]1C[C@@H](C(=O)NCC)N(Cc2ccc(F)cc2C)C1 95390083 FUHVCTDSLJXPNK-KAGICYHLSA-N 375.488 2.686 0 50 GFAA O=C(NCc1cc2n(n1)CCCN(C(=O)C1CCC1)C2)c1ccccc1Cl 91656811 AIHBZUBQUOCGAW-UHFFFAOYSA-N 386.883 2.999 0 50 GFAA CC(C)n1ccnc1C1CCN(C(=O)c2ccc(S(C)(=O)=O)cc2)CC1 91625875 ZHSFSRSFNSTFRL-UHFFFAOYSA-N 375.494 2.887 0 50 GFAA O=C(N[C@@H]1CCO[C@H](c2cccnc2)C1)N[C@@H]1CCN(Cc2ccccc2)C1 297077169 OTKIIHFVMWTVSP-NJYVYQBISA-N 380.492 2.875 0 50 GFAA CN(C)Cc1nnc([C@H]2C[C@H](NC(=O)CCc3ccccc3Cl)C2)n1C 252568966 VRUJMVSJAIXZGU-SHTZXODSSA-N 375.904 2.525 0 50 GFAA Cc1ccc([C@@H](C(=O)N2CCN(c3ncnc4ccccc34)CC2)N(C)C)cc1 823646300 OLJHVBUJZRHDBU-NRFANRHFSA-N 389.503 2.890 0 50 GFAA CN(Cc1ccccc1CN1CCCC1)C(=O)c1cnc2ccccn2c1=O 952988857 SZEHIPPUEPXADB-UHFFFAOYSA-N 376.460 2.563 0 50 GFAA CC1(C)CCc2cc(CC(=O)N3CCN(C(=O)c4ccco4)CC3)ccc2O1 888105516 HHAKPZDOIMFHPC-UHFFFAOYSA-N 382.460 2.910 0 50 GFAA CC(=O)N1CC[C@H](NC(=O)c2nn[nH]c2-c2ccccc2)c2ccc(F)cc2C1 194230107 UEGSQVPELRTVSM-SFHVURJKSA-N 393.422 2.834 0 50 GFAA CCCOc1c(CNc2ccc(C(=O)N3CCOCC3)cn2)cccc1OC 1529117846 AWCKDAZYDDXCNF-UHFFFAOYSA-N 385.464 2.964 0 50 GFAA Cc1ccc(C)c(NC(=O)CCNc2ccc(C(=O)N3CCOCC3)cn2)c1 1529190678 LVBXOXHPQPEPCN-UHFFFAOYSA-N 382.464 2.612 0 50 GFAA COc1ccc(C(=O)Nc2ccnn2C2CCN(Cc3cnn(C)c3)CC2)cc1 11718033 LPLZLORNMNCQOQ-UHFFFAOYSA-N 394.479 2.715 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](O)C2)c2c(n1Cc1ccccc1F)CCCC2=O 12302153 ZQVQRZPQEVGEFO-INIZCTEOSA-N 384.451 2.639 0 50 GFAA CN(Cc1nccn1C)C(=O)[C@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 12316747 MJHDUQVDHXTCFD-INIZCTEOSA-N 388.899 2.513 0 50 GFAA Cn1cc(CN2CC(=O)N(C3CCCCC3)C[C@H](OCc3ccccc3)C2)cn1 14732381 OFQLOKCYNBUICD-JOCHJYFZSA-N 396.535 2.982 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)NC[C@H](C)c2ccccc2)c1=O 14983006 SXLPNYXXFIVADR-INIZCTEOSA-N 383.492 2.788 0 50 GFAA COc1ccc(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)c(OC)c1 5617963 MKNFUJGRNCRHQT-LICLKQGHSA-N 379.441 2.691 0 50 GFAA CNc1ncccc1C(=O)N1CCC2(CC1)OCCc1sc(C(=O)O)cc12 1857682455 KREVOHDDHGKPAS-UHFFFAOYSA-N 387.461 2.587 0 50 GFAA CC(C)=CCCN1CC[C@@H](O)[C@]2(CCCN(C(=O)c3c(C)noc3C)C2)C1 1857689051 CQZJXOLGSBHWDU-WIYYLYMNSA-N 375.513 2.937 0 50 GFAA CCCN1CC2(CCN(C(=O)c3sc(CC)nc3C)CC2)OCCC1=O 1857713884 VQTTWNNLBQDHLM-UHFFFAOYSA-N 379.526 2.648 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N(C)CCCN(C)C)C3)nc2c1 1857727459 SHKXVQSBDRVMFI-INIZCTEOSA-N 388.512 2.853 0 50 GFAA O=C(COc1ccc(F)cc1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857729042 SCMSVUKGVRKLRM-JQVVWYNYSA-N 396.418 2.506 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccc(C)n4)[C@H]4CC[C@]3(C2)O4)nc1 1857736115 LGECFTPQGPHBFQ-KLJZETAQSA-N 392.503 2.503 0 50 GFAA Cc1cc(N2CCC(C3CCN(C(=O)c4nsnc4C)CC3)CC2)ncn1 1875240981 MJTARCMRGTYBSR-UHFFFAOYSA-N 386.525 2.714 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCC(Cc3ccccc3)CC2)[C@H]1c1cnn(C)c1 115202141 RTYFSRMFCAAGJO-IFMALSPDSA-N 394.519 2.811 0 50 GFAA CCc1n[nH]c(=O)c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c1CC 125419968 ZMLOGBOBMYGQTR-UHFFFAOYSA-N 388.899 2.506 0 50 GFAA Cc1ccc(OCCS(=O)(=O)N2C[C@H]3CC[C@@H](C2)N(CC2CC2)C3)cc1 248030177 PZAMXTJPWPVYCF-OALUTQOASA-N 378.538 2.510 0 50 GFAA CC(=O)Nc1cnc(C)c(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)c1 1875274139 MSAQADPYKOYYTC-CYBMUJFWSA-N 380.448 2.966 0 50 GFAA C/C=C/c1cc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc(OC)c1OC 1875402477 HPSRALKRZHJPDA-QOQQBZNLSA-N 385.464 2.503 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)CN(C(=O)c1ccncc1C(F)(F)F)C2 885679327 SPYBCZDVIOXYLO-UHFFFAOYSA-N 399.394 2.507 0 50 GFAA O=C(c1c[nH]nc1[C@H]1CCNC1)N1CCC2(CCc3ccccc3C2=O)CC1 888102050 WGSHWCTZEAAVGJ-INIZCTEOSA-N 378.476 2.538 0 50 GFAA C[C@H](Oc1cccc2ccccc12)C(=O)N1CC[C@@H](c2cc(O)nc(O)n2)C1 898231114 HVZYCXFZESYJNA-DZGCQCFKSA-N 379.416 2.824 0 50 GFAA COc1ccc(CN2C(=O)COc3nccc(I)c32)cc1 38534156 HHASLJWLUTWBFA-UHFFFAOYSA-N 396.184 2.620 0 50 GFAA in-vitro O=C(NC[C@@H]1CCC[C@H]1N1CCCS1(=O)=O)c1ccc(-c2ccccc2)nc1 2325768132 QHIUVXJTEIGMBI-FXAWDEMLSA-N 399.516 2.683 0 50 GFAA Oc1ccc2c(c1)C1(CC1)CN(c1ncnc3nc(N4CCOCC4)sc13)C2 2325789235 GBVBQJWUXJDPGI-UHFFFAOYSA-N 395.488 2.680 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccccc2OC)cc1Br 1180225 FAWQQURWGHIEEJ-UHFFFAOYSA-N 386.267 2.945 0 50 GFAA Cc1cccc(CCNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)c1 2356143851 YKWZMDAJEARRFM-WWEVIYMKSA-N 389.499 2.986 0 50 GFAA CCCN(Cc1nccn1C)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356145098 AMYOXOHPPJYXSU-UHFFFAOYSA-N 388.537 2.685 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356169467 CBOWSIYPHCZONA-QYWGDWMGSA-N 392.446 2.866 0 50 GFAA COc1ccc(N([C@H](C)C(=O)N2CCCc3ccccc32)S(C)(=O)=O)cc1 10449551 VCIYRRWXRIHNFH-OAHLLOKOSA-N 388.489 2.829 0 50 GFAA Cc1c(C(=O)N(Cc2ccccc2)C[C@H](C)CO)nnn1Cc1ccccc1 55283794 ZMTCCGRYRMWWRN-KRWDZBQOSA-N 378.476 2.906 0 50 GFAA CN(Cc1cnccn1)C(=O)c1cc(COc2cccc3cnccc23)on1 12300844 SSYFZCZHESOLFT-UHFFFAOYSA-N 375.388 2.864 0 50 GFAA COc1cccc(NC(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)c1 21795058 RBGPTAFCCWHXEH-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H](Cn3ccnc3)C2)cc1NC(=O)[C@H]1CCCO1 20821565 FHFUDHFEPARDCZ-FXAWDEMLSA-N 396.491 2.861 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C)CC3)[C@@H](CCO)C2)c2ccccc12 20449536 OSDJREWNPVEZGY-NRFANRHFSA-N 397.563 2.811 0 50 GFAA Cc1nc2sc3c(c2c(=O)n1NC(=O)c1nn(C)cc1Cl)CC[C@@H](C)C3 2778286 SNDLMOZPKWOGTR-MRVPVSSYSA-N 391.884 2.662 0 50 GFAA CC(=O)N[C@H](CC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1)c1ccccc1 150754002 MVYAUTPCARLIJU-QFBILLFUSA-N 387.430 2.927 0 50 GFAA CCOc1cc(CNC(=O)[C@@H]2COCCN2CC2CCC2)ccc1OC(F)F 483730665 JFONMMROCKBUGJ-INIZCTEOSA-N 398.450 2.804 0 50 GFAA O=C(Nc1ccccc1)C(=O)N1CCC[C@@]2(CCC(=O)N(C3CCCC3)C2)C1 77337535 RNQYCWQBRSZIKO-JOCHJYFZSA-N 383.492 2.799 0 50 GFAA Cn1cc(-c2nc([C@H]3COCCN3C(=O)c3sccc3C3CC3)no2)cn1 373032226 SSANYCFAWVLUAC-CQSZACIVSA-N 385.449 2.623 0 50 GFAA COc1ccccc1N1C[C@H](Nc2nc(C(C)C)nc3c2cnn3C)CC1=O 72147019 ABTGYCCURHFRSP-CYBMUJFWSA-N 380.452 2.713 0 50 GFAA CCOc1cc(C(=O)N[C@@H]2CCO[C@H](CC(C)C)C2)ccc1OCC(=O)O 262717521 DCEOEAMITNOPSK-HZPDHXFCSA-N 379.453 2.872 0 50 GFAA O=C([C@@H]1COCCN1CC(F)F)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 497775473 HCIYBVKHWLZUNN-SFHVURJKSA-N 395.425 2.979 0 50 GFAA COc1ccc(C2(C(=O)N3CCN(c4cccc(OC)c4)C(=O)C3)CC2)cc1 82108006 QEGXILQXROIHJW-UHFFFAOYSA-N 380.444 2.611 0 50 GFAA Cc1ccn(CC(=O)N2C[C@@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)n1 95368544 MBYBUCPBYPGEPZ-CEWLAPEOSA-N 386.446 2.559 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2cc(C)nc(C)c2)CC1 96152818 UJXUMYOAGZNYLW-UHFFFAOYSA-N 393.495 2.574 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@H](c4nccn4CCCN(C)C)C3)cn2c1 95372068 IZLUJJCAGHGGTD-SFHVURJKSA-N 394.523 2.811 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2ccc(-c3ccccc3C)cc2)C[C@@H]1CO 91906867 BLTXHOCEDMDXFF-FGZHOGPDSA-N 396.531 2.921 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCC(CCn3cccn3)CC2)c1 97815210 CRLDLJFCIOILOI-UHFFFAOYSA-N 385.468 2.586 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@H]3CC[C@@H]1[C@@H]32 248042631 OQPJCJPJPNWQBN-NAAVPDOZSA-N 379.504 2.873 0 50 GFAA Cc1ccccc1-c1cc2c(=O)n(C[C@H](O)c3ccc4c(c3)OCO4)ccn2n1 263616910 LDLLDVNMGVCZBT-IBGZPJMESA-N 389.411 2.934 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2CC[C@H]3OCc4cnnn4[C@H]3C2)c1 299780106 IHKYJAUJVBYHLY-PZJWPPBQSA-N 390.443 2.940 0 50 GFAA Cc1ncnc(C)c1C(=O)NC[C@@H]1CCCN(c2nnc(C)c3ccccc23)C1 952970894 XFBXKCIZLCXARE-KRWDZBQOSA-N 390.491 2.991 0 50 GFAA CN1CCC([C@@H]2CCN(C(=O)NCc3ccc(-n4ccnc4)c(F)c3)C2)CC1 270301763 YNEZDDPEOQLKPK-GOSISDBHSA-N 385.487 2.885 0 50 GFAA C[C@@](O)(CN1CCc2c(F)ccc(F)c2C1)c1ccc(S(C)(=O)=O)cc1 272029117 BZYGKCIBCDRLHD-LJQANCHMSA-N 381.444 2.634 0 50 GFAA C[C@H](NC(=O)c1ccnc(S(N)(=O)=O)c1)c1ccc(-c2ccccc2)cc1 186879555 BBBJYNKDQCRTKR-AWEZNQCLSA-N 381.457 2.887 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(C(=O)c2cccc(-n3cnnc3)n2)C1 1506408493 YMGNTKXNSSCOJE-QGZVFWFLSA-N 377.448 2.902 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@@H]1COC[C@H]1Cc1ccncc1 1704326605 JBUWGHJYTKGMSQ-QZTJIDSGSA-N 390.505 2.750 0 50 GFAA CC(=O)c1ccc(N2CN=c3s/c(=C\c4cccc(Cl)c4)c(=O)n3C2)cc1 1137489 VJZDYGSFVCTHRX-ZDLGFXPLSA-N 397.887 2.649 0 50 GFAA CCn1ccc(-c2nc(COc3cccc(OC)c3)nn2[C@@H]2CCOC2)cc1=O 1772808091 ZADFEGPROFJWGM-MRXNPFEDSA-N 396.447 2.676 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCC(O)(c2ccccc2)CC1 11879793 AKPYTAZFGPZFRN-UHFFFAOYSA-N 380.423 2.589 0 50 GFAA COc1cccc(OCc2cc(C(=O)NCCc3nc(C)cc(C)n3)no2)c1 12057196 BWBSLCOEFXZAJP-UHFFFAOYSA-N 382.420 2.642 0 50 GFAA CCN(CCN(C)C)C(=O)c1cnn(-c2nccc(-c3ccccc3F)n2)c1C 12132240 HFUVZENHHNZKFO-UHFFFAOYSA-N 396.470 2.801 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CNCC2(O)CCCCC2)cc1OC 15070833 ZYUVBEOPAWQWAH-LJQANCHMSA-N 394.556 2.562 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)CCC(F)(F)F)C1 15077465 GWJSZQOPXSCDLV-CYBMUJFWSA-N 386.418 2.785 0 50 GFAA COCc1ccc(CN2CCC[C@@H](CNC(=O)c3ccc4c(c3)OCO4)C2)o1 19741557 ASEWWYIGZIOFIL-HNNXBMFYSA-N 386.448 2.797 0 50 GFAA COc1ccc(CN[C@H]2CC(=O)N(c3ccc(Br)cc3)C2=O)cc1 19832317 CUPPBXSBGNDUNR-INIZCTEOSA-N 389.249 2.879 0 50 GFAA Cc1c(O)cccc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857720432 ULMQNXMCNUNTFF-KNKQGSTJSA-N 378.428 2.615 0 50 GFAA CN(C)C(=O)CCNC(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857734976 ATQJTAGFMDPOJP-ZDUSSCGKSA-N 392.887 2.682 0 50 GFAA Cc1ccc(F)cc1S(=O)(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857737449 MTKQYJPBINNDFZ-GBESFXJTSA-N 390.480 2.627 0 50 GFAA O=C(CN1CCC[C@H](Cc2nnc3ccccn23)C1)Nc1ccc(F)cc1F 225612564 PWPPVNGMQDPQGN-CQSZACIVSA-N 385.418 2.901 0 50 GFAA COCC1CCN(CC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)CC1 112354651 WWMSGKFCARRMMD-UHFFFAOYSA-N 399.457 2.712 0 50 GFAA COc1ccc(CCNC(=O)N2C[C@H](C)OC3(CCOCC3)C2)c(Cl)c1 447950044 DZDOSOORUUZXTQ-AWEZNQCLSA-N 382.888 2.871 0 50 GFAA CC(C)c1c(NC(=O)N2C[C@@H](O)C[C@H]2CO)cnn1-c1ccccc1Cl 370650311 KZHQZBKUEFSNLI-STQMWFEESA-N 378.860 2.609 0 50 GFAA CCn1cnc2c(NCc3ccc(C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)ncnc21 264655349 JSEUFGUYYNVUAW-GJZGRUSLSA-N 394.479 2.708 0 50 GFAA CS(=O)(=O)C1(c2ccc(-c3noc(C(F)(F)C4(O)CCC4)n3)cc2)CC1 904221755 ONYZXHDLAPBTJZ-UHFFFAOYSA-N 384.404 2.777 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cs1 1704303430 XWSNUUOLKJMENK-HXUWFJFHSA-N 384.505 2.927 0 50 GFAA CC1(C)CN(C(=O)C(C)(C)N2CCNCC2)[C@H]1c1nccn1-c1cccc(F)c1 952893757 JGBBLVJLEMRHSD-SFHVURJKSA-N 399.514 2.605 0 50 GFAA CC[C@H]1CN(C(=O)CC2(OC)CCC2)CC[C@@H]1NC(=O)c1cc(C(F)F)[nH]n1 1875333885 OUKHVZYRQYNBRW-STQMWFEESA-N 398.454 2.663 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)N2C[C@H](C(=O)OC)C[C@H](C(C)(C)C)C2)c1 1875370344 LALWGMJTTXPJNG-KGLIPLIRSA-N 388.464 2.814 0 50 GFAA COc1ccc([C@H](NC(=O)N2CCO[C@](C)(C(F)F)C2)c2nccn2C)cc1 888102070 XTHHXRXHZAJOBH-KXBFYZLASA-N 394.422 2.584 0 50 GFAA CCOC(=O)C(C)(C)Oc1ccc(/C=C2\SC(=N)NC2=O)cc1OCC 1772715444 CIFYPXIWYHQLST-UVTDQMKNSA-N 378.450 2.944 0 50 GFAA CCCCC(=O)N1CCCCC[C@@H](NC(=O)[C@@]2(CC(C)C)CCNC2=O)C1 1775991125 HOBMZPFQQVUQCR-DYESRHJHSA-N 379.545 2.616 0 50 GFAA C[C@@H](CNC(=O)C[C@H]1CN(CC2C3(CC3)C23CC3)C2(CCC2)CO1)c1cnc[nH]1 2325785290 OLLLIFDFSATKKZ-IRXDYDNUSA-N 398.551 2.833 0 50 GFAA CN(Cc1cc(Br)ccc1Cl)C(=O)[C@@H]1NCCc2nn(C)cc21 2325795685 SXRMGXUKVPWOKB-OAHLLOKOSA-N 397.704 2.681 0 50 GFAA CSc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)N(C)C 1066420 VVMUYWMRWCKYQN-UHFFFAOYSA-N 379.507 2.660 0 50 GFAA NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 1244268 NNLJGFWTDLMBNJ-UHFFFAOYSA-N 390.266 2.669 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)c1cc2c(s1)CCOC21CCNCC1 2356153258 YQDNLJMTSODCAE-UHFFFAOYSA-N 386.473 2.558 0 50 GFAA O=C(Cc1cccc(F)c1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356166224 XQNUEMSTHOERGV-IPJJNNNSSA-N 388.483 2.655 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@H]1O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 246184006 HMWNQOWDRXIDLH-PWIZWCRZSA-N 379.460 2.705 0 50 GFAA Cc1ccccc1[C@@H]1CC(=O)c2cnc(NCCCN3CCOCC3)nc2C1 20101123 IVJXHECEADVLFS-KRWDZBQOSA-N 380.492 2.832 0 50 GFAA Cn1c(=O)oc2cc3c(cc21)NC(=O)C[C@@H]3c1cc(F)ccc1-n1cccn1 65501611 DPAHCBRHRRRSDN-LBPRGKRZSA-N 378.363 2.930 0 50 GFAA O=C(CCc1nnc(C2(c3ccc(Cl)cc3)CCC2)o1)N[C@H]1CCOC1=O 23153243 QMNILGBOVMAYBN-AWEZNQCLSA-N 389.839 2.557 0 50 GFAA O=C(C1CCCC1)N1CCC[C@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 23375096 MKEBPABEVLJLKF-FQEVSTJZSA-N 399.535 2.714 0 50 GFAA Cn1ccnc1C[C@@H]1CCCN(C(=O)c2cc(N3CCCC3=O)ccc2F)C1 119333714 OACXGGHGEXUIKT-HNNXBMFYSA-N 384.455 2.781 0 50 GFAA Cc1cccc(CN2CCC(N3CCC(C(=O)NCC(F)(F)F)CC3)CC2)n1 20862732 RPAQBQFTGWFBKG-UHFFFAOYSA-N 398.473 2.745 0 50 GFAA NC(=O)c1ccc(-c2nc3c(c(N[C@@H]4C[C@H]4c4ccccc4)n2)CCNC3)cc1 71754407 BSOKIMSTTYOIRT-RBUKOAKNSA-N 385.471 2.856 0 50 GFAA CO[C@H]1CN(C(=O)c2ccc(-c3cn(-c4ccccc4)cn3)cc2)CC[C@H]1N 71764093 DOEWDKJFHRQDLE-CTNGQTDRSA-N 376.460 2.728 0 50 GFAA Cn1cc(N2CCC[C@@H](NC(=O)c3csc(Cc4ccccc4)n3)C2)cn1 154016942 RUGUBWHTVMBREP-MRXNPFEDSA-N 381.505 2.866 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCc2ccon2)(Cc2ccccc2)c2ccccc21 71419124 MZYHOGCXNJZKJT-JOCHJYFZSA-N 375.428 2.838 0 50 GFAA Cn1cc(C(=O)NC[C@H]2CCCN(Cc3ccco3)C2)c(=O)c2ccccc21 216208710 RLWAIOQGGHXMQS-MRXNPFEDSA-N 379.460 2.774 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2cc(C(C)C)nn2C)c2ccccc2C12CCNCC2 72480548 CUKXOKVVJGGSIU-UXHICEINSA-N 382.508 2.664 0 50 GFAA Cc1ccc(CN2CCN(C(=O)Cc3ccc(F)c(F)c3F)CC2=O)cc1 77379452 QWKGSZQMQOVGJB-UHFFFAOYSA-N 376.378 2.826 0 50 GFAA CC(C)n1ncc2c(C(=O)N3CCO[C@@H](C(=O)O)C3)cc(-c3ccccc3)nc21 262898462 PMKJJJUWLXIQGC-GOSISDBHSA-N 394.431 2.605 0 50 GFAA C[C@H]1CCCN([C@@H]2CCC(=O)N(CCS(=O)(=O)c3ccccc3)CC2)C1 43056880 GXNVZKPVOVQABJ-ZWKOTPCHSA-N 378.538 2.573 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4cnccc4C)C3)CCC2=O)cn1 91595918 NSDHVAVNXJYNHF-QFIPXVFZSA-N 393.491 2.533 0 50 GFAA CCn1ccnc1CN1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91792695 GHGBNJKGHGCOOR-UHFFFAOYSA-N 381.524 2.745 0 50 GFAA Cc1oc2c(c1C(=O)N1CCC[C@H](CNC(=O)c3cccnc3)C1)C(=O)CCC2 95498242 JMBIKCAUFBFFDC-OAHLLOKOSA-N 395.459 2.784 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)N(C)CCCN1CCOCC1)c1ccncc1 426503229 GOWAJJLXGKPJSV-NRFANRHFSA-N 382.508 2.843 0 50 GFAA O=C(CCC(=O)N1CCC(c2noc3cc(F)ccc23)CC1)N=c1cc[nH]cc1 334161496 CVBRWHUIVGBOBT-UHFFFAOYSA-N 396.422 2.909 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3cc4ccccc4[nH]3)C[C@H]2NC(C)=O)cc1 92078641 CNQYQKYSDJOKJL-GHTZIAJQSA-N 377.444 2.921 0 50 GFAA CNc1nc(C(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)cs1 95499317 MHYAECBPKXCWHO-UHFFFAOYSA-N 382.493 2.844 0 50 GFAA O=C(c1cccc(O)c1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95378972 VICFKQIFJABRFC-VLCRHTCISA-N 392.455 2.823 0 50 GFAA CSCc1nc(CNC(=O)c2ccc(C)c(N3CCNC3=O)c2)cs1 96130710 YRDLMRSLQXXNEI-UHFFFAOYSA-N 376.507 2.774 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)C1 95500627 ZTXOINBSDYJCJN-MRXNPFEDSA-N 381.480 2.745 0 50 GFAA COc1ccc(-c2ccc(C(=O)N[C@H](c3cnn(C)c3)[C@H]3C[C@@H](O)C3)o2)cc1 244866441 VWGARLOZNFGTQZ-NBQZKYEYSA-N 381.432 2.931 0 50 GFAA COc1cccc(OC)c1C(=O)N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 244619998 FJYVCKUASVYJLU-VWKPWSFCSA-N 383.444 2.881 0 50 GFAA Cc1cc(C(=O)N[C@H]2C[C@@H](c3nnc(Cn4cccn4)n3C)C2)ccc1Cl 244816890 SQKXBTPPLITCAS-GASCZTMLSA-N 384.871 2.698 0 50 GFAA O=C(NCC(=O)N1CCc2ccccc21)N1CCO[C@H](CCc2ccccc2)C1 183293542 HFOSHWGWNYSLMZ-HXUWFJFHSA-N 393.487 2.619 0 50 GFAA Cc1[nH]nc(-c2ccc(F)cc2)c1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 253409834 MMYGAJTXMHZSQP-SFHVURJKSA-N 381.407 2.879 0 50 GFAA COC(=O)c1cn([C@H](CN2CCCCC2)c2ccccc2)cc2c(=O)[nH]nc1-2 263587168 CYTOMGPVIUGLOQ-GOSISDBHSA-N 380.448 2.538 0 50 GFAA Cc1ccc(CNc2nc(CN3CCNC(=O)CC3)nc3ccccc23)cc1 64002218 CUWREPORRZWONU-UHFFFAOYSA-N 375.476 2.872 0 50 GFAA C[C@@H]1CN(CCC(=O)Nc2cccc(Br)c2)CCN1CC(C)(C)O 189946759 AOGHSSKNUNRAIJ-CQSZACIVSA-N 398.345 2.555 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)NC1CCN(C[C@H]2CCCO2)CC1 1506414593 GHZDZLWTHVZAEZ-QGZVFWFLSA-N 393.915 2.737 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N3CCc4n[nH]c(C)c4C3)c(C)s2)n[nH]1 1506399077 JXMQGSONOCYJQD-UHFFFAOYSA-N 377.495 2.534 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(Cc1ccccc1)S(C)(=O)=O 627776 NNBRJEFCFYLSIR-UHFFFAOYSA-N 382.869 2.749 0 50 GFAA O=C(CN1CCCCC1=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704358581 OJDAAIPDASZWNC-UHFFFAOYSA-N 381.476 2.571 0 50 GFAA CN1CCC2(CC1)CN(C(=O)c1ccccc1OC(F)(F)C(F)F)CCO2 1772817358 NGTIWLKZEMEFQO-UHFFFAOYSA-N 390.377 2.860 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)[C@@H]1CCCO1 11814310 PEJRHUJEIUVODX-RTWAWAEBSA-N 386.536 2.928 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCC3(CCN(Cc4ccsc4)CC3)O2)n(C)n1 12002965 HMFHPVZEPSVDOX-KRWDZBQOSA-N 388.537 2.734 0 50 GFAA CN(Cc1ccccc1)C(=O)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1 12003232 GKKNMVAIIWOPBX-UHFFFAOYSA-N 392.864 2.679 0 50 GFAA COC[C@H](O)CNC(=O)c1csc2nc(-c3ccc(C(F)(F)F)cc3)cn12 12317182 MPVBTHOBMYLKIY-GFCCVEGCSA-N 399.394 2.819 0 50 GFAA COc1cc(CN(C)CC2CCOCC2)ccc1OC[C@@H](O)CN(C)C(C)C 12454723 RZAYZCIOEUGNQY-FQEVSTJZSA-N 394.556 2.634 0 50 GFAA COC(=O)c1ccc(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)cc1 12701245 MSQNWJMHVMNQGW-GOSISDBHSA-N 398.434 2.667 0 50 GFAA Cc1ccc(N2C[C@H](c3nnc(NC(=O)[C@@H]4CCCO4)s3)CC2=O)cc1C 12862825 YHRQQZAGTRGURR-HIFRSBDPSA-N 386.477 2.793 0 50 GFAA CC(C)CC(=O)N1CCC[C@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 19223878 AHLZMPBDTCQSSO-IBGZPJMESA-N 387.524 2.570 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ncc[nH]2)CC12CCN(C/C=C/c1ccccc1)CC2 1857686352 RZPJBNFFSZQZFG-QTWIXLPOSA-N 380.492 2.722 0 50 GFAA CCN(CC)C(=O)c1ccccc1NC(=O)c1cc(Cn2cc(C)cn2)on1 122528623 BAMWUTVLJFWSKI-UHFFFAOYSA-N 381.436 2.962 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)C1 814335995 PYWVYBVWQZGGHS-RISCZKNCSA-N 381.391 2.999 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)[C@H]1C[C@H]2CC[C@H]1C2 333480454 XUHUZIMQSSZNKP-ZYRLFZHTSA-N 383.536 2.597 0 50 GFAA CN(C(=O)c1ccc(C(=O)O)s1)[C@@H]1CCN(c2ccccc2Cl)C1=O 237279805 HRYFPMRHNKMMQK-GFCCVEGCSA-N 378.837 2.977 0 50 GFAA O=C1CCCN1CC[C@@H]1CN(C(=O)COCc2cccnc2)c2ccccc21 805188926 KSWWDGSDCUQZIN-GOSISDBHSA-N 379.460 2.741 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@@H](CNC(=O)c1cccc(O)n1)Cc1ccccc1 820515932 NCUWLTYTGRBYSP-MRXNPFEDSA-N 385.464 2.995 0 50 GFAA CCC[C@H](C)N(C)C(=O)[C@H](Cc1cn(-c2cncc(C(=O)O)c2)nn1)C1CC1 1875326155 CJZPOMFOKPIZGN-SCLBCKFNSA-N 385.468 2.576 0 50 GFAA CN(C[C@H]1CCCO1)C(=O)c1ccccc1Cn1cc([C@H](O)C(C)(C)C)nn1 1875316436 RAPXSBRHRWPURS-APWZRJJASA-N 386.496 2.657 0 50 GFAA C[C@@H](Cc1nc(-c2ccccc2)no1)NC(=O)N1CCCc2c(cnn2C)C1 888102603 KXEUBOOFPZSYOY-AWEZNQCLSA-N 380.452 2.559 0 50 GFAA COCC1(CNC(=O)C[C@H](C)CC(C)(C)C)CCN(C(=O)[C@@H](C)OC)CC1 1775989082 CHEFZXVZPIUOCW-DLBZAZTESA-N 384.561 2.855 0 50 GFAA COC(=O)[C@@H]1CCCN1Cc1cn(CCOc2cccc3ccccc23)nn1 1776003534 WAFFNCVKWONOIA-IBGZPJMESA-N 380.448 2.648 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 1322524638 SHPWAKKCBDBRLD-HSZRJFAPSA-N 391.471 2.719 0 50 GFAA COc1cccc(/C=c2\sc3nnc(-c4ccccc4C)n3c2=O)c1OC 717760 GBXIGWGGMHVQBW-WJDWOHSUSA-N 379.441 2.691 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3nc(-c4cccc(Cl)c4)oc3c2)C(=O)N1 1857798034 KMNROEDYBGOLNZ-CQSZACIVSA-N 383.791 2.683 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356149867 DFNPXMRJIINGQW-JOCHJYFZSA-N 393.443 2.608 0 50 GFAA Cc1ccc(C)c(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1 3597968 DKWDNTSEVNZNJA-UHFFFAOYSA-N 392.452 2.716 0 50 GFAA O=C(NCc1ccccc1F)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 7960937 VCHLJOWSAHCDJW-CQSZACIVSA-N 382.482 2.604 0 50 GFAA C[C@H]1CCCN(C(=O)C(=O)O[C@@H](C)C(=O)Nc2ccc(Br)cc2)C1 225840795 XOASAVYKWWHDFQ-RYUDHWBXSA-N 397.269 2.578 0 50 GFAA COCCN1CC[C@]2(CCC1=O)CN(Cc1ccc(Cl)s1)CCN2C 108046066 DHRBFRIGYGCLHZ-GOSISDBHSA-N 385.961 2.547 0 50 GFAA O=C(NCCc1cccnc1)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252495492 ORPUTYBWZGYLLS-UHFFFAOYSA-N 388.493 2.667 0 50 GFAA N=C1Nc2nc3ccccc3n2[C@H](c2ccc(I)o2)N1 1430186 BUBVGTWAZMDGTG-LLVKDONJSA-N 379.161 2.731 0 50 GFAA C1CN(c2nnc(CC34CC5CC(CC(C5)C3)C4)n2C[C@@H]2CCOC2)CCO1 328809280 DWYGPOBQGZZPEI-RMJOCGACSA-N 386.540 2.910 0 50 GFAA COc1ccc(-n2ccnc2SCc2ccccc2S(N)(=O)=O)cc1 253430348 WCUGLGBLJMGALP-UHFFFAOYSA-N 375.475 2.821 0 50 GFAA COc1cc(NC(=O)[C@@H]2C[C@]23CCOc2ccccc23)cc(S(C)(=O)=O)c1 375867808 RBBGZVLTJOEXQM-PXNSSMCTSA-N 387.457 2.778 0 50 GFAA CN1CCCN(C(=O)[C@@H]2CCS(=O)(=O)c3ccccc32)c2ccc(F)cc21 367405891 SNZLDESXBSYBSW-MRXNPFEDSA-N 388.464 2.960 0 50 GFAA Cc1nc2c(c(N3CCCC3)n1)CCN(C(=O)c1cn3c(C)cccc3n1)C2 71746867 MAWHDJPZCSBOQC-UHFFFAOYSA-N 376.464 2.540 0 50 GFAA O=C(c1cc(C(=O)N2CCNC[C@@H]2c2cccc(Cl)c2)c[nH]1)N1CCCC1 261994661 MZDAVJZTYLODAF-GOSISDBHSA-N 386.883 2.691 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2CC[C@H](c3ccccc3OC)C2)c1 158030902 ZLNMUAHNSFCJLE-KRWDZBQOSA-N 381.476 2.873 0 50 GFAA COc1ccc(-c2nn3c(NCCN4CCOCC4)cc(C)nc3c2C)cc1 40216849 LMZJMTDFKREPRP-UHFFFAOYSA-N 381.480 2.766 0 50 GFAA Cc1cnc(CNC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)[nH]1 426677709 PUYOINTVSGHMCV-UHFFFAOYSA-N 385.493 2.873 0 50 GFAA CCn1nnc(-c2cccc(NC(=O)N3CCO[C@H](c4ccccc4)C3)c2)n1 426719808 FVJJRWDABUFAMS-SFHVURJKSA-N 378.436 2.965 0 50 GFAA CON(C[C@H]1CCC[C@H](C)C1)C(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 290353461 JMTODSXCTFLSNB-RYUDHWBXSA-N 381.860 2.594 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)NC[C@](C)(O)c2ccc(F)cc2F)ccn1 293512885 XKLWGVWCOWCILC-IBGZPJMESA-N 377.391 2.592 0 50 GFAA CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CC(=O)N(C)c3ccccc32)cc1 178199395 NAKYDVRFHVIBHM-INIZCTEOSA-N 380.444 2.985 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N2CCOCC2)c1 95502982 KSJUTKIJYYIMEB-UHFFFAOYSA-N 388.508 2.953 0 50 GFAA CCCc1nnc(N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)s1 91645034 MBEVCDHUFPBLNO-OAHLLOKOSA-N 378.542 2.879 0 50 GFAA CCSc1ccc(NC(=O)NC2CCN(CC(=O)NC3CC3)CC2)cc1 97514378 SLAMMFGAECOODO-UHFFFAOYSA-N 376.526 2.663 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(Cc2nc(C)n3ccccc23)CC1 96164014 HSVJIDFCHVTNNL-UHFFFAOYSA-N 381.528 2.695 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2ccc3c(c2)CCO3)CC1 95361683 IABDOZIYQWOIPV-UHFFFAOYSA-N 382.508 2.790 0 50 GFAA Cc1cccc(C)c1CC(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 181356514 KSTBKKHRZCSCAU-SFHVURJKSA-N 378.538 2.699 0 50 GFAA CC(C)Cn1cnc(S(=O)(=O)Nc2ccccc2-c2nnnn2C(C)C)c1 181796545 ZAHVYQCAKIUWED-UHFFFAOYSA-N 389.485 2.574 0 50 GFAA C[C@@H](NC(=O)N1CCOCC2(CCOCC2)C1)c1ccc(-n2cccn2)cc1 181878153 SDEQRPXARFIZQW-QGZVFWFLSA-N 384.480 2.772 0 50 GFAA COc1ccccc1-c1nc(C(=O)N(CCC(=O)O)C[C@H]2CCCO2)cs1 299753845 ZOBDJMRJCSSPML-CYBMUJFWSA-N 390.461 2.915 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2)c1)N1CC2(CCOC2)C1 296714586 FTLGJEIYVJRFIZ-UHFFFAOYSA-N 387.461 2.742 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)c1 299338348 FTDAEVZVCXJBFP-KMUNFCNLSA-N 385.869 2.601 0 50 GFAA CC(=O)N[C@@H]1CCN(C(=O)c2cccc(-c3ccc(N(C)C(C)=O)cc3)c2)C1 299790784 CBUFSCLWCJHVGN-HXUWFJFHSA-N 379.460 2.687 0 50 GFAA Cc1ccc(-n2cnnn2)cc1NC(=O)N(C)Cc1noc(C2CCCC2)n1 299787480 XQTPNVPEJZOHRO-UHFFFAOYSA-N 382.428 2.675 0 50 GFAA Cc1cc2[nH]cc(C(=O)NC[C@@H](c3ccccc3)N3CCCCCC3)c(=O)n2n1 825292081 PEVQOUIACCPUTE-IBGZPJMESA-N 393.491 2.678 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)c2nncn2C(C)C)c2c1CCCC2 670447709 SVOFGWCSMYMCEN-ZDUSSCGKSA-N 378.498 2.786 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)NC(C)(C)C)cc1 952986916 LQVSTPROHZUJSD-DLBZAZTESA-N 389.496 2.931 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)c2cnc(-c3ccncc3)nc2)c1 952860261 KBTDOFOZPGSGFG-UHFFFAOYSA-N 377.404 2.684 0 50 GFAA C[C@@H](NC(=O)c1cnc2ccccn2c1=O)c1cnn(-c2ccccc2F)c1 952989329 TZENGPDLMLPSQJ-CYBMUJFWSA-N 377.379 2.510 0 50 GFAA C[C@@H](C(=O)NCC1(O)C2CC3CC(C2)CC1C3)c1nnc(O)c2ccccc12 952987561 KAPFMXQUMXEQSI-CVCZQLCKSA-N 381.476 2.742 0 50 GFAA Cc1nnc(-c2ccccc2C(=O)NC2CCC(Oc3cnccn3)CC2)o1 189034382 QVNCRZHFIHXYKX-UHFFFAOYSA-N 379.420 2.955 0 50 GFAA C[C@H](NC(=O)CSc1nc(=O)cc(N)n1-c1ccccc1)c1ccccc1 657248 RCEGTTUIVPAPDG-AWEZNQCLSA-N 380.473 2.784 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)Cn1cnc2ccc(Cl)cc2c1=O 624861 ZGNLVEJOZGXZGA-UHFFFAOYSA-N 385.807 2.865 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(OC)c1OC 862470 XHQDBRHJFNOJHW-SFHVURJKSA-N 397.431 2.979 0 50 GFAA CCN(CCn1cccn1)Cc1ccccc1OC[C@H](O)CN1CCCCC1 15064985 OAQNLIFMCUOIIF-OAQYLSRUSA-N 386.540 2.631 0 50 GFAA CC(C)(C)SCCNC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 2881076 XRDFYSFXWWBKLC-UHFFFAOYSA-N 396.937 2.893 0 50 GFAA Cc1ccccc1OCc1nnc(SCC(=O)Nc2nccs2)n1C 4735886 XKNZDDLNYUCWOQ-UHFFFAOYSA-N 375.479 2.890 0 50 GFAA O=C([C@H]1COc2ccccc2O1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857672255 NOZLQBMDTLSJNZ-HXUWFJFHSA-N 375.428 2.844 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3-c3ccc(NS(C)(=O)=O)cc3C)c2n1 1857672879 IXUBCXJAUBYWLL-UHFFFAOYSA-N 396.476 2.879 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3cnn(C)c3)oc2c1 1857710223 MPPALZCGUXVHJA-PMACEKPBSA-N 396.491 2.927 0 50 GFAA Cc1c(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)[nH]c2c1C(=O)CCC2 1857736971 XYNUUFMPLKIBSV-UGKGYDQZSA-N 395.503 2.986 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CC[C@H](CN2CCOCC2)C1)c1ccccc1 266273866 YHMVPOKFSOUMPX-GOSISDBHSA-N 393.487 2.733 0 50 GFAA C[C@H](NC(=O)[C@@H]1COc2ccc(O)cc2O1)[C@@H](O)c1c(F)cccc1Cl 866791173 WJVILMIOUZMVMW-WIVTXXNASA-N 381.787 2.563 0 50 GFAA O=C(N=c1cc(C2CCOCC2)o[nH]1)NC[C@H](CO)c1ccc(Cl)cc1 1875257832 WXGFPAUQGIWRJP-CQSZACIVSA-N 379.844 2.542 0 50 GFAA Cn1cc(CNC(=O)N2CC[C@@H](C3CC3)[C@@H]2c2nc(O)n[nH]2)c2ccccc21 1875402219 CIRKKDUYYSQKRY-DOTOQJQBSA-N 380.452 2.685 0 50 GFAA CN(C)S(=O)(=O)C1(CNc2nc(-c3ccccn3)nc3sccc23)CC1 884688417 CAAMMASXJHZGIV-UHFFFAOYSA-N 389.506 2.589 0 50 GFAA Cc1cnn(C2CCN(S(=O)(=O)c3cnc4onc(C5CC5)c4c3)CC2)c1 2325752463 GCPZQFMXLMUHMW-UHFFFAOYSA-N 387.465 2.631 0 50 GFAA Cc1ncc(CN2CCC3(CCC3)S(=O)(=O)CC2)c2c1OC(C)(C)OC2 2325779489 JKVISSDEZFHVAQ-UHFFFAOYSA-N 380.510 2.578 0 50 GFAA CCCCc1ccc(CC(=O)NC2(CNC(=O)[C@@H]3CCN(C)[C@@H]3C)CC2)cc1 2325793738 GKIIXLDCOASNPF-YLJYHZDGSA-N 385.552 2.677 0 50 GFAA O=C1N[C@H](c2cccc(Cl)c2)[C@H](C(=O)c2cccnc2)[C@](O)(C(F)(F)F)N1 4086339 JMWAGBGINOXEHS-IOASZLSFSA-N 399.756 2.839 0 50 GFAA CN(CCn1cccn1)C(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 111918848 VVMADFIZKPNBNK-UHFFFAOYSA-N 399.838 2.821 0 50 GFAA O=C(Nc1ccc(Br)nc1)c1cc(N2CCNC2=O)c(F)cc1F 134079253 LXKWBTQWIAVMCY-UHFFFAOYSA-N 397.179 2.904 0 50 GFAA CC(=O)N(Cc1ccco1)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1=O 100560675 JBDRWVRGEDGSIT-HNNXBMFYSA-N 391.221 2.723 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)CSc2nnc(C)s2)s1 23251548 OUXROXDKLDULPX-SNVBAGLBSA-N 382.536 2.723 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2ccc(Br)nc2)C1 124125062 KFRAAOBSCKAZDV-LBPRGKRZSA-N 384.274 2.973 0 50 GFAA CN1CCN(c2cc(C(=O)N3CC[C@@H](Cc4ccc(F)cc4)C3)ccn2)CC1 119507863 FMQSRESRBQGPFL-SFHVURJKSA-N 382.483 2.677 0 50 GFAA O=C(CCN1CCCCO1)NCc1cccnc1N1CCc2ccccc2C1 39466138 JYPGISMPBNOAIU-UHFFFAOYSA-N 380.492 2.678 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2cnc(Cl)s2)CC1 328625389 DCUYCWVJYVVGLH-OAHLLOKOSA-N 379.917 2.990 0 50 GFAA Nc1ncc(CN2CCC(Oc3ccc(C(=O)N4CCCCC4)cc3)CC2)cn1 12441985 MGYMIFIUWHCLHP-UHFFFAOYSA-N 395.507 2.728 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2CC(=O)N[C@@H](C)c2cccs2)n1C 431952179 QCBIOVISYCKKIT-GOEBONIOSA-N 388.537 2.851 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N[C@H]2c3ccccc3C[C@@H]2O)CC1 123565254 ZWFUSNQMHGZIRH-VXKWHMMOSA-N 379.504 2.917 0 50 GFAA C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)[C@@H]1CN 156813518 HMBYRNYOSSYKBC-OXJNMPFZSA-N 386.517 2.860 0 50 GFAA Cn1ccnc1[C@H]1c2[nH]cnc2CCN1Cc1cn[nH]c1-c1cccc(F)c1 71416294 CAINTZVIQJCIFO-LJQANCHMSA-N 377.427 2.820 0 50 GFAA NC(=O)CC[C@@H]1CCCN(c2nnnn2Cc2ccc(-c3ccccc3)cc2)C1 77486101 LFCSLZOXIBIYPR-KRWDZBQOSA-N 390.491 2.870 0 50 GFAA Cc1cccc(OC[C@H]2CCCN(C(=O)CCc3c(C)nc(=O)[nH]c3C)C2)c1 72431323 REQPKLCUWUAIID-SFHVURJKSA-N 383.492 2.945 0 50 GFAA CO[C@@H]1COC[C@H]1n1cc(C(=O)N2CC=C(c3cccc4ccccc34)C2)nn1 377684218 WENGUKPIDDOSTK-NHCUHLMSSA-N 390.443 2.557 0 50 GFAA COc1cc(NC2CCN(C(=O)c3ccc(C(N)=O)cc3)CC2)cc(OC)c1 378042566 HERTTWJNWMRXEM-UHFFFAOYSA-N 383.448 2.519 0 50 GFAA O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)[C@H]1CCCN1Cc1ccccc1 173260142 KQBQXEZNGICBRL-QGZVFWFLSA-N 397.441 2.568 0 50 GFAA O=C([C@@H]1CCCCN1Cc1ccccc1)N1CCN(c2ccccc2)C(=O)C1 82096564 DGYQRGDQGZFUSU-NRFANRHFSA-N 377.488 2.917 0 50 GFAA CC[C@H](NC(=O)c1ccc(-c2cc(C(=O)O)ccn2)cc1)c1ncnn1CC 426412993 PSSKNHFDGQBRCU-INIZCTEOSA-N 379.420 2.939 0 50 GFAA Cc1ccsc1CCNC(=O)c1ccc([C@H]2CCCN2C(=O)CN)s1 20868649 YHHNEZWRGGJBDE-CYBMUJFWSA-N 377.535 2.713 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccc4[nH]cnc4c3)CC2)CN1C[C@H]1CCCO1 91326295 GKUCOEAAGBGRRC-QGZVFWFLSA-N 396.491 2.587 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(OCc3cccnc3)CC2)c2cc(F)ccc2N1 92045798 BRQFYAKMSFODEK-SFHVURJKSA-N 383.423 2.854 0 50 GFAA COc1ccc(CN2CC(c3ccccn3)C2)c(OC[C@H](O)CN2CCCC2)c1 95519278 LIEVLRUSRVPXHJ-HXUWFJFHSA-N 397.519 2.525 0 50 GFAA CC[C@@]1(C)CC(=O)c2cc(NC(=O)N3Cc4nc(C)[nH]c(=O)c4C3)ccc2O1 96148417 ZFRLURQZMICWIG-FQEVSTJZSA-N 382.420 2.760 0 50 GFAA CN1CCCCC[C@H]1C(=O)N1CCC2(CC1)CCN(Cc1ccccc1)C2=O 95380379 YYKBFCGJTORCBN-FQEVSTJZSA-N 383.536 2.902 0 50 GFAA CO[C@@H]1CCCN(C(=O)c2cnc(COc3ccc(C(C)(C)C)cc3)[nH]c2=O)C1 91494482 UHCWHPPDHJWOFW-QGZVFWFLSA-N 399.491 2.897 0 50 GFAA Cc1ccccc1N1CCCN(C(=O)Nc2cccc(-n3cnnn3)c2)CC1 95513164 NMPVMBWQULQOEV-UHFFFAOYSA-N 377.452 2.715 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N(C)C[C@H](C)O)cc3o2)cc1OC 95526104 JSAZUBIZEJCKSZ-ZDUSSCGKSA-N 384.432 2.889 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@@H]2NS(=O)(=O)c1cn(C)cn1 91254484 CPQOYDFEAMCRLK-INIZCTEOSA-N 399.520 2.906 0 50 GFAA COCc1nc(O)cc([C@H]2C[C@@H](NC(=O)c3ccc4sc(C)nc4c3)C2)n1 240824804 QKYWSGUGMZNZOQ-BETUJISGSA-N 384.461 2.923 0 50 GFAA Cc1cc(F)ccc1-n1ccc(C(=O)Nc2ccc(N3CCOCC3)cn2)n1 183275231 ITPQNUVBPGOHJJ-UHFFFAOYSA-N 381.411 2.804 0 50 GFAA COc1cccc(C(=O)NCC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)c1 183218343 BCWYEVJZYHAQLS-UHFFFAOYSA-N 392.459 2.708 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N[C@@H]1CCCN(c2cccnc2)C1=O 183748868 LPXHBVKFIHLFFZ-LJQANCHMSA-N 390.447 2.644 0 50 GFAA CNC(=O)c1cc(NC(=O)NC2CCN(c3ccccc3)CC2)ccc1OC 299801523 ZTLACWPCJMICCS-UHFFFAOYSA-N 382.464 2.845 0 50 GFAA O=C([C@H](c1ccc(F)cc1)N1CCCCC1)N1CCCN(c2ncccn2)CC1 826583371 USVSPCKHQKPDCY-FQEVSTJZSA-N 397.498 2.882 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@H](N(C)C)CC[C@H]2C1 1356153590 KNZSJCRBUNJOOO-MTQWCTHYSA-N 387.524 2.533 0 50 GFAA CN1CCC[C@H]1C(=O)N1CCN(c2cc(C(F)(F)F)nc3ccccc23)CC1 952970889 QBXPYIBUGIWMKP-INIZCTEOSA-N 392.425 2.996 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccc2scnc2c1)c1cccc(F)c1 952981714 NLDXQEOQFDVPTB-UHFFFAOYSA-N 379.438 2.840 0 50 GFAA Cc1c(NC(=O)Cn2c(C)cc(=O)c3ccccc32)cccc1C(=O)N(C)C 952988575 JRAIKZGIAJJBSS-UHFFFAOYSA-N 377.444 2.959 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)[C@H]1C[C@H]2C=C[C@@H]1C2 1565506677 UYCLYPZSVYYVGZ-RDGPPVDQSA-N 395.503 2.564 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCc4c(F)cc(F)cc4C3)ccc2N1 408338928 NBKPPUZPXFSRDZ-UHFFFAOYSA-N 392.427 2.987 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)Nc1ccccc1C(F)(F)F 170596466 GQHKJTJZRFWSQH-OLZOCXBDSA-N 379.404 2.687 0 50 GFAA O=C(NCc1ccc2c(c1)OCCCO2)NC1CCN(Cc2ccncc2)CC1 171158784 QRKVMFCLKHOZDU-UHFFFAOYSA-N 396.491 2.707 0 50 GFAA Cc1nnc(S)n1CCNC(=O)[C@H]1C[C@H]1c1ccccc1Br 170644561 SKPPOGJKLLWESJ-RYUDHWBXSA-N 381.299 2.558 0 50 GFAA CN(C)Cc1cc(CNC(=O)CCc2nc(-c3ccccn3)no2)ccc1F 170627242 GYADFHPOKUBDKF-UHFFFAOYSA-N 383.427 2.581 0 50 GFAA CCc1ccc([C@@H]2CN(C(=O)Nc3cnn(-c4ncccn4)c3)CCO2)cc1 192279464 UOSOTCMLLFPFPI-SFHVURJKSA-N 378.436 2.830 0 50 GFAA C[C@H](C(=O)NCc1nc2cccnc2[nH]1)N1CCC(Cc2ccccc2)CC1 194230431 ZLZJTMCPNGOOMO-MRXNPFEDSA-N 377.492 2.917 0 50 GFAA CCn1nc(C)cc1C(=O)NC[C@@H]1CCCN(CCn2cnc3ccccc32)C1 1506399810 QMHOILXMOVDYDX-SFHVURJKSA-N 394.523 2.703 0 50 GFAA C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1ccc2c(=O)n(C)cnc2c1 1506416548 FATDRNXVPUAVEM-ZDUSSCGKSA-N 379.416 2.538 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CCN4[C@@H](C5CC5)COC[C@H]4C3)o2)c1 1529174942 ZCVUMIMUKNXYKN-IEBWSBKVSA-N 382.460 2.890 0 50 GFAA O=C(N[C@H]1COC[C@H]1Cc1ccnc2ccccc12)c1ccccc1-n1cnnc1 1704347484 MQIGREBVMRDLEB-UTKZUKDTSA-N 399.454 2.803 0 50 GFAA CC1=C(C(=O)OCc2ccc3c(c2)OCO3)[C@@H](c2ccc(F)cc2)NC(=O)N1 812918 QCGHTRAZOATGMB-GOSISDBHSA-N 384.363 2.926 0 50 GFAA COC(=O)c1ccccc1C(=O)N1CCC[C@@H](CNC(=O)c2ccc(F)cc2)C1 11709976 AZIWMCUUDHSEQC-HNNXBMFYSA-N 398.434 2.895 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)c(C)c1 13009124 MHZLYDIYSJVDEG-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccc2oc(CCc3ccccc3)nc2c1 14952273 SFCXKFPGMIOVSV-MRXNPFEDSA-N 398.484 2.778 0 50 GFAA O=S(=O)(N[C@H]1c2cccc3cccc(c23)[C@@H]1N1CCNCC1)c1ccccc1 19810987 DFHHBGRWPZJXGB-VXKWHMMOSA-N 393.512 2.819 0 50 GFAA Cc1cccc(NC(=O)Cn2ccn3nc(-c4ccccc4)c(CO)c3c2=O)c1 169752504 WWUJIBAJSAFMPZ-UHFFFAOYSA-N 388.427 2.602 0 50 GFAA COc1ccc(CCC(=O)NC[C@@H](C)NC(=O)CCc2ccc(OC)cc2)cc1 6183542 LOBDPOWDLXHJPS-QGZVFWFLSA-N 398.503 2.890 0 50 GFAA Cc1cccc(SC2CCN(C(=O)c3cc4n(n3)CCN(C)C4=O)CC2)c1 1857696674 KZQMNHCBQHSSHY-UHFFFAOYSA-N 384.505 2.674 0 50 GFAA CCc1cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccsc4)[C@H]4CC[C@]3(C2)O4)on1 1857732218 HWDIQZLTCNNONR-JRBPQWBISA-N 387.505 2.708 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCC(C)(C)N(C)C)C3)nc2c1 1857740528 RIGBRWMAZKHGLJ-HNNXBMFYSA-N 388.512 2.899 0 50 GFAA O=C1O[C@H]2CN(Cc3ccc4c(c3)OCCO4)C[C@H]2N1CCc1ccc(F)cc1 206659460 XABPTPPSCGHZCW-NQIIRXRSSA-N 398.434 2.845 0 50 GFAA NC(=O)[C@@H]1CCCCN1C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 120365981 QWIRPGBPLCLBIJ-AWEZNQCLSA-N 399.451 2.615 0 50 GFAA Cc1ccc(C)c(-n2ncc(C(=O)N3CCC[C@@H]3CN3CCOCC3)c2C)c1 124949466 MVBGWMTZSFPZTB-LJQANCHMSA-N 382.508 2.734 0 50 GFAA Cc1cc(C(=O)N2CC[C@](C)(C(=O)O)C2)nn1-c1ccc(Br)cc1 237709613 GXJCFGDLQMTJGY-KRWDZBQOSA-N 392.253 2.880 0 50 GFAA CC(C)CNC(=O)c1cn([C@H]2CCCN(C(=O)/C=C/c3cccs3)C2)nn1 14987130 OQHZWQXZEVQMFG-KIUWMYQTSA-N 387.509 2.602 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCc2ccccc2[C@@H]1C(N)=O)c1ccc(Cl)cc1 370787777 HMKTYDLNSRUHOS-UYAOXDASSA-N 399.878 2.519 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCOC[C@H]2c2c(C)nn(-c3ccccc3)c2C)c[nH]1 952888109 NUEXFIFKPIPSER-IBGZPJMESA-N 392.459 2.700 0 50 GFAA COc1ccccc1-c1ccnc(N2CC[C@@H](C3CC3)[C@@H]2c2nc(O)n[nH]2)n1 1875399571 CYWSQWOJTVDUEZ-SUMWQHHRSA-N 378.436 2.954 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)c1csc(Cc2ccc(Cl)cc2)n1 1321746039 CVKFZXJCKMBXPZ-UHFFFAOYSA-N 393.877 2.901 0 50 GFAA Cc1cc(=NC(O)=C2C=C(c3ccccc3)N=N2)n([C@@H]2CCS(=O)(=O)C2)[nH]1 2083582269 VGEYAFDIBLNVPJ-CQSZACIVSA-N 385.449 2.619 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c1C(=O)N1CCN(C)[C@H](Cc2ccccc2)C1 2325773530 QRBOWTIXQPLZEZ-LJQANCHMSA-N 375.476 2.779 0 50 GFAA C[C@@H](CNC(=O)C(C)(C)c1cccnc1)N(C)C(=O)C[C@H]1CCC(C)(C)CO1 2325794019 ODZSWIKBKWKTKV-FUHWJXTLSA-N 389.540 2.918 0 50 GFAA N[C@@]1(c2ccccc2)CCN(C(=O)NCc2c(F)cccc2-n2cccn2)C1 2325860123 YGHNWNGIGNSULQ-NRFANRHFSA-N 379.439 2.781 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1=O 2356139385 WVZOKDBZHNKFMZ-LJQANCHMSA-N 382.863 2.652 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2Cc2cnc(=NCc3ccccc3)[nH]c2)C1=O 2356167046 GMWYSTUOIMIBIX-QHCPKHFHSA-N 393.535 2.876 0 50 GFAA CCn1c(S[C@H](C)C(=O)Nc2nnc(C)s2)nnc1-c1ccncc1 4736477 GOTKVRIWPARAJE-SECBINFHSA-N 375.483 2.639 0 50 GFAA Cc1cccc([C@H](NC(=O)C2CCN(S(C)(=O)=O)CC2)c2ccccc2)c1 65361999 VIFSBNNRGTVKEN-HXUWFJFHSA-N 386.517 2.872 0 50 GFAA COC[C@H]1CCC[C@H]1NC1CCN(c2ccc(N3CCN(C)C3=O)cc2)CC1 23312182 DIGZVMJEAMYYTO-DYESRHJHSA-N 386.540 2.932 0 50 GFAA CCn1ccc(CN(C)C(=O)[C@@H](Cc2cccnc2)NC(=O)c2ccccc2)c1 252491594 LOEFHHNDIBUVGJ-OAQYLSRUSA-N 390.487 2.903 0 50 GFAA Cc1cc(C(F)(F)F)n(-c2nc(C(=O)N[C@H]3CC[C@H]3NC(C)C)cs2)n1 72473039 RAPSFJSNCTYVCC-MNOVXSKESA-N 387.431 2.915 0 50 GFAA COc1cccc(-c2cc(C(=O)N3N=C(C(F)F)C[C@@]3(O)C(F)F)n[nH]2)c1 6420408 POXNCAGTLYKITG-MRXNPFEDSA-N 386.305 2.506 0 50 GFAA COc1ccc(C(=O)Oc2cc(N)n(S(=O)(=O)c3ccccc3C)c2)cc1 253427429 MKLNXFIRSQAEOG-UHFFFAOYSA-N 386.429 2.844 0 50 GFAA COc1ccc(Cn2cc(C(=O)N3CCC[C@H]3c3nc(C(C)C)no3)nn2)cc1 72145058 YWDGHEUXSSNOMO-KRWDZBQOSA-N 396.451 2.819 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(Cc1nnnn1C(C)C)CC2 328650291 VNVHOAQOPXLVSQ-KRWDZBQOSA-N 388.541 2.719 0 50 GFAA C[C@H](C(=O)N1CCCc2cc(Cl)cc(Br)c21)S(C)(=O)=O 332706169 WYPDWXAMKBPHBC-MRVPVSSYSA-N 380.691 2.815 0 50 GFAA O=C(Cn1cn[nH]c1=O)N[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 157256321 XGWIXDXSOUQJFO-DZGCQCFKSA-N 382.386 2.823 0 50 GFAA CCCCN1CCN([C@@H](C(=O)N(C)C2CCCCC2)c2ccccc2)C(=O)C1=O 77406794 KFTIKOLPCQPOFK-HXUWFJFHSA-N 399.535 2.990 0 50 GFAA Cc1ccc(NC(=O)CN(C2CC2)[C@@H]2CCc3ccccc32)cc1S(N)(=O)=O 157825735 OXKKODDXKDYPTM-LJQANCHMSA-N 399.516 2.733 0 50 GFAA COc1cc2nccc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)c2cc1OC 334023588 FMWBVEDLOIAPMT-IBGZPJMESA-N 376.478 2.657 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)NCCc3nc(-c4cccnc4)no3)cc2)n1 77458246 HBXHATXTFORYTE-UHFFFAOYSA-N 388.431 2.907 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(OCC(=O)O)cc2)c1 263006631 LGHNDFLDOSDNKJ-AWEZNQCLSA-N 384.432 2.733 0 50 GFAA CS(=O)(=O)C[C@H]1CCN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C1 292225065 ZUDATLAOVOIJPJ-NSHDSACASA-N 384.910 2.970 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2nnn(-c3ccc(-c4ccccc4)cc3)c2C)C1 179002432 MSTTULPRZNUAHB-KRWDZBQOSA-N 375.476 2.924 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC(Cc3nncn3-c3ccccc3)CC2)n1 82096503 YICBHJJZKHWWMQ-UHFFFAOYSA-N 392.507 2.952 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC(c3nccn3CCCN(C)C)CC2)s1 95360975 GMJZVMUHUHKVFI-UHFFFAOYSA-N 375.542 2.928 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)c2cc3c(n(C)c2=O)CCCC3)cc1 426534450 MGVXVYXZHNKFJT-UHFFFAOYSA-N 376.460 2.688 0 50 GFAA CC(C)Cc1nc(CNC(=O)N2CCN(C/C=C/c3ccccc3)CC2)no1 426434186 ZPIBSUDKSGMSCY-RMKNXTFCSA-N 383.496 2.809 0 50 GFAA O=C(N[C@@H]1CCSC1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91998000 JTLDHRMPUYTXCL-SECBINFHSA-N 384.288 2.903 0 50 GFAA Cc1cccc2nc(C(=O)N3C[C@H]4CC[C@@H]3CN(Cc3ccncc3)C4)cn12 92098593 XYSHIBBNZDVKKZ-RBUKOAKNSA-N 375.476 2.774 0 50 GFAA Cn1cccc1C(=O)C(=O)N1C[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2 95383777 ZEWDHJQLLGXZLQ-VQTJNVASSA-N 379.504 2.763 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)C2CCN(C3CCCCC3)CC2)on1 97594817 WXOOUDYFBYTRGB-XLIONFOSSA-N 375.513 2.701 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95390660 AHJCQSUKFNKHLK-SFHVURJKSA-N 386.459 2.994 0 50 GFAA Cc1noc(CN2CCC[C@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n1 95508022 UPPVEKHLOLTHKQ-CQSZACIVSA-N 378.423 2.965 0 50 GFAA Cc1ccc2ncccc2c1CNC(=O)[C@@H](c1cccnc1)N1CCOCC1 95502571 XFGFNAPZUHDGGC-OAQYLSRUSA-N 376.460 2.628 0 50 GFAA O=C(c1cc(Cl)ccc1-n1cnnn1)N1CCO[C@@H](CCc2ccccc2)C1 183339129 MLFUTGJZILJHEN-KRWDZBQOSA-N 397.866 2.790 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)c1cccc(-c2cc(N)ncn2)c1)C1CC1 299789402 ZMEAGGUFDJJKLW-UHFFFAOYSA-N 376.464 2.881 0 50 GFAA COc1ccc2nc(CNC(=O)c3cn(C)c4ccc(C)cc4c3=O)[nH]c2c1 670451091 HONALHNWBYTEPD-UHFFFAOYSA-N 376.416 2.662 0 50 GFAA O=C1[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)N1CCS(=O)(=O)c1ccc(Cl)cc1 170592489 UJOARQYFMKELOE-RCBQFDQVSA-N 396.896 2.709 0 50 GFAA COc1ccc([C@@H](CN2C(=O)[C@H]3Cc4ccccc4CN3C2=O)N(C)C)cc1 170613694 USOXKHBRWBJRLW-WOJBJXKFSA-N 379.460 2.687 0 50 GFAA CC(C)C[C@@H]1C(=O)NCCN1C(=O)c1cnc(-c2ccc3c(c2)CCO3)s1 189046770 UTYWRXKLNVZGDG-OAHLLOKOSA-N 385.489 2.732 0 50 GFAA COCCN(C)c1ccc(CN2CCC[C@@H](C(=O)Nc3cccc(C)n3)C2)cn1 191242128 ZHGCROYWZBAHLX-LJQANCHMSA-N 397.523 2.718 0 50 GFAA Cc1cc(C[C@@H]2CN(c3nc4c(c(C(F)(F)F)n3)CCCC4)C[C@@H]2O)on1 1704334259 HDGDTQMANCIQFF-ABAIWWIYSA-N 382.386 2.710 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)c1ccc(-c2noc(C3CC3)n2)cc1 1704313085 NEYXMNFVJDUSIC-UHFFFAOYSA-N 394.479 2.850 0 50 GFAA Cc1c(NC(=O)c2ccco2)cccc1C(=O)N1C[C@H]2CCCN2C(=O)[C@@H]1C 1772707405 ZJZBFTOPQUIHJA-LSDHHAIUSA-N 381.432 2.676 0 50 GFAA Cc1cccc(CN2C[C@@H]3CN(CCOc4ccc(F)cc4)C[C@@]3(CO)C2)c1 1772807464 NVAATZAAWPJKFW-REWPJTCUSA-N 384.495 2.939 0 50 GFAA Cc1noc(CN2C[C@@H]3CN(Cc4cc[nH]n4)C[C@]3(CCc3ccccc3)C2)n1 1772813996 DRMBNYRLKVYTEO-SIKLNZKXSA-N 392.507 2.668 0 50 GFAA O=C1CC[C@H](C(=O)NC[C@@H]2Cc3cc(-c4ccsc4)cc(Cl)c3O2)N1 12048050 ZKXQZZIMUOQUDJ-DZGCQCFKSA-N 376.865 2.767 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)Cc2ccc(F)cc2Cl)C1)N1CCOCC1 12192631 GXHAYSJPMLCUKU-OAHLLOKOSA-N 396.890 2.899 0 50 GFAA CCCn1cc(CN2CCC(CCC(=O)N3CCN(CC)CC3)CC2)c(C)n1 12432530 JNBWPXUQERQITA-UHFFFAOYSA-N 389.588 2.758 0 50 GFAA Cc1nn(C)cc1CN(C)C(=O)c1coc(COc2cccc(F)c2F)n1 12715766 WLIGWPJWYPDVGR-UHFFFAOYSA-N 376.363 2.846 0 50 GFAA COC(=O)[C@@H]1CCCCN1C(=O)c1cc(COc2ccc(C(C)=O)cc2)on1 12835562 DWKNJBSYDPJBAV-SFHVURJKSA-N 386.404 2.624 0 50 GFAA CCOC(=O)c1nn(CCC(F)(F)F)c2c1CN(C(=O)c1ccccn1)CC2 14754494 ZPWJBYJBCNEGPV-UHFFFAOYSA-N 396.369 2.606 0 50 GFAA CC(=O)N1CCN(c2ccc(NC(=S)NC(=O)c3cccs3)cc2)CC1 2592662 IETSUTMIHMBMHC-UHFFFAOYSA-N 388.518 2.543 0 50 GFAA CSCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O 4760713 BCFXIICWEDEFQM-HOTGVXAUSA-N 396.509 2.650 0 50 GFAA CCN(CC(=O)Nc1ccc(OC)c(Cl)c1)S(=O)(=O)c1ccccc1 4858387 FJQLPCCTDMZHQT-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA COCc1nnc([C@]23CC[C@H]2CCN3C(=O)Cc2cccc3cccnc23)o1 1857528877 OBXAXMKERQONCT-KKSFZXQISA-N 378.432 2.845 0 50 GFAA CCc1nnc([C@]23CC[C@H]2CCN3C(=O)CCn2cc(Br)cn2)o1 1857530442 QPOZSLWBEHEBDV-ZBEGNZNMSA-N 394.273 2.519 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ccc4sc(=N)[nH]c4c3)C1)CC2 1857698125 FAJLQZAOELOMMT-HXUWFJFHSA-N 395.488 2.633 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)C1(CCN(C3CCNCC3)CC1)OCC2 1857704067 CGIDFVOJVDTWMY-UHFFFAOYSA-N 389.565 2.646 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1cc(=O)c2ccccc2o1 1857722999 SRNMDPJNARFLHG-HYFFOGBASA-N 390.439 2.737 0 50 GFAA Cc1cccnc1C(=O)NC[C@H]1[C@H]2CN(Cc3cccs3)C[C@]23CC[C@H]1O3 1857725911 SNTZGZPXVDFGCG-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA CN(C)c1cccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857728140 PCEXGLBCNIQLCT-VIZSFHNOSA-N 391.471 2.667 0 50 GFAA O=C(NCc1ccc(Br)cc1Cl)c1cn(C2CCNCC2)nn1 237803833 STDZAMDAWAOCTG-UHFFFAOYSA-N 398.692 2.549 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)[C@H]2CC[C@H](C)CC2)CN1Cc1cccs1 249686116 GOTMFUCTGXEKRF-OVWQWFNUSA-N 377.554 2.770 0 50 GFAA CC(C)[C@H](NC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12)c1ccc2c(c1)OCCO2 252477428 NOPWPXWAUHQABO-HEFCMCLBSA-N 390.505 2.725 0 50 GFAA COc1cc(OC)c(C(=O)N2CCC[C@]3(CCc4cnc(C)nc43)C2)cc1OC 1704340288 FMSPAQCHKGUQFL-QFIPXVFZSA-N 397.475 2.931 0 50 GFAA CC(C)n1ncc2cc(/C=C/C(=O)Nc3ccc(F)c(NC(N)=O)c3)c(=O)[nH]c21 817213712 ZPMGJFCJKWAAQG-ZZXKWVIFSA-N 398.398 2.587 0 50 GFAA COCCC1(c2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)CCC1 952893874 LHCPARLIGFUFIV-CQSZACIVSA-N 387.484 2.743 0 50 GFAA CCNc1nc(C(=O)N2CCC(NC(=O)c3ccccc3F)CC2)cs1 952992522 DQOYMPWKMRUFKP-UHFFFAOYSA-N 376.457 2.749 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(Nc2cccnc2)cc1 1875403566 YYHPRBNIQXHHBO-CDHQVMDDSA-N 377.448 2.591 0 50 GFAA CC1(C)C[C@@H](S(C)(=O)=O)CN1C(=O)NCc1ccc(-c2ccsc2)nc1 1875405727 NDKCFQIJJAOTSI-OAHLLOKOSA-N 393.534 2.917 0 50 GFAA O=C(Nc1cnc2ccnn2c1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 888916884 OIJZJSWUXYVSSO-GFCCVEGCSA-N 388.378 2.731 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1 1446761988 IIYOQELTTJDCPR-UHFFFAOYSA-N 381.432 2.914 0 50 GFAA COc1ccc(C2(CNC(=O)C(=O)Nc3ccc(C)cc3)CCOCC2)cc1 2323140 QVDPISHAOZIWJJ-UHFFFAOYSA-N 382.460 2.807 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N(C)Cc3nc4ccccc4n3C)cn12 2100545125 QCLHCGHMXRLMRE-IBGZPJMESA-N 392.463 2.578 0 50 GFAA CS(=O)(=O)c1csc(S(=O)(=O)N2CCc3cccc(Cl)c32)c1 2325828514 JDIMNWJXCVXKMM-UHFFFAOYSA-N 377.896 2.556 0 50 GFAA CC1(C)NC(=O)N(C[C@H](O)COc2c(Cl)cc(Cl)cc2Cl)C1=O 1165572 RDOQRAQZSHKBNK-QMMMGPOBSA-N 381.643 2.717 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)nn1C(F)F 2356141961 XQMWXMBCPCEXIG-IBGZPJMESA-N 390.438 2.563 0 50 GFAA COc1ccccc1CNC(=O)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356146579 MHHBCEWWGODTIB-QSAZIKIQSA-N 391.471 2.643 0 50 GFAA COc1ccc(CN2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1O 2356153477 ITCFCGOMXHSBQC-SPEDKVCISA-N 388.508 2.661 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1 2770472 UZAIBIZLRWYXHP-UHFFFAOYSA-N 378.881 2.795 0 50 GFAA Cc1ccc(C(=O)N[C@H](C(=O)NCCN(C)C)C23CC4CC(CC(C4)C2)C3)cc1 4428164 GKWCPILEDIIPBG-ZNKOEICNSA-N 397.563 2.988 0 50 GFAA COc1ccc(F)c(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)c1 104449514 CUHJTEVIGVYYIS-HXUWFJFHSA-N 393.547 2.576 0 50 GFAA O=C(NC[C@H]1CCCO1)C1CCN(C2CCN(CCc3ccccc3)CC2)CC1 20542494 OCFDANAKTIQXDI-HSZRJFAPSA-N 399.579 2.701 0 50 GFAA CN1CCN(CCc2nc3cc(NC(=O)c4ccc(F)cc4)ccc3n2C)CC1 20503967 AGCGIILADZHBLQ-UHFFFAOYSA-N 395.482 2.755 0 50 GFAA CCOC(=O)CSc1nnc2[nH]c3c(c(=O)n12)[C@@](C)(CC)Cc1ccccc1-3 101170580 QNGJMQMZPDVAKP-FQEVSTJZSA-N 398.488 2.964 0 50 GFAA CCOc1cccc(CCNC(=O)NC2CCN(Cc3ccccn3)CC2)c1 136013118 JTPKRVFPULREHD-UHFFFAOYSA-N 382.508 2.987 0 50 GFAA Cc1nc(-c2ccc(C(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c2sccc2n1 2356096805 DTXGPJNDNJTOPG-CQSZACIVSA-N 387.486 2.584 0 50 GFAA Cc1nnsc1CN(C)C[C@@]1(O)CCCN(CCC2CCCCC2)C1=O 67842943 HBWMQMUMERAVJA-IBGZPJMESA-N 380.558 2.602 0 50 GFAA O=C(c1cc(CN2CCC[C@@H](O)C2)on1)N1CCC(Cc2ccccc2)CC1 67604593 FCPBTZKDRZSJGQ-LJQANCHMSA-N 383.492 2.726 0 50 GFAA Cc1cc(OC[C@H](O)CN2CCN(c3ccccn3)CC2)cc(C)c1Cl 2674808 QNKKBPVCPAIMBM-QGZVFWFLSA-N 375.900 2.914 0 50 GFAA Cc1cc(NC(=O)N2CCC(n3cnnc3O)CC2)cnc1N1CCCC[C@@H]1C 375463517 CHSSICGHFYBXHV-HNNXBMFYSA-N 399.499 2.935 0 50 GFAA O=C1CC[C@]2(CCCN(Cc3ccc(-c4ccccn4)cc3)C2)CN1CCO 77301594 QMWCMXIDNBQTMK-QHCPKHFHSA-N 379.504 2.946 0 50 GFAA O=C([C@H]1CSCN1C(=O)c1c[nH]c2ccccc12)N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 333029408 BKMSTSLOJKMBIE-YAUBAPCASA-N 393.512 2.964 0 50 GFAA Cc1cc(N2CC[C@@H](N3CC4(CCOCC4)[C@@H]3c3ccccc3)C2=O)n(C)n1 333194985 VZEJDYVZXQEATD-QUCCMNQESA-N 380.492 2.688 0 50 GFAA COCc1nc(NCc2cc(-c3cccc(OC)c3)no2)c2cnn(C)c2n1 72447493 NBXOENUXYKBANL-UHFFFAOYSA-N 380.408 2.785 0 50 GFAA O=C(c1cnnn1-c1c(Cl)cccc1Cl)N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 333872401 UUFGLXYDNMIIDP-ANGCBRKESA-N 377.231 2.600 0 50 GFAA CS[C@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1N1CCCC1 241132818 JLYRAMLGIBZVJP-MSOLQXFVSA-N 383.521 2.745 0 50 GFAA O=C(c1cnc(NC[C@H]2CCCS(=O)(=O)C2)c(Cl)c1)N1CCCCC1 288468947 KKHNXYSSCRLHFM-CYBMUJFWSA-N 385.917 2.598 0 50 GFAA Cc1c(CNC(=O)N(CCO)CCSc2ccc(Cl)cc2)cnn1C 426551939 FYSACUDHZPMOIL-UHFFFAOYSA-N 382.917 2.678 0 50 GFAA O=C(NC[C@@H]1CCCCO1)c1ccc(-c2cc(C(=O)NC3CC3)ccn2)cc1 426510847 OITSDHRYCJJQTB-IBGZPJMESA-N 379.460 2.940 0 50 GFAA O=C(CCN1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1)NC1CC1 426397368 IVPKBFWBMAONBT-OAQYLSRUSA-N 377.479 2.921 0 50 GFAA Cc1nc(CCN(C)C(=O)N[C@@H](CCn2ccnc2C)c2ccccc2)no1 426398033 JBTIVULLOOJAFO-SFHVURJKSA-N 382.468 2.898 0 50 GFAA CSc1nc(N)cc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)n1 95502313 XEZFZKDELOPFCG-HNNXBMFYSA-N 381.509 2.805 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 95371226 DRTNNGDYPXMQII-UHFFFAOYSA-N 384.480 2.583 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)Cn3ncc4ccccc4c3=O)C2)c1 95361940 ULBUKCIJFZKNGM-SFHVURJKSA-N 391.427 2.501 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCN(c3ccncc3)CC2)cc1Cl 95510668 GLUXXHKDWCZYFE-UHFFFAOYSA-N 387.871 2.839 0 50 GFAA COc1cc(F)c(C(=O)N[C@H](c2ccc(OC)nc2)[C@H]2C[C@@H](O)C2)c(F)c1 244619934 FIUQTGWODPWJFJ-FTLABTOESA-N 378.375 2.619 0 50 GFAA CCCc1nnc(NC(=O)CN2Cc3cnc(-c4ccccc4)nc3C2)s1 244873469 WQXHWHNDQKBRJL-UHFFFAOYSA-N 380.477 2.902 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)CO[C@@H]2CCC[C@H](C)C2)cc1OC 299741686 ADIJIUFUQBNASN-IMJJTQAJSA-N 379.453 2.931 0 50 GFAA Cc1cc(NC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3)n(Cc2ccccc2Cl)n1 299776928 IJZJMRWFMNKZMB-CABCVRRESA-N 387.871 2.636 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 299754497 YPVITGAHYZKTAX-ACRUOGEOSA-N 383.536 2.758 0 50 GFAA biogenic O=C(Nc1cccc(/C=C/c2ccccn2)c1)N1C[C@H]2C[C@H](O)[C@H](O)C[C@H]2C1 299760237 DPTZIXCRITXXJM-HZYWHLHGSA-N 379.460 2.848 0 50 GFAA CCc1oc(C(=O)Nc2ccc(Oc3nn[nH]n3)cc2)cc1CN1CCCC1 823570792 RLYCBFVUKGSMMF-UHFFFAOYSA-N 382.424 2.996 0 50 GFAA COc1cc(C(=O)Nc2ccccc2NC(=O)CN(C)C)c2ccccc2n1 824852895 SUGQXKFBNSSTKV-UHFFFAOYSA-N 378.432 2.996 0 50 GFAA Cc1cc(-c2cccc(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)c2)cn2ccnc12 584891875 BMKBYIVQKMQTEF-GOSISDBHSA-N 383.473 2.569 0 50 GFAA O=C(NCCn1ccc2c(Cl)cccc21)c1ccc(F)c(-n2cnnn2)c1 828154455 GHDPLEAWODHMHG-UHFFFAOYSA-N 384.802 2.840 0 50 GFAA Cc1ccccc1OCCNC(=O)N1CCCC[C@@H]1CCN1CCOCC1 584895135 QWTKCJSKOBOPIA-LJQANCHMSA-N 375.513 2.660 0 50 GFAA CCOc1ccc(S(=O)(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc1 952980408 KRYWSKRQAVNGRN-SFHVURJKSA-N 376.478 2.850 0 50 GFAA COc1cc(C(=O)O)cc(C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)c1 952979972 GQCOTFLJGDKRSI-UHFFFAOYSA-N 396.403 2.828 0 50 GFAA Cc1ccc(-c2c[nH]cc2C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)s1 275117336 IDHFBSTWKBEFMU-UHFFFAOYSA-N 381.523 2.548 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)O 268929034 IHQBBFSQJQPLTC-IBGZPJMESA-N 384.432 2.998 0 50 GFAA COC(=O)[C@@](C)(NC(=O)Cn1cc(C2CC2)nn1)c1ccc(Cl)c(Cl)c1 170599524 MTXPQBCVEGUSEG-KRWDZBQOSA-N 397.262 2.667 0 50 GFAA O=C(NC1CCN(c2ccccn2)CC1)N1C[C@@H](CO)[C@H](c2ccsc2)C1 190267934 YTXWCPKTVVNDDN-WMZOPIPTSA-N 386.521 2.529 0 50 GFAA CCN(C[C@H]1CCCCO1)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506402281 VSRWBIDKVYYRLZ-SNVBAGLBSA-N 379.837 2.757 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N(C[C@H]1CCC(=O)N1)C(C)C 1506422999 RZXJPONXQYHEGR-CYBMUJFWSA-N 388.917 2.725 0 50 GFAA CC[C@@H](NS(=O)(=O)c1ccc(OC)c(Cl)c1)c1cn2cccnc2n1 1506430928 ZMXXMDMCPWWLSF-CYBMUJFWSA-N 380.857 2.821 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@H]1c1cccc(OC)c1OC 1057771 LXBUQFNLBKQEEU-HNNXBMFYSA-N 376.434 2.527 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)CCCc3ccc(Cl)cc3)CC2)[C@H]1O 1704301118 KXKHRCDCDUVLPF-RBUKOAKNSA-N 381.900 2.556 0 50 GFAA CCOc1ccccc1N(CC(=O)NC)S(=O)(=O)c1ccc(Cl)cc1 1144804 DWHALOUNIWOQCB-UHFFFAOYSA-N 382.869 2.680 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)CCn2cncn2)C1 11844037 CZADSRCCXAJXRX-AWEZNQCLSA-N 380.370 2.809 0 50 GFAA CC(=O)N1CCC(N2CC[C@@]3(CCCN(CCCc4ccccc4)C3=O)C2)CC1 12315684 SLKYGVSLBCXXHM-DEOSSOPVSA-N 397.563 2.945 0 50 GFAA O=C(Oc1cccnc1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 16607250 UTQGMSHWFPEYFQ-UHFFFAOYSA-N 380.853 2.741 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)Cc4ccc(F)cc4)C3)nn2)n1 169778130 LIELNQZFOYSXFI-OAHLLOKOSA-N 384.415 2.607 0 50 GFAA O=C(C[C@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1cccc2[nH]ccc12 206235790 ATJURXODROXAOF-GOSISDBHSA-N 376.416 2.660 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)cc1 4336827 LOBUABOINZONHD-UHFFFAOYSA-N 387.505 2.588 0 50 GFAA Cc1[nH]c(=N)nc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1Cl 1857673363 QRFALBBBXOYSJC-IBGZPJMESA-N 386.887 2.708 0 50 GFAA COC(=O)[C@@H]1CCCN1C(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857701780 WAELANRRORMVLG-HNNXBMFYSA-N 391.855 2.862 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)[C@@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857722070 DBVXYDWVJFXLSM-CQSZACIVSA-N 397.504 2.738 0 50 GFAA CNc1nccnc1N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857730120 YUQROSXJERENGH-OAQYLSRUSA-N 389.463 2.560 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCCOc2cccc3ccc(C)nc23)C[C@H]1N 1857730736 ZVVBLNAADPKNBD-IPMKNSEASA-N 385.508 2.961 0 50 GFAA CC1=C[C@@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@@H]4[C@]2(O)[C@@H]1O)[C@@H]1[C@@H](C[C@@H]3C)C1(C)C 504185756 ONMDPPVVEFWDOD-KSCGSJDBSA-N 388.504 2.614 0 50 GFAA biogenic O=C(Cn1ccc(C(F)(F)F)n1)NC1(c2nc3ccccc3s2)COC1 1875270996 ZLPOEYXDHZEIDI-UHFFFAOYSA-N 382.367 2.554 0 50 GFAA OC[C@@H]1CN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C2(CC2)CO1 1875318847 WTKDOEOOKPZZHY-AWEZNQCLSA-N 383.473 2.790 0 50 GFAA Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@]45CCCC[C@H]4C5)C3)CC2)s1 1875328152 BAAKAGVRUFIAHQ-KKSFZXQISA-N 387.549 2.605 0 50 GFAA O=C(NC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O)[C@@]1(Cc2ccccc2)CCc2ccccc21 1875405452 GPQXYIFVSGCPAW-NRJIPQFQSA-N 391.511 2.607 0 50 GFAA O=C([C@@H]1OC[C@H]2COCC[C@H]21)N(Cc1ccc2c(c1)OCCO2)C1CCCC1 885703027 IBQJLQQIYJHJPV-HGHGUNKESA-N 387.476 2.781 0 50 GFAA CCn1cnc2c(N3CC[C@]4(NC(=O)[C@@H]5C[C@H]5C5CC5)CCC[C@H]34)ncnc21 1775990170 DLJUUFOODXRCGZ-KGWSRGFLSA-N 380.496 2.510 0 50 GFAA Cc1ccc(C(=O)N[C@@]23CCC[C@H]2N(C(=O)[C@@H](C(C)C)N(C)C)CC3)s1 1775993392 ZUFWYMJLJXUDEF-MBOZVWFJSA-N 377.554 2.896 0 50 GFAA C[C@@]1(C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)c2[nH]ccc2-c2ccccc2)CCOC1 2325793158 IYHSYBKXKRGZKH-PNLZDCPESA-N 379.460 2.534 0 50 GFAA O=C(N[C@H]1C[C@@H](NC(=O)c2ccc(C(F)F)o2)C12CCC2)C1=CCOCC1 2325794995 ZCKKRACGJJSEHY-LSDHHAIUSA-N 380.391 2.721 0 50 GFAA COc1ccc([C@H]2CCCCCN2C(=O)Cc2ccc(-c3nn[nH]n3)nc2)cc1 2325808439 ZWPSRKNIYBZHCN-LJQANCHMSA-N 392.463 2.957 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)C(=O)NC[C@H](N)c2ccccc2)s1 2325860139 ZCLNSKAFUUPOGI-HNNXBMFYSA-N 380.473 2.873 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(C(=O)O)c2)ccc1C 1234545 WBHTZLYCQDAESO-UHFFFAOYSA-N 390.461 2.976 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)N=C(O)N(Cc2ccccc2)C1=O)c1cccs1 2863647 JAANGBYPFWYURS-OAHLLOKOSA-N 383.351 2.693 0 50 GFAA COC(=O)c1cncc(C(=O)N2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)c1 2356168354 ZZGQFXWKLBKMCR-VQPPSCEASA-N 380.444 2.628 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@@H]3CC(C)=C(C)C[C@@H]3C(=O)O)CC2)c1 6727037 NMRKHYOCKIUMBD-UXHICEINSA-N 386.492 2.787 0 50 GFAA COc1ccc(NC(=O)CS[C@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 100274178 HTCJIOQIQIHXCN-INIZCTEOSA-N 388.420 2.838 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)ccc1NCc1cccnc1 100582033 ZNFUSHNZKCNOBJ-KODHJQJWSA-N 389.411 2.703 0 50 GFAA COc1ccccc1OCc1cc(C(=O)N2CC(N3CCCC[C@H]3C)C2)n[nH]1 67789664 JNZUNTUYMWJXGA-OAHLLOKOSA-N 384.480 2.696 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)Nc1ccccc1C(=O)N1CCCC1 65361897 SHRHDLBPBAOEHO-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA C[C@@H]1Cc2cc(Br)cc3c(=O)c(C(=O)NC[C@@H]4CCCO4)cn1c23 33089172 YUWZOTCGDOVTOW-MFKMUULPSA-N 391.265 2.790 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc(O[C@@H](C)C(=O)O)cc3)CC2=O)cc1 72133085 DDFXVXQZEPLGTR-KRWDZBQOSA-N 382.460 2.691 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 150750988 LIDJUSKEMDSTKE-MRXNPFEDSA-N 380.427 2.652 0 50 GFAA COc1cc(NC(=O)N2CCCC[C@H]2c2cc[nH]n2)cc(S(C)(=O)=O)c1 376776573 HVDQNVGZEZIZIG-INIZCTEOSA-N 378.454 2.581 0 50 GFAA CC(C)c1cc(C(=O)N2CCCN(Cc3cccc(F)c3)CC2)nc2ncnn12 215392480 TWICKBPCJFARQR-UHFFFAOYSA-N 396.470 2.735 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCC[C@H](O)C1 71775686 XIGOPRXUSOLSPG-KRWDZBQOSA-N 398.532 2.667 0 50 GFAA O=S(=O)(c1cnc[nH]1)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 372229590 XIBOCNNYYSFRAR-AWEZNQCLSA-N 393.513 2.874 0 50 GFAA Cc1ccc(-n2nc(C(=O)N(C)CCc3noc(C)n3)c3c2CCC3)c(C)c1 285918337 UOBGQFGFHVDINT-UHFFFAOYSA-N 379.464 2.984 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N(C)Cc1nc(-c2ccccn2)no1 82091488 CZBUPKBIDIHAQN-UHFFFAOYSA-N 376.420 2.838 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC[C@@H](Cn2cc(C(C)(C)N)nn2)C1 48351439 AJKFMHWJAKFLLM-CQSZACIVSA-N 375.904 2.986 0 50 GFAA CC[C@@H](NC(=O)c1ccc(-c2cc(C(=O)O)ccn2)cc1)c1ncnn1CC 426412994 PSSKNHFDGQBRCU-MRXNPFEDSA-N 379.420 2.939 0 50 GFAA Cn1ncc2c(C(=O)N3CCN(Cc4cccs4)CC3)cc(C3CC3)nc21 20607636 HOPLBEIZQGYPMZ-UHFFFAOYSA-N 381.505 2.865 0 50 GFAA COCC(=O)N1CCC(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1 91519386 FKICHMVWFNXAKW-NRFANRHFSA-N 380.488 2.972 0 50 GFAA O=C(N[C@H](CO)c1ccccc1)c1cn(Cc2ccncc2)c(=O)c2ccccc12 253399895 DKIDNAOWQWHFIU-JOCHJYFZSA-N 399.450 2.908 0 50 GFAA biogenic COc1ccc(Cl)cc1CN(C)C(=O)NCC[C@H](C)N1CCN(C)CC1 534655575 XVSQLCGMTOIKRN-HNNXBMFYSA-N 382.936 2.516 0 50 GFAA COC(=O)c1cn(CCc2nc(-c3ccccc3)cs2)cc2c(=O)[nH]nc1-2 263588372 SMHQVLXLYJBTOQ-UHFFFAOYSA-N 380.429 2.829 0 50 GFAA O=C(NCCN1CCC[C@@H](CO)C1)c1cccc(OCc2cccc(F)c2)c1 828711160 LWHIKHKOJFAXEO-GOSISDBHSA-N 386.467 2.839 0 50 GFAA c1ccc(Cn2cccn2)c(CNC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)c1 952988191 ORUKAAAWOXKBKF-OTXOEQGISA-N 389.507 2.756 0 50 GFAA Cc1ccc2c(C)c(C(=O)N[C@H]3CCN(Cc4ccccn4)C[C@@H]3O)oc2c1 1565511987 GXOXGSZELOMGCP-OALUTQOASA-N 379.460 2.810 0 50 GFAA CC(C)c1csc(C(=O)N[C@H]2COCC[C@@H]2Oc2ccc(CO)cc2)n1 1565527275 BSMUFPOGJJIKEF-RDJZCZTQSA-N 376.478 2.725 0 50 GFAA Cn1ncc(NC[C@H](O)c2ccc(C(C)(C)C)cc2)c(Br)c1=O 169987960 AFPIRXYRUZLCJD-AWEZNQCLSA-N 380.286 2.986 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(N4CCCC4)ccn3)C2)nc1 188674840 CFRKPKQLJKYJBV-QGZVFWFLSA-N 393.491 2.876 0 50 GFAA COc1cccc([C@@H]2CCN(CC(=O)NCCc3ccc(F)cc3)C2)c1OC 1529159235 QTAMNGKQUATHHG-QGZVFWFLSA-N 386.467 2.991 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3ccnc(C(=O)O)c3)CC1)OCC2 1704309737 RXCBJSJGHIVRMI-UHFFFAOYSA-N 384.432 2.865 0 50 GFAA COc1cc(-c2onc(N3CCC[C@@]4(CCNC4)C3)c2C(=O)O)ccc1F 1772706991 OXFQQHIPKMKVLK-IBGZPJMESA-N 375.400 2.767 0 50 GFAA CCCCn1c(-n2ncnc2[C@@H]2CCCN(C(=O)CO)CC2)nc2ccccc21 1772814637 KVPCBASNKDKKBE-MRXNPFEDSA-N 396.495 2.506 0 50 GFAA CCOc1cc(CN2CCC3(CC[C@@H](CNC(C)=O)O3)CC2)ccc1OC 12158278 PQMMSQYOKHETIK-SFHVURJKSA-N 376.497 2.744 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)c2cccc(Cl)c2)C1 12587637 ZGDMNRZGZWPTHR-OAHLLOKOSA-N 395.912 2.974 0 50 GFAA O[C@H](COc1ccccc1CNCC1(O)CCCCC1)CN1CCCCC1 12592956 KDVIWGJBBKBAIT-FQEVSTJZSA-N 376.541 2.697 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCCN1CCOCC1)c1ccc(F)cc1 19835106 TVGUKTCMRZYIMX-UHFFFAOYSA-N 385.439 2.530 0 50 GFAA CCOc1ncccc1C(=O)N1CCC([C@@H](O)CN(C)Cc2ccccc2)CC1 1857729646 FZASLXPVVRVPLC-NRFANRHFSA-N 397.519 2.825 0 50 GFAA C[C@@H]1CN2C[C@H](NC(=O)Cc3ccccc3OCc3ccccc3)C[C@H]2CO1 1857736230 GFGJDZFGJXQHKM-UIFIKXQLSA-N 380.488 2.786 0 50 GFAA CS(=O)(=O)CCCN[C@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 368351499 HMOBHFVGWZMVSC-YLJYHZDGSA-N 393.480 2.601 0 50 GFAA Cc1ccc(N(C)C(=O)[C@@H]2CC(=O)N(C3CC3)[C@H]2c2cnn(C)c2C)c(F)c1 857629746 WTCVIISWIFCTPT-FOIQADDNSA-N 384.455 2.891 0 50 GFAA O=C(NCCN=c1ccc(F)c[nH]1)c1ccc(Nc2nccs2)cc1F 1875327442 XIAXCHZKHGWHJH-UHFFFAOYSA-N 375.404 2.824 0 50 GFAA OC[C@H]1CCN(c2ccc3nnc(-c4ccncc4)n3n2)C[C@H]1c1ccccc1 1875307712 SESRGIXBZGCUER-MOPGFXCFSA-N 386.459 2.789 0 50 GFAA COc1cccc(CN[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)n1 1875399159 QMECXLIHOFVRTR-PWIZWCRZSA-N 378.476 2.883 0 50 GFAA CC[C@H]1CC[C@H](C(=O)N2CCC(O)(CNC(=O)C(C)(C)C(F)F)CC2)CC1 1775990700 HDCZTNSRGLGUDT-SHTZXODSSA-N 388.499 2.964 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2csc(C)n2)C[C@H]1NC1CCOCC1 2100483116 SNTFULROPVVIRM-KFKAGJAMSA-N 395.569 2.800 0 50 GFAA Cn1c(=O)c2c(nc(NC3CCCCC3)n2CCCc2ccccc2)n(C)c1=O 637494 WCUSNMYRDOMHTE-UHFFFAOYSA-N 395.507 2.811 0 50 GFAA COCC1CC(NC(=O)C(=O)NCc2ccc(C)cc2O[C@H](C)CC(C)C)C1 2325760759 KETVJNPAJHWZED-LRYGQEGESA-N 390.524 2.966 0 50 GFAA CSCc1n[nH]c(CN2CCC(=O)N(CCC(C)(C)C(F)(F)F)C2=O)n1 2325779917 QGBFOZZKRISVOX-UHFFFAOYSA-N 393.435 2.801 0 50 GFAA Fc1cccc(N2CCN(CC3CCN(CCN4CCCCC4)CC3)CC2)n1 2325801711 SPEPZIWRTSTVLH-UHFFFAOYSA-N 389.563 2.541 0 50 GFAA COc1ccc(C2=CCN(C(=O)c3cnc(OC4CCOCC4)cn3)C2)cc1 2325816043 MIBGFHDPIZGEOP-UHFFFAOYSA-N 381.432 2.582 0 50 GFAA COc1csc(S(=O)(=O)Nc2cc(F)ccc2-n2cccn2)c1OC 2325826519 DPQQKUDCFVPFGM-UHFFFAOYSA-N 383.426 2.891 0 50 GFAA COc1cccc([C@H](CN)NC(=O)c2ccn3c(Br)cnc3c2)c1 2325859266 SYODTBHRHDWPKV-AWEZNQCLSA-N 389.253 2.535 0 50 GFAA COc1cccc(NC(=O)CNS(=O)(=O)c2cc(Cl)ccc2Cl)c1 665478 NMCKRKRDTUVXHG-UHFFFAOYSA-N 389.260 2.919 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3nccs3)o2)cc1OC 2720348 GRKDRAHGGICCHL-UHFFFAOYSA-N 378.435 2.941 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)cc1 4880086 JYCOEYQRWAWQBF-UHFFFAOYSA-N 378.519 2.774 0 50 GFAA COc1ccc(CCC(=O)NCCCNC(=O)CCc2ccc(OC)cc2)cc1 4903097 HZNOQXAJQCIGIX-UHFFFAOYSA-N 398.503 2.892 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)cc1 110597746 NLHHZCUKJIZYCB-JKSUJKDBSA-N 398.406 2.773 0 50 GFAA C[C@H](NC(=O)Nc1nnc(C(F)(F)F)s1)c1nc(-c2ccncc2)no1 23340459 BLUACOXLHLPVPS-LURJTMIESA-N 385.331 2.885 0 50 GFAA COc1cccc(N2CCC(N3CCC[C@@H](N4CCC(CO)CC4)C3)CC2)c1 23374531 IXQMMZHSJRRFCV-JOCHJYFZSA-N 387.568 2.833 0 50 GFAA CCCOc1ccc(CNC(=O)N2CCO[C@@H](Cn3cc(C)cn3)C2)c(C)c1 252494981 OJVSPZDYXSJBHH-HXUWFJFHSA-N 386.496 2.899 0 50 GFAA COc1cccc(C(=O)Nc2ccc(C)cc2CCCNS(C)(=O)=O)c1 77522263 UARBXEGLQTVOAK-UHFFFAOYSA-N 376.478 2.738 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(NC[C@H](c2cnn(C)c2)N(C)C)ncn1 328656172 ZBSBWGQCMVECCR-HLIPFELVSA-N 387.532 2.540 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C[C@@H](O)c2ccccc2F)CC1 328650601 VOMKZWFEKCKWBA-GHTZIAJQSA-N 386.471 2.552 0 50 GFAA CC1CCN(C(=O)c2ccc(N3CCC[C@H](N4CCCCC4=O)C3)nc2)CC1 363526219 CJAZNCHQHMEVED-IBGZPJMESA-N 384.524 2.935 0 50 GFAA O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1csc(Cc2ccccc2F)n1 238110537 VPJQXIWCMHAOQQ-CQSZACIVSA-N 392.452 2.969 0 50 GFAA CN1Cc2c(NC(=O)N3CCCN4c5ccccc5C[C@H]4C3)cccc2C1=O 333949533 XJZSBVCCUOFIDW-INIZCTEOSA-N 376.460 2.941 0 50 GFAA O=C(O)Cn1ccc([C@@H]2CCCN(Cc3ccc(Cn4cccn4)cc3)C2)n1 426689834 HEVDMCFGEIIXBY-LJQANCHMSA-N 379.464 2.592 0 50 GFAA O=C(NCc1cccnc1)c1cccc(OC2CCN(c3cnccn3)CC2)c1 96161573 GJCKOCIBQQMXIV-UHFFFAOYSA-N 389.459 2.849 0 50 GFAA Cc1nc2c(c(N3CCN(C[C@H]4CCCO4)CC3)n1)Cc1ccccc1OC2 95502201 CFGAOAVWXZAUAY-GOSISDBHSA-N 380.492 2.569 0 50 GFAA Cc1ccccc1CN1CCC(CN(C[C@H]2CCCO2)S(C)(=O)=O)CC1 95500034 XSHJCMOAYPOVMD-HXUWFJFHSA-N 380.554 2.648 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)c1 180289175 XFMVATTZHAOOQF-IBGZPJMESA-N 378.538 2.699 0 50 GFAA COc1ccnc(CNC2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c1 95497876 PYSFQGOOEDHFDX-UHFFFAOYSA-N 382.512 2.547 0 50 GFAA C[C@@H]1CN(C(=O)c2cn3cc(Cl)ccc3n2)CC[C@@]1(O)C1CCOCC1 91468811 SRCWELBMJYXDAN-YJYMSZOUSA-N 377.872 2.627 0 50 GFAA COC[C@@H]1CCCN1C(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 95527557 AISOVKOWBMVTTE-SFHVURJKSA-N 386.492 2.717 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)N(C(=O)c1n[nH]c3ccccc13)C2 95364286 AGRDABQJYHGXDW-JKSUJKDBSA-N 379.464 2.904 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2C(=O)N[C@@H]3CCCC[C@H]3N2C(=O)c2ccco2)c1 239433687 YHVQUFHTUQQOGA-KZNAEPCWSA-N 395.459 2.869 0 50 GFAA CN(C[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)Nc1ccc(-n2cncn2)cc1 95523169 FMYLKIYTHYSBEU-OAHLLOKOSA-N 382.468 2.522 0 50 GFAA O=C(CCN1CCCS1(=O)=O)N1CCc2ccc(-c3ccccc3)cc2C1 295419806 MKCOBEDILNNLEC-UHFFFAOYSA-N 384.501 2.664 0 50 GFAA CCN1CCC(N2C[C@@H]3OC(=O)N(CCCc4ccc(F)cc4)[C@@H]3C2)CC1 249692468 MQRZJFRNHFRCFZ-UXHICEINSA-N 375.488 2.748 0 50 GFAA CN(C)c1ccncc1C(=O)N1CCN(Cc2ncc(-c3ccccc3)o2)CC1 183547670 VCNRFGGSPFWKQN-UHFFFAOYSA-N 391.475 2.761 0 50 GFAA COCCN1CCC(CN(C)C(=O)c2cccc(-c3cnn(C)c3C)c2)CC1 534651175 HAZHULCYFNBNDM-UHFFFAOYSA-N 384.524 2.826 0 50 GFAA COc1ccc(CNC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)cc1 263617816 PTXMKZOYIBNUAO-SFHVURJKSA-N 382.395 2.627 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3nc4c(s3)CCCC4)cn12 1940195378 POGFYNKIJKFPGT-KRWDZBQOSA-N 385.493 2.684 0 50 GFAA Cc1ccc(-c2nn3c([C@@H]4CCCN(S(C)(=O)=O)C4)nnc3s2)cc1C 825186653 LUJPQNWQAVQJKE-CQSZACIVSA-N 391.522 2.609 0 50 GFAA CC(C)=CCN1CCC2(CC[C@@H](CNC(=O)N(C)Cc3ccon3)O2)CC1 584888858 PECVOYXAFJMIHT-SFHVURJKSA-N 376.501 2.796 0 50 GFAA COc1cc2c(cc1OC)[C@H](NC(=O)c1c(-n3cnnn3)sc(C)c1C)CC2 888088174 NEKXVSIUKJPHMG-CQSZACIVSA-N 399.476 2.775 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2COCCN2CC2CCC2)cc1C(=O)N(C)C(C)C 192551061 OOVMXOSZLDYNJU-FQEVSTJZSA-N 387.524 2.915 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(CCn3cc(Cl)cn3)CC2)O1)c1ccco1 1506403076 VIRNFCYLDKJHIO-MRXNPFEDSA-N 392.887 2.573 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)c3cc(=O)n(-c4ccccc4)[nH]3)C2)n1 1506397847 XQECBTWSFPNWCS-HNNXBMFYSA-N 395.463 2.767 0 50 GFAA Cc1cc(S(=O)(=O)N2CC(=O)N[C@@H](Cc3ccccc3)C2)c(C)cc1Cl 1772704495 UFUJAZDSWRVHRV-INIZCTEOSA-N 392.908 2.689 0 50 GFAA CC(C)(C)CN1CCN(c2cccc3c2C(=O)N(C[C@H]2CCCO2)C3=O)CC1 12338129 LQHBTSLPHIFPFR-MRXNPFEDSA-N 385.508 2.630 0 50 GFAA COc1ccc(OC)c(Cc2nnc(CCC(=O)NCc3ccsc3)o2)c1 12594065 JTUXQTNMZMEBEY-UHFFFAOYSA-N 387.461 2.988 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2ccc(OC3CCN(C)CC3)c(OC)c2)C1 12596311 WBZZUWWCKOGMQW-MRXNPFEDSA-N 376.497 2.667 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)CCN1CCCO1 12757636 SXWSUOBVPLAAFZ-UHFFFAOYSA-N 377.504 2.566 0 50 GFAA CCc1nnc(NC(=O)[C@H](C)Sc2nnc(-c3ccncc3)n2CC)s1 13956249 BPBXRUWEWNWFEC-JTQLQIEISA-N 389.510 2.893 0 50 GFAA CCOC(=O)[C@]1(CCCc2ccccc2)CCCN(C(=O)c2ccc(O)nn2)C1 14973037 LBHAOCXQFMBNOC-JOCHJYFZSA-N 397.475 2.991 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(NCCn3ccc(C)n3)nc2)CCN1C(C)C 19334359 NZAKJTVTPLWURN-LJQANCHMSA-N 384.528 2.643 0 50 GFAA COc1ccc(C(=O)[C@H]2CCCN(S(=O)(=O)CC(F)(F)F)C2)c(C)c1 19842004 ARNWWIOXRCMRTN-LBPRGKRZSA-N 379.400 2.790 0 50 GFAA O=C(CCn1ccn2nc3c(c2c1=O)CCCC3)NCc1ccccc1Cl 169779624 PTCWIHLCJXMPRL-UHFFFAOYSA-N 384.867 2.735 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCC([C@@H](O)c3nccn3C)CC2)cs1 158196469 ZIHXMMQLAJQVQQ-OAHLLOKOSA-N 377.514 2.655 0 50 GFAA c1ccc(-c2nnc(CN3CC[C@]4(CN(Cc5cnsc5)CCO4)C3)o2)cc1 1857686166 KNBJIDMMQHZOTP-HXUWFJFHSA-N 397.504 2.670 0 50 GFAA Cc1nc(CC(=O)N[C@H]2[C@H]3CC[C@@H]2CN(C(=O)CCC(F)(F)F)C3)cs1 1857689731 WPJWJIJEYJVVFU-DRXBFXEBSA-N 389.443 2.690 0 50 GFAA CN1C[C@@H]2COC[C@H](C1)N(C(=O)c1cccc(NCc3ccc(F)cc3)c1)C2 1857710350 SCVWFARGKBPJEB-UWJYYQICSA-N 383.467 2.840 0 50 GFAA CCOCc1nnc(N2C[C@@H](C(=O)NC3(CC(C)(C)C)CC3)CC2=O)s1 1857715089 APPXUUSGPNNSAG-LBPRGKRZSA-N 380.514 2.513 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4ccc5cccc(F)c5n4)[C@@H]2CC(=O)N13 1857715164 FKWPBNZALPVNHX-FVJLSDCUSA-N 383.423 2.572 0 50 GFAA COCCC[C@@]1(CO)CN(Cc2cc(Cl)cc3c2OCC3(C)C)CC[C@H]1O 1857722148 PPEHJKGCEYYNAZ-NQIIRXRSSA-N 397.943 2.982 0 50 GFAA CC[C@H]1[C@@H](C(=O)OC)C[C@H]2CN(C(=O)c3cc4ccccc4s3)CC(=O)N21 1875244537 UBCRZXJPDIQJDF-KKUMJFAQSA-N 386.473 2.526 0 50 GFAA C[C@H](NC(=O)c1cnc2c(cnn2C)c1O)c1ccc(NC(=O)C2CC2)cc1 132561126 LYHUFSDWTPXKHE-NSHDSACASA-N 379.420 2.513 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Cn2nc(C)c(Cl)c2C)CC1 138643315 ZQBBHEUHAOHVAT-UHFFFAOYSA-N 376.888 2.947 0 50 GFAA C[C@@H]1C[C@H](C(=O)NCc2cc3ccccc3n(C)c2=O)N1C(=O)OC(C)(C)C 1875284507 XLPHSPWXKFAQIS-CXAGYDPISA-N 385.464 2.553 0 50 GFAA CC(C)c1cnc(O)c(C(=O)Nc2ccc(CN3CCN(C4CC4)CC3)cn2)c1 1875310403 OUXFZINLYNKKKV-UHFFFAOYSA-N 395.507 2.838 0 50 GFAA O=C(O)c1n[nH]c2ccc(Oc3ccc(S(=O)(=O)N4CCCC4)cc3)cc12 1875301523 LZUANJLFBPTFPI-UHFFFAOYSA-N 387.417 2.838 0 50 GFAA COCc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875403437 XFQVKSKLKAZTNA-ATZDWAIDSA-N 395.459 2.859 0 50 GFAA O=C(NCCc1ccccc1Cl)N1CC[C@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401773 RJGGXYWMHMKFAA-UKRRQHHQSA-N 375.860 2.889 0 50 GFAA Cc1cccc(N2C(=O)C[C@@H](N3CCN(C/C=C/c4ccccc4)CC3)C2=O)c1 100051378 ZQFYUJJDAANAKW-MOVYNIQHSA-N 389.499 2.958 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NC2CCC2)CC[C@@H]1NC(=O)c1ccc(O)cc1F 2100555346 RVSJIHFIQURWKU-AGRHKRQWSA-N 392.471 2.894 0 50 GFAA CCOCC1(C(=O)N2[C@H]3CCC[C@H]2CC(NC(=O)C2=C(C)OCCC2)C3)CC1 2325793369 RHSQHNUDYOJSBJ-ROUUACIJSA-N 390.524 2.916 0 50 GFAA CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 869224 AAJPBGSVEDDJSI-SFHVURJKSA-N 390.480 2.856 0 50 GFAA Cc1c(C(=O)N2CCN(S(=O)(=O)c3cccs3)CC2)oc2ccccc12 1055996 DTVWCWPFNXHZQP-UHFFFAOYSA-N 390.486 2.949 0 50 GFAA CCOC(=O)C1=NN(C(=O)Cc2ccccc2)[C@](O)(c2ccc(Cl)cc2)C1 1214853 CXEMHOIHPJJOES-HXUWFJFHSA-N 386.835 2.879 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1 6728721 RXCCFQZCUBAOPM-UHFFFAOYSA-N 391.468 2.981 0 50 GFAA Cc1nn([C@H](C)C(=O)NCc2ccco2)c(=O)c2nn(-c3ccccc3)c(C)c12 6943973 QDPYBPUCMXNKFQ-OAHLLOKOSA-N 391.431 2.669 0 50 GFAA CONS(=O)(=O)c1ccc(C(=O)N(C)[C@@H](C)Cc2ccccc2C)cc1 225567332 ZHOKBWWGPXEFAS-HNNXBMFYSA-N 376.478 2.538 0 50 GFAA CC[C@@H](C(=O)NCc1ccccn1)N(c1cc(C)ccc1C)S(C)(=O)=O 65364744 BDQWCKDSPWSWFL-KRWDZBQOSA-N 375.494 2.559 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN[C@H](c2cccnc2)C(F)(F)F)cc1 65495843 YCGBYSOKRLDZSX-QGZVFWFLSA-N 380.370 2.896 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CN(C(=O)c1cccc(-n2nnnc2C)c1)CC3 170625258 VPJGSIQAALXIEE-UHFFFAOYSA-N 388.431 2.659 0 50 GFAA biogenic O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3ccc(F)cc3F)CC2)C1 67855034 DYWQNLSUPCDUCG-INIZCTEOSA-N 377.479 2.920 0 50 GFAA CN1CCN(C)C2(CCN(c3nc(-c4ccccc4)nc4c3CCC4)CC2)C1 67458964 IDPLRPWGAQIBSZ-UHFFFAOYSA-N 377.536 2.849 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)N[C@H](CN1CCOCC1)c1ccccc1 144160330 YVDQXQBTGLWKSN-JOCHJYFZSA-N 390.487 2.605 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N2CCC(N3CCC[C@@H](CO)C3)CC2)c1 72439262 CYBISUOGNGLMJD-LJQANCHMSA-N 388.552 2.699 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2cc(C)nc(N3CCCCC3)n2)CC1 72441268 HTKVWTYHWNEPRK-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 72438150 WVBPYUGUGQQWMB-GOSISDBHSA-N 395.507 2.583 0 50 GFAA O=C(c1ccc(O)c(Cl)c1)N1CCc2c(nc(-c3ccccc3)[nH]c2=O)C1 71388754 MLADPXYCYHIDRM-UHFFFAOYSA-N 381.819 2.994 0 50 GFAA CCc1ncc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 72168472 ZPJIEDMNHLOQHG-CEWLAPEOSA-N 380.467 2.881 0 50 GFAA O=C1CN(Cc2cnc(-c3ccccn3)nc2)CCN1Cc1cccc(F)c1 72150966 DNFCLRUMXSLTMZ-UHFFFAOYSA-N 377.423 2.522 0 50 GFAA O=C(O)C[C@H]1COCCN1Cc1cn(-c2ccccc2)nc1-c1ccncc1 72157829 IWUHEWAXUOZRAB-IBGZPJMESA-N 378.432 2.610 0 50 GFAA O=C(O)c1ccc(C[C@H]2CCN(C(=O)c3cc4ccccc4[nH]c3=O)C2)cc1 72426794 LAPDPDHYDXYXEJ-OAHLLOKOSA-N 376.412 2.931 0 50 GFAA CN1C[C@@H](C(=O)NC2(c3cccc(F)c3)CCOCC2)c2ccccc2C1=O 377509974 GZOPMJSFXQAWTP-LJQANCHMSA-N 382.435 2.817 0 50 GFAA Cc1ccccc1C(=O)N[C@H](C(=O)NCc1cccc(OCC(=O)O)c1)C(C)C 262871891 XVKAEHRTQHMYCE-FQEVSTJZSA-N 398.459 2.529 0 50 GFAA O=C(CN1CCC[C@@H](C[C@@H]2CCOC2)C1)Nc1cccc(C(=O)NC2CC2)c1 378395658 MBMYEEJPRYQQJC-IRXDYDNUSA-N 385.508 2.656 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@@H]3CCS(=O)(=O)c4ccccc43)CC2)c1C 283846309 MDYRTJNEOMJGDZ-LJQANCHMSA-N 398.528 2.913 0 50 GFAA CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NCc1ccc(CO)c(F)c1 174514174 XVACUNFSDGJWNN-IBGZPJMESA-N 385.483 2.982 0 50 GFAA CCCC(=O)N1CCCC[C@H]1C(=O)N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 290640122 MTMVPHGUVPVDPA-SIKLNZKXSA-N 390.499 2.760 0 50 GFAA Cc1cnc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)nc1N(C)C 95522982 IYQTTZRANKYWDH-GOSISDBHSA-N 377.496 2.875 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)c1cnc(-c2ccccn2)nc1O 91505186 YHQMOZUTYUZMST-UHFFFAOYSA-N 378.367 2.532 0 50 GFAA CC[C@@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)NCc2ccon2)c1 95383301 AGWCPWRWCNDSGY-MRXNPFEDSA-N 377.466 2.558 0 50 GFAA COc1ccc(C(=O)N2CCCOCC2)cc1OC1CCN(C(C)C)CC1 95518587 UVCQIWBNZPLYHV-UHFFFAOYSA-N 376.497 2.809 0 50 GFAA Cc1nc(C)c(CN2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)s1 91781928 PMVWZEWBUREMEZ-FQEVSTJZSA-N 376.570 2.669 0 50 GFAA O=C(CCc1ccsc1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 91973758 REXLUDCSGBELAQ-GOEBONIOSA-N 375.519 2.787 0 50 GFAA CN(CCC(=O)O)C(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 299753898 ZSCZOOIQWQMNAP-XJKSGUPXSA-N 386.370 2.548 0 50 GFAA CCOc1ccccc1CN[C@@H]1CNC(=O)c2cc(-c3cccc(OC)c3)nn21 263619604 ZNMNAAXHPQURLR-NRFANRHFSA-N 392.459 2.989 0 50 GFAA O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)c1cc2ccccn2c1 185273599 WUZPRRLQZNECMT-UHFFFAOYSA-N 387.436 2.548 0 50 GFAA O=C(CC[C@@]1(Cc2ccco2)CCC(=O)N1)NCc1nc2c(s1)CCCC2 299770478 SRSRLPCFROISKF-FQEVSTJZSA-N 387.505 2.903 0 50 GFAA Cc1cc(O)nc(S[C@@H](C)C(=O)NCc2nc3ccc(Cl)cc3[nH]2)n1 827647227 HJGUCIHJXDKNGK-VIFPVBQESA-N 377.857 2.817 0 50 GFAA NC(=O)[C@H]1C(=O)N(CCC2=CCCCC2)[C@@]23CCOC[C@H]2[C@H]1c1ccccc1O3 826828485 IFOPXEFWHTXBMX-JBYGMCGMSA-N 396.487 2.730 0 50 GFAA biogenic Cc1cnn(CCC(=O)NC[C@H]2CCCN(C(=O)/C=C/c3ccccc3)C2)c1 952974072 SWOCUPRILSUPEK-SQUSKLHYSA-N 380.492 2.650 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)Nc3ccc(OC[C@@H]4CCCCO4)cc3)nn2)CC1 952988704 RQXAOHMZENDNSN-WDYCEAGBSA-N 399.495 2.921 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCN[C@H](C)C3)cc2Br)no1 408519281 IEXISOSNCUCJBU-LLVKDONJSA-N 394.269 2.758 0 50 GFAA CS(=O)(=O)c1ccc(F)c(C(=O)N(Cc2cccc(O)c2)CC2CC2)c1 270236764 PFQJBMIIDDETEQ-UHFFFAOYSA-N 377.437 2.987 0 50 GFAA Cc1nn(-c2ccccc2)cc1C(=O)N[C@](C)(COc1ccccc1)C(=O)O 170044606 FHYMXHKUIOAMHM-OAQYLSRUSA-N 379.416 2.833 0 50 GFAA CC[C@H](NC(=O)N1CCc2n[nH]c(=O)cc2C1)c1ccccc1OC(F)F 274818801 DMLYILOSTHJBLL-ZDUSSCGKSA-N 378.379 2.590 0 50 GFAA COc1cccc(SCC(=O)Nc2ccccc2N2C(=O)N[C@@H](C)C2=O)c1 1506414190 MNMYFFDZMKKMLV-LBPRGKRZSA-N 385.445 2.871 0 50 GFAA CNc1nnc(Cc2csc(NC(=O)c3nn(C)c4ccccc34)n2)s1 1529104807 UDASVMBJKARGJZ-UHFFFAOYSA-N 385.478 2.766 0 50 GFAA CCN1CCC[C@H]1C(=O)N1CCCN(C(=O)c2ccc(-c3cnco3)cc2)CC1 1704315653 AJPNNEIOEZKEQI-IBGZPJMESA-N 396.491 2.500 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCc2n[nH]c3c2CCC3)ccc1F 1704303223 FTQRARLMBNJPRT-UHFFFAOYSA-N 399.426 2.697 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3cccnc3O)CC1)OCC2 1704339116 DNZWFFVXTLSVSK-UHFFFAOYSA-N 384.432 2.509 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCC[C@H]1C1(O)CC1 1772804876 DKBJRTCBTLDYOP-IBGZPJMESA-N 385.485 2.790 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(Cc3cc(O)c4ccccc4n3)C2)CC1 12448313 IUNHCLKUYPJIET-SFHVURJKSA-N 396.535 2.707 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(Cc2cccc(Br)c2)CC1 19841899 ANYRUFIPEDKFCR-UHFFFAOYSA-N 395.322 2.956 0 50 GFAA CCCc1nc(C(=O)N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)cs1 1857673229 LSCBDTYILZNEFF-ROUUACIJSA-N 399.516 2.738 0 50 GFAA CCC[C@H]1COC[C@H]2CN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CCN12 1857736316 OUNCWSHOWZQCFE-LSDHHAIUSA-N 392.443 2.579 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)ccc1F 1857736478 QMZPHUUZSNXMGC-CYBMUJFWSA-N 376.457 2.778 0 50 GFAA CCOc1ccccc1CC(=O)N1C[C@H](c2cccc(OC)c2)[C@@H](C(=O)O)C1 211896889 VWKKYJHEWDCQSC-MOPGFXCFSA-N 383.444 2.963 0 50 GFAA CN1CCC[C@@H]1[C@H]1CCCN1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 363403788 FLMJNPXFJIMWHL-NHCUHLMSSA-N 394.519 2.665 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C1 265297553 ODIGEPMMVXTLHV-HNNXBMFYSA-N 380.423 2.769 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N2CCC[C@@]23CCC[S@](=N)(=O)C3)n1 1875396233 ZMXDZFUHWPTZQP-SXBQZSJRSA-N 376.404 2.619 0 50 GFAA CC(=O)N1CCC2(CC1)CC(=O)c1ccc(OC[C@@H]3C[N@@]3CC3CC3)cc1O2 1875381613 BDXCQIMAJUUFTI-BXKMTCNYSA-N 384.476 2.506 0 50 GFAA C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)N1CCCc2c(cnn2C)C1 888102604 KXEUBOOFPZSYOY-CQSZACIVSA-N 380.452 2.559 0 50 GFAA O=C1CCCCN1[C@H]1CCCN(c2ncnc3c2cnn3-c2ccccc2F)C1 892492038 JWMBUPQSJAUDNS-HNNXBMFYSA-N 394.454 2.936 0 50 GFAA CN1c2ncc(CNC(=O)OC(C)(C)C)cc2N(C(=O)OC(C)(C)C)[C@H]1O 38534140 XUHDIUAWLWAPDH-HNNXBMFYSA-N 380.445 2.574 0 50 GFAA in-vitro Oc1nnc(-c2ccc(F)cc2)c2c1Nc1nnnn1[C@@H]2c1ccc(F)cc1 9202038 FDXVVEYAWHCLLV-MRXNPFEDSA-N 379.330 2.809 0 50 GFAA O=C(Nc1cccc(F)c1)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1 832301 QDNZYNPFXOYFFH-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA O=C1c2cc3ccccc3c(-c3ccccc3)c2C(=O)N1c1c[nH]c(=O)[nH]c1=O 1171032 WSSCVEDMNSTNAN-UHFFFAOYSA-N 383.363 2.684 0 50 GFAA COC(=O)CCCN1CC[C@H]2[C@@H]1CCN2C(=O)c1c[nH]nc1C1CCCCC1 2356143647 QUORXDSHSARVCX-ROUUACIJSA-N 388.512 2.699 0 50 GFAA CCc1ccc(OCC(=O)Nc2ccccc2N2CCN(C(C)=O)CC2)cc1 4412746 IZSAYLZOHLZBIM-UHFFFAOYSA-N 381.476 2.935 0 50 GFAA CC[C@H](C)C(=O)N1CCC[C@H](C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1 247500628 XOJHDLHMFQVEQD-BZSNNMDCSA-N 387.524 2.675 0 50 GFAA CCCc1nc(CN(CC)C(=O)[C@@H]2CCCN2C(=O)C2CCCCC2)no1 55325260 UNRWOOJJJTXZFA-INIZCTEOSA-N 376.501 2.942 0 50 GFAA Cc1noc(CN(C)C(=O)c2coc(COc3cccc4cnccc34)n2)n1 67983279 KDHPCFBWECMJDX-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Nc3ccc(OC)cc3C)CC2)n1 67602063 KUNZFTTYVLBVDH-UHFFFAOYSA-N 384.484 2.888 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](N3CCc4ccccc4C3)C2)cnc2ccnn12 72164077 IIZVDSLROZCITG-LJQANCHMSA-N 375.476 2.701 0 50 GFAA O=C(Cc1ccn[nH]1)N[C@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1 121504609 IOTPHBBXVVACJL-INIZCTEOSA-N 376.416 2.666 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3n[nH]c4c3CCCC4)CC2)cn1 328620717 AALZFQBDHPZBBK-HNNXBMFYSA-N 382.512 2.856 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@H](c2cccs2)N2CCCC2)cc1C(=O)O 232756715 FRFJGSFUQNPKLM-MRXNPFEDSA-N 394.518 2.870 0 50 GFAA COC[C@H](Nc1nc(-c2ccccn2)nc2c1c(C)nn2C)c1ccccn1 72418098 IGVRUGYFYPOWIA-INIZCTEOSA-N 375.436 2.928 0 50 GFAA CN1CCN(c2ccc(NC(=O)Cc3csc(-c4ccoc4)n3)nc2)CC1 156350721 VFOWFTRKPJRNAM-UHFFFAOYSA-N 383.477 2.731 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N3CCC[C@H]3C)c2=O)cc1 77320109 ICNVVUXNLZWBRZ-MRXNPFEDSA-N 392.459 2.721 0 50 GFAA CN(C)[C@H]1CCN(C(=O)C2(N(C)Cc3ccccc3)Cc3ccccc3C2)C1 39364745 NNYVJNTWJMNAFK-QFIPXVFZSA-N 377.532 2.819 0 50 GFAA CN(Cc1cnn(-c2ccccc2)c1)C(=O)CCn1c(=O)[nH]c2ccccc21 77486471 DBHUNCFUZNHOEG-UHFFFAOYSA-N 375.432 2.564 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@H](O)c3ccccc3Cl)c2c1 241911230 UATQZOFUONNMRY-INIZCTEOSA-N 377.853 2.832 0 50 GFAA Cn1cc(C(=O)N2CCOC[C@@H]2c2ncn(CC(F)(F)F)n2)c2ccccc21 286044947 LAGNAIZQIYRCFZ-OAHLLOKOSA-N 393.369 2.546 0 50 GFAA CC(C)c1nnc2n1C[C@H](NC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)CC2 176174006 HBGUZINXFYCLAR-MSOLQXFVSA-N 385.487 2.636 0 50 GFAA COCCn1c(C(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc2ccccc21 225425458 HAHATPNJDIZZQU-AEFFLSMTSA-N 391.471 2.709 0 50 GFAA biogenic Cc1nccn1C[C@@H]1CCCN1C(=O)Nc1cc(F)cc(N2CCOCC2)c1 176941225 QFMUAEYYRMBFCP-SFHVURJKSA-N 387.459 2.864 0 50 GFAA O=C(Nc1ncn(Cc2ccc(Cl)cc2)n1)c1ccc(N2CCCC2)nn1 176970779 XMXQWKJQPMQPMO-UHFFFAOYSA-N 383.843 2.622 0 50 GFAA Cc1ccc(C)c([C@@H](C)NC(=O)CSc2nnc(C3CCNCC3)n2C)c1 426535911 PYDNNLXYRPIQKJ-OAHLLOKOSA-N 387.553 2.868 0 50 GFAA CCc1nn(C)cc1C(=O)N1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1 179969255 YCGOXBDFDWOZKV-OAHLLOKOSA-N 394.479 2.552 0 50 GFAA CCCO[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91906597 QRYQJBJHMRPDFX-GOSISDBHSA-N 387.524 2.670 0 50 GFAA O=C(O)c1cncc(-c2ccc(C(=O)N3CCC(c4cc[nH]n4)CC3)cc2)n1 426368396 XRHRQBCBZVPYPQ-UHFFFAOYSA-N 377.404 2.585 0 50 GFAA CN1CCCC[C@@H]1C(=O)N1CCc2ccc(NC(=O)c3ccccn3)cc2C1 95529823 BDZQGZCLGUQWBJ-HXUWFJFHSA-N 378.476 2.703 0 50 GFAA CCn1cc(C(=O)N2CC[C@]3(OC)CC[C@@H](Oc4ccccn4)C[C@H]23)c(C)n1 426479883 ZJKROULNEISZLA-PLMTUMEDSA-N 384.480 2.838 0 50 GFAA COc1cccc(-c2ccc(NC(=O)[C@H]3CCCN(S(C)(=O)=O)C3)cc2)c1 95526410 HYDRQWBSAMGYPD-KRWDZBQOSA-N 388.489 2.972 0 50 GFAA O=C(CN1CCN(Cc2cccc(Cl)c2)CC1)Nc1cccc2nonc12 22752172 JCBRAXWHENVNKX-UHFFFAOYSA-N 385.855 2.633 0 50 GFAA O=C(Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1)NC1Cc2ccccc2C1 95516628 DOJLQYNIXCBYRV-HXUWFJFHSA-N 379.460 2.884 0 50 GFAA C[C@H](NC(=O)Nc1ccccc1)C(=O)O[C@H](C)C(=O)N1[C@@H](C)CCC[C@H]1C 239667636 BQXNELUDWFTVED-XUWVNRHRSA-N 375.469 2.918 0 50 GFAA CN(CCCO)Cc1cc(Cl)ccc1OC[C@H](O)CN1CCCCCC1 95519373 SUXDUQWDNOAUGN-LJQANCHMSA-N 384.948 2.770 0 50 GFAA CCc1c(C)nn(C)c1NC(=O)c1ccc(CN2CCN3CCC[C@H]3C2)cc1 248016656 GNZABDXONNKWTF-IBGZPJMESA-N 381.524 2.823 0 50 GFAA CC(C)c1nccc(CN2CCC(CNC(=O)C[C@H](C)n3cccn3)CC2)n1 827802440 MKNJTMZESCHZQI-KRWDZBQOSA-N 384.528 2.776 0 50 GFAA Cc1cc2[nH]cc(C(=O)N[C@@H](c3cccnc3)c3ccc(C)c(C)c3)c(=O)n2n1 670455911 UAKVGURDSUNYER-HXUWFJFHSA-N 387.443 2.862 0 50 GFAA Cc1sc2nc(CCNC(=O)[C@H]3CC(=O)OC34CCCC4)nc(O)c2c1C 670448435 ATQPHUFYNNKVRT-GFCCVEGCSA-N 389.477 2.548 0 50 GFAA COc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)/C=C/c1cnc(N(C)C)nc1 952969029 OYKUQJOYFOFWNJ-NADMHLTPSA-N 382.464 2.983 0 50 GFAA O=C(NCC1CCN(C(=O)COc2ccccc2Cl)CC1)c1ccoc1 952977144 SMLBCBJHRAMVAB-UHFFFAOYSA-N 376.840 2.980 0 50 GFAA C[C@@H]1C[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCO1 271477101 CVTMKIRMQLKVCC-LMNJBCLMSA-N 389.540 2.546 0 50 GFAA Cc1cc2c(cc1C)O[C@H](C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)O)C2 170044528 XBPXMDYPJVIXSF-ICSRJNTNSA-N 378.428 2.900 0 50 GFAA CCc1nc(C2CCN(Cc3nnc(C(=O)Nc4ccccc4)s3)CC2)n[nH]1 190650915 ZSNMWULIYMQYHM-UHFFFAOYSA-N 397.508 2.851 0 50 GFAA CN(C[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1cnc(N)nc1-c1ccccc1 1506405494 FCAWCECRWFLYGM-HNNXBMFYSA-N 393.491 2.589 0 50 GFAA COc1ccc(NC2(C(=O)NCC3(CO)CCOCC3)CCCCC2)cc1 1506403823 WINDXQGHZDJWGF-UHFFFAOYSA-N 376.497 2.715 0 50 GFAA O=C(O)c1cc(O)cc(C(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)c1 1506424140 ZBGHITBZIFVMIT-UHFFFAOYSA-N 384.476 2.817 0 50 GFAA CCOC(=O)C1CCN(C(=O)c2ccc(I)cc2)CC1 1181880 KKMMTJOEFGNTID-UHFFFAOYSA-N 387.217 2.707 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)NCc2cc(Cl)ccc2OC(C)C)cc1 1506413652 SHDCKLBCZSJVBN-UHFFFAOYSA-N 396.896 2.965 0 50 GFAA Cc1cc(OCc2cc(C(=O)NC[C@H]3COCCO3)no2)cc(C)c1Cl 11841049 VTEBDMXYNMOQFK-HNNXBMFYSA-N 380.828 2.669 0 50 GFAA CC(C)c1ccc(CN2CCC(n3cc(C(=O)N4CCOCC4)nn3)CC2)cc1 12134905 DUTANIUDSFPEPW-UHFFFAOYSA-N 397.523 2.711 0 50 GFAA O=C(Cn1cnc2ccccc21)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 12316724 CLHQIEWOPVASSF-KRWDZBQOSA-N 392.459 2.911 0 50 GFAA CCOC(=O)c1nn(CC(C)C)c2c1CN(C(=O)[C@@H]1CCOC(C)(C)C1)CC2 14536331 HFEGDXHBNAHYNC-OAHLLOKOSA-N 391.512 2.806 0 50 GFAA CC1=C(CCN2C[C@H](n3cnnn3)C[C@H]2C(=O)NCC(C)C)C(C)(C)CCC1 14984033 YPSOTNXZEHQCAQ-MJGOQNOKSA-N 388.560 2.977 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N1CCCc2ccccc21)CCCC3 169778260 LGULCIOZZPQMGW-UHFFFAOYSA-N 376.460 2.822 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ccc4nccnc4c3)C1)CC2 1857690406 AYXSABZHQAEDDV-OAQYLSRUSA-N 375.432 2.554 0 50 GFAA CCn1ccc(C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)cc1=O 1857701260 KGIGDTIBBOBRFY-UHFFFAOYSA-N 376.460 2.510 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccsc4)C[C@]34CC[C@H]2O4)cn1 1857714664 GPIOIPLAHMAWQA-QEUVDIPISA-N 383.517 2.861 0 50 GFAA Cc1ccc(C)c(C(=O)NC[C@H]2[C@H]3CN(c4ncccn4)C[C@]34CC[C@H]2O4)c1 1857724264 SBRYGTCXFNBCNS-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA O=C(Nc1ccccc1)c1sccc1S(=O)(=O)N1CCCC[C@@H]1CCO 745477095 SSJILDSEPBKDJL-OAHLLOKOSA-N 394.518 2.926 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1C[C@@H]2C[C@@H](C(=O)O)C[C@@H]21 907945251 STZDAKVSKPZEJH-WBKHQIRZSA-N 387.402 2.781 0 50 GFAA O=C(CCc1cccnc1)N1CC[C@H]2CN(c3ncnc4c(F)cccc34)C[C@H]21 1875303205 BSUUECKZCDQDHW-QFBILLFUSA-N 391.450 2.834 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 1875402276 DPFAJUZSWZJXIK-IUIKQTSFSA-N 388.855 2.596 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)NCc1cc2ccccc2o1 1875401816 SSFZRYFKVKNSPO-WBVHZDCISA-N 381.436 2.950 0 50 GFAA O=C(O)C[C@H](CNS(=O)(=O)c1ccc(Br)cc1)c1ccccc1 4654006 ZMXUOCDIQZRGHI-CYBMUJFWSA-N 398.278 2.986 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 12317318 ILMUJQAEJSBEIA-INIZCTEOSA-N 393.447 2.526 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cc1 2325890038 UZCIHMBHVYDSDE-IBGZPJMESA-N 397.862 2.802 0 50 GFAA COc1ccc(C(=O)CSc2nn3c(=O)c(C(C)(C)C)nnc3s2)cc1 622859 RUTRAHBESVIVOH-UHFFFAOYSA-N 390.490 2.827 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cccc(F)c3F)C[C@H]2CCO)CC1 104841411 BNIMRXBFSNUKOA-LJQANCHMSA-N 381.511 2.706 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(N3C[C@H]4CC[C@H]3C4)nc2)CC1 102592453 QGOVKAHANGPIMV-HKUYNNGSSA-N 382.508 2.545 0 50 GFAA COc1cc(OC)cc(-c2nnc(SCC(=O)N[C@H]3C[C@H]4CC[C@H]3C4)[nH]2)c1 101760509 KWLVCGQKCCZOIO-MKBNYLNASA-N 388.493 2.886 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)c(F)c3)C[C@@H]2CCO)CC1 20543066 RKHRELRYMJGRHN-IBGZPJMESA-N 381.511 2.706 0 50 GFAA COCCc1noc(CN2CCc3onc(-c4ccc(F)c(F)c4)c3C2)n1 67805809 MQBKDXPWNGGJET-UHFFFAOYSA-N 376.363 2.750 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3c2cnn3Cc2cccnc2)cc2c1OCO2 65452766 YNVPFQGEBZXLKE-CQSZACIVSA-N 378.388 2.538 0 50 GFAA Cc1ccccc1-c1cc(O)c2c(c1)CN(c1cncc(C(N)=O)n1)CCO2 67956286 ITKBQCGEYCBQEK-UHFFFAOYSA-N 376.416 2.656 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3cccc(C)c3C)CC2)cc(-n2cccn2)n1 35597325 CTZUGDPYGKAEOR-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA COC(=O)c1ccccc1S(=O)(=O)Nc1cccc(Oc2cnccn2)c1 3997656 BGLYOXKPCXRWNJ-UHFFFAOYSA-N 385.401 2.856 0 50 GFAA CS(=O)(=O)CCc1ccc(NC(=O)c2cnc([C@@H]3CCCO3)s2)cc1 121264619 HPQWMCHZTQKEJZ-AWEZNQCLSA-N 380.491 2.834 0 50 GFAA O=C(N1CCOCC2(CCOCC2)C1)C1(c2cncc(Br)c2)CC1 281502374 WTGSLOKBXDNECG-UHFFFAOYSA-N 395.297 2.531 0 50 GFAA Cc1[nH]c(=O)c(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c(C)c1Cl 72424460 ZDVUZYWJTDGCFN-UHFFFAOYSA-N 377.847 2.742 0 50 GFAA CSCC[C@H](O)C(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 72432242 HINXJKZDKNJKRQ-AWEZNQCLSA-N 377.428 2.629 0 50 GFAA Cc1nn(C)c2nc(-c3ccncc3)nc(N3CCN[C@H](c4ccccc4)C3)c12 72475051 VBZCSZQBJYERIG-SFHVURJKSA-N 385.475 2.885 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)NCCSc1ccc(Cl)cc1 72419944 VKVPVHKILVMTLM-UHFFFAOYSA-N 378.929 2.871 0 50 GFAA COc1cccc([C@H]2CN(C(=O)Cc3cccnc3)[C@@H]3C4CCN(CC4)[C@H]23)c1 72463821 OUEHIMIHFNTXOX-YMPZKCBVSA-N 377.488 2.722 0 50 GFAA Cc1cccc(C)c1OCCC(=O)N1CCC[C@H]1c1nc(C(=O)NC2CC2)no1 372795353 HNOVRVFVDUTWRY-INIZCTEOSA-N 398.463 2.711 0 50 GFAA COCc1ccc(S(=O)(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)cc1 262379898 GTDBRHFVOSIUCK-KRWDZBQOSA-N 377.462 2.587 0 50 GFAA CCCNC(=O)N1CCc2cc(S(=O)(=O)NCc3cccs3)ccc2C1 77320235 MWECPTGFGJSBFV-UHFFFAOYSA-N 393.534 2.704 0 50 GFAA CO[C@H]1CCCN(C(=O)c2ccc(-n3ncc(C(=O)O)c3C(F)(F)F)cc2)C1 177953597 BATDLEPQKHMBCB-ZDUSSCGKSA-N 397.353 2.840 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@@H](C(=O)N4CCOCC4)C3)CC2)cc1 82092024 RLXPLFLBDODVMY-OAQYLSRUSA-N 385.552 2.530 0 50 GFAA COc1cccc(-n2cc(CNC(=O)N3CCC(c4cc[nH]n4)CC3)cn2)c1 426574934 ATCFGFJXPGPVJZ-UHFFFAOYSA-N 380.452 2.693 0 50 GFAA CCCC[C@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)c1cncnc1C 82155773 AQVQINZRLJWMLT-INIZCTEOSA-N 382.464 2.841 0 50 GFAA O=C(Nc1ccc2c(c1)CCC2)N1CCN(S(=O)(=O)c2ccccc2)CC1 20530087 NSORPMWNQIGYPE-UHFFFAOYSA-N 385.489 2.714 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)N(CCC(=O)O)C1CCOCC1 237824194 FLSRCHUYEMOBIU-CMDGGOBGSA-N 397.475 2.985 0 50 GFAA COC(=O)c1ncsc1S(=O)(=O)N[C@H]1C[C@@H]2CCCc3cccc1c32 161965230 RHPMRRLJDGHEIL-AAEUAGOBSA-N 378.475 2.773 0 50 GFAA Nc1ccnc(N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C2CC2)C3)n1 92099263 VORNEGLUTQKUOK-GOSISDBHSA-N 377.492 2.824 0 50 GFAA CCn1c(Cn2cncn2)nnc1C1CCN(Cc2ccc(F)c(C)c2)CC1 96140953 SGNUGWGWYFPCPC-UHFFFAOYSA-N 383.475 2.765 0 50 GFAA COC(=O)C[C@H]1CCN(C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)C1 97347177 ACPGNCJFFDVVQU-GFCCVEGCSA-N 381.860 2.895 0 50 GFAA C[C@]12CC[C@@H](O)C[C@@H]1CC[C@H]1[C@H]2C(=O)C[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254418784 BIEADAHRODWPEW-CPLGYVAXSA-N 388.504 2.783 0 50 GFAA O=C(Nc1cc(-n2cnnn2)ccc1F)N1CCO[C@@H](CCc2ccccc2)C1 184821813 KKPHXZNGSXKHJS-KRWDZBQOSA-N 396.426 2.667 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N(C)C[C@H]3CCCN4CCCC[C@H]34)CC2=O)cc1 299754447 PXMAICBDTVDHQB-DBXWQHBBSA-N 399.535 2.771 0 50 GFAA biogenic CS(=O)(=O)N1CCC[C@H](c2nnc3sc(-c4ccccc4Cl)nn23)C1 825598284 QTIFFRTZCQAOBC-JTQLQIEISA-N 397.913 2.645 0 50 GFAA Cc1cc(-c2ccc(S(=O)(=O)NCc3nncn3C3CCCCC3)o2)on1 825300458 KTRIFVVTBLZFCJ-UHFFFAOYSA-N 391.453 2.818 0 50 GFAA Cc1sc2nc(CCNC(=O)c3ccc4c(c3)OCCO4)nc(O)c2c1C 670436790 NAVNGSUJCXXVLJ-UHFFFAOYSA-N 385.445 2.757 0 50 GFAA Cc1nnc(SCCCNS(=O)(=O)c2c(C)nn(C(C)C)c2C)s1 670460405 VPMXWTDHFVGWMQ-UHFFFAOYSA-N 389.572 2.701 0 50 GFAA O=C(c1cn2cccnc2n1)N1C[C@@H]2CC[C@H]1CN(CCCc1ccccc1)C2 1565514055 YVRLOFWIJWHDSS-UXHICEINSA-N 389.503 2.899 0 50 GFAA COCc1noc(CN2CCC3(CC2)C[C@H]3N(Cc2ccsc2)C(C)=O)n1 276421984 LJTOWEYSYGGKFX-MRXNPFEDSA-N 390.509 2.681 0 50 GFAA Cn1cc(C(=O)N2CCCN(Cc3ccccc3)CC2)c2ccccc2c1=O 277047879 HTSYDCKRHPEYSV-UHFFFAOYSA-N 375.472 2.887 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCN(c2cccnn2)CC1)c1ccccc1 170631903 CUJQPIRIEBZFPV-UHFFFAOYSA-N 387.443 2.691 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cccc(C)n1 788410061 KQVVENHXUCOZPY-LBPRGKRZSA-N 398.868 2.576 0 50 GFAA CNC(=O)CC[C@@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2F)C1 1506431616 RTEHAVRBMOUTHZ-LBPRGKRZSA-N 376.881 2.547 0 50 GFAA COc1ccc(-c2ccc(C(=O)O)c(N3CCC[C@@H](CCC(N)=O)C3)n2)cc1 1529169392 YGIVYTZCLMYLNH-AWEZNQCLSA-N 383.448 2.937 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCCN(C(=O)c2ccc(F)cc2Cl)CC1 1529104833 UNFPBKZAHOZDMZ-UHFFFAOYSA-N 390.842 2.960 0 50 GFAA COc1ccc(-c2cc(CNc3nccc(N4CCC[C@H](O)C4)n3)no2)cc1 1704300915 ZKBKOPNVNMNGIY-INIZCTEOSA-N 381.436 2.713 0 50 GFAA Cc1c2c(=O)n(-c3ccccc3)[nH]c2cc(=O)n1Cc1ccc2c(c1)OCO2 5274875 ANUFFQUQIIVNIW-UHFFFAOYSA-N 375.384 2.566 0 50 GFAA COc1ccc(CCNC(=O)Cn2nc(-c3ccc(Cl)cc3)ccc2=O)cc1 5388555 XWLGVTNJFQCDPE-UHFFFAOYSA-N 397.862 2.931 0 50 GFAA CC[C@@H](C)NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(OC)cc1 5953888 FMEZFDCCGJZPRC-OAHLLOKOSA-N 376.478 2.805 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)N3CCCc4ccccc43)c2)C1=O 12003715 WHHBSDRLRXLGKR-CQSZACIVSA-N 384.457 2.592 0 50 GFAA COCCN(C)C(=O)c1cnn(-c2ncc3c(n2)-c2ccccc2CCC3)c1C 12132644 XAHULHMPOQERAM-UHFFFAOYSA-N 391.475 2.845 0 50 GFAA O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc2oc(CCc3ccccc3)nc2c1 12437605 KJROOUOYIPHBED-INIZCTEOSA-N 384.457 2.530 0 50 GFAA CNC(=O)c1nn(CCc2ccccc2)c2c1C[C@@H](NCc1ccco1)CC2 14748701 CJHBOBGFBJLGOJ-KRWDZBQOSA-N 378.476 2.726 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2ccccc2F)c(=O)c(C(=O)NC(C)C)c1 15004468 WUZLCJCKCRGNAG-UHFFFAOYSA-N 387.455 2.712 0 50 GFAA CN(c1ccc(C(=O)NCc2ccncc2)cc1)S(=O)(=O)c1cccs1 16626737 KRVDUPSWHSOUJX-UHFFFAOYSA-N 387.486 2.898 0 50 GFAA Cc1cccc(OCC(=O)NCc2nnc3ccc(-c4ccc(F)cc4)nn23)c1 169778398 QNVJRKOMRIVTNO-UHFFFAOYSA-N 391.406 2.934 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCc4c(C)n[nH]c4C)CC3=O)sc2c1 1857714579 XCBJIDAQGQRDMH-CYBMUJFWSA-N 383.477 2.614 0 50 GFAA COc1cccc(CCC(=O)N2CCC[C@](O)(CN3CCC(F)(F)CC3)C2)c1 1857733408 JLEDRIIEXLZPHF-FQEVSTJZSA-N 396.478 2.712 0 50 GFAA O=C1CC[C@@]2(C(=O)N3CCC[C@H]4C(O)=NC[C@H]43)Sc3ccc(Cl)cc3N12 328586495 MKDIFABUYIRXDR-BVRBVLIYSA-N 391.880 2.846 0 50 GFAA O=C(Cc1cc2ccccc2[nH]c1=O)N1CCC(C(=O)O)(c2ccccc2)CC1 238062518 NZXDWRWPXMJQDB-UHFFFAOYSA-N 390.439 2.716 0 50 GFAA CC(C)CCC(=O)N1CCC([C@]2(Cc3ccccc3F)NC(=O)NC2=O)CC1 11787737 JVOPUDCZILTMLM-NRFANRHFSA-N 389.471 2.621 0 50 GFAA CCO[C@@H]1CN(C(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)C[C@@H]1CO 1875268113 XOFRIHGHBDSHAZ-CZUORRHYSA-N 392.887 2.514 0 50 GFAA C[C@@H]1CCCCN1c1cc(C(=O)N2CC[C@@H](NC(=O)CC(F)(F)F)C2)ccn1 1875259080 DBJCEXWVEKKJCT-UKRRQHHQSA-N 398.429 2.744 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2cc(-c3c(F)cc(F)cc3F)no2)[C@@H](C)C1 1875380881 CXPZOUBJGSXETD-JTQLQIEISA-N 379.338 2.618 0 50 GFAA O=C(c1cc(F)ccc1F)N1CCC([C@@H]2OCC[C@H]2Nc2ncccn2)CC1 888103586 OEHLJRYZULDGTH-MSOLQXFVSA-N 388.418 2.877 0 50 GFAA Cc1cscc1C(=O)N=[S@@](C)(=O)c1cnn2c1CN(C(=O)C(C)C)CC2 2325784973 XATDDWPUWJNVIA-SANMLTNESA-N 394.522 2.548 0 50 GFAA CN(C)C(=O)Cc1ccc(C(=O)O[C@H]2CCCN(c3ccccc3F)C2=O)cc1 2325789105 PDCHOZHXAJXSTK-IBGZPJMESA-N 398.434 2.809 0 50 GFAA Cc1c(C(=O)NC[C@@H]2C[C@H](C(=O)NCC3CCC3)CO2)oc2c(F)cccc12 2332238048 WUATYUUIXZWVFB-GJZGRUSLSA-N 388.439 2.932 0 50 GFAA COc1cc(C(OC(C)=O)OC(C)=O)c(Br)cc1OC(C)=O 1135615 YKVPXVLWBWJLED-UHFFFAOYSA-N 375.171 2.508 0 50 GFAA CCOc1ccc(N([C@H](C)C(=O)Nc2ccccc2OC)S(C)(=O)=O)cc1 1137841 YQDVGMRGOKUUFF-CQSZACIVSA-N 392.477 2.887 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)NC1CC1)S(=O)(=O)c1ccccc1 1174531 FQJLOJMFJGYAAV-UHFFFAOYSA-N 394.880 2.823 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc4nc[nH]c4c3)C1)CC2 2356153504 JTHZHDQNKRAEDL-NRFANRHFSA-N 376.464 2.539 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@]12CCCN2Cc1ccncc1Cl 2356168903 HCXWTZVNDUOYLK-MBOZVWFJSA-N 377.916 2.996 0 50 GFAA COc1ccccc1NC(=S)N[C@H](NC(=O)N(C)C)C(Cl)(Cl)Cl 3130739 GGMNNTRYORIZAR-SNVBAGLBSA-N 399.731 2.949 0 50 GFAA C[C@@H](C(=O)N1CCc2ccccc2C1)N(c1ccc(F)cc1)S(C)(=O)=O 7872001 UWTGQMWMUROXCM-AWEZNQCLSA-N 376.453 2.565 0 50 GFAA CC(C)[C@@H](NC(=O)CN1CCN(C[C@@H]2CCCCN2C)CC1)c1ccccc1 109752133 QJZDVBLBKOSPOY-JTHBVZDNSA-N 386.584 2.602 0 50 GFAA O=C(CN1CCC(NC(=O)c2cc3ccccn3c2)CC1)Nc1ccccc1 114116317 FOJZDQSQHXXSQP-UHFFFAOYSA-N 376.460 2.772 0 50 GFAA C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)[C@@H]2CSCN2C(=O)c2ccccc2)C1 227448454 JFUWFOXPLAYQLI-ZMMAXQRCSA-N 389.565 2.684 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CNCCc3ccccn3)C2=O)cc1 67856829 VWZKFOYTWXMDNZ-HSZRJFAPSA-N 381.520 2.891 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2ccc3[nH]c(-c4ccccn4)nc3c2)CC1 172295454 OYAJNDGVKSBLME-UHFFFAOYSA-N 392.463 2.957 0 50 GFAA C[C@@H]1CCCC[C@H]1NC(=O)CS(=O)(=O)Cc1nnc(-c2ccccc2)s1 122442890 KRIJZJJOJQFIGB-UKRRQHHQSA-N 393.534 2.815 0 50 GFAA CC[C@H]1CN(C(=O)c2cnc(SC)nc2)CCC(=O)N1Cc1ccccc1 71748348 AXYOCCFNXSPALC-KRWDZBQOSA-N 384.505 2.852 0 50 GFAA O=C(COc1ccc2c(c1)OCO2)N1CCCN(Cc2cccc(F)c2)CC1 77470525 YCRXCVOXPGHQMJ-UHFFFAOYSA-N 386.423 2.668 0 50 GFAA CN(Cc1ccccc1)[C@H]1CCCN(c2cncc(C(=O)N3CCCC3)n2)C1 72173905 PZVGRDTZSHRGNJ-IBGZPJMESA-N 379.508 2.813 0 50 GFAA O=C(NCCc1ccn(-c2ccc(F)cc2)n1)c1cccc(N2CCOC2=O)c1 174353416 ADEPSCPCNAXMCU-UHFFFAOYSA-N 394.406 2.941 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)N2CCC[C@H](N(C)CC(=O)O)CC2)C12CCCCC2 263207559 IHSGQJYHVXSOHT-RCCFBDPRSA-N 395.544 2.695 0 50 GFAA O=C(NCCc1nc2ccccc2[nH]1)N1CCC(OCc2cccnc2)CC1 426734024 OGKMGJIWRVMKGX-UHFFFAOYSA-N 379.464 2.891 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1ccn(C(F)F)n1 82098486 CAFSSFLFXQKZCL-UHFFFAOYSA-N 378.427 2.553 0 50 GFAA CCCCN1CCN(C(=O)c2ccc(-c3ccc(O)c(CO)c3)cc2)CC1=O 426649681 NGKUAFGXBNXXKZ-UHFFFAOYSA-N 382.460 2.636 0 50 GFAA CSc1cccc(NC(=O)N2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)c1 91830401 URQFRJRLZOMKHP-IBGZPJMESA-N 376.526 2.569 0 50 GFAA COc1cc(C(=O)N2C[C@@H](NC(=O)N(C)C)[C@H](C(C)C)C2)nc2ccccc12 91725184 SJOLYASFBTWSJD-MAUKXSAKSA-N 384.480 2.611 0 50 GFAA CCCc1cnc(C)nc1N1CCC(N2CCN(c3ccccn3)CC2)CC1 95521516 QJBJULZVCBZPJW-UHFFFAOYSA-N 380.540 2.924 0 50 GFAA CCCN1CCC[C@@H](NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C1 91737427 KSHFWMSQMAWTKW-CQSZACIVSA-N 387.436 2.587 0 50 GFAA CC(C)(C)c1cc(CNC(=O)[C@@H]2CCC(=O)N(CCc3ccccc3)C2)[nH]n1 91562764 QLLATGFOMSGYIO-QGZVFWFLSA-N 382.508 2.805 0 50 GFAA CC(C)=CCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1ccc(Cn3ccnc3)o1)C2 95372539 AEVIJBPABMGXAN-DLBZAZTESA-N 382.464 2.554 0 50 GFAA CCCn1ccnc1CN1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1 91645631 SZQWMARADDCMID-UHFFFAOYSA-N 396.539 2.796 0 50 GFAA CCc1cc(C(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2c(C)noc2C)C3=O)ccn1 95506714 XOBUGZRLGRLJSW-FUHWJXTLSA-N 382.464 2.512 0 50 GFAA Cc1ccccc1CNC(=O)CN1CCC[C@]2(CCC(=O)N(CC3CC3)C2)C1 92019283 KRQFMFSBDAYJPT-QHCPKHFHSA-N 383.536 2.726 0 50 GFAA CCOc1c(Cl)cc(C(=O)N(CCC(=O)O)C2CCOCC2)cc1OC 299748136 GELIMZBCIXTUJW-UHFFFAOYSA-N 385.844 2.843 0 50 GFAA Cn1nc(-c2cccc(C(=O)N3CCC(N4CCCCC4)CC3)c2)ccc1=O 534639519 AICCWYFUICARKD-UHFFFAOYSA-N 380.492 2.538 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCc3nc[nH]c3[C@H]2c2ccccn2)o1 825647683 HCSJTGKCYCCTLN-GOSISDBHSA-N 393.476 2.825 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@@H]2CC(=O)N(c3cccc(Cl)c3)C2)c(C)n1 584886803 VXBQKNMLOIQJCA-MRXNPFEDSA-N 389.887 2.812 0 50 GFAA Oc1cccc(CN2CCC[C@@H](NCc3cnc(N4CCCCC4)nc3)C2)c1 952988257 NBQQCDWCRDBSHO-HXUWFJFHSA-N 381.524 2.927 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCCN(Cc3ccccc3F)CC2)nc(O)n1 952973906 SGTCCTWPCQWIDP-UHFFFAOYSA-N 386.471 2.868 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)N(C)CCN(C)C3CCCC3)cc12 952980161 FRPHFMOPPNZNHP-UHFFFAOYSA-N 377.510 2.744 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)[C@@H](Cc1cnc[nH]1)n1cccc1 952971791 FYLDXZNCXNYPIK-LJQANCHMSA-N 376.420 2.704 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)NC[C@H](C)N2CCN(C)CC2)c1C 1506400330 CRPZDPAYMVWALW-INIZCTEOSA-N 381.586 2.515 0 50 GFAA O=C(NC1CCCCC1)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 11763824 SNFZULNEEGOFGQ-UHFFFAOYSA-N 396.417 2.808 0 50 GFAA COc1ccc(-c2cn3c(C(=O)N4CCC(O)CC4)csc3n2)cc1F 11819668 KPXKORYZPVVZIE-UHFFFAOYSA-N 375.425 2.807 0 50 GFAA C[C@H]1CN(CC(=O)NCc2c[nH]nc2-c2ccccc2)Cc2ccccc2O1 11909031 JNGWLGBJENSTHQ-INIZCTEOSA-N 376.460 2.976 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(N(C)Cc3nccn3CC)nc2)CCN1C(C)C 12302739 PQTHPWYUMXITNP-LJQANCHMSA-N 398.555 2.879 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2CCC[C@H](N(C)Cc3ccccc3)C2)CC1 12590703 MJBAYEHJFWXWDN-FQEVSTJZSA-N 386.540 2.503 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)N1CCC(C)CC1 14399184 NTUGAGFVKBSBAV-UHFFFAOYSA-N 392.477 2.639 0 50 GFAA CC(C)OCCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14749751 AWNGQBBBALNJIV-IBGZPJMESA-N 398.551 2.954 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)C[C@@H](C)O1 14981417 JDGAGRKYRIIPCU-HDICACEKSA-N 397.523 2.834 0 50 GFAA CN(Cc1ccc2c(c1)OCCO2)Cc1nnc(SCc2ccncc2)n1C 15008255 DBTUHLXQIUZPBK-UHFFFAOYSA-N 397.504 2.906 0 50 GFAA CN(CCn1cccn1)C(=O)c1cc(-c2cnn(C)c2)nc2ccc(F)cc12 19225931 ZRLQAJVZPOKGJB-UHFFFAOYSA-N 378.411 2.743 0 50 GFAA COc1ccc(/C=C/CN2CCN(Cc3cccc(C)n3)[C@@H](CCO)C2)cc1 19607767 ARQZKKFTOZQFAM-LHXJMTLCSA-N 381.520 2.981 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4ccc(OC)cc4C)CC3)nn2)n1 169777350 CFCTXNYCHVOLJW-UHFFFAOYSA-N 396.451 2.685 0 50 GFAA C[C@H]1CCCN(CCOc2ccccc2CN2CCc3[nH]nc(C(=O)O)c3C2)C1 1857675467 YZXRAXJMOXZQLF-INIZCTEOSA-N 398.507 2.777 0 50 GFAA CCOCc1nnc(N2C[C@H](C(=O)NC3(CC(C)(C)C)CC3)CC2=O)s1 1857715088 APPXUUSGPNNSAG-GFCCVEGCSA-N 380.514 2.513 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@H](C)[C@@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237346527 ACVVRMGSLVHFKT-KUHUBIRLSA-N 385.464 2.804 0 50 GFAA Cc1cc(Br)ccc1S(=O)(=O)N1CCCC[C@H]1c1nc[nH]n1 133485010 ADZZRFHGSCIDDB-LBPRGKRZSA-N 385.287 2.792 0 50 GFAA CC(C)c1ccc(-n2cnnc2SCC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)cc1 249628241 UNRBRRQYWANZOD-ZLOLBAIHSA-N 398.532 2.711 0 50 GFAA COc1cc(C(=O)N2CCc3nnn(C4CC(C)C4)c3C2)cc2c1O[C@H](C)C2 870739096 WIWVNEKEIDQIIV-MFOWVQHXSA-N 382.464 2.780 0 50 GFAA CC(C)(C)c1ccnc2c(C(=O)Nc3cccc(N4CCNC4=O)c3)cnn12 1875290453 GZXUHYXRYZDNQO-UHFFFAOYSA-N 378.436 2.809 0 50 GFAA CC1(c2ccc(C(=O)NS(=O)(=O)CCc3ccc4c(c3)CCO4)cc2)CC1 1875362854 WGPYYHKAEKFSLV-UHFFFAOYSA-N 385.485 2.975 0 50 GFAA Cn1nc(O)cc1C(=O)Nc1cccc(Oc2ncc(Br)cn2)c1 1875318208 KDMFJPYMHOLHPY-UHFFFAOYSA-N 390.197 2.723 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCc2nc(CCc3ccccc3)nn2CC1 2100539829 ZWKZFBWXXDKODZ-UHFFFAOYSA-N 393.491 2.686 0 50 GFAA Cc1c(NC(=O)N2CC[C@@](N)(c3ccccc3)C2)nnn1Cc1cccc(F)c1 2325773003 HGVOJAAKUMSXJU-NRFANRHFSA-N 394.454 2.866 0 50 GFAA C[C@H](NC(=O)c1cnn(C2CCNCC2)n1)c1ccc(-c2ccncc2)cc1 2325820844 PGRBZJNMJJIYHW-HNNXBMFYSA-N 376.464 2.756 0 50 GFAA Cc1cc(C)cc(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1 101128968 OQXDSSGTXQVDLS-HXUWFJFHSA-N 379.460 2.884 0 50 GFAA CCn1c(=O)n(CC(=O)Nc2ccccc2-n2nc(C)nc2C)c2ccccc21 134143753 IQCZWUBYDAIRQG-UHFFFAOYSA-N 390.447 2.659 0 50 GFAA Cc1cccc2c(=O)oc(-c3ccc4c(c3)C(=O)N(C[C@@H]3CCCO3)C4=O)nc12 1123281 HAAWQHNQRSWMLW-AWEZNQCLSA-N 390.395 2.938 0 50 GFAA O=C(NCCc1cn2ccccc2n1)c1cc2c(s1)C1(CCNCC1)OCC2 2356136168 IWQOYMOIQGFFPZ-UHFFFAOYSA-N 396.516 2.520 0 50 GFAA COc1ccc(N[C@@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccc(Cl)cc2)cc1 4158929 LGRQAOZPZCZMGN-IAGOWNOFSA-N 395.864 2.783 0 50 GFAA COCCN1CC(=O)N(C[C@@H]2CCCN(C)[C@@H]2c2cccc(Cl)c2)C1=O 225557782 GQRLDGJQMFOVPI-MAUKXSAKSA-N 379.888 2.634 0 50 GFAA Cc1cccc(CN2CCN(c3ncnc4c(C)csc34)C[C@H]2CCO)n1 106976656 DAXGAFNWSNMWPN-QGZVFWFLSA-N 383.521 2.776 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CC[C@@H](N(C)C)C1 23158561 QBCMJADMQMACOA-LJQANCHMSA-N 391.519 2.742 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@@]1(O)CNCc1nc2ccccc2o1 67881559 OWVXLIGTWGYMAI-JOCHJYFZSA-N 379.460 2.514 0 50 GFAA Cc1nn(-c2ccc(N3CCCC3)nn2)c2c1[C@@H](c1ccc(O)cc1)CC(=O)N2 65364348 GRZUREONOHZDMC-MRXNPFEDSA-N 390.447 2.751 0 50 GFAA Cc1c(NC(=O)c2cc(S(=O)(=O)N(C)C)c(Cl)cc2Cl)cnn1C 2794035 WAVXAQNWNHDMIU-UHFFFAOYSA-N 391.280 2.538 0 50 GFAA C[C@H](c1nc2c3cnn(C)c3ncn2n1)n1nc(C(F)(F)F)cc1C1CC1 2802899 VZNXXPMDZRZZJI-MRVPVSSYSA-N 376.346 2.713 0 50 GFAA O=C(N[C@@H]1CCCN(C2CCCCCC2)C1)c1ccc(Cn2cnnn2)cc1 11813458 CXCWYZXUFVETCS-LJQANCHMSA-N 382.512 2.638 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCC[C@@H](O)C1 71775687 XIGOPRXUSOLSPG-QGZVFWFLSA-N 398.532 2.667 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N3CCC[C@@H]3C)c2=O)cc1 77320112 ICNVVUXNLZWBRZ-INIZCTEOSA-N 392.459 2.721 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1cn(Cc2ccccc2)nn1 363300169 QUGGXXAWADJCHK-UHFFFAOYSA-N 393.466 2.860 0 50 GFAA O=C(Cn1nc2n(c1=O)CCCCC2)Nc1cnccc1Oc1ccccc1 376717808 SSWRPBFAFQMOIT-UHFFFAOYSA-N 379.420 2.597 0 50 GFAA O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 332917729 ZJQFYOHHICYFQM-HIFRSBDPSA-N 398.429 2.903 0 50 GFAA COc1ccc2cc([C@H]3CN(C(=O)c4cc(C(C)=O)n[nH]4)CCO3)ccc2c1 71747074 SXEZDRUULURDHE-HXUWFJFHSA-N 379.416 2.988 0 50 GFAA O=c1cc(CN2CCC[C@@H](CCc3ccccc3C(F)(F)F)C2)[nH]c(=O)[nH]1 72151594 ZWMNIZWPXWLNCT-ZDUSSCGKSA-N 381.398 2.927 0 50 GFAA COc1ccc(CCNc2nc(-c3cccnc3)nc3c2cnn3C)cc1O 72172992 KFGYXRDZAUEBGG-UHFFFAOYSA-N 376.420 2.794 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)s1 82091194 XCKKRWXBXODYMG-KRWDZBQOSA-N 389.565 2.996 0 50 GFAA COc1ccc2c(c1)C1(CC1)CN(C(=O)CNC(=O)c1ccccc1OC)C2 290324567 FGMZKGOTQPNTCV-UHFFFAOYSA-N 380.444 2.508 0 50 GFAA CC(=O)c1cn([C@H](C)C(=O)NCc2nc(C(F)(F)F)n[nH]2)c2ccccc12 426399101 WQOLVJUXCCQJJA-SECBINFHSA-N 379.342 2.858 0 50 GFAA CCCC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 290640117 MTMVPHGUVPVDPA-DENIHFKCSA-N 390.499 2.760 0 50 GFAA Cc1ccc(-c2nnn(C)n2)cc1NC(=O)NCCCn1nc(C)c(C)c1C 426429792 KJPUVLJWFOIBIF-UHFFFAOYSA-N 382.472 2.519 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)N1CCC(OCc3cccnc3)CC1)C2 95390781 TYMFSDLPAIHBCU-GOSISDBHSA-N 382.460 2.849 0 50 GFAA CCOC(=O)c1ccc(NC(=O)N2CCCN(Cc3ccccn3)CC2)cc1 96149936 NWBQYSLRTCBTIE-UHFFFAOYSA-N 382.464 2.998 0 50 GFAA Cc1ccc(C(=O)NCc2nc(-c3ccccc3)no2)cc1N1CCNC1=O 91327117 HBTVLFGHJAENGN-UHFFFAOYSA-N 377.404 2.505 0 50 GFAA Cn1c(Cn2cccn2)nnc1C1CCN(Cc2ccc3[nH]ccc3c2)CC1 96133488 ZCADKTROIMTMFX-UHFFFAOYSA-N 375.480 2.921 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)NC[C@@H]2CCCOC2)CC1 95512802 ALMOFTKOPIPFGT-HNNXBMFYSA-N 394.899 2.886 0 50 GFAA O=CN1CCCN(C(=O)c2ccc(Sc3ccccc3Cl)nn2)CC1 294382618 DLZFAAWIWGFLRI-UHFFFAOYSA-N 376.869 2.586 0 50 GFAA Cn1cnnc1CN1CCC[C@@H](C(=O)Nc2ccccc2Oc2cccnc2)C1 95496907 IBFRIGDTDYUOLK-MRXNPFEDSA-N 392.463 2.853 0 50 GFAA CN(C)c1cncc(-c2cccc(C(=O)N3CCC(N4CCCC4)CC3)c2)n1 534661175 ZKAIQPGYTSSUJQ-UHFFFAOYSA-N 379.508 2.910 0 50 GFAA CC1(C)Cc2cccc(CN[C@H](Cc3ccccc3)C(=O)N3CCOCC3)c2O1 185168756 SJKNTNHNCPAYMZ-OAQYLSRUSA-N 394.515 2.960 0 50 GFAA O=C(c1cccs1)N1CCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 278667035 QSJUTHPRXPZXJW-HXUWFJFHSA-N 399.560 2.797 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)[C@@H]2COc3c(cccc3OC)C2)c1C 824424286 FYKHUTRXMVVSLJ-INIZCTEOSA-N 398.459 2.570 0 50 GFAA CCCc1nnc(-c2cccc(C(=O)N3CC[C@@]4(CN(C)C(=O)O4)C3)c2)s1 823020292 MMQJQOGKNRHTQC-LJQANCHMSA-N 386.477 2.824 0 50 GFAA C[C@@H](NC(=O)c1[nH]nc(N)c1-c1ccccc1)c1nc(-c2cccnc2)no1 822284905 PGNBJEGYNSNLOR-LLVKDONJSA-N 375.392 2.595 0 50 GFAA Cc1cc(CC(=O)NCC2CCN(c3nc(-c4ccccc4)no3)CC2)on1 827861473 HEZOVKCBEDEHBM-UHFFFAOYSA-N 381.436 2.608 0 50 GFAA Cc1cc(C)n([C@@H](C)CNC(=O)N2CCN(c3nc4ccccc4o3)CC2)n1 584891484 ASZPBYSVRDZOIX-INIZCTEOSA-N 382.468 2.734 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3ccc4cc[nH]c4c3)C[C@@H]2NC(C)=O)cc1 1565516719 VCQXCSXZWNWTPO-CTNGQTDRSA-N 377.444 2.921 0 50 GFAA Cc1ccc(CN2CC[C@@H](NC(=O)CCn3cc(Br)cn3)C2)cc1 1471314767 LHSPRZQFKFLSMC-QGZVFWFLSA-N 391.313 2.735 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2ccc(C)c(Br)c2)CC1 275821117 WBHZMHGOXRENGW-UHFFFAOYSA-N 383.286 2.769 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)N[C@H]2CCc3cc(Cl)ccc32)CC1 171193816 PHVJEELLEYYFHU-IBGZPJMESA-N 399.926 2.974 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)/C=C/c2ccc(OC)c(OC)c2)c1 1114972 QOZHIJMMZXHKHZ-UXBLZVDNSA-N 399.399 2.929 0 50 GFAA O=C(N[C@H](c1cccnc1)C(F)(F)F)c1cn(Cc2ccc(F)cc2)nn1 12192654 WDURZKZNSHDJSN-OAHLLOKOSA-N 379.317 2.894 0 50 GFAA O=C(c1cn(CCC2CCCCC2)nn1)N1CCN(c2ccccc2O)CC1 12207897 LBTOYSLXUQXCMY-UHFFFAOYSA-N 383.496 2.917 0 50 GFAA CN(CCc1ccccc1)[C@@H]1CCc2c(c(C(=O)N3CCSCC3)nn2C)C1 14743778 VWKCPUJWWCHBRC-GOSISDBHSA-N 398.576 2.641 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2)CN(Cc2ccc(CO)o2)CC1=O 14746537 STVKTRJAWPVYLF-OAQYLSRUSA-N 386.492 2.658 0 50 GFAA O[C@@H](COc1ccccc1CNCc1ccc(F)cc1)CN1CCSCC1 14964630 XUDHROAHIBHLNI-HXUWFJFHSA-N 390.524 2.904 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN(C)C3CCCCC3)C2=O)c1 15072783 IRCNICSMXYHJTC-NRFANRHFSA-N 378.488 2.952 0 50 GFAA COc1ccc(S(=O)(=O)Oc2ccc(/C=C3\SC(=N)NC3=O)cc2)cc1 15837732 VJGDXSTYPSGQMH-GDNBJRDFSA-N 390.442 2.602 0 50 GFAA COc1ccccc1CN1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 19831656 QGHSARYCSNMCEJ-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA Cc1nc(-c2cn([C@H]3CCCN(C(=O)c4ccc(Cl)s4)C3)nn2)no1 169777895 DOBMXWYRBVRHOP-JTQLQIEISA-N 378.845 2.829 0 50 GFAA CC(C)c1ncsc1C(=O)N[C@H]1CCC(=O)N[C@@H]1c1ccnn1C(C)C 1857529803 YURMKFCKFJKCIQ-LRDDRELGSA-N 375.498 2.794 0 50 GFAA CNC(=O)CCN(C)C(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857715238 IGJTVJZLTFXEPR-ZDUSSCGKSA-N 392.887 2.682 0 50 GFAA O=C(CCC1CCCC1)N1CCO[C@@H](CN2CCOCC2)[C@@H]1c1cccnc1 1857722364 UAZDXLKBGXWUQA-UNMCSNQZSA-N 387.524 2.653 0 50 GFAA CC(C)Oc1ccc(CN2C[C@@H]3[C@H](CNC(=O)C4CC4)[C@H]4CC[C@]3(C2)O4)cc1 1857723693 RABQAVRTCHKUSY-ZZLPTCMGSA-N 384.520 2.979 0 50 GFAA Cc1nc2c(c(=NCC3CC3)[nH]1)CC[C@@]21CCCN(C(=O)c2c(C)noc2C)C1 1875249071 COOWDRZBHRZXLO-JOCHJYFZSA-N 395.507 2.754 0 50 GFAA CS(=O)(=O)c1nc(C(=O)NC2(c3cccc(Cl)c3)CC2)c2ccccn12 150830946 XFBUQVXYVDZRRZ-UHFFFAOYSA-N 389.864 2.810 0 50 GFAA C[C@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(F)cc3Cl)CC2)C1 1704297510 BIGKZTAOMSACKJ-HNNXBMFYSA-N 377.865 2.564 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)Nc3ccccc3C(=O)O)C1)CC2 1704332521 ZDOGCBGQRGZCON-OAQYLSRUSA-N 395.463 2.753 0 50 GFAA COc1ccc([C@@](C)(O)CNC(=O)c2cnn(C)c2Cc2ccccc2)cc1 1875297981 KKHHKKSNOHBBCT-QFIPXVFZSA-N 379.460 2.657 0 50 GFAA CCn1nc(C)c(-c2cs/c(=N/c3ccccc3)n2C[C@H]2CNC(=O)C2)n1 1875266211 ZVCCTKHXAKGSBR-HFGXJBEUSA-N 382.493 2.505 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(c4c(F)cccc4F)CC3)n[nH]c21 1875394931 BSXORKVHPXLHGH-NEPJUHHUSA-N 376.407 2.673 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccccc2I)CC1 1875324129 IOZATBBTYDEKNM-UHFFFAOYSA-N 384.217 2.654 0 50 GFAA O=C(O)c1n[nH]c2ccc(NCc3ccc(OCCN4CCOCC4)cc3)cc12 1875300068 JVSDFBOICBHMHT-UHFFFAOYSA-N 396.447 2.584 0 50 GFAA CCCc1cc(C(=O)N[C@H]2CCN(c3ncnc(CC)c3F)C[C@H]2CC)n[nH]1 1875334106 YHIUTHXQBSFVCN-CJNGLKHVSA-N 388.491 2.889 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2ccc3c(c2)N(C(=O)OC(C)(C)C)CC3)[C@@H](C)C1 1875381458 VWMAQOLAEOECHH-HNNXBMFYSA-N 399.491 2.843 0 50 GFAA Cn1ncc2c(NC[C@]34CCC[C@H]3CN(C(=O)c3ccncc3)C4)ccnc21 888103604 PGTQDWZCAWIXEL-KKSFZXQISA-N 376.464 2.718 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)[C@]2(C)CCCOC2)n1 1775990779 FHASMZDXVFHQFE-KHSSZTOVSA-N 398.429 2.846 0 50 GFAA CC1(C)O[C@]2(CCCN(C(=O)[C@@]3(c4ccccc4)C[C@H]3C(F)(F)F)C2)NC1=O 2325784336 VHTVHDWVLWDNEA-MDASCCDHSA-N 396.409 2.750 0 50 GFAA O=C(C[C@@H]1CN(Cc2ncc[nH]2)C2(CCC2)CO1)N1CC=C(C(F)(F)F)CC1 2325785157 GCYWUNRHXKQOTH-OAHLLOKOSA-N 398.429 2.644 0 50 GFAA Cc1cn2c(n1)CC[C@H](CN(C)C(=O)c1ccc(=O)n(-c3ccccc3)c1)C2 2325798658 MUWTWNYMTAWVTL-QGZVFWFLSA-N 376.460 2.677 0 50 GFAA Cc1ccc(-n2[nH]c(C(=O)N3CCCN[C@H](c4ccccc4)C3)cc2=O)cc1C 2325798840 CXDNLHDHMNERNV-NRFANRHFSA-N 390.487 2.959 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1 721045 XCUDGQITAILRDV-JTQLQIEISA-N 380.326 2.917 0 50 GFAA Cc1ccc(S(=O)(=O)N2C(=O)CC[C@H]2C(=O)Nc2ccc(C)c(C)c2)cc1 1117487 LZKBAACBWRLMMT-SFHVURJKSA-N 386.473 2.930 0 50 GFAA O=C(c1ccc(Cl)cn1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356169589 DJNBJJOIHZPCDM-JXXFODFXSA-N 391.899 2.636 0 50 GFAA CC(C)c1nnc(NC(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)s1 4731758 AGLLLIIPTNVEFW-ZDUSSCGKSA-N 376.457 2.830 0 50 GFAA Cc1cccnc1NC(=O)CCc1nnc2ccc(NCc3ccco3)nn12 9744623 GPKTXKBEXCAJEF-UHFFFAOYSA-N 377.408 2.604 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC(Cn3cc(-c4ccc(F)cc4)nn3)CC2)c[nH]1 20256105 LUXITQLNULBJLV-UHFFFAOYSA-N 395.438 2.633 0 50 GFAA CN(CCc1nc(C2CC2)nn1-c1ccccc1C(F)(F)F)S(C)(=O)=O 65460893 DNOOSYGOFHSEDK-UHFFFAOYSA-N 388.415 2.597 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccncc2)c(Cl)cc1Cl 1071905 INJQGVPVMRLLAQ-UHFFFAOYSA-N 388.276 2.569 0 50 GFAA O=C1CCN1c1cccc(-c2noc(-c3ccnc(N4CCCCC4)n3)n2)c1 252487843 ICFVYVMRWGBNTN-UHFFFAOYSA-N 376.420 2.921 0 50 GFAA Cn1nc(C(F)F)c2cc(C(=O)N3CCC[C@@H]3[C@H]3COCC[C@@]3(C)O)sc21 329006528 NASRURNWGKMYRD-SEDUGSJDSA-N 399.463 2.965 0 50 GFAA Cn1nc(NC(=O)CCCn2cncn2)c2c(Oc3cccnc3)cccc21 72476413 BPVSWKKFTXWFJA-UHFFFAOYSA-N 377.408 2.771 0 50 GFAA O=C(CNC(=O)c1ccc(F)c(F)c1)Nc1ccn(-c2ncccc2Cl)n1 126515073 BJYSRVOBEAQDIW-UHFFFAOYSA-N 391.765 2.567 0 50 GFAA CC(C)CNC(=O)C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72158441 HXVUEDVBYYBQSM-OAQYLSRUSA-N 395.503 2.942 0 50 GFAA O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1ccc(-c2cccnc2)cc1 363430836 IFDGZZUSIYMRQQ-KDURUIRLSA-N 377.444 2.540 0 50 GFAA CN(CCCN1CC2(CCN([C@@H]3CCOC3)CC2)OC1=O)C1CCCCC1 72425002 JLTLHNWHBWCODV-LJQANCHMSA-N 379.545 2.717 0 50 GFAA CCn1nc2c(cc1=O)CN(C(=O)Nc1ccc(OC)c(OC(C)C)c1)CC2 363904709 ADOFJBMPMBTDTF-UHFFFAOYSA-N 386.452 2.649 0 50 GFAA CC(C)(C)c1ccc([C@H](CC(=O)O)NC(=O)Cn2c(=O)[nH]c3ccccc32)cc1 236703594 CILPEAGYWNGLNL-KRWDZBQOSA-N 395.459 2.959 0 50 GFAA CN(C)c1nnc(-c2ccc(NC(=O)NC[C@@](C)(O)c3cccs3)cc2)o1 153607264 SDHWFMIFZHRTHB-GOSISDBHSA-N 387.465 2.893 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(c3ncnc4ccsc34)CC2)C1)N1CCCC1 71763963 QRQCCRNEQKDBBZ-MRXNPFEDSA-N 399.564 2.995 0 50 GFAA CC(C)CC(=O)Nc1ccc(C(=O)N2CCC[C@H]2C(=O)NC2CC2)cc1F 172743040 GJHQZLNVKJBQLO-KRWDZBQOSA-N 375.444 2.694 0 50 GFAA Cc1ccc2oc(CN3CCN[C@@H](C(=O)NCc4cccnc4)C3)c(C)c2c1 72152045 RMNCZHFGVMFDHL-LJQANCHMSA-N 378.476 2.535 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccn(-c2ccccc2F)n1 130070384 AAZJNMFSJMSSCU-IBGZPJMESA-N 392.434 2.932 0 50 GFAA CC[C@@H](NC(=O)N1CCc2ccc(S(C)(=O)=O)cc2CC1)c1nccs1 374832914 MUTWIQHZBGZIQO-MRXNPFEDSA-N 393.534 2.808 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CC[C@H](CN3CCCC3)C2)CC1 174217543 DESRKTIAQOOGFD-GOSISDBHSA-N 386.540 2.791 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCOC[C@@H]3C[C@H](O)c3ccco3)cc2)CC1 158903630 ZWYSFYMDMYMTQV-OALUTQOASA-N 383.448 2.830 0 50 GFAA CCOc1cc(C(=O)NC[C@@H](C)c2c(C)noc2C)ccc1OCC(=O)O 262873659 WVEPWPFUIGHPCT-LLVKDONJSA-N 376.409 2.687 0 50 GFAA O=C(CCCN1CCCC1=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 222548349 MBKBWZCGPMWKGJ-CWZMJNCASA-N 381.476 2.566 0 50 GFAA O=C(O)c1cc2cc(NC(=O)[C@H]3CC34CCS(=O)(=O)CC4)ccc2s1 263288948 QLTVLOBNCPIKOK-GFCCVEGCSA-N 379.459 2.753 0 50 GFAA O[C@H](COCc1ccccc1Cl)Cn1cnc2c(N3CCCC3)ncnc21 176943122 FEPKRQQZXUDNHY-HNNXBMFYSA-N 387.871 2.658 0 50 GFAA O=C1CCC[C@H](CC(=O)NC2(c3cccc(C(F)(F)F)c3)CCOCC2)N1 289428942 NLDQGOFVNYPKRJ-OAHLLOKOSA-N 384.398 2.886 0 50 GFAA CN(CCn1ccc2ccccc21)C(=O)[C@H]1CC(=O)N(Cc2ccncc2)C1 97568974 FGULVTJKQVUXKU-IBGZPJMESA-N 376.460 2.543 0 50 GFAA CN(C)CCO[C@H]1C[C@@H](O)C12CCN(c1nnc(-c3ccccc3)s1)CC2 91452401 NKDLDESEJFSBNY-SJORKVTESA-N 388.537 2.503 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2CCOc3ccccc3C2)cc1N1CCNC1=O 95354157 QUBZBJONVFDKPG-INIZCTEOSA-N 379.460 2.896 0 50 GFAA CCCc1ccc(CN2CC[C@H](N3CCN(C)CC3)[C@H](CCC(=O)O)C2)o1 95524811 WCFGVGQCSTZEII-XLIONFOSSA-N 377.529 2.535 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@@H]([C@H](C)N)C1)c1ccc(Br)cc1 299739274 MRTYWIVCKURNLK-XGWLTEMNSA-N 396.329 2.602 0 50 GFAA Cc1cc(NC(=O)c2ccccc2N2CCOCC2)ccc1NC(=O)CN(C)C 952967268 LEKINTZVPHTDGT-UHFFFAOYSA-N 396.491 2.584 0 50 GFAA Cc1noc(C)c1CO[C@H]1COCC[C@@H]1NC(=O)Cc1c[nH]c2ccccc12 1565512417 IXNPIJKZKCIUAF-PMACEKPBSA-N 383.448 2.806 0 50 GFAA O=C(c1ccccc1-n1cncn1)N(CCOc1ccccc1)C[C@@H]1CCCO1 952968518 KHKHUALSGKVWKW-IBGZPJMESA-N 392.459 2.968 0 50 GFAA Cc1nc(C)c(S(=O)(=O)NC(=O)c2ccc(F)c(COC(C)C)c2)s1 170650475 DOFPLMCKVBNNMB-UHFFFAOYSA-N 386.470 2.943 0 50 GFAA CCc1nccn1[C@H]1CCCN(S(=O)(=O)CCc2ccc3c(c2)CCO3)C1 189634924 PYQHGGAKXJKOLD-SFHVURJKSA-N 389.521 2.590 0 50 GFAA COc1ccccc1-n1ncc(C(=O)N2CCc3ccccc3[C@H]2CO)c1C 192561959 RYHAQTABXNKXMI-HXUWFJFHSA-N 377.444 2.921 0 50 GFAA Cc1ccc(C(=O)N(Cc2ccccn2)C[C@H]2CCCO2)cc1N1CCNC1=O 1506407895 KTYCYZZQEMSAPQ-LJQANCHMSA-N 394.475 2.741 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2sccc2C)cc1OC 1529154118 HHPRQQQOVBULMI-IAGOWNOFSA-N 377.462 2.648 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3csc(-c4cccs4)n3)C[C@@H]12 1704315757 VNDBWEUVWZXUDX-KDOFPFPSSA-N 391.518 2.883 0 50 GFAA CC1=CC2(CCN(C(=O)CN3CCN(c4cccc(C)c4)CC3)CC2)OCC1 1704325852 USZJZZZTEUHXET-UHFFFAOYSA-N 383.536 2.845 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(c3ccnc(C)n3)C[C@]2(CCc2ccccc2)C1 1772815406 LGKXTDNTDSZHPO-NZQKXSOJSA-N 394.519 2.719 0 50 GFAA CCNC(=O)c1cn([C@@H](C)CC)cc(C(=O)NCc2cc(F)ccc2C)c1=O 11788647 AGMXMUXTYONVPC-AWEZNQCLSA-N 387.455 2.947 0 50 GFAA COc1cccc(N2C(=O)CN(C(=O)COc3ccc(C(C)=O)cc3)C[C@@H]2C)c1 11871653 RSEQLXPJEXQXCZ-HNNXBMFYSA-N 396.443 2.541 0 50 GFAA CC(C)CCCN1CC[C@@H](N2CCN(C(=O)c3ccco3)CC2)CCC1=O 12040885 LXVDYTZRRPMTKU-SFHVURJKSA-N 375.513 2.855 0 50 GFAA CC(C)(C)c1ccc(C(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)cc1 13008789 YPMRMJBGHYXMDX-UHFFFAOYSA-N 390.491 2.922 0 50 GFAA CSc1ccccc1C(=O)N1CCC[C@@H](CCC(=O)N2CCN(C)CC2)C1 14949895 LCJZAZMVTTWRNG-KRWDZBQOSA-N 389.565 2.815 0 50 GFAA O=C(NCCn1cccn1)c1coc(COc2cccc(C(F)(F)F)c2)n1 14962758 HQXSGCCASIXEPU-UHFFFAOYSA-N 380.326 2.899 0 50 GFAA COCCNc1ncnc2sc(C(=O)N(C)Cc3cscn3)c(C)c12 14982109 YEPRGIOMZCOXJG-UHFFFAOYSA-N 377.495 2.787 0 50 GFAA Cc1nc(CN2CCC3(CC2)CN(CCC(C)C)C[C@@H]3C(=O)O)n(C)c1C 1857681659 BPAVCMALHMFTBV-GOSISDBHSA-N 376.545 2.682 0 50 GFAA COc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccoc4)[C@H]4CC[C@]3(C2)O4)c1 1857716269 FDKMIDMCBYXKGL-GPQLQYNLSA-N 382.460 2.698 0 50 GFAA CC(C)NC(=O)CNC(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857723590 MMIYRQQEVGEODS-ZDUSSCGKSA-N 392.887 2.729 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC[C@@H](n2ncc(N3CCC3)cc2=O)C1 328602859 CZPZEQUJZONNJP-MRXNPFEDSA-N 386.883 2.893 0 50 GFAA Cc1nc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)[nH]c(=O)c1CCO 11905684 XFYULAPUSQEPBO-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA O=C(Nc1ccn(CCc2ccncc2)n1)[C@H]1CCO[C@@H](c2ccccc2)O1 847413881 CNUVLJWKRXVFIN-WIYYLYMNSA-N 378.432 2.964 0 50 GFAA CC(C)(C)OC(=O)c1c(NS(=O)(=O)c2cncc(F)c2)nc2n1CCCC2 864096972 XZINDIISWUPTIF-UHFFFAOYSA-N 396.444 2.510 0 50 GFAA C[C@H](NC(=O)[C@@H](C)N1CCc2c(O)nc(O)nc2C1)c1ccc2ccccc2c1 1875308072 RPFSDZSUXHAAKU-UONOGXRCSA-N 392.459 2.665 0 50 GFAA COC(=O)COc1cccc(C(=O)Nc2cc(-c3ccc(OC)cc3)ncn2)c1 1875356466 LKBABVCGFSPTHR-UHFFFAOYSA-N 393.399 2.956 0 50 GFAA C[C@H]1CN(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)C[C@@]1(C)CO 888101911 KEPBDPOZULKPLC-LIRRHRJNSA-N 382.526 2.882 0 50 GFAA Cn1cc(N2C[C@H](Nc3ccnc4cc(Br)ccc34)CC2=O)cn1 2325857308 WWJRCRCKPZRZGY-GFCCVEGCSA-N 386.253 2.948 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2CCNC(=O)[C@H]2c2ccc(F)cc2C)c1 2325888914 LNANMBYIEUTMQA-LJQANCHMSA-N 381.407 2.572 0 50 GFAA Cc1cc2c(cc1CN1CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C1)OCCO2 2356155988 QJKRIJGXERIGHH-TZIWHRDSSA-N 377.481 2.840 0 50 GFAA CC(=O)c1ccc(NC(=O)CSc2nc(=O)cc(N)n2-c2ccccc2)cc1 2876620 HCUFOCNNMFDBHA-UHFFFAOYSA-N 394.456 2.748 0 50 GFAA COc1ccc(N(CC(=O)Nc2cc(C)ccc2C)S(C)(=O)=O)cc1OC 2966315 ILGQWFINNGODMQ-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@@H]1NCCOc1cc(Cl)cc(Cl)c1 225671656 NISVOVOKWOGNAV-GJZGRUSLSA-N 381.325 2.822 0 50 GFAA CCOC(=O)c1cn(CCc2nncn2CC)cc(Oc2ccccc2)c1=O 55361072 HBRPUZKWNFENJR-UHFFFAOYSA-N 382.420 2.671 0 50 GFAA COc1ccc(-c2noc(CN(C)C[C@@H](O)c3ccccc3)n2)c(OC)c1OC 20784778 XDUFXOQXCGPXCJ-MRXNPFEDSA-N 399.447 2.928 0 50 GFAA CN1CCN(c2ccc(N3CCC(NCCc4ccccn4)CC3)cc2)C1=O 23380480 UCEKKMJITMFYJK-UHFFFAOYSA-N 379.508 2.755 0 50 GFAA O=C(NCCC(=O)N1CCCC[C@@H]1CCN1CCCC1)c1ccccc1F 55359335 YEVWBKIRTKAKAG-QGZVFWFLSA-N 375.488 2.813 0 50 GFAA O=C(c1ccc(Cl)cc1)c1ccc(OC[C@H](O)CN2CCOCC2)cc1 20293856 WXHVFFOONPLLGV-GOSISDBHSA-N 375.852 2.643 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(-c4ccc(O)c(OC)c4)[nH]c3C2)c1 65397920 OAEAKGZALNSIDB-AWEZNQCLSA-N 379.416 2.869 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2cccnc2)C1)N1CCN(c2ccccn2)CC1 20363444 AJIHVCICRLGSEX-FQEVSTJZSA-N 393.535 2.818 0 50 GFAA Cc1cc(NC(=O)c2ccc3c(c2)CCC(=O)N3)cc(N2CCN(C)CC2)c1 252501752 UJIARBGGWRIFEQ-UHFFFAOYSA-N 378.476 2.884 0 50 GFAA O=C(c1cccc2nccn12)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328614518 AHDFAOHJYBKTRU-INIZCTEOSA-N 377.448 2.623 0 50 GFAA C[C@H]1CCCC[C@@H]1NC(=O)CS(=O)(=O)Cc1nnc(-c2ccccc2)s1 122442695 KRIJZJJOJQFIGB-ZFWWWQNUSA-N 393.534 2.815 0 50 GFAA Fc1ccccc1-c1noc(Cn2nnc(-c3ccc(Br)o3)n2)n1 435771946 NOUZARWUHQTTCO-UHFFFAOYSA-N 391.160 2.933 0 50 GFAA CCOc1ccccc1CCNC(=O)c1cc(-c2c(C)nn(C)c2C)nn1C 216360288 NKVWJCHJLGMIOJ-UHFFFAOYSA-N 381.480 2.809 0 50 GFAA Cc1ccccc1NC(=O)N1CCO[C@@H](C(=O)N2CCc3ccccc3C2)C1 72407051 OKXXMCVWSAROBY-HXUWFJFHSA-N 379.460 2.813 0 50 GFAA CC1(C)CN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)[C@H]1c1ccncc1 367929233 IBXVLZSMHNTWSU-SFHVURJKSA-N 393.447 2.748 0 50 GFAA CCn1nncc1C(=O)N(Cc1cc(C)nc(N2CCCCC2)n1)CC(C)C 494139135 YGUKVIHEPCQTNB-UHFFFAOYSA-N 385.516 2.685 0 50 GFAA CC(C)c1nnc(/C=C/C(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)o1 376648076 DICIGPMKMVQQLK-WAVCKPEOSA-N 397.479 2.881 0 50 GFAA O=S(=O)(Cc1noc(-c2ccc(Cl)cc2)n1)c1nnc2n1CCCCC2 125323940 KGJKDLPBXPKUBO-UHFFFAOYSA-N 393.856 2.682 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCC(c2nc(C)no2)CC1)c1ccc(F)cc1F 172791406 BJFWAEWRIHVQDM-KRWDZBQOSA-N 392.406 2.630 0 50 GFAA COCCN1CCn2c(nc3cc(NC(=O)c4ccc(OC)cc4)ccc32)C1 19874448 XBVRGODRZFHYLL-UHFFFAOYSA-N 380.448 2.759 0 50 GFAA O=C1C[C@@H](NC(=O)N2CCC(OCc3ccccn3)CC2)c2ccccc2N1 426624725 DQOAQUSBEFRTMK-LJQANCHMSA-N 380.448 2.856 0 50 GFAA NC(=O)[C@@H](c1ccccc1)N1CCN(Cc2ncc(C(F)(F)F)s2)CC1 289919389 VRBDRSJQTMHAKH-OAHLLOKOSA-N 384.427 2.506 0 50 GFAA CC[C@H](NC(=O)c1cc(C)nc2[nH]c(=O)[nH]c(=O)c12)C12CC3CC(CC(C3)C1)C2 20607262 YHDKKOZGXYWBNS-UTQJESMHSA-N 396.491 2.645 0 50 GFAA Cc1ncc(S(C)(=O)=O)c(N2CCc3[nH]c4c(Cl)cccc4c3C2)n1 95385432 ZFRWVOBWWHRECL-UHFFFAOYSA-N 376.869 2.886 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)c2cn(C)c3ccccc23)C1 95380801 NMSPHGQLCFCROJ-KRWDZBQOSA-N 379.508 2.956 0 50 GFAA COc1ccc(NC(=O)N2CCC3(CC2)c2ccccc2C[C@H]3O)c(OC)n1 96153875 APUFJOPVKRESKC-QGZVFWFLSA-N 383.448 2.582 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)c3cccc([C@H]4CCCNC4)c3)CC2)n1 95354719 FSWYDCBJYGVJCX-FQEVSTJZSA-N 379.508 2.523 0 50 GFAA CC[C@H](C)[C@@H](CO)NC(=O)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O 252585004 FLMRIIGSFMEMHE-DQLDELGASA-N 380.488 2.777 0 50 GFAA biogenic COC(=O)c1cn(-c2ccc(-c3ccc(CO)o3)c(Cl)c2)cc2c(=O)[nH]nc1-2 253413554 VBYMTUOUQNIGAU-UHFFFAOYSA-N 399.790 2.858 0 50 GFAA Cc1nn(C)c(C)c1[C@@H](C)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl 299781305 HQKSCBMNEXBXSR-SECBINFHSA-N 383.279 2.951 0 50 GFAA COCCN1C[C@H](CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)CC1=O 299788410 PDUZPRKAMJHEHC-AWEZNQCLSA-N 386.323 2.610 0 50 GFAA C[C@@H](NC(=O)c1ccccc1N1CCOCC1)c1ccc(-n2cncn2)cc1 488887216 AWBSDTFJESTZIX-MRXNPFEDSA-N 377.448 2.595 0 50 GFAA Nc1ccc(C(=O)N2CCC[C@H](CNC(=O)CCCc3cccs3)C2)cn1 952970836 VTDJGYXNEONJAS-OAHLLOKOSA-N 386.521 2.717 0 50 GFAA CNS(=O)(=O)c1ccc(NCc2ccc(-n3ccnc3)c(F)c2)c(F)c1 301986270 ZGRGFMFAQLRYJB-UHFFFAOYSA-N 378.404 2.671 0 50 GFAA Cn1cncc1CCC(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 170610273 PQINEOSJGHHYOS-MRXNPFEDSA-N 378.270 2.715 0 50 GFAA CCN1CCCN(C(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)CC1=O 190463255 HWJYVKCTKKFNRK-UHFFFAOYSA-N 381.263 2.874 0 50 GFAA CC(C)(C)c1nc(CN2CCCN(C(=O)c3coc(C4CCC4)n3)CC2)no1 192616220 AKQWAFVCTVOSSH-UHFFFAOYSA-N 387.484 2.971 0 50 GFAA O=C(Nc1cncnc1N1CCCC1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 760634920 XONPIZZHAADESY-QGZVFWFLSA-N 391.475 2.557 0 50 GFAA CCCn1nc(C)c(NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)c1C 1506418165 VEYQTLPLXBSYGW-UHFFFAOYSA-N 378.498 2.623 0 50 GFAA COc1cccc(OC)c1C(=O)N1CCCN(c2ccc(C(C)=O)cn2)CC1 1772813759 RZHNRMRHXZDCBE-UHFFFAOYSA-N 383.448 2.654 0 50 GFAA CN(Cc1nccs1)C(=O)c1cc(COc2ccc(-n3cncn3)cc2)on1 11814195 CWIYYWOWDIOQTD-UHFFFAOYSA-N 396.432 2.563 0 50 GFAA CCNC(=O)c1cn([C@H](C)CC)cc(C(=O)NCc2ccc(F)c(F)c2)c1=O 11814218 OPEFECJUZILDBG-GFCCVEGCSA-N 391.418 2.777 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(Cc3cc4ccccc4[nH]3)CC2)O1)[C@@H]1CCCO1 11995844 WAPJOWWYILVEMS-FPOVZHCZSA-N 397.519 2.977 0 50 GFAA Cc1ccsc1C(=O)N[C@@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 12314242 PXXYZKATHUPCTE-MRXNPFEDSA-N 386.521 2.863 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2F)CN(C(=O)c2ccncc2)CC1=O 14532220 DGPQRNROISDMHV-LJQANCHMSA-N 399.466 2.747 0 50 GFAA COc1ccc(-n2c(CCNC(=O)Cc3ccccc3)nnc2SC)cc1 14881570 KKTDGLAYTFKPEU-UHFFFAOYSA-N 382.489 2.899 0 50 GFAA CCOc1ccc(CN2CCC(n3cc(C(=O)NCC(C)C)nn3)CC2)cc1 14983044 SAGDFOYIRGWQND-UHFFFAOYSA-N 385.512 2.900 0 50 GFAA CCOc1ccc(/C=C(/NC(=O)c2ccc(C)cc2)C(=O)N[C@H](C)C(=O)O)cc1 16675733 NHXVYPWNHGXYKX-DQPIFXJKSA-N 396.443 2.754 0 50 GFAA COCCCN=c1[nH]c(C)nc2c1CCC21CCN(Cc2cscn2)CC1 1857692596 LVTQTKPIRKGMBK-UHFFFAOYSA-N 387.553 2.592 0 50 GFAA O[C@H]1CN(Cc2cccc(OCCCn3ccnc3)c2)C[C@H]1Cc1ccncc1 1857716801 FLAXBIKAKSGECE-GGAORHGYSA-N 392.503 2.783 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CC(=O)N([C@H](C)c3ccccc3)C2)cc1C(=O)O 120743322 APLCRQFSDMRNGI-CJNGLKHVSA-N 384.432 2.854 0 50 GFAA COc1ccc(CC[C@H](C)N2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)cc1 11910255 NQIKEOQFWLMLGF-INIZCTEOSA-N 397.523 2.837 0 50 GFAA CCCOc1ccc(CNC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)c(C)c1 241644561 PRTBCQILDWZLPC-UHFFFAOYSA-N 396.491 2.835 0 50 GFAA CN1CCC[C@H]1[C@@H]1CCCN1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 363403790 FLMJNPXFJIMWHL-SFTDATJTSA-N 394.519 2.665 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2cc(=O)c3cc(Cl)ccc3[nH]2)C[C@H]1O 1704331156 PCYMNPOZZQDZNK-MJGOQNOKSA-N 378.856 2.619 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CC(O)(c2ccccc2)C1 807752531 DOGMUNCLRULZBD-UHFFFAOYSA-N 388.349 2.630 0 50 GFAA Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1CC(=O)N1CC[C@@H](F)[C@H](O)C1 1875278594 NONJQVPNEJPYKM-IAGOWNOFSA-N 399.388 2.982 0 50 GFAA C[C@@](Cc1ccc(F)cc1)(NC(=O)c1cc(C2CC2)nc2ccnn12)C(=O)O 1875277927 OBMIIZYBIHGSQR-FQEVSTJZSA-N 382.395 2.562 0 50 GFAA Cn1cc(N2C[C@H](C(=O)OC3CC(c4cc(F)cc(F)c4)C3)CC2=O)cn1 2325779724 ZULWXERLJMDBED-UIORMTCPSA-N 375.375 2.541 0 50 GFAA O=C(c1ccccc1)N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 634588 TUOHAIMSYDWAQE-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA Cn1ccnc1C(=O)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2356136831 LLHBQKYYUKGWDP-OAQYLSRUSA-N 390.487 2.998 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)c1cccc(Cl)c1 4454673 YNTFDFUGVAFISD-UHFFFAOYSA-N 378.881 2.691 0 50 GFAA CC(C)CCN1C(=O)c2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2C1=O 4808295 CPDCCYUMCNLXRU-UHFFFAOYSA-N 394.427 2.957 0 50 GFAA O=C(CN1CCN(Cc2ccccc2)CC1)Nc1ccc(Br)cn1 21965921 WXOITNTZFBNVSB-UHFFFAOYSA-N 389.297 2.600 0 50 GFAA Cc1nc2c(c(=O)[nH]1)CN(C(=O)c1csc3nc(-c4ccccc4C)cn13)C2 67643296 IDKLFXVEXBOKAS-UHFFFAOYSA-N 391.456 2.919 0 50 GFAA COc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCN(C)CC2)n3C)cc1 20706774 NGSSSZPCIDRBAW-UHFFFAOYSA-N 393.491 2.582 0 50 GFAA Cn1nc(-c2ccccn2)c2c1NC(=O)C[C@@H]2c1cc2ccc(F)cc2[nH]c1=O 67981716 CTJIKNZJPLSETH-CYBMUJFWSA-N 389.390 2.937 0 50 GFAA O=C1CN(C(=O)CN2CCC(OCc3ccccc3)CC2)c2ccccc2N1 119952872 PPTBKAJGEFVPKR-UHFFFAOYSA-N 379.460 2.653 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c1 72446829 MNXNNGCQPITCAN-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CN1C(=O)C[C@@H](CNCc2ccn(Cc3ccccc3)c2)[C@@H]1c1cnn(C)c1 328619756 GEKQLVLFMOHGEH-SIKLNZKXSA-N 377.492 2.579 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1)c1ccc(F)c(F)c1 125941739 JOSGCVSQOOWGMC-VQIMIIECSA-N 388.414 2.809 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(C(=O)CCC3CC3)CC2)C1 71747932 VYRLWXFCEYYZFE-FQEVSTJZSA-N 398.551 2.591 0 50 GFAA COc1ccc(CN2CCN(c3nc(C)cc(C(F)(F)F)n3)CC2)cc1O 72158864 FVNYBTFLNJBJIU-UHFFFAOYSA-N 382.386 2.840 0 50 GFAA Cc1c(NC(=O)c2ccc3c(n2)CCCC3)cccc1C(=O)N1CCOCC1 333589101 WQBJSJXPDKCBFK-UHFFFAOYSA-N 379.460 2.994 0 50 GFAA C[C@H](NC(=O)C1CCCC1)C(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 333740007 LHRIMKHYEVFVRV-DZGCQCFKSA-N 390.446 2.889 0 50 GFAA O=C(CN1CCN(Cc2ccc([C@@H]3CCCCO3)o2)CC1)N1CCCCC1 72454479 XOEZRPOMTFLQJP-IBGZPJMESA-N 375.513 2.651 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2S(=O)(=O)c2ccc3ccccc3c2)O1 242196982 XGRRCLPTJQVYEO-PZGXJPJSSA-N 389.473 2.712 0 50 GFAA Cc1cccc2nc(C(=O)N3CCC[C@@H](Cn4cc(CC(C)C)nn4)C3)cn12 48063585 HZMFMDQEOWHNTI-QGZVFWFLSA-N 380.496 2.985 0 50 GFAA Cc1cc(F)ccc1-n1cc(O)c(C(=O)N2CCC(Cn3cccn3)CC2)n1 176116196 FQTSJEXBSDDYES-UHFFFAOYSA-N 383.427 2.774 0 50 GFAA CC1=C[C@@H]2[C@@H]3C(=O)NC(=O)[C@@H]3[C@@H](C(=O)c3cccs3)N2c2ccc(C)cc21 137356421 NJXWMPDQQFJXCZ-UBDQQSCGSA-N 378.453 2.802 0 50 GFAA CCn1cc(CN(CCOC)C(=O)c2cccc(-c3ncccc3N)c2)cn1 426387818 RYBCTTBLURVYNX-UHFFFAOYSA-N 379.464 2.836 0 50 GFAA Cc1nc(O)cc(CSc2nnc(C3CCNCC3)n2Cc2ccccc2)n1 426409312 LFRWBCPNNRRCDG-UHFFFAOYSA-N 396.520 2.890 0 50 GFAA Cc1nc(Cl)ccc1NC(=O)NC[C@H](c1ccncc1)N1CCOCC1 96163445 RCTRMOSNKDQHEY-MRXNPFEDSA-N 375.860 2.633 0 50 GFAA Cc1cccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2c[nH]c(=O)cc2O)c1C 91871674 AQACUTYUJKLHNR-INIZCTEOSA-N 378.432 2.690 0 50 GFAA Cc1cccc(Cl)c1C(=O)N1C[C@H]2CN(CC3CCC3)C[C@@]2(C(=O)O)C1 96179681 YEWZAKDAMXIUEQ-FOIQADDNSA-N 376.884 2.907 0 50 GFAA Cc1cc(N2CCC(NCc3cnn(C)c3)CC2)nc(-c2ccccc2O)n1 95522608 UIRSGDMMBRIGNZ-UHFFFAOYSA-N 378.480 2.650 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cc(-c2ccc(Br)s2)n[nH]1 253408625 KXOCQKVSXYYHGU-QMMMGPOBSA-N 390.328 2.745 0 50 GFAA Cn1cccc1CNC(=O)C[C@H]1N=C(O)N(c2cccc3ccccc23)C1=O 252537403 LBEMKQHZLDIHTM-QGZVFWFLSA-N 376.416 2.514 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)Nc1cnn(Cc2ccccc2)c1 298956313 LKNCJYCUCPGPJY-UHFFFAOYSA-N 375.436 2.557 0 50 GFAA CC[C@@]12C[C@H]3C[C@@](O)(C1)C[C@@](C(=O)N1CCN(C(=O)c4ccco4)CC1)(C3)C2 822692529 ATCDMUQJNDMNHK-IDZYALCFSA-N 386.492 2.676 0 50 GFAA CCC(=O)N1CCC2(CC1)CN(Cc1cccc(Cn3cccn3)c1)CCO2 822529886 WXDSGCKUTMCRQC-UHFFFAOYSA-N 382.508 2.535 0 50 GFAA COc1ccc(Cl)cc1CN(C)C(=O)N[C@@H]1CCCN(C(=O)C2CC2)C1 584897481 BIGALCOPVCONDI-MRXNPFEDSA-N 379.888 2.891 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCn3cccc3[C@H]2c2cccnc2)c1C 952873205 XCMSPXSMACVGMK-OAQYLSRUSA-N 377.448 2.531 0 50 GFAA O=S(=O)(c1ccc2nc[nH]c2c1)N1C[C@@H]2CC[C@H]1CN(Cc1ccccc1)C2 952860321 MGWHESMCPHQGSC-MSOLQXFVSA-N 396.516 2.848 0 50 GFAA Cc1nccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)n1 185439298 WWKTTZMMSONBGK-UHFFFAOYSA-N 377.448 2.640 0 50 GFAA O=C(c1cnc(-c2ccco2)s1)N1CCN(C(=O)c2ccccc2O)CC1 170892853 CSGXIDKFJBDRNZ-UHFFFAOYSA-N 383.429 2.707 0 50 GFAA CN(CC(=O)O)C1CCN(C(=O)c2cc(Cl)ccc2Br)CC1 186628956 MIDFSMRPABYSFM-UHFFFAOYSA-N 389.677 2.724 0 50 GFAA Cc1cnccc1N1CCCN(CC(=O)NCCc2cccc(Cl)c2)CC1 1529145015 AHEBVNKRAFQDAM-UHFFFAOYSA-N 386.927 2.914 0 50 GFAA CCn1cc(C(=O)N2CCCN(Cc3coc(-c4ccccc4)n3)CC2)cn1 1775976478 AHLNWMXZSZHUSG-UHFFFAOYSA-N 379.464 2.906 0 50 GFAA Cc1cnn(CCCN2C[C@H]3CN(Cc4ccccc4)C[C@]3(CCC(=O)O)C2)c1 1772809442 WOQZTCQNVMQKFF-GMAHTHKFSA-N 396.535 2.880 0 50 GFAA CNC(=O)c1c(NC(=O)c2cccc(N3C(=O)CCC3=O)c2)sc2c1CCC2 5055711 ZCUCCDVVNGGAQN-UHFFFAOYSA-N 397.456 2.502 0 50 GFAA C[C@H](c1ccon1)N(C)C(=O)Cn1cc(NC(=O)CSc2ccccc2)cn1 12054013 NHTYPENXABZYMJ-CQSZACIVSA-N 399.476 2.822 0 50 GFAA COc1ccc(/C=C/CN2CCC[C@@H](n3cc(C(=O)N4CCCC4)nn3)C2)cc1 12510921 ZYADLHCUOHMQJG-FHHGHWCOSA-N 395.507 2.873 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccnn4C)C3)C2)c1OC 12751923 UZUSPCJABQGYKV-JOCHJYFZSA-N 398.507 2.566 0 50 GFAA O=C(CCN1CCCC1=O)N[C@H]1CCCc2c1cnn2-c1ccc(F)cc1F 14950734 FPMHYCQEXLXUMZ-INIZCTEOSA-N 388.418 2.657 0 50 GFAA COCCN1CCN(C(=O)c2csc3nc(-c4ccccc4C)cn23)CC1 19840032 UBKOXXRGZVHKCD-UHFFFAOYSA-N 384.505 2.775 0 50 GFAA O=C(Nc1cccnc1)[C@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2)C1 19860847 YMFHAXJYGBZSIT-HNNXBMFYSA-N 393.896 2.916 0 50 GFAA O=C1CC2(CCN(Cc3cccc(F)c3)CC2)OCCN1C[C@@H]1CCCO1 1857684291 HMCILTZFLAYJBE-IBGZPJMESA-N 376.472 2.588 0 50 GFAA C[C@H]1CN2C[C@H](NC(=O)c3cc4c(-c5ccccc5)nn(C)c4s3)C[C@H]2CO1 1857690216 WTFLTTZAAMJZIP-IMJJTQAJSA-N 396.516 2.893 0 50 GFAA CC(=O)NCc1cnc2c(c1)CN(C(=O)c1c(-c3ccccc3)noc1C)CC2 1875249420 RQNRKQSGEZEWBZ-UHFFFAOYSA-N 390.443 2.880 0 50 GFAA Cn1cnnc1[C@H]1CCCN(C(=O)C[C@](C)(C(=O)O)c2ccc(Cl)cc2)C1 414070994 CQKWIGWGSRHTBX-DJJJIMSYSA-N 390.871 2.607 0 50 GFAA CN1CCN(c2ccc3nc(-c4c(O)nc5ccsc5c4N)[nH]c3c2)CC1 1848441488 QVLFEWNYZXVCHO-UHFFFAOYSA-N 380.477 2.879 0 50 GFAA in-vitro COC(=O)C[C@@H]1CN(C(=O)c2cc(O)cc(C(F)(F)F)c2)C2(CCC2)CO1 1875298884 QSUXJODEEWHPQS-CQSZACIVSA-N 387.354 2.738 0 50 GFAA Cc1nn(C2CCOCC2)cc1C(=O)NCc1cc(OCC(F)F)ccn1 1875269786 RSAWFXFSBRCOOT-UHFFFAOYSA-N 380.395 2.512 0 50 GFAA NCc1ncc(C(=O)N2CCC[C@H](c3cc(O)cc(F)c3)C2)c(C(F)F)n1 1875311394 XTIPLOYZWCAOEB-JTQLQIEISA-N 380.370 2.737 0 50 GFAA CC(C)Cc1ccc(CCC(=O)N2C[C@H]3C[C@H]2[C@@H]3c2ocnc2C(N)=O)cc1 1875394646 QKGHTWLGYSEVKI-ZIFCJYIRSA-N 381.476 2.919 0 50 GFAA CC[C@H](OC)C(=O)Nc1c(I)cnn1-c1ccccc1 888096635 DEVDQSVSDUQIPN-LBPRGKRZSA-N 385.205 2.840 0 50 GFAA O=C(c1ccccc1)N1CC[C@@H]2[C@H](C1)NC(=O)N2C1CCN(CC2CCC2)CC1 888103350 DQALKEGMDOSCTN-LEWJYISDSA-N 396.535 2.559 0 50 GFAA CC(C)Cc1noc(CN(C)C(=O)c2ccc3nnc(-c4cccn4C)n3c2)n1 2100556455 ADDCISKXUCKRBB-UHFFFAOYSA-N 393.451 2.589 0 50 GFAA CC(=O)Nc1ccc(F)c(C(=O)N2CC[C@@H](Oc3cccc(C(=O)O)c3)C2)c1 2325792550 QMKWZGZKBHYEOQ-MRXNPFEDSA-N 386.379 2.776 0 50 GFAA Cc1nn(CC(=O)Nc2ccc3nc(C4CCNCC4)[nH]c3c2)c2ncccc12 2325856948 JODVJHNHELYZMG-UHFFFAOYSA-N 389.463 2.722 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1=O 120205759 YIIDEKKXECQWBS-WMLDXEAASA-N 399.878 2.640 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSc2nnc(-c3ccc(N)cc3)n2C)cc1 815655 JUXJRXLOXIHXPC-UHFFFAOYSA-N 396.476 2.754 0 50 GFAA COC(=O)c1ccc(-n2nnc(SCC(=O)Nc3ccc(C)c(C)c3)n2)cc1 1083189 ZVMUWCYWKAYEKC-UHFFFAOYSA-N 397.460 2.797 0 50 GFAA COc1cccc(N(CC(=O)Nc2cc(Cl)ccc2OC)S(C)(=O)=O)c1 1171280 FXSWFIABPAULSZ-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)Nc2nc3c(o2)C[C@H](C(C)C)CC3=O)cc1 2356152588 QLKNGHXCUDHBHJ-CQSZACIVSA-N 394.435 2.541 0 50 GFAA O=C(CCc1cnccn1)N1CC[C@H]2[C@@H]1CCN2C(=O)Nc1cccc(Cl)c1 2356159146 OALIXFIZCDLEDT-ROUUACIJSA-N 399.882 2.970 0 50 GFAA COc1cccc(CN2CCC[C@@]23CCCNC3=O)c1OCCCn1ccnc1 2356165945 RIRDHVUXLQRGCV-JOCHJYFZSA-N 398.507 2.605 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1cccnc1)c1cccc(Cl)c1 4973529 GDHGLKFCUKMKCG-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1ccccc1Br 101429841 JIKGUVORMWLCCS-VXGBXAGGSA-N 377.238 2.729 0 50 GFAA NC(=O)CCn1cc(CNCCN2CCc3ccccc3C2)c2ccccc21 55036176 NJIZCSCQUMIQSA-UHFFFAOYSA-N 376.504 2.665 0 50 GFAA O=C(NC[C@@H]1CCCO1)C1CCN(C2CCN(CCc3ccccc3)CC2)CC1 20542490 OCFDANAKTIQXDI-QHCPKHFHSA-N 399.579 2.701 0 50 GFAA Cc1nonc1[C@@H]1CCCN1C(=O)c1cc(CN(C)Cc2ccccc2)on1 67677851 HUCPLYWYZBZQDC-SFHVURJKSA-N 381.436 2.975 0 50 GFAA COc1ccc(-c2nc(CNC(=O)N3CCC[C@@H]3c3ccncc3)n[nH]2)cc1 120601784 PDBQOMPXBIIRQB-QGZVFWFLSA-N 378.436 2.922 0 50 GFAA O=C(Nc1cncc(F)c1)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O 281424733 DRQPMAZRBATKEH-INIZCTEOSA-N 378.354 2.812 0 50 GFAA O=C(Nc1ccnn1C1CCN(c2ncnc3[nH]ccc23)CC1)c1cccnc1 67713616 SEMFADZZCNSYGP-UHFFFAOYSA-N 388.435 2.643 0 50 GFAA Cc1nn(C)c(C)c1CN1CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CC1 172068066 FHEHKFGQIOIYOO-AZUAARDMSA-N 385.487 2.559 0 50 GFAA CC(C)C(=O)N1N=C(c2ccco2)C[C@@H]1c1ccccc1NS(C)(=O)=O 252508191 XFWBFPMSAWVQID-MRXNPFEDSA-N 375.450 2.985 0 50 GFAA Cc1nn(CCCNS(=O)(=O)c2c(C)nn(C(F)F)c2C)c(C)c1Cl 2803541 DDJNRYIPOREZBR-UHFFFAOYSA-N 395.863 2.730 0 50 GFAA O=C(N1CCCC1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nc3c([nH]2)CCCC3)C1 329056813 YAYBTAYBGKUSLH-APWZRJJASA-N 399.539 2.880 0 50 GFAA Cc1cc2n(n1)[C@H](C(F)(F)F)CCN2C(=O)c1cccc(-n2cccn2)n1 485488191 IHGVSMJVLMQAAI-ZDUSSCGKSA-N 376.342 2.926 0 50 GFAA CS[C@@H]1CN(c2ccc(C(=O)Nc3ccccc3)nn2)C[C@H]1N1CCCC1 241132819 JLYRAMLGIBZVJP-QZTJIDSGSA-N 383.521 2.745 0 50 GFAA Cc1cc([C@H](C)NC(=O)N2CCC(N3CCCS3(=O)=O)CC2)c(C)s1 334028165 IZHHWYHLPSEDCT-ZDUSSCGKSA-N 385.555 2.635 0 50 GFAA N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N[C@@H](Cc1ccccc1)C1CC1 237843327 ODGVZRPOLWROIZ-GOTSBHOMSA-N 388.515 2.939 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)[C@H](Oc2ccc(F)c(F)c2)c2ccccc2)CCO1 262465267 XIHGBRYFZUBVNF-HNAYVOBHSA-N 391.370 2.787 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1 374851488 FHHRSOYNIQGWFT-CYBMUJFWSA-N 383.427 2.937 0 50 GFAA CC(C)(C)c1ccc(N(CCC(=O)NCc2ccccn2)S(C)(=O)=O)cc1 242746783 DFYMCHBGGWHXIR-UHFFFAOYSA-N 389.521 2.852 0 50 GFAA COc1ccccc1NC(=O)Cn1nc(-c2ccc(F)cc2OC)ccc1=O 49549298 QNNVVOBWUAFAGQ-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)Nc2cccc(C(C)=O)c2)n1 49550732 YRJSOOLQZVHMJY-UHFFFAOYSA-N 395.390 2.899 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)C1 238997399 AFOURSBHZGYIQY-ABAIWWIYSA-N 399.274 2.900 0 50 GFAA Cc1cc(N2CCC(N3CCOC4(CCCC4)C3)CC2)nc(N2CCCC2)n1 95506996 MYGIHIQRMHDEOK-UHFFFAOYSA-N 385.556 2.999 0 50 GFAA COc1ccc(NC(=O)CC[C@@H]2CCCN(C(=O)Cc3c[nH]cn3)C2)c(C)c1 95506375 RXJAOIKYVSJDCL-INIZCTEOSA-N 384.480 2.927 0 50 GFAA O=C(NC[C@H](O)CO)c1ccc2oc(-c3ccc(C(F)(F)F)cc3)nc2c1 95509183 YNUVLQLAYSXMFO-ZDUSSCGKSA-N 380.322 2.597 0 50 GFAA COc1ccccc1CN1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91656040 OUJDGPFTPUFDGD-QFIPXVFZSA-N 382.508 2.866 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)NC(C)C)C2)c(OC)c1 95530576 ANIMWOHPWOQXHA-MRXNPFEDSA-N 391.512 2.930 0 50 GFAA CCNc1ccc(S(=O)(=O)C(F)F)cc1NS(=O)(=O)CCCCF 296008184 QITFRTCMOKKHKS-UHFFFAOYSA-N 388.433 2.606 0 50 GFAA COc1ccc([C@H](NC(=O)Cc2nc3ccccc3[nH]2)[C@H]2C[C@@H](O)C2)cc1F 244899467 ZKKPNIZKFOPQLQ-QTCYRWPVSA-N 383.423 2.882 0 50 GFAA CCn1nc(C)c(C(=O)NCC2CCN(C(=O)Cc3cccs3)CC2)c1C 952974623 JNDXFXIAXBHIJF-UHFFFAOYSA-N 388.537 2.792 0 50 GFAA COc1cc(-n2cnnn2)ccc1NC(=O)c1ccc(N2CCCCC2)cc1 952861479 HFLYULHJZFYGNA-UHFFFAOYSA-N 378.436 2.914 0 50 GFAA CC(C)c1ccc(CCC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)cc1 276462949 NDCKFPZDGFWUGE-LJQANCHMSA-N 381.524 2.848 0 50 GFAA COc1ccc(F)c(C(=O)N2CCC[C@@H](Cn3nc(C)nc3C)C2)c1OC 188465412 NIRNURAZSXRASH-CQSZACIVSA-N 376.432 2.604 0 50 GFAA COc1cccc2c1CCN(C(=O)c1cc(N3C[C@H](C)O[C@H](C)C3)ccn1)C2 192462496 NUOAQXOQSHFJTN-IYBDPMFKSA-N 381.476 2.902 0 50 GFAA COc1ccccc1-n1ncc(C(=O)N2CCc3ccccc3[C@@H]2CO)c1C 192561947 RYHAQTABXNKXMI-FQEVSTJZSA-N 377.444 2.921 0 50 GFAA CCOC1CC(CN[C@H](C)c2nc3c(s2)CCCC3)(N2CCOCC2)C1 193396512 MLYUJXKNZJYLNR-LSWWBPAMSA-N 379.570 2.942 0 50 GFAA Cc1cccc(OC2CN(C(=O)CN3CCN(c4cccc(C)c4)CC3)C2)c1 1506412360 CQBDHWNQYPCLHI-UHFFFAOYSA-N 379.504 2.715 0 50 GFAA CN(C[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1cc(O)nc2cc(F)ccc12 1529103566 DLAKCBNLSPENTO-CYBMUJFWSA-N 385.439 2.943 0 50 GFAA CO[C@H]1CN(C(=O)Cn2c(C3CC3)nc3ccccc32)C[C@H]1Cc1cc(C)no1 1704347482 MOILNGNKUOUXPH-UZLBHIALSA-N 394.475 2.926 0 50 GFAA Cc1ccc2nc(CN3CC[C@](Cc4ccccc4)(C(=O)O)[C@@H](O)C3)cn2c1 1704326671 LBCZEHOKZKBZSF-SIKLNZKXSA-N 379.460 2.523 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N[C@@H]1CCCN(CCCc2ccccc2)C1 12050695 RNLILUXWTYJJRT-LJQANCHMSA-N 393.487 2.808 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C[C@H]3CCOC3)CC2)c1 12074385 WZTYSKMVZGRDHM-QGZVFWFLSA-N 388.508 2.811 0 50 GFAA OC1CCN([C@@H]2CCN(Cc3ccc4c(c3)Cc3ccccc3-4)C[C@H]2O)CC1 12197036 QUZUFASFEKVQII-DNQXCXABSA-N 378.516 2.650 0 50 GFAA CCOC(=O)c1cnn(-c2ccc3c(c2)OCCO3)c1CNCc1ccco1 19837968 RUCXCFDNLNOULK-UHFFFAOYSA-N 383.404 2.703 0 50 GFAA Cc1ccc(OCC(=O)N2CCC3(CC2)NC(c2ccc(C)cc2)=NO3)cc1 169755008 DQMBCLKUEGSPTL-UHFFFAOYSA-N 379.460 2.983 0 50 GFAA COc1ccccc1Cc1nc(-c2cnc3cccnn23)n([C@H]2CCOC2)n1 1857675262 PWKLLOPAPASKIS-HNNXBMFYSA-N 376.420 2.549 0 50 GFAA COc1cc2c(cc1-c1nccn1C1CCN(c3cccnn3)CC1)OCCO2 1857682271 UOXGVYWPLDKTOZ-UHFFFAOYSA-N 393.447 2.961 0 50 GFAA Cc1ccc2c(C(=O)N3CC[C@H]4[C@@H]3CC(=O)N4CC3=CCCCC3)cnn2c1 1857696415 ZFKLBBPHGCTVRI-PMACEKPBSA-N 378.476 2.959 0 50 GFAA COc1ccc(N2CCN(C(=O)COc3ccc(Cl)cc3C)CC2)cn1 1857701041 OFYPSQBQXPCDOL-UHFFFAOYSA-N 375.856 2.780 0 50 GFAA CS(=O)(=O)c1ccc(-c2nccn2[C@@H]2CCOC3(CCOCC3)C2)cc1 1857726980 GUDYFOPUBXEYFP-MRXNPFEDSA-N 376.478 2.854 0 50 GFAA CC(C)c1cccc(S(=O)(=O)N2CCC[C@H](c3nn(C)cc3C(=N)O)C2)c1 328602499 BSQQMENACBFBTQ-HNNXBMFYSA-N 390.509 2.995 0 50 GFAA O=C(CN1C(=O)CSC1=O)N1Cc2ccccc2O[C@H](c2ccccc2)C1 12281702 MKXJNQKRCJMSGB-KRWDZBQOSA-N 382.441 2.844 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCC(=O)N(C3CC3)[C@@H]2c2ccnn2C)ccc1F 366367184 XGHZFVNDUUZKRR-UZLBHIALSA-N 384.455 2.626 0 50 GFAA CCCNC(=O)c1cccc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)c1 265878656 SPJCRCQSXNSWBU-FQEVSTJZSA-N 381.476 2.666 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2ccc(Cn3ccnc3)cc2)C1 163703256 SRFSTJCOMUIQNQ-LJQANCHMSA-N 376.460 2.949 0 50 GFAA COC(=O)[C@@H]1COCC[C@@H]1C1CCN(c2cc(Cl)c3cnn(C)c3n2)CC1 1875294581 JUORMWBIKUCALB-UKRRQHHQSA-N 392.887 2.664 0 50 GFAA COc1c(C(=O)N2CC[C@H](c3cc(O)nc(O)n3)C2)sc(Cl)c1Cl 1875274432 PRZYZNFPKUWBBR-LURJTMIESA-N 390.248 2.894 0 50 GFAA NC(=O)CO[C@@H]1CCN(C(=O)N[C@@H](CCc2ccc(F)cc2)c2ccccc2)C1 1875304273 FVTJZRZZDCPQQM-UXHICEINSA-N 399.466 2.785 0 50 GFAA CC(C)(C)O[C@@H]1C[C@H](NC(=O)N=c2nc(C3(C)CC3)[nH]s2)C12CCOCC2 1875396512 KINZGWKQOGMYEC-QWHCGFSZSA-N 394.541 2.886 0 50 GFAA O=C(NCc1c[nH]nc1-c1cccc(F)c1)c1ccc2[nH]nc(C(=O)O)c2c1 1875300040 INBVRQYTTWEBSN-UHFFFAOYSA-N 379.351 2.720 0 50 GFAA CN(c1cc(C(=O)N=c2ccn(Cc3ccncc3)[nH]2)ccn1)C1CCCC1 2325748588 VVVVPDSRRMTFAH-UHFFFAOYSA-N 376.464 2.774 0 50 GFAA C[C@H]1c2sccc2CCN1C(=O)c1nc(N2CCOCC2)ncc1Cl 2325761480 UWSZGPPLOXYGKR-NSHDSACASA-N 378.885 2.788 0 50 GFAA COc1ccc([C@@H]2NC(=O)[C@@H](C3CC(C)(C)C3)NC2=O)cc1Br 2325776895 MBCPNAWGMGKBBG-UONOGXRCSA-N 381.270 2.550 0 50 GFAA COc1ccc2[nH]c(C(=O)N[C@@H]3C[C@H](Cn4cc(Cl)cn4)C[C@H]3O)cc2c1 2325785808 OIOHVTHSWMPSFM-LIXBPZJASA-N 388.855 2.596 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCN(C(=O)c3c(C4CC4)cnn3C)C2)nc1C 2325793272 NPDHOJBUPDBBSC-RDJZCZTQSA-N 395.507 2.590 0 50 GFAA Cc1cnc(C(C)(C)NC(=O)C[C@H]2Cn3nc(-c4ccccc4)cc3NC2=O)[nH]1 2325859812 LLJASZBWBWEYTR-HNNXBMFYSA-N 392.463 2.592 0 50 GFAA O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)NCc1ccccn1 829917 ONVUMBVXEFXNTJ-UHFFFAOYSA-N 381.457 2.593 0 50 GFAA Cc1cc(S(=O)(=O)NCC(C)C)ccc1OCC(=O)NCc1ccccc1 1065567 JZOUFUBEXLUCEJ-UHFFFAOYSA-N 390.505 2.625 0 50 GFAA O=C(N[C@@H]1CCN(c2ccccc2)C1)c1cc2c(s1)CCOC21CCNCC1 2356159661 LYFIEIVZOXFACD-MRXNPFEDSA-N 397.544 2.908 0 50 GFAA Cc1cc(=O)[nH]c(S[C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(C)s2)n1 55168886 XOXJZLHOVVAWBL-AWEZNQCLSA-N 394.566 2.519 0 50 GFAA Cc1c[nH]c(CN(C)C(=O)c2cccc(-n3nc(C)c4ccccc4c3=O)c2)n1 20255775 PYNLJUOLXSTHMB-UHFFFAOYSA-N 387.443 2.998 0 50 GFAA Cc1csc(CNC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)n1 252485301 GQQSTSKIAKAQEY-UHFFFAOYSA-N 394.522 2.994 0 50 GFAA COc1ccnc(C[S@](=O)c2nc3ccc(OC(F)F)cc3[nH]2)c1OC 4099200 IQPSEEYGBUAQFF-AREMUKBSSA-N 383.376 2.884 0 50 GFAA biogenic,fda COc1ccc2c(C)cc(N3CCN(CC(=O)N4CCCCC4)CC3)nc2c1 77555564 NQCOYQBXJMRYPI-UHFFFAOYSA-N 382.508 2.686 0 50 GFAA COC(=O)c1c(NC(=S)NCc2cnn(C)c2)sc2c1CC[C@@H](C)C2 6201433 ARGRHKMQHHZIMR-SNVBAGLBSA-N 378.523 2.880 0 50 GFAA CCc1nc(N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)ncc1C 71422271 MMKPIVSEOFTURB-GOSISDBHSA-N 385.556 2.651 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)c2cc(-c3cccc(OC)c3)[nH]n2)c1 480484803 WZSZFILGRYTYJF-UHFFFAOYSA-N 380.404 2.706 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(N)nc2)CCC(=O)N1Cc1ccc(F)cc1 71747828 SCXARXZAYZVZME-GOSISDBHSA-N 384.455 2.702 0 50 GFAA CCN(CC)C[C@@H](O)COc1cc(CN(C)CC2CCOCC2)ccc1OC 12612258 GCDQEXLLWHBKKJ-HXUWFJFHSA-N 394.556 2.635 0 50 GFAA O=C1COc2ccc(C(=O)N3CCOC[C@@H]3c3nc4ccccc4s3)cc2N1 367065355 HYCDERBKXHZPFX-OAHLLOKOSA-N 395.440 2.841 0 50 GFAA C[C@@H](C(=O)NCCc1nc(C(=O)O)cs1)N1C(=O)c2cccc3cccc1c23 219932378 SSUQWLHQAWOLDI-NSHDSACASA-N 395.440 2.702 0 50 GFAA O=C1CCCC(=O)N1C1CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1 372310682 VNXPCPIUAHZWSK-FQEVSTJZSA-N 386.492 2.748 0 50 GFAA O=C(NCCN1CCC[C@@H](c2ccccc2)C1)c1ccc(-n2cnnc2)cc1 216220191 BQJARPDGHFIUMK-HXUWFJFHSA-N 375.476 2.877 0 50 GFAA COc1cccc(C(=O)N2CCN(Cc3ccc(Cn4cccn4)cc3)CC2)c1 72170017 QGTNHUFHHKQELO-UHFFFAOYSA-N 390.487 2.898 0 50 GFAA COCCN(Cc1cccs1)C(=O)c1cc(-c2c(C)nn(C)c2C)nn1C 216178096 SXOIQWFWWQCYHP-UHFFFAOYSA-N 387.509 2.788 0 50 GFAA Cc1cc(C)cc(-c2nnc(NC(=O)N3CC[C@@H]4OCCN(C)[C@@H]4C3)s2)c1 285168691 MBBLOIASXWALJZ-CVEARBPZSA-N 387.509 2.759 0 50 GFAA Cc1cc(NC(=O)Cn2ccc(-c3cc(CN4CCCC4)cs3)n2)n(C)n1 48501644 DEDSBRLIKWDKRO-UHFFFAOYSA-N 384.509 2.888 0 50 GFAA O=S(=O)(NC[C@](O)(c1ccccc1)C(F)(F)F)c1c(F)cc(F)cc1F 160887205 UYNDZPCRTJEGRS-AWEZNQCLSA-N 399.312 2.832 0 50 GFAA Cc1n[nH]c(C)c1-c1ccc(C(=O)N2CCC[C@@H](CN3CCOCC3)C2)cc1 426634075 AGFFPJPIXWJABL-SFHVURJKSA-N 382.508 2.878 0 50 GFAA CCc1cccc(OC2CN(C(=O)Cn3c(=O)c(C)nc4ccccc43)C2)c1 95522599 JSQCMBFAHZYIEH-UHFFFAOYSA-N 377.444 2.557 0 50 GFAA O=C(NCCC[C@H]1CCOC1)N1CCC(c2nnc3n2CCCCC3)CC1 426730297 DFBZKJDSYLGWKA-INIZCTEOSA-N 375.517 2.710 0 50 GFAA Cc1cc(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)c2c(C)noc2n1 292739935 DYUYVURCSOVEDN-UHFFFAOYSA-N 391.431 2.960 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1cc(Cl)ccc1Cl 239347109 MCUPLIBUCFXMBW-GKAQULHVSA-N 384.215 2.673 0 50 GFAA CC(C)N1CCC(N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)CC1 91965564 ZSIRBJGSXGLTGP-UHFFFAOYSA-N 387.572 2.530 0 50 GFAA CC(C)n1ccnc1C1CCN(C(=O)CCn2c(=O)[nH]c3ccccc32)CC1 95507927 SDNRVGUYLFTONU-UHFFFAOYSA-N 381.480 2.903 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)nc(C)n1 91858647 UNTCWDSKABTGIS-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA O=C1CCC2(CCN(C(=O)NCCc3ccccc3)CC2)CN1C[C@H]1CCCO1 91462147 ZMOLGGMQFKWQCT-HXUWFJFHSA-N 399.535 2.822 0 50 GFAA O=C(c1nc(=O)c2ccccc2[nH]1)N1CCC2(CC1)OCCc1ccsc12 539804191 SSKXTMQPNQLFOW-UHFFFAOYSA-N 381.457 2.689 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CC[C@H](C(=O)NC3CCCC3)C[C@H]2O)ccc1Cl 1940198282 APRMXTLLYGXCCQ-BMGDILEWSA-N 378.900 2.967 0 50 GFAA CN(C[C@H]1CCCN2CCCC[C@H]12)C(=O)CCc1nc(O)c2ccccc2n1 299754357 CQEABHXMZGKDIQ-VQIMIIECSA-N 382.508 2.991 0 50 GFAA biogenic O=C(Nc1ccccc1CN1CCCCC1)N1CCN(c2cnccn2)CC1 299786035 QUQSXIVJIGSMHM-UHFFFAOYSA-N 380.496 2.817 0 50 GFAA COc1cccc(-c2ccccc2NC(=O)N2CCN([C@@H]3CCNC3)CC2)c1 299784164 LJJRLUHTYFHUKR-GOSISDBHSA-N 380.492 2.874 0 50 GFAA NC(=O)c1ccc2nc(CN3CCC(O)(c4ccccc4)CC3)cc(O)c2c1 299791561 FMLARETVXRNTRO-UHFFFAOYSA-N 377.444 2.523 0 50 GFAA CO[C@@H]1CCCN(S(=O)(=O)c2cc(-c3cc(C(F)(F)F)n[nH]3)oc2C)C1 952979647 NZTZBSNFWKDHHI-SNVBAGLBSA-N 393.387 2.796 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CCC(Oc3ncccc3F)CC2)cc1 278325104 KVQDPKVYRYQYHM-UHFFFAOYSA-N 383.423 2.707 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)Nc3ncn(C4CCCCC4)n3)C2)n(C)n1 278172058 ZAWSESUIXOFZMX-HNNXBMFYSA-N 386.504 2.616 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C)C[C@@H]2CCCO2)c1 170598704 KUNJRBIEQMUNPX-ZDUSSCGKSA-N 388.917 2.620 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)CCc2cccc(Br)c2)CC1 186656464 NIPCNELMDRLUGT-MRXNPFEDSA-N 397.313 2.779 0 50 GFAA O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)N[C@@H]1CCc2[nH]ncc2C1 190743838 YBWWKLHKFVUYJY-CYBMUJFWSA-N 379.386 2.967 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)N(C)CCCn2cccn2)cc1Cl 1506395590 BXFCZXMHXALDKD-UHFFFAOYSA-N 378.281 2.909 0 50 GFAA CN(Cc1cc(-c2ccccn2)no1)C(=O)C(C)(C)NC(=O)c1cccs1 1506400382 UGLXIANWYZRMMC-UHFFFAOYSA-N 384.461 2.965 0 50 GFAA COc1cc(CN2C[C@]3(C(=O)O)C[C@]3(C(=O)O)C2)ccc1OCc1ccccc1 1704330212 FPKWRDGTFLHUJG-SZPZYZBQSA-N 397.427 2.636 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(C(=O)CCc3nc4ccccc4nc3OC)C[C@@H]21 1704297289 KXIZYQHHYNXCCL-ZMPRRUGASA-N 383.492 2.971 0 50 GFAA O=C(NC/C=C/c1ccccc1)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772812710 PABURISDHQKJEG-BBOMDTFKSA-N 383.517 2.914 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCCN(C(=O)CCOc2ccccc2)CC1 1772712765 YLCGXHXUVGGTMB-UHFFFAOYSA-N 399.491 2.754 0 50 GFAA Cc1cc(C)cc(-n2ncc3c2CCC[C@@H]3NC(=O)CCN2CCCC2=O)c1 11817395 FUGOLPFDDPWMCD-IBGZPJMESA-N 380.492 2.995 0 50 GFAA CN(CCn1cc(C(=O)NCc2ccncc2)nn1)CC1=CC[C@H]2C[C@@H]1C2(C)C 12152974 GIIZTIBXTXPQCM-OALUTQOASA-N 394.523 2.527 0 50 GFAA O=C(NCc1csc(-c2cccs2)n1)c1cn(C[C@H]2CCCO2)nn1 14978845 WKTFDRBSJQSBRW-GFCCVEGCSA-N 375.479 2.572 0 50 GFAA CCc1ncnc(N2CCC(C3CCN(C(=O)[C@@H]4CCCO4)CC3)CC2)c1F 1857718933 AQUUIHQXPOTJMZ-SFHVURJKSA-N 390.503 2.812 0 50 GFAA O=C(CCc1nnc(NC(=O)c2cc3ncccn3n2)s1)c1ccccc1 1875246151 IZTMKBIAOVJGON-UHFFFAOYSA-N 378.417 2.649 0 50 GFAA O=C(CCc1ccsc1)NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3 1875247976 XHKLZOCYQQHJDK-XKGFGPFHSA-N 383.517 2.876 0 50 GFAA C[C@@]1(c2ccccc2)CN(C(=O)c2cc(C(=O)O)nn2-c2ccccc2)CCO1 237393416 YDNANEJNJNEFAP-QFIPXVFZSA-N 391.427 2.958 0 50 GFAA COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCC(C(=O)O)CC1 237104338 XRBCURAMVWUZBE-HNNXBMFYSA-N 398.297 2.968 0 50 GFAA Cc1ccc(-n2ncc(C(=O)N3CCO[C@@H](C(=O)O)C3)c2C2CC2)cc1Cl 237782245 PXAFXPKCPCSJPX-MRXNPFEDSA-N 389.839 2.637 0 50 GFAA O=C(c1ccccc1Cn1cncn1)N1CCC(C(=O)O)(c2ccccc2)CC1 238069443 IDCNKSPQMQMYDJ-UHFFFAOYSA-N 390.443 2.585 0 50 GFAA COc1ccc(CN2CCC[C@@H](n3cc(C(=O)N4CCCC4)nn3)C2)c(C)c1C 14984731 SEVCFGRXGCHITB-LJQANCHMSA-N 397.523 2.977 0 50 GFAA COc1ccc([C@H](CNC(=O)[C@H]2NCCO[C@@H]2C)c2c[nH]c3ccccc23)cc1 261919454 KBGMVWOGHQDMHO-MPHOGZCYSA-N 393.487 2.802 0 50 GFAA C[C@@H](c1ccccc1)[C@@H](O)CNC(=O)C(=O)c1ccc(Br)s1 856288387 GFHLFUKHCZPSEF-JQWIXIFHSA-N 382.279 2.974 0 50 GFAA COc1cc(NC(=O)c2cn3c4c(c(F)c(F)cc4c2=O)OC[C@@H]3C)ccn1 1875326984 VGCPXXYAPKJIKK-VIFPVBQESA-N 387.342 2.889 0 50 GFAA O=C(NC[C@@]12CC[C@@](C(=O)O)(CO1)C2)c1cc2ccccc2nc1N1CCCC1 1875300703 NZYOZWXHTGYKKA-VXKWHMMOSA-N 395.459 2.589 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnn(C2CC2)c1 1875403374 UYDMANISKZGNPI-CDHQVMDDSA-N 391.475 2.651 0 50 GFAA O=C(c1ncccc1O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100480624 KSBBTCJLRLCRAN-QFIPXVFZSA-N 379.460 2.627 0 50 GFAA Cc1nc(-c2ccccc2)c(NC(=O)[C@@H]2CC(=O)N(Cc3cccnc3)C2)n1C 2100483455 VVHYANSBNCZZFB-GOSISDBHSA-N 389.459 2.778 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2c(-c3ccccc3)noc2C)cc1 917592 OKUCBEDYMRFTQP-UHFFFAOYSA-N 399.428 2.727 0 50 GFAA COc1ccccc1NC(=O)CSc1nc(O)cc(=O)n1-c1ccccc1 1230707 IKHREWKUJYODEJ-UHFFFAOYSA-N 383.429 2.678 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)C[C@H]1C 245436939 VZRYUPXQOTXEER-SQNIBIBYSA-N 391.512 2.553 0 50 GFAA CCOc1cc(C=O)c(Br)c(Br)c1OCC(=O)OC 2775177 MWQOJJOSKMEDTO-UHFFFAOYSA-N 396.031 2.975 0 50 GFAA Cc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1C 3566175 DNZIQEKNOJGMLS-UHFFFAOYSA-N 389.473 2.852 0 50 GFAA Cc1ccc(CCN2C[C@@H](C(=O)NCCCN3CCC(C)CC3)CC2=O)cc1 4711004 YMHXVXJDEKHWCK-NRFANRHFSA-N 385.552 2.624 0 50 GFAA CC(=O)NCC1CCN(CC2CCN(C(=O)OCc3ccccc3)CC2)CC1 225675983 QQYLOYSWIRZDHK-UHFFFAOYSA-N 387.524 2.883 0 50 GFAA Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1 113567386 BRVIBMVJJBINOP-IBGZPJMESA-N 394.475 2.969 0 50 GFAA CCc1c(C(=O)NC[C@@H]2CN(C3CC3)CCO2)cnn1-c1cccc(Cl)c1 114858386 NRYUWZZYNIYADQ-QGZVFWFLSA-N 388.899 2.681 0 50 GFAA CCn1nc(C)c(CN2CCN(Cc3cccc(OC)c3)[C@@H](CCO)C2)c1C 22932658 GPQUUNSIFSVCAZ-FQEVSTJZSA-N 386.540 2.597 0 50 GFAA CCn1c(CN2CC[C@@]3(CCCN(C(=O)CCOC)C3)C2)nc2ccccc21 67947331 PUNHZFLBEFHIQB-QFIPXVFZSA-N 384.524 2.907 0 50 GFAA O=C1C[C@H](NCc2cccn2-c2ncccn2)CN1CCc1cccc(Cl)c1 12387200 RSUJZBKZQAXFGA-SFHVURJKSA-N 395.894 2.854 0 50 GFAA Cc1cc(C(F)F)nn1Cc1nnc(SCC(=O)NCC(C)C)n1C1CC1 2792282 MQXCTOZDZISOJR-UHFFFAOYSA-N 398.483 2.968 0 50 GFAA CC(=O)Nc1cccc(OCCNC(=O)c2cccc(Cn3ccnc3)c2)c1 253419123 ZUQDIGCLSVYBGM-UHFFFAOYSA-N 378.432 2.699 0 50 GFAA Clc1cccc(N2CCOCC2)c1CN1CCN(Cc2ccncc2)CC1 253424127 AUPHJAMSTIWSCU-UHFFFAOYSA-N 386.927 2.889 0 50 GFAA CN(C)CCN1C(=O)CC[C@H]1CCNC(=O)c1cc2c(Cl)cccc2n1C 215777794 HDMNBZFZPMBBDQ-AWEZNQCLSA-N 390.915 2.504 0 50 GFAA CC[C@H]1CCCCN1C(=O)[C@H](C)N1CCCN(Cc2nc(C)c(C)o2)CC1 370812317 VBXQGDPXKIHVBE-HKUYNNGSSA-N 376.545 2.979 0 50 GFAA COc1cccc(Cn2nccc2NC(=O)N2CCN3CCCC[C@@H]3C2)c1OC 158707709 DQVLWNBZYFWXNT-QGZVFWFLSA-N 399.495 2.651 0 50 GFAA CC(C)c1ccc(CN2CCN(Cc3cccnc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 72478653 JOIGALTYICEICG-FCHUYYIVSA-N 399.560 2.688 0 50 GFAA CCCc1cnc(C)nc1N1CCC(N2CCC(C(=O)NC3CC3)CC2)CC1 71745473 YZXJERMDHIDEAM-UHFFFAOYSA-N 385.556 2.697 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2)C1 237662040 BCEJNAFKXYDECP-MRXNPFEDSA-N 378.226 2.572 0 50 GFAA CC(C)[C@H]1N(C(=O)NCc2cccc(N3CCOCC3)c2)CC12CCOCC2 334116160 HIZDTJNBKGXWEO-HXUWFJFHSA-N 387.524 2.870 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@@H](Cc1ccccc1)n1cnnn1 426722733 XLSNEHLIIURFEQ-HXUWFJFHSA-N 388.431 2.771 0 50 GFAA CC(C)=CCO[C@@H]1COCC[C@H]1NC(=O)c1nn2cc(C)cnc2c1Cl 223287299 DHPKRIKINPCCDH-ZIAGYGMSSA-N 378.860 2.561 0 50 GFAA Cc1ccc(C)c(CCNC(=O)[C@H]2CCC(=O)N(CCc3ccccn3)C2)c1 91327145 SMACKIBMXFEKPR-FQEVSTJZSA-N 379.504 2.838 0 50 GFAA CN1CCN(C(=O)Nc2ccccc2OCCCc2ccccc2)C[C@@H]1CO 95503357 VUGIPBBVDWQGFA-LJQANCHMSA-N 383.492 2.838 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)COc1ccccc1)CC2)[C@H]1CCCO1 95508547 HVWNFMJHPIBWPA-HXUWFJFHSA-N 380.444 2.768 0 50 GFAA Cc1nccn1CC[C@H]1CCCCN1C(=O)NCCSc1nccn1C 426575077 VFSRUPNBAFWFKA-MRXNPFEDSA-N 376.530 2.672 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C(=O)N1c1cccc(I)c1 239347186 MHPWIUHQCRHJIL-CTTWBBHYSA-N 391.208 2.849 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)ccc1O 91746046 WSFXASFFEFPOPC-SFHVURJKSA-N 386.492 2.724 0 50 GFAA CNCc1cn(C[C@H]2CCCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)nn1 23581626 GTQWTELXESCALQ-INIZCTEOSA-N 380.496 2.648 0 50 GFAA COc1ccc(C)c(N2C(=O)C[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c1 97062816 DYQSPHNWWAEDBM-HXUWFJFHSA-N 397.450 2.597 0 50 GFAA O=c1c2ccccc2nc(O)n1C[C@H]1CC[C@H](C(=O)NCc2ccncc2)CC1 245255111 FNXCXRLLOAXSMB-QAQDUYKDSA-N 392.459 2.620 0 50 GFAA O=c1c2ccccc2nc(O)n1C[C@H]1CC[C@H](C(=O)NCc2ccco2)CC1 245257417 ZKTNLZATPDUEAG-SHTZXODSSA-N 381.432 2.818 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N(C)C[C@H]2CCCC[C@@H]2O)CC1 182533780 JOYYZWQZVQLUFQ-APWZRJJASA-N 375.513 2.857 0 50 GFAA CC(=O)N[C@H](CC(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@H]21)c1c(F)cccc1F 299753064 WRRCIMHBXJEQAH-DXEWXGHRSA-N 394.418 2.776 0 50 GFAA Cc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@@H](CC(=O)O)C2)cc1C 299751816 RWZZPWWCRCTFLY-KRWDZBQOSA-N 381.428 2.850 0 50 GFAA CCN(C(C)=O)c1nc(CN2CCNC(=O)[C@H]2c2ccc(F)cc2C)cs1 184753891 GWFHTLOPPXGIMJ-QGZVFWFLSA-N 390.484 2.637 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@@H](NCc2ccc(F)cc2F)CNC3=O)cc1 263617983 QTNFCVVTSVCNND-LJQANCHMSA-N 384.386 2.869 0 50 GFAA CC(C)CN(C)C(=O)C[C@@]1(c2ccccc2)CC(=O)N(Cc2ccncc2)C1=O 299755148 AQOXFSHHGXOSIW-QHCPKHFHSA-N 393.487 2.783 0 50 GFAA CCN(Cc1nc(C(C)C)no1)S(=O)(=O)c1c(C)cc(C)c2nonc12 823086629 BPAQICBHUZUFNB-UHFFFAOYSA-N 379.442 2.557 0 50 GFAA Cc1cc(NC(=O)c2cc3ccccc3n(C)c2=O)ccc1NC(=O)CN(C)C 823676221 WUDFAUPLPYSEQX-UHFFFAOYSA-N 392.459 2.599 0 50 GFAA Cc1ccccc1-n1cc(CN(C)C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)cn1 584884512 WYQWWBGKKLOJBX-KDURUIRLSA-N 399.539 2.821 0 50 GFAA O=C(Nc1ccc(Oc2nn[nH]n2)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1 952871718 CFOJMFOXQDWPRI-KRWDZBQOSA-N 392.419 2.625 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2cc(F)cc(Br)c2)CC1 186669837 HPOOXGHACDYXBU-AWEZNQCLSA-N 387.249 2.599 0 50 GFAA CCCn1cnnc1[C@@H](C)NS(=O)(=O)c1cc(-c2ccno2)sc1C 1506404861 JIUPSNBBCZPUTC-SNVBAGLBSA-N 381.483 2.753 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2cccc(C)c2F)cc1OC 1529174996 ZMWNNSOBLVARHI-UYAOXDASSA-N 389.423 2.726 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3cccc(C)n3)C[C@]2(CCc2ccccc2)C1 1772808610 VTNCAHMOTLBSCC-XUZZJYLKSA-N 393.531 2.930 0 50 GFAA COc1ccccc1C(=O)[C@H]1CCCN(C(=O)Cn2nc3ccccc3n2)C1 12112296 UXWIJSALGDSAJQ-HNNXBMFYSA-N 378.432 2.561 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 12302576 SAIWUGQAIPAPEX-OAQYLSRUSA-N 390.455 2.510 0 50 GFAA CC1(CNC(=O)[C@@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)COC1 12459163 KXJCJSJUKAEHGV-HXUWFJFHSA-N 385.552 2.516 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NCc2ccc(Cl)cc2)CN1C1Cc2ccccc2C1 207612742 UWVAMCGCWKPALB-FPOVZHCZSA-N 383.923 2.786 0 50 GFAA Cc1nc(C)c(C(=O)N[C@@H]2CCC[C@@H](NC(=O)Cc3n[nH]c4ccccc34)C2)o1 1857689308 NGLYQNIMQHSMSA-HUUCEWRRSA-N 395.463 2.568 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCCc2ncc[nH]2)CC[C@@H]1NC1CCCC1 1857712539 CRXNEKZVEKBDDQ-WDSOQIARSA-N 376.545 2.955 0 50 GFAA COc1ccc(NC2(C(=O)N3C[C@H](O)[C@H](Cc4cc(C)[nH]n4)C3)CCCC2)cc1 1857717395 NQHPVMIRZUBUFB-UZLBHIALSA-N 398.507 2.513 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4cnn(-c5ccccc5F)c4)[C@@H]2CC(=O)N13 1857737999 MSGCLVJECOOBSY-ZVDOUQERSA-N 384.455 2.569 0 50 GFAA CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1ccc2c(c1)OCCO2 115588154 HJVQSVYSKYNIMZ-QGZVFWFLSA-N 388.489 2.747 0 50 GFAA O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N1CCC(c2nc[nH]n2)CC1 363319349 GVTVTIBGAIVOBR-UHFFFAOYSA-N 386.843 2.847 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](c3ccccn3)C(C)C)C2)c1C 1875397779 NMOXOPIPZYASKA-MJGOQNOKSA-N 396.539 2.756 0 50 GFAA CC(C)C[C@@H]1C[C@H](C(=O)N=c2[nH][nH]c3ccc(Br)cc23)CC(=O)N1 1875359045 RZRAKTXFYBWJKA-CMPLNLGQSA-N 393.285 2.627 0 50 GFAA Cc1ccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(C)c1 1875397253 RUNSHBPOOJIDFR-LJQANCHMSA-N 381.524 2.781 0 50 GFAA Cn1ncc2c(O)nc(N3CCC(C4(NC(=O)/C=C/C(C)(C)C)CC4)CC3)nc21 1775992673 UITWMKYMTCCMSU-VMPITWQZSA-N 398.511 2.536 0 50 GFAA COc1ccc(OC[C@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 20109776 SEQFSUFNUVIUSY-GOSISDBHSA-N 376.884 2.911 0 50 GFAA C[C@H](O)c1cn(-c2ccc(CNC(=O)c3n[nH]cc3-c3ccccc3)cc2)nn1 2325869527 RTTNOKTWHFIQDQ-AWEZNQCLSA-N 388.431 2.641 0 50 GFAA CC(C)S(=O)(=O)Cc1cccc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c1 112429101 CRUPXNKUZHIYHY-RBUKOAKNSA-N 388.489 2.790 0 50 GFAA COc1ccccc1CCC(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356137136 GRIOWXRTSYDJES-QHCPKHFHSA-N 394.519 2.990 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)[C@@H]3CCn4nccc4C3)CC1)OCC2 2356149022 FPZCVISOZVMCQY-QGZVFWFLSA-N 381.476 2.545 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccccn2)S(=O)(=O)c2ccccc2)cc1 4982250 QTIIQGOWLJOLPO-UHFFFAOYSA-N 397.456 2.924 0 50 GFAA C[C@@H](c1ccncn1)N(C)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 55074311 MKOIQBVIMLBVIV-HNNXBMFYSA-N 391.541 2.850 0 50 GFAA COc1ccc(NC(=O)CC(=O)N(C)[C@H](CN(C)C)c2ccccc2)c(OC)c1 55042434 JEBRVRNIJNCIGD-LJQANCHMSA-N 399.491 2.794 0 50 GFAA COC(=O)C1CCN([C@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 20512208 FCWDBMFIAFLEGD-AWEZNQCLSA-N 385.247 2.510 0 50 GFAA CCn1ccnc1CN1CCC[C@H](N2CCN(c3ccccc3OC)CC2)C1 23374843 GBRASSKOXNFZQF-IBGZPJMESA-N 383.540 2.698 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)c4ccc(C)c(C)c4)CC3)nn2)n1 72116088 CEIWLMKUTNJUEK-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1ccc(CCCN2C(=O)O[C@@H]3CN(c4nc(C)cnc4C)C[C@@H]32)cc1 12076375 RLPMEVCWZZLHEN-RBUKOAKNSA-N 382.464 2.744 0 50 GFAA COc1ccc2[nH]cc(CCN[C@H]3CC(=O)N(c4cccc(F)c4)C3=O)c2c1 4728057 GHTLPNWVPFZSPB-IBGZPJMESA-N 381.407 2.780 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 232756944 MVYPYIUVWYRYHQ-OAHLLOKOSA-N 380.491 2.562 0 50 GFAA CC(C)N1CCC(N2CCN(c3ccnc4ccccc34)C[C@@H]2CCO)CC1 72421253 XQDOJYOODDBRNL-FQEVSTJZSA-N 382.552 2.981 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4cccc(Cl)c4)CC3)ncn2)n1 72438164 GKALSYHJZARALG-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA NC(=O)c1csc(CNC(=O)C(F)(F)c2cccc(Cl)c2Cl)n1 1437802231 BRIFLAPFXHSKQH-UHFFFAOYSA-N 380.203 2.957 0 50 GFAA O=C(NC[C@H](O)c1cccc(F)c1)C(=O)Nc1cc(Br)ccc1F 122757899 JPBJGVZJMXAVPJ-AWEZNQCLSA-N 399.191 2.516 0 50 GFAA O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)N[C@H]1CC[C@@H](C(=O)O)C1 262682582 BABVFVCGQWGHMP-CEXWTWQISA-N 380.444 2.917 0 50 GFAA CC(C)c1nccc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)n1 71754145 MWKVJAPVIAJPQR-KRWDZBQOSA-N 385.556 2.555 0 50 GFAA CC(C)[C@@H](NC(=O)c1cc(F)ccc1-n1cnnn1)c1nc2ccccc2n1C 223228547 UNBFZSWSKATRGI-GOSISDBHSA-N 393.426 2.815 0 50 GFAA Cc1nn2cc(CNC(=O)N3CCC(Oc4ccccc4F)CC3)nc2s1 426360019 CGTIMYIUPJFLHB-UHFFFAOYSA-N 389.456 2.991 0 50 GFAA CC(=O)N1C[C@H]2CN(Cc3ccc4c(c3)Cc3ccccc3-4)C[C@@]2(C(=O)O)C1 96164172 WKXSXFYAILELNG-AUSIDOKSSA-N 376.456 2.623 0 50 GFAA COc1ncccc1C(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 91416939 IEMMKLAUNWVBGV-QFBILLFUSA-N 377.488 2.794 0 50 GFAA O=C([C@H]1COc2ccccc2C1)N(CCCn1ccnc1)Cc1cccnc1 91625430 RZAKBZYLTGDCIE-HXUWFJFHSA-N 376.460 2.948 0 50 GFAA O=C(c1ccc(-c2ncccn2)cc1)N1CCCC[C@@H]1CCN1CCOCC1 426571646 QSZJTZYYYHHTNB-HXUWFJFHSA-N 380.492 2.861 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)Cn3ccccc3=O)CC2)C1 95378704 AEAUIYLDTDEZGF-FQEVSTJZSA-N 379.504 2.576 0 50 GFAA O=C(c1cncs1)N1C[C@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95520553 LUMCLISISFIHOP-NIKGAXFTSA-N 383.473 2.574 0 50 GFAA CC[C@H]1CN(C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)CCN1 95525294 GMYJURCHRZXDFB-IBGZPJMESA-N 380.492 2.875 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)NCCCn2nnc3ccccc32)c1 91664773 HRBYOAMYVBXZEY-UHFFFAOYSA-N 376.420 2.650 0 50 GFAA CCN1CCN(C2(C(=O)NCc3cc(F)ccc3C)Cc3ccccc3C2)CC1 22920178 QVGBMISEQVEMHU-UHFFFAOYSA-N 395.522 2.925 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)N[C@@H]1CCC[C@H]1OCc1ccccc1 96149097 YXKBQXUZRDHOBL-RTBURBONSA-N 378.436 2.922 0 50 GFAA C[C@@H](CN1CCCC1)C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 91846064 WFORZBVKODBNKU-SFHVURJKSA-N 381.524 2.764 0 50 GFAA Cn1cc([C@@H](NS(=O)(=O)c2ccc(C(C)(C)C)cc2)[C@H]2C[C@@H](O)C2)cn1 252571265 XQWGVWSMDNACMD-XCRHUMRWSA-N 377.510 2.508 0 50 GFAA CC(C)(C)OC(=O)NCCNC1CCN(C(=O)OCc2ccccc2)CC1 66323406 MMPPFABFCSYSQR-UHFFFAOYSA-N 377.485 2.902 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)[C@@H]1C[C@@H]2C=C[C@H]1C2 299763363 UYCLYPZSVYYVGZ-FCGDIQPGSA-N 395.503 2.564 0 50 GFAA Cc1ccccc1OCCNC(=O)N1CCCC[C@H]1CCN1CCOCC1 584895134 QWTKCJSKOBOPIA-IBGZPJMESA-N 375.513 2.660 0 50 GFAA COc1ccc(CNC(=O)C2CCN(Cc3cc(C(C)=O)cn3C)CC2)cc1 952968129 JSRSCSFAZKZACZ-UHFFFAOYSA-N 383.492 2.765 0 50 GFAA COc1cccc2c1OCCCN(C1CCN(C(=O)c3ccncc3)CC1)C2 952983435 DYILBTIEVMZSQL-UHFFFAOYSA-N 381.476 2.980 0 50 GFAA C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CSC[C@H]1C(=O)N(C)C 170620624 NNIVWWNTMOBJFI-RNCFNFMXSA-N 377.293 2.750 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1 779856494 JPVVHQITLDWRQZ-NWANDNLSSA-N 377.828 2.571 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCCN(Cc3cccc4nonc34)CC2)s1 1529190026 DEVRSQPNTDXPPI-UHFFFAOYSA-N 384.461 2.835 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(N(C)C)c4ccccc34)C[C@@H]2O)on1 1704354176 VHLLHBFSYKCJHC-VFNWGFHPSA-N 379.460 2.878 0 50 GFAA COCC1CCN(C(=O)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)CC1 12386277 GOYSSPCLTGNKPM-QGZVFWFLSA-N 378.900 2.964 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN([C@@H](C)CC(C)(C)O)CC1 12597465 NPJUCPYRQVYXKW-HNNXBMFYSA-N 390.524 2.980 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@@H]2CCCN(CC3CCCCC3)C2)CC1 12612813 NTASZSHQWBVGBL-LJQANCHMSA-N 378.561 2.541 0 50 GFAA O=C(NCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)CC3CC3)CC2)C1 14960077 ORWDULMDLRLSSL-FQEVSTJZSA-N 383.536 2.806 0 50 GFAA COc1ccc(-c2noc(CN3CCCC[C@H]3CCCO)n2)c(OC)c1OC 15065183 VJQFWGOGRDPCFK-AWEZNQCLSA-N 391.468 2.889 0 50 GFAA COCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(-n2nc(C)cc2C)cc1 15077621 YNSHUXACVDPPRM-IBGZPJMESA-N 384.480 2.845 0 50 GFAA CC(C)C(=O)N1CCC(N2CCC[C@@H](C(=O)NCCc3ccccc3)C2)CC1 15077683 YNNHBCRZWQONJV-HXUWFJFHSA-N 385.552 2.704 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1)[C@H]1CCCC[C@H]1C(=O)O 16294359 QADZZZIOWJHBAT-UONOGXRCSA-N 394.855 2.642 0 50 GFAA COc1ccccc1N1CCC(N2CCC[C@@H](N3CCC(CO)CC3)C2)CC1 19228127 VJZRYHPDHTWKLA-OAQYLSRUSA-N 387.568 2.833 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc4ncccc4c3)C[C@@H]2CCO)CC1 19228192 QSMAHQZHFIPNQF-QHCPKHFHSA-N 396.579 2.976 0 50 GFAA COc1cccc(-c2cc3c(=O)n(CCNC(=O)C4CCCCC4)ccn3n2)c1 169777049 NGBVVKOTCROFPA-UHFFFAOYSA-N 394.475 2.868 0 50 GFAA CCn1cc(C(=O)N2CCC3(CCc4c(O)nc(C5CC5)nc43)CC2)c(C)n1 1857717940 GTMWFMSDYGBIJK-UHFFFAOYSA-N 381.480 2.705 0 50 GFAA Cc1ccccc1[C@@H](CNC(=O)c1cn2c(n1)CCNCC2)N1CCC(C)CC1 1857724440 DTOCMXWCRAPUIS-OAQYLSRUSA-N 395.551 2.540 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccccn4)[C@H]4CC[C@]3(C2)O4)cc1 1857724993 IHVJUINCHAYAJB-KLJZETAQSA-N 377.488 2.799 0 50 GFAA Cn1cnc2c(c1=O)CCN(C(=O)c1ccc3c(ccn3Cc3ccccc3)c1)C2 432148857 PSHXSPQHOFWZPM-UHFFFAOYSA-N 398.466 2.982 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)Cn2nc(C)cc2C)cc1 247880988 JAIBQTIUYDAYGC-UXHICEINSA-N 382.508 2.632 0 50 GFAA COc1ccccc1CC(=O)N1CCN(c2nc3c(F)cccc3n2C)CC1 1875257876 ITYVLDTXFVQCHW-UHFFFAOYSA-N 382.439 2.612 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCO[C@H](C(F)(F)F)[C@@H]3C)ccc21 1875372057 VDEUGLZCLZHEII-SJCJKPOMSA-N 382.382 2.944 0 50 GFAA COCCc1nsc(N2CC[C@@H](N(C)C(=O)c3cnc(C(C)C)s3)C2)n1 1875312487 MZMXTVVCILGXBJ-GFCCVEGCSA-N 395.554 2.658 0 50 GFAA Cc1nc2ccccc2c(C)c1C(=O)NCc1ccnc(N2CCNCC2)c1 1875301181 COBQSCFHISMOKV-UHFFFAOYSA-N 375.476 2.586 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCc3ccccc3OCC(C)(C)O)nn(C)c21 1875402903 NPOVGWQQDWYFTH-KGLIPLIRSA-N 387.480 2.522 0 50 GFAA O=C(c1cc[nH]n1)N1CC[C@H]2[C@H](CCCN2C(=O)CC2(C(F)(F)F)CC2)C1 1775993200 XGLPBSFBTQGBAV-OCCSQVGLSA-N 384.402 2.595 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCc2ccccc2C1)c1cccc(F)c1 2100482864 DIMYHMWIOLNABD-UHFFFAOYSA-N 376.453 2.567 0 50 GFAA C[C@H](c1ccccc1)N1C[C@H](C(=O)OCc2ncn(-c3ccccc3)n2)CC1=O 2325731312 DPYUHLOLZPWEDS-SJLPKXTDSA-N 390.443 2.920 0 50 GFAA CS(=O)(=O)c1cccc(C[C@H]2CCCN(c3nccc4nccnc34)C2)c1 2325796206 ARYJUVUWNYAIAA-MRXNPFEDSA-N 382.489 2.887 0 50 GFAA O=C1O[C@H]2C[C@H](C(=O)N(CCn3ccnc3)Cc3cccc(Cl)c3)C[C@H]2O1 2325799285 FKJOCEDSFNHWLY-XGBSXSJOSA-N 389.839 2.879 0 50 GFAA O=C(CN(c1ccccc1F)S(=O)(=O)c1ccccc1)NCc1cccnc1 1092997 XESQEZLMKHPZIO-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA O=C(O)CCC(=O)O[C@H]1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O 2008581 UCUOKZUJHTYPJT-LJQANCHMSA-N 386.791 2.864 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)CCn2c(O)nc3ccccc32)C1=O 2356146835 XICLEUROAZFHGF-NRFANRHFSA-N 384.480 2.524 0 50 GFAA Cc1cccc(S(=O)(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356154301 PWUUTEUMGCOPQL-FQEVSTJZSA-N 386.521 2.520 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@@H](c3cccc(F)c3)C2)c(OC)c1 225782286 UFBUXDNHDBHMRV-QGZVFWFLSA-N 378.425 2.954 0 50 GFAA CC1(C)[C@H](NC(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)[C@@H]2CCO[C@H]21 246734780 FAFKKKSKWFCBIM-IPMKNSEASA-N 394.475 2.947 0 50 GFAA Cc1nc(CN(C)Cc2cccc(C(=O)Nc3c(C)cc(=O)[nH]c3C)c2)no1 67840161 LESRRTGFPACMMR-UHFFFAOYSA-N 381.436 2.567 0 50 GFAA Cc1n[nH]c2ncc(NC(=O)C3CCN(C(=O)COc4ccccc4)CC3)cc12 126466093 SSFFNNDTQBMGOW-UHFFFAOYSA-N 393.447 2.522 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F 123761164 HLUUQBKJUOVPKI-VXGBXAGGSA-N 386.376 2.501 0 50 GFAA COc1coc(CN2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)cc1=O 72128241 HDXDYPWBHLMNMN-VLCRHTCISA-N 384.451 2.850 0 50 GFAA O=C(NC[C@@H]1CCCS1(=O)=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 124476832 ODUBJPLDKHHERO-YJBOKZPZSA-N 375.494 2.982 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)c1)c1cccs1 363438753 SSVJDASHTDPHIL-MRXNPFEDSA-N 398.488 2.630 0 50 GFAA NC(=O)NCC(=O)N1CCC[C@H](C(=O)c2ccc(-c3ccccc3)c(F)c2)C1 72129236 XWGRSOMLZSYPTP-INIZCTEOSA-N 383.423 2.582 0 50 GFAA CN(Cc1nc2ccccc2s1)C(=O)c1cn(CC[C@@H]2CCCCN2)nn1 77407986 KWDMOBKCRYCHPE-AWEZNQCLSA-N 384.509 2.692 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N[C@H]1CS(=O)(=O)c2ccccc21 172527373 QBMQADFALMLDJQ-HNNXBMFYSA-N 388.470 2.899 0 50 GFAA COc1ccc(N2C[C@H](C(=O)NC3(c4nc(C)no4)CCCCC3)CC2=O)cc1 77197363 WMPLIOPAOSDUHK-OAHLLOKOSA-N 398.463 2.715 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)c2c[nH]cc2-c2ccc(F)cc2)CC1 173275105 AEOJUJDGLNWQPP-UHFFFAOYSA-N 393.466 2.898 0 50 GFAA COc1cccc(NC(=O)CN(C)Cc2nc([C@@H](C)OCC(C)C)no2)c1 173925533 WFTSYFFCKZDYCI-CQSZACIVSA-N 376.457 2.882 0 50 GFAA O=C(NC[C@@H](O)c1ccccc1Cl)c1nc(N2CCCC2)ncc1Cl 130228138 QBKRBXGAXZYMQB-CQSZACIVSA-N 381.263 2.847 0 50 GFAA Cc1nccn1-c1cc(NCCNC(=O)c2ccc(C(F)(F)F)cc2)ncn1 82230190 PRVQMZOWLNIRQO-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA FC(F)(F)CN1CC[C@@H](c2nc(-c3cn(Cc4ccccc4)nn3)no2)C1 289919632 YQUXXUMLQXMDCW-CYBMUJFWSA-N 378.358 2.728 0 50 GFAA COc1cccc(-c2noc(CCCC(=O)N3CCC[C@H]3c3n[nH]c(C)n3)n2)c1 426428690 CCJJSPGHAYWCED-INIZCTEOSA-N 396.451 2.858 0 50 GFAA CC(C)c1c(C(=O)N2CC[C@@H](CN)C2)cnn1-c1ccc(C(F)(F)F)cn1 178559830 VUPVKBGULFEIDL-LBPRGKRZSA-N 381.402 2.830 0 50 GFAA Cc1cc(C)c(C(=O)NC2CCN(Cc3cc(F)cc(F)c3)CC2)c(=O)[nH]1 91645221 NQSUQCFQJORFND-UHFFFAOYSA-N 375.419 2.664 0 50 GFAA Cc1cc(C)nc(N2CCC[C@H](C(=O)NC[C@H]3CCCN4CCCC[C@H]34)C2)n1 238950620 ZALXBUPLKWCELC-HSALFYBXSA-N 385.556 2.691 0 50 GFAA CO[C@@]12CC[C@H](OCC3CC3)C[C@@H]1N(C(=O)c1cc(C)c(C)n(C)c1=O)CC2 426359591 IGGGMONJBJDNFS-LQBOVUBWSA-N 388.508 2.581 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3ccc4nsnc4c3)C2)N1Cc1ccccn1 91988066 CIPHXVNTWNUDFZ-DOTOQJQBSA-N 379.489 2.709 0 50 GFAA CSCC(=O)N1CCC2(CCN(CCc3ccccc3)CC2)[C@@H](CO)C1 97156029 ZFKRXXBEKONQEJ-LJQANCHMSA-N 376.566 2.515 0 50 GFAA CNS(=O)(=O)c1ccc(CNC(=O)N[C@H]2CCCc3ccc(C)cc32)s1 179400361 KLFNMQIYDJZOKU-INIZCTEOSA-N 393.534 2.841 0 50 GFAA CCc1cnc(C)nc1N1CCC(c2nnc(Cn3ccnc3)n2CC)CC1 96148630 DSLHYOVRQZNPLZ-UHFFFAOYSA-N 380.500 2.588 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(CCOc1ccc(Cl)cc1)CCN2C 91550910 GGSLXUZCDUKJON-FQEVSTJZSA-N 379.932 2.737 0 50 GFAA COc1ccc(NC(=O)N[C@@H](C)Cc2cccs2)cc1NS(C)(=O)=O 95512875 ISVRRLALJCFZCD-NSHDSACASA-N 383.495 2.881 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C[C@@H]1COc3ccccc3O1)CC2 91468507 SEXXJJVGHGWHLG-GOSISDBHSA-N 388.508 2.568 0 50 GFAA COc1ccc(F)cc1CN1CC[C@@]2(O)CCN(C(=O)C3CCCC3)C[C@H]2C1 95378106 VAZQEODQNVYXRZ-XMSQKQJNSA-N 390.499 2.810 0 50 GFAA CCN1CC2(CCN(S(=O)(=O)C3CC3)CC2)C[C@@H](c2ccccc2)C1=O 91737514 BGETZBRMTSTSGW-SFHVURJKSA-N 376.522 2.597 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1C[C@@H]2CC[C@H](C1)N(CC1CCC1)C2 95363255 WCTGYJMGKQVHBQ-RTBURBONSA-N 379.504 2.724 0 50 GFAA Cc1nc(N)nc(C)c1CC(=O)N[C@@H](C)c1cnn(-c2cccc(F)c2)c1C 92036823 PMAVCCHNOBLFPK-ZDUSSCGKSA-N 382.443 2.729 0 50 GFAA CCCCn1c(S(=O)(=O)Cc2nn(C)cc2Br)nc(C)c1C 295888304 KTXBIJZCHQJTDR-UHFFFAOYSA-N 389.319 2.770 0 50 GFAA Cn1cccc1CNC(=O)CC[C@H]1N=C(O)N(c2cccc3ccccc23)C1=O 252494905 OHQQOYKSXDGSTA-GOSISDBHSA-N 390.443 2.904 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2)C1=O)Nc1nc2ccccc2s1 252536975 KANBVGHJZVZMMJ-CQSZACIVSA-N 380.429 2.950 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252553302 VJMDWGJUMYILLC-IEGUWTFLSA-N 391.471 2.990 0 50 GFAA O=C(NCc1ccc(F)cc1F)c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2 263615478 CQAWPHYZZQQBLP-QGZVFWFLSA-N 388.349 2.897 0 50 GFAA COc1cccc(CNC(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)c1 35310551 QEOBPALCHUMXMN-HFXUHXBXSA-N 391.471 2.643 0 50 GFAA COCCN1C[C@H](CN2CCN(c3cc(Cl)ccc3Cl)CC2)CC1=O 299782807 GKYFMQCRYDMWDT-AWEZNQCLSA-N 386.323 2.610 0 50 GFAA COCCCn1c(C)cc(O)c([C@@H](CC(=O)OC)c2ccc(OC)cc2)c1=O 824396204 AVHXQUYBGNYLIE-KRWDZBQOSA-N 389.448 2.602 0 50 GFAA CCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCc3noc(C4CC4)n3)ccc12 823498918 XGSKWQTWCBOSLG-NSHDSACASA-N 383.404 2.700 0 50 GFAA CCOc1ccc([C@H](CC)NS(=O)(=O)c2csc(C(=O)NC)c2)cc1 670438588 OCFOOYWIEZLZLL-HNNXBMFYSA-N 382.507 2.936 0 50 GFAA Cc1cc2cc(C(=O)NCC3CCN(C(=O)CCn4cccn4)CC3)ccc2o1 952978398 ZJJUGXVOEGKUCG-UHFFFAOYSA-N 394.475 2.996 0 50 GFAA COCCN1CC[C@H](CNCc2ccccc2OCCCCn2ccnc2)C1 952970518 PFQDFTGYQANOMH-HXUWFJFHSA-N 386.540 2.800 0 50 GFAA O=S(=O)(c1ccc(Br)o1)N1CCN(C2CCCCC2)CC1 408214261 LYFHMFWYICOQQO-UHFFFAOYSA-N 377.304 2.681 0 50 GFAA CC(C)Cn1c(N)c(-c2csc(-c3c(F)cccc3F)n2)c(=O)n(C)c1=O 170597895 LGJAFRRLTQETDC-UHFFFAOYSA-N 392.431 2.854 0 50 GFAA CNC(=O)c1cccc(NC(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)c1 192793568 NZEJOYIPBOFLJG-UHFFFAOYSA-N 398.438 2.565 0 50 GFAA COc1ccc(-n2nnc(C(=O)NC3CCN(CC4CCCC4)CC3)c2C)cc1 194524742 HKKDBXNJUPZHKR-UHFFFAOYSA-N 397.523 2.969 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCOc2ccc(CO)cc2C1 1506424557 KMBNBMYRNTUSFB-GOSISDBHSA-N 377.824 2.861 0 50 GFAA CC[C@H](C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12)N(C)CC 1704301044 HNMGGXHENYWMTH-GOSISDBHSA-N 390.524 2.825 0 50 GFAA CCCCS(=O)(=O)N1CCCN(C(=O)Cc2c(F)cccc2Cl)CC1 1775977019 CWCGGHJMWILTTQ-UHFFFAOYSA-N 390.908 2.686 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)NCCn1nccc1C)C2 1772804359 NFZXPZIGZKUXKS-CQSZACIVSA-N 385.493 2.841 0 50 GFAA O=C(NCCCn1nnc2ccccc21)[C@H]1CC(Cc2cccc(Cl)c2)=NO1 12167859 GFJYXKQOKAZNTO-LJQANCHMSA-N 397.866 2.979 0 50 GFAA Cc1cccnc1CN(C)C[C@@]1(O)CCCN(Cc2ccc(F)c(F)c2)C1=O 12306427 YXNGZDIXJGJHGI-NRFANRHFSA-N 389.446 2.654 0 50 GFAA Cc1cccc(C)c1Oc1ncccc1CNC(=O)C[C@@H]1CCS(=O)(=O)C1 12306543 ZARWKXYPDMZUKU-INIZCTEOSA-N 388.489 2.932 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3cccc(C)n3)C2)cc1 12320567 WWINMTGXBYQKLR-QGZVFWFLSA-N 389.521 2.589 0 50 GFAA COCCN1CCC(CN(C[C@@H]2CCCO2)C(=O)Cc2cccs2)CC1 12585125 RSPJQIWVFMFXKT-SFHVURJKSA-N 380.554 2.657 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)CCc4cnccn4)C3)C2)c1 12713389 NXCWZZGUSMSCFM-QHCPKHFHSA-N 394.519 2.933 0 50 GFAA COC(=O)CCC(=O)N1CCC(CCC(=O)NCc2cccc(Cl)c2)CC1 14966301 URTPURATDTVXNS-UHFFFAOYSA-N 394.899 2.928 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@@H](NCCc3ccc(OC)cc3)C2=O)cc1 19804907 VCNNFWMSDYLBFS-HXUWFJFHSA-N 382.460 2.948 0 50 GFAA CC[C@@H](C(=O)NCc1nnc2c(-c3nc(C)no3)cccn12)c1ccccc1 169775976 YHPKDAMEBSYKQK-OAHLLOKOSA-N 376.420 2.898 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)N(C)Cc3cccc4cccnc34)CC2=O)s1 1857667746 ILCVLFAINYEOJF-HNNXBMFYSA-N 395.488 2.660 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(c3cnccn3)CC1)OCC2)N1CCCC1 1857693062 GPUFCCBTRRPMEN-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA O=C(Cc1ccc(F)c(F)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857727217 NQMUYYOYXTXBOR-KNKQGSTJSA-N 398.409 2.808 0 50 GFAA CCc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3[nH]cnc3C)[C@H]3CC[C@]2(C1)O3 1857727571 UXDBGAMBFUKJFP-DZCCDHAISA-N 394.519 2.690 0 50 GFAA CC(C)CNC(=S)N1CCC([C@@H]2OCC[C@H]2NC(=O)OC(C)(C)C)CC1 840800895 WBZBBOQDWGGGLZ-CVEARBPZSA-N 385.574 2.911 0 50 GFAA CC(C)(CO)c1nc2ccc(C(=O)Nc3cnn([C@@H]4CC4(F)F)c3)cc2[nH]1 1875396296 BBSNSRJGVBDWIE-CQSZACIVSA-N 375.379 2.862 0 50 GFAA C[C@@H](NC(=O)CC(C)(C)CC(=O)O)c1cn([C@H]2CCCc3cccnc32)nn1 1875354454 WFWXWEGMEGVKHY-CJNGLKHVSA-N 385.468 2.667 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccccc1Br 4144245 AKEGIBOVECMXSC-AWEZNQCLSA-N 383.242 2.657 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCCc3nc4c(s3)CCCC4)cn12 2100557260 YYFBQCKWBHDJST-SFHVURJKSA-N 399.520 2.727 0 50 GFAA CC(C)C1(C(=O)N2CC[C@@]3(C2)c2ncn(C)c2CCN3C(=O)[C@@H]2CC2(C)C)CC1 2325776798 AAXGAIYWHLILLY-QMHKHESXSA-N 398.551 2.715 0 50 GFAA O=C([C@@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC(N2CCCCC2)CC1 2325807675 LPLBOUDVDJPWRW-HXUWFJFHSA-N 394.523 2.764 0 50 GFAA O=C(NC[C@@H]1CCC2(CCC2)CO1)c1[nH]nc2ncc(Br)cc12 2325853899 GNCXDHRKKIIPAB-NSHDSACASA-N 379.258 2.800 0 50 GFAA O=C(O)[C@@H](CNCc1ccc2nc(O)[nH]c2c1)Cc1cc(F)c(F)c(F)c1 2325876892 DLHBWFPNAJMFRB-LLVKDONJSA-N 379.338 2.719 0 50 GFAA CS(=O)(=O)N(Cc1ccc(C(=O)NC[C@H]2CCCO2)cc1)c1ccccc1 839565 JAIGEPWMHQYETA-LJQANCHMSA-N 388.489 2.562 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSc1nc(-c2ccccc2)cc(=O)[nH]1 1050804 KBLLQYKTVABWLZ-UHFFFAOYSA-N 395.440 2.954 0 50 GFAA O=C(COC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1 1229644 UPBVKAOXHZCNJR-UHFFFAOYSA-N 387.457 2.901 0 50 GFAA COc1cc(C(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)ccc1C 2356141955 XKEKOJTUCPZTJN-DENIHFKCSA-N 383.444 2.524 0 50 GFAA COc1ccccc1CNC(=O)[C@@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 2883249 FSHYWYRNHQINPL-MRXNPFEDSA-N 390.505 2.783 0 50 GFAA COc1cc(OC)cc(C(=O)Nc2ccccc2N2CCN(C(C)=O)CC2)c1 4412739 XRQOLPDDIANPPU-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1 6697363 LQGBHALEDPFWAX-HXUWFJFHSA-N 381.476 2.870 0 50 GFAA O=C(NCc1ccncc1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 7367032 IEYHFELYNMFZDF-FQEVSTJZSA-N 395.484 2.704 0 50 GFAA OC[C@@H]1CCCN(c2cc(NCc3ccc(-n4ccnc4)c(F)c3)ncn2)C1 110280459 VGFGCQCGMVWHFC-MRXNPFEDSA-N 382.443 2.622 0 50 GFAA CCOC(=O)[C@]1(COC)CCCN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1 225624158 OUHZSZZWVIMFCD-LJQANCHMSA-N 397.855 2.543 0 50 GFAA O=C1Nc2cc(F)ccc2[C@@H]1CC(=O)N1CCc2nc[nH]c2[C@@H]1c1ccncc1 102334570 KQVRREZSIMJBBS-YWZLYKJASA-N 391.406 2.544 0 50 GFAA Cc1ccc(OCC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c(C)c1 20255200 VIYZVXKJDZRSOD-UHFFFAOYSA-N 382.460 2.755 0 50 GFAA CCOC(=O)[C@H]1CCCCN1C(=O)CN1CCC[C@H]1Cc1cccc(OC)c1 248184068 GICSRADQSXQCFK-AZUAARDMSA-N 388.508 2.646 0 50 GFAA CCc1nc2n(n1)C[C@H](NC(=O)c1cncc(-c3ccc(OC)cc3)c1)CC2 135581648 RXAWNSZSVWWGCY-QGZVFWFLSA-N 377.448 2.656 0 50 GFAA COc1cccc(OC[C@@H](O)CNC(=O)c2ccc3nc(C4CC4)oc3c2)c1 12090689 RQNSRMAFUUMVGG-HNNXBMFYSA-N 382.416 2.884 0 50 GFAA O=C(NCCc1c[nH]cn1)c1cc(CN2CCC(Cc3ccccc3)CC2)on1 67672933 LXXYHMTYOMPLRV-UHFFFAOYSA-N 393.491 2.825 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@@H]2CN2CCCC2)CC1 171670140 CIZNSSNLORTNKP-LJQANCHMSA-N 386.540 2.934 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1)C2 171799601 FYYNSRHSGICUAD-PMACEKPBSA-N 397.519 2.959 0 50 GFAA C[C@@H]1Cc2cc(C(=O)NCc3nc(C4CC4)cs3)ccc2N1S(C)(=O)=O 127009905 DVJCWCKKNICCRY-LLVKDONJSA-N 391.518 2.661 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 11817590 IXFHKAXULYKXJQ-MRXNPFEDSA-N 392.459 2.980 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CC[C@H](N(C)C)C2)no1 11874711 ARAHOLMHLHHDGZ-ZDUSSCGKSA-N 379.844 2.692 0 50 GFAA CC[C@H](C(=O)N1N=CC[C@]1(O)C(F)(F)F)n1nc(C)c(Br)c1C 6489488 ZNAZRCMTGQELQR-SKDRFNHKSA-N 397.195 2.683 0 50 GFAA CC(C)Cc1ccc(CN2CCn3nc([C@@H](O)c4nccn4C)cc3C2)cc1 218794310 BYJJQVARKSBWHS-OAQYLSRUSA-N 379.508 2.913 0 50 GFAA O=C(N[C@@H]1C[C@@H]1C1CCCCC1)N1CCC(S(=O)(=O)N2CCCC2)CC1 369108006 YPGPDAYTFYOIGU-QZTJIDSGSA-N 383.558 2.555 0 50 GFAA CS(=O)(=O)Nc1c[nH]nc1[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 371607960 PNLUIIRQEPEGRY-SNVBAGLBSA-N 389.403 2.579 0 50 GFAA CCNCCNC(=O)c1ccccc1SCC(=O)N1CCc2ccccc21 236978523 UTDHLJMMAVAMFM-UHFFFAOYSA-N 383.517 2.707 0 50 GFAA O=C(c1cnnn1-c1c(Cl)cccc1Cl)N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 333872405 UUFGLXYDNMIIDP-NBLIUIFLSA-N 377.231 2.600 0 50 GFAA CN1Cc2ccccc2[C@H](NC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 378277619 OIRBASNJFUJJCH-GHTZIAJQSA-N 395.478 2.981 0 50 GFAA O=C(NCCc1nc2c(s1)CCCC2)N[C@H]1CCN(c2ncccc2F)C1 130592994 AGLRMTCRAMPTPB-ZDUSSCGKSA-N 389.500 2.677 0 50 GFAA CC(C)N1CCC(NC(=O)CN(CCCO)[C@@H]2CCCc3ccccc32)CC1 174905057 HLTSHCLUUYTHKG-JOCHJYFZSA-N 387.568 2.737 0 50 GFAA O=C(O)c1cc2c(nc1N1CCC(Oc3ccccc3)(C(=O)O)CC1)CCC2 82147582 WRBWODCTJTZWNM-UHFFFAOYSA-N 382.416 2.771 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(Cc1cccc(-n3cccn3)c1)CC2 91526081 WDVAZKFMBKMKRB-UHFFFAOYSA-N 376.508 2.965 0 50 GFAA Cc1csc(SCc2nc(CC(N)=O)nn2Cc2ccc(F)cc2)n1 95512634 GVHLNPAZHHSENO-UHFFFAOYSA-N 377.470 2.551 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)N(CC(=O)O)C1CCOCC1 237824106 GDGRAAFXWQSYCG-CMDGGOBGSA-N 383.448 2.595 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C(=O)c4ccc(F)cc4)N4CCC[C@H]4[C@@H]3C2=O)cc1 245327755 QGOXTTHFVIUWDE-MUGJNUQGSA-N 392.430 2.969 0 50 GFAA COC(=O)/C=C1/CC[C@@H]2[C@H](C(=O)C[C@H]3[C@@](C)(C(=O)OC)[C@@H](O)CC[C@]23C)[C@@H]1C 257347281 CFNLOOTYKUBPGV-OAPRFNFNSA-N 392.492 2.677 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(SC)cc2)CN1C1Cc2ccccc2C1 32540547 CAZHJKSKKYYPJW-KNQAVFIVSA-N 395.572 2.854 0 50 GFAA COCCn1cnc2sc3c(c2c1=O)CC[C@H](NCCc1ccccc1)C3 299778871 OZWXCDHJFOZXDV-INIZCTEOSA-N 383.517 2.794 0 50 GFAA CN1CCN(c2ccc(C(=O)Nc3ccc(CC(=O)NC4CC4)cc3)cc2)CC1 823792651 BICWOCKCSZPELZ-UHFFFAOYSA-N 392.503 2.512 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@@H]2CCCN(Cc3cccc4nonc34)C2)s1 825272171 DTLUVWCZVQKZQA-AWEZNQCLSA-N 385.493 2.938 0 50 GFAA O=C(NC1(C(=O)O)CCCC1)N(CCOc1ccccc1)C[C@H]1CCCO1 827881126 IEUAMYLEDNYESD-QGZVFWFLSA-N 376.453 2.653 0 50 GFAA COc1ccccc1-n1cc(C(=O)NCCc2nc(C)c3c(n2)CCCC3)cn1 824835054 BGPXTTWSYNWMKM-UHFFFAOYSA-N 391.475 2.831 0 50 GFAA COC1CCN(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCCCCC2)CC1 670439123 MGNZJCLEWKLTPB-FQEVSTJZSA-N 395.569 2.549 0 50 GFAA CCN1CCC(N(CCc2ccccn2)Cc2c(CO)cnc(C)c2O)CC1 952872077 IZEJCGJBQZWNSM-UHFFFAOYSA-N 384.524 2.512 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCN(c2nsc3ccccc23)CC1 952975138 OIVSJLGFZIYMAM-UHFFFAOYSA-N 383.521 2.928 0 50 GFAA Cc1ccccc1N1CCCN(C(=O)c2ccc3c(=O)n(C)cnc3c2)CC1 952987210 SQZILCHHYDDPMQ-UHFFFAOYSA-N 376.460 2.594 0 50 GFAA O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@@H](c2noc(C3CC3)n2)C1 270089799 TVAZNFWBZMCSRI-HZPDHXFCSA-N 382.468 2.510 0 50 GFAA CCOCCC1(CNC(=O)C2=NO[C@H](CNC(=O)OC(C)(C)C)C2)CCCC1 170608065 PXOWELCURLSFAT-HNNXBMFYSA-N 397.516 2.759 0 50 GFAA O=S(=O)(CCc1ccc2c(c1)CCO2)NCc1ccn(C2CCCC2)n1 189746082 KCVLPANKDHOSLX-UHFFFAOYSA-N 375.494 2.595 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N1CCCC[C@H]1c1nnc2n1CCCC2 195441563 OCMIJURCAQGRCN-HNNXBMFYSA-N 390.509 2.847 0 50 GFAA COCC1(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCc3cccs3)C2)CCC1 220224518 GWXCAXHGKXJJGP-AEFFLSMTSA-N 390.549 2.947 0 50 GFAA CCCCS(=O)(=O)N1CCCN(C(=O)c2cc(Cl)ccc2OC)CC1 1775983102 RXHMUUGWKVORBI-UHFFFAOYSA-N 388.917 2.626 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)[C@H]2COc3ccccc3C2)CC1)C1CC1 12298641 NOOCXZMXYMKZCW-QGZVFWFLSA-N 394.475 2.646 0 50 GFAA O=C(CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1)NCc1cccnc1 12324901 JQBDQRXSEXFTQH-UHFFFAOYSA-N 397.866 2.600 0 50 GFAA CC(C)CCN(C)Cc1cnc(S(=O)(=O)CC2CC2)n1C[C@@H]1CCCO1 12434340 AOGFVAOIDKXWSJ-SFHVURJKSA-N 383.558 2.724 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(Cc4cnc(C)n4C)C3)C2=O)c1 12444936 FAMPUNVYUUUTLN-JOCHJYFZSA-N 382.508 2.752 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)CCSC)C3)C2=O)c1 12713593 AGALZDIFLVNUNU-HXUWFJFHSA-N 376.522 2.789 0 50 GFAA O=C(CCC1CCN(Cc2cccn2-c2ccccn2)CC1)N1CCOCC1 19838689 ORYFEEVDHQWBLJ-UHFFFAOYSA-N 382.508 2.723 0 50 GFAA CC(C)C[C@@H](NC(=O)c1ccc2c(c1)NC(=O)CO2)c1nnc2ccccn12 206250408 BIUPMKSAXXEAFD-OAHLLOKOSA-N 379.420 2.577 0 50 GFAA Cn1ccc2c(C(=O)Nc3ccc4c(c3)C(=O)N3CCC[C@@H]3C(=O)N4)cccc21 206252751 BCJKWDNZTMBWTL-LJQANCHMSA-N 388.427 2.987 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)[C@@H](C)CCc1ccccc1F)CCO2 1857527935 JBXAIXOSBUUATF-MMZARCGUSA-N 396.528 2.884 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCCCn3ccnc3)cc12 1857683142 DFWDKXVFZLYCAH-UHFFFAOYSA-N 388.537 2.648 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2ccccc2OC(F)F)N1Cc1ccncc1 1857683269 TVUWFXRXSAHDSD-HOTGVXAUSA-N 387.386 2.699 0 50 GFAA O=C(NCCCO)c1cc2c(s1)C1(CCN(C3CCCC3)CC1)OCC2 1857704026 AGGDVQMRVICEAP-UHFFFAOYSA-N 378.538 2.667 0 50 GFAA OC[C@]1(Cc2ccccc2)CN(Cc2nnc(-c3cccc(F)c3)o2)CC[C@H]1O 1857719103 DBIZWZZWMQANPS-KNQAVFIVSA-N 397.450 2.664 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)cc1 1857723609 NIGUGFIHPNFYBH-SFTDATJTSA-N 382.508 2.797 0 50 GFAA C[C@H]1CCN(C(=O)NCC(C)(C)c2c(F)cccc2Cl)CCS1(=O)=O 428633241 OOKFKLCSPFXYIG-LBPRGKRZSA-N 390.908 2.975 0 50 GFAA O=C(NCc1cc2ccccc2[nH]1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 263922427 SKDGGIVEUMAWTI-QUCCMNQESA-N 393.443 2.556 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)CCc3ccc4c(c3)OCO4)C1)CC2 1704301129 LMUOEJDAAODUBP-JOCHJYFZSA-N 379.460 2.953 0 50 GFAA O=C(C(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1)N1CCCC1 1704330805 GKSPSDDZMGIBPW-QHCPKHFHSA-N 390.487 2.572 0 50 GFAA O=C(NCC[C@H](c1ccccc1)N1CCCC1)c1nnn(-c2ccccc2)n1 1875329291 OVDZJDIWRHHGMA-LJQANCHMSA-N 376.464 2.619 0 50 GFAA Cc1nc(C)c(CC(=O)NCC[C@H]2CCN(C(=O)c3cc(Cl)c[nH]3)C2)s1 1875332486 UQECQANLOKWLFS-ZDUSSCGKSA-N 394.928 2.953 0 50 GFAA Cc1cc(F)cc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397800 OLHNMFGIYDSIFK-GOSISDBHSA-N 385.487 2.611 0 50 GFAA CC[C@@H](CC(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2)CC(F)(F)F 2325781059 HEBJABURORTPRB-VIFPVBQESA-N 378.372 2.720 0 50 GFAA CCc1nc2cc(C(=O)N[C@@H]3CCC(=O)NC3=O)ccc2n1C1CCCCC1 1857797717 CYJDQUTWODMLCK-OAHLLOKOSA-N 382.464 2.639 0 50 GFAA COC(=O)[C@@H](CC(C)C)NC(=O)c1ccccc1I 1000449 VGEHSOPFWIXDQB-GFCCVEGCSA-N 375.206 2.609 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@H]1c1cc(OC)c(OC)cc1Br 1080979 SPTYXSCPYMRLLO-NSHDSACASA-N 398.253 2.907 0 50 GFAA CCc1c(O)nc(SCC(=O)N(CC)CC)n(-c2ccccc2C)c1=O 1231053 GJVIMSGKCRMKAH-UHFFFAOYSA-N 375.494 2.769 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356147250 NZOACEUMRHUSIJ-QFIPXVFZSA-N 378.476 2.696 0 50 GFAA Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)ccc21 2865661 AULBITWANOCIGP-UHFFFAOYSA-N 385.367 2.697 0 50 GFAA CCCn1nc(N(Cc2noc(-c3ccccc3)n2)S(C)(=O)=O)cc1C 2356158581 PTUJRERHIGOZSU-UHFFFAOYSA-N 375.454 2.618 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCc3ccnn3C)C2=O)cc1 2356163456 DSQRLEITOHSPBS-QFIPXVFZSA-N 380.492 2.849 0 50 GFAA Cc1nc(Cc2noc(C3CCN(C(=O)c4ccc(F)cc4F)CC3)n2)no1 109513335 WEZLCUZTMXGKFC-UHFFFAOYSA-N 389.362 2.650 0 50 GFAA O=C(c1coc(COc2cccc3cccnc23)n1)N1[C@H]2CC[C@@H]1C[C@H](O)C2 102797437 SSEZCVLGGAOUTB-ZSHCYNCHSA-N 379.416 2.930 0 50 GFAA CCCc1nnc(NC(=O)CSc2nnc(-c3cccnc3)n2CC)s1 9304344 XPCQULBZBNPOAT-UHFFFAOYSA-N 389.510 2.895 0 50 GFAA CSc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)N(C)Cc2nc(C)c[nH]2)cc1 67678934 NHRDVORTLOHXKB-QGZVFWFLSA-N 385.493 2.727 0 50 GFAA NC(=O)c1ccc(NC(=O)Cn2nc(-c3ccc4ccccc4c3)ccc2=O)cc1 61718085 OKNOZDNLUUDIMQ-UHFFFAOYSA-N 398.422 2.801 0 50 GFAA O=C(C1=CCCC1)N1CCC[C@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 20600963 RGTNSUSSUQCWMH-FQEVSTJZSA-N 397.519 2.634 0 50 GFAA CS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Oc2ccccc2)nc1 67680386 XZRMHKCRCBIRAJ-INIZCTEOSA-N 375.450 2.627 0 50 GFAA C[C@@H]1COCCN1CC(=O)N(C)[C@@]1(c2ccccc2Cl)CCCCC1=O 229380882 DFBKVXLOOSRNEX-FOIQADDNSA-N 378.900 2.858 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3c2c(O)nc2nc4ccccc4n32)ccc1O 4624525 JISZXEKOFFJVID-LLVKDONJSA-N 376.372 2.776 0 50 GFAA CC[C@@H](C(=O)N1N=CC[C@@]1(O)C(F)(F)F)n1nc(C)c(Br)c1C 6488991 ZNAZRCMTGQELQR-JOYOIKCWSA-N 397.195 2.683 0 50 GFAA O=C(N[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1cnc2sccn2c1=O 121728042 JNCZFWYULSETTL-JQWIXIFHSA-N 395.362 2.941 0 50 GFAA CS(=O)(=O)c1ccc([C@H](O)CN2CCC([C@H](O)c3ccccc3)CC2)cc1 154790977 YPMXQDDNHLQSDB-NHCUHLMSSA-N 389.517 2.569 0 50 GFAA COc1ccccc1C[C@H]1CCCN1C(=O)C1CCN(c2cnccn2)CC1 124207407 DKVUIXXQGCNCLH-LJQANCHMSA-N 380.492 2.935 0 50 GFAA CN(C)C(=O)[C@@H](NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccccc1 328625378 DCBJTEQDFIEMQW-DYVFJYSZSA-N 380.414 2.883 0 50 GFAA C[C@H](C(=O)N1CCC[C@H]2CN(C(=O)[C@H](C)c3cccnc3)C[C@H]21)c1cccnc1 330066380 SUUVORBJYSYJRP-SQBLYHGDSA-N 392.503 2.833 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)C2(C(=O)N3CCC[C@@H]([C@H](C)N)C3)CCCC2)c1 237480800 BFRVHFVTDLQKSN-ZWKOTPCHSA-N 392.565 2.976 0 50 GFAA CCC1(CNC(=O)NCc2ccc(C(N)=O)o2)CCN(Cc2ccccc2)CC1 378261752 UOHRATURAIQVRF-UHFFFAOYSA-N 398.507 2.870 0 50 GFAA CCc1c[nH]c(SCC(=O)c2cc(C)n([C@H]3CCS(=O)(=O)C3)c2C)n1 129014957 LLXWZZIHDUDRFE-AWEZNQCLSA-N 381.523 2.725 0 50 GFAA CC(=O)N1CC(NC(=O)c2cc(-c3cc(C)sc3C)nc3onc(C)c23)C1 173215686 NSWKSVWVIOMKLJ-UHFFFAOYSA-N 384.461 2.837 0 50 GFAA Cc1nc(CNc2nccc(-c3cc(C(=O)O)ccn3)n2)nc2c1CCCC2 72475457 HJOTZQHYZKCYQX-UHFFFAOYSA-N 376.420 2.826 0 50 GFAA CCc1nn2c(nnc3c(=O)n(C[C@@H]4CCCO4)ccc32)c1-c1ccccc1 40390843 UUTHMFCJSQFQJC-HNNXBMFYSA-N 375.432 2.848 0 50 GFAA C[C@@H]1[C@@H](N(Cc2ccc3c(c2)OCO3)C(=O)c2ccc(=O)n(C)n2)CCC[C@H]1C 242273709 YFIGVMVSODHRAL-VKJFTORMSA-N 397.475 2.976 0 50 GFAA O=C(c1cccc(N2CCOCC2)c1)N1CCC([C@@H](O)c2ccccn2)CC1 222690895 CITBLBXSMGGLFH-OAQYLSRUSA-N 381.476 2.504 0 50 GFAA COc1ccc(C(=O)N2CCC(Cc3ccccc3)CC2)cc1-n1cnnn1 180439716 LCEXTKLUDSBKOX-UHFFFAOYSA-N 377.448 2.766 0 50 GFAA CC1(C)CCCC[C@@H]1CC(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1 178595837 QKXSCGWCRMVBEC-CQSZACIVSA-N 380.501 2.974 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)Cc3cc(C)no3)C2)cc1 95509619 ACBJMHMBIPEGFJ-LJQANCHMSA-N 385.508 2.947 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2nnc(C(C)C)o2)CC3)cn1 95361884 WRWRMJHZWKGIQR-UHFFFAOYSA-N 398.511 2.696 0 50 GFAA CCc1cc(CN2CCC3(CCN(CCCSC)CC3)[C@@H](CO)C2)n[nH]1 97657148 QTIBLYVKJYMKIL-QGZVFWFLSA-N 380.602 2.622 0 50 GFAA Cc1cc(N2CC[C@H](N3CCN(C)CC3)[C@H](CCC(=O)O)C2)c2ccccc2n1 95392901 RMHVKZXBEURULX-NQIIRXRSSA-N 396.535 2.850 0 50 GFAA C[C@H](CN(Cc1ccccc1)C(=O)c1cc(N2CCNC2=O)ccc1F)C(=O)O 299749113 JGUZZIKTZFYZFV-CQSZACIVSA-N 399.422 2.718 0 50 GFAA CC[C@H](C)[C@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)Nc1ccc(OC)cc1 252347088 UKXUAQJQENTZMU-RVHYNSKXSA-N 395.503 2.879 0 50 GFAA CN(C)CCn1ccc(NC(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)n1 183161171 YSEYZFUVDPZCOK-CYBMUJFWSA-N 399.421 2.529 0 50 GFAA CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)c1cccc(-c2csc(C(N)=O)c2)c1 534658238 MMJFNAOJVPHIHA-INIZCTEOSA-N 385.489 2.643 0 50 GFAA COc1ccc([C@@H](NC(=O)/C=C/c2cnc(N(C)C)nc2)c2ccncc2)cc1 824654094 HQWUUKGSLBAAFC-AZJBKQKUSA-N 389.459 2.865 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1cccc2ncccc12 827968302 QAGCETVMQBQIGR-UHFFFAOYSA-N 391.427 2.725 0 50 GFAA Cc1noc([C@@H](C)NC(=O)N2CCC(C(=O)NC3CCCCCC3)CC2)n1 584885999 OJSQMRPYKBDUDW-CYBMUJFWSA-N 377.489 2.700 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)Nc2c(-c3cnn(C)c3)nc3ccccn23)C1 268127451 KFWQOTSQDHHOJR-MRXNPFEDSA-N 381.484 2.683 0 50 GFAA COc1cc(CCC(=O)N2CCC(C(=O)O)CC2)ccc1OCC(F)(F)F 268946877 PQNCTQSYDQBPFG-UHFFFAOYSA-N 389.370 2.892 0 50 GFAA C[C@@H]1CN(C(=O)[C@@H]2CCC[C@@H](C(=O)N3C[C@@H](C)OC(C)(C)C3)C2)CC(C)(C)O1 222156770 KUTBNEJIWOKSET-BRSBDYLESA-N 394.556 2.845 0 50 GFAA COC[C@H]1CCCCN(Cc2nnnn2-c2ccccc2Br)C1 170597092 KAZVEFJQGPFWTB-ZDUSSCGKSA-N 380.290 2.673 0 50 GFAA O=C(NC1(C(=O)NCC2CC2)CCCC1)c1ccc(-c2cncnc2)cc1F 186295954 HKMKQSWNCKYOEE-UHFFFAOYSA-N 382.439 2.852 0 50 GFAA Cc1noc2ncnc(NCc3cccc(S(=O)(=O)N4CCCCC4)c3)c12 195512461 UWQCKQBVDLCAOF-UHFFFAOYSA-N 387.465 2.713 0 50 GFAA Cn1c([C@H]2CCCN(C(=O)c3nc(N)nc4c3CCCC4)C2)nc2ccccc21 1506405245 YGYJSFWHEIHCGE-AWEZNQCLSA-N 390.491 2.844 0 50 GFAA COc1cc(CNCCSC)ccc1OC[C@H](O)CN1CCCCCC1 11842585 HZVXPOCVBWBRDZ-GOSISDBHSA-N 382.570 2.764 0 50 GFAA CCn1nc(C)c(CNC(=O)c2cn(Cc3ccc(F)cc3Cl)nn2)c1C 11873838 ZQKRSKSBFWKNIE-UHFFFAOYSA-N 390.850 2.882 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H](NC(=O)COc2ccccc2)C1 12209603 NTAUDYJBYUJWBJ-SFHVURJKSA-N 396.491 2.522 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@H](C(=O)c2cccc(OC(C)C)c2)C1 12588614 DRJQRCKECFOWGM-INIZCTEOSA-N 376.453 2.641 0 50 GFAA CCS(=O)(=O)N1C[C@H](C(=O)N2CCCc3ccccc32)Oc2ccccc21 16651808 GGTYHBNESJUDIB-LJQANCHMSA-N 386.473 2.583 0 50 GFAA CN(C)CCOc1cccc(CN2CCN(CC(C)(C)C)[C@@H](CCO)C2)c1 19838907 DVRMFYKLSVJFKY-FQEVSTJZSA-N 377.573 2.542 0 50 GFAA Cc1ccc(C)c(Cn2c(=O)c(-c3noc(C)n3)c3n(c2=O)CCCCC3)c1 169763996 XASJIODMUVIGTI-UHFFFAOYSA-N 380.448 2.760 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C[C@H](O)C1CCN(C(=O)C2(C)CC2)CC1 1857717878 CRZGFVKBFFSQKM-SFHVURJKSA-N 398.507 2.568 0 50 GFAA COc1ccc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1OC 1857729206 NBBBMPLXZQXNLW-XPNTWCBSSA-N 394.471 2.978 0 50 GFAA CC(C)c1cc(CN2C[C@@H]3[C@H](CNC(=O)C4CC=CC4)[C@H]4CC[C@]3(C2)O4)no1 1857730270 OYCLEEJOWDVAML-JZJXAQOMSA-N 385.508 2.860 0 50 GFAA O=C(NC[C@H]1CCCCCN1)Nc1cccc(C(=O)N2CCSCC2)c1 904320020 AWNYSIPBSYTDNZ-QGZVFWFLSA-N 376.526 2.529 0 50 GFAA Cc1ccn(C)c(=O)c1NC(=O)N1CCN(c2nccc3sccc23)CC1 808838368 UBLXTJNYKFPQQL-UHFFFAOYSA-N 383.477 2.658 0 50 GFAA Cc1ccc(Cn2nc(C)c(CCC(=O)N3C[C@H]4NC(=O)CC[C@@H]4C3)c2C)cc1 1875295934 AUPCCDRLESGIHX-TZIWHRDSSA-N 394.519 2.526 0 50 GFAA O=C(NC[C@H](O)c1ccc(O)cc1)[C@H]1[C@H]2c3cccc(Br)c3C[C@H]21 1875322970 QAJVJXMNHTZGRO-LAVFITLUSA-N 388.261 2.890 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C(=O)OC)cc1 1875371128 PRLYQWNFCLMODT-HIFRSBDPSA-N 384.354 2.767 0 50 GFAA C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)N1CCC(c2ccncn2)CC1 886074535 LVOFVDDOGSJNCE-XLIONFOSSA-N 394.523 2.671 0 50 GFAA CCCc1nnc(S)n1CC(=O)N(C)Cc1cnn(-c2ccc(F)cc2)c1 2325803075 OSFFKEVIWRIFON-UHFFFAOYSA-N 388.472 2.503 0 50 GFAA O=C(c1ccc(F)cc1O)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356151019 MTKDDIHQHAMVLN-OAQYLSRUSA-N 383.423 2.724 0 50 GFAA Nc1cccc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)n1 2356162263 FGCGWPBSSJSUAU-JOCHJYFZSA-N 378.476 2.504 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)Nc1ccc(F)cc1F 2882791 NWNAJBGJRRVOCV-UHFFFAOYSA-N 384.404 2.541 0 50 GFAA Cc1cccc(Cl)c1S(=O)(=O)N1CCCc2c(OCC(N)=O)cccc21 414382419 KSTMKHVPGWJOEB-UHFFFAOYSA-N 394.880 2.654 0 50 GFAA CN1CCN(Cc2cccc(-c3nc(Cc4cccc(F)c4)cc(=O)[nH]3)c2)CC1 20998413 YPFUUUNQSKFYCN-UHFFFAOYSA-N 392.478 2.914 0 50 GFAA CCn1c(C)ccc(C(=O)NCc2cccnc2-n2cnc3ccccc32)c1=O 67883917 GLCLVLNIZUZGHS-UHFFFAOYSA-N 387.443 2.841 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Nc3ccccc3OCC)CC2)n1 65362516 PKUDXHFWVBXWAU-UHFFFAOYSA-N 384.484 2.970 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)CCCc3cccs3)C2)CC1 20204348 VMHOJYKLPOMKPY-KRWDZBQOSA-N 393.553 2.836 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CN(C)Cc3ccccc3)C2=O)c1OC 67695514 DKOIZMXACMFFFI-QHCPKHFHSA-N 398.503 2.689 0 50 GFAA COC[C@@H](CO)NC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cccs1 252495228 OOASUWNZHQBKQT-ZNFPLGDCSA-N 383.473 2.738 0 50 GFAA C[C@@H]1C[C@@H]1[C@@H](NC(=O)Cn1nc2n(c1=O)CCCCC2)c1ccc(Cl)cc1 230218807 AEVLHFKWGHQRGH-AZOIQLNYSA-N 388.899 2.938 0 50 GFAA O=C(c1nc2ncccn2n1)N1CCc2c([nH]c3ccccc23)[C@H]1c1ccccn1 11662953 HMZVKCGAHVNUDZ-LJQANCHMSA-N 395.426 2.789 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)c3ccc(Cl)cc3O)CC[C@H]21 72477325 MZZOWOAZNIXLNX-XJKSGUPXSA-N 380.872 2.535 0 50 GFAA CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2ccc(=O)n(-c3ccccc3)n2)c1 437214800 AJFDNZJSFVQTQB-AZUAARDMSA-N 375.428 2.917 0 50 GFAA O=C1OCCN1c1cccc2c1CCN(C[C@@H](O)COc1ccc(F)cc1)C2 174057204 AOJIRJGWJSBILR-QGZVFWFLSA-N 386.423 2.580 0 50 GFAA CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)C1 366346621 MZPYHVNHAGVYCQ-MRXNPFEDSA-N 399.447 2.790 0 50 GFAA Cc1nc(C)n(C[C@@H](C)C(=O)N2CCCN(CCCc3ccccc3)CC2)n1 77426226 COABUHVPEWTYQL-GOSISDBHSA-N 383.540 2.698 0 50 GFAA Cc1cc(C(=O)N2CCc3c(nc(-c4cccnc4)nc3N(C)C)C2)ccc1O 72156293 PJMCNEWYQRTTMS-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA Cc1nc(N2CCN(C(=O)C3CCCCC3)CC2)cc(-n2cnc(C)c2C)n1 72437528 GVWAHYBSCGHQQL-UHFFFAOYSA-N 382.512 2.816 0 50 GFAA CC(C)[C@H]1CN(C(=O)CN2CCCC2)CCC(=O)N1Cc1ccc(F)cc1 71745421 SJLACNQTNUXIOT-LJQANCHMSA-N 375.488 2.507 0 50 GFAA CCc1oncc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 72151325 UVXGMZSCXPPZPW-LBPRGKRZSA-N 381.354 2.787 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCC[C@H](COc4ccccc4F)C3)nc2n1 426518834 RXBNEEAUDSIBLY-HNNXBMFYSA-N 383.427 2.811 0 50 GFAA Cc1ccc([C@@](C)(O)CNC(=O)C2CCN(c3nc4ccccc4o3)CC2)o1 176749625 UGYGHIPNICBXFJ-NRFANRHFSA-N 383.448 2.970 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nnc(CN4CCCCCC4)n3C)CC2)on1 96160198 HLORZRZRZLBNJR-UHFFFAOYSA-N 386.500 2.507 0 50 GFAA Cc1ccccc1-c1noc([C@H](C)NC(=O)Cn2cnc3ccccc3c2=O)n1 91411887 JAEGGIAJHGFEJE-AWEZNQCLSA-N 389.415 2.632 0 50 GFAA CNc1nc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)cs1 95502525 DFRZMFLNMDKXEL-OAHLLOKOSA-N 382.493 2.844 0 50 GFAA Cc1oc(-c2cccc(F)c2)nc1CN1CCN(C)[C@@]2(CCNC(=O)CC2)C1 91657324 GJJXEEPZNDHDJU-NRFANRHFSA-N 386.471 2.575 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 95354812 KTRYUELWNDPJQA-AWEZNQCLSA-N 383.431 2.611 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1n[nH]c2c1CCCCC2 97528019 BZUCXEPXRWJEGO-UHFFFAOYSA-N 376.482 2.712 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccccc3-c3ncc[nH]3)C2)CCC1=O 95529366 FYXODKIMFNTLEL-QFIPXVFZSA-N 396.491 2.568 0 50 GFAA CC[C@@H](NC(=O)Nc1ccccc1CCC(=O)NC)c1cn2cccnc2n1 96149071 NDPFUWGSLSBDGT-OAHLLOKOSA-N 380.452 2.681 0 50 GFAA O=c1cc(CN2CCc3nc[nH]c3[C@@H]2c2ccccn2)[nH]c2c(F)cccc12 92066773 LPHHEVVFNPIADL-NRFANRHFSA-N 375.407 2.933 0 50 GFAA O=C(c1cnc(N2CCOCC2)nc1)N1CCC(Cc2ccccc2F)CC1 95366090 NBRWYPAAWATFRL-UHFFFAOYSA-N 384.455 2.547 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95527395 UYEDCDVHARVDDC-MRXNPFEDSA-N 376.464 2.558 0 50 GFAA O=C(NCCCc1ncc[nH]1)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 244874436 XBFHLNUJPIZUEV-UHFFFAOYSA-N 381.402 2.789 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1C(=O)O 299750245 NAMVTZIMLIWQKD-LLVKDONJSA-N 392.358 2.576 0 50 GFAA O=c1c(=Cc2cccnc2)sc2nc(-c3ccc(Br)cc3)nn12 254438674 CEPOPXCADDSITC-UHFFFAOYSA-N 385.246 2.523 0 50 GFAA CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)c1cccc(-c2ccc(=O)n(C)n2)c1 534637700 XXMZAPDXAUUGRR-UHFFFAOYSA-N 379.464 2.740 0 50 GFAA COCCOc1ccccc1NC(=O)N1CCC[C@H](C(=O)N2CCCC2)C1 299769919 KGEFOVPSKXZIGN-INIZCTEOSA-N 375.469 2.578 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@@H](Cn1ccnc1)c1ccccc1 827995238 WRNDXMILIUXASH-FQEVSTJZSA-N 376.460 2.635 0 50 GFAA Cc1cc(CC(=O)NC[C@H]2CCCN(Cc3noc(-c4ccccc4)n3)C2)on1 827861505 JILMPRZVFHDDFR-MRXNPFEDSA-N 395.463 2.604 0 50 GFAA Cc1cccc2nc(CCN(C)C(=O)NCCCn3c(C)cccc3=O)[nH]c12 584892825 BMGYIZUTRVVKCH-UHFFFAOYSA-N 381.480 2.616 0 50 GFAA COc1cc2nc(N3CC[C@]4(C3)OCc3ccccc34)nc(N)c2cc1OC 302250257 MMBZIXQGYGJWFG-OAQYLSRUSA-N 378.432 2.865 0 50 GFAA CCCc1c(C(=O)NC[C@@H]2CCN(CC)C2)nnn1-c1cccc(Cl)c1 109259251 RAVGURXRIHQSKF-AWEZNQCLSA-N 375.904 2.945 0 50 GFAA Cc1noc(C)c1COc1cccc(C(=O)NS(=O)(=O)C2CCCC2)c1 170658218 IWNGKPCFFWFMST-UHFFFAOYSA-N 378.450 2.873 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)C2)CN1 279190547 WKXGYLBQKXDNMO-NRFANRHFSA-N 378.432 2.683 0 50 GFAA Cc1cc(C(=O)N2C[C@H](Cc3cnccn3)[C@@H](O)C2)c2ccc(C)c(C)c2n1 1615935830 BLVYWJWYPOTOPM-JXFKEZNVSA-N 376.460 2.626 0 50 GFAA COCCSc1nnc(NC(=O)c2nc3ccc(Cl)cn3c2F)s1 1529174917 YGUISUFKOSCWHX-UHFFFAOYSA-N 387.849 2.969 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)c1 1529189124 HNMLNWDHSSIYGE-NFBKMPQASA-N 396.487 2.929 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H](C(C)C)N(C)C)ccc1F 1704324695 DCXRWUVHMXDDSY-OAHLLOKOSA-N 392.475 2.871 0 50 GFAA CCc1noc(C)c1C(=O)N1CCCN(C(=O)c2ccc(CSC)o2)CC1 1772712280 MPTFSCBLEJFHBE-UHFFFAOYSA-N 391.493 2.990 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)Cc4ccccn4)C3)C2=O)c1 11821722 HJNVLDHSDNZIAP-QHCPKHFHSA-N 393.487 2.674 0 50 GFAA CCNC(=O)c1ccc([C@@H]2CCCN2C(=O)CN(C)Cc2cccnc2)s1 19781547 KRKKOPRRVULJPJ-INIZCTEOSA-N 386.521 2.688 0 50 GFAA Cc1cc2occ(CC(=O)N3C[C@@H]4CCOC[C@]4(C(=O)O)C3)c2cc1Cl 1857669704 ZUUKRDNESGHURE-ORAYPTAESA-N 377.824 2.887 0 50 GFAA OCCCn1nc(COc2cccc(Cl)c2)nc1[C@H]1CCn2nccc2C1 1857678109 BJQRSUPXEIWSTL-AWEZNQCLSA-N 387.871 2.819 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)NCCc2ncc[nH]2)cc1OC 1857688650 UXHIAGPVPJCMRT-UHFFFAOYSA-N 396.447 2.650 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)CC2CCN(Cc3ccccc3)CC2)CC[C@@H]1O 1857723865 ZVUYBWDVTBBZBJ-GMAHTHKFSA-N 388.552 2.661 0 50 GFAA CCOCCN1C[C@@H]2[C@H](CNC(=O)c3ccccc3Cl)[C@H]3CC[C@]2(C1)O3 1857732717 CSJVORDFIUEEPR-IXIUHKBRSA-N 378.900 2.586 0 50 GFAA CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O 2566275 XINBRUNUJFZFGH-OALUTQOASA-N 398.459 2.750 0 50 GFAA in-vitro O=C(NC[C@H]1CCN(CC(F)(F)F)C1)C1CCN(Cc2ccccc2)CC1 263809771 MXQJURHEFUMMDQ-QGZVFWFLSA-N 383.458 2.899 0 50 GFAA CN(C(=O)c1ccc(N2CCCC2)nn1)[C@@H]1CCN(c2ccccc2Cl)C1=O 264763021 NXEKGHBYYYTETQ-QGZVFWFLSA-N 399.882 2.608 0 50 GFAA C[C@H](CC(=O)N[C@@H](CO)[C@@H](O)c1cccnc1)c1ccc(Br)cc1 913565486 KKZBOJTZVAOCEM-PUECVXPYSA-N 393.281 2.548 0 50 GFAA CC[C@H](C)c1ccc(C(=O)NCc2cccc(NC(=O)CN(C)C)c2)c(O)n1 1875282620 LYLOZUGRVGDGRU-AWEZNQCLSA-N 384.480 2.731 0 50 GFAA C[C@@H](c1nc2ccccc2s1)N1CCN(c2ncc3ncn(C)c3n2)CC1 1875305451 RGKWKAOKOFHKEN-ZDUSSCGKSA-N 379.493 2.856 0 50 GFAA Cc1ccc(F)c2[nH]c(C(=O)NC[C@H]3CC(=O)N(C)[C@@H]3c3cnn(C)c3C)cc12 1875392194 ITDKOGXLYBZSND-XCLFUZPHSA-N 397.454 2.607 0 50 GFAA O=C(CCc1cccc2c1B(O)OC2)NC1(c2ccc(C(F)(F)F)cc2)CC1 1875368980 UOPRURVSNHUYGA-UHFFFAOYSA-N 389.182 2.661 0 50 GFAA C[C@@]1(c2ccc(CN=c3cc(C4CCCCC4)nc[nH]3)cc2)NC(=O)NC1=O 1875360670 FDVQDILCEYGZGT-NRFANRHFSA-N 379.464 2.613 0 50 GFAA COC(=O)[C@@H](OC)C1CCN(C(=O)CNc2cccc(C(F)(F)F)c2)CC1 1875308756 VFJWBYVAZBNDEP-INIZCTEOSA-N 388.386 2.544 0 50 GFAA Cn1cc(S(=O)(=O)N2CC=C(c3cccc(OC(F)(F)F)c3)CC2)cn1 888090944 XQVJLUPNUPPJNR-UHFFFAOYSA-N 387.383 2.797 0 50 GFAA COCCn1cc2c(n1)[C@@H](NC(=O)c1ccc3c(c1)nc(O)n3C1CC1)CCC2 888101029 OYTWYOAOYUGZCZ-INIZCTEOSA-N 395.463 2.727 0 50 GFAA O=C(O)[C@]1(CCCc2ccccc2)CN(Cc2cn3ccccc3n2)CC[C@H]1O 2100477984 QGIOWSHEFIOMKY-NFBKMPQASA-N 393.487 2.995 0 50 GFAA CC1(C)CC[C@@H](N2CCC3(CCc4c(O)nc(N5CCOCC5)nc43)CC2)C1 2100556243 JPQFIDYCWBUQPY-MRXNPFEDSA-N 386.540 2.877 0 50 GFAA O=C1[C@@H](NC2CC(c3ccc(Br)cn3)C2)CCN1CC(F)(F)F 2325805999 KVGUHLDBSJZPOH-OCTTZUBCSA-N 392.219 2.843 0 50 GFAA O=C(c1ccc(N2CCCC2)cc1)N1CCN(C(=O)c2ccccc2O)CC1 2325808385 WDUKJVXDNZEBKC-UHFFFAOYSA-N 379.460 2.591 0 50 GFAA CC(C)c1ccc2nc(NC(=O)CN3CCN(c4ccncc4)CC3)[nH]c2c1 2325859821 LUDXNDRFXZUKKD-UHFFFAOYSA-N 378.480 2.842 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](Sc3nc(C)cc(C)n3)C2=O)cc1 792850 JAHZNETYWDRHOA-OAHLLOKOSA-N 385.445 2.694 0 50 GFAA O=C(NC(=S)Nc1cccc2nsnc12)c1cncc(Br)c1 977587 UOTSZKLGZCIPQW-UHFFFAOYSA-N 394.279 2.976 0 50 GFAA C[C@@H](C(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1)c1cc2ccccc2o1 225716194 HVWAKAABCONMBQ-GDBMZVCRSA-N 376.478 2.563 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4F)CC3)C2=O)cc1 100119102 LMQKQGLMOSZHOA-HXUWFJFHSA-N 397.450 2.679 0 50 GFAA O=C(c1cc(COc2ccccc2F)[nH]n1)N1CCN[C@@H](c2ccccc2)C1 67855436 LXZZBAVCAFTCDL-LJQANCHMSA-N 380.423 2.915 0 50 GFAA O=C(Nc1cccnc1)C1CCN(S(=O)(=O)Cc2cccc(Cl)c2)CC1 24610816 XETOXTQGRYCLKG-UHFFFAOYSA-N 393.896 2.916 0 50 GFAA CC[C@@H]1CN(CCNC(=O)c2cccnc2OC)Cc2cc(OC)ccc2O1 11971637 VMQWCFWDCRLYNY-MRXNPFEDSA-N 385.464 2.502 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1 67785514 FGUZHRRKMGNIGR-QHCPKHFHSA-N 378.520 2.818 0 50 GFAA COC(=O)c1nc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)sc1C(C)C 170625137 GATPTTGDMCOZHB-LBPRGKRZSA-N 389.481 2.698 0 50 GFAA O=C(N1CCCC1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nc3c([nH]2)CCCC3)C1 329056814 YAYBTAYBGKUSLH-LPHOPBHVSA-N 399.539 2.880 0 50 GFAA CCC[C@@H](C)C(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccc(OC)cc2)C1 67934489 KSXVQZPLRIRWPM-CQSZACIVSA-N 385.464 2.959 0 50 GFAA O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccn(-c2ccccc2)n1 155063012 ZEWCXHVGQDSXNY-IBGZPJMESA-N 388.471 2.836 0 50 GFAA O=C(N[C@H]1CC[C@H]1NC1Cc2ccccc2C1)c1c[nH]c2c(F)cccc2c1=O 72432791 RGAALRBUHCVNMZ-UXHICEINSA-N 391.446 2.685 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O 130976949 BPBYQTBJUCKEMZ-LBPRGKRZSA-N 379.482 2.734 0 50 GFAA Cc1ocnc1C(=O)N1CCN(Cc2nc(-c3ccc(Cl)cc3)no2)CC1 128391827 PPPCJPBIQRIYMH-UHFFFAOYSA-N 387.827 2.644 0 50 GFAA C[C@@H](N)[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)C1 237366611 IDEJKXWVEHUESO-APWZRJJASA-N 386.517 2.860 0 50 GFAA Cc1ccc([C@]2(C(=O)NCc3cc(N4CCOCC4)ncn3)CC2(C)C)cc1 72474971 CPKNWWWAZGHAGD-QFIPXVFZSA-N 380.492 2.606 0 50 GFAA CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCC(n2cc(C3CCCC3)nn2)CC1 48187638 BEQCKRCQVBYWQL-MSOLQXFVSA-N 387.528 2.652 0 50 GFAA COc1ccc(S(=O)(=O)N2CC[C@]3(C)[C@@H](C2)C3(Cl)Cl)cc1C(=O)O 284113327 SRBNOXFEFFCHNR-TZMCWYRMSA-N 394.276 2.598 0 50 GFAA CC[C@@H](CO)N1CCN([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 174132456 RWXHQIPMJGODST-SFTDATJTSA-N 385.483 2.894 0 50 GFAA CS(=O)(=O)c1ccccc1CC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 284820326 XQSSMFMZZYIKHK-QGZVFWFLSA-N 393.892 2.886 0 50 GFAA Cc1cc(=O)c(C2=Nc3c(C(N)=O)cnn3[C@H](c3ccc(Cl)cc3)C2)c(O)o1 198834440 FIAKYRIVUNCAQR-AWEZNQCLSA-N 398.806 2.717 0 50 GFAA Cc1nn(CCNC(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)c(C)c1C 426563182 UIVCJTHRALCLQH-UHFFFAOYSA-N 377.876 2.985 0 50 GFAA C[C@@H](Cn1cncn1)NC(=O)N1CCC(CCC(=O)Nc2ccccc2)CC1 426726686 BRJCWGWILVUHGZ-INIZCTEOSA-N 384.484 2.507 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)c1ccccc1N1CCOCC1 148659240 MAXGIVXJDGJEAI-UHFFFAOYSA-N 379.460 2.580 0 50 GFAA COCCn1ccc2ccc(NS(=O)(=O)c3ccc4c(c3)CC(=O)N4)cc21 179889378 QIQRMXNDEQXVIL-UHFFFAOYSA-N 385.445 2.583 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)[C@@H](OC)c1ccccc1)CC2 95521542 OCYRHARKHATIOM-IBGZPJMESA-N 382.508 2.883 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCC[C@@H](OCc2ccccc2)C1 97288709 SLFDJDYKRTUJGY-HXUWFJFHSA-N 377.448 2.543 0 50 GFAA C[C@H](NC(=O)c1cnc(-c2ccncc2)nc1O)c1ccc2c(c1)OCCO2 91706348 OOXNMRQACXEKNY-LBPRGKRZSA-N 378.388 2.506 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1cc(Cl)ccc1Cl 239347108 MCUPLIBUCFXMBW-ARIMKUTISA-N 384.215 2.673 0 50 GFAA CC(C)n1ccnc1C1CCN(C(=O)CC[C@@H](C)N2CCN(C)CC2)CC1 95526151 GRQKPFATEYCMCG-GOSISDBHSA-N 375.561 2.586 0 50 GFAA CC(=O)N1CCc2cc(C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)O)ccc21 299746525 XZSQLOYSSNBJIK-LJQANCHMSA-N 391.427 2.503 0 50 GFAA COC(=O)c1cn([C@H]2CCCc3c2[nH]c2ccc(OC)cc32)cc2c(=O)[nH]nc1-2 263588125 PIFASBOYYLOYRB-KRWDZBQOSA-N 392.415 2.878 0 50 GFAA Cc1nn(C)cc1-c1ccc(C(=O)N2CCC3(CCNC(=O)CC3)CC2)cc1 534634338 VBFAWIWUGFISIU-UHFFFAOYSA-N 380.492 2.918 0 50 GFAA CN1CC[C@H](C(=O)N[C@H]2C[C@]3(CCNC3)Oc3ccccc32)c2ccccc21 1342237958 YIQGYEHNMMSYKY-LTMIRXACSA-N 377.488 2.982 0 50 GFAA CN(C)C[C@@]1(CO)CCCN(S(=O)(=O)c2cccc3cccc(Cl)c23)C1 952984092 ZRMYFWGKZYYHBL-IBGZPJMESA-N 396.940 2.818 0 50 GFAA C[C@H](C(=O)N1CCN(CCc2ccccc2)C(=O)C1)n1cnc2ccccc21 952989674 UBOLFWUDPCWDSY-QGZVFWFLSA-N 376.460 2.511 0 50 GFAA O=C(c1ccc(NC2CCN(CCc3ccccc3)CC2)nc1)N1CCOCC1 881803515 YFLIDBYBBAMGFE-UHFFFAOYSA-N 394.519 2.673 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)Cc2cnc3c(C)cccn23)n1 952973621 YEDGGTPFYIAQOP-INIZCTEOSA-N 383.452 2.511 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 269921028 JBIBAKWYLJHICK-SXLOBPIMSA-N 399.491 2.767 0 50 GFAA NC(=O)c1cnn2c(C(=O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@H]43)ccnc12 275244747 HIZBMVQIWJIVNY-CGTJXYLNSA-N 389.459 2.627 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1ccc(O)nc1)CC2 275529746 CSIZZOFBOCDJKL-KRWDZBQOSA-N 385.489 2.892 0 50 GFAA C[C@@H](O)c1ccc(CNC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 186707384 KUTYCBUVYIBGPK-JPYJTQIMSA-N 397.519 2.518 0 50 GFAA N[C@H](C(=O)N1CCC(NC(=O)c2ccccc2F)CC1)c1cccc(Cl)c1 170677425 YUQWMKDEJXXADM-SFHVURJKSA-N 389.858 2.900 0 50 GFAA COCCOc1ccc(N[C@@H]2CCCN(c3cnn(C)c3)C2=O)cc1Cl 170644333 MHIAJFZSENTYQG-MRXNPFEDSA-N 378.860 2.706 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CCCN(c3ccc4nnc(C5CC5)n4n3)C2)n1 301151473 KKHKOMVYSAZXKC-HNNXBMFYSA-N 377.452 2.560 0 50 GFAA COc1ccc(Cn2ccc(NC(=O)c3cccc(C(=O)N(C)C)c3)n2)cc1 186969657 XCFFCFVGYJGQKZ-UHFFFAOYSA-N 378.432 2.894 0 50 GFAA O=C(NC1CCN(CC(F)(F)F)CC1)N1CCCN(c2ccccc2)CC1 195298156 PGWYMGKKTOQMTM-UHFFFAOYSA-N 384.446 2.935 0 50 GFAA CC[C@@H](CNC(=O)c1c(N(C)C)noc1-c1ccc(F)c(OC)c1)N(C)C 1704304298 CMCYJSDSEABERK-ZDUSSCGKSA-N 378.448 2.625 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCc3cc(C(C)C)no3)CCC2=O)cc1 11772909 HIPKJYSZMFHKCR-QGZVFWFLSA-N 399.491 2.904 0 50 GFAA Cc1cnc(C(=O)NC[C@H]2Cc3cccc(-c4nc(C)cc(C)n4)c3O2)cn1 12126967 LEDUBZLEWQJZJS-MRXNPFEDSA-N 375.432 2.592 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4cnc(OC)nc4)C3)C2)c1 12459372 DJHWZFREQFDXBK-QFIPXVFZSA-N 396.491 2.622 0 50 GFAA O=C1N(CC2CCC2)CCC[C@]1(O)CN1CCOc2ccc(Cl)cc2C1 12586240 CWLVMNJRBUFICX-FQEVSTJZSA-N 378.900 2.688 0 50 GFAA Cc1nonc1C(=O)N(CC1CCN(C2CCCC2)CC1)C[C@@H]1CCCO1 12586925 IYETTYSCGDPTMM-SFHVURJKSA-N 376.501 2.654 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCC[C@H](CCC(=O)N4CCOCC4)C3)cc2c1 12717871 FENFAXOOMGAXSJ-MRXNPFEDSA-N 399.491 2.668 0 50 GFAA CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3ccncc3)CC2)cc1 13331516 MYBRDRUYKCOEOD-MRXNPFEDSA-N 387.505 2.742 0 50 GFAA Cc1c(C)n(-c2ccc(Br)cn2)c2ncnc(NCCCO)c12 13693146 NKYYKDZROLLCLP-UHFFFAOYSA-N 376.258 2.989 0 50 GFAA COC[C@H](C)N1CCC2(CC1)C(=O)N(C(C)C)C(=O)N2CCc1ccccc1 14540895 NDQBCAVORFCXHD-SFHVURJKSA-N 387.524 2.771 0 50 GFAA CN(C)C(=O)c1nn(CC2CCCCC2)c2c1C[C@H](NCC(C)(C)CO)CC2 14751712 RVXXJWYFEBMVJP-QGZVFWFLSA-N 390.572 2.631 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1cnn(Cc2ccc(Cl)c(Cl)c2)c1 169619977 ORQFGHOGKYZHFZ-WCVJEAGWSA-N 392.242 2.905 0 50 GFAA Cc1cc(-c2nc(-c3ccc(C(N)=O)cc3)nn2[C@H]2CCOC2)nn1C(C)C 1857676231 LYRRQOTVXOUJSL-INIZCTEOSA-N 380.452 2.758 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)COc1ccccc1O)CC2 1857712344 VHQAAXILWXTVSV-UHFFFAOYSA-N 377.444 2.799 0 50 GFAA Cn1ccnc1CN1CCC(C2CCN(c3ccnc(C(=O)O)c3)CC2)CC1 1857719209 GXMDQEGCRKMZOT-UHFFFAOYSA-N 383.496 2.642 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)N1CCC(c2cc[nH]n2)CC1 1857729547 DOXGEZOKACNNMO-HNNXBMFYSA-N 394.479 2.959 0 50 GFAA O=C(c1ccc(Cl)cn1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857730874 AWDYIEVHRLQHKC-HLIPFELVSA-N 383.835 2.650 0 50 GFAA Cc1c(C(=O)N2CC[C@@H](N)C[C@H]2C)cnn1-c1cccc(Br)c1 237427939 JHEZJMHQFSVDED-BXUZGUMPSA-N 377.286 2.895 0 50 GFAA CN(CCO)c1ccc(NCc2c(Cl)cccc2N2CCOCC2)nc1 815129537 RLMNFHACHSCFEO-UHFFFAOYSA-N 376.888 2.612 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1cncc(Br)c1 1076354 BDHVJMSEUXMJFY-UHFFFAOYSA-N 390.237 2.569 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 1820717 RZIXHFYAMYCAOX-NRFANRHFSA-N 393.487 2.930 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(OC)c1 4156385 XQEPMDYKCGSDGU-INIZCTEOSA-N 380.466 2.628 0 50 GFAA N[C@H]1CCn2ncc(C(=O)Nc3cnc4ccc(Br)cc4c3)c2C1 2325856417 PAHRVRCXZOJESA-LBPRGKRZSA-N 386.253 2.720 0 50 GFAA CN(Cc1nccn1Cc1ccccc1)C1=NC[C@H](c2ccc(CO)cc2)N1 2325863800 XBXHNNCYFTZSSW-HXUWFJFHSA-N 375.476 2.556 0 50 GFAA COc1ccc(NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(OC)c1 633631 TUPHJGKOISEODD-GOSISDBHSA-N 382.416 2.963 0 50 GFAA Cc1ccc(N(CC(=O)N2CCCC2)S(=O)(=O)c2ccc(F)cc2)cc1 843051 NQRXXALFWNNIEZ-UHFFFAOYSA-N 376.453 2.952 0 50 GFAA O=C(c1ccc(NC(=S)Nc2ccc3c(c2)OCO3)cc1)N1CCOCC1 1121121 NFESSURPPHAXOI-UHFFFAOYSA-N 385.445 2.697 0 50 GFAA CCOc1ccc2nc(NC(=N)NS(=O)(=O)c3ccc(C)cc3)nc(C)c2c1 2183192 IQYDPEKLUSJJTG-UHFFFAOYSA-N 399.476 2.971 0 50 GFAA O=C(NCCc1ccccc1F)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356161421 VMEZSKAMRYUSRJ-UQNRQAKVSA-N 393.462 2.816 0 50 GFAA CCc1c(C)sc(NC(=S)Nc2cnn(CC)c2C(N)=O)c1C(=O)OC 2853559 SRHPXOVLEDWMGF-UHFFFAOYSA-N 395.510 2.530 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N1CCN(C)CC1 6697362 LQGBHALEDPFWAX-FQEVSTJZSA-N 381.476 2.870 0 50 GFAA CCCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1CC(=O)N(Cc2ccncc2)C1 55212096 HKIIHFIAGHCTFY-LJQANCHMSA-N 381.476 2.878 0 50 GFAA C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 112439321 MGKFVHHPUKRHLZ-AEFFLSMTSA-N 399.495 2.694 0 50 GFAA CC(C)CCC1=NC(=O)C2(CCN(C(=O)CN3[C@@H](C)CCC[C@H]3C)CC2)N1 55119338 ZMSYBHHNQOASPM-CALCHBBNSA-N 376.545 2.575 0 50 GFAA CCN(CC)[C@H](CNC(=O)CCNC(=O)c1ccccc1F)c1ccco1 55386920 FUGHVCPOOQBEAT-QGZVFWFLSA-N 375.444 2.738 0 50 GFAA O=C(NCCc1nccs1)N1CCC(C(=O)N2CCc3ccccc3C2)CC1 51336060 BGGNIUXLGQQYPD-UHFFFAOYSA-N 398.532 2.692 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 67665662 HSTPZONBAXXQTK-GOSISDBHSA-N 384.480 2.788 0 50 GFAA COCCn1c(CN(C)[C@H](C)c2ccon2)cnc1S(=O)(=O)CCC(C)C 20453468 DTWFGJNPNKNUOR-OAHLLOKOSA-N 398.529 2.530 0 50 GFAA Cc1ncc(CC(=O)N2CCC(c3[nH]ncc3-c3cccc(F)c3)CC2)c(=O)[nH]1 67833758 IMQGACLDTUWSNH-UHFFFAOYSA-N 395.438 2.556 0 50 GFAA Cc1nn(C)cc1CN1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)CC1 20777036 TUOQXXMPHJNRSM-UHFFFAOYSA-N 380.414 2.982 0 50 GFAA CCS(=O)(=O)c1cccc(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c1 119390832 DLJXCZGBMUIBNZ-HNNXBMFYSA-N 390.480 2.876 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](N2CCCC2)C1)c1cccs1 171450596 AUIVMRFYOLSMDF-OALUTQOASA-N 397.544 2.786 0 50 GFAA CN1CC[C@@](C)(CNC(=O)c2coc(COc3cccc4cccnc34)n2)C1 67473143 WCEDCRBYRRSJAK-NRFANRHFSA-N 380.448 2.873 0 50 GFAA Cc1cc(=O)[nH]c(S[C@@H](C)C(=O)N[C@H](C)c2cnn(-c3ccccc3)c2)n1 32577730 YPPYAZAUKPMANF-KGLIPLIRSA-N 383.477 2.622 0 50 GFAA C[C@](O)(CNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1 131044071 WZAFTGQCPCSTHK-JPYJTQIMSA-N 398.478 2.631 0 50 GFAA Cc1cnc(-c2cccc(NC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)c2)o1 363331113 JODICCNONAPMFH-OAQYLSRUSA-N 390.399 2.957 0 50 GFAA CN(C)CCN(C)C(=O)CC[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71763929 KLRPMNWRTDWZSJ-XMMPIXPASA-N 393.531 2.944 0 50 GFAA CN(CCN1CC2(CCN(C[C@@H]3CCOC3)CC2)OC1=O)C1CCCCC1 72421260 FCWLQCNGCIPQEU-SFHVURJKSA-N 379.545 2.574 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@@H](c3cccs3)C2)n(-c2ccccc2)n1 237981075 WHDQKEDZAYWWKZ-MRXNPFEDSA-N 383.429 2.846 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)N(C)Cc2nc3c(s2)CCCC3)c1 175616831 CIOCBBKVJFEWHU-UHFFFAOYSA-N 383.481 2.970 0 50 GFAA NC(=O)c1ccc(OCC(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)cc1 290833017 CUWMNYRBVXEPDB-LJQANCHMSA-N 395.503 2.583 0 50 GFAA COc1ccc(-n2ccc(C(=O)N[C@@H]3CCCN(CC(F)(F)F)C3)n2)cc1 288646787 QROWHMWFDBIULZ-CYBMUJFWSA-N 382.386 2.637 0 50 GFAA O=C(COc1ccccc1Cl)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 426490462 ONQKMOUSZAKROK-FQEVSTJZSA-N 376.884 2.970 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)no1 97602514 YJIVZWSVRZDQPU-INIZCTEOSA-N 383.408 2.750 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@H]2CCCN(CCc3ccc(F)cc3)C2)cn1 95501818 HFVWKPNQKNCEJD-QGZVFWFLSA-N 385.487 2.684 0 50 GFAA CSc1nc(N)cc(N2CCC[C@H](c3nccn3Cc3ccccn3)C2)n1 95531070 MDMGQWCVELYCQS-AWEZNQCLSA-N 381.509 2.805 0 50 GFAA O=C(O)[C@H]1C[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 299752933 WAUGDAWTEPVNME-RYUDHWBXSA-N 381.215 2.863 0 50 GFAA O=C(c1cccc2c1OCC2)N1CCc2[nH]nc(-c3ccc4c(c3)OCO4)c2C1 67850718 KXEJUOBKUSHQPK-UHFFFAOYSA-N 389.411 2.939 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3ccc4c(c3)OCC(=O)N4)cc2)CC1 823764804 HOPAKLSOTCODJR-UHFFFAOYSA-N 381.432 2.743 0 50 GFAA COc1ccccc1-c1cc(CNC(=O)N2CC(n3nc(C)cc3C)C2)on1 584886414 RZMADFQCBUQXIZ-UHFFFAOYSA-N 381.436 2.930 0 50 GFAA O=C(NCCCSCc1ccco1)N1CCC[C@@H](c2cc(O)ncn2)C1 670433927 PCYGENLMQMBWPW-CQSZACIVSA-N 376.482 2.988 0 50 GFAA Cc1ccccc1OC[C@@H](O)C(=O)N1CCN(c2nc3ccccc3s2)CC1 952983051 RGGQQLQNNALQGZ-QGZVFWFLSA-N 397.500 2.693 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2cccnc2)C3)n(C)n1 1565528589 FIQIGVFCKDHILE-QUCCMNQESA-N 381.524 2.750 0 50 GFAA Nc1nc(N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cc(-n2cccn2)n1 302512546 XNAJCACXOKWTLW-LBPRGKRZSA-N 389.385 2.954 0 50 GFAA CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccnc1C(F)(F)F 188135730 FWWPFIOCOMFYLT-LJQANCHMSA-N 393.409 2.809 0 50 GFAA COc1ccnc(N2CCC(CNC(=O)Cc3c(F)cccc3Cl)CC2)n1 1506417239 HJGYQFXDJCDCPM-UHFFFAOYSA-N 392.862 2.853 0 50 GFAA O=C(c1cnn(Cc2ccccc2)c1)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529158795 MEFYRMMSFVVEKK-NHCUHLMSSA-N 377.444 2.506 0 50 GFAA O=C1NCCN(C(=O)c2cc(O)cc(OCC3CC3)c2)[C@H]1c1cccc(F)c1 1772805439 KQSWTKRRENVTEQ-IBGZPJMESA-N 384.407 2.633 0 50 GFAA O=C(c1csc2ccccc12)N1C[C@@H]2CN(Cc3ccns3)C[C@@]2(CO)C1 1772813132 WWAXWHVJFFRERU-XOBRGWDASA-N 399.541 2.924 0 50 GFAA CCCn1c(C)c(CC(=O)N2CCC[C@H](C(N)=O)C2)c2c1CC(C)(C)CC2=O 12714919 YJQDIGKLYLJRBR-HNNXBMFYSA-N 387.524 2.628 0 50 GFAA CCOc1ccc2nc(N3CCC(C(=O)NC[C@@H]4CCCO4)CC3)nc(C)c2c1 14886448 SPZZMBSWBBSZPT-SFHVURJKSA-N 398.507 2.849 0 50 GFAA COCCn1c(=O)c(CN(C)Cc2cnn(C)c2)cc2cc3c(cc21)CCC3 14985744 HNWOQHVUMXUPCO-UHFFFAOYSA-N 380.492 2.502 0 50 GFAA C/C(=C\c1ccccc1)CN1CCc2nnc(CCNC(=O)C3CCC3)n2CC1 14993230 NOPJUSAUZFWFBD-FBMGVBCBSA-N 393.535 2.699 0 50 GFAA O=C(Cn1cc(C(=O)C(=O)N2CCCC2)c2ccccc21)NCc1cccs1 16527172 CNQNIYCMYCECOK-UHFFFAOYSA-N 395.484 2.824 0 50 GFAA CCN1CCN(C(=O)C[C@@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)CC1 1857667158 GNGYUUMPUUTTGF-INIZCTEOSA-N 386.496 2.607 0 50 GFAA O=C(c1ccc(OCc2ccccc2F)cc1)N1CC[C@@]23OCCN2C(=O)C[C@@H]13 1857740427 IOKMKZKYBJCDLH-KNQAVFIVSA-N 396.418 2.578 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCCc3c[nH]c4ccccc34)cn12 1875243723 UOSBYHBKYKJMTQ-IBGZPJMESA-N 377.448 2.873 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2cc(S(N)(=O)=O)ccc2F)C[C@H](C(C)C)O1 1875249261 NHQOFSPQKUTWCO-CXAGYDPISA-N 386.489 2.529 0 50 GFAA C[C@@]1(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCCN1C(=O)c1ccccc1 116632255 PFEDXFJQLSYEPG-KXBFYZLASA-N 397.441 2.682 0 50 GFAA CN(C)c1ncc(CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)n1C 265323401 JOPBSAHUSCUUCN-UHFFFAOYSA-N 377.374 2.969 0 50 GFAA CC(C)NC(=O)[C@@H](C)NC(=O)N=c1[nH]nc(-c2ccc(C(C)C)cc2)s1 1875266158 CKZYWXLETXWOGW-GFCCVEGCSA-N 375.498 2.785 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nc2ccccc2CN2CCNC2=O)cc1 1875373556 FTRXINLPUGLOET-UHFFFAOYSA-N 378.432 2.613 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@H]1c1ccc(OC)cc1OC 1022416 WYDBXTYNCYOSFQ-INIZCTEOSA-N 376.434 2.527 0 50 GFAA Cc1nc(N2CCNCC2)sc1C(=O)N[C@H](C)c1cccc(-n2cccn2)c1 2325768407 SEFHRNDQAVNSAF-CQSZACIVSA-N 396.520 2.538 0 50 GFAA Cc1c(CN[C@@H]2C[C@@H](Cn3cc(C(=O)O)cn3)C[C@H]2O)ccc2ccccc12 2325785645 HILKUZRQQFDMKK-IPHXSNPTSA-N 379.460 2.972 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2Cc3ccc(O)cc3[C@@H](C(=O)O)C2)cc1 2325851661 FWFSICGUOCWTFY-IBGZPJMESA-N 379.416 2.975 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC(=O)c2ccc3c(c2)CCC=C3)c(C)c1 2325870442 YIZVHDLIIONDAP-UHFFFAOYSA-N 385.441 2.860 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)nn1 755075 ATFKOCPYDSEOJR-UHFFFAOYSA-N 384.417 2.538 0 50 GFAA O=C(C[C@@H]1Sc2ccccc2NC1=O)Nc1ccc(N2CCOCC2)cc1 833988 KCUGCBSATGXGKB-SFHVURJKSA-N 383.473 2.965 0 50 GFAA COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)c1cccc(OC)c1 1108309 VFIOWXCLNVKZKO-UHFFFAOYSA-N 375.377 2.760 0 50 GFAA O=C1c2ccccc2C(=O)N1CCc1nc2ccccc2c(=O)n1-c1ccccn1 1211082 WVQMUNBZTGQICV-UHFFFAOYSA-N 396.406 2.619 0 50 GFAA CN(C)c1ccc(-c2ccnc(N3CCN4[C@@H](C5CC5)COC[C@H]4C3)n2)cc1 2356135380 BPFYQUWIGLEIGM-TZIWHRDSSA-N 379.508 2.509 0 50 GFAA CCOc1cc(CNCc2ccco2)cc(Br)c1OCC(N)=O 4841931 XHUWMSRIVVTOTK-UHFFFAOYSA-N 383.242 2.595 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2nnnn2-c2cccc(C(F)(F)F)c2)cc1 6760274 HIZMZNCIJKXGIJ-UHFFFAOYSA-N 382.367 2.963 0 50 GFAA O=C(CCn1nc2ccccn2c1=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 225359661 FLSLIQQKXVUISL-YJBOKZPZSA-N 377.448 2.514 0 50 GFAA O=C1CC[C@@H](C(=O)N2CCN(Cc3cccnc3)CC2)CN1CC1CCCCC1 20774858 DSSQJSMZDCVTAK-OAQYLSRUSA-N 398.551 2.545 0 50 GFAA O=C(NCCO)c1ccc([C@H]2CCCN2Cc2ccc3nsnc3c2)s1 20860132 LIDVVYMOBCBVFB-OAHLLOKOSA-N 388.518 2.812 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@]1(O)CNCc1cc2ccccc2[nH]1 67433430 WSAGCBKBBBMURM-QHCPKHFHSA-N 377.488 2.854 0 50 GFAA Cc1cc(C)n([C@H]2CCN(Cc3cccn3S(=O)(=O)c3ccccc3)C2)n1 67712618 XZOFTAXUTXZMQE-IBGZPJMESA-N 384.505 2.985 0 50 GFAA Cc1cccc(-c2noc(CN(C)C(=O)C(=O)Nc3cc(F)cc(F)c3)n2)c1 65406464 QYGSWSUNUDLBHJ-UHFFFAOYSA-N 386.358 2.920 0 50 GFAA COc1ccc(NC(=O)CCN2CCN(c3ncnc4ccsc34)CC2)cc1 124392805 RMMFARIWPUUQFS-UHFFFAOYSA-N 397.504 2.851 0 50 GFAA CC1(C)[C@H](NC(=O)C(=O)Nc2ccccc2N2CCCCCC2)[C@H]2CCO[C@H]21 230217635 JJDDNUKJIZUXGE-ATZDWAIDSA-N 385.508 2.935 0 50 GFAA Cc1ccc(CN(C)C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)nc1 252483007 DSFRROZDIOSOIX-UHFFFAOYSA-N 386.427 2.665 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc3c(c2)OCCO3)c1 71764259 MZLZZTIOPQFFKN-UHFFFAOYSA-N 377.418 2.510 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CN[C@H](C(=N)O)c2ccc(F)cc2)CC(=O)N1C 328620095 GQXLZDFYQLOMBO-ZOCIIQOWSA-N 387.459 2.562 0 50 GFAA Cc1ccc([C@H]2OC[C@@H]3O[C@@H](c4ccc(C)cc4)O[C@H]([C@H](O)CO)[C@@H]3O2)cc1 38189450 LQAFKEDMOAMGAK-BGJURXJTSA-N 386.444 2.553 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cc(-c3ccncc3)n[nH]2)CCC(=O)N1CC1CC1 71589575 VIYMHAZUVUZJDB-LJQANCHMSA-N 381.480 2.581 0 50 GFAA COC(C)(C)CNC(=O)[C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 71422316 SPZLSLYGMRCIES-FQEVSTJZSA-N 387.568 2.904 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)o1 364257745 SJYFDJXYLZROCI-UHFFFAOYSA-N 382.388 2.525 0 50 GFAA Cc1ccc2[nH]c(C(=O)N[C@@H]3CCOC[C@H]3Oc3ccc(CO)cc3)cc2c1 218804079 DVNQDEHKVURZJO-TZIWHRDSSA-N 380.444 2.935 0 50 GFAA O=C(NCc1nc(-c2cccc(Cl)c2)no1)c1ccc(-n2ccnc2)nc1 363356167 OJJBZVXNNSLUGD-UHFFFAOYSA-N 380.795 2.901 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)Nc3cc(-c4cccnc4)n[nH]3)cc2C[C@H]1C 131341110 MBRIZQQNLUGGJO-GFCCVEGCSA-N 397.460 2.570 0 50 GFAA CNC(=O)[C@H]1CN(C(=O)NCC2(c3cccc(Cl)c3)CCCCC2)CCO1 455376780 DAIHAXJMEYMWFM-QGZVFWFLSA-N 393.915 2.698 0 50 GFAA COc1ccc(OC)c([C@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)c1 77422898 BBEKKBOOJHSZEM-INIZCTEOSA-N 378.432 2.914 0 50 GFAA O=C(O)CCN(C(=O)c1csc(Cc2ccccc2F)n1)C1CCOCC1 238080527 FQKIXWQBBRACJN-UHFFFAOYSA-N 392.452 2.969 0 50 GFAA Cc1ccc(-c2cnc(CCC(=O)N3CCN(c4cnn(C)c4)CC3)o2)cc1 173681784 QZIUWGWWRSQNSF-UHFFFAOYSA-N 379.464 2.665 0 50 GFAA C[C@H](NS(=O)(=O)c1cccc2cnccc12)C1(N2CCOCC2)CCCC1 178132486 ITYZBLUKSNEZOF-INIZCTEOSA-N 389.521 2.547 0 50 GFAA Cc1c(C(=O)N2CC[C@H](n3cc(Cl)cn3)C2)nnn1Cc1ccc(F)cc1 290730755 NZESILUMCRVRHR-INIZCTEOSA-N 388.834 2.711 0 50 GFAA COc1cccc(NC(=O)N2CCCN(C(=O)[C@@H]3CCCO3)CC2)c1Cl 96148736 WWUPYFXRRYBINZ-HNNXBMFYSA-N 381.860 2.594 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3cccc(Cn4cccn4)c3)C[C@@H]2N)cc1 91574892 YLUFABFIUGKTDW-RTWAWAEBSA-N 376.460 2.507 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@H](C(=O)O)c3ccccc3)cc2)C[C@@H](C)O1 237628587 HGGONKLSTKVCMH-YRNRMSPPSA-N 382.460 2.852 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(F)c(C)c1)CC2 95510686 GZYUJWXGZBDFDA-UHFFFAOYSA-N 384.455 2.783 0 50 GFAA Cc1ccccc1CSCCNC(=O)[C@H](c1cccnc1)N1CCOCC1 95384639 FSGJCWNDXOMTIN-FQEVSTJZSA-N 385.533 2.813 0 50 GFAA Cc1nc2cc(C(=O)N3CCC[C@@H](c4nccn4CCN(C)C)C3)ccc2[nH]1 95530600 GETKRENWWGXDHV-QGZVFWFLSA-N 380.496 2.649 0 50 GFAA Cn1c(Cn2cccn2)nnc1[C@H]1C[C@H](NC(=O)c2scc3c2CCCC3)C1 252537356 KZASWVAWRMMPHY-SHTZXODSSA-N 396.520 2.676 0 50 GFAA CC[C@H](C)Oc1cccc(CNC(=O)N2CCN(C(=O)c3ccc[nH]3)CC2)c1 534589006 MPPNDNZVYHVXCK-INIZCTEOSA-N 384.480 2.860 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1CCC2(CC1)CN(C[C@@H]1CCOC1)CCO2 828171145 LKWHSKLNWOCJGE-KRWDZBQOSA-N 383.492 2.511 0 50 GFAA COc1cc(C(=O)NCCn2c(C)cc(C)nc2=O)c(Cl)cc1OC(C)C 824539659 BJDPPGXDKGAVJE-UHFFFAOYSA-N 393.871 2.739 0 50 GFAA O=C(Nc1nncs1)c1ccc(N2CC[C@@H](Oc3cccc(F)c3)C2)nc1 302140800 JIOGLYDADRPSPY-OAHLLOKOSA-N 385.424 2.982 0 50 GFAA CC[C@@H](C(=O)N1CCC(NC(=O)c2ccc3nc[nH]c3n2)CC1)c1ccccc1 271244841 BUPXLODVBSBWSD-QGZVFWFLSA-N 391.475 2.873 0 50 GFAA Cc1c(NC(=O)N(C)[C@H]2CCS(=O)(=O)C2)cccc1OCC(F)(F)F 170620798 CBNALQDOCSPJDN-NSHDSACASA-N 380.388 2.587 0 50 GFAA CCOc1ccc(OCC(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 170601428 MENYCGLKMOSKRU-QHCPKHFHSA-N 398.503 2.560 0 50 GFAA COc1c(C)cc([C@H](C(=O)O)N2CCN(C(=O)c3cccs3)CC2)cc1C 1506423829 XBQXHLGJJJEPNY-QGZVFWFLSA-N 388.489 2.957 0 50 GFAA COc1cccc(CN(C)C(=O)[C@H]2OCC(=O)N[C@@H]2c2ccccc2Cl)c1 1529168416 CHQAOLCMTJBYPQ-MOPGFXCFSA-N 388.851 2.563 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCO[C@@H](C3CC3)C2)ccc1F 1704333669 CJUBMTIDEMQJKV-MRXNPFEDSA-N 389.427 2.806 0 50 GFAA O=C(O)[C@H]1CN(C(=O)COc2ccc(Cl)cc2Cl)CC12CCOCC2 1800410319 PJLIPYMORWODCS-GFCCVEGCSA-N 388.247 2.712 0 50 GFAA COc1cc(-c2onc(NCCN3CCCCC3=O)c2C(=O)O)ccc1F 1704312189 MXIBPSXEICRUPI-UHFFFAOYSA-N 377.372 2.612 0 50 GFAA Cc1ccccc1-n1ncc([C@H](C)NC(=O)c2ccc3c(c2)no[n+]3[O-])c1C 11816989 HJAKAVYZWSMLDT-ZDUSSCGKSA-N 377.404 2.755 0 50 GFAA Cc1cc(C)nc(CCNCc2ccccc2OC[C@@H](O)CN2CCCCC2)n1 11933125 MGPISHDIVLMNNS-NRFANRHFSA-N 398.551 2.651 0 50 GFAA COc1cccc(CN2C[C@H](C(=O)N(C)CCC3CCOCC3)CCC2=O)c1 12438711 OFWHTUTVTAXRFZ-LJQANCHMSA-N 388.508 2.709 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)CC4CC4)C3)C2=O)c1OC 12456817 DEMWKBUZZBINSI-QFIPXVFZSA-N 386.492 2.845 0 50 GFAA COCCCNc1ncnc2sc(C(=O)NCCc3ccncc3)c(C)c12 12571756 NPOHVGAGJKTUEK-UHFFFAOYSA-N 385.493 2.816 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@H](NCCOC(C)C)C2 14731446 CUZMNPONZODXDN-INIZCTEOSA-N 388.512 2.640 0 50 GFAA CC[C@@H](C)N1CCC2(CC1)C(=O)N(CCc1ccccc1)C(=O)N2CCOC 14745631 NSBQDZHGMNDMDF-GOSISDBHSA-N 387.524 2.773 0 50 GFAA CC1CCN(C(=O)c2cn(Cc3ccccc3)cc(C(=O)NC(C)C)c2=O)CC1 14999368 AXYBVNKAGVVQFC-UHFFFAOYSA-N 395.503 2.907 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(c3nc(N(C)C)nc4c3CCCC4)C1)CC2 1857674126 SBWMRYHADSUOJM-QFIPXVFZSA-N 394.523 2.710 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)Cc3cccnc3)C1)CC2 1857683561 JOCGHGCBBZQBAW-JOCHJYFZSA-N 380.492 2.924 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ccn(C(C)(C)C)c3)C1)CC2 1857705966 DAZAGUKCSPPEHR-JOCHJYFZSA-N 397.523 2.925 0 50 GFAA O=C(COCc1ccccc1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857711868 OMFCXFGAGRAXFJ-MZKRTTBSSA-N 392.455 2.504 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857730311 QLDOLINKMSOFIS-JQVVWYNYSA-N 395.459 2.525 0 50 GFAA O=C(NCc1ccc2nc[nH]c2c1)[C@@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857735898 VMZXCDKOMADZLW-CYBMUJFWSA-N 391.456 2.842 0 50 GFAA CC(C)(C(=O)N1CCCN(c2ccccc2Cl)CC1)S(=O)(=O)C1CC1 329464198 UMJWEZKNWIIIKB-UHFFFAOYSA-N 384.929 2.735 0 50 GFAA C[C@H](c1nccs1)N1CCN(C(=O)c2csc(-c3cnn(C)c3)n2)CC1 329689532 CPRZTKFFGWSQIM-GFCCVEGCSA-N 388.522 2.519 0 50 GFAA COc1cc(C(=O)N2CCC[C@H](C(=O)O)C2)ccc1OCc1cscn1 262370557 ASIXWCVSZPOFRL-ZDUSSCGKSA-N 376.434 2.668 0 50 GFAA Cc1cccc(CC(=O)N2C[C@@H](C(=O)O)C[C@H](c3cnn(C)c3)C2)c1Cl 868457652 ZVTGYBJDRMBQGV-GJZGRUSLSA-N 375.856 2.641 0 50 GFAA COC(=O)C[C@H]1CN(C(=O)c2cc(O)cc(C(F)(F)F)c2)C2(CCC2)CO1 1875298883 QSUXJODEEWHPQS-AWEZNQCLSA-N 387.354 2.738 0 50 GFAA O=C(O)CCc1ccc(C(=O)NC2CCN(c3nc4ccccc4[nH]3)CC2)cc1 1875286138 HABDXMRAIMCDPJ-UHFFFAOYSA-N 392.459 2.979 0 50 GFAA CC(=O)N[C@H](Cc1ccc2c(c1)OCO2)C(=O)N[C@H]1C[C@H](c2ccccc2C)C1 1875252066 DBVKWZHKPGFHRC-QWFCFKBJSA-N 394.471 2.833 0 50 GFAA Cc1csc(N2CCC[C@H](C(=O)N3C[C@H]4C[C@H]3C[C@]4(O)C(F)(F)F)C2)n1 1875392126 BXKSSDCHWDZOOW-RSUWNVLCSA-N 389.443 2.582 0 50 GFAA CSCc1n[nH]c(CNC(=O)N2CCC[C@@H](c3cc(O)cc(F)c3)C2)n1 1875301752 SJSPYXPBYRBOGG-LLVKDONJSA-N 379.461 2.602 0 50 GFAA COCC(=O)N1CCN(C(=O)c2cc(C)cc(Cl)c2)CCC12CCOCC2 1775962903 UIITWKFCLHUMGY-UHFFFAOYSA-N 394.899 2.519 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N2CCc3ccccc3CC2)CC1=O 2100482520 FQAOTMGHCZQDAN-HXUWFJFHSA-N 378.472 2.671 0 50 GFAA COC(=O)c1nc(N2CCN(c3cccc4nc[nH]c34)CC2)c2sccc2n1 2325802755 ZPQVHICERMCTBZ-UHFFFAOYSA-N 394.460 2.681 0 50 GFAA COc1cccc(CNC(=O)C(=O)NCc2noc(-c3ccccc3)c2C)c1F 2325819074 QJNXGXOVZQZLPX-UHFFFAOYSA-N 397.406 2.730 0 50 GFAA C[C@H](NC(=O)c1cnc(CN)nc1C(F)(F)F)c1cccc2cccnc12 2325856966 KJFWRIRFDOJMEQ-JTQLQIEISA-N 375.354 2.993 0 50 GFAA CC(C)n1c(CCNC(=O)c2cccc3c2OCC(=O)N3)nc2ccccc21 136475966 WFOOIBDDHTVDSR-UHFFFAOYSA-N 378.432 2.921 0 50 GFAA CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1-c1ccncc1 779254 INEJPJSIXCHDMP-UHFFFAOYSA-N 383.433 2.820 0 50 GFAA COc1ccc(-c2onc(N[C@H]3CCCOC34CCNCC4)c2C(=O)O)cc1 2356136426 UNJXTSVJFIESOO-HNNXBMFYSA-N 387.436 2.762 0 50 GFAA COc1cc(-c2o[nH]c(=NCCCc3csc(=N)[nH]3)c2C(=O)O)ccc1F 2356141896 UZKKCZQRCRMDMT-UHFFFAOYSA-N 392.412 2.523 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356148819 URYIMXFXBRBTMH-JOCHJYFZSA-N 389.459 2.527 0 50 GFAA COc1ccc(-c2onc(N3CCN(c4ccncc4)CC3)c2C(=O)O)cc1 2356155295 AZPGQTQRQBZAAA-UHFFFAOYSA-N 380.404 2.770 0 50 GFAA CS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2cccc(C(F)(F)F)c2)n1 3216775 WCJLTNSLLQJDSU-UHFFFAOYSA-N 379.747 2.805 0 50 GFAA CN(C(=O)CCc1nc(-c2ccco2)no1)[C@H]1CCN(c2ccccc2F)C1=O 112328157 AULFDRQBSDLHKN-HNNXBMFYSA-N 398.394 2.665 0 50 GFAA CNC(=O)CCC(=O)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67514991 IUENGNCUZAGKSO-UHFFFAOYSA-N 388.851 2.960 0 50 GFAA C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 252457446 JXINXUFLHOSMLE-LERXQTSPSA-N 382.338 2.863 0 50 GFAA O=C(N[C@@H]1CCn2ccnc2C1)c1cc(-c2ccc(Br)cc2)[nH]n1 427994320 GZYYYAARIGCJPU-CYBMUJFWSA-N 386.253 2.781 0 50 GFAA COC(=O)[C@@H](CNC(=O)C(C)(C)c1ccc(F)cc1)Oc1ccc(F)cc1 129351995 CYDGQGKWOAPFMK-QGZVFWFLSA-N 377.387 2.979 0 50 GFAA Cc1cc(C(=O)Nc2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc(C)c1OC(F)F 124135988 XAFGHRDZAXHWFG-UHFFFAOYSA-N 375.331 2.687 0 50 GFAA CC(C)[C@](C)(O)CNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363421885 FCVYAKQJKZJYKS-PGRDOPGGSA-N 384.476 2.673 0 50 GFAA Cc1nc(CN2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cs1 71575657 AFMWDYDVDSUBBE-KRWDZBQOSA-N 376.570 2.750 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CC=C(c2ccc(O)cc2)CC1 363207611 HLHIEHOGDDNGBR-UHFFFAOYSA-N 375.432 2.972 0 50 GFAA CCOC(=O)c1ccsc1NC(=O)CN1CCOC[C@H]1c1nc(C)cs1 375828960 DPOXVYDZUBLIPH-ZDUSSCGKSA-N 395.506 2.702 0 50 GFAA CCc1noc(C)c1C(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1 486391942 ZKUOEABZFBRZJX-INIZCTEOSA-N 385.420 2.877 0 50 GFAA O=C(CN1CCCn2nc([C@H](O)c3ccccc3)cc2C1)N1CCCCCC1 219997809 JZSQWQMLKDTZHP-JOCHJYFZSA-N 382.508 2.573 0 50 GFAA COc1ccc(OC)c(-c2cc(C(=O)NC[C@]3(O)CCc4ccccc43)no2)c1 158733456 ZCTSQZCNPNBHSQ-JOCHJYFZSA-N 394.427 2.923 0 50 GFAA CCCN(C)C[C@H]1CCN(C(=O)c2nnn(-c3cccc4cnccc34)c2C)C1 173809954 YILBXSBKYUQHJB-QGZVFWFLSA-N 392.507 2.928 0 50 GFAA O=C(NC[C@H]1CCCCN1C(=O)c1cc2ccccc2[nH]c1=O)c1ccccc1 174592902 UUQHPQFOSCBICZ-GOSISDBHSA-N 389.455 2.953 0 50 GFAA CC(C)N(C)C(=O)CN1CC[C@@]2(CCCN(CCCc3ccccc3)C2=O)C1 426649767 VLNPJXPNCKCENC-QHCPKHFHSA-N 385.552 2.801 0 50 GFAA CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)Nc1cc(F)c2c(c1)NC(=O)CO2 426477862 GUUPEMCVACWIBN-UHFFFAOYSA-N 375.404 2.841 0 50 GFAA C[C@H](c1ccccc1)n1nccc1NC(=O)N1CCN(c2cnccn2)CC1 95505851 JVFHRUFIJPSPMR-MRXNPFEDSA-N 377.452 2.637 0 50 GFAA CCOc1ccccc1CN1CCN(C2CSCCSC2)C[C@@H]1CCO 95519029 AWTBZQJRNNHZRM-SFHVURJKSA-N 396.622 2.803 0 50 GFAA O=S(=O)(c1cccnc1)N1C[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2 91770202 VYKZBFCWOJYSQT-VQTJNVASSA-N 385.533 2.799 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(Cc4cccc(C)n4)C3)CCC2=O)cn1 91468775 YKYVAQJUJFWELP-QFIPXVFZSA-N 379.508 2.893 0 50 GFAA CCc1c(C)sc2ncnc(-c3cccc(C(=O)N4CCNC(=O)C4)c3)c12 534635625 DHXVGQBUFCTTOE-UHFFFAOYSA-N 380.473 2.801 0 50 GFAA CC(=O)NC[C@H]1CCC2(CCN(Cc3cc(CN4CCCC4)cs3)CC2)O1 299767583 LWYYIHGCWHZJDZ-LJQANCHMSA-N 391.581 2.994 0 50 GFAA CCc1cc(CN2CCC(CNC(=O)Cc3sc(C)nc3C)CC2)on1 823565724 YHWNKQBAKUVMBV-UHFFFAOYSA-N 376.526 2.881 0 50 GFAA CCN(Cc1nc(C(C)C)no1)S(=O)(=O)c1ccc2c(c1)OCCCO2 823086414 MBPROJNZPNVBIL-UHFFFAOYSA-N 381.454 2.565 0 50 GFAA CCCCc1nc2ccccc2n1[C@H](C)C(=O)N(CCO)Cc1nccn1C 952983977 YIWCFEMWYUPNQK-MRXNPFEDSA-N 383.496 2.695 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)c1ccccc1N1CCOCC1)OCCO2 952989469 RDGLZZVSDBKTBM-UHFFFAOYSA-N 382.416 2.749 0 50 GFAA C[C@H](C(=O)NCCC(=O)Nc1ccc(F)cc1)c1nnc(O)c2ccccc12 952988786 SGEBBHASGKZDHM-LBPRGKRZSA-N 382.395 2.723 0 50 GFAA COCCn1cnnc1CNC(=O)Nc1cc(C(F)(F)F)ccc1Cl 952990267 HPDJCEFOJFQEPW-UHFFFAOYSA-N 377.754 2.918 0 50 GFAA O=S(=O)(c1ccc(OC2CCOCC2)c(F)c1)N(CC(F)F)C1CC1 186930595 WCIYSKHPYRSAKZ-UHFFFAOYSA-N 379.400 2.802 0 50 GFAA CCc1ccc(S(=O)(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3CC2CCC2)cc1 216886090 BOVCKGKSWSRTKL-MSOLQXFVSA-N 376.522 2.661 0 50 GFAA Cc1cc(C(=O)N2CCCN(Cc3c[nH]nc3-c3cccc(F)c3)CC2)no1 1775981626 HERVPCLLJOENJI-UHFFFAOYSA-N 383.427 2.860 0 50 GFAA CC(C)N(Cc1nccn1C)c1nc2nonc2nc1NCc1cccs1 11664198 WRNYLXUGMFBIIZ-UHFFFAOYSA-N 384.469 2.835 0 50 GFAA COc1cccc(OC)c1CNC[C@H]1C[C@@H](CO)N(C)[C@H]1c1ccccc1F 11842979 HCRKDVZNWXNIGO-ZMPRRUGASA-N 388.483 2.986 0 50 GFAA CCC(=O)NCCc1nnc(SC[C@@H]2CCCO2)n1-c1ccccc1F 12151876 SYGNORHMOKWFSL-ZDUSSCGKSA-N 378.473 2.746 0 50 GFAA COc1cc(CNCc2ccc(C)o2)ccc1OC[C@H](O)CN(C)C(C)C 12203372 ZDISCHVDDPEXOT-GOSISDBHSA-N 376.497 2.966 0 50 GFAA O=C([C@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1)N1CCCC1 12577287 SLIWDDHRLAWZQG-NRFANRHFSA-N 381.564 2.953 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)[C@H](C)n3cncn3)CC2)c1 12583509 BUSJCNSNVCRXBZ-HNNXBMFYSA-N 385.468 2.505 0 50 GFAA COCCn1nc2c(c1C(=O)N(C)Cc1nccn1C(C)C)C[C@@H](C)O[C@H]2C 1857528292 STDCDVIVFNXMCG-CABCVRRESA-N 389.500 2.601 0 50 GFAA Cc1cc(CC(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cc(C)n1 1857666767 SQIAGHCLVNRTSY-QFIPXVFZSA-N 379.460 2.517 0 50 GFAA Cc1cccc2nc(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3ccccc3)cn12 1857716348 HUDHWVNTUJQZNP-FPOVZHCZSA-N 378.476 2.787 0 50 GFAA O=C(C1Cc2ccccc2C1)N1CC[C@@]23O[C@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857717441 SPAZGUYPVMDYRE-IMSXRSKXSA-N 388.467 2.702 0 50 GFAA CC(=O)NC[C@H]1[C@H]2CN(Cc3cnc(-c4ccccc4)s3)C[C@]23CC[C@H]1O3 1857722032 CSHBDSBPVFPGOO-QEUVDIPISA-N 383.517 2.926 0 50 GFAA Cc1ccncc1C(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3)C[C@]23CC[C@H]1O3 1857731030 ICRFXDWHKFVTTM-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA CN(C)c1ccc(C(=O)N2CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1857734143 LMLVTFVKANELMS-MZKRTTBSSA-N 391.471 2.667 0 50 GFAA CCNC(=O)N1C[C@@H]2[C@H](CNC(=O)c3cccc(C(C)C)c3)[C@H]3CC[C@]2(C1)O3 1857736331 PGGIBRIMTKAOHK-JZJXAQOMSA-N 385.508 2.749 0 50 GFAA COc1ccccc1Cc1nc([C@H]2CC[C@@H](O)[C@H](N)C2)n(-c2ccc(F)cc2)n1 1857738482 JZISSOOWFRJDHW-KFKAGJAMSA-N 396.466 2.962 0 50 GFAA COCCn1nnc([C@@H]2CN(Cc3ccccc3-c3ccccc3)CCO2)n1 1875249318 SQCPLWHKKCGPKY-FQEVSTJZSA-N 379.464 2.560 0 50 GFAA COC[C@@H]1CCCN1Cc1cccc(-c2nc(C3CCNCC3)cc(=O)[nH]2)c1 23146135 HFRBLJVDJPAUCA-IBGZPJMESA-N 382.508 2.515 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CC[C@@H](CN2CCOCC2)C1)c1ccccc1 266273868 YHMVPOKFSOUMPX-SFHVURJKSA-N 393.487 2.733 0 50 GFAA COCCCOCC(=O)N1CC(C)(C)[C@@H]1c1nccn1-c1cccc(F)c1 952891215 XXVMKFJATXPQQP-SFHVURJKSA-N 375.444 2.974 0 50 GFAA Ic1cc(-c2noc([C@H]3CCc4nn[nH]c4C3)n2)cs1 952892565 DXIJVXDOSXEWHO-LURJTMIESA-N 399.217 2.793 0 50 GFAA O=C([C@H]1CCN(C[C@H]2CCCc3ccccc32)C1)N1CCc2c(O)ncnc2C1 1875261818 KGRBSTPDFGOMMD-MSOLQXFVSA-N 392.503 2.509 0 50 GFAA COC[C@@]1(O)CCOC[C@H]1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 1875278516 GPDZFWKPFGMBCV-GGAORHGYSA-N 394.471 2.586 0 50 GFAA CN1CCc2nc(O)c(CNC(=O)N3CC4(CCC4)[C@H]3c3ccncc3)cc2C1 1875295452 YMNGYZYRQPMTEI-LJQANCHMSA-N 393.491 2.607 0 50 GFAA O=C1Cc2cc(CCCC(=O)N3CC[C@@](CO)(Cc4ccccc4)C3)ccc2N1 1875308317 ZSBUBFCHSNIMAF-XMMPIXPASA-N 392.499 2.958 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N[C@]23CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1 1875373629 IPZXNADLKSJOIA-AOMKIAJQSA-N 399.491 2.965 0 50 GFAA O=C(c1cccc(O)n1)N1CCC2(CC1)C[C@@H](O)c1nn(C3CCCC3)cc1O2 1875394828 YFDLLPZKVXAZHA-MRXNPFEDSA-N 398.463 2.590 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N1CC[C@@H](CCC(=O)O)C1 1875300595 JTXFODDENAIWMU-ZWNOBZJWSA-N 375.391 2.879 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnc(C2CC2)[nH]1 1875403192 RJJBRHBIHFYIBK-LSBZLQRGSA-N 391.475 2.720 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2cccnc2)C[C@H]1NC1Cc2ccccc2C1 2100540065 BTQSKIYXJOJODX-KSEOMHKRSA-N 379.504 2.639 0 50 GFAA CC(C)n1cc(-c2cn(C3(c4ccc(Br)cc4)CNC3)nn2)cn1 2325787402 ZCWZVAOZLBPOIL-UHFFFAOYSA-N 387.285 2.832 0 50 GFAA CC[C@@]1(C)C[C@H]1C(=O)N1CCN(CCNC(=O)C23CC(C(C)(C)C)(C2)C3)CC1 2325793795 IAVWTKZLWRQIMZ-FNCUHFQMSA-N 389.584 2.899 0 50 GFAA O=C(C[C@@H]1CC1(Cl)Cl)NC[C@@H]1C[C@H](F)CN1C(=O)[C@H]1CC=CCC1 2325823036 CKATZHZMZYLFBI-CRWXNKLISA-N 377.287 2.982 0 50 GFAA CCOc1ccc(N([C@@H](C)C(=O)Nc2ccccc2OC)S(C)(=O)=O)cc1 1137839 YQDVGMRGOKUUFF-AWEZNQCLSA-N 392.477 2.887 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2C)cc1 2997641 LQPUANPDHDTIDD-UHFFFAOYSA-N 382.869 2.964 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cc1 2356168563 IWRDOALYWCMFNL-UHFFFAOYSA-N 389.459 2.900 0 50 GFAA CCN(CC)C(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccccc1 4996220 CMYNSYAZNDKQHV-UHFFFAOYSA-N 376.478 2.759 0 50 GFAA Cc1ccccc1CN(c1c(C)n(C)n(-c2ccccc2)c1=O)S(C)(=O)=O 8041580 DJVAEQOMQIIICB-UHFFFAOYSA-N 385.489 2.759 0 50 GFAA C[C@@H]1c2ccccc2CCN1C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 171507157 QKOQTMDCACBKOU-MRXNPFEDSA-N 399.516 2.628 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)NCc2nc(C)c3c(n2)CCCC3)cc1 55154823 XXYNOPFCYPJJBI-UHFFFAOYSA-N 382.464 2.708 0 50 GFAA CC[C@@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)n1cnc2ccccc2c1=O 9422323 LHIXGWFCQBZJMZ-FQEVSTJZSA-N 394.450 2.836 0 50 GFAA C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@@H]1CCN1CCCC1=O 20861173 CRWJBJOYWYRKSA-JKSUJKDBSA-N 388.464 2.576 0 50 GFAA OCC[C@@H]1CN(Cc2cccn2-c2ccccn2)CCN1CCc1ccccc1 22913298 AXBDCKZDHSAWQZ-JOCHJYFZSA-N 390.531 2.984 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)NC[C@@H](O)c2cccc(C)c2)C1 119226886 HURYVJHBZFYOCF-YLJYHZDGSA-N 383.492 2.863 0 50 GFAA COC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1 229890494 VAJSNIUHAUKOTE-SOUVJXGZSA-N 393.459 2.856 0 50 GFAA Cc1cc(=O)c(O)c([C@H](CC(N)=O)c2ccc(-c3cccc(C(=O)O)c3)o2)o1 217609382 ZSCVQSSIQMVMLU-CYBMUJFWSA-N 383.356 2.619 0 50 GFAA biogenic C[C@H](Oc1ccccc1)C(=O)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 72438148 WVBPYUGUGQQWMB-SFHVURJKSA-N 395.507 2.583 0 50 GFAA COc1ccc([C@@H]2N=C(O)N(c3cc(C(=O)N(C)C)ccc3C)C2=O)c(OC)c1 328595212 OFAOGVAYKAXDFW-SFHVURJKSA-N 397.431 2.716 0 50 GFAA OC1=NC2(CCC(NC[C@@H]3CCc4nc(C(F)(F)F)cn4C3)CC2)C(O)=N1 328633253 LXVXTRADUHGCCN-SGWRBKMISA-N 385.390 2.619 0 50 GFAA Cc1cc(C)c2nccc(N3CC[C@@H](NC(=O)c4ccccn4)[C@H](O)C3)c2c1 77419048 JSWQOBBPBWBVPN-YLJYHZDGSA-N 376.460 2.616 0 50 GFAA Cc1nc([C@@H]2CCCOC2)sc1C(=O)Nc1cccc(NS(C)(=O)=O)c1 368314785 GYIGLZKBYVFWHD-GFCCVEGCSA-N 395.506 2.969 0 50 GFAA CN1CCOc2cc(C(=O)N3CCC4(CC3)C(=O)Nc3ccccc34)ccc21 72163729 ZQJQMNPEOYTJSH-UHFFFAOYSA-N 377.444 2.641 0 50 GFAA Cn1ncnc1[C@H]1COCCN1c1nc(C(F)(F)F)c(Br)s1 333499195 HOGUNNGGIRHOCF-ZCFIWIBFSA-N 398.208 2.631 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 262493613 XADAODQYMITSKY-KRWDZBQOSA-N 387.457 2.597 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)nnn1C1CCNCC1 237741003 LZJUGJNCVAOSGW-HNNXBMFYSA-N 394.479 2.672 0 50 GFAA O=C(Nc1cccc(CNC(=O)N2CCn3cncc3C2)c1)c1ccc(F)cc1 378112738 OSEGUJSGOCTJDL-UHFFFAOYSA-N 393.422 3.000 0 50 GFAA CCS(=O)(=O)CCNC(=O)c1cccc(-c2cc(F)ccc2C(C)=O)c1 426486079 VDFREZXBXFPWMQ-UHFFFAOYSA-N 377.437 2.860 0 50 GFAA C[C@H](C1CCN(C(=O)c2ccc(OC(F)F)cc2)CC1)N1CCN(C)CC1 82120209 KHYNLXUFNCYRHH-OAHLLOKOSA-N 381.467 2.776 0 50 GFAA O=C(c1c(F)cccc1Cl)N1CCN(c2ccnc(N3CCCC3)n2)CC1 82230619 DYCSPGQUUJCSPF-UHFFFAOYSA-N 389.862 2.832 0 50 GFAA CNc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)ccn1 91444823 APRBSOUIYDCUBP-UHFFFAOYSA-N 393.491 2.563 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)c1c(F)ccc(C)c1F)CC2 91594157 YTUXVDNMSLVWLP-UHFFFAOYSA-N 380.435 2.764 0 50 GFAA O=C(CCn1c(CO)nc2ccccc21)NC[C@H]1CCOc2ccccc2C1 97766572 LABDZNAPOUXHJS-INIZCTEOSA-N 379.460 2.676 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N[C@@H]4CCN(C)C4)cc3o2)cc1OC 95526695 MSKXULFTVLEWFK-MRXNPFEDSA-N 395.459 2.870 0 50 GFAA COc1ccc(NC(=O)NCC2(Cn3ccnc3C)CC2)cc1C(=O)N(C)C 97436985 WVIDQTPLJVPMRK-UHFFFAOYSA-N 385.468 2.504 0 50 GFAA C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCO1 245333763 ANBKWOVLQRFZTG-JQHSSLGASA-N 392.496 2.780 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[S@@](=O)C[C@@H](C)C3)cc2F)n1 297640764 IJPGVXMQPYKFGG-GWQKEKGPSA-N 378.473 2.861 0 50 GFAA Cc1nccn1CCNC(=O)CC[C@@H]1N=C(O)N(c2ccc(C(C)C)cc2)C1=O 252489127 JGIRECKCPJINCX-SFHVURJKSA-N 397.479 2.541 0 50 GFAA CC(C)Oc1cc(-c2ccc(C(=O)N[C@@H](C)Cn3cccn3)cc2)nc(N)n1 534587519 RUFWZCJPQCVJCG-AWEZNQCLSA-N 380.452 2.528 0 50 GFAA O=C(NC[C@@]1(O)CCNC1)c1cccc(-c2cccc(OC(F)(F)F)c2)c1 299770368 QMTHDPZPVRWEAY-GOSISDBHSA-N 380.366 2.706 0 50 GFAA Cc1cccc(-c2ncc(CN3CCC[C@@H](C(=O)N4CCOCC4)C3)cn2)c1 670441984 AOCUKKVVCOMZJF-HXUWFJFHSA-N 380.492 2.523 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(O)nn3)n2C[C@@H]2CCCO2)[C@H]2CCCC[C@@H]12 1344667777 PYCNUCCPLRHEFC-AESZEHBQSA-N 384.484 2.635 0 50 GFAA CC[C@@]1(C)NC(=O)N(NC(=O)[C@@H](C)Sc2nc3ccccc3s2)C1=O 278629044 GIAXHKDCTLPHBD-JDNHERCYSA-N 378.479 2.529 0 50 GFAA O=C(NCc1nc(-c2cccs2)c[nH]1)c1cc(N2CCNC2=O)ccc1F 170597720 LUSREPWXZPNQHD-UHFFFAOYSA-N 385.424 2.737 0 50 GFAA CN1C(=O)C[C@@H](C(=O)N2CCN(C3CC3)c3ccc(F)cc32)[C@H]1c1cccnc1 187368042 KAPRVDZFGKGFNN-DYESRHJHSA-N 394.450 2.756 0 50 GFAA C[C@H](C(=O)N1CCCN(Cc2cccnc2)CC1)c1nnc(O)c2ccccc12 1506423814 WYHQZJNOMBYGLR-INIZCTEOSA-N 391.475 2.568 0 50 GFAA CN1C[C@@H]2C[C@H](N(C)C(=O)CCC(=O)Nc3ccc4c(c3)CCC4)C[C@@H]2CC1=O 1529119216 DHHKJGACWXPDDY-WSTZPKSXSA-N 397.519 2.609 0 50 GFAA CCCC[C@@H]1CN(c2cc(C(=O)N3CCOCC3)ccn2)C[C@H](C(C)C)O1 1529191241 VMRFPMKUUBJRTG-RTBURBONSA-N 375.513 2.974 0 50 GFAA CS(=O)(=O)Cc1ccc(N2CCC3(CC2)OCCc2ccsc23)nc1 1704302975 GMUVANAAUDPGCM-UHFFFAOYSA-N 378.519 2.756 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)CCCc3c[nH]c4ccccc34)C[C@@H]12 1704358239 HHFAXVSFCWGUQZ-KNQAVFIVSA-N 383.492 2.888 0 50 GFAA COc1cc(CN2C[C@@H]3CNC(=O)C[C@@H]3C2)ccc1OCc1ccccc1F 1800411950 QWKMOZUKXMVIGZ-MSOLQXFVSA-N 384.451 2.981 0 50 GFAA CCOc1ccccc1NC(=O)c1cccc(N2C(=O)[C@H](C)CS2(=O)=O)c1 12003951 LHUCPTKNZZOPBE-CYBMUJFWSA-N 388.445 2.650 0 50 GFAA O=C(c1ccccc1NS(=O)(=O)Cc1ccc(Cl)cc1)N1CCOCC1 14291507 BWDMPAOAQBIBQO-UHFFFAOYSA-N 394.880 2.754 0 50 GFAA CN1CCN([C@H]2COC[C@@H]2n2ccnc2-c2ccc3cccc(Cl)c3n2)CC1 1857705514 KTBPWRRHSYODNY-OALUTQOASA-N 397.910 2.939 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCCC2)CC[C@H]1NC(=O)c1ccn(C)c1C 1875250552 LJKSFDGRZVXYDL-QXAKKESOSA-N 375.513 2.650 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@H](NC(=O)CCS(=O)(=O)CC(C)C)C1 117189292 BZXSNMFEZQWRGM-KRWDZBQOSA-N 384.517 2.680 0 50 GFAA Cc1ccc(F)c(-n2nc(C(=O)Nc3c(O)ncnc3N(C)C)c3c2CCC3)c1 1875266213 NNIUGGAHVSMSJI-UHFFFAOYSA-N 396.426 2.622 0 50 GFAA O=C(NC[C@@H]1CC2(CCNCC2)C(=O)O1)N1CC[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 1875392232 SEXQYVKCRDAMAQ-FUMNGEBKSA-N 397.519 2.507 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cc(C(F)(F)F)ccn3)CC2)c2n1CCNC2 1875393132 HBSTVPJAYZPXAQ-UHFFFAOYSA-N 393.413 2.728 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1NCc1ccccc1OCc1ccccn1 1875400072 QIHHLJQVNKEFKQ-IOMROCGXSA-N 378.476 2.786 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)c(OC)c2)cc1 845630 LQLCKYJZZWGCGI-GOSISDBHSA-N 383.404 2.676 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@@H](Sc2nnnn2C2CCOCC2)C1=O 117111933 DNAAZHYTMNBAAB-MRXNPFEDSA-N 391.472 2.760 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)CN(c1ccccc1C)S(C)(=O)=O 652628 OJVOQFJOLOFPFH-UHFFFAOYSA-N 390.461 2.576 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)CC1 2356134960 KGLIMUBSZFOABZ-SFHVURJKSA-N 393.487 2.594 0 50 GFAA Nc1cc(N2C[C@@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2[C@H]3Cc2cccc(F)c2)ncn1 2356147052 FWNCJZHRSQXXJN-NEPXVJNWSA-N 395.482 2.646 0 50 GFAA N=c1[nH]nc(-c2ccc(-c3ccc(C(=O)N4CC(c5ccccn5)C4)cc3)o2)[nH]1 2356167053 GQWYEKCWXVVTCS-UHFFFAOYSA-N 386.415 2.779 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCC2(CC1)NCCNC2=O 67805511 AHLIQWZFHACPRF-UHFFFAOYSA-N 380.448 2.565 0 50 GFAA OCC[C@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCc1ccccc1 20999901 VHVMTLXMBOXJDK-NRFANRHFSA-N 382.504 2.569 0 50 GFAA CCN1CCN(Cc2cc(C(=O)NCC3C4CC5CC(C4)CC3C5)no2)CC1 67817446 OEXASZZNLSVCDK-UHFFFAOYSA-N 386.540 2.614 0 50 GFAA O=C1N[C@@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccncc1 67773442 GUOKMDODIZTSKC-QFIPXVFZSA-N 378.476 2.505 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N2CC[C@H]3[C@@H](CCCN3Cc3ccccc3)C2)C1 248157128 RMMLCACMIFSMMB-ACRUOGEOSA-N 398.551 2.693 0 50 GFAA CC(=O)N1CCn2nc(C(=O)N(Cc3c(F)cccc3Cl)C3CC3)cc2C1 65382352 XGEGWFFXEOGBPR-UHFFFAOYSA-N 390.846 2.843 0 50 GFAA Cc1ccc2oc(C(=O)NC[C@H](c3cccs3)N3CCOCC3)cc(=O)c2c1 23745095 UEAQNABGHLHZLG-MRXNPFEDSA-N 398.484 2.966 0 50 GFAA Cc1cc(-c2nc(CC(C)C)nn2-c2ccccn2)cc(S(N)(=O)=O)c1C 65470212 VJSPDADBQRQPAB-UHFFFAOYSA-N 385.493 2.792 0 50 GFAA CN(CCC(C)(C)O)c1ccc(C(=O)N2CCCC[C@H]2CCn2cccn2)cn1 67843412 SCQINZHUBKFFDG-IBGZPJMESA-N 399.539 2.960 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)c(F)c1 252492139 MEBMXZLRQNUPER-AWEZNQCLSA-N 394.468 2.648 0 50 GFAA O=C(NCc1cn2ccsc2n1)c1coc(Cn2cnc3ccccc32)n1 12445052 ALZRNMBOZLYZDQ-UHFFFAOYSA-N 378.417 2.712 0 50 GFAA CN(C(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(Cl)nc1 328599032 PXCSBANOATZKOX-INIZCTEOSA-N 393.896 2.941 0 50 GFAA CN1C(=O)N(c2ccc(-n3ccnn3)cc2)C(=O)[C@H]1c1cc(F)c(F)c(F)c1 328594737 APTUKSFWNZIVBD-MRXNPFEDSA-N 387.321 2.824 0 50 GFAA O=C(NCCc1ccco1)[C@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71662849 AGYDRGNITTZJFO-FQEVSTJZSA-N 396.535 2.710 0 50 GFAA O=C(c1ccc(Cl)cc1O)N1CCc2c(nc(-c3ccccc3)[nH]c2=O)C1 71661698 WZWVDILNZMFNEQ-UHFFFAOYSA-N 381.819 2.994 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCNC[C@@H]3C)cc2Br)no1 126017584 FGJNBDRXDNVGDU-NSHDSACASA-N 394.269 2.758 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)Nc1cnn(C[C@@H]2CCCO2)c1 363435740 WFTCAVQZMSKXSA-IBGZPJMESA-N 397.479 2.506 0 50 GFAA O=C1CCC(=O)N(c2ccc(C(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)N1 126304962 HZWQLQWXNUGHHW-QGZVFWFLSA-N 377.444 2.549 0 50 GFAA CN(C)[C@@H]1CCN(c2nccc(C3(c4ccccc4Cl)CCNCC3)n2)C1 72477792 RRFUATKFLRZBIO-MRXNPFEDSA-N 385.943 2.940 0 50 GFAA CCn1ccnc(N2CCC(NC(=O)N[C@H]3CCCc4ccccc43)CC2)c1=O 364675919 VIAVHHHSXRQISU-IBGZPJMESA-N 395.507 2.609 0 50 GFAA O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC[C@H](N2CCCS2(=O)=O)C1 366930411 RWOHCDGLMXJHBT-HNNXBMFYSA-N 381.473 2.735 0 50 GFAA CCCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 216218555 XKKYCIFJNFUUPQ-ZWKOTPCHSA-N 378.476 2.925 0 50 GFAA Cc1cncc(C(=O)N2CCC3(CC2)CN(CCOc2ccccc2)C(=O)O3)c1 77387905 JWDZCEHAUFHFNU-UHFFFAOYSA-N 395.459 2.896 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCC[C@H]2c2nc(-c3ccncc3)no2)no1 426489876 GXBMOKVAEIPHOV-ZDUSSCGKSA-N 383.412 2.685 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc1 19790093 DPLFWVGSDMHTLV-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@H]1CCCN(C/C=C/c2ccccc2)C1 426503160 JYINMSMFESQZRV-MRSBXDGLSA-N 381.524 2.540 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(C(=O)c2ccn(C(C)(C)C)c2)C1 95384086 WLVIUQKKBDUPIM-INIZCTEOSA-N 395.511 2.636 0 50 GFAA COc1cccc(C(=O)N2CCN([C@H](C(=O)O)c3ccc(C)cc3C)CC2)c1 95363621 PVUAIEXHPIKNGI-FQEVSTJZSA-N 382.460 2.896 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CCC2(CC1)[C@@H](OCCO)C[C@H]2O 91781121 NPBVJKMWOLHZPP-RTWAWAEBSA-N 381.472 2.718 0 50 GFAA O=C([C@H]1CCCCn2nnnc21)N(CCc1ccc(F)cc1)Cc1cccnc1 97370262 JLBCLRDEMOXPTL-IBGZPJMESA-N 394.454 2.746 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95506789 OGJSZANRUAOBSM-QGZVFWFLSA-N 382.489 2.900 0 50 GFAA CCOc1ccc(CN2CCC3(CC2)c2nc[nH]c2CCN3CC)cc1CO 91595739 WOMGKOUIAAPRJE-UHFFFAOYSA-N 384.524 2.670 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Nc3ccccc3OC)C2)CCC1=O 91650940 IYVNVMREKLHLED-HXUWFJFHSA-N 375.469 2.578 0 50 GFAA CCOc1ccccc1CN[C@@H]1CNC(=O)c2cc(-c3ccc(OC)cc3)nn21 263616473 IWYCSOKAMXOHNB-NRFANRHFSA-N 392.459 2.989 0 50 GFAA Cc1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccncc3)C2)cc2sc(N)nc12 952991427 RMVNHJSLVLNHTP-CYBMUJFWSA-N 381.461 2.569 0 50 GFAA CN(CC(=O)N1CC=C(c2ccc(Cl)cc2)CC1)c1ncnc2nc[nH]c12 170655805 HLTJCPUZVZDFSG-UHFFFAOYSA-N 382.855 2.758 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(CC[C@H]1CCOC1=O)CC2 276402481 KMDPWPAEVCCAHG-ROUUACIJSA-N 376.522 2.904 0 50 GFAA C[C@@H]1C[C@@H]1c1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)o1 170641633 LMDMHIBCJIJPFA-KOLCDFICSA-N 396.852 2.866 0 50 GFAA Cc1ccc(-n2nnc(C(=O)N3CCOC[C@H]3c3nc(C)cs3)c2C)cc1 188583050 UONYWGBQIJEEDQ-INIZCTEOSA-N 383.477 2.863 0 50 GFAA CC(=O)c1ccccc1NC(=O)[C@@H](C)N1CCC(CC(=O)N2CCCC2)CC1 194280535 PHJSKAVURPWXOF-MRXNPFEDSA-N 385.508 2.941 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)c3ccco3)CC2)cc2sc(N)nc12 1506415028 JPOFRFSMWYDWKY-UHFFFAOYSA-N 384.461 2.768 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)c2)n1 1704311071 WPZYFHAWSDVUQO-UHFFFAOYSA-N 394.523 2.784 0 50 GFAA O=C([C@@H]1CCc2sc(N3CCOCC3)nc2C1)N1CCc2sccc2C1 1772818685 JRZLJAPQSYHLNU-CYBMUJFWSA-N 389.546 2.731 0 50 GFAA COc1cc([C@@H]2NC(=O)N(C)C(C)=C2C(=O)OC(C)C)cc(OC)c1OC 5426675 PAWLKZGGQKAVFZ-INIZCTEOSA-N 378.425 2.634 0 50 GFAA CC(=O)N[C@@H](CC(C)C)c1nnc2n1CCN(CCCc1ccccc1)CC2 12158980 NFGMZWKPRVJIIJ-FQEVSTJZSA-N 383.540 2.992 0 50 GFAA O=C(c1cc(Cn2cnc3ccccc32)[nH]n1)N1CCCN(C2CCCC2)CC1 12299937 WPHCJFSUNKODGM-UHFFFAOYSA-N 392.507 2.898 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(COc3cccc(C(C)=O)c3)[nH]n2)C1 12305567 CVWKYSNYTLNGGE-MRXNPFEDSA-N 399.447 2.607 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@@]1(O)CN1CCC(N2CCCC2)CC1 12440537 YISFJXJZZOWFPJ-HSZRJFAPSA-N 391.600 2.871 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1)NC1CCC1 12595431 JNPZVLNEJHAFSV-NRFANRHFSA-N 377.488 2.713 0 50 GFAA CC(C)Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4ccccc34)C2)s1 169774367 ODWOIMGFSFKUOA-NSHDSACASA-N 384.465 2.605 0 50 GFAA CO[C@H](CNS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1Cl 206852968 ZOWOOBDOCQADHA-QGZVFWFLSA-N 383.853 2.777 0 50 GFAA C[C@@H](SCc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)CC(=O)NCCO2 1857688145 VNXPDHFFNNXBJS-CQSZACIVSA-N 396.940 2.859 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3C[C@@H]4[C@H](CN(C)C)[C@H]5CC[C@]4(C3)O5)n[nH]2)cc1 1857727670 WYKVIYXMMTUQAV-BJJLKGPWSA-N 394.519 2.820 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N3C[C@@H](O)[C@H](Cc4ccccn4)C3)c2)n1 1857734170 MHSGJRXFZRANFQ-IFMALSPDSA-N 390.487 2.619 0 50 GFAA Cc1ccc(C)c(O[C@@H](C)C(=O)N2CCN(c3nc(C)nc4[nH]ccc34)CC2)c1 1875264094 GSNNRFZLLLVVTM-INIZCTEOSA-N 393.491 2.999 0 50 GFAA O=C1Cc2cc(CNC(=O)c3c[nH]c4ncc(Br)cc34)ccc2N1 1875261630 AXUDTZIZMMQOSC-UHFFFAOYSA-N 385.221 2.750 0 50 GFAA C[C@H](C1CC1)n1ncc2cc(C(=O)N3Cc4nc(C5CC5)nc(O)c4C3)cnc21 1875283820 DBIMLIYOLASUNP-LLVKDONJSA-N 390.447 2.931 0 50 GFAA Cn1cc(CC(=O)N[C@@H]2CCC[C@@H]2CNCc2ccc(Cl)cc2F)cn1 1875374695 XUROJXXEMXHWMF-CRAIPNDOSA-N 378.879 2.830 0 50 GFAA Cc1ccccc1Nc1scnc1C(=O)N1C[C@@H](C)O[C@H](CC(=O)O)C1 1875312512 NGBLJBKUCWDWTE-CHWSQXEVSA-N 375.450 2.899 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(F)c(COCC2CC2)c1 1875403321 SSQWEBFTHCCGKG-CWFSZBLJSA-N 387.455 2.518 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H](C)Cc2cccc(Br)c2)CC1 1776004449 RVBBUTJRLHIDHQ-ZDUSSCGKSA-N 379.298 2.921 0 50 GFAA CN1c2ncc(CNC(=O)OC(C)(C)C)cc2N(C(=O)OC(C)(C)C)[C@@H]1O 38534142 XUHDIUAWLWAPDH-OAHLLOKOSA-N 380.445 2.574 0 50 GFAA in-vitro CC[C@@]1(C)C[C@@H]1C(=O)N1CCN(CCNC(=O)C23CC(C(C)(C)C)(C2)C3)CC1 2325793797 IAVWTKZLWRQIMZ-ZPRFCUBTSA-N 389.584 2.899 0 50 GFAA O=C(c1cc(=O)c2c(O)cccc2o1)N(CCc1ccccc1)[C@@H]1CCOC1 2325870272 QCLNTLRQZRBEFD-MRXNPFEDSA-N 379.412 2.972 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CO[C@H](CNC(=O)CCc3ccoc3)C2)cc1F 2332238038 WDTLZQYJRFKNHQ-HOCLYGCPSA-N 390.411 2.520 0 50 GFAA Cc1nc2c(C(=O)N3CCN(c4nsc5ccccc45)CC3)ccnc2n1C 2356141860 SQTDNXOWWNQYAO-UHFFFAOYSA-N 392.488 2.849 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3ccc4ncnn4c3)C2=O)cc1 2356144529 BWFBGDPNTPWKHB-JOCHJYFZSA-N 389.459 2.840 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2ccc(SC)s2)[C@@H]1c1cnn(C)c1 225836585 QJWANWBRMWKLPI-SCLBCKFNSA-N 394.566 2.529 0 50 GFAA CCN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)c3ccc(C)nc3)CC2)[C@H]1O 20905930 INVLKCITSXZWFL-RTWAWAEBSA-N 379.504 2.931 0 50 GFAA C[C@H](N[C@@H]1CCOC2(CCOCC2)C1)c1cccc(N2CCCS2(=O)=O)c1 329195250 VGWKXFSRUQPTNY-FUHWJXTLSA-N 394.537 2.605 0 50 GFAA CCCCN1CCOC[C@@H]1C(=O)NCc1cc2c(cc1OCC)C[C@H](C)O2 252552175 UQGNSAJSJZETIZ-MAUKXSAKSA-N 376.497 2.526 0 50 GFAA CNC(=O)c1ccc(CNCc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc1 123447768 LATVDZLPNPHCRD-QZTJIDSGSA-N 381.520 2.945 0 50 GFAA CCOc1ccc(CC(=O)N2N=C(C(F)F)C[C@@]2(O)C(F)F)cc1OCC 653095 HTNDAALRCHWYLT-QGZVFWFLSA-N 392.349 2.834 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)sc2c1 2503181 SUINWZINFPLMBA-MNOVXSKESA-N 382.463 2.529 0 50 GFAA Cc1c(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)cnn1C 2764555 QONDCJCYRFTYOB-UHFFFAOYSA-N 376.482 2.546 0 50 GFAA CCCN(CCC)C(=O)C[C@@H]1C(=O)NCCN1Cc1c(F)cccc1Cl 72173901 HUJMHAJNENENBH-QGZVFWFLSA-N 383.895 2.818 0 50 GFAA C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1CC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 172328787 QXUSQGHFOWWGRV-UKRRQHHQSA-N 395.434 2.868 0 50 GFAA N[C@@H]1c2ccccc2C2(CCN(C(=O)CCCOc3ccccc3)CC2)[C@H]1O 72135161 RRPWYCACSIGXEP-YADHBBJMSA-N 380.488 2.780 0 50 GFAA Cc1nc(S)sc1CC(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 155281506 FXTBXCQGEQJLTC-LSDHHAIUSA-N 378.519 2.634 0 50 GFAA C[C@@H](CN(C)C)NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1 72166002 GVHNRKZCOJDGNH-IBGZPJMESA-N 379.548 2.765 0 50 GFAA NCC[C@H]1CCCN(C(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 442620613 SVHCHAVKJSBRHB-OCCSQVGLSA-N 384.307 2.934 0 50 GFAA Cc1cccc([C@@H](C)NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)c1 333744786 YQBBJWLYIUKPCF-MRXNPFEDSA-N 379.526 2.656 0 50 GFAA O=C(c1cnnn1-c1c(Cl)cccc1Cl)N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 333872407 UUFGLXYDNMIIDP-XEQNPHJVSA-N 377.231 2.600 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N[C@H](c2ccccc2)c2ccncc2)cc1 181522741 QMXMVHNJMHBHDY-LJQANCHMSA-N 381.457 2.509 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 175650012 JIBKLMHUPURSBD-JXFKEZNVSA-N 383.540 2.932 0 50 GFAA CCCc1cc(NC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)n2ncnc2n1 131796450 NMHIXINXXXPMGB-CQSZACIVSA-N 389.843 2.647 0 50 GFAA CC(C)(C)OC(=O)Nc1ccc(-n2ncc3cnc(S(C)(=O)=O)nc32)cc1 85999776 UAXMOLPYUHSLPD-UHFFFAOYSA-N 389.437 2.566 0 50 GFAA Cn1nccc1[C@@H](O)c1cc2n(n1)CCN(Cc1ccc(F)c(Cl)c1)C2 221318291 GGXKRWGKKMSSNS-SFHVURJKSA-N 375.835 2.507 0 50 GFAA Cc1cc(N2CC[C@H](Nc3ccc(C(=O)NC4CCCC4)cc3C)C2=O)n(C)n1 177167431 XZUOPKZBRIBBTC-IBGZPJMESA-N 395.507 2.927 0 50 GFAA O=C1CN(C(=O)c2ccc([C@H]3CCCN3)s2)CCN1Cc1cccc(F)c1 20236188 LMPAHDZCWZGJGY-MRXNPFEDSA-N 387.480 2.796 0 50 GFAA COCCN1C(=O)c2ccccc2[C@H](C(=O)Nc2nncs2)C12CCCC2 49550933 LTNUYNMLFYIRRI-OAHLLOKOSA-N 386.477 2.675 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)c3cc4c(n(C)c3=O)CCCC4)CC2)n1 426411242 FTLAVAIABWQZQU-UHFFFAOYSA-N 384.480 2.790 0 50 GFAA CCN1CC2(CCN(C(=O)Cc3cc4c(cc3Cl)OCCO4)CC2)CC1=O 95500733 CVHLGZXUHDKGAS-UHFFFAOYSA-N 392.883 2.515 0 50 GFAA CC(=O)c1cccc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)c1 91625697 ZDHHQYYGVLAMQF-HXUWFJFHSA-N 398.503 2.913 0 50 GFAA Cc1cccnc1[C@H](C)Nc1ncc(C(C)(C)C(=O)O)c(N2CCOCC2)n1 96136355 LMJZVSZMRUVXLE-AWEZNQCLSA-N 385.468 2.552 0 50 GFAA O=C(C1CCN(c2ncnc3c2Cc2ccccc2OC3)CC1)N1CCCC1 95520106 UPVOMYAYQHASLM-UHFFFAOYSA-N 378.476 2.799 0 50 GFAA CCN1CCC(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)CC1 95362906 JMIQODBHJHINOK-WWPVKYPJSA-N 383.536 2.762 0 50 GFAA Cc1cccc(N2C[C@H](NC(=O)c3cc(=O)c4ccc(C)cc4o3)CC2=O)c1 244652027 GYLIAFZZQWDHIL-OAHLLOKOSA-N 376.412 2.945 0 50 GFAA CN1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CC[C@@H](c4ccccc4)C[C@H]32)C1=O 248001725 APUVCZANMBRGLQ-BVZALQNUSA-N 389.455 2.690 0 50 GFAA CCN(C)C(=O)c1ccc(-c2cccc(C(=O)N(C)[C@@H]3CCN(C)C3)c2)nc1 534632971 CNBJTVONUQLUJR-LJQANCHMSA-N 380.492 2.617 0 50 GFAA O=C(NCc1ccccc1F)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 57992264 TTXSBYVATMDJPS-JLDZCNIISA-N 379.435 2.774 0 50 GFAA Cc1c(C(=O)NCc2cnn(-c3cccc(F)c3)c2)sc2[nH]cnc(=O)c12 826621226 RHRJGXDJWNRMFY-UHFFFAOYSA-N 383.408 2.548 0 50 GFAA CN1CC2(CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)OCC1=O 670473746 JEAJKTKNXNJYJO-UHFFFAOYSA-N 378.472 2.746 0 50 GFAA COCC(=O)Nc1ccc(OC)cc1NC(=O)[C@H](c1ccc(F)cc1)N(C)C 952965639 BAHVYKYHDMGJJY-IBGZPJMESA-N 389.427 2.661 0 50 GFAA Cc1oc(-c2cccs2)nc1CN1C[C@@H]2CC[C@H]1CN(S(C)(=O)=O)C2 1565511057 SLSILJNLDBCDIP-KBPBESRZSA-N 381.523 2.567 0 50 GFAA CC(C)CCO[C@@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4ccc(O)cc4)n3C2)C1 170614661 SNJVWCBRYUCAEF-IEBWSBKVSA-N 398.507 2.877 0 50 GFAA CCN(C(=O)CN1CCN(c2cc(C)[nH]n2)CC1)c1nc2ccccc2s1 187272800 RVJDCSFBHNGQSO-UHFFFAOYSA-N 384.509 2.503 0 50 GFAA O=S1(=O)C[C@H](O)[C@@H](n2ccnc2-c2ccc(-c3ccccc3Cl)o2)C1 216601862 CKSUPELWKCARGV-KBPBESRZSA-N 378.837 2.794 0 50 GFAA C[C@]1(O)CC2(CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)OC[C@@H]1O 1704345489 ZNXUBVZDUAOJRS-HOCLYGCPSA-N 389.279 2.892 0 50 GFAA O=C(NCc1n[nH]c2c1CCC2)[C@H]1CCc2sc(-c3ccncc3)nc2C1 1772815198 ZHMUYALYZXWCHB-ZDUSSCGKSA-N 379.489 2.838 0 50 GFAA COCc1ccc(C(=O)N2CCC(CCC(=O)NCc3cccnc3)CC2)o1 11661935 BCTDGBBGYNAHLO-UHFFFAOYSA-N 385.464 2.770 0 50 GFAA COc1cc(NC[C@H](O)COc2ccc3c(C)cc(=O)oc3c2)cc(OC)c1 11866527 WFHQWBYMFWIZFK-HNNXBMFYSA-N 385.416 2.970 0 50 GFAA biogenic Cc1cnc(C)c(-c2ccc(F)c3c2O[C@H](CNC(=O)CN2CCCCC2)C3)n1 11979818 BFSYAJTYNGLCPO-INIZCTEOSA-N 398.482 2.805 0 50 GFAA COC(=O)CCC(=O)N1CCC2(CC1)C[C@@H]2C(=O)Nc1ccc(SC)cc1 12129063 MNQUJGOBPHIXQE-MRXNPFEDSA-N 390.505 2.929 0 50 GFAA CCCS(=O)(=O)c1ncc(CN(C)Cc2ccsc2)n1C[C@H]1CCCO1 12317007 KVVPITSZOWCTSO-QGZVFWFLSA-N 397.566 2.939 0 50 GFAA CS(=O)(=O)Nc1cccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)c1 13681367 ZHNDWQODXRRUOI-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1 14949465 WEHMTWNZTFDGIO-OAQYLSRUSA-N 376.472 2.984 0 50 GFAA COCCN1CCC(CN(Cc2cccc3c2OCO3)C[C@H]2CCCO2)CC1 14954517 IOWUBNBXBCDSBP-HXUWFJFHSA-N 390.524 2.755 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2CCCc3nc(N4CCC(CO)CC4)ncc32)cc1 15073196 KIUDWHRXZYKFGY-LJQANCHMSA-N 380.492 2.801 0 50 GFAA COc1ccc(-c2nc3s/c(=C\C4=Cc5ccccc5OC4)c(=O)n3n2)cc1 16732001 ZNNVLAQJJDZYGX-WQRHYEAKSA-N 389.436 2.802 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCC([C@H](O)c3nccn3C)CC2)cs1 158196311 ZIHXMMQLAJQVQQ-HNNXBMFYSA-N 377.514 2.655 0 50 GFAA O=C1CC2(CCN(c3cnccn3)CC2)OCCN1Cc1cc(F)ccc1F 1857687797 FOKGZKMWFDVLSI-UHFFFAOYSA-N 388.418 2.543 0 50 GFAA C[C@H](N)c1nc(-c2ccccc2)nn1CC(=O)NCc1cc(-c2ccco2)on1 1857689204 ITUDRCYZBSVKAX-ZDUSSCGKSA-N 392.419 2.529 0 50 GFAA C[C@@H]1CN(C(=O)C2CCN(c3ccc(Cl)cn3)CC2)C[C@]2(CCCOC2)O1 225470500 DLFRIYQHIZEOFU-QRWLVFNGSA-N 393.915 2.748 0 50 GFAA C[C@H](CN1CCOCC1)NC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 111456339 XNNJGVNPMPUZRC-OAHLLOKOSA-N 388.487 2.917 0 50 GFAA CCc1cc(NC(=O)N2CCCCC[C@H]2c2noc(-c3cnn(C)c3)n2)n(C)n1 329369443 IHENEGZKXGENPL-HNNXBMFYSA-N 398.471 2.915 0 50 GFAA CC(C)C[C@@H](NC(=O)CCCNC(=O)c1cnccn1)c1nc2ccccc2[nH]1 248290448 SHTDKJSHIDODME-QGZVFWFLSA-N 394.479 2.767 0 50 GFAA O=C(Nc1cc(-c2ccc(Cl)cc2)nn1CCO)[C@H]1CCCc2[nH]ncc21 135303598 XYTBFLAPNVBWPD-AWEZNQCLSA-N 385.855 2.978 0 50 GFAA O=C(O)c1cccc(CC(=O)N2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c1 907880248 JQPCFRLSVYSCAO-CYBMUJFWSA-N 379.338 2.752 0 50 GFAA CC[C@@H](C)c1ccc(C(=O)NCc2cccc(NC(=O)CN(C)C)c2)c(O)n1 1875282621 LYLOZUGRVGDGRU-CQSZACIVSA-N 384.480 2.731 0 50 GFAA Cc1c[nH]nc1C(=O)NCC[C@H]1CCCN(C(=O)c2ccnc3ccccc23)C1 1875310243 KBEFKQNRTYIXTR-MRXNPFEDSA-N 391.475 2.939 0 50 GFAA CNc1c(C(=O)NCCc2ccccc2N2CCOCC2)sc2nccnc12 1875301110 FQFGORWRSDAFDA-UHFFFAOYSA-N 397.504 2.542 0 50 GFAA CCc1onc(C)c1CN1CCC[C@@H]1CNC(=O)c1ccc2nc(O)[nH]c2c1 1875362116 RQXUALQVPUICJX-CQSZACIVSA-N 383.452 2.522 0 50 GFAA Cc1cc(C(=O)NCC2(O)CCN(C(=O)c3ccoc3C)CC2)c(C)s1 1775991808 NELPDEXQGMAOBC-UHFFFAOYSA-N 376.478 2.663 0 50 GFAA Cc1ccc(Cc2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)cn1 1775960561 SKHJOODOWVQLEF-OAHLLOKOSA-N 380.452 2.579 0 50 GFAA COC(=O)c1ccccc1NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 714668 MKQFBLREYYAJDJ-UHFFFAOYSA-N 396.852 2.531 0 50 GFAA CC(C)(CNC(=O)c1ccc(-n2ccnc2)cn1)N1CCc2ccccc2C1 2325740489 LJSWVQMCMPCYPQ-UHFFFAOYSA-N 375.476 2.834 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ocnc1-c1ccccc1 2325785520 CBWSKQMYNOZEPL-APHBMKBZSA-N 386.839 2.761 0 50 GFAA O=C(c1ccc(Br)cc1Br)N1CCN[C@H](CF)C1 2325792415 ZOVOEAQWNIVTFK-SECBINFHSA-N 380.055 2.595 0 50 GFAA O=C(CCn1nc(O)c2ccccc2c1=O)N(CCc1ccccc1)C1CC1 914489729 QPXFZRGBAMVRDK-UHFFFAOYSA-N 377.444 2.726 0 50 GFAA Cc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(Br)cc1 1145080 CSPKKEQSEIADRZ-UHFFFAOYSA-N 383.267 2.675 0 50 GFAA CS(=O)(=O)N(Cc1cc(-c2ccccn2)no1)c1cccc(-n2cccn2)c1 2356141526 GBYRYMCBHZCNGT-UHFFFAOYSA-N 395.444 2.889 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N3CC(c4nc5ccccc5[nH]4)C3)cn12 2356165669 FKYXDHWAUQZIJW-SFHVURJKSA-N 390.447 2.535 0 50 GFAA O=C(CCc1nc2ccccc2s1)N1CC[C@](O)(c2ccccc2)[C@@H](O)C1 2356167927 JCSJYGUFRJPPRG-RXVVDRJESA-N 382.485 2.710 0 50 GFAA CCc1ccc(-c2noc(C3=NN(c4ccc(F)cc4)[C@@H](C(N)=O)C3)n2)cc1 113737088 XGQCDOQEWQVOJM-QGZVFWFLSA-N 379.395 2.906 0 50 GFAA CC(C)(C)c1noc(-c2ccccc2C(=O)NC[C@@H]2CN(C3CC3)CCO2)n1 114858006 PKFYZQPIWGXJGG-OAHLLOKOSA-N 384.480 2.627 0 50 GFAA COc1cc(C(=O)N2CCN(C[C@@H]3C[C@H]4C=C[C@H]3C4)CC2)cc(OC)c1OC 100573521 QCNAYMQWEXXBLQ-BQFCYCMXSA-N 386.492 2.682 0 50 GFAA CC(C)(C)c1ccc(OCc2nn3c(CN4CCOCC4)nnc3s2)cc1 57524435 MZRUKEQTHIKPRJ-UHFFFAOYSA-N 387.509 2.895 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc(F)ccc3F)C[C@H]2CCO)CC1 104355138 SJPKLAUFTLLOCJ-HXUWFJFHSA-N 381.511 2.706 0 50 GFAA CN1CCC(N2CCN(Cc3ccc(-c4ccco4)cc3)C[C@H]2CCO)CC1 106687579 NXYQNOKTCVWXML-JOCHJYFZSA-N 383.536 2.909 0 50 GFAA CN(CCCN1CCOCC1)Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 20210453 KOYBPCUAJJKUAR-UHFFFAOYSA-N 384.402 2.910 0 50 GFAA COCCN(Cc1sccc1C)C(=O)[C@H](c1cccnc1)N1CCOCC1 65504058 BFLIABFGBPXQSP-IBGZPJMESA-N 389.521 2.500 0 50 GFAA CCNc1cc(N2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc(C)n1 65363190 NCWPKTWSWQNVPV-UHFFFAOYSA-N 389.887 2.598 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)c1cnc(-c2ccccn2)s1 171416998 JHODUDRSWRCMQJ-UHFFFAOYSA-N 378.457 2.914 0 50 GFAA CN(Cc1ccoc1)C(=O)c1coc(CN2CCN(Cc3ccccc3)CC2)n1 67755255 PIKAYOQNHQJDHO-UHFFFAOYSA-N 394.475 2.858 0 50 GFAA O=C(Nc1cccnc1)c1cccc(CN2CCN(C3CCOCC3)CC2)c1 65527946 DUWHKHXAZJXQQI-UHFFFAOYSA-N 380.492 2.631 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2cnn3ccccc23)CC1 328628206 GZIDRPFEQRQOJB-HXUWFJFHSA-N 378.480 2.528 0 50 GFAA COc1ccc(CCN2C(=O)CC[C@@H]3CN(Cc4cnn(C)c4C)CC[C@@H]32)cc1 12080113 YNTYCNNLZFOQKH-KNQAVFIVSA-N 396.535 2.793 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)Nc1nnc(C(C)(C)C)s1 151931253 RWOMNAVTUVIMQY-UHFFFAOYSA-N 394.522 2.936 0 50 GFAA CS(=O)(=O)Cc1ccccc1NC(=O)c1ccnc(OCC(F)(F)F)c1 152863074 DCJNKLYRCMRBTC-UHFFFAOYSA-N 388.367 2.820 0 50 GFAA CS(=O)(=O)c1ccccc1C(=O)N1CCC(C(=O)c2ccc(O)cc2)CC1 363143993 PNZOXUZQIBRVPU-UHFFFAOYSA-N 387.457 2.531 0 50 GFAA O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12 72158752 UNSJDGXKUBKDIN-QFIPXVFZSA-N 388.427 2.908 0 50 GFAA O=C(OC[C@H]1CCCCN1Cc1cn(Cc2cccnc2)nn1)N1CCCCC1 368037931 NYVZVOFGHYFPDJ-HXUWFJFHSA-N 398.511 2.698 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3ncn(-c4ccccc4)n3)CC2)oc1C 156668401 ZGUUYMNXCPRCQN-UHFFFAOYSA-N 394.479 2.514 0 50 GFAA COc1ccc(CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1F 237256098 JFSNJABTKZRLHW-LJQANCHMSA-N 385.483 2.821 0 50 GFAA COc1cnc2ccccc2c1C(=O)N1CCO[C@H](c2nnc(C(C)C)o2)C1 283217500 SBIVMMYRDVWHMN-INIZCTEOSA-N 382.420 2.964 0 50 GFAA CCCN1CCCn2nc(CNC(=O)c3c(OC)ccc(F)c3F)cc2C1 82161559 IKDPRIOZOKHEFT-UHFFFAOYSA-N 378.423 2.716 0 50 GFAA CCc1nc(CN2CCN(C(=O)Nc3cc(C)cnc3OC)CC2)cs1 174961857 BAIYAEIUWMIDQG-UHFFFAOYSA-N 375.498 2.767 0 50 GFAA C[C@@H](NC(=O)CN1CCn2c(Br)cnc2C1)c1ccccc1Cl 225670617 QNDLJZDPCVDLHL-LLVKDONJSA-N 397.704 2.992 0 50 GFAA CC(C)C(=O)Nc1ccc2[nH]cc([C@@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c2c1 227173757 OQFYKPKKUCEUSB-PXAZEXFGSA-N 387.436 2.685 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N[C@H](C)Cn3ccc(C)n3)c2n1 20602215 CAXJEDHTWZNLHJ-GFCCVEGCSA-N 394.401 2.777 0 50 GFAA NC[C@@H]1CCN(C(=O)c2cnc(Cc3c(Cl)cccc3Cl)nc2O)C1 92099210 JJYLIPZSEGSUIC-JTQLQIEISA-N 381.263 2.501 0 50 GFAA CCN(Cc1cnn(CC)c1)C(=O)Nc1cc(Cl)c2c(c1)NC(=O)CO2 96159938 HQGXRSSUAHLYGB-UHFFFAOYSA-N 377.832 2.941 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cnccn1 95502502 YCBKDCWQOVUFEG-IBGZPJMESA-N 382.508 2.902 0 50 GFAA COc1ccc(-n2ccnc2-c2cn(C[C@H](O)c3ccc(O)cc3)nn2)cc1 91494665 DEUTZLPFHUDZQX-IBGZPJMESA-N 377.404 2.579 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CCc3c(C)noc3C)[nH]c2C1 95371542 VVRANAFDVITXPQ-CQSZACIVSA-N 380.448 2.878 0 50 GFAA CCN(C(=O)NC1CCN(S(=O)(=O)CC(C)C)CC1)[C@H](C)c1cccnc1 180740062 RNODGAMZFVYOJN-MRXNPFEDSA-N 396.557 2.624 0 50 GFAA Cc1nc(CNC(=O)c2cccc(-c3ccc(CN4CCCC4)cn3)c2)no1 534649968 SGGRFTXQCOZLQE-UHFFFAOYSA-N 377.448 2.966 0 50 GFAA O=C(C1CCN(c2ncccn2)CC1)N(Cc1ccsc1)C[C@H]1CCCO1 55036591 JYQKEFMPCGXYID-GOSISDBHSA-N 386.521 2.962 0 50 GFAA COc1ccc(-c2cc3c(c(OC)c2)OCCN(Cc2ccccn2)C3)nn1 55168489 ZSMDAAINNWISLX-UHFFFAOYSA-N 378.432 2.950 0 50 GFAA O=C(CSCc1ccccc1Cl)N1CC[C@H]2[C@H](C1)OCc1cnnn12 299761574 KYVHNCAVWOJROV-HOTGVXAUSA-N 378.885 2.537 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)c2ccc3c(c2)CCCO3)C1)c1cncc(F)c1 826630313 OERAAGOISJWQOP-HNNXBMFYSA-N 397.450 2.828 0 50 GFAA O=C(N[C@H]1CCCN(C2CCCC2)C1)N1CCN(c2ncccc2Cl)CC1 584885899 VYUGPENHWRPBHG-INIZCTEOSA-N 391.947 2.974 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)NCc1n[nH]c2c1CCCCC2 670464604 ZCYXREJDNBISOO-UHFFFAOYSA-N 380.452 2.763 0 50 GFAA Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)Cc1ccc(C(N)=O)cc1 275443165 HVJCEJKKNMMRHL-IRXDYDNUSA-N 376.501 2.595 0 50 GFAA Cc1ncc2c(n1)CCC[C@H]2NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 742682509 SPAZQNOMOFSINP-OAHLLOKOSA-N 387.509 2.962 0 50 GFAA COc1ccc2nc(CNC(=O)c3cn(C/C=C/c4ccccc4)nn3)[nH]c2c1 11663636 JDRORTJQTXXVEQ-VMPITWQZSA-N 388.431 2.806 0 50 GFAA CN(Cc1ccccn1)C(=O)c1cc(COc2ccc(-n3cncn3)cc2)on1 11667903 AISOWLKWNJROSU-UHFFFAOYSA-N 390.403 2.502 0 50 GFAA CCOC(=O)C1(CCOC)CCN(Cc2ccc(OCC)c(CO)c2)CC1 12386848 YNFPCEIAAUKVNN-UHFFFAOYSA-N 379.497 2.759 0 50 GFAA CC1CCN(CCCNS(=O)(=O)c2ccc(Br)cc2)CC1 12976509 WBLQZWIJNJNPRT-UHFFFAOYSA-N 375.332 2.849 0 50 GFAA CC(C)Cc1cc(CN2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)n[nH]1 15066360 YPUUIGJGJZVHJB-FQEVSTJZSA-N 376.545 2.896 0 50 GFAA CC(=O)c1ccc(N2CCN([C@H]3CC(=O)N(c4ccc(C)cc4)C3=O)CC2)cc1 19794696 YOLCYEOWNQIZQS-NRFANRHFSA-N 391.471 2.652 0 50 GFAA Cc1noc(-c2cn([C@@H]3CCN(C(=O)c4cc(Cl)ccc4F)C3)nn2)n1 169777914 RDKHHARNKRWDMG-LLVKDONJSA-N 376.779 2.516 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)N3CCCCC3)cn2)CCN1c1ccc(F)cn1 1857690193 FHTLSXJYIUDKGY-INIZCTEOSA-N 383.471 2.957 0 50 GFAA CCOCCC(=O)N1CCC2(CC1)CN(CC1CCCCC1)C[C@@H]2C(=O)O 1857691159 XDEQNDXAIVJSFC-GOSISDBHSA-N 380.529 2.619 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)C[C@@H]3CCCN3C)CC2)OCCC1=O 1857715430 RBTNUWCVQQIGLE-IBGZPJMESA-N 393.572 2.517 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)N(CCO)Cc1ccccc1 1857717211 NNDZNJMLQGLWLS-GOSISDBHSA-N 394.475 2.850 0 50 GFAA Cc1ccoc1C(=O)N1C[C@@H]2[C@H](CNC(=O)c3ccccc3)[C@H]3CC[C@]2(C1)O3 1857725257 YTIGVQHBKPXNMS-KCXPTXFHSA-N 380.444 2.638 0 50 GFAA Cc1nc(NC(=O)CCc2nc(-c3ccccc3)no2)sc1C(=O)N(C)C 1875247242 HJBXZPXFPYFAKX-UHFFFAOYSA-N 385.449 2.775 0 50 GFAA Cc1ccc2c(C(=O)N[C@@H](CO)CC(F)F)cc(-c3cnn(C)c3)nc2c1C 935649606 UENWZMDZMHVEIJ-CQSZACIVSA-N 388.418 2.998 0 50 GFAA CN(C(=O)c1ccncc1)c1ccc(CNC(=O)C2(C(=O)O)CCCC2)cc1 844155658 SQAHALQWLQPAQI-UHFFFAOYSA-N 381.432 2.619 0 50 GFAA C[C@](CO)(Cc1ccc(Cl)cc1)NC(=O)c1cnc(C2CCC2)nc1O 1875278649 RGRYLHZOAIDNFT-LJQANCHMSA-N 375.856 2.827 0 50 GFAA Cc1ncnc2c1C[C@@H](C(=O)N1CCC[C@@H](CN(C)Cc3cccnc3)C1)CC2 1875290670 WMKDDTKNWPFEHD-PMACEKPBSA-N 393.535 2.656 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(OC)cc1F)C[C@H](C)O[C@@H]2C 1875316108 VOKYEAJKZCSCCX-QWHCGFSZSA-N 391.443 2.629 0 50 GFAA COc1c(F)cc2nc(N3CCN(C(=O)c4cccn4C)CC3)sc2c1F 1875310364 NLLJKCLOMCVMAY-UHFFFAOYSA-N 392.431 2.884 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)c1c[nH]nc1[C@H]1CCCNC1)CC3 1875315216 LMWXWLVQQGWFBP-GJZGRUSLSA-N 377.492 2.954 0 50 GFAA C[C@@H]1CN(C(=O)c2cnc3cc[nH]c3c2)CC[C@@H]1NC(=O)c1coc(C2CC2)n1 1875333656 GLSBMFSATUDKBC-DOMZBBRYSA-N 393.447 2.709 0 50 GFAA O=C1Cc2ccc(NC(=O)[C@@H]3CCN(C(=O)OCc4ccccc4)C3)cc2N1 895334582 JCLALBFZHWOMEI-MRXNPFEDSA-N 379.416 2.778 0 50 GFAA CC1CCN([C@H]2CC(=O)N(c3ccc(I)cc3)C2=O)CC1 18250368 CKOJXPDTAMPVJN-AWEZNQCLSA-N 398.244 2.655 0 50 GFAA CCN(CC)c1ncc(Cl)c(C(=O)N(C)C[C@@H](O)c2ccc(F)cc2)n1 2325708921 DGUSMLHCEYUZMP-OAHLLOKOSA-N 380.851 2.921 0 50 GFAA N[C@H]1CCc2cc(C(=O)N3CCC(F)(F)[C@@H](C(F)(F)F)C3)ccc2NC1=O 2325774963 LOCBDMKQNCEPCE-AAEUAGOBSA-N 391.340 2.558 0 50 GFAA CC[C@H](CNS(C)(=O)=O)Nc1ccnc2cc(OC(F)(F)F)ccc12 2325862008 FYYPBSBFTXZVHI-SNVBAGLBSA-N 377.388 2.873 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1 134850990 OLYZNTJIEJPNFH-OAHLLOKOSA-N 388.489 2.876 0 50 GFAA CCOC(=O)COc1ccc(S(=O)(=O)NCc2ccc(Cl)cc2)cc1 1127149 YPZDOUMSZCPRLJ-UHFFFAOYSA-N 383.853 2.760 0 50 GFAA O=C(c1cc(-c2ccccc2)no1)N1CCc2nc(C3CCOCC3)nn2CC1 2356133771 CKCGOOCZSOEHCV-UHFFFAOYSA-N 393.447 2.526 0 50 GFAA COc1ccc(C(=O)N/C(=C\c2ccccc2)C(=O)N[C@@H](C(=O)O)C(C)C)cc1 2999560 CKSSKKOBJMOSRS-CWDSQJGSSA-N 396.443 2.692 0 50 GFAA biogenic OCC[C@@H]1CN(c2nc3ccccc3cc2CO)CCN1Cc1ccccc1 106986114 QSFORWDNUPNQGB-OAQYLSRUSA-N 377.488 2.800 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)c3ncoc3C3CC3)CC2)[C@H]1O 20601456 GLUFITDWFASVOT-QUCCMNQESA-N 381.476 2.703 0 50 GFAA COc1ccc(CCNC(=O)NS(=O)(=O)c2ccccc2Cl)cc1OC 22204862 APOHRYNKZLGLTI-UHFFFAOYSA-N 398.868 2.588 0 50 GFAA O=C(C1CCN(S(=O)(=O)Cc2ccccc2F)CC1)N1CCCCCC1 24612601 JIAVWPSDVKKKIR-UHFFFAOYSA-N 382.501 2.770 0 50 GFAA FC(F)(F)[C@@H](Nc1nc2nonc2nc1N1CCSCC1)c1ccccn1 11821127 FOMSRBJMPZIQJW-JTQLQIEISA-N 397.386 2.677 0 50 GFAA CC(=O)[C@H]1CC(C(=O)NCCCCN2CCC[C@H](C)C2)=NN1c1ccccc1 252458494 LRRWRQSKOUHGAF-LAUBAEHRSA-N 384.524 2.839 0 50 GFAA CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C 252516919 XWNSEMFEYYFBKI-HFBAOOFYSA-N 385.291 2.995 0 50 GFAA COc1cccc(NC(=O)CN2CCC(c3nnc4cc(C)ccn34)CC2)c1 252537166 KNKCDFPEORWKQY-UHFFFAOYSA-N 379.464 2.864 0 50 GFAA Cn1cc(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c(-c2ccoc2)n1 436432597 NLQCTBDQLBVPKX-UHFFFAOYSA-N 388.427 2.820 0 50 GFAA CCn1ccnc1CN(C(=O)[C@@H]1COc2ccccc21)[C@H]1CC12CCNCC2 328642114 QVTRJOJZGQITIH-MJGOQNOKSA-N 380.492 2.550 0 50 GFAA CN(Cc1cccc(N(C)C)c1)C(=O)NCc1ccnc(O[C@@H]2CCOC2)c1 152340923 NDVXCCABMMSWCZ-LJQANCHMSA-N 384.480 2.657 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCc3n[nH]c(=O)c4ccccc34)cc2)n1 72419512 YEVJKMKBQPALTL-UHFFFAOYSA-N 387.443 2.715 0 50 GFAA O=C(CCc1nnc(C2(c3ccc(Cl)cc3)CCC2)o1)N1CCOCC1 12478531 PLMAZDPPMRIUIQ-UHFFFAOYSA-N 375.856 2.984 0 50 GFAA Cn1cc(NC(=O)N2C[C@@H]3Oc4c(F)ccc(F)c4O[C@@H]3C2)c(C2CC2)n1 333457600 ZVSTYULWUCNPDC-OKILXGFUSA-N 376.363 2.632 0 50 GFAA COCc1ccccc1C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 371641620 HWCKBKHXSXCMBW-KRWDZBQOSA-N 380.423 2.975 0 50 GFAA Cc1cccc([C@@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCOCC2)c1 241515551 OGFIHOATNMMECE-QGZVFWFLSA-N 396.413 2.557 0 50 GFAA CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCC[C@@H](CC(=O)O)OC 43772101 UBKBNBIEPZZFBF-DHZSCDGNSA-N 386.529 2.892 0 50 GFAA in-vitro CCCCS(=O)(=O)NC[C@@H]1C[C@H](F)CN1C(=O)c1ccc(Cl)s1 82160810 KTRCNLOYLGQTSV-QWRGUYRKSA-N 382.910 2.674 0 50 GFAA COc1ccc(CNC(=O)Cn2nc(-c3ccccc3Cl)ccc2=O)cc1 49545833 TZPFJMRKMFBSJJ-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCNC(=O)[C@@H]2c2cccc(F)c2)cs1 426396667 UMHMZPKFKUBDHD-HNNXBMFYSA-N 376.457 2.788 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)C1 136108240 BREKILRDFPTFFU-NHYWBVRUSA-N 399.274 2.921 0 50 GFAA O=C1OCCN1Cc1nc([C@@H](O)c2ccccc2)nn1CCc1ccccc1 95506502 HNROANFQPRTFHM-IBGZPJMESA-N 378.432 2.555 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3cncnc3C)C2)c1 95517962 YTIVYGCXSSVAMA-KRWDZBQOSA-N 396.491 2.742 0 50 GFAA CCn1ncnc1[C@H](C)NC(=O)c1cnc(CSc2ccccc2)nc1O 91586943 XDYHFNPGIQHNNL-LBPRGKRZSA-N 384.465 2.577 0 50 GFAA Cc1nnnn1-c1cccc(C(=O)N2CCC(c3nccn3CC3CC3)CC2)c1 95498437 QSFFDUPELGJEDQ-UHFFFAOYSA-N 391.479 2.597 0 50 GFAA CCn1ccc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2ccccc2)C3)cc1=O 95524585 VHPQCGQNHAXVNL-UHFFFAOYSA-N 393.487 2.523 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N3CCC[C@H]3Cn3cccn3)CC2)cc1 534635086 JMFPZDMMYUFZDH-FQEVSTJZSA-N 395.507 2.670 0 50 GFAA Cc1csc(-c2cc(C(=O)N(C)Cc3ccon3)cc(-n3cnnn3)c2)c1 299765776 AOUMVUCLUJDNDA-UHFFFAOYSA-N 380.433 2.959 0 50 GFAA Cc1nn(C[C@@H](NC(=O)OCc2ccccc2)C(=O)O)c(C)c1Br 725346583 IVLZGEYCQQKATP-CYBMUJFWSA-N 396.241 2.642 0 50 GFAA O=C(CCCc1ccc(F)cc1)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 828003620 SYKTXSHCRGOQEY-AGXSTUJCSA-N 383.471 2.999 0 50 GFAA O=C1C[C@@H](CNS(=O)(=O)Cc2cc(F)ccc2Cl)CN1C1CCCC1 670458015 DFNHDRPBEONMLO-LBPRGKRZSA-N 388.892 2.690 0 50 GFAA Cn1nc(C(=O)N2CCC([C@@H]3C[C@@H](N)CCO3)CC2)cc1-c1ccc(F)cc1 1343670380 AOUWWFZETPNJLL-PXNSSMCTSA-N 386.471 2.585 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCC(CNC(=O)Cc2cccs2)CC1 952970039 NUJQQZVAEBCROV-UHFFFAOYSA-N 389.521 2.883 0 50 GFAA CCC(CC)n1cnc2c(-c3cnc(N)cn3)nc(N3C[C@@H]4CC[C@H](C3)O4)nc21 72315114 VZZGNDREIXJEAB-OKILXGFUSA-N 394.483 2.594 0 50 GFAA Cc1noc(C[C@H](NC(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc2)n1 277052456 CLKUECVIJGXRMF-ZDUSSCGKSA-N 379.342 2.694 0 50 GFAA CC1(C)CN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)CC2(CCCC2)O1 190800425 WJHGDPWWVRHYPP-QGZVFWFLSA-N 394.537 2.906 0 50 GFAA Cc1sc(-c2cc(C(F)(F)F)n[nH]2)cc1S(=O)(=O)N[C@H]1CCOC1 1506419783 XAXBFHMYSQMAKH-QMMMGPOBSA-N 381.401 2.533 0 50 GFAA CCNC(=O)N1C[C@@H]2CN(Cc3cccnc3N)C[C@@]2(CCc2ccccc2)C1 1772815608 PUJVFTUMQBIYRV-REWPJTCUSA-N 393.535 2.760 0 50 GFAA Cc1nc(C(=O)NC[C@H]2Cc3cccc(-c4ccc(C(N)=O)cc4)c3O2)cs1 11813781 XIDDUTCCSRRZEQ-MRXNPFEDSA-N 393.468 2.951 0 50 GFAA CCSc1nnc([C@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1C 12125288 INLRVPQEMNVDJS-VIFPVBQESA-N 394.444 2.985 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1c(F)cccc1F 12475712 SYPGMVUOZXQQHW-GOSISDBHSA-N 384.390 2.544 0 50 GFAA Cc1ccccc1C[C@]1(CO)CCCN(C(=O)c2n[nH]c(=O)c3ccccc23)C1 12717139 NNFTXXMVTMTFFY-HSZRJFAPSA-N 391.471 2.689 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@H](C2CCN(CCc3ccccc3)CC2)C1 19300729 ZLCZRSICPYBNKT-QFIPXVFZSA-N 379.504 2.737 0 50 GFAA Nc1nc(CN2CCN(Cc3ccccc3)CC2)nc(Nc2ccc(F)cc2)n1 19899204 IWCWEPQWFYAFFY-UHFFFAOYSA-N 393.470 2.654 0 50 GFAA CCc1nc(C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n(-c2cnn(C)c2)n1 1857671013 KWUDBBFHXXLSGR-AWEZNQCLSA-N 392.467 2.559 0 50 GFAA COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C(N)=O)c3ccccc3n2)C1 1857676861 UPIULWLERLPCTI-QFIPXVFZSA-N 375.428 2.655 0 50 GFAA Cc1[nH]nc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1Cl 1857697483 BAEAHDLVEVWVAJ-IBGZPJMESA-N 387.871 2.865 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)C[C@H]3CCCN3C)CC2)OCCC1=O 1857715431 RBTNUWCVQQIGLE-LJQANCHMSA-N 393.572 2.517 0 50 GFAA CCN1CCC[C@@H](CN(C)[C@@H](C)C(=O)N2CCCCCC2)[C@@H]1c1cnn(C)c1 328631789 KWXGCGNSFMNWAI-IRFCIJBXSA-N 389.588 2.916 0 50 GFAA Cc1cc(CCCC(=O)N[C@H](C)Cn2cc([C@@H](O)C3CC3)nn2)c(C)s1 1875338513 ZYIFPQOAAWPJQD-BLVKFPJESA-N 376.526 2.927 0 50 GFAA CC(=O)Oc1ccc(C=C(NC(=O)c2ccco2)C(=O)NCc2ccco2)cc1 2049286256 RJXSHUCRVPTFOI-UHFFFAOYSA-N 394.383 2.885 0 50 GFAA Cc1nc(C2CCNCC2)[nH]c1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1 2325768323 DEWUVNGJSOIJNT-UHFFFAOYSA-N 391.475 2.647 0 50 GFAA Cc1sc2ncn(CCC(=O)N3CCCc4c(CN)cccc43)c(=O)c2c1C 2325769128 JNHOZTBZUXDTTN-UHFFFAOYSA-N 396.516 2.903 0 50 GFAA COc1ccc([C@@H]2NC(=O)[C@@H](C3CC4(CCC4)C3)NC2=O)cc1Br 2325776907 MWYNDMUWVDPDEN-LSDHHAIUSA-N 393.281 2.694 0 50 GFAA O=C(Nc1ccnc(Sc2ccccn2)c1)[C@@H]1C[C@@H]2C[C@H](C1)C[C@@H](O)[C@H]2O 2325805591 UVQFGBZSYXGPKS-FUSWIWGXSA-N 385.489 2.724 0 50 GFAA CN1CC[C@](C)(CNC(=O)C[C@@H](NC(=O)c2ccc(O)cc2)c2ccccc2)C1 2325810594 SZSQBJLBQHWFNV-NFBKMPQASA-N 395.503 2.711 0 50 GFAA CCCN1CCC[C@]2(CCCN2S(=O)(=O)Cc2ccc(F)cc2F)C1=O 2356151227 YFGWMYSSWOBKIZ-SFHVURJKSA-N 386.464 2.662 0 50 GFAA COCCCN1C(=O)c2ccc(C(=O)Nc3cc(OC)ccc3OC)cc2C1=O 2334847 IQJRQIXTALAMBJ-UHFFFAOYSA-N 398.415 2.589 0 50 GFAA COc1ccc(CN2Cc3nnc(Cn4nc(C)c(C)c4C)n3[C@@H](C)C2=O)cc1 2356159643 KZUBERLCTBOPDV-INIZCTEOSA-N 394.479 2.560 0 50 GFAA O=C(c1ccc(-c2cnco2)cc1)N1CCc2nc(C3CCOCC3)nn2CC1 2356169721 XGJFWNAIFZDTTN-UHFFFAOYSA-N 393.447 2.526 0 50 GFAA CCNC(=O)c1c(NC(=O)CSc2nnc(C)o2)sc2c1CCCC2 55392905 UARUULKTGSNPHC-UHFFFAOYSA-N 380.495 2.799 0 50 GFAA CN1CC[C@H](CNC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 245822427 WHZMSAWQLLHOTB-MLGOLLRUSA-N 384.307 2.666 0 50 GFAA O=C(Nc1cnn(-c2ccc(C(=O)N3C[C@H]4CC[C@H]3C4)cc2)c1)C1CCOCC1 102672707 VDRXIPFAJWSRCI-YWZLYKJASA-N 394.475 2.862 0 50 GFAA O=C1Nc2cc(F)ccc2[C@@H]1CC(=O)N1CCC[C@H](OCc2cccnc2)C1 20993454 WENMNQTXBRSJEW-WMZOPIPTSA-N 383.423 2.854 0 50 GFAA CN(Cc1ccc2nsnc2c1)[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O 23129321 ABNVHOUAHSIOOS-UXHICEINSA-N 380.517 2.860 0 50 GFAA Cc1cc(N(C)C[C@@H]2CCC[C@@H]2O)nc([C@H](C)N(C)C[C@@H]2CCC[C@H]2O)n1 252477721 UPDBJVBVCQAZNM-FKSLSLAPSA-N 376.545 2.536 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@@H](O)c1ccccc1 67817994 DJRCXSBEDJTVSO-FQEVSTJZSA-N 376.460 2.505 0 50 GFAA CCOC(=O)c1cc(C(=O)Nc2sc3c(c2C(=O)OC)CCCC3)nn1C 1012066 XPDQCCCSFFZMHJ-UHFFFAOYSA-N 391.449 2.576 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)N[C@H]1CCc2nc(C(C)C)nn2C1 252508759 XSWQVONIOBZAQA-JTQLQIEISA-N 398.389 2.960 0 50 GFAA Cc1cc(N2CCCC2)nc(N2CCN(C(=O)CCc3ccccc3)CC2)n1 32498018 RMHSUUVOQGDFMJ-UHFFFAOYSA-N 379.508 2.667 0 50 GFAA C[C@H](O)CN1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3s2)[C@H](C)C1 240465968 GBTOFXCRADURRN-HZSPNIEDSA-N 379.551 2.690 0 50 GFAA O=C(NCc1ccc(Cn2cccn2)cc1)Nc1cnn(C[C@@H]2CCCO2)c1 363098317 LARVIVSGFZWWSP-IBGZPJMESA-N 380.452 2.629 0 50 GFAA COc1cc(CN2CCN(Cc3cnc(C)s3)C[C@H]2CCO)cc(OC)c1 39413463 LXGBZRRODUKCKL-QGZVFWFLSA-N 391.537 2.538 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(c2cccs2)CC1 156767213 DIPGYYQPYLAGIQ-LJQANCHMSA-N 396.516 2.625 0 50 GFAA CCCN(CCC)C(=O)c1cccc(C(=O)N2CCO[C@@H](c3nc(C)n[nH]3)C2)c1 173086715 KELPTJOEHPCHAN-GOSISDBHSA-N 399.495 2.589 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)O)C1CCN(C(=O)Nc2ccccc2)CC1 378183233 KVHMAWBJEJPCEV-LJQANCHMSA-N 395.459 2.743 0 50 GFAA CC(C)c1ncc(C(=O)N2CCc3[nH]nc(-c4ccccc4F)c3C2)c(=O)[nH]1 71415639 CFCRQLWHVUGFIS-UHFFFAOYSA-N 381.411 2.621 0 50 GFAA C[C@@H](c1nc(-c2ccc(N3CCCN(C)CC3)c(Cl)c2)no1)S(C)(=O)=O 289974313 CWJPHVATADIKPO-LBPRGKRZSA-N 398.916 2.638 0 50 GFAA CCN(CC)C(=O)c1cc(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)n(C)n1 20606066 NIMYWVVZLTXMBQ-UHFFFAOYSA-N 390.312 2.850 0 50 GFAA O=C([C@H]1CCCCN1Cc1ccccc1)N1CCC(O)(c2cccnc2)CC1 223296462 WFZOCKVSUWHQDT-OAQYLSRUSA-N 379.504 2.946 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cscn3)CC2)CN1CCc1ccccn1 91965757 YMOQOSBOEYBZGF-UHFFFAOYSA-N 384.505 2.626 0 50 GFAA O=C(c1ccc2nc(C(F)(F)F)[nH]c2c1)N1CCN(C2CCCC2)C(=O)C1 426652814 DYAVGKILHOZOHW-UHFFFAOYSA-N 380.370 2.809 0 50 GFAA C[C@H]1C[C@H](C)CN(CCCCNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1 237553590 XTMIQBIDGUOCJI-KBPBESRZSA-N 386.489 2.560 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2cc(Cl)c(C)c(Cl)c2)C[C@@H]1CO 91706316 OTTDJPNVFJUFSP-HUUCEWRRSA-N 389.323 2.561 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)cc1O 91493851 SNYDSFHMINAIBO-GOSISDBHSA-N 386.492 2.724 0 50 GFAA C[C@H](C(=O)NC1CC1)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95520614 IJOXVNNSKIZEGS-OAHLLOKOSA-N 389.927 2.822 0 50 GFAA CCc1nn2c(=O)cc(CN(C)Cc3ccc(-n4cccn4)cc3)nc2s1 244828622 TZRCVYLQTLIIQG-UHFFFAOYSA-N 380.477 2.531 0 50 GFAA Cc1ccc2c(C)c(C(=O)N[C@@H]3CCN(Cc4ccccn4)C[C@H]3O)oc2c1 252485521 GXOXGSZELOMGCP-RTBURBONSA-N 379.460 2.810 0 50 GFAA CN(C[C@H]1COCCO1)C(=O)c1cccc(-c2ccc3nccc(N)c3c2)c1 534634717 CMSTUCPVIFKARJ-SFHVURJKSA-N 377.444 2.971 0 50 GFAA Cc1cc2c(NC(=O)NC[C@H]3CCCN(c4ncccn4)C3)cccc2nn1 299803123 XKWIIHMBXQSWOO-OAHLLOKOSA-N 377.452 2.766 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)N[C@@H](CC(C)(C)C)c2cccnc2)cs1 823836839 HCQPAXTTYXIXLC-AWEZNQCLSA-N 381.523 2.959 0 50 GFAA Cc1ccc(C)c(OCCNC(=O)N2CCCC[C@@H]2CN2CCOCC2)c1 584904179 RNFUXMHOFDZTIC-LJQANCHMSA-N 375.513 2.579 0 50 GFAA Cc1c[nH]ccc1=NCCNCc1cccc(OCCCCN2CCOCC2)c1 952982591 YYHICABWIZIRFO-UHFFFAOYSA-N 398.551 2.505 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3[C@H](C(=O)O)C[C@@H]4CCCC[C@@H]43)n2)cc1 268950939 TVNGXMRPJPMBQR-XIRDDKMYSA-N 399.447 2.922 0 50 GFAA O=C(c1ccc(-c2noc(C(F)(F)F)n2)cc1)N1CC[C@@](O)(C(F)(F)F)C1 169994843 WBUWIZJLWYDWSY-ZDUSSCGKSA-N 395.259 2.895 0 50 GFAA Cc1ccc([C@H]2CCN(C(=O)c3ccc(=O)n(-c4cnn(C)c4)c3)C2)c(C)c1 279333922 CCIBZTBSKUKMCF-KRWDZBQOSA-N 376.460 2.818 0 50 GFAA CCc1cc2c(C)cc(=O)oc2cc1OC(=O)[C@@H]1CC12CCS(=O)(=O)CC2 193527216 SFWAANUSOBBKLG-HNNXBMFYSA-N 390.457 2.784 0 50 GFAA O=C(Nc1cc2nc(O)[nH]c2cc1N1CCCC1)[C@H]1Cc2ccccc2CN1 1506418907 WPBBZNJXAINZMU-GOSISDBHSA-N 377.448 2.522 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(S(=O)(=O)c3cc(OC)c(C)cc3OC)C[C@@H]21 1704337358 RFHXOBRUDYGIHY-ZRGWGRIASA-N 383.510 2.574 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(C/C(=C\C(C)C)c3ccccc3)C[C@]2(CO)C1 1772819030 NSSZXSJTSASWTI-FUDRQBCRSA-N 386.536 2.515 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@H](C(=O)NCC(F)(F)F)C3)nc2c1 11786959 NERVBYBSAVRBRN-LBPRGKRZSA-N 382.386 2.842 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@H](CNC(=O)Cn2nc(C)cc2C)O3)n1 11996048 QRIYVJNZTOMACL-LJQANCHMSA-N 391.475 2.694 0 50 GFAA COc1cc(C(C)=O)ccc1OCc1cc(C(=O)NCc2ccncc2)no1 12305745 ZVRDXEYIKVKVLH-UHFFFAOYSA-N 381.388 2.790 0 50 GFAA O=C(NCCN1CC[C@H](c2ccccc2)C1)c1cn(Cc2ccc(F)cc2)nn1 12575827 JQVCJSJHCVFCSY-IBGZPJMESA-N 393.466 2.685 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)nn2)n1 13009088 GHHVUUZAPBSTHP-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA CCOC(=O)c1c(-c2cccs2)csc1NC(=O)CN1CCOCC1 19902744 KMIPWJVRZJVEDC-UHFFFAOYSA-N 380.491 2.924 0 50 GFAA O=C(NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12)c1c(F)cccc1F 169776291 GLOCHEOCWGATBJ-UHFFFAOYSA-N 396.357 2.865 0 50 GFAA Cn1nc(C2CC2)cc1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857673102 NVVOGCLUVGJIGM-UHFFFAOYSA-N 375.476 2.939 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)O)C2(CCN(C(=O)C3CC=CC3)CC2)C1 1857686918 IARAPKNNNBBQHE-IBGZPJMESA-N 398.503 2.787 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)NC(C)C)C[C@]34CC[C@H]2O4)c1C 1857712533 QGNKXEOFKQIYLF-JZJXAQOMSA-N 385.508 2.631 0 50 GFAA COCC1(C(=O)NC[C@H]2[C@H]3CN(C4CCCCCC4)C[C@]34CC[C@H]2O4)CC1 1857720310 OJWVBNQVJAKCQO-JZJXAQOMSA-N 376.541 2.731 0 50 GFAA O=C(CCc1ccccc1O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857725602 FEKBYGVDWROJRX-NOXFTYBFSA-N 392.455 2.626 0 50 GFAA Cc1ccc(-c2nccn2[C@H]2C[C@H]3CO[C@@H](CCO)CN3C2)c2cccnc12 1857727950 GXAYNAUZCKEMMW-BZSNNMDCSA-N 378.476 2.803 0 50 GFAA Cn1cnc2cc(C(=O)N3CCCC[C@@H]3CNC(=O)c3ccccc3)ccc21 153215225 XWUMZBHCIJQKOL-GOSISDBHSA-N 376.460 2.998 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3ccc(Br)cn3)CCN2)c1 870149005 AJMUYNCUBJJEEC-MRXNPFEDSA-N 376.254 2.639 0 50 GFAA Cc1nccn1-c1cncc(N2CCC[C@@H](C3(C(=O)O)CC(F)(F)C3)C2)n1 1875283507 UZNLLIOTHVUUFT-CYBMUJFWSA-N 377.395 2.687 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccc(C)c(C)c3)CC2)cc1 807610 HJHDZFVWHFVJOQ-UHFFFAOYSA-N 387.505 2.773 0 50 GFAA Cn1c(=O)c2c(nc3n(-c4cccc(Cl)c4)c(-c4ccco4)cn23)n(C)c1=O 12324072 LBKDSEATESOWER-UHFFFAOYSA-N 395.806 2.589 0 50 GFAA O=C(/C=C/c1ccc2c(c1)OCO2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 13425502 KNCDCPNZLUQYET-ZZXKWVIFSA-N 394.427 2.502 0 50 GFAA C[C@H]1C(=O)Nc2cc(C(=O)O[C@H](Cn3cncn3)c3ccccc3)ccc2N1C 2325745742 UMWLUCHMJYXFIN-IFXJQAMLSA-N 391.431 2.653 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CC[C@@H]3SCCS[C@@H]32)c(Cl)c1 2325779867 MDDHWOAZHYAGHY-HZSPNIEDSA-N 391.967 2.853 0 50 GFAA Cc1cc(NC(=O)Cc2ccc3c(c2)ncn3C)ccc1N1CCN(C)CC1 2325798487 XRXWAYBTXBVRKO-UHFFFAOYSA-N 377.492 2.815 0 50 GFAA CCc1ccc(N2CCN(S(=O)(=O)c3cc(OC)ccc3OC)CC2)cc1 1109258 AAQKNBBBJFTMAV-UHFFFAOYSA-N 390.505 2.777 0 50 GFAA CCOc1cc(C=O)ccc1OCC(=O)Nc1ccccc1N1CCOCC1 4841157 BUDUDJJBCVPNEA-UHFFFAOYSA-N 384.432 2.752 0 50 GFAA Cc1ccc(OCC(=O)N2CCCN(C(=O)COc3ccc(C)cc3)CC2)cc1 8567297 NGXSUEISGRRXDB-UHFFFAOYSA-N 396.487 2.822 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3c(F)ccc(O)c3F)CC2)oc1C 225505313 TYVBNIBNLLKZSQ-UHFFFAOYSA-N 379.407 2.917 0 50 GFAA Cc1c(CN2CCN(c3ccc(F)cc3)CC2)c(=O)n(-c2ccccc2)n1C 23281568 QBPMDXPNZZGGES-UHFFFAOYSA-N 380.467 2.946 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(C(=O)c2cc(O)c(C)c(O)c2)C3)cc1 67872540 FQECNPHVZKFQTH-UHFFFAOYSA-N 391.427 2.952 0 50 GFAA Cn1ncc2c1C[C@@H](C(=O)Nc1nc3ccccc3nc1N1CCCC1)CC2 280972318 LAEVWUKIPDIMGM-AWEZNQCLSA-N 376.464 2.707 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cc3ccccc3o2)c1 71765070 PZTCYAHAPQKRLR-UHFFFAOYSA-N 375.402 2.723 0 50 GFAA CN(C(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(Cl)nc1 328599034 PXCSBANOATZKOX-MRXNPFEDSA-N 393.896 2.941 0 50 GFAA CC(C)Cn1ncc(C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)c1C1CC1 153621401 CWWSMNLUWDSLIE-INIZCTEOSA-N 397.523 2.967 0 50 GFAA CCCCN1C(=O)c2ccc(C(=O)N3CCC([C@@H]4CCOC4)CC3)cc2C1=O 371776838 CGWXXZUMSMPCQJ-QGZVFWFLSA-N 384.476 2.971 0 50 GFAA O=C(N1CCO[C@@]2(CNCCOC2)C1)C1(c2ccc(Cl)cc2)CCCCC1 72140227 DETSQHBZPQGMTK-FQEVSTJZSA-N 392.927 2.759 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C)[C@@H](n2ccnc2)C1)c1ccc2c(c1)OCCO2 129707935 BNDDBLWYCSSWKF-DFEOGRTESA-N 398.507 2.803 0 50 GFAA Cc1cc(CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)nc(N(C)C)n1 241515630 OGQCGIKKCQCZAY-CQSZACIVSA-N 377.439 2.821 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@H](C)CN(C)C[C@H]1C)c1ccc2c(c1)OCCCO2 241816006 SEVCPFYAKYBLMP-YVHKJVDXSA-N 389.540 2.686 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)NCc2ccccc2F)n1 44916460 FOOLKWIISSFFHZ-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA C[C@@](O)(CCNc1cc(S(=O)(=O)N2CCCC2)ccn1)c1ccccc1 286814617 XRJIEPXGQNCQHG-LJQANCHMSA-N 375.494 2.576 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCCNCC4)csc3C2)nc1 426409230 XPMYKZGJBZIJAM-UHFFFAOYSA-N 384.549 2.699 0 50 GFAA CCOc1ccccc1CN1CCN(C(=O)c2cnc(C3CC3)nc2N)[C@H](C)C1 288040469 DSFLGKOPAUTCOD-OAHLLOKOSA-N 395.507 2.681 0 50 GFAA Cc1c[nH]ccc1=NCCNC(=O)N1CCC[C@H]1c1ccc(CN(C)C)cc1 426501749 ITMNORAAJRHGNV-NRFANRHFSA-N 381.524 2.832 0 50 GFAA O=C(NC1CCN(Cc2ccco2)CC1)c1cnc(-c2ccccc2)nc1O 92065338 ASGKSRDMXLJKFT-UHFFFAOYSA-N 378.432 2.837 0 50 GFAA COC[C@H](c1ccccn1)N(C)C(=O)Nc1ccc(Cc2nc(C)n[nH]2)cc1 96136344 KLZGGAFSIXWBFY-GOSISDBHSA-N 380.452 2.950 0 50 GFAA CCc1ccc(NC(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)cc1 91987791 JHSYWOXDEQTNHW-MJGOQNOKSA-N 389.496 2.668 0 50 GFAA O=C(NCC[C@H]1CCCCN1)c1ccc(-c2ccc(-c3nn[nH]n3)cc2)cc1 426435421 OROLGWJYJVHPEK-LJQANCHMSA-N 376.464 2.796 0 50 GFAA CN1CCN(C(=O)N(C)CC2CCN(CCc3ccc(Cl)cc3)CC2)CC1 95508619 NDYMAFQAVTVBEN-UHFFFAOYSA-N 392.975 2.894 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)C[C@H]2CN(C(C)C)CCO2)CC1 95499609 AHVABQXDCMJIGM-IBGZPJMESA-N 376.545 2.889 0 50 GFAA NC(=O)Cn1ccnc1C1CCN(Cc2cccc(F)c2C(F)(F)F)CC1 95520758 WXTBMTKFWPRKAN-UHFFFAOYSA-N 384.377 2.906 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)[C@@H]1Cc3ccccc3S1)CC2 92028810 YKNIUYGMXSNTIG-SFHVURJKSA-N 382.533 2.822 0 50 GFAA CC(C)CCOc1ccccc1CCNC(=O)N1CCC[C@H]1C(=O)N(C)C 584899740 BEUKRJQSDVFQFH-SFHVURJKSA-N 375.513 2.916 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@H]3CN(C(=O)c4ccncc4)CC[C@@H]32)[nH]n1 43631890 LIRXVSVGNHUXDS-PXNSSMCTSA-N 395.507 2.770 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)NC1CCOCC1)CC2 276496852 PEDJRNDQRGIGCF-GOSISDBHSA-N 391.537 2.840 0 50 GFAA CC1(C)OCC(C)(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CO1 270915413 CAQWXTFITJYVPC-UHFFFAOYSA-N 382.451 2.835 0 50 GFAA O=C(NCc1cccnc1-n1cccn1)c1cc(F)cc(Br)c1O 170606233 OIZLGZIWJSYJIE-UHFFFAOYSA-N 391.200 2.805 0 50 GFAA CC(=O)Nc1ccncc1NS(=O)(=O)c1cc(Br)ccc1F 170609094 XOFIPXIDHGQPIW-UHFFFAOYSA-N 388.218 2.742 0 50 GFAA Cc1ccccc1N1CCN(C(=O)C2CCN(C(=O)N3CCCC3)CC2)CC1 192609677 CINUVSLBXUJZLH-UHFFFAOYSA-N 384.524 2.571 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)[C@@H]1COCCN1C1CCCC1 195096610 CVTRSPMSAUGQNT-QFIPXVFZSA-N 396.535 2.808 0 50 GFAA COC(=O)c1ccc(-c2ccc(C(=O)OC)c(C(=O)OC)c2)cc1C(=O)OC 135734449 NJIGQKCRWMSZBA-UHFFFAOYSA-N 386.356 2.500 0 50 GFAA Cc1cccn2ncc(C(=O)NC3CCN(C(=O)NC4CCCCC4)CC3)c12 1772708173 DWYOIUWVWHQEMO-UHFFFAOYSA-N 383.496 2.879 0 50 GFAA Cc1ccc(CN2C[C@@H]3CN(C4CCOCC4)C[C@]3(CCC(=O)O)C2)s1 1772703348 ZSTCMDBAWGYLOX-UZLBHIALSA-N 378.538 2.834 0 50 GFAA COc1ncc(CN2CC[C@@]3(CCCN(Cc4ccccc4F)C3=O)C2)cn1 11708294 CSHNIXZFSKWOKU-NRFANRHFSA-N 384.455 2.639 0 50 GFAA Cc1nc(C(=O)NC[C@@H]2Cc3cccc(-c4ccc(C(N)=O)cc4)c3O2)cs1 11813780 XIDDUTCCSRRZEQ-INIZCTEOSA-N 393.468 2.951 0 50 GFAA CCOC(=O)N1CCC(NC(=O)[C@H]2CC23CCN(Cc2ccoc2)CC3)CC1 12053212 GHBBVLDCGJQNMQ-GOSISDBHSA-N 389.496 2.619 0 50 GFAA CCc1nnc(SCC(=O)N2CCC[C@H](Nc3ccc(OC)cc3)C2)o1 12440981 OHMYAEUPEYBNHO-AWEZNQCLSA-N 376.482 2.836 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1)NCc1cccnc1 12448968 IAZQUFQUOSRCHG-OAQYLSRUSA-N 393.487 2.720 0 50 GFAA O=C(c1cn(C[C@@H]2CCCN(CCCc3ccccc3)C2)nn1)N1CCCC1 15000839 UMPHGOWNFZQSGU-HXUWFJFHSA-N 381.524 2.859 0 50 GFAA O=C(NC1CCCC1)[C@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860080 JKZDDIKRGOPDOO-HNNXBMFYSA-N 384.929 2.941 0 50 GFAA O=C1C[C@@H](NC(=O)c2cc3c(s2)C2(CCNCC2)OCC3)c2ccccc2N1 1857699609 VXTUYTGLIJAYHM-MRXNPFEDSA-N 397.500 2.713 0 50 GFAA COCCn1ccnc1-c1nccn1C12C[C@H]3C[C@@H](CC(n4cncn4)(C3)C1)C2 1857708315 NCKAQTNXTCDOAA-FBIZOPLVSA-N 393.495 2.689 0 50 GFAA CCCNC(=O)[C@@]12CCCCN1C[C@@H](NC(=O)c1conc1-c1ccccc1)C2 1875247802 OXMSVNLUDGVWLK-JTSKRJEESA-N 396.491 2.595 0 50 GFAA Cc1nc(CC(=O)N2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)cs1 132223542 CESUOKZDRFYNIY-OAHLLOKOSA-N 383.395 2.713 0 50 GFAA CC(C)(C(=O)N1CC[C@@H](NS(C)(=O)=O)C1)c1ccc(-c2ccccc2)cc1 152200076 SLXLEKCNFZTLBC-LJQANCHMSA-N 386.517 2.781 0 50 GFAA O=C(NCC1(C(=O)O)CC1)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 263389837 COVINGRMDRHKFQ-ZDUSSCGKSA-N 385.247 2.579 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)C=C1CCNCC1)CC2 952893781 JIRNWGQQENLPES-LJQANCHMSA-N 387.549 2.788 0 50 GFAA Cc1nnc(CCC(=O)N2CCN([C@@H](c3ccccc3)C(F)(F)F)CC2)n1C 1875280482 NENUPCLJRNULMG-SFHVURJKSA-N 395.429 2.504 0 50 GFAA O=C(N[C@@H]1c2ccccc2CC[C@H]1N1CCCC1)c1cnc2sccn2c1=O 892266241 DSJJDRZGPKNLTB-QZTJIDSGSA-N 394.500 2.638 0 50 GFAA Cc1cccc([C@H](C)C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)CCc2cnccn2)c1 1775991284 KGBDFBLFJKDIGU-WMQCIHAUSA-N 392.503 2.723 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cc3ccccc3oc2=O)c1 703471 UTOUEFUZPLOMCD-UHFFFAOYSA-N 381.340 2.619 0 50 GFAA Cc1nccnc1N1CCN(C(=O)[C@@H](C)n2ccnc2-c2ccccc2)CC1 2325749149 OFTXLHBXTIVFFU-QGZVFWFLSA-N 376.464 2.558 0 50 GFAA CC(C)c1nc(CCNC(=O)c2cc(Cl)ccc2OCCN(C)C)n(C)n1 2325770145 JFGNILJCFZCMCV-UHFFFAOYSA-N 393.919 2.505 0 50 GFAA Cc1c(CNS(=O)(=O)NCc2ccc(F)cc2)noc1-c1ccccc1 2325818988 LBBJQPCDZHERRR-UHFFFAOYSA-N 375.425 2.913 0 50 GFAA O=C(CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NCc1cccnc1 706963 APAWFOQKZZVRKQ-UHFFFAOYSA-N 386.502 2.667 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(OC)cc2)cc1 1115319 WIYAYHOBQVHZGC-UHFFFAOYSA-N 398.506 2.527 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(Cc2cnn(-c3ccccc3F)c2)C1 2356144082 IRJOPGJHYGLUTL-OAQYLSRUSA-N 378.455 2.694 0 50 GFAA CN(CCC[C@H]1CCCO1)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356145430 BTCCDYVVIKXBQK-HNNXBMFYSA-N 378.538 2.931 0 50 GFAA Cc1ncc(CN2CCC3(CCc4c(O)nc(-c5cccnc5)nc43)CC2)cn1 2356169552 UGBHGCBHKCPKFT-UHFFFAOYSA-N 388.475 2.823 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1OC 7708564 RIXDQOMWQNNNCV-UHFFFAOYSA-N 376.434 2.631 0 50 GFAA NC(=O)COc1cccc(C(=O)Nc2ccnn2Cc2cccc(Cl)c2)c1 55119033 UGBJHBVUQHGPIU-UHFFFAOYSA-N 384.823 2.701 0 50 GFAA COC(=O)c1ccc(Cl)c(NC(=O)CN2CCN(c3ccccc3)CC2)c1 55554748 FZUMRQNXHOPUTJ-UHFFFAOYSA-N 387.867 2.887 0 50 GFAA Cn1c(C(=O)N2CCN(C(=O)COc3ccccc3)CC2)cc2ccccc21 20721575 JKLWCNJPNBRGBK-UHFFFAOYSA-N 377.444 2.542 0 50 GFAA O=C(c1ccc(NC[C@H]2CCCO2)nc1)N1CCC(Oc2cccnc2)CC1 67818881 OYXMAHMUVHOPSD-GOSISDBHSA-N 382.464 2.751 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3cnccc3N(C)C)CC2)cn1 252508262 XIMZYRJAMIFUED-MRXNPFEDSA-N 382.512 2.715 0 50 GFAA CS(=O)(=O)c1ccc2c(c1)CCN([C@@H]1CCCN(c3ccccc3)C1=O)CC2 328680846 CGPZOEQWCAHATE-OAQYLSRUSA-N 398.528 2.686 0 50 GFAA Cc1ccc(Sc2cc(N3CCC(c4cc(=O)[nH]cn4)CC3)nc(N)n2)cc1 32541251 JEZFAYNZOKWXHJ-UHFFFAOYSA-N 394.504 2.986 0 50 GFAA CN1C[C@]2(CCN(C(=O)c3ccccc3OC(F)(F)C(F)F)C2)OC1=O 219483931 HSAHBWUUEKUECG-HNNXBMFYSA-N 376.306 2.590 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3ccc4[nH]c(CO)nc4c3)C[C@H]2N(C)C)cc1 77542112 CJVQCYRKSZIXMU-FXAWDEMLSA-N 378.476 2.533 0 50 GFAA COc1cc(-n2cccc2)c(Cl)cc1C(=O)N1CCC[C@H](NC(C)=O)C1 124784203 RHWPKAVXEVBJIY-AWEZNQCLSA-N 375.856 2.880 0 50 GFAA O=C(c1ccc[nH]1)N1CCN(Cc2cccc(OCc3ccccn3)c2)CC1 215276689 UTYSOQLBXHXPIL-UHFFFAOYSA-N 376.460 2.947 0 50 GFAA COc1cc(CN(C)Cc2cc(C)no2)ccc1OC[C@@H](O)CN(C)C(C)C 12745018 ZPKKZNGDHFGXPP-SFHVURJKSA-N 391.512 2.704 0 50 GFAA CC1(C)CN(CC2(CN3CC(C)(C)[C@@H]3[C@H]3CCCO3)COC2)[C@H]1[C@@H]1CCCO1 368076578 VCNOIJRLNLJAHM-YRPNKDGESA-N 392.584 2.782 0 50 GFAA C[C@@H]1Oc2ccccc2[C@H]1NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 377606527 NKENEEWLOHXORA-SGTLLEGYSA-N 387.461 2.652 0 50 GFAA COC(=O)[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(C(=O)OCc2ccccc2)C1 72194251 BOZPQGHPJKFXML-JKSUJKDBSA-N 392.452 2.711 0 50 GFAA Cn1c(=O)c(C(=O)N2CCN(Cc3cccc(F)c3)CC2)cc2ccccc21 72408991 LLSATLQCYCIKOD-UHFFFAOYSA-N 379.435 2.636 0 50 GFAA C[C@H](NC(=O)N1CC[C@H](N2CCCC2)[C@H]1C)C(=O)N1c2ccccc2C[C@@H]1C 334095074 QZKQXNHZZGAMMC-BMFAXAFESA-N 384.524 2.621 0 50 GFAA Cc1nc(C(C)C)cc(N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)n1 71750127 IBUWBXUWCQQWLI-QGZVFWFLSA-N 385.556 2.868 0 50 GFAA OCCCNc1nc(N2CCN(Cc3ccccc3)CC2)nc2ccccc12 41150369 NWYGQTKYDAMFSN-UHFFFAOYSA-N 377.492 2.746 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)COc3ccc(C(C)C)c(C)c3)C2=O)n(C)n1 174994456 UPGMIFCZJHDEMJ-LJQANCHMSA-N 398.507 2.851 0 50 GFAA O=C(NCCN1CCCc2ccccc21)N(Cc1cocn1)Cc1cocn1 426423854 YWZWFDYRNNUQSR-UHFFFAOYSA-N 381.436 2.827 0 50 GFAA CCn1cc(C(=O)N2C[C@H](c3cccc(OC)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95362068 CFEWQDXDRNNHPS-NJDAHSKKSA-N 380.492 2.614 0 50 GFAA Cc1cc(N2CCC(N(C)Cc3cc(-c4ccccc4)[nH]n3)CC2)nc(N)n1 95363733 PZVZMYYZANYINB-UHFFFAOYSA-N 377.496 2.858 0 50 GFAA Cc1ccc(-n2cnnn2)c(NC(=O)N2CCc3[nH]nc(C4CCC4)c3C2)c1 95531137 USLSHWBSVCSOHW-UHFFFAOYSA-N 378.440 2.552 0 50 GFAA Cc1cnc(OC(C)C)c(NC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1 296734302 ABRZQFDWQLKIAM-INIZCTEOSA-N 376.501 2.894 0 50 GFAA CC(C)C(=O)N1CCC[C@@H](NS(=O)(=O)Cc2ccc(Cl)cc2F)C1 825524466 QRADEVYRXAYEIT-CQSZACIVSA-N 376.881 2.546 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccc2c(c1)CCCO2 827968275 LXXWGAZISGSCCQ-UHFFFAOYSA-N 396.443 2.502 0 50 GFAA Cc1cccc(CN(C[C@@H]2CCCO2)C(=O)NCc2cnc3cnccn23)c1 584893370 IQYMTVFFZJDQKF-IBGZPJMESA-N 379.464 2.929 0 50 GFAA Cc1ccc(OCC(=O)N2CCC[C@H](CNC(=O)Cc3cccnc3)C2)cc1C 952973852 IGHMTRKBFLNIIY-HXUWFJFHSA-N 395.503 2.675 0 50 GFAA CSCC[C@H](C(=O)Nc1ccc(O)cc1)n1c(O)nc2ccccc2c1=O 888089983 SSWCUESAYHRFNH-MRXNPFEDSA-N 385.445 2.741 0 50 GFAA CN(CC(=O)N1C[C@@H]2CC[C@H]1CN(Cc1ccccc1)C2)Cc1cccnc1 1565529049 OUWANJIOMVQKPP-YADHBBJMSA-N 378.520 2.636 0 50 GFAA O=C(Cn1cc2ccccc2n1)N1C[C@@H]2CC[C@H]1CN(Cc1ccccn1)C2 1565514367 CWHNZJURZPPHDP-XLIONFOSSA-N 375.476 2.554 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N(Cc1ccncc1)C[C@H]1CCCO1 952972366 JPMPCHWKLJPQPI-LJQANCHMSA-N 391.471 2.913 0 50 GFAA C[C@H]1CN(c2ccc(CNC(=O)c3cc(COC(C)(C)C)on3)cn2)CCO1 185199815 OUMPPNNBCKMQCQ-AWEZNQCLSA-N 388.468 2.540 0 50 GFAA CC(C)(C)OC(=O)N1CC(S(=O)(=O)c2ccc(Br)cc2)C1 90635729 GBYNEEZSXKSQCS-UHFFFAOYSA-N 376.272 2.842 0 50 GFAA in-vitro CCN1CCN(C(=O)CCCc2nc(-c3ccc(F)cc3)no2)C(C)(C)C1=O 188177296 JTCIQYKRCYFKFE-UHFFFAOYSA-N 388.443 2.668 0 50 GFAA CC(C)CN1CCN(C(=O)c2cnc(-c3ccc4c(c3)CCO4)s2)CC1=O 188640870 KOQIFQOHPDOOKC-UHFFFAOYSA-N 385.489 2.685 0 50 GFAA Cc1oc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)N(C)C[C@H]1CCOC1 1506396102 HQQZYXJVBHMYLQ-SNVBAGLBSA-N 394.371 2.919 0 50 GFAA Cc1cccc(Cc2nnc(NC(=O)c3cn([C@H]4CC[C@@H](N)CC4)nn3)s2)c1 1529189893 BGNSJQOARHVVPR-GASCZTMLSA-N 397.508 2.724 0 50 GFAA Cc1c([C@H](C)NC(=O)CN2CCOc3ccccc3C2)cnn1-c1ccccn1 12320892 SFIGPZKVWFMOPK-INIZCTEOSA-N 391.475 2.648 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)NCCc2ccc(O)cc2)o1 12597054 PBWPSIPYXNCSNO-UHFFFAOYSA-N 395.459 2.861 0 50 GFAA Cc1c(CC(=O)N[C@@H](C)C(N)=O)c2c(n1C1CCCCC1)CC(C)(C)CC2=O 12705975 MQJYUNDNWCXELL-ZDUSSCGKSA-N 387.524 2.989 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CCCN(CCC)CC3)nc2)on1 12707394 ZIPDHMFJASRXGT-UHFFFAOYSA-N 385.512 2.874 0 50 GFAA O=C(NCCCn1nnc2ccccc21)c1cc(COc2ccccc2)on1 12708626 YVARVTGQPCHXEF-UHFFFAOYSA-N 377.404 2.818 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CC(O)=Nc3nc(N4CCCCC4)nc(N)c32)cc1 13690956 AIPJJISWFWBLKH-CQSZACIVSA-N 396.451 2.772 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2C)CCCN(C(=O)CCCn2cncn2)C1 15070700 RMYWUZIWGWSZAA-JOCHJYFZSA-N 398.507 2.781 0 50 GFAA CCc1nc(C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n(CC(C)(C)O)n1 1857668685 CJMBFIVGXDGGPH-AWEZNQCLSA-N 384.484 2.607 0 50 GFAA CCc1nc(C[C@H]2CCCN(c3nc4ncccc4o3)C2)n(-c2cnn(C)c2)n1 1857671014 KWUDBBFHXXLSGR-CQSZACIVSA-N 392.467 2.559 0 50 GFAA COc1ccc(C(=O)NCc2cnn(C)c2)cc1Oc1cccc(OC)c1CN 1857684381 LRJKKKYYPWSLSB-UHFFFAOYSA-N 396.447 2.618 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)NCCc1nc2ccccc2s1 1857706062 IPUPAPNTZBUVIK-UHFFFAOYSA-N 388.518 2.870 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Cl)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1857713208 LFKMFLDLHWIFNI-MEBBXXQBSA-N 385.773 2.824 0 50 GFAA Cc1cccc(-c2ncc(CN3C[C@@H]4[C@H](CN(C)C)[C@H]5CC[C@]4(C3)O5)cn2)c1 1857715335 NBDGRFIOJOSGBY-ZZLPTCMGSA-N 378.520 2.993 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)CCc4nc5ccccc5s4)[C@@H]2CC(=O)N13 1857733241 AZAKIUVPLDENRN-XPIZARPCSA-N 399.516 2.813 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)cc1 1058800 ZDCZXHYKEDGPMY-INIZCTEOSA-N 384.413 2.767 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@H](N=c2ccn3ncc(Br)c3[nH]2)C1 1857781115 MDPPTHYJSQTQSQ-LLVKDONJSA-N 396.289 2.725 0 50 GFAA Cc1cccc([C@@H](CNC(=O)[C@@H]2CCCC23CCNCC3)N2CCOCC2)c1 1875277115 IUTCGYYBVDAXGL-LEWJYISDSA-N 385.552 2.654 0 50 GFAA Cc1sc2nc(CCC(=O)N3Cc4ccccc4[C@@H](N)C3)nc(O)c2c1C 1875292426 HYHFANADFQXDKS-HNNXBMFYSA-N 382.489 2.989 0 50 GFAA COc1ccc(F)c(N2CCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)c1 1875394941 CFXMLKCNMMPOJH-QWHCGFSZSA-N 388.443 2.542 0 50 GFAA N=[S@]1(=O)CCC[C@@]2(CCCN2C(=O)c2cnn(-c3ccccc3F)c2)C1 1875395353 BQFXEMYUIUEGQS-QYBDOPJKSA-N 376.457 2.827 0 50 GFAA Cc1cccnc1C(=O)NC1(C2CCN(c3ncnc4onc(C)c34)CC2)CC1 1775990915 ICJBUZXDGSVBHC-UHFFFAOYSA-N 392.463 2.809 0 50 GFAA CC1(NC(=O)c2cccs2)CCN(C(=O)c2cn(-c3ccccc3)nn2)CC1 1775989053 AZJQHDDLDBSJOW-UHFFFAOYSA-N 395.488 2.754 0 50 GFAA C[C@@H]1C(=O)Nc2cc(C(=O)O[C@H](Cn3cncn3)c3ccccc3)ccc2N1C 2325745741 UMWLUCHMJYXFIN-AUUYWEPGSA-N 391.431 2.653 0 50 GFAA COc1cc(C(=O)N[C@H](C)C(=O)Nc2csc(C)c2)cc(OC)c1OC 2325760400 GPMFPWUHOZTAOJ-LLVKDONJSA-N 378.450 2.839 0 50 GFAA N[C@H]1CCc2cc(C(=O)N3CCC(CCc4cccnc4)CC3)ccc2NC1=O 2325769187 SPANAZJUTKPROG-FQEVSTJZSA-N 392.503 2.779 0 50 GFAA O=C([C@@H](c1ccccc1)n1sc2ccccc2c1=O)N1CC2(CCNCC2)C1 2325795756 WYBZAFAMONSKFE-LJQANCHMSA-N 393.512 2.864 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(OC)cc2OC)cc1 862584 DTCPWQYFLARWMP-IBGZPJMESA-N 397.431 2.979 0 50 GFAA O=C(CNS(=O)(=O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1 1144026 MRPZTOMVNXDFSC-UHFFFAOYSA-N 390.480 2.585 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2cc(-c3ccccc3)no2)C1=O 2356164832 IOSSBBSKKQWLKT-OAQYLSRUSA-N 383.448 2.585 0 50 GFAA CCOc1ccccc1NC(=O)CN(CC)S(=O)(=O)c1ccc(F)cc1 4857663 QBMZBRCVQRMDOC-UHFFFAOYSA-N 380.441 2.874 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)[C@@H]1COc2ccccc21 113037721 GNZMAAKSPSOATN-MRXNPFEDSA-N 388.489 2.556 0 50 GFAA CC[C@@H](CNC(=O)c1cc(C)sc1NC(=O)C(C)(C)C)N1CCOCC1 55199459 ZWZKEAWBZNHXJH-AWEZNQCLSA-N 381.542 2.882 0 50 GFAA Cc1cc(C)c2[nH]c(C(=O)N3CCC(Cn4cc(CN)nn4)CC3)c(C)c2c1 23542069 CHOZGVSOHHZNBS-UHFFFAOYSA-N 380.496 2.696 0 50 GFAA Cc1nonc1CN(C)C(=O)c1coc(COc2cccc3cccnc23)n1 67840831 NAMWVZRHLJXEGO-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA Cc1n[nH]c(C)c1CN(C)c1ccc(C(=O)NCC[C@@H]2CCCCN2C)cn1 20209135 UPJITLSQIRSVPN-SFHVURJKSA-N 384.528 2.662 0 50 GFAA COc1cccc(CN2CCN(Cc3cc(CC(C)C)[nH]n3)C[C@@H]2CCO)c1 20455718 BOFLETROIGNYDD-NRFANRHFSA-N 386.540 2.686 0 50 GFAA CN(C(=O)c1ccoc1C1(O)CCOCC1)[C@@H]1CCCN(c2ccccc2)C1=O 253418616 SZNFAWNCFVLCJK-GOSISDBHSA-N 398.459 2.545 0 50 GFAA O=c1nc2sccn2c2ccc(S(=O)(=O)N3CCc4ccccc43)cc12 4709566 HVUXJQPMWVOXEN-UHFFFAOYSA-N 383.454 2.661 0 50 GFAA Cc1cccnc1CN(Cc1ccccc1)C(=O)[C@H]1CC2(CCNCC2)CN1 72129589 UIFIEJOASRGUDM-HXUWFJFHSA-N 378.520 2.651 0 50 GFAA CCOc1ccc(C(=O)N2CCC(NCc3ccc(C(=O)NC)cc3)CC2)cc1 126326915 QMGOQZPKKZXJSG-UHFFFAOYSA-N 395.503 2.839 0 50 GFAA NC(=O)CC1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)CC1 173948374 KAPQGPUILWPTGG-OAHLLOKOSA-N 378.904 2.606 0 50 GFAA Cc1c(NCC(C)(C)C)cccc1C(=O)N1CCC[C@@](O)(Cn2ccnn2)C1 284977520 YLFCMVCHLRTASZ-NRFANRHFSA-N 385.512 2.712 0 50 GFAA Cc1cccc2c3c([nH]c12)CCN(C(=O)CC[C@@]1(CCC(=O)O)CCC(=O)N1)C3 222747354 YNVSXIUHVJANDL-JOCHJYFZSA-N 397.475 2.655 0 50 GFAA COCCN1CC[C@H](CNC(=O)N2CCC(c3ccccc3OC)CC2)C1 426515541 NZSUHOKVRYJLPW-QGZVFWFLSA-N 375.513 2.553 0 50 GFAA Cn1c(N2CC[C@H](O)C2)nc2cc(C(=O)NCc3ccc4cc[nH]c4c3)ccc21 95374028 UGBJFQFULKRXBR-KRWDZBQOSA-N 389.459 2.556 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCC[C@H](c4nnc(CO)n4C)C3)cc2s1 95530839 ACOAHPXXENBJTQ-LBPRGKRZSA-N 386.481 2.637 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1C[C@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95503871 LILRQERXTBNQCH-DUXKGJEZSA-N 398.457 2.879 0 50 GFAA O=C(O)[C@@H]1[C@H](C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)[C@H]2CC[C@H]1O2 239305875 GDCZQRJGPIDFRI-FPCVCCKLSA-N 399.274 2.520 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc(NC(=O)N2CC(c3cccnc3)C2)cc1 95517087 VNRDNVZWOIAFQX-IBGZPJMESA-N 380.448 2.622 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccccc1CC)CC2 91486087 QZTNWCXJFDNCMA-UHFFFAOYSA-N 380.492 2.898 0 50 GFAA O=C(CCSc1nc(O)c2ccccc2n1)N[C@@H](C(=O)O)c1ccccc1 252535700 GPNZPQFJJHTISQ-MRXNPFEDSA-N 383.429 2.760 0 50 GFAA O=C(NCCCC(=O)N1CCCC[C@H]1c1nc2ccccc2[nH]1)c1cnccn1 253402958 GUQZOKJOEDQLRZ-SFHVURJKSA-N 392.463 2.617 0 50 GFAA CC(=O)N1CCCN(c2nccc(-c3cnn(-c4ccc(F)cc4)c3)n2)CC1 48294063 SPZGLFMREAOZSS-UHFFFAOYSA-N 380.427 2.527 0 50 GFAA CCCCN1CCn2nc(CNC(=O)[C@H](O)c3cccc(Cl)c3)cc2C1 299761639 YNQZJFYHFIJGAI-GOSISDBHSA-N 376.888 2.502 0 50 GFAA O=C(NCCc1nc2c(s1)CCC2)c1ccc(CSc2nnc[nH]2)o1 299763080 YHBYPWUBCYGZHT-UHFFFAOYSA-N 375.479 2.608 0 50 GFAA C[C@@H](C(=O)NCc1nncn1C1CCCCC1)c1nnc(O)c2ccccc12 827654309 IVOXQJJYCYLJPD-CYBMUJFWSA-N 380.452 2.852 0 50 GFAA COc1cccc2c1OC[C@@H](NCc1cc3c(nc1OC)CN(C(C)C)C3=O)C2 952982479 LZWKOKYYARVYNT-INIZCTEOSA-N 397.475 2.556 0 50 GFAA COc1ccc(CNC(=O)CCCCCN2C(=O)c3ccncc3C2=O)cc1 951723476 RGFGKXLMWBHUBF-UHFFFAOYSA-N 381.432 2.563 0 50 GFAA CCc1nc(SCC(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccc2)C3)n[nH]1 1565525219 MXPYHWDXKKPQHP-SJORKVTESA-N 385.537 2.582 0 50 GFAA CC(C)c1cc(NC(=O)C(=O)Nc2ccc(N3CCC3=O)cc2)n(C(C)C)n1 408518874 GWQZZNLKGDFCFH-UHFFFAOYSA-N 383.452 2.901 0 50 GFAA CC(C)(C)C(=O)Nc1ccncc1C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 170595222 JCMRAKUPPPHWGS-GOSISDBHSA-N 394.475 2.992 0 50 GFAA COc1cc(C2=N/C(=C\c3ccc(OC(C)=O)cc3)C(=O)O2)cc(OC)c1OC 1041650 GUDFGQPCMXVXFG-SXGWCWSVSA-N 397.383 2.982 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704337690 BTFVWMKZVYDIJE-IBGZPJMESA-N 381.476 2.569 0 50 GFAA CC(C)Cn1c(CN(CC2CCC2)C[C@@H]2CCCO2)cnc1S(C)(=O)=O 11664499 PFABZSITJNKZDQ-SFHVURJKSA-N 383.558 2.724 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1)NC1CCC1 12836471 CSFZWLHWDUEVHL-NRFANRHFSA-N 393.487 2.838 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCCc1cccc(OC)c1)C2 14748923 OAUXWSQEAVIEFK-SFHVURJKSA-N 396.535 2.837 0 50 GFAA O=C(c1cccc(OC2CCN(C(=O)[C@H]3CC=CCC3)CC2)c1)N1CCOCC1 14981374 NSWVJRGHCNLYAL-SFHVURJKSA-N 398.503 2.885 0 50 GFAA O=C(CCCn1cccn1)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1857719843 WXMMCQOXINFEQB-UHFFFAOYSA-N 381.480 2.543 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2sc(C)nc2C)C[C@H]1NC(=O)CC 1875243645 QGOVKCRHGMMTLH-ARFHVFGLSA-N 381.542 2.866 0 50 GFAA CC(=O)N1CCCCC[C@@H]1C1CCN(C(=O)c2cccc(-n3cncn3)c2)CC1 363585024 GAHLKHKAXMUQON-OAQYLSRUSA-N 395.507 2.911 0 50 GFAA CO[C@H]1C[C@@H](CO)N(C(=O)c2ccc3c(c2)ncn3-c2cc(C)ccc2C)C1 497933734 LPBNGIQYILZECT-ROUUACIJSA-N 379.460 2.864 0 50 GFAA Cn1cnc2c(C(=O)OCc3nc(N)c4c5c(sc4n3)CCCC5)ccnc21 805673222 KQTZLTMSPUKHAZ-UHFFFAOYSA-N 394.460 2.791 0 50 GFAA O=C(c1cnn(CCC(F)(F)F)c1)N1CC[C@@H](c2ccccc2)S1(=O)=O 814091787 KGLKMOZAIIZZFK-AWEZNQCLSA-N 387.383 2.753 0 50 GFAA CN1C[C@@H](C(=O)N[C@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)CCC1=O 818725637 OZCXIJDWEJPGFY-HNAYVOBHSA-N 392.459 2.537 0 50 GFAA CC(C)Cn1cc(NC(=O)[C@@]23CC[C@@H](C2)S(=O)(=O)CC3)c(C(F)F)n1 1875294325 DYYLMVSCHJIWMT-MEDUHNTESA-N 375.441 2.773 0 50 GFAA COCCOC[C@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1 1875294189 CUNQJHWKSYKYHM-QGZVFWFLSA-N 380.448 2.560 0 50 GFAA C[C@]12CN(Cc3ccccc3)C[C@H]1CN(C(=O)c1cnn3ccc(N)cc13)C2 1875392421 LUQOPXQATGKOAU-HTAPYJJXSA-N 375.476 2.511 0 50 GFAA Nc1c(C(=O)NCC(=O)O)sc2nc3c(c(C(F)(F)F)c12)CCCCC3 4395164 QQYGWDOGYROUTG-UHFFFAOYSA-N 387.383 2.981 0 50 GFAA Cc1nc(N2CCN(C)CC2)ccc1NC(=O)Cc1cc2ccccc2c(O)n1 2325786593 DWEUSZLPFYTRMC-UHFFFAOYSA-N 391.475 2.577 0 50 GFAA Cc1c(CNS(=O)(=O)c2ccn([C@@H]3CC3(F)F)n2)noc1-c1ccccc1 2325812350 RGKRPKOVWLRAAK-CQSZACIVSA-N 394.403 2.905 0 50 GFAA COc1cccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)c1 917336 OHBWPKCNWSHILC-UHFFFAOYSA-N 384.417 2.538 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CCCCCC2)cc1 1133018 ANSXELQODIDGIY-OAHLLOKOSA-N 382.526 2.981 0 50 GFAA Cc1c(O)nc(SCC(=O)NC2CCCCC2)n(-c2ccc(F)cc2)c1=O 1178035 LWSHSCUUENJDEL-UHFFFAOYSA-N 391.468 2.927 0 50 GFAA Cc1ccc(OCC(=O)NC(=S)Nc2ccc(N3CCOCC3)cc2)cc1 1180427 ICPNKTZDWGJAPS-UHFFFAOYSA-N 385.489 2.724 0 50 GFAA O=C1N[C@H](c2cccc(Cl)c2)[C@@H](C(=O)c2cccnc2)[C@@](O)(C(F)(F)F)N1 101751028 JMWAGBGINOXEHS-WOSRLPQWSA-N 399.756 2.839 0 50 GFAA O=S(=O)(NC1CCCC1)[C@H]1CCCN(c2ncnc3c2CCCCC3)C1 329711776 PASFBSVUCUOUQI-INIZCTEOSA-N 378.542 2.576 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3cc(C)ccc3OC)CC2)nc(C)n1 67603750 KRKAACVIKIBSPD-UHFFFAOYSA-N 384.484 2.888 0 50 GFAA Cc1ccc(C)c(OCCN(Cc2cn3c(n2)CCCC3)S(C)(=O)=O)c1 328618266 DNBOSVPGKXUJEU-UHFFFAOYSA-N 377.510 2.677 0 50 GFAA O=C([C@@H]1C[C@H]2CC[C@H]1N2C(=O)C1CCC(F)(F)CC1)N1CC[C@@]2(CCOC2)C1 253418938 FTLLIGJJQXZSGM-WOCWXWTJSA-N 396.478 2.830 0 50 GFAA Cc1nc(N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c2ccsc2n1 71774687 GTXINIHSUXBSSF-OAHLLOKOSA-N 399.564 2.959 0 50 GFAA CCc1cnc(C)nc1N1CCC(c2n[nH]c(=O)n2Cc2ccccc2)CC1 71551785 RAYODMACYCMMBJ-UHFFFAOYSA-N 378.480 2.665 0 50 GFAA CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CCN(C(=O)c2ccc3c(c2)OCO3)C1 366346620 MZPYHVNHAGVYCQ-INIZCTEOSA-N 399.447 2.790 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@H](CC(=O)O)c1cccs1 236584834 NGFUGRNZFWRUQL-SJORKVTESA-N 386.473 2.916 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2c3ccccc3C3(CCNCC3)[C@H]2OC)cc1 72475160 QDRROQVPLOKVCW-YADHBBJMSA-N 380.488 2.745 0 50 GFAA C[C@H](N)[C@@H]1CCCCN1C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 237441673 GHIYTVJEELLYOQ-BONVTDFDSA-N 378.270 2.633 0 50 GFAA C[C@@H]1CCN(C(=O)c2ccn([C@@H]3CCCNC3)n2)CCN1Cc1ccccc1 262871942 XWAXWNFFNOEKMJ-UYAOXDASSA-N 381.524 2.544 0 50 GFAA COc1cccc(C[C@@H]2CN(C(=O)c3cc4c(nc3OC)CCC4)CCO2)c1 71751192 HJRVWSCWZMWCEE-GOSISDBHSA-N 382.460 2.671 0 50 GFAA CC[C@H](C)[C@@H](C(=O)N1CCN(c2ccc3nncn3n2)CC1)c1ccccc1 136401520 XILJZJZQFIBARW-OXJNMPFZSA-N 378.480 2.603 0 50 GFAA CNC(=O)Cc1ccc(-c2cccc(C(=O)NCCN3CCCCC3)c2)cc1 426475597 XYMAFICOVCLVSS-UHFFFAOYSA-N 379.504 2.858 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCNC(=O)[C@H]3c3ccc(F)cc3)c(C)c2c1 97785002 YTLDGBATWORFJZ-LJQANCHMSA-N 381.407 2.937 0 50 GFAA O=C(CCc1cccs1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95505046 BZSFJHFOZAKPHK-DZGCQCFKSA-N 375.519 2.787 0 50 GFAA O=C([C@H]1COc2ccccc2C1)N1CCC(c2nnc3n2CCCCC3)CC1 95504282 CUEIAQIDNBWZBV-GOSISDBHSA-N 380.492 2.962 0 50 GFAA CC[C@@H](C(=O)N1CCC(c2nccn2Cc2cccnc2)CC1)n1cccn1 95500754 LFWYCAGYDVWQKX-IBGZPJMESA-N 378.480 2.880 0 50 GFAA CCOc1ccc(NC(=O)N2Cc3cnn(CCO)c3C2)cc1-n1cccc1 97641984 OEEDBKXEMZUAQF-UHFFFAOYSA-N 381.436 2.613 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)c1ccc(OC)cc1F)C[C@@H]2CO 97729631 CAYVPDLEFMLPQT-MRXNPFEDSA-N 378.488 2.781 0 50 GFAA Cc1ccnn1-c1ccccc1NC(=O)c1ccnc(N2CCN(C)CC2)c1 182211572 PAJIFVLFRHUFRZ-UHFFFAOYSA-N 376.464 2.580 0 50 GFAA COc1ccc([C@H](NC(=O)COc2ccccc2Cl)[C@H]2C[C@@H](O)C2)cn1 252536080 HOLLYXZAMANHKD-KSMMKXTCSA-N 376.840 2.751 0 50 GFAA C[C@H](NC(=O)N1CCc2nnc(Cc3cccnc3)n2CC1)C1CCCCC1 534588183 QDFBPCBIWFZCRD-INIZCTEOSA-N 382.512 2.800 0 50 GFAA CC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)s1 1565509746 DRJXWMNADIKNLB-ZBFHGGJFSA-N 383.473 2.723 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2nc3ccc(C)cn3c2F)cc1OC 952873328 VJIRURRMUCKSTC-UHFFFAOYSA-N 386.383 2.628 0 50 GFAA O=C(CSc1ncn(-c2ccccc2)n1)c1cn(-c2ccc(F)cc2)nn1 170646914 MBUFPVAILUIYGN-UHFFFAOYSA-N 380.408 2.962 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)N[C@H](C)c1nncn1C 277013258 VWSPOAQXICTFOK-LJHODMEESA-N 394.479 2.573 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)c3cccc4cc(C)cnc34)CCO2)cn1 189228835 QSKMFYKEFGMUGX-QGZVFWFLSA-N 386.477 2.522 0 50 GFAA O=C(N1CCOCC1)[C@@]1(Cc2ccccc2)C[C@H]2CC[C@@H]1N2Cc1ccncc1 1704354535 IBISDUFHUPFIMT-GPXNEJASSA-N 391.515 2.906 0 50 GFAA O=C(NCCS(=O)(=O)c1ccccc1)c1cc(-c2ccc(F)c(F)c2)on1 1775964950 NFFUPAAIQUEWLK-UHFFFAOYSA-N 392.383 2.824 0 50 GFAA O=C(c1ccccc1F)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697931 OWECFLQQAWEOBD-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA Cc1c(C(=O)NCc2cccnc2)sc2ncnc(NC[C@@H]3CCCO3)c12 12048900 YZRMQWFJSUSQFX-AWEZNQCLSA-N 383.477 2.916 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2)o1 12443312 PFUHMDNXDJTPOK-GOSISDBHSA-N 387.455 2.854 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)CCc3cnccn3)C2)cc1 12585554 AJWIECVXCOLDQD-HXUWFJFHSA-N 396.535 2.831 0 50 GFAA Cc1ccc(Cl)cc1N([C@H](C)C(=O)NCc1ccncc1)S(C)(=O)=O 13679951 DHIYCHJSZJZFEF-CYBMUJFWSA-N 381.885 2.514 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)CCSC)C3)C2=O)c1 14958861 NGGQDTLZDCZWMK-HXUWFJFHSA-N 394.512 2.929 0 50 GFAA O=C1C[C@H](N2CCN(Cc3ccccc3)CC2)C(=O)N1c1cccc(Cl)c1 19335911 OPMAZMCKYASYBJ-IBGZPJMESA-N 383.879 2.790 0 50 GFAA Cc1ccc(C(=O)N2CCC(n3cc(-c4nc(C5CC5)no4)nn3)CC2)cc1 169777447 NNFGYOBUTVNINT-UHFFFAOYSA-N 378.436 2.991 0 50 GFAA COCCOc1ccc2c(c1)CCOC21CCN(c2nccnc2OC)CC1 1857679277 RLWQCERTPZBCAI-UHFFFAOYSA-N 385.464 2.579 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3C[C@H](C(=O)O)C4(CCOCC4)C3)o2)cc1 1857690728 QJOVODFCHYNTEW-MRXNPFEDSA-N 385.416 2.909 0 50 GFAA CN1CCC[C@H](C(=O)N2CCC3(CCc4c(O)nc(C(C)(C)C)nc43)CC2)C1 1857717423 RJQBKDGEOKTKII-HNNXBMFYSA-N 386.540 2.628 0 50 GFAA O=C1CCOC2(CCN(c3nc(-c4ccccc4)nc4c3CCC4)CC2)CN1 1857725874 QPFTUPDMOLTHJW-UHFFFAOYSA-N 378.476 2.508 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N[C@H]1CCOC2(CCOCC2)C1 1857730359 NUZHBHAKFHRAAE-ZDUSSCGKSA-N 388.493 2.621 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4cccc(C(F)(F)F)c4)[C@@H]2CC(=O)N13 1857730772 WUZHQKNJPGLECC-FCEWJHQRSA-N 396.409 2.832 0 50 GFAA CC(C)(C)CN1C[C@@H]2[C@H](CNC(=O)c3ccn(C(F)F)n3)[C@H]3CC[C@]2(C1)O3 1857733573 PHPUOYZALVPGJY-FAYLSGKYSA-N 382.455 2.534 0 50 GFAA COc1cc(-c2nccn2[C@H]2C[C@H]3CO[C@@H](C(C)C)CN3C2)cc(OC)c1O 1857741060 ASBMNHQDMYROFX-TXPKVOOTSA-N 387.480 2.943 0 50 GFAA CN(C)C(=O)CN1C[C@@H]2CC[C@H](C1)CN2Cc1ccc(F)c(C(F)(F)F)c1 248016342 QLOXLKHGRNRENA-CABCVRRESA-N 387.421 2.829 0 50 GFAA FC(F)Cn1ccnc1CSc1n[nH]c(-c2ccc3c(c2)OCCO3)n1 871665867 XSSVSTCQOYXCFT-UHFFFAOYSA-N 379.392 2.997 0 50 GFAA CCOc1cc(C(=O)N[C@H](Cc2c[nH]c3cccc(F)c23)C(=O)OC)ccn1 1875316381 MOSYPEKTYFJQCO-MRXNPFEDSA-N 385.395 2.615 0 50 GFAA CCOc1cccc([C@H](C)N[C@@H]2CCN(c3nc(C(N)=O)nc(C)c3C)C2)c1 1875397851 QMHPZJLQGQTQIH-DOTOQJQBSA-N 383.496 2.521 0 50 GFAA Cc1occ(C(F)(F)F)c1CC(=O)N1CC[C@@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401079 FCSKHBWYPISIJX-HZMBPMFUSA-N 384.358 2.973 0 50 GFAA Cc1nnc([C@H]2CN(C(=O)NCc3cn(-c4ccccc4)nc3C)C[C@@H](C)O2)o1 888101731 QPUOZPPHIMWKKC-FZKQIMNGSA-N 396.451 2.544 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)[C@@]2(C)CCCOC2)n1 1775990770 FHASMZDXVFHQFE-COJSNBRMSA-N 398.429 2.846 0 50 GFAA CCOCCn1cc(C(=O)N2CCCCC[C@@H](NC(=O)C[C@H](C)CC)C2)cn1 1775990473 BFBVKKLSUCKOBZ-IEBWSBKVSA-N 392.544 2.857 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cc(C)ccc3C)CC2)cc1 1078322 HJHSPAXZOGYMMS-UHFFFAOYSA-N 387.505 2.773 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)N1CCC2(CC1)Nc1ccccc1NC2=O 2100544588 ADFUVFWNTVUELD-UHFFFAOYSA-N 380.448 2.950 0 50 GFAA C[C@@H]1CN(c2cccc(CN(C)Cc3ccc4cc[nH]c4n3)c2)S(=O)(=O)C1 2325779654 VWTWZGCEESNIFJ-OAHLLOKOSA-N 384.505 2.981 0 50 GFAA N[C@@H](Cc1ccoc1)C(=O)N1CCc2[nH]c3ccc(Br)cc3c2C1 2325793373 RTTLBDQRVYUVQH-HNNXBMFYSA-N 388.265 2.978 0 50 GFAA O=C(Nc1cccc(NC(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)c1)c1ncnc2c1CCC2 2325872472 ZFKWULFUGXQQCS-ZSOFBXJNSA-N 392.459 2.971 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CC4(CNC(=O)N4C)C3)cc2)c2sccc2n1 2356155488 FSFWFNGTLTVJMP-UHFFFAOYSA-N 393.472 2.516 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)Cc2c(C)[nH]c3ccc(F)cc23)C[C@@H]1O 2356157202 FAPFJIOPVSQIJE-PXNSSMCTSA-N 376.428 2.622 0 50 GFAA O=C(CCn1ccccc1=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356157353 GUWJMHCEWLQTES-UHFFFAOYSA-N 391.471 2.810 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc(-c3ccccc3)nc2O)CC[C@@H]1O 2356169764 ZANPFNWDLMWTNS-LAUBAEHRSA-N 384.432 2.532 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccc(-n4cccn4)cc3)C[C@@H]2N1CCc1ccccn1 55244617 ZIFWSRNPSDPLSK-LEWJYISDSA-N 389.459 2.515 0 50 GFAA Cc1cccc(CN2CCN(C(=O)CCc3[nH]nc4c3CCCC4)[C@H](C)C2=O)c1 55134254 KJNBZGNHZTYVOW-QGZVFWFLSA-N 394.519 2.789 0 50 GFAA CCCCn1c(CN2CC[C@@H](N(C)C)C2)cnc1S(=O)(=O)C1CCCCC1 20599316 PEQLAHLIUCJRHG-QGZVFWFLSA-N 396.601 2.926 0 50 GFAA O=c1[nH]c2ccccc2cc1CN1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 67725346 CDRITRPQHSAPJE-PKOBYXMFSA-N 378.428 2.607 0 50 GFAA O=C(c1ccccc1-n1cccn1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20858409 USRSZIWKXIOJDI-UHFFFAOYSA-N 390.443 2.559 0 50 GFAA O=C(NC1CCCC1)c1cn(C2CCN(c3cnc4ccccc4n3)CC2)nn1 67884517 FOAWIIKIGDCPEM-UHFFFAOYSA-N 391.479 2.735 0 50 GFAA CC(C)C(=O)N1N=C(c2ccco2)C[C@H]1c1ccccc1NS(C)(=O)=O 252508190 XFWBFPMSAWVQID-INIZCTEOSA-N 375.450 2.985 0 50 GFAA COc1ccnc(C[S@@](=O)c2nc3ccc(OC(F)F)cc3[nH]2)c1OC 4676424 IQPSEEYGBUAQFF-SANMLTNESA-N 383.376 2.884 0 50 GFAA biogenic,fda Cc1ccc2c(c1)CN(CCNC(=O)[C@H]1COc3ccccc3C1)C[C@H](C)O2 39355297 LMDATTPZGPLQJT-FXAWDEMLSA-N 380.488 2.945 0 50 GFAA CSCC[C@H](N)C(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 72407032 FCOQTHLRFQZYFC-AWEZNQCLSA-N 376.444 2.596 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@@H](CO)OC[C@@H]1C 154165515 LXIUWVDQQKTXQO-NHYWBVRUSA-N 396.896 2.906 0 50 GFAA COc1ccc(-n2ccc(CNC(=O)Nc3cnn(C[C@H]4CCCO4)c3)n2)cc1 363445601 ZGQFOIPYYVOXTN-LJQANCHMSA-N 396.451 2.578 0 50 GFAA O=C(N1CCS(=O)(=O)CC1)N1CCC[C@H]1c1nc(C2CCCCC2)co1 365305790 BGPPGQRBOMKNGR-INIZCTEOSA-N 381.498 2.710 0 50 GFAA O=C(O)CN(C(=O)c1ccc2c(c1)nc(O)n2C1CCCC1)C1CCOCC1 486040635 UTHJCKXCCCKLDN-UHFFFAOYSA-N 387.436 2.563 0 50 GFAA C[C@@H]1CCCN(C(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)[C@@H]1CN 237446927 BOMCJDSDVWXLMH-OXQOHEQNSA-N 386.517 2.860 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)C(=O)O 262674766 QSYZGOBOPSCKPM-GXTWGEPZSA-N 376.482 2.523 0 50 GFAA O=C(NCCOCCOC(=O)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 214075918 DNPQXKIRYRVAEE-UHFFFAOYSA-N 385.313 2.846 0 50 GFAA CN1C[C@@]2(CCCN(Cc3cnc4c(-c5ccccc5)cnn4c3)C2)OC1=O 72409628 MIAACKNSBRZWQE-OAQYLSRUSA-N 377.448 2.813 0 50 GFAA Cc1c(C(=O)O)cnn1C1CCN(C(=O)COc2ccccc2Cl)CC1 263155195 JHTIEWVBNGEXGW-UHFFFAOYSA-N 377.828 2.786 0 50 GFAA O=C(Cn1cnc(NC(=O)C2(Cc3ccccc3)CC2)n1)NCc1ccccc1 177022216 RHUZZHRXFYPUMJ-UHFFFAOYSA-N 389.459 2.556 0 50 GFAA CN1CC2(CCC1=O)CCN(C(=O)c1cccc(-c3ccc(N)cn3)c1)CC2 426490318 NZDZEYJUDISFCK-UHFFFAOYSA-N 378.476 2.805 0 50 GFAA C[C@@H]1CN(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CCS1(=O)=O 291642385 HJXYSMCAKBONIJ-SNVBAGLBSA-N 388.367 2.620 0 50 GFAA CC(C)CN1CC2(CCN(Cc3cccc(N4CCOCC4)c3)CC2)CC1=O 95355244 SZGYMKUVFLGBNG-UHFFFAOYSA-N 385.552 2.994 0 50 GFAA COc1ccc(C(=O)N2CCC([C@H](C)N3CCN(C)CC3)CC2)cc1Cl 91410047 HNFBVCLMEQLUBD-HNNXBMFYSA-N 379.932 2.837 0 50 GFAA O=C(NCC1(COc2ccccc2)CC1)c1cnc(-c2ccccn2)nc1O 91255806 ZQJWADHUFJNMBD-UHFFFAOYSA-N 376.416 2.833 0 50 GFAA CSc1nc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccn2)C3)cs1 95371399 MZZSPTZDXQZXEL-QWHCGFSZSA-N 388.518 2.637 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCCc2ccc(C(=O)O)cc2)cc1 237732240 MPJFBAQFOXWSBG-LJQANCHMSA-N 380.444 2.543 0 50 GFAA O=c1[nH]c(-c2cccc(CN3CCC[C@@H]3c3ccccn3)c2)nc2c1CNCC2 23505269 ZHDNNQDGVWCDCJ-OAQYLSRUSA-N 387.487 2.815 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H]2C(=O)O)ccc1OCc1csc(C)n1 299743047 JPGRDCLHOJOSPD-CQSZACIVSA-N 376.434 2.728 0 50 GFAA CCCC[C@@]12[C@@H]3[C@H]4[C@@H]([C@@H]5[C@H]1[C@H]3[C@@]5(Br)C41OCCO1)C21OCCO1 252428371 ZTNRQRIGEAIPNV-VTKFSBQNSA-N 383.282 2.548 0 50 GFAA CN(C)c1ncnc2c1CCN(C(=O)c1ccc(N3CCCC3)c(Cl)c1)C2 299790704 BHUMLUOSUPCVQD-UHFFFAOYSA-N 385.899 2.995 0 50 GFAA O=C(O)CN(C(=O)CCOc1ccc(Cl)cc1Cl)C1CCOCC1 299750052 MNUUYODEMPOMPS-UHFFFAOYSA-N 376.236 2.855 0 50 GFAA O=C(C1CCC1)N1CCCN(Cc2cnc(NCc3ccccc3)nc2)CC1 827715473 RDUDIAGKKBNWCB-UHFFFAOYSA-N 379.508 2.923 0 50 GFAA Cc1nn(-c2ccccc2)cc1CNC[C@@H](c1ccccn1)N1CCOCC1 952969650 AIXAYNJLEJPUJJ-QFIPXVFZSA-N 377.492 2.739 0 50 GFAA Cc1cccc(N2CCN(CC(=O)N(C)CCCc3c(C)n[nH]c3C)CC2)c1 952992124 XBJQUZIRIFBGHX-UHFFFAOYSA-N 383.540 2.548 0 50 GFAA O=C(c1ccc(-c2nc[nH]n2)cc1)N1C[C@@H]2CC[C@H]1CN(Cc1cccnc1)C2 1565530716 CZAYGDOXOADOAU-XLIONFOSSA-N 388.475 2.603 0 50 GFAA CC(C)CC(=O)N1CCC(NC(=O)c2ncccc2OCc2ccncc2)CC1 170849823 VPHRRNNXMWCLAX-UHFFFAOYSA-N 396.491 2.823 0 50 GFAA C[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(N2CCCC2)c1 195356165 KOPTVWOSZKYJAR-YWZLYKJASA-N 379.460 2.734 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)Cn2nc3ccccc3n2)CC1 1704299995 WSUMCIICEYDZJF-UHFFFAOYSA-N 392.459 2.531 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H](NC(=O)c2ccc(F)cc2)C1 12025631 GQXJOPTTXFNPOY-KRWDZBQOSA-N 384.455 2.896 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@H](CNC(=O)c3ccc(F)cc3)C2)cs1 12612153 TWERJLOLUHYKQN-CQSZACIVSA-N 375.469 2.802 0 50 GFAA O=C(c1cn(C(c2ccccc2)c2ccccc2)nn1)N1CCC[C@@H](CO)C1 12752101 FVSCLKDIRHBMCR-QGZVFWFLSA-N 376.460 2.760 0 50 GFAA COc1cc(CC[C@H](O)C[C@@H](O)CCc2ccc(O)c(OC)c2)ccc1O 13377892 OELMAFBLFOKZJD-IRXDYDNUSA-N 376.449 2.792 0 50 GFAA biogenic,in-vitro CCn1nc2c(c1C(=O)NCc1cc(Br)c[nH]1)C[C@@H](C)O[C@H]2C 1857531176 HGQDNXZMHDKQKO-ZJUUUORDSA-N 381.274 2.946 0 50 GFAA Cc1nn(C)c2c1[C@H](NC(=O)Cc1cc3c(cc1Cl)OCCO3)CCC2 1857674427 HSSXBIFRLOJVNN-CQSZACIVSA-N 375.856 2.889 0 50 GFAA CCCCn1nc(Cc2ccccc2OC)nc1-c1cc2n(n1)CCN(C)C2=O 1857677595 IZFAKEINJHPEOS-UHFFFAOYSA-N 394.479 2.627 0 50 GFAA Cc1nc(C)c2c(n1)O[C@@H](COc1ccc3c(c1)CCOC31CCNCC1)C2 1857689221 JQJNZBWIOSKZTE-GOSISDBHSA-N 381.476 2.627 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857718352 FQTTZPHFJMJSBL-ROUUACIJSA-N 388.899 2.752 0 50 GFAA N=c1nc(O)c2c([nH]1)C1(CC2)CCN(C(=O)c2ccc(Cl)cc2F)CC1 1857722118 OQNHFKQUTFWUMN-UHFFFAOYSA-N 376.819 2.507 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccoc4C)[C@H]4CC[C@]3(C2)O4)n1 1857729303 WNOLUFKLNALEMJ-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA Cc1[nH]c2c(F)cccc2c1CC(=O)N1CC[C@H](O)[C@](CC2CC2)(C(=O)O)C1 1875245774 QBEITWAMOCAYLQ-LAUBAEHRSA-N 388.439 2.622 0 50 GFAA C[C@H](N)[C@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 237427345 FGLUKKMWZYHERX-UWVGGRQHSA-N 381.723 2.850 0 50 GFAA O=C(NC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1cccn2nnnc12 907783677 YAIFJEOOYLMVQN-UHFFFAOYSA-N 391.353 2.579 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(Cl)cc1)c1cnn(CCC(F)(F)F)c1 845892217 FBCXIYXGTJUELI-UHFFFAOYSA-N 395.790 2.749 0 50 GFAA CC1(C)CN(Cc2nnc3n2CCOC3)[C@H]1c1nccn1-c1cccc(F)c1 952891873 JRRWEHLQDRKYBA-SFHVURJKSA-N 382.443 2.716 0 50 GFAA Cc1sc2nc(-c3cccnc3)nc(N3CCC4(CC3)NC(=O)CO4)c2c1C 1875274227 WFBCTGNHQBBFNX-UHFFFAOYSA-N 395.488 2.813 0 50 GFAA O=C(NC1CCN(CC(F)F)CC1)c1nnn(-c2ccc(F)cc2)c1C1CC1 1875252942 KOWXUUPABQSKKM-UHFFFAOYSA-N 393.413 2.743 0 50 GFAA CCOc1cccc(CCC(=O)NC2CC(CNC(=O)c3cncs3)C2)c1 1775997046 SCBCPHQIVYHMBN-UHFFFAOYSA-N 387.505 2.799 0 50 GFAA COc1ccc2[nH]nc(CN3CCC4(CCc5c(O)nc(C)nc54)CC3)c2c1 2100534684 TYGXBOGREVNRAT-UHFFFAOYSA-N 379.464 2.856 0 50 GFAA Cc1c(CN2CC[C@@H](N3CCC(O)CC3)[C@H](O)C2)[nH]c2ccc(Cl)cc12 19299983 IVTDZFGGHKRRSF-WOJBJXKFSA-N 377.916 2.522 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)C1 2325888761 XHBANKKIRWFFNO-HNNXBMFYSA-N 399.491 2.821 0 50 GFAA OCCN(CCO)C[C@@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21 626541 IUYHQXQULKHTOS-OAHLLOKOSA-N 397.302 2.749 0 50 GFAA O=C(c1cc2ncccn2n1)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356167430 ORDVKWQDOKTEPE-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA CCc1ccccc1N1CCN(S(=O)(=O)c2ccc(OC)c(OC)c2)CC1 2858350 FTNWNGCKAILVNV-UHFFFAOYSA-N 390.505 2.777 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)c3ccccc3C(=O)O)sc2c1 2911205 SNKNZVJZVMRVNZ-UHFFFAOYSA-N 376.415 2.650 0 50 GFAA O=S(=O)(c1ccccc1)n1nc(-c2cccnc2)nc1NCc1ccco1 4810616 PJYHKMGRDJGZTK-UHFFFAOYSA-N 381.417 2.782 0 50 GFAA Cc1noc(CCC(=O)NS(=O)(=O)c2ccc(C3CCCCC3)cc2)n1 133278906 YTZOAHKMHGKELR-UHFFFAOYSA-N 377.466 2.863 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@H](c3cc(OC)cc(OC)c3)C2)c1 225498129 HULWTOSTXRLYSA-IBGZPJMESA-N 390.461 2.823 0 50 GFAA CC[C@@H](NC(=O)c1cc(Cn2c(C)nc3ccccc32)on1)c1ccnn1C 67641799 BXWMNKFIZHBLSQ-OAHLLOKOSA-N 378.436 2.996 0 50 GFAA Nc1ncccc1CNC(=O)c1coc(COc2ccc(F)cc2Cl)n1 67757313 CUGAQQJNEMRJTP-UHFFFAOYSA-N 376.775 2.953 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2C[C@H](F)CN2c2ccncn2)nn1[C@@H](C)C1CC1 329953881 JRADHKHJKYBACQ-XIRDDKMYSA-N 386.475 2.642 0 50 GFAA Cc1cc(C)nc(NC(=O)c2ccc(CN(C)Cc3cnc(N)nc3)cc2)c1 65397582 SKZNHDJNFVUYNE-UHFFFAOYSA-N 376.464 2.955 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@@]1(O)CNCc1ccc(F)cc1 11997173 RVUKRQQPDLFDOG-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA COc1cc(C(=O)N[C@H]2CC(=O)N(Cc3cccc4ccccc34)C2)ccn1 72172872 PYQKSBNQYDUPME-SFHVURJKSA-N 375.428 2.774 0 50 GFAA COc1cc2c(cc1OC)CN1C(=S)N(c3ccccc3OC)C(=O)[C@H]1C2 4743809 OGUCPSSTNVXKLQ-OAHLLOKOSA-N 384.457 2.771 0 50 GFAA COC(=O)N1CC[C@H](NC(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)C1 253428686 DSAVKRLZFBROAH-HOCLYGCPSA-N 397.516 2.617 0 50 GFAA Cc1ccc(O[C@@H]2CCN(S(=O)(=O)c3c(Cl)nc4ccccn34)C2)cn1 328633632 SRIVHPVZJNHYAO-CQSZACIVSA-N 392.868 2.533 0 50 GFAA O=C(CSc1nc(O)cc(-c2ccccc2)n1)NCc1ccc2c(c1)OCO2 8670091 AEVTWCJCVVAUFK-UHFFFAOYSA-N 395.440 2.986 0 50 GFAA CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)N1CCO[C@@]2(CCCOC2)C1 332824284 HUFTXDOGFUTSAZ-DXIQSLLYSA-N 388.508 2.961 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)c1ccc(N2CCOCC2)cc1 72436951 NUYIZOZXGGWJFR-UHFFFAOYSA-N 393.487 2.576 0 50 GFAA Cn1nc(NS(=O)(=O)c2cccnc2)c2c(Oc3cccnc3)cccc21 77472010 FWKYMWDCTSLZSO-UHFFFAOYSA-N 381.417 2.956 0 50 GFAA CC(=O)N1CCC(N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)CC1 71415545 FBQXFXTVXVKKNK-NRFANRHFSA-N 389.515 2.896 0 50 GFAA CCCCN1CCCC[C@H]1C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1 241738554 QYLYYCSSKMMEFE-HNNXBMFYSA-N 375.498 2.830 0 50 GFAA C[C@@H]1CN(Cc2ccc(-c3nc(-c4cccnc4)cc(=O)[nH]3)cc2)CCN1C 48501655 BSFQTCHMBOXWKQ-MRXNPFEDSA-N 375.476 2.635 0 50 GFAA COc1cccc(-n2cc(CNC(=O)N3CC[C@H](n4nc(C)cc4C)C3)cn2)c1 426547603 JLTXJMYEHLSOQE-IBGZPJMESA-N 394.479 2.851 0 50 GFAA Cc1nc(CCC(=O)N(C)CC2CCN(CCc3cccc(F)c3)CC2)n[nH]1 95520641 MERAGUWQOJXDGJ-UHFFFAOYSA-N 387.503 2.598 0 50 GFAA CCNc1ncc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(F)cc2)C3)cn1 95361684 RKYWOOWZAZGYTC-QFBILLFUSA-N 383.471 2.784 0 50 GFAA CN1CCCN(C[C@H]2C[C@H](CO)CN(Cc3cc4ccccc4s3)C2)CC1 91650115 PYOMFQAOQWJWRK-MOPGFXCFSA-N 387.593 2.969 0 50 GFAA CC(C)c1nccn1[C@H](C)C(=O)NC1CCN(c2ccc(Cl)nn2)CC1 95517419 DQEYNGGQMAIJIV-CYBMUJFWSA-N 376.892 2.796 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1cnc(-c2ccccn2)nc1O 91468764 JCEKBDWQHMVNOM-KRWDZBQOSA-N 389.459 2.639 0 50 GFAA Cc1ccc([C@H]2CN(S(=O)(=O)c3cnoc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95355579 KCSBSMZDWFCXGJ-MISYRCLQSA-N 387.505 2.542 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccccc2)C1=O)N1CCc2ccccc2C1 252572434 ZHZLUPPSCLETRH-LJQANCHMSA-N 377.444 2.677 0 50 GFAA COC(=O)C[C@H](c1c(O)ncc(C(=O)OC)c1O)c1ccnc2ccccc12 253623629 CEFAMFWUHYXRAW-ZDUSSCGKSA-N 382.372 2.523 0 50 GFAA biogenic Cc1nn(C(C)C)c(C)c1S(=O)(=O)N[C@H](Cn1cccn1)c1ccccc1 607362765 GVLVRMVCPAUEFY-GOSISDBHSA-N 387.509 2.997 0 50 GFAA Cc1ccc([C@H]2Cn3nc(C(=O)Nc4ccc(C(N)=O)cc4)cc3CO2)cc1 263617299 NBXMHAYVGTZCEW-LJQANCHMSA-N 376.416 2.814 0 50 GFAA CCOc1cc(CN2CC[C@H]3[C@H](C2)OCc2cnnn23)c(Cl)cc1OC 299788148 QJOVBPZIGXZWAY-YJBOKZPZSA-N 378.860 2.685 0 50 GFAA O=C(NCCSc1cnn[nH]1)Nc1ccc(OC[C@@H]2CCCCO2)cc1 299762155 WIXFUUUXZRLIEF-HNNXBMFYSA-N 377.470 2.666 0 50 GFAA COc1ccccc1CN(Cc1ccc(C)cc1)C(=O)CCS(C)(=O)=O 824819763 OMKUMOLXZQISSB-UHFFFAOYSA-N 375.490 2.967 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCC[C@@H](C(=O)c3nccn3C)C2)c1 823531365 BBTULXIXRVGXBZ-QGZVFWFLSA-N 396.491 2.823 0 50 GFAA CCCc1cc(CNS(=O)(=O)c2ccc(-c3nnc(C4CC4)o3)o2)on1 670467117 FVAWQZNQHUTBEB-UHFFFAOYSA-N 378.410 2.626 0 50 GFAA C[C@H](C(=O)Nc1ccc(CC(=O)NC2CC2)cc1)N1CCc2ccccc2C1 952963621 HMKOEIKOCIEPLJ-MRXNPFEDSA-N 377.488 2.893 0 50 GFAA O=C(Cn1cc(Br)cn1)N1CCC(c2c[nH]c3ncccc23)CC1 410052971 QPHOCSIJNQXRFK-UHFFFAOYSA-N 388.269 2.928 0 50 GFAA CCOC(=O)C[C@@](C)(NC(=O)CCN1CCN(c2ccccc2)CC1)C(C)C 170599911 ZPAZAHOALJYEBN-JOCHJYFZSA-N 389.540 2.683 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNc2cc(N3CCC(O)CC3)ncn2)C1 1529191191 UFFLKSDNXIHROQ-SFHVURJKSA-N 381.524 2.648 0 50 GFAA CN(C)C[C@@]12CN(C(=O)CCC3CCCC3)C[C@H]1CN(C(=O)C1CC=CC1)C2 1772706567 SYEADELUVHEOJC-REWPJTCUSA-N 387.568 2.772 0 50 GFAA CC(C)CN1CCNC(=O)[C@@H]1CC(=O)N(C)Cc1cccc(C(F)(F)F)c1 12597760 IGDSROCESIKNOQ-INIZCTEOSA-N 385.430 2.510 0 50 GFAA Nc1cc(=O)[nH]c(SCC(=O)N(Cc2ccccc2)c2ccc(F)cc2)n1 13426410 NSLSBSAXPAGISU-UHFFFAOYSA-N 384.436 2.817 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)NC[C@@H](c3ccco3)N3CCOCC3)oc2c1C 15859907 PGJSYOWOFWZASH-KRWDZBQOSA-N 396.443 2.806 0 50 GFAA CCc1cc(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cs1 16580274 VEAGQTVEYAMIRU-UHFFFAOYSA-N 380.491 2.584 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)COc3ccccc3)CC2)[C@H]1O 19866990 NAIFCUVVINGCKY-YADHBBJMSA-N 380.488 2.603 0 50 GFAA COC(=O)[C@H]1CN(C(=O)C[C@@H]2CCCO2)C[C@@H]1c1ccc(Br)cc1 1857531820 QACKIDBGMOBALS-XHSDSOJGSA-N 396.281 2.733 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857739810 TZKHNSMLJAHPNZ-JOCHJYFZSA-N 393.443 2.909 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)c(C)c1 119643272 HEDYWEKOJULUBN-HNNXBMFYSA-N 380.416 2.665 0 50 GFAA CC(=O)NCCCC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704342475 DBLRIWNDHGFLAL-HSZRJFAPSA-N 392.503 2.866 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(CCCOc2ccc(F)cc2)C[C@@H]1O 1704315806 OJUIYECVDQTLGY-RBBKRZOGSA-N 387.451 2.975 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCC[C@@]3(CCc4cnc(N)nc43)C2)c1 1704316485 RIEBEYBYFUEUGH-JOCHJYFZSA-N 390.491 2.733 0 50 GFAA CN(C)c1ncc(CN2Cc3cnn(-c4ccccn4)c3CC(C)(C)C2)n1C 952891148 BEWFCUWJVIQRSD-UHFFFAOYSA-N 379.512 2.651 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)O)NC(=O)c1ccc(CN2CCOCC2)cc1 952832852 XOQSORRQLZYXRT-HXUWFJFHSA-N 382.460 2.773 0 50 GFAA COC(=O)Cc1ccc(NC(=O)C[C@H](NC(C)=O)c2ccc(C)cc2)c(OC)c1 1875320586 GJOYWIRHDQFDNE-IBGZPJMESA-N 398.459 2.925 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)Cc1n[nH]c2c1CCCC2 1875401540 KYQXMGXFHHKTPE-LIRRHRJNSA-N 398.511 2.709 0 50 GFAA COC(=O)c1cc(C2CC2)sc1NC(=O)C1CCN(C(=O)N(C)C)CC1 2325757884 BFSOMBUFLBICTC-UHFFFAOYSA-N 379.482 2.744 0 50 GFAA O=S(=O)(c1cnccn1)N1CCC[C@@H]1Cc1ccccc1Br 2325776476 QFSCMDSCWNOHQU-CYBMUJFWSA-N 382.283 2.635 0 50 GFAA O=C1CCN(C[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)C(=O)N1Cc1ccc2c(=O)cc[nH]c2c1 2325779779 BRECGDKMCRVKSZ-OBQKDBCYSA-N 391.471 2.975 0 50 GFAA CCc1nccn1[C@H](C)CC(=O)NCC1(NC(=O)c2ccoc2Cl)CC1 2325794888 VJINSKJFQSJXTO-GFCCVEGCSA-N 378.860 2.722 0 50 GFAA CN=c1cc(-c2noc(Cn3c(Cc4ccccc4)nc4ccccc43)n2)nc[nH]1 2325841530 YRZUPWQANMMRRJ-UHFFFAOYSA-N 397.442 2.979 0 50 GFAA O=C(N[C@@H](CCO)C1CCC(F)(F)CC1)c1nnc2c(F)cccc2c1O 2325842478 ZTYJOICKMCNJMA-ZDUSSCGKSA-N 383.370 2.781 0 50 GFAA O=C(NCc1cccc(N2CCCC2=O)c1)c1csc(C2CCNCC2)n1 870865345 PQYPNBILSWZFPH-UHFFFAOYSA-N 384.505 2.667 0 50 GFAA CCCCNC(=O)CSc1nc(N)c(C(=O)Nc2ccc(OC)cc2)s1 2303470 DANBHLAMBBYUCE-UHFFFAOYSA-N 394.522 2.995 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 2467695 DXPLWZCWPXXTOS-AWEZNQCLSA-N 382.482 2.604 0 50 GFAA CCn1cc(Br)c(C(=O)Nc2cc(OC)c(OC)c(OC)c2)n1 2768689 FRZWMYQNQRONFU-UHFFFAOYSA-N 384.230 2.944 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CSc1nnc2nc(O)cc(C)n12 4250014 SRLLFJMGDZTDMU-UHFFFAOYSA-N 379.829 2.531 0 50 GFAA Cc1ccc(NC(=O)Cn2c(=O)n(CCC(C)C)c(=O)c3cccnc32)cc1C 6805192 JLKQODFHOQNLDV-UHFFFAOYSA-N 394.475 2.860 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)Nc1n[nH]c(-c2ccccc2F)n1 23505046 KEOYNROBLYRWJP-UHFFFAOYSA-N 378.371 2.513 0 50 GFAA Cc1nc(NCCNC(=O)c2cccc3ccccc23)cc(N2CCOCC2)n1 65362501 DPXOSIZYKIOGIM-UHFFFAOYSA-N 391.475 2.617 0 50 GFAA COC(=O)[C@@H]1CCCN1C(=O)c1cc(COc2ccc(F)cc2Cl)on1 20996584 PIXOYYPVDPEOKZ-AWEZNQCLSA-N 382.775 2.824 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)c2ccc3[nH]c(=O)[nH]c3c2)cn1 67934092 UXCYPXVRYRNVPZ-UHFFFAOYSA-N 375.388 2.677 0 50 GFAA CCCn1nc(C)cc1NC(=O)c1cccc(CN2CCC(=O)NC[C@@H]2C)c1 65526467 NWXKQGKXXVDZKK-INIZCTEOSA-N 383.496 2.564 0 50 GFAA COc1cc(CN2CC[C@H](NC(=O)Cc3n[nH]c4ccccc34)C2)cc(OC)c1 121347029 DZEJKCZORAJOIT-INIZCTEOSA-N 394.475 2.513 0 50 GFAA CCCS(=O)(=O)N1CC[C@@]2(CCCN(Cc3cccc(OC)c3OC)C2)C1 72149733 SIQMJPRWZDGXAF-HXUWFJFHSA-N 396.553 2.732 0 50 GFAA Cc1nn(C)c(-n2cccn2)c1C(=O)NC1CCN(CC2CCCCC2)CC1 364464030 VLWYZPITMKUTHG-UHFFFAOYSA-N 384.528 2.689 0 50 GFAA Cn1cc(-c2ccccc2CNC(=O)Nc2ccc(S(C)(=O)=O)cc2)cn1 363162324 ISVHIURNQLKTAA-UHFFFAOYSA-N 384.461 2.812 0 50 GFAA O=C(N[C@H]1CCN2CCCC[C@H]12)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 332828107 NMVIPZGSESKEJL-GVDBMIGSSA-N 394.878 2.510 0 50 GFAA O=C(CC1CCCCC1)NC1CCC(C(=O)N2CC[C@H]3CC[C@@H](C2)N3)CC1 262629651 MCPAGCOXUFPPPB-TUNPWDSISA-N 375.557 2.985 0 50 GFAA CN1CCN(C(=O)c2ccc(-c3noc([C@@H]4Cc5ccccc5O4)n3)cc2)CC1 371911139 YIQTYWCMUWTRSR-IBGZPJMESA-N 390.443 2.800 0 50 GFAA COCCc1nsc(N2CCC3(CC2)C[C@@H]3N(C)Cc2nccs2)n1 373098544 JRVCXQDWCVDVJF-ZDUSSCGKSA-N 379.555 2.674 0 50 GFAA O=C(NCC1(c2ccc3c(c2)OCO3)CCCCC1)[C@@H]1CCc2[nH]nnc2C1 283190685 YQPZENNKRCLJGB-CQSZACIVSA-N 382.464 2.657 0 50 GFAA CC(C)N1CCC(NC(=O)CN(CCCO)[C@H]2CCCc3ccccc32)CC1 174905080 HLTSHCLUUYTHKG-QFIPXVFZSA-N 387.568 2.737 0 50 GFAA CN(C)C(=O)[C@H]1CC[C@@H](C(=O)Nc2cc(C(C)(C)C)nn2Cc2ccccc2)O1 287910310 ZOQUAGLODCGVQW-DLBZAZTESA-N 398.507 2.803 0 50 GFAA O=C(NC1CCN(Cc2cccnc2)CC1)N1CC[C@H](Oc2ccccc2)C1 426511645 JHUYZCXWXZZADI-NRFANRHFSA-N 380.492 2.909 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N[C@H](c1cnn(C)c1)C1CC(O)C1 223067764 CLPOVPHFPIGCLX-DDRXVLGJSA-N 380.492 2.998 0 50 GFAA CNc1cc(C)nc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 95354301 VUGCZYWXBSYPOM-UHFFFAOYSA-N 394.523 2.673 0 50 GFAA Cc1ccc(C(=O)NCCC(=O)N2CC[C@H](Cc3ccc(CO)cc3)C2)cc1 91690561 PXIBQLWGSAGTFY-HXUWFJFHSA-N 380.488 2.698 0 50 GFAA CCCSCC(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 91547121 RZYROEAPWOUIPD-UHFFFAOYSA-N 375.538 2.956 0 50 GFAA Cc1cc(=O)oc2cc(NC(=O)N3CCCN(c4ncccn4)CC3)ccc12 95521735 KRUGRUSWKVIDQB-UHFFFAOYSA-N 379.420 2.636 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)n1 95509547 MRNKIAFYGQFMAJ-MRXNPFEDSA-N 384.509 2.607 0 50 GFAA Cc1cc(CNC(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)on1 95523857 GJRZYDFPSXTWBK-UHFFFAOYSA-N 383.448 2.693 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)N(C)CCc1nc3ccc(F)cc3[nH]1)CC(=O)N2 91526103 JDIIIXRZUTURCQ-HNNXBMFYSA-N 396.422 2.838 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(CCN3CCCC3=O)CC2)cc1F 95362330 XPXGRZCKUGMPJI-IBGZPJMESA-N 378.444 2.685 0 50 GFAA Cc1nc(N)sc1C(=O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 91650082 ZZPOOAYBKQSREQ-UHFFFAOYSA-N 388.541 2.699 0 50 GFAA O=C(NCC[C@@H]1COc2ccccc2O1)c1ccc(N[C@H]2CC[C@H](O)CC2)nc1 244678457 IDINUUSXMCKTQN-KZNAEPCWSA-N 397.475 2.757 0 50 GFAA Cc1ccc(NC(=O)N2CCCN(CC(F)F)CC2)cc1N1CCOC1=O 162978532 WDCOMOQLLLKGMC-UHFFFAOYSA-N 382.411 2.756 0 50 GFAA CO[C@H]1Cc2ccccc2N(C(=O)Nc2ccccc2N(C)S(C)(=O)=O)C1 297643827 MVIKBFZHAFHMAE-HNNXBMFYSA-N 389.477 2.692 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)N[C@H](C)c1cnn(-c2ccccc2OC)c1 534657481 QLFMBHIUKMJVDF-OAHLLOKOSA-N 382.468 2.907 0 50 GFAA Cc1occc1C(=O)Nc1ccc(C(=O)N2CCC[C@@H](CCC(N)=O)C2)cc1 55370420 URBMPVOOOMGDDN-HNNXBMFYSA-N 383.448 2.958 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)CCn2cnc3ccccc3c2=O)cc1 828052343 UTPLXCSJQBZETE-OAHLLOKOSA-N 390.443 2.941 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccncc3)no2)nc(N)n1 1506409429 ZOXGMCQIPKDPKP-INIZCTEOSA-N 393.451 2.680 0 50 GFAA COc1ccccc1-c1nc(CN2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)c(C)o1 1704340054 FDQYBMRVLXIDCY-DNVCBOLYSA-N 382.464 2.726 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)ccc1F 1704337885 GRSCKSNYPHKXCK-OAQYLSRUSA-N 384.455 2.811 0 50 GFAA CCn1nc(CC(C)C)cc1-c1nc([C@@H]2CCCN(C)C2)nn1-c1cnn(C)c1 1772809061 KZECVIOZVVYWAO-MRXNPFEDSA-N 396.543 2.892 0 50 GFAA CCC(=O)N1CCC[C@H](c2nc(-c3cccnc3O)nn2-c2cccnc2)CC1 1772804482 AZZSSEJVBVUBGF-HNNXBMFYSA-N 392.463 2.936 0 50 GFAA O=C(Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1C(=O)Nc2ccccc2[S@@]1=O 5739296 PTUIGLJFYKYTGB-HWRSSNJWSA-N 397.239 2.630 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCCc3ccc(F)cc3)CCC2=O)cc1 11662985 TUJJYMIVGCKHEL-IBGZPJMESA-N 398.478 2.974 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1 12001986 KCOXIMJRIFJEKT-UHFFFAOYSA-N 383.473 2.816 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)CC[C@@]2(Cc3ccsc3)CCC(=O)N2)C1 12244080 AQIXFVNJTIAVKO-OXJNMPFZSA-N 392.521 2.521 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)CC2=CCCCC2)CC1)[C@H]1CCOC1 12299311 LPVVZIGEGFUDAP-KRWDZBQOSA-N 386.496 2.912 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)CCC(C)=O 12431239 OJPPUOOZXSETBC-LJQANCHMSA-N 386.536 2.710 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@@H](C)Cc3cc(C)ccn3)CC2)CC1 12435591 MFYUHWTYMVZORB-FQEVSTJZSA-N 386.584 2.977 0 50 GFAA CC(=O)N1CCN(C(=O)C[C@@H](c2ccccc2)c2ccc3c(c2)OCO3)CC1 14981130 HXVGICNVIGHUQH-IBGZPJMESA-N 380.444 2.628 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2CCC(O)CC2)Cc2ccccc2C1 15062563 JIZMLALNSDMTOO-UHFFFAOYSA-N 378.516 2.682 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)Cc4ccc(F)cc4)nnc23)n1 169775934 XSDLLRTZEVZPIU-UHFFFAOYSA-N 394.410 2.901 0 50 GFAA COc1nc2c(cc1C(=O)N1CCC3(CC1)C[C@H](O)C[C@H](C(C)C)O3)CCC2 1857708923 ULXSLGMDVBIJCU-VQIMIIECSA-N 388.508 2.750 0 50 GFAA O=C1CCOC2(CCN(c3cnccn3)CC2)CN1C/C=C/c1ccccc1 1857735464 OTAWQXKPAWSEJP-QPJJXVBHSA-N 378.476 2.778 0 50 GFAA COc1cc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)ccn1 1857738665 SAASUHXTNRBMEF-OKZBNKHCSA-N 387.867 2.688 0 50 GFAA Cc1cccc2nc(C(=O)N3CCC[C@]4(CCc5cnc(N(C)C)nc54)C3)cn12 1704325820 SLYQXQCUVFPRDI-QFIPXVFZSA-N 390.491 2.619 0 50 GFAA Cc1ccc(CNC(=N)NCCNC(=O)c2ccc(Br)cc2)cc1 849066206 HWWZSCXIMOXLSY-UHFFFAOYSA-N 389.297 2.801 0 50 GFAA O=C(N=c1[nH]nc(-c2ccc(C(F)(F)F)cc2)s1)NC[C@@]12COC[C@@H]1C2 1875270271 MPMWHLGKYVUPQQ-NHYWBVRUSA-N 384.383 2.804 0 50 GFAA Cc1cccc(-n2cc(C(=O)N(CC(=O)O)Cc3ccccc3Cl)nn2)c1 1875257431 QBRGSZWPWLORNQ-UHFFFAOYSA-N 384.823 2.956 0 50 GFAA CCOc1cccnc1S(=O)(=O)N(C)C[C@@H]1CCCc2sc(C)nc21 1875298951 TULSUQJDLNOYIJ-ZDUSSCGKSA-N 381.523 2.986 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)C(=O)NCC(C)(C)c2cnccn2)s1 1875313120 HPEORWYUZUQUJI-UHFFFAOYSA-N 395.488 2.941 0 50 GFAA O=C(NCCc1ccc(CN2CCOCC2)cc1)c1cnn(CC2CCCC2)c1 1875357336 CBOMBDICXFXZJW-UHFFFAOYSA-N 396.535 2.878 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2nnc(C3(c4ccccc4)CC3)s2)CC1 1875365449 VTYPKDPOQUFRMV-UHFFFAOYSA-N 382.489 2.981 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1cnnc(-c2ccccc2)c1 1875401851 UNJMOHFCYBOKIA-FUHWJXTLSA-N 390.447 2.591 0 50 GFAA CCOC(=O)C[C@@H](NS(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1 3626805 FGJBAWRVRCPOEY-GOSISDBHSA-N 377.462 2.976 0 50 GFAA CC(C)NC(=O)Nc1ccc(C(=O)N[C@H]2c3cccc(O)c3C[C@H]2C(=O)O)cc1 2325820989 GNIIMSGFFQRDIB-AEFFLSMTSA-N 397.431 2.650 0 50 GFAA Brc1ccc(-c2ccnc(NCc3cnn4c3CNCC4)n2)cc1 2325858398 LORIZIHFOUJPAA-UHFFFAOYSA-N 385.269 2.818 0 50 GFAA COc1ccc(N([C@H](C)C(=O)Nc2cccc(C(C)=O)c2)S(C)(=O)=O)cc1 1115784 NZOMHXITBQRMKK-CYBMUJFWSA-N 390.461 2.691 0 50 GFAA CCN(CC)C[C@@H](O)CN(c1cccc(C)c1)S(=O)(=O)c1ccccc1 2988318 JCSYGSKTMQRGLF-LJQANCHMSA-N 376.522 2.893 0 50 GFAA COc1ccccc1CN1C(=O)C(=O)N(Cc2c(F)cccc2Cl)C1=O 4013488 ZSJCSILEIHCDAK-UHFFFAOYSA-N 376.771 2.979 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCC(N3CCCCCC3)CC2)cc1 4744128 WMRUCRFBZWLYAG-UHFFFAOYSA-N 379.526 2.674 0 50 GFAA CC(=O)Oc1ccccc1C(=O)N(C)c1c(C)n(C)n(-c2ccccc2)c1=O 6184187 HTURIJKWRRLMFZ-UHFFFAOYSA-N 379.416 2.686 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N2CCC[C@@H]2C(=O)O)cc1 6646373 RMXOJFYFBGLTHY-GDLUXTLDSA-N 394.427 2.542 0 50 GFAA Cc1c(CN2CCC[C@@H](CCC(=O)NC3CC3)C2)c(=O)n(-c2ccccc2)n1C 12092985 PLPQVVRRDAWKLN-SFHVURJKSA-N 396.535 2.755 0 50 GFAA COc1ccccc1CCCNC(=O)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 12306894 HDJPUNIOXPXBCD-LJQANCHMSA-N 395.503 2.620 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@H](NCc1ccccn1)CC2 14538671 HRYWLDWBDFRXHZ-GOSISDBHSA-N 389.503 2.734 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3cccnc3)CC2)cc1Br 19558944 UOOHKABWZYYYLI-UHFFFAOYSA-N 390.281 2.811 0 50 GFAA Cc1nc2nc3ccn(C[C@H]4CCCO4)c(=O)c3c(-c3ccc(F)cc3)n2n1 40398564 MXYDWUNNDMIPJC-OAHLLOKOSA-N 379.395 2.733 0 50 GFAA COCc1c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC[C@H]2C)noc1C 55199156 SDCFSRPYRHQWKV-GFCCVEGCSA-N 386.452 2.859 0 50 GFAA COc1cc(NC(=O)c2ccnc(-n3cnnc3)c2)ccc1NC(=O)CC(C)C 55328004 YSIQGZREYLZVEN-UHFFFAOYSA-N 394.435 2.908 0 50 GFAA COc1ccc([C@H]2N[C@](CO)(c3ccccc3)[C@H]3CN(C)C[C@@H]23)c(Cl)c1O 65425793 KDMJCDMPHOFINT-NNNWTRQLSA-N 388.895 2.764 0 50 GFAA O=C(C1CC1)N1CCCN(Cc2ccc(O[C@@]34CCCN(CC3)C4)cc2)CC1 67473065 XREGABQTMOKSHE-QHCPKHFHSA-N 383.536 2.748 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](N)CN1C1CCN(c2ccccc2Cl)CC1 67869050 RNBPTQCNTYWYSA-KXBFYZLASA-N 378.948 2.579 0 50 GFAA C[C@H]1CN(C(=O)c2nc3sccn3c2-c2nc3ncccc3[nH]2)C[C@@H](C)O1 71752162 HAINLAWCMSJCOD-PHIMTYICSA-N 382.449 2.584 0 50 GFAA Cc1ccccc1NC(=O)N1CCN(c2cc(-n3cnc(C)c3C)ncn2)CC1 72119275 BJVKHEMFUGMOJE-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CC(=O)Nc1ncc(C(=O)N2CCC[C@H](N(C)CCc3ccccc3)C2)s1 72143300 SXYQNOWMNYSISL-KRWDZBQOSA-N 386.521 2.881 0 50 GFAA CC(C)c1ccc(C(=O)N2CC[C@@H](Cc3ccc(C(=O)O)cc3)C2)c(=O)n1C 72435504 KJTFJNKDNLEISH-INIZCTEOSA-N 382.460 2.912 0 50 GFAA O=C(O)[C@H]1CC2(CCN(c3nccc4ccccc34)CC2)CN1C(=O)C1CC1 72475173 CJNGQJRAQNHLHO-GOSISDBHSA-N 379.460 2.917 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4ccccc4O)C3)CCC2=O)cn1 91664919 KQJHCVJJHNVZSL-QFIPXVFZSA-N 394.475 2.536 0 50 GFAA CC(C)=CCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)Cc1cnc3c(C)cccn13)C2 95357131 YAYYNSYVQMBPPC-ZWKOTPCHSA-N 380.492 2.601 0 50 GFAA COCC(=O)N(CC1CCN(C2Cc3ccccc3C2)CC1)C[C@H]1CCCO1 95508674 KJJZXTYVXMVRLO-JOCHJYFZSA-N 386.536 2.520 0 50 GFAA Cc1nnnn1-c1ccc(NC(=O)NC[C@@H](c2ccco2)N2CCCC2)cc1 96163288 DZSAHNUANWMUTO-KRWDZBQOSA-N 381.440 2.522 0 50 GFAA CC(C)(NS(=O)(=O)c1ccc(F)cc1Cl)C(=O)NCC1CCCC1 135662690 XWNVWOGPIIVTML-UHFFFAOYSA-N 376.881 2.842 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1 186970255 JZZVSSDRLOLJKR-HNNXBMFYSA-N 375.454 2.566 0 50 GFAA Cc1cc(C(=O)NC2CCN(C(=O)c3cc(N4CCCC4)ccn3)CC2)c(C)o1 194563278 HCBRRUDUCRSIBW-UHFFFAOYSA-N 396.491 2.926 0 50 GFAA CCOC(=O)[C@@H](COC)N(C(=O)COc1cc(Cl)ccc1Cl)C1CC1 225563154 BBSLIIJTXBWNQA-CQSZACIVSA-N 390.263 2.941 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237456126 MOYFLEUMNBMJNY-STQMWFEESA-N 377.286 2.834 0 50 GFAA NC(=O)[C@H]1C[C@H](C(=O)O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21 253185535 PZLZBGBHBUGRNT-BFUOFWGJSA-N 394.427 2.586 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CCN1 262940074 UJWTYHHVRNCVIF-LZQZEXGQSA-N 389.499 2.867 0 50 GFAA Cc1ccc(-c2noc(CCC(=O)N3CCC(F)(F)[C@H](CO)C3)n2)cc1F 291186431 JAMGOQKVOSBQRX-ZDUSSCGKSA-N 383.370 2.593 0 50 GFAA O=C(NCc1csc(Br)c1)[C@@H]1CC[C@H](C(F)(F)F)NC1=O 298471274 PZSIHCBQKCPRQD-JGVFFNPUSA-N 385.205 2.584 0 50 GFAA COc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1OC 363435470 GUTBJADUJZBCPI-LJQANCHMSA-N 396.487 2.801 0 50 GFAA Cn1cc([C@H](NC(=O)N2CCOc3cc(O)ccc3C2)c2ccc(F)cc2)cn1 376933288 TUYSXBGUSOYFSC-HXUWFJFHSA-N 396.422 2.958 0 50 GFAA CCc1nc(CN2CCC[C@@H](NC(=O)[C@H](C)c3c(F)cccc3F)C2)no1 378321302 XLHRQAJOFYPSNR-CHWSQXEVSA-N 378.423 2.795 0 50 GFAA O=C(NCC[C@@H]1CCCCN1)c1ccc(-c2ccc(-c3nn[nH]n3)cc2)cc1 426435420 OROLGWJYJVHPEK-IBGZPJMESA-N 376.464 2.796 0 50 GFAA CCCn1ncnc1[C@@H](C)NC(=O)c1cccc(-c2ccc(C(=O)O)cn2)c1 426641491 JCBWZBVEJRYLHW-CYBMUJFWSA-N 379.420 2.939 0 50 GFAA CCOc1cccc(CN(CCO)[C@H]2CCN(c3ccccc3OC)C2=O)c1 452052195 ZIENBUAQRDBMQP-FQEVSTJZSA-N 384.476 2.694 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1ccc(F)cc1 764703120 GEFGOPBNTPPJED-UHFFFAOYSA-N 387.816 2.623 0 50 GFAA O=C(C[C@H]1CCc2ccccc21)Nc1ccc(OCC(=O)N2CCOCC2)cc1 827807385 ITQIBBAKTKRLDS-GOSISDBHSA-N 394.471 2.983 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(OC[C@@H]2CCCCO2)cc1 827861300 BDONLYAQNPVKIP-SFHVURJKSA-N 393.443 2.983 0 50 GFAA C[C@H]1Oc2ccc(NC(=O)c3cnc(-c4ccccn4)nc3)cc2N(C)C1=O 952978657 SMJODSVBQYAHEW-GFCCVEGCSA-N 375.388 2.535 0 50 GFAA CN(Cc1cc(=O)n2nc(C3CC3)sc2n1)C[C@H]1Cc2ccccc2CN1C 1506421993 YBHXHYXSOOSARX-GOSISDBHSA-N 395.532 2.517 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)n1 1565511283 MHFADPQVTPNRBE-QUCCMNQESA-N 376.460 2.686 0 50 GFAA COc1cc(C)sc1C(=O)N[C@H]1COCC[C@@H]1Oc1ccc(CO)cc1 1565530158 DONAZBFVCSLSTP-HOTGVXAUSA-N 377.462 2.524 0 50 GFAA COCCNC(=O)c1cc2c(s1)CCOC21CCN(Cc2ccoc2)CC1 1857685871 YIPUIZHUJFRTQM-UHFFFAOYSA-N 390.505 2.781 0 50 GFAA O=C(O)CN1CC[C@H]2[C@@H]1CC(=O)N2CCC(c1ccccc1)c1ccccc1 1857705152 VCPWAGCKTLUPEY-SFTDATJTSA-N 378.472 2.968 0 50 GFAA COc1cc(C(=O)N[C@H]2C[C@H]3CO[C@H](C(C)C)CN3C2)ccc1OC(C)C 1857730313 QMIXVMRDAZCAFL-ZWOKBUDYSA-N 376.497 2.710 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCn4nccc4C)C3)nc2c1 1857739130 DJTQKNJGFNZDTR-INIZCTEOSA-N 397.479 2.764 0 50 GFAA Cc1noc(C)c1COc1ccccc1C(=O)N[C@@H](C)c1nnc2ncccn12 1875264738 IBIFFOSGXGXXEO-ZDUSSCGKSA-N 392.419 2.799 0 50 GFAA Cn1cnc([C@@H](CNc2ncnc3[nH]c(Br)cc23)N2CCCC2)c1 1875313411 NGMXPOYKYCSVHQ-CYBMUJFWSA-N 390.289 2.703 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(c3cccnc3)C[C@H]2C1 1875329248 MRXKTYIRPGBYMV-MZKRTTBSSA-N 393.487 2.929 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cc(C2CC2)[nH]n1 1875403360 UNENDYFNWHFQTR-LXGCGDOSSA-N 391.475 2.720 0 50 GFAA COc1cc(-c2cc(=NC(=O)C[C@@H](C)n3ccnc3C)[nH][nH]2)cc(OC)c1OC 2100480249 BGCISJLLDXXCAQ-GFCCVEGCSA-N 399.451 2.619 0 50 GFAA CCOc1ccc(N([C@H](C)C(=O)NCc2ccc(C)cc2)S(C)(=O)=O)cc1 1139868 QMNBBWPYISOPIL-MRXNPFEDSA-N 390.505 2.865 0 50 GFAA O=C(c1cc(O)no1)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356159279 UAGVKHAJFQVKMY-OAQYLSRUSA-N 376.416 2.957 0 50 GFAA CCc1ccccc1N(CC(=O)Nc1cc(C)ccc1OC)S(C)(=O)=O 2979704 OMGKACSDJSMDKC-UHFFFAOYSA-N 376.478 2.971 0 50 GFAA C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCO1 4410572 ANBKWOVLQRFZTG-RYQLBKOJSA-N 392.496 2.780 0 50 GFAA CCOCCCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 4809425 APEAOMSETAFRRV-UHFFFAOYSA-N 376.478 2.952 0 50 GFAA Cc1cccc(CN2CCN(C(=O)CCc3[nH]nc4c3CCCC4)[C@@H](C)C2=O)c1 55134257 KJNBZGNHZTYVOW-KRWDZBQOSA-N 394.519 2.789 0 50 GFAA CC(C)(C)OC(=O)NCC1CCN(C(=O)c2snc(O)c2Cl)CC1 225802710 OMPSQUMSJPWIDV-UHFFFAOYSA-N 375.878 2.879 0 50 GFAA COc1ccc(C)cc1N1C[C@H](C(=O)N2CCN(c3ccccc3)CC2)CC1=O 9266234 BIXGNDAQYBHUIH-GOSISDBHSA-N 393.487 2.705 0 50 GFAA CC[C@H](C(=O)N1N=C(C(F)F)C[C@@]1(O)C(F)F)n1nc(C)c(Cl)c1C 6555263 JHZHZDBHJPVTFV-YMTOWFKASA-N 384.761 2.912 0 50 GFAA C[C@H](NC(=O)c1cccs1)C(=O)N1CCC[C@@H]1CN1CCc2ccccc21 140395462 XLZYGPLMODREGA-DOTOQJQBSA-N 383.517 2.920 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cnc(C)cc1C)C(=O)N(C1CCCC1)C2 71745895 JRISPLLHZWNXGL-UHFFFAOYSA-N 394.475 2.930 0 50 GFAA O=C(NCc1cccnc1)c1cn2c3c(cc(Br)cc3c1=O)CC2 33088973 OAOPTNIAPIQBHZ-UHFFFAOYSA-N 384.233 2.645 0 50 GFAA CN1C(=O)[C@@](CC(=O)N2CCCOCC2)(Cc2ccccc2)c2ccccc21 71736100 CILPTSROXSOPOM-HSZRJFAPSA-N 378.472 2.783 0 50 GFAA C1CC[C@H](c2nnc(N3CCOC[C@H](C4CCC4)C3)n2C[C@@H]2CCCO2)OC1 428192468 QYINATAYQHFNOK-CEXWTWQISA-N 390.528 2.952 0 50 GFAA CCc1c(C)sc(NC(=O)c2ccnn2C)c1C(=O)NCc1cccnc1 6394585 KSFKREUYSRNFEK-UHFFFAOYSA-N 383.477 2.930 0 50 GFAA CCn1ncc2cc(C(=O)NCc3ccc(N4CCCC4=O)cc3)c(C)nc21 281470530 NVIFKCQCUFKICM-UHFFFAOYSA-N 377.448 2.816 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCN(c2ccncc2)CC1 121900075 LCZWWMZNRKUXDF-HXUWFJFHSA-N 379.508 2.578 0 50 GFAA CN(C)Cc1cc2n(n1)CCCN(C(=O)c1cnc(Nc3ccccc3)nc1)C2 72432056 TZLKMMXWCLWMGM-UHFFFAOYSA-N 391.479 2.524 0 50 GFAA CCOc1ccc(CN2CCC[C@H](CNC(=O)c3cccnc3)C2)cc1CO 12315213 CYSWPNQVNKMCQH-GOSISDBHSA-N 383.492 2.615 0 50 GFAA CNC(=O)c1ccc(CNCc2ccccc2CN2C[C@H](C)O[C@@H](C)C2)cc1 123447500 LATVDZLPNPHCRD-ROUUACIJSA-N 381.520 2.945 0 50 GFAA Cc1ccc2nc(N3CCC[C@@H](O)C3)c(CN(C)Cc3cnn(C)c3)cc2c1 72409087 HXFFWRLYPOGGEC-HXUWFJFHSA-N 379.508 2.870 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(c3cc(C4CC4)ncn3)CC2)C1)N1CCCC1 71750627 NJOAQNRETXTJDK-GOSISDBHSA-N 383.540 2.657 0 50 GFAA COc1cc2nc(N3CCO[C@]4(CCc5ccccc54)C3)nc(N)c2cc1OC 157871694 GMUVQBBAMPTLQZ-JOCHJYFZSA-N 392.459 2.908 0 50 GFAA C[C@H]1C[C@@H](C)CN(CCCCNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1 237512268 XTMIQBIDGUOCJI-OKILXGFUSA-N 386.489 2.560 0 50 GFAA Cc1cccc2[nH]c([C@@H]3CCCN(C(=O)c4cnc(C5CC5)[nH]c4=O)C3)nc12 77505687 QVMWLVNFIUJWLP-CQSZACIVSA-N 377.448 2.852 0 50 GFAA Cc1ccc(N2C(=O)[C@@]3(Cc4ccccc4N4CCC[C@H]43)C(=O)N=C2O)cc1 229958802 PTKLITULSWPWCX-PGRDOPGGSA-N 375.428 2.994 0 50 GFAA Cc1cc(N2CCCN(C(=O)C3CCN(Cc4ccco4)CC3)CC2)ccn1 220632012 HDOONRQXOFDQJX-UHFFFAOYSA-N 382.508 2.934 0 50 GFAA C[C@](O)(CNC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccc(F)cc1 131393178 AFUDDJSSJYTPKY-SFHVURJKSA-N 378.835 2.507 0 50 GFAA CCCC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@](CO)(Cc2ccc(F)cc2)C1 290640119 MTMVPHGUVPVDPA-KNQAVFIVSA-N 390.499 2.760 0 50 GFAA Cc1cccc(-n2cc(CNC(=O)N3CCC[C@@H](Cn4ccnc4)C3)cn2)c1 426386913 OHAWNFZMWZQUCK-SFHVURJKSA-N 378.480 2.999 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)CCO1 238048350 HOSRNZYYOXIVJT-OEMOTLHWSA-N 377.746 2.988 0 50 GFAA Cc1cc(F)cc(S(=O)(=O)NC(=O)c2cccnc2OCC(F)(F)F)c1 180025715 YTSBUEWEUXJRRP-UHFFFAOYSA-N 392.330 2.589 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@H](NS(=O)(=O)N2CCCC2)C1 92077069 PVLQRKBYYRSEQV-QGZVFWFLSA-N 392.500 2.955 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)c1 91586407 RELWVOCCJPMHSC-UHFFFAOYSA-N 381.432 2.743 0 50 GFAA CC(C)OCCCNC(=O)C1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263616071 GVKRZBMSGNGUGJ-UHFFFAOYSA-N 399.539 2.756 0 50 GFAA O=C1N(CCO)c2ccccc2[C@@]12CCN(Cc1c[nH]nc1-c1ccccc1)C2 1940195303 KKBINGSKAODFEI-QHCPKHFHSA-N 388.471 2.559 0 50 GFAA CCn1cc(-c2cccc(C(=O)NC3CCN(C[C@H]4CCCO4)CC3)c2)cn1 299802213 YCVNKGONBHIHKH-OAQYLSRUSA-N 382.508 2.943 0 50 GFAA CCN1CCN(CC(=O)N(Cc2ccc(OC)c(OC)c2)C2CCCC2)CC1 823112998 YNEDLRJQUYNUIH-UHFFFAOYSA-N 389.540 2.613 0 50 GFAA COc1cc(S(=O)(=O)N(C)C[C@@H]2CC(=O)N(C(C)(C)C)C2)c(C)cc1C 952986956 HCYAUXKEQNJIFZ-HNNXBMFYSA-N 382.526 2.580 0 50 GFAA Cc1cccc(OC2CN(S(=O)(=O)c3cc(-n4cccn4)ccc3C)C2)c1 952972005 HCZSCHAIZIAXRA-UHFFFAOYSA-N 383.473 2.941 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cnc(CC(C)C)nc2)cc1 410013778 WEXGPHFGLMBJBO-GOSISDBHSA-N 382.464 2.927 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2[nH]1 170838672 VMVNELLCUSJBDD-DNVCBOLYSA-N 376.460 2.974 0 50 GFAA O=C([C@H]1COc2ccccc2O1)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 170654082 BGKYDJGRAYTHGG-MRXNPFEDSA-N 393.365 2.589 0 50 GFAA Cn1ccc([C@H]2NC(=O)N(Cc3nc(-c4ccc(Cl)cc4)cs3)C2=O)n1 170613935 JAQRDJORKHVDRN-OAHLLOKOSA-N 387.852 2.990 0 50 GFAA Cn1nccc1C1CCN(S(=O)(=O)c2cccc3c2OC(C)(C)C3)CC1 192632671 SJBHTGPNFAIRGY-UHFFFAOYSA-N 375.494 2.702 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CC(=O)N(c2ccccc2)C1 195221610 HMTKHVBLAWQYJT-GOSISDBHSA-N 392.459 2.850 0 50 GFAA COC(=O)c1ccc(NC(=O)COC(=O)CSc2nc3ccccc3[nH]2)cc1 1772491100 XWTHFUZUTARWSJ-UHFFFAOYSA-N 399.428 2.624 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@@H](C(=O)c2cc(F)ccc2F)C1 11936242 WEBHBCUPORSTJI-GFCCVEGCSA-N 377.391 2.960 0 50 GFAA C[C@@]1(COc2ccc(C(=O)N3CCC(Cn4cccn4)CC3)cn2)CCCNC1 12429832 YIFDAIOZQQVSCK-JOCHJYFZSA-N 397.523 2.599 0 50 GFAA COc1ccc(-c2noc(CN3CCC(C(=O)N4CCCCC4)CC3)n2)cc1 12572789 DWZSLDSWYMZLJE-UHFFFAOYSA-N 384.480 2.970 0 50 GFAA Cc1cc(=O)n2nc(N3CCC[C@H](C(=O)N[C@H](C)c4ccccc4)C3)sc2n1 13110883 FJKVGYLFYFQGGM-ZBFHGGJFSA-N 397.504 2.553 0 50 GFAA COc1ccc(OCc2nc(C(=O)N(C)Cc3c(C)nn(C)c3C)co2)cc1 15066875 XWVIHCYOBIODDV-UHFFFAOYSA-N 384.436 2.885 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)NC[C@H](c3ccco3)N3CCOCC3)oc2c1C 15859906 PGJSYOWOFWZASH-QGZVFWFLSA-N 396.443 2.806 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1C 16625082 VLYLRJZJTWKMDH-UHFFFAOYSA-N 388.489 2.586 0 50 GFAA COc1ccccc1NC(=O)CSc1nc(N)c(-c2ccccc2)c(=O)[nH]1 18082364 UMEFHODEENEJTJ-UHFFFAOYSA-N 382.445 2.759 0 50 GFAA O=C1CCO[C@H]2CN(c3ncnc4sccc34)C[C@@H]2N1Cc1ccccc1 1857709691 MBCOOMDSOITTGX-IRXDYDNUSA-N 380.473 2.698 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)N1CCCNCC1 1857714508 BXSJPYLFUIIVND-AWEZNQCLSA-N 376.888 2.910 0 50 GFAA O=C(CN1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1)Nc1cccc(Cl)c1 1857715986 QTIGGLYLOKREQW-CTNGQTDRSA-N 388.895 2.567 0 50 GFAA COc1ccnc(N2CCN([C@@H](C)c3nc(-c4ccc(C)c(F)c4)no3)CC2)n1 140257796 JVOCEDHGNCXJPW-AWEZNQCLSA-N 398.442 2.866 0 50 GFAA CC(=O)Nc1nc(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)cs1 363384574 MIPVSYMOOZVXKI-UHFFFAOYSA-N 376.457 2.635 0 50 GFAA C[C@@H]1Oc2c(cccc2C(=O)NC2(c3ccc(F)cc3)CCOCC2)NC1=O 264359791 FJLMCYNDIYZZIB-ZDUSSCGKSA-N 384.407 2.981 0 50 GFAA C[C@H](NC(=O)[C@@H]1COc2ccc(O)cc2O1)[C@H](O)c1c(F)cccc1Cl 866791171 WJVILMIOUZMVMW-KMNYPPFZSA-N 381.787 2.563 0 50 GFAA CN(C)C(=O)C[C@@H](NC(=O)[C@@H]1CNC[C@H](c2ccccc2)C1)c1ccccc1 1875277006 VXLSQTAVALWQIE-QHAWAJNXSA-N 379.504 2.716 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@H](CO)Cc2ccccn2)nn1-c1ccccc1 1875284285 PGGJSJSPYHUEBS-SFHVURJKSA-N 378.476 2.799 0 50 GFAA CC(=O)Nc1ccc(-c2ccc([C@H](C)C(=O)NS(C)(=O)=O)cc2F)cc1F 1875325079 QHYZAQLIFLIREU-JTQLQIEISA-N 396.415 2.770 0 50 GFAA Cc1ccnc(Nc2cccc(C(=O)N=S3(=O)CCC4(CCN4)CC3)c2)n1 1875319696 OEUNGQPRYCJIET-UHFFFAOYSA-N 385.493 2.663 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1cnnc(-c2ccccc2)c1 1875401850 UNJMOHFCYBOKIA-AEFFLSMTSA-N 390.447 2.591 0 50 GFAA Cc1ccccc1Oc1ccc(C(=O)N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)nc1 1875402512 IFVJIYHCQYAZTJ-PWIZWCRZSA-N 392.459 2.948 0 50 GFAA N[C@@H]1CCc2nc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cn2C1 2325855888 SKDHTGOYXNXUFU-OAHLLOKOSA-N 375.432 2.661 0 50 GFAA COc1cc(NC(=S)N2CCN(c3ncccn3)CC2)c(OC)cc1Cl 2415476 OSMNTDUIWJGPEL-UHFFFAOYSA-N 393.900 2.666 0 50 GFAA CCOC(=O)c1c(NC(=O)[C@H]2CCCO2)sc(C(=O)N(CC)CC)c1C 2736896 SMXZARZSSDAHCR-GFCCVEGCSA-N 382.482 2.833 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H](C)Oc1ccc(OC)cc1 2848525 DQQFTWDXCPEIIK-GFCCVEGCSA-N 389.404 2.905 0 50 GFAA Cc1ncc2c(c1-c1noc(C3CCOCC3)n1)CCN(c1cnccn1)C2 20233859 IQJRRUYWINAARY-UHFFFAOYSA-N 378.436 2.687 0 50 GFAA O=C(Nc1ccc(Cl)cc1)N1CCN(c2cc(-n3cccn3)ncn2)CC1 65365835 LXLYJXANWBQVQD-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA Nc1nnc(SCC(=O)NCc2cc(-c3ccccc3Cl)no2)s1 55309434 VVTDGPJVXVLAKZ-UHFFFAOYSA-N 381.870 2.837 0 50 GFAA O=C1CC2(CCCC2)CC(=O)N1CCCCNC[C@H]1COc2ccccc2O1 2557963 HCVRCHQFYYZPHT-KRWDZBQOSA-N 386.492 2.906 0 50 GFAA in-vitro CCN(C1CCCCCC1)S(=O)(=O)c1sc2c(c1C(=O)O)CCNC2 67489891 KUIXFYMGVGWGOP-UHFFFAOYSA-N 386.539 2.825 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3c2c(-c2cccnc2)nn3C)cc2c1OCO2 65462129 RXAKJSFSDHRWBN-ZDUSSCGKSA-N 378.388 2.694 0 50 GFAA Cc1cccc2[nH]c([C@H]3CCCN(C(=O)c4cc5n(n4)CCN(C)C5)C3)nc12 67643164 JFGOTDZXCRVYCZ-HNNXBMFYSA-N 378.480 2.533 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc4c(c3)OCCO4)C[C@H]2CCO)cc1 36385656 OOUJGJJERQPVJB-OAQYLSRUSA-N 382.504 2.835 0 50 GFAA CC1(C)[C@@H]2C[C@@H]1CC(=O)[C@]2(C)OC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 252485010 GMFYNJHSTOUGIQ-OPOZHTRXSA-N 394.537 2.649 0 50 GFAA O=C(c1ccccc1)N1CCCN([C@H]2CCN(c3ccccc3F)C2=O)CC1 171821503 ZYRSTWMUAWEPMH-FQEVSTJZSA-N 381.451 2.779 0 50 GFAA CC(C)c1nnc([C@H]2CN(S(=O)(=O)c3c(F)cccc3Cl)CCO2)o1 328626933 MFCBNIIUCRJEQK-GFCCVEGCSA-N 389.836 2.748 0 50 GFAA Cc1noc(C2(NC(=O)[C@H]3CC(=O)N(c4cccc(F)c4)C3)CCCCC2)n1 77197361 MVNMODURHOURCX-AWEZNQCLSA-N 386.427 2.846 0 50 GFAA NC(=O)[C@H](NC(=O)NC[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1 363663833 GSLYTCAFJGNPHA-DNVCBOLYSA-N 384.455 2.568 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1Cn1cncn1 363678280 LFRXNPHRLVDVGJ-HXUWFJFHSA-N 389.503 2.968 0 50 GFAA Cc1cc2nc(CCC(=O)N3CCC(c4ccnc(N)n4)CC3)[nH]c2cc1C 219957168 PSOBNTJJSKTCJJ-UHFFFAOYSA-N 378.480 2.891 0 50 GFAA CC(C)Cc1ccc(CN2CCn3nc([C@@H](O)c4ccnn4C)cc3C2)s1 219820594 CVGZEZPUBUKJJF-HXUWFJFHSA-N 385.537 2.974 0 50 GFAA Cc1nc2n(n1)CCC[C@@H]2NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 176288773 AYIYQEAXOWITEB-HNNXBMFYSA-N 380.452 2.610 0 50 GFAA CCOC(=O)Cc1c(C)[nH]c2c(-c3cccc(Br)c3)cnn2c1=O 18187884 HTOWJOTXUVFVBR-UHFFFAOYSA-N 390.237 2.866 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2c(F)cccc2F)C[C@H]1c1ccc2c(c1)OCO2 91808100 PTSZQBLZJVSCPK-NWDGAFQWSA-N 375.327 2.634 0 50 GFAA COc1ccc(-c2nnc(C)o2)cc1NC(=O)NCCc1nc(C)cc(C)n1 96153079 FNKRDVBNPIQMOD-UHFFFAOYSA-N 382.424 2.825 0 50 GFAA Cc1nnc(SCCCNc2cc([C@H]3C[C@@H](N)C3)nc(N(C)C)n2)s1 244673938 HYKZYGRZSPWYEV-TXEJJXNPSA-N 379.559 2.502 0 50 GFAA Cc1ccccc1NC(=O)Cn1ccn2nc(-c3ccccc3)c(CO)c2c1=O 263618748 VIOAPWITSIRQIK-UHFFFAOYSA-N 388.427 2.602 0 50 GFAA Cc1occc1C(=O)Nc1nc2c(s1)C(=O)C[C@H](C(=O)N(C)C(C)C)C2 299763967 ZOKPOXOTOZWDOV-LLVKDONJSA-N 375.450 2.909 0 50 GFAA COc1c(C)cc(-c2cccc(C(=O)NC[C@@H]3CN(C)CCN3C)c2)cc1C 299801168 YXEMCMZKWUGDHS-OAQYLSRUSA-N 381.520 2.955 0 50 GFAA CC(C)n1cc(CN(C)C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 584890197 UUGPLERYCWYCCW-AWEZNQCLSA-N 378.498 2.770 0 50 GFAA Cc1oc(-c2cc[nH]n2)cc1S(=O)(=O)N1CCCN(C2CCCC2)CC1 952872645 BDHDSZGZLZQZJA-UHFFFAOYSA-N 378.498 2.617 0 50 GFAA Cc1nccn1Cc1ccccc1NC(=O)c1cn([C@H]2CC[C@@H](N)CC2)nn1 952989110 HLGXHNUCQWDYOA-CALCHBBNSA-N 379.468 2.526 0 50 GFAA COCc1nc(OC)c2c(C)c(C(=O)NCCCCCCC(=O)O)sc2n1 170672306 ZGGAUWYNRBSNQS-UHFFFAOYSA-N 395.481 2.920 0 50 GFAA O=C(c1nc(-c2ccccc2)n2c1CCCCC2)N1CCN2C(=O)OCC[C@@H]2C1 764261366 YZVURYKNJNMOSF-QGZVFWFLSA-N 394.475 2.943 0 50 GFAA C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC(O)(c2ccc(F)cc2)C1 792876896 ZYYUVRIZSNPFKA-ZDUSSCGKSA-N 378.394 2.827 0 50 GFAA CC(C)c1ccc(-n2cc(CN3C[C@H](Cc4cnccn4)[C@@H](O)C3)cn2)cc1 1615736683 LQZBNHFFVBAZPT-UGKGYDQZSA-N 377.492 2.821 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N1CCC([C@H](O)c2cccs2)CC1 1506423081 SJXPNQFQONHCSK-IBGZPJMESA-N 393.530 2.884 0 50 GFAA O=C(NCc1ccc2c(c1)CCCO2)[C@@]1(Cc2cscn2)C[C@H]2CC[C@@H]1N2 1704340164 WILSEAHAYPPHEY-LKUPVBHCSA-N 383.517 2.838 0 50 GFAA CCc1nccc(CN2CCCN(C(=O)c3cn(C)c4ccccc34)CC2)n1 1775979955 QHMODOUVFHUFRD-UHFFFAOYSA-N 377.492 2.879 0 50 GFAA O=C(Cn1c2ccccc2c2cc(Cl)ccc21)N1C[C@H]2[C@@H](C1)C2(CO)CO 1772709967 TYVOUPVEIZNBRO-CALCHBBNSA-N 384.863 2.507 0 50 GFAA Cc1cc(C(=O)NCc2nnc3n2CCN(C[C@@H]2CC=CCC2)CC3)c(C)o1 11872296 JDWWPDAYZSRRFU-QGZVFWFLSA-N 383.496 2.632 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)CCC(=O)OC 12298312 QKQCSTHCDPZSBO-LJQANCHMSA-N 390.524 2.751 0 50 GFAA O=C(CSc1nc2ccccc2c(=O)[nH]1)N1CCN(c2ccccc2F)CC1 12360235 JEMBKQSZZOKYTO-UHFFFAOYSA-N 398.463 2.503 0 50 GFAA biogenic,in-vitro CCOC(=O)CN(C)C(=O)CC[C@]1(Cc2ccc3ccccc3c2)CCC(=O)N1 14878872 GTTAFMNUZCWJOV-QHCPKHFHSA-N 396.487 2.833 0 50 GFAA O=c1c2c3c(sc2ncn1Cc1ccccc1)C[C@@H](N1CCOCC1)CC3 14964413 FJMHGCZWJBBNDW-INIZCTEOSA-N 381.501 2.696 0 50 GFAA CCOC(=O)c1cnn(-c2ccc3c(c2)OCCO3)c1CNCc1cccnc1 15068078 YOFQOAZKTQHANW-UHFFFAOYSA-N 394.431 2.505 0 50 GFAA Cc1ccc(-c2ccc3nnc(CNC(=O)c4ccc5c(c4)OCO5)n3n2)cc1 169778450 OCDZOBRMHFWSKS-UHFFFAOYSA-N 387.399 2.758 0 50 GFAA COc1ccc(C(=O)N[C@@H]2CC[C@H](O)C2)cc1Oc1cccc(OC)c1CN 1857692524 JENGNBMFQBRLNW-CABCVRRESA-N 386.448 2.598 0 50 GFAA Cc1ccccc1CC(=O)N1CCO[C@@H](CN2CCCCC2)[C@@H]1c1cnn(C)c1 1857710289 PERKHWZBOZPEMY-GMAHTHKFSA-N 396.535 2.726 0 50 GFAA Cc1nn(CC(=O)Nc2nc3c(o2)C[C@H](C(C)C)CC3=O)c(=O)c2ccccc12 1875241224 RCIJNLYRPQYHTN-CYBMUJFWSA-N 394.431 2.733 0 50 GFAA CN(C)S(=O)(=O)c1cccc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)c1 437372713 KVBASSPYMQVMEB-DLBZAZTESA-N 378.881 2.876 0 50 GFAA Cn1ncc2c(O)nc(CCC(=O)N[C@@H]3CCC(C)(C)c4ccccc43)nc21 745807242 YQZYCFKVYUOKHK-MRXNPFEDSA-N 379.464 2.930 0 50 GFAA O=C(C[C@H]1Oc2ccccc2NC1=O)OCc1ncc(Br)s1 785022035 ZGTKTIASURRJPJ-SNVBAGLBSA-N 383.223 2.739 0 50 GFAA Cc1ccc(CNC(=O)c2nnc(CN3CCC4(CCOCC4)C3)s2)cc1 266602038 DSWMWKZJBARLCR-UHFFFAOYSA-N 386.521 2.779 0 50 GFAA CC(C)C(=O)NCC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704340056 FHYQIFHOVTUXRM-HSZRJFAPSA-N 392.503 2.722 0 50 GFAA O=C(N[C@@H]1C[C@H]2CCCCN2C1=O)c1cc2ccc(C(F)(F)F)cc2nc1O 822302730 RQGHKQKEKKRFKY-IUODEOHRSA-N 393.365 2.842 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NCCS(=O)(=O)C3CC3)c12 839856969 ZPTUCGVJKSFNHF-UHFFFAOYSA-N 385.445 2.505 0 50 GFAA C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)Nc1cnc2c(c1)CNCC2 2325722331 GCSRHNCYVFSJAF-GFCCVEGCSA-N 395.488 2.637 0 50 GFAA CS(=O)(=O)c1cccc(C[C@@H]2CCCN(c3nccc4nccnc34)C2)c1 2325796205 ARYJUVUWNYAIAA-INIZCTEOSA-N 382.489 2.887 0 50 GFAA CN1CCCc2ccc(NS(=O)(=O)c3ccccc3Cn3cncn3)cc2C1 2325798945 KNKFNTMDVWIMRJ-UHFFFAOYSA-N 397.504 2.505 0 50 GFAA C[C@@H]1CCn2ncc(C(=O)N[C@@H](C(=O)O)c3ccc(F)c(Cl)c3F)c2C1 2325805630 YEBVNSBAQIOCSG-ANRSDYALSA-N 383.782 2.953 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC(=O)N2CCCC2)cc1 814004 KJCRWMCWWBZDJL-UHFFFAOYSA-N 388.489 2.509 0 50 GFAA O=C(Nc1ccc(C(=O)NN2C(=O)c3ccccc3C2=O)cc1)c1ccccc1 1104519 XQQOIKPQHQVEGE-UHFFFAOYSA-N 385.379 2.880 0 50 GFAA CC(C)c1cc(CNC(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)no1 2356156311 VOVQOJRARDZXKR-JLDZCNIISA-N 394.475 2.746 0 50 GFAA Cc1ccc(C)c2c(C)c(C(=O)N3CCC4(CC3)C[C@](C)(O)[C@@H](O)CO4)[nH]c12 2356155984 QHDOJBROTNZEPP-KKSFZXQISA-N 386.492 2.600 0 50 GFAA O=C(c1cncnc1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1ccccc1 2356162265 FHJZHLYTXBXVQZ-ZFMNYDKASA-N 390.487 2.561 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OCCSC)cc(Cl)c1O 4142359 CWAHXMHHBXQGKA-CYBMUJFWSA-N 386.857 2.588 0 50 GFAA C[C@H](Sc1nnc(-c2ccc3c(c2)OCO3)n1C)C(=O)Nc1nccs1 4736383 LYOXCLPPVXGUPP-VIFPVBQESA-N 389.462 2.787 0 50 GFAA COCc1nnc(NC(=O)c2ccccc2S(=O)(=O)CCC(C)C)s1 6701397 YVEAVGPLUKOHQT-UHFFFAOYSA-N 383.495 2.757 0 50 GFAA O=C(c1cc(=O)[nH]c2ccc(F)cc12)N(Cc1ccccn1)C[C@H]1CCCO1 55393288 PNZMYWMJAYZPNY-MRXNPFEDSA-N 381.407 2.884 0 50 GFAA CC(=O)N1CCCC[C@@H]1C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 329115687 SXJARLTVHHTXFF-IRFCIJBXSA-N 397.519 2.682 0 50 GFAA NC(=O)c1ccc(NC(=O)NC2CCN(CCc3ccccc3)CC2)cc1F 171893568 ICUBHIXXVDIFMY-UHFFFAOYSA-N 384.455 2.753 0 50 GFAA Cc1cc(C(F)(F)F)n(-c2nc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4)cs2)n1 65525890 YIQRZXJISIJPFR-MNOVXSKESA-N 385.415 2.623 0 50 GFAA Cn1cc(S(=O)(=O)Nc2cnn(Cc3ccc(Cl)c(Cl)c3)c2)cn1 2804019 HPSCMNUGJIEDLY-UHFFFAOYSA-N 386.264 2.773 0 50 GFAA NC(=O)c1cccc(C[C@H]2CCN(C(=O)CCN3Cc4ccccc4C3)C2)c1 72168203 UOQHVAUWMRPAKG-GOSISDBHSA-N 377.488 2.582 0 50 GFAA Cn1cc([C@H]2CN(C(=O)NCc3cccc(-c4cccnc4)c3)CCO2)cn1 363811335 CWJHKKOCNQTVQE-HXUWFJFHSA-N 377.448 2.765 0 50 GFAA COc1ccccc1[C@H]1CN(c2ncccc2C(=O)O)[C@@H]2C3CCN(CC3)[C@H]12 72128990 FQZDPSSZQLZQHR-MISYRCLQSA-N 379.460 2.855 0 50 GFAA CON(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](C3CC3)C2)ccc1Cl 368043983 IUJWIARWJGFKOB-AWEZNQCLSA-N 386.901 2.784 0 50 GFAA C[C@@H](C(=O)NCc1ccc(F)cc1)N1CCN(c2ncnc3ccsc23)CC1 124356651 OSAOUPMYPDTPIY-AWEZNQCLSA-N 399.495 2.657 0 50 GFAA Cc1ccc(OCc2nc(CN3CCOC[C@H]3c3ncnn3C)cs2)cc1 284835331 QQKQULANQWJVDS-KRWDZBQOSA-N 385.493 2.733 0 50 GFAA C[C@@H](NC(=O)N1CCC(N2CCCCC2)CC1)c1nc(-c2ccccn2)no1 426494507 PLHKMUZYKIZWAL-OAHLLOKOSA-N 384.484 2.853 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@@]2(CCCN(CC3CC3)C2)C1 426394450 ATNGWYSQWMICBC-JOCHJYFZSA-N 382.508 2.804 0 50 GFAA CCn1ccnc1[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1 95517439 MJFUSRCOWGYSAY-ZDUSSCGKSA-N 382.468 2.830 0 50 GFAA Nc1ccc(C(=O)N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 95355225 YKBSNPWVORNHRT-CDHQVMDDSA-N 384.430 2.644 0 50 GFAA Cc1cc(C)n(-c2ccccc2NC(=O)N2CCC(N3CCOCC3)CC2)n1 95517929 LTWFEELRIIHHHD-UHFFFAOYSA-N 383.496 2.818 0 50 GFAA Cc1nnc(N2CC[C@@]3(O)CCN(C(=O)C4CCC4)C[C@H]3C2)c2ccccc12 95512835 LHWDOSMAIBNBNL-VGOFRKELSA-N 380.492 2.528 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)Cc2ccc(F)c(F)c2F)C1 95359557 QWRIAKFGGOQJGU-OAHLLOKOSA-N 394.441 2.811 0 50 GFAA O=C(CCc1cc2n(n1)CCCN(C(=O)CCc1ccccc1F)C2)NC1CC1 91306106 BNAWMTJQOLSQTB-UHFFFAOYSA-N 398.482 2.599 0 50 GFAA O=C1C[C@@H](Cc2ccc(NC(=O)Nc3c[nH]nc3-c3ccccc3)cc2)C(=O)N1 180529518 HMWNVBOZAWYWGF-OAHLLOKOSA-N 389.415 2.926 0 50 GFAA C[C@@H]1CCN(C(=O)NCCOc2ccc(Cl)c(Cl)c2)CCS1(=O)=O 298211361 USSOOAMHWBCNGL-LLVKDONJSA-N 395.308 2.591 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCCN(C(=O)c2ccc3nc[nH]c3c2)CC1 368898739 CMKOPZHXWULSEB-UHFFFAOYSA-N 385.855 2.543 0 50 GFAA O=C(Cc1cccc(C(F)(F)F)c1)N1CC[C@@H](O)[C@](CC2CC2)(C(=O)O)C1 1940195803 NTZOMYMEGKXLFP-CRAIPNDOSA-N 385.382 2.712 0 50 GFAA CC(C)c1nnc(N2CCOC3(CCN(C(=O)c4ccoc4)CC3)C2)s1 952965622 AUXKQMKLBKRQKH-UHFFFAOYSA-N 376.482 2.766 0 50 GFAA COc1nc2c(cc1CNCc1noc(-c3cccs3)n1)C(=O)N(C(C)C)C2 952965306 GLHLZCBKKXTPKP-UHFFFAOYSA-N 399.476 2.856 0 50 GFAA CN1CCCC[C@@H]1CCN1CCN(CC(=O)Nc2ccccc2Cl)CC1 272436662 BMGSNOWIAZZGLK-QGZVFWFLSA-N 378.948 2.771 0 50 GFAA COCC(=O)N1CCc2cc(NC(=O)c3c(-c4ccccn4)noc3C)ccc21 187452140 AJGPULTYVGBAGY-UHFFFAOYSA-N 392.415 2.833 0 50 GFAA O=C([C@H]1Cc2cc(Br)ccc2O1)N1CCC(n2ccnc2)CC1 194209269 BOLCBWJZJOIWSB-MRXNPFEDSA-N 376.254 2.813 0 50 GFAA Cc1cc(C)n(C2CN(S(=O)(=O)c3ccc(-c4onc(C)c4C)o3)C2)n1 1506428560 PJUZUXNNRPCWAF-UHFFFAOYSA-N 376.438 2.610 0 50 GFAA CSc1cccc(CN(C(C)C)S(=O)(=O)N2CCC[C@@H](C(=O)O)C2)c1 1506396475 HAWSVQLPYZOSLO-OAHLLOKOSA-N 386.539 2.660 0 50 GFAA COCCn1cncc1CNS(=O)(=O)c1cc(C(C)(C)C)cc(C)c1C 1506405405 BMZUAKMDCZEZPX-UHFFFAOYSA-N 379.526 2.922 0 50 GFAA Cc1cccc(NC(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2Cl)c1 12004018 DGJZFMBYVSIDMC-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CC[C@H](N(C)C)C3)no2)c(Cl)c1 12752452 YLEGGPYKMNXKCJ-LBPRGKRZSA-N 379.844 2.692 0 50 GFAA CCOC(=O)c1nn(CCCc2ccccc2)c2c1CN(C(=O)C1CC1)CC2 14541497 QFNZTRPNICRNCZ-UHFFFAOYSA-N 381.476 2.987 0 50 GFAA CC[C@@H](COC)Nc1ncnc2sc(C(=O)NCCOC(C)C)c(C)c12 15000856 ITIXQVDTRFDZML-ZDUSSCGKSA-N 380.514 2.991 0 50 GFAA O=C(NCc1nn(CCc2ccccn2)c(=O)c2ccccc12)c1ccccc1 18194984 WFQXLMQIROPGCF-UHFFFAOYSA-N 384.439 2.964 0 50 GFAA COc1ccc(C(=O)NCCc2cnc[nH]2)cc1Oc1ccc(CN)cc1F 1857687325 SCJCSLCALLUTFV-UHFFFAOYSA-N 384.411 2.781 0 50 GFAA Cc1ccc(CC(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)cc1 1857710016 DECZTBCBWFTRDC-GMAHTHKFSA-N 396.535 2.726 0 50 GFAA O=C([C@H]1CC12CCNCC2)N1CCO[C@H](c2ccccc2Br)C1 236588209 HHAQPJDXAHZPIT-ZBFHGGJFSA-N 379.298 2.739 0 50 GFAA C/C=C(\C)CN1CCC([C@]2(CCC)NC(=O)N(C[C@H]3CCCO3)C2=O)CC1 12037912 JZYMWOSJBQOJSQ-NGPXOYCESA-N 377.529 2.934 0 50 GFAA CC(C)Cn1cc(C(=O)NCC2CCCCC2)c(=O)c(C(=O)NC(C)C)c1 14999424 PHNFWZJRFCSSFH-UHFFFAOYSA-N 375.513 2.953 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C(N)=O)c(C)c1 264029888 LTDFTOPPWASYEY-GOSISDBHSA-N 395.459 2.736 0 50 GFAA NCc1ccc(C2(C(=O)N3CCC(S(=O)(=O)c4ccccc4)CC3)CC2)cc1 1875287765 YPRVWLNCSDVNML-UHFFFAOYSA-N 398.528 2.642 0 50 GFAA Cc1ccccc1Cn1c(Oc2ccc(F)cc2)nc2c1c(=O)n(C)c(=O)n2C 1423934 LLSWFURKGITGNS-UHFFFAOYSA-N 394.406 2.722 0 50 GFAA Cn1nccc1C(=O)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100537453 NPIYBAMTLWHKQL-JOCHJYFZSA-N 390.487 2.998 0 50 GFAA COC(=O)C1CCCC(N=c2ccc3nnc(-c4ccccn4)n3[nH]2)CCC1 2325790936 YVQICWIIVATYGS-UHFFFAOYSA-N 380.452 2.532 0 50 GFAA COc1cncc(C(=O)N(C)C[C@H](C)NC(=O)CC(C)(C)C(F)(F)F)c1C 2325794254 WCAASDTZTQGWOJ-NSHDSACASA-N 389.418 2.954 0 50 GFAA COc1cc(C(=O)NS(=O)(=O)c2cccc3ccccc23)nnc1C1CC1 2325865267 UYPDRRWWOONCKD-UHFFFAOYSA-N 383.429 2.635 0 50 GFAA Cc1ccccc1N(CC(=O)NCc1ccccn1)S(=O)(=O)c1ccccc1 889622 QVEUMGVCZNKORT-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA COc1cccc2c1C1(CCN(c3ccc(S(C)(=O)=O)cn3)CC1)OCC2 2356146782 VHYBHYORKFWRKJ-UHFFFAOYSA-N 388.489 2.562 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(N3CCN(c4ccccc4)CC3)CC2)cc1 4703430 DCFBQNBMBAMSMO-UHFFFAOYSA-N 399.560 2.970 0 50 GFAA O=C(Nc1cccc(Cl)c1)N1CCN(S(=O)(=O)c2ccccc2)CC1 6726103 HBGVABJNVRSWSX-UHFFFAOYSA-N 379.869 2.878 0 50 GFAA Cc1cccc(NC(=O)C[C@H]2C(=O)NCCN2C(=S)Nc2ccccc2)c1 8682848 GMDZMIXGHXJMPN-KRWDZBQOSA-N 382.489 2.521 0 50 GFAA COc1cc(NC(=O)CN2CCN(Cc3ccco3)CC2)c(OC)cc1Cl 20227963 BZZMDWAZDJIESO-UHFFFAOYSA-N 393.871 2.707 0 50 GFAA OCC[C@@H]1CN(Cc2cccc3c2OCO3)CCN1CCCc1ccccc1 20204150 LBBNTXIIGXIBSG-OAQYLSRUSA-N 382.504 2.917 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H]3CC(=O)Nc4ccc(F)cc43)n1)CCNC2 20539095 UIAXSPIAYCKHHN-HNNXBMFYSA-N 379.395 2.699 0 50 GFAA Cc1ccc2cc(C3(O)CCN(C(=O)COc4cccnc4)CC3)ccc2n1 67909578 CJVFFZZXFLHFPG-UHFFFAOYSA-N 377.444 2.827 0 50 GFAA C[C@@H](CNC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1)N1CCC[C@@H](C)C1 229818664 IPDSMUURMRECIW-PMPSAXMXSA-N 377.916 2.930 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1 72469546 GYJBKZUYEZTZLI-HXUWFJFHSA-N 380.488 2.921 0 50 GFAA O=C(c1coc(C2CCOCC2)n1)N1CCC(OC[C@@H]2CCCCO2)CC1 328826299 SSNVCTVHYGFBKF-KRWDZBQOSA-N 378.469 2.759 0 50 GFAA CN(C)S(=O)(=O)N1CCc2[nH]nc(C(c3ccccc3)c3ccccc3)c2C1 11934401 ADEVWHGADDMIKN-UHFFFAOYSA-N 396.516 2.754 0 50 GFAA COc1nc2c(cc1CNC(=O)CCc1ccccn1)C(=O)N(C1CCCC1)C2 71763352 FLBCWTDHIUHRJQ-UHFFFAOYSA-N 394.475 2.633 0 50 GFAA CNC(=O)Cc1noc(CN2Cc3cc(OC)ccc3C[C@@H]2C2CCCCC2)n1 360621409 OVAMDWWUNKKQFQ-LJQANCHMSA-N 398.507 2.874 0 50 GFAA CC(C)NC(=O)CCNC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1 363113348 CTSBLUVYTZLJQK-JOCHJYFZSA-N 386.540 2.599 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC[C@@H]1CCC(F)(F)C1 281966766 YCADYYXHLQUUCV-WDEREUQCSA-N 380.844 2.558 0 50 GFAA O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)N[C@H]1CC[C@@H](C(=O)O)C1 262682584 BABVFVCGQWGHMP-QYZOEREBSA-N 380.444 2.917 0 50 GFAA Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 282385754 DBRJTOWSWRLWRD-CQSZACIVSA-N 396.413 2.763 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCC[C@H]2OCC[C@H]12 126404710 APGBLPZJCNTXFY-RBSFLKMASA-N 392.912 2.961 0 50 GFAA CCNS(=O)(=O)c1ccc2c(c1)N(Cc1ccn(-c3ccccc3)n1)CC2 127311991 JVHVXWNIJARDIM-UHFFFAOYSA-N 382.489 2.733 0 50 GFAA Cc1c(C(=O)N2CCC[C@](O)(CN(C)C)C2)n[nH]c1-c1ccc(Cl)cc1 72163904 HINFWASBUHVYRN-IBGZPJMESA-N 376.888 2.567 0 50 GFAA CCc1cc(N2CCN(C(=O)c3cccc(CCC(C)(C)O)c3)CC2)ncn1 72410771 IYSDAXFNWWMYBI-UHFFFAOYSA-N 382.508 2.705 0 50 GFAA Cc1cc([C@@H]2CN(C(=O)c3ccccc3Cn3cncn3)CCO2)ccc1F 128609216 CPVIYXNTMWDKOA-FQEVSTJZSA-N 380.423 2.988 0 50 GFAA O=C(Cn1nc(-c2ccccc2)n(CCc2ccccc2)c1=O)NC1CCC1 77377944 PBMHJTGXIVDSLX-UHFFFAOYSA-N 376.460 2.623 0 50 GFAA CN(C(=O)c1cnc2nc(O)nc(O)c2c1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C 288040316 DNTHMIKWNQZMQJ-JKSUJKDBSA-N 394.431 2.754 0 50 GFAA Cc1cc(N2CCC(NC(=O)N3CCCC[C@@H]3c3ncc[nH]3)CC2)nc(C)n1 176899476 CSUQNOHLURZZHV-QGZVFWFLSA-N 383.500 2.722 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95497002 UTHAGZKEPZELOO-SFHVURJKSA-N 382.489 2.895 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3ccccc3-c3nc[nH]n3)C[C@H]2N(C)C)cc1 95517264 IGNKQOXHXBIQQE-VQTJNVASSA-N 375.476 2.950 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2ccc(Cl)o2)CC1 96163555 RYFTXSHXYGKCLF-UHFFFAOYSA-N 388.859 2.809 0 50 GFAA CCc1nn(C)c(NC(=O)N[C@H](c2ccccc2)c2nnc(N)s2)c1CC 95496590 MZNOJZPSCVJRDN-CQSZACIVSA-N 385.497 2.890 0 50 GFAA COc1cc(N2CCC[C@@]3(CCC(=O)N(CCc4ccccc4)C3)C2)ncn1 91872717 TUOGHLMEYJCHJZ-JOCHJYFZSA-N 380.492 2.937 0 50 GFAA Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1CC(=O)N1CC[C@@H](CN)C1 299738892 IBXMVNZVBPZKHY-AWEZNQCLSA-N 380.414 2.858 0 50 GFAA CC[C@@H](C(=O)Nc1ccc(OC)cc1)N1CCC(N2CCSCC2)CC1 244795800 RNXAXTBBTIJQPG-IBGZPJMESA-N 377.554 2.926 0 50 GFAA C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]3CC[C@@]4(OCO[C@]45COCO5)[C@H]3CC(=O)[C@H]12 257347629 NJDQZPLIXBEZLQ-CJRFYIOJSA-N 390.476 2.831 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N(CC(=O)O)Cc1ccccc1 299740900 CBYLCPZOPJXTDE-FQEVSTJZSA-N 380.444 2.636 0 50 GFAA CCS(=O)(=O)CCNC(=O)c1ccc(-c2ccc(CSC)cn2)cc1 534636942 OSALTJPDCMDDDT-UHFFFAOYSA-N 378.519 2.776 0 50 GFAA CC[C@@H]1C(=O)NCCN1C(=O)c1cccc(-c2nn(C)c3ccc(F)cc23)c1 534638290 JDHFOJHSTRZURG-QGZVFWFLSA-N 380.423 2.730 0 50 GFAA Cc1cc2cc(C(=O)N[C@H]3CCN(Cc4c(C)noc4C)C[C@@H]3O)ccc2o1 1565510842 FWGNUVDOMKNORU-OALUTQOASA-N 383.448 2.711 0 50 GFAA CCS(=O)(=O)c1ccccc1N1CCN(c2ncnc3sccc23)CC1 276321030 OVZQAKZGJSDALY-UHFFFAOYSA-N 388.518 2.812 0 50 GFAA CN(CC(=O)O)C1CCN(C(=O)c2cccc(OCc3ccccc3)c2)CC1 186625331 RNRDQKHHFSMATB-UHFFFAOYSA-N 382.460 2.887 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC(c3n[nH]c(CC)n3)CC2)c(C)c1 190484218 GCVJZNCZWCCRIE-UHFFFAOYSA-N 378.498 2.643 0 50 GFAA O=C(N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12)c1cccc2c1OCCO2 1616082823 XXODSJPENXGCPG-JXFKEZNVSA-N 390.439 2.994 0 50 GFAA Cc1ccc(CC(=O)N2C[C@H]3CN(Cc4ccoc4)C[C@]3(CCC(=O)O)C2)cc1 1775984206 KAXWLLLBBVGYRN-NFBKMPQASA-N 396.487 2.956 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4c[nH]nc43)C2)ccc1N1CCOCC1 1775978811 PFIGENRDVGWYQI-QFIPXVFZSA-N 380.492 2.675 0 50 GFAA O=C(NCCN1Cc2ccccc2O[C@H](c2ccccc2)C1)c1cc[n+]([O-])cc1 12078421 ZLTSEVNYRUURKH-QFIPXVFZSA-N 389.455 2.686 0 50 GFAA Cc1nc(CN(C)C[C@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)cs1 12470826 XRUWFUXLBXJXET-LJQANCHMSA-N 377.485 2.576 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CNC[C@H](C(=O)Nc3ccc4c(c3)CCC4)C2)cc1 14534298 RQOHHKJPIJHICB-LEWJYISDSA-N 391.515 2.964 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@@H]2[C@H]1c2cc3c(cc2CCN1C)OCO3 19972672 JZUTXVTYJDCMDU-MOPGFXCFSA-N 383.400 2.873 0 50 GFAA biogenic,in-man CN(C)c1nc(N2CCCC2)c2c(n1)C1(CC2)CCN(C[C@H]2CCCO2)CC1 1857694235 GVEZEYCPASIYJZ-QGZVFWFLSA-N 385.556 2.602 0 50 GFAA Cc1cccc(CN2CCN(Cc3cc(O)c4ccccc4n3)C[C@H]2CCO)n1 104640854 YOBAYLUCKUCQPU-HXUWFJFHSA-N 392.503 2.713 0 50 GFAA O=C(N[C@@H]1CCN(c2ccccc2)C1)c1ccc(S(=O)(=O)C(F)F)cc1 264500587 MCXOXOAXNQJQDU-CQSZACIVSA-N 380.416 2.692 0 50 GFAA O=C(N[C@@H](c1ccc(Cl)c(F)c1)c1nn[nH]n1)[C@H]1CCOC2(CCCC2)C1 907414443 WRAWYTVKCLQIIA-WFASDCNBSA-N 393.850 2.937 0 50 GFAA C[C@@H](NC(=O)c1csc(-c2cnn(C)c2)n1)c1ccc(N2CCNC2=O)cc1 843990881 MJNGCHWINBFFMZ-GFCCVEGCSA-N 396.476 2.564 0 50 GFAA Cn1cc([S@@](C)(=O)=NC(=O)c2csc(COc3ccc(F)cc3)n2)cn1 1875354868 RDZCJWVYBIJWQL-AREMUKBSSA-N 394.453 2.892 0 50 GFAA CO[C@@H]1C[C@@H](CN=c2ccc(-c3ccccn3)n[nH]2)N(Cc2ccccc2)C1 1875327039 WQYCAPXHEZFXBX-RBUKOAKNSA-N 375.476 2.662 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3sc(Br)cc3C2)CC1 1875366180 ZCDVVZGMKVROIJ-UHFFFAOYSA-N 383.311 2.820 0 50 GFAA CCn1nc(C(=O)N2CCN(c3ccccc3)CC2)c2c1CCN(CC(C)C)C2 20204621 YJNXMDZKKAYEJU-UHFFFAOYSA-N 395.551 2.880 0 50 GFAA O=C([C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)N1CCC[C@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 2325826687 JSMMIBWSEBKMQS-DASLAIFKSA-N 380.532 2.630 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N[C@H](C(=O)O)[C@H](O)c3ccncc3)ccc2c1 2325876191 MNGFXDHLPRCGOR-QTJFZDIUSA-N 394.427 2.650 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)NC2CCN(Cc3ccccc3)CC2)c1 811960 FPFXAMSVJDTHQE-UHFFFAOYSA-N 390.505 2.647 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C(=O)n2cccn2)c(Cl)cc1Cl 812242 NPJJEPLFIHGSSH-UHFFFAOYSA-N 376.265 2.909 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 892989 CHIKWLYLKYELOW-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)c1ccc(-c2cncc(N)n2)cc1 2356138248 JYSHCYXHADXRKQ-FQEVSTJZSA-N 387.487 2.855 0 50 GFAA O=C(Nc1nccs1)[C@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O 3958782 CTGMTADATDZJNG-INIZCTEOSA-N 377.425 2.989 0 50 GFAA COc1ccc(C2(C(=O)N(CCC(N)=O)Cc3ccccc3)CCOCC2)cc1 9048861 FVNSHEGYPOLMQD-UHFFFAOYSA-N 396.487 2.648 0 50 GFAA C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCC[C@H]2CCNC2)cc1 246366020 AFBJFHPFOVQJIM-FGTMMUONSA-N 387.524 2.584 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCN(C(C)C)CC3)C2=O)cc1 20539501 RJWHCWSTVPDPFI-HSZRJFAPSA-N 387.568 2.690 0 50 GFAA CCn1ncc(NC(=O)Cn2ncc3cc(-c4ccc5c(c4)OCO5)ccc32)n1 55119786 VTJNPKIDGVNXQP-UHFFFAOYSA-N 390.403 2.682 0 50 GFAA COCc1nc(N2CCN(Cc3ccccc3)CC2)[nH]c(=O)c1CCC(C)C 22448849 LTTQZDFJAPMISC-UHFFFAOYSA-N 384.524 2.827 0 50 GFAA O=c1[nH]c(Nc2ccc(Cl)cc2)nc(=O)c2c1ncn2Cc1ccccc1 20909686 TUHXQZXFFGSPRM-UHFFFAOYSA-N 379.807 2.925 0 50 GFAA O=C1CCCN1Cc1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)cc1 67601863 WVWBQGWVCSHEIH-UHFFFAOYSA-N 378.881 2.941 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)N2CCC[C@H]2c2ccc(C(N)=O)s2)c1C 23399635 QCCVEEGIIVALSY-LBPRGKRZSA-N 389.477 2.946 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN3CCC(C)(C)CC3)C2=O)c1 67642450 QRNQUGCTFRXXHQ-NRFANRHFSA-N 378.488 2.810 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4nc(C)cc4C)ncn3)CC2)cc1 67601979 RMLDZHFYGRAOIE-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA Cc1cc2c(=O)n(NC(=O)[C@@H](C)n3nc(C(F)(F)F)cc3C)c(C)nc2s1 2776951 VOKZUWBWFKHVLF-SECBINFHSA-N 399.398 2.930 0 50 GFAA OCc1ccc(CN2C[C@H]3CCC[C@@]3(c3nc(-c4cnccn4)no3)C2)cc1 328603474 GDBHGSNYBAFQMX-DYESRHJHSA-N 377.448 2.573 0 50 GFAA COc1ccc(Oc2cccc(CN3CCN[C@H](C(=O)NC4CC4)C3)c2)cc1 72144249 RZGBILOLVDQQGY-NRFANRHFSA-N 381.476 2.540 0 50 GFAA O=C(Cc1ccccc1)NCC(=O)Nc1cccc(C(=O)Nc2ccccn2)c1 253424917 UKXNFQWDIKAOIM-UHFFFAOYSA-N 388.427 2.631 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)C2=NNC(=O)CC2)cc1 12595650 NFIQNGYHVQYLHW-KRWDZBQOSA-N 393.491 2.929 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2C[C@@H]3C[C@H]2C(=O)N3c2cccc(Cl)c2)[nH]n1 77426600 NNWRRDPQIQLFPW-KSSFIOAISA-N 395.850 2.699 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCC[C@H]1c1nn2c(C3CC3)nnc2s1 71747702 VGPPNIZDRNGANW-ZDUSSCGKSA-N 393.469 2.728 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@H](C)N2CC[C@@H](c3nc(C4CC4)no3)C2)c1 375466288 SURHEKQGXXTDHH-SWLSCSKDSA-N 383.452 2.722 0 50 GFAA CN(c1ccccc1)C1CCN(C(=O)NCCn2c(=O)oc3ccccc32)CC1 176160178 AAWRQOACOGZPEL-UHFFFAOYSA-N 394.475 2.905 0 50 GFAA COc1ccccc1-c1c2c(=O)n(Cc3ccccn3)ccc2nc2nc(C)nn12 40398456 WVZCAYYUWAYMOB-UHFFFAOYSA-N 398.426 2.867 0 50 GFAA O=C(CCC(=O)N1CCN(c2ccccn2)CC1)Nc1nc2ccccc2s1 40267470 KRZAPMKLJRTOTB-UHFFFAOYSA-N 395.488 2.759 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N[C@H]2CCCN(Cc3cccnc3)C2)c1 97635049 ZKCCPIHQXLRAGI-KRWDZBQOSA-N 385.443 2.965 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)c2cnc(Br)s2)CC1 95495793 MHPMDVNPVKRDEF-UHFFFAOYSA-N 376.276 2.599 0 50 GFAA O=C(C1CCC1)N1CCc2[nH]cnc2C12CCN(Cc1ccc(O)cc1)CC2 91493373 NGSYOPMXRQFYOP-UHFFFAOYSA-N 380.492 2.791 0 50 GFAA O=C(N1CCCC1)N1CC[C@]2(O)CCN(c3nccc(C4CCCC4)n3)C[C@@H]2C1 95361895 YLWFNKYTVUXIGV-XMSQKQJNSA-N 399.539 2.613 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)CCO1 299752612 UTUSSHLZFYBDQD-AQNXPRMDSA-N 381.428 2.681 0 50 GFAA Cc1cc2c(SCC(=O)N[C@H]3C[C@H](c4cc(O)ncn4)C3)ncnc2s1 253535284 OKPVRYKVRDABJI-XYPYZODXSA-N 387.490 2.650 0 50 GFAA Nc1nnc(C2(NC(=O)Nc3ccc4c(c3)OCCO4)CCCCC2)s1 299799478 GQIRYNGGUFJBMH-UHFFFAOYSA-N 375.454 2.873 0 50 GFAA CCNC(=O)c1ccc(NC(=O)NCc2cnc(SC)n2C)cc1Cl 299765741 CLTMTUHJTPPGAO-UHFFFAOYSA-N 381.889 2.867 0 50 GFAA CCOC(=O)[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1NC(=O)OC(C)(C)C 66055076 HEPWCOHMSQJSLO-HOTGVXAUSA-N 392.452 2.711 0 50 GFAA in-vitro NC(=O)c1cnn2c(C(=O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@@H]43)ccnc12 275244759 HIZBMVQIWJIVNY-JQHSSLGASA-N 389.459 2.627 0 50 GFAA O=C(Nc1cccc(Oc2ccccc2)c1)C(=O)N[C@H]1CCc2[nH]ncc2C1 167432687 XYTCRFXVZXFYPE-INIZCTEOSA-N 376.416 2.814 0 50 GFAA NC(=O)c1cccc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)n1 170593709 KWGWQGYMYFBFRX-GFCCVEGCSA-N 375.812 2.644 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1ccnc(C)c1 793281401 RVMWVOVKPLVDSC-GFCCVEGCSA-N 398.868 2.576 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCN(C(=O)c2cccs2)CC1 1506401018 HOMAWPMLYTZFDC-MRXNPFEDSA-N 394.880 2.994 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)NC[C@H](c1cccnc1)N1CCCCC1 1506428197 YEVLXFWBQRRTOA-OAQYLSRUSA-N 381.524 2.960 0 50 GFAA COCCN1CCC[C@@H](C(=O)Nc2c(-c3ccc(OC)cc3)c(C)nn2C)C1 1529196726 FSAQYJSAAAWONJ-QGZVFWFLSA-N 386.496 2.701 0 50 GFAA CCc1nccn1C[C@@H](C)N1CCCN(C(=O)c2ccc(C(C)=O)s2)CC1 1772812969 SFMIYVORYKRWGZ-OAHLLOKOSA-N 388.537 2.946 0 50 GFAA O=C(CCn1cnnn1)NCc1cccnc1Oc1cccc(C(F)(F)F)c1 11661583 XGITZWLIAJXQRY-UHFFFAOYSA-N 392.341 2.586 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3cccc(Cl)c3)c2)C1=O 12003875 XOUXUCTVKNYWFH-NSHDSACASA-N 378.837 2.905 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)c3cc(C)nn3C)C2)cc1 12073504 IVUIAONBXIJQGP-IBGZPJMESA-N 384.524 2.764 0 50 GFAA O=C(c1cn(CCN2CCCCC2)nn1)N1CCC(OCc2ccccc2)CC1 12299270 OXPQIXUXZBODSH-UHFFFAOYSA-N 397.523 2.585 0 50 GFAA COCCN(C)Cc1ccc(OC)cc1OC[C@H](O)CN1CCCCCCC1 14959638 KFVKCLCMPDLPGH-HXUWFJFHSA-N 394.556 2.779 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]1(O)CNCc1ccccc1F 14974672 QMLIJBLJMLZCKM-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCc1ccccc1Cl)CCCC3 169778259 ROYYSDBFHKRZAO-UHFFFAOYSA-N 384.867 2.813 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4nccc5ccccc45)nnc3c2)n1 169781036 XHOMQGSYHSPMNC-UHFFFAOYSA-N 399.414 2.820 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)COC[C@@H]1CCCCO1)CC2 1857667166 FZHHEEIZFXKEBK-SFHVURJKSA-N 383.492 2.600 0 50 GFAA CCCc1nc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cs1 1857674002 WTYHCPDDKFKPNQ-HXUWFJFHSA-N 385.489 2.985 0 50 GFAA O=C1CC2(CCN(C(=O)C3CC3)CC2)OCCN1Cc1ccc(Cl)cc1 1857695077 SOAVRCSXXDUPMG-UHFFFAOYSA-N 376.884 2.860 0 50 GFAA O=C(O)[C@@H]1CN(CCc2ccccc2)CC12CCN(C(=O)C1CC=CC1)CC2 1857703779 RKCZNBBNKVTFTQ-FQEVSTJZSA-N 382.504 2.821 0 50 GFAA CCc1cc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc(N(C)C)n1 1857711409 XSZZWYNWFZJIQR-JOCHJYFZSA-N 394.523 2.962 0 50 GFAA O=C1C[C@H]2N(Cc3cnc(-c4cccc5ccccc45)nc3)CC[C@]23OCCN13 1857712249 GWJCAMTZLBRFQE-OFNKIYASSA-N 386.455 2.830 0 50 GFAA O=C(NCCC1CCC1)[C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857718525 ITLUXIAVWQUEMW-MRXNPFEDSA-N 384.505 2.788 0 50 GFAA Cc1ocnc1C(=O)N1CCC[C@@]2(CCCN(Cc3ccccn3)C2=O)[C@H]1C 1875249144 KNWCIFBFPCOKPV-IERDGZPVSA-N 382.464 2.812 0 50 GFAA COC(=O)CC1(CN2CCN([C@@H](C)c3nc(-c4ccccc4)no3)CC2)CC1 225640544 BEJNABOHIFVBJZ-INIZCTEOSA-N 384.480 2.759 0 50 GFAA O=C(CN1CCC[C@H](c2nnc3ccccn23)C1)NCc1cccc(Cl)c1 155814467 MTVXQCZRBRZAHD-INIZCTEOSA-N 383.883 2.879 0 50 GFAA CN1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H](CC(=O)O)C1=O 1857782989 HJOBHLVCGNOWDX-LJQANCHMSA-N 394.427 2.553 0 50 GFAA O=C(CCCc1ccc2c(c1)CC(=O)N2)NC[C@@]1(O)CCc2cc(F)ccc21 1875266570 GICPKHYGMMKIQR-QFIPXVFZSA-N 382.435 2.593 0 50 GFAA Cc1ncnc2c1C[C@@H](C(=O)N1CCN(C/C=C/c3ccccc3)CC1)CC2 1875290448 GKOYMQRTVWLPHV-FKIZTMCRSA-N 376.504 2.748 0 50 GFAA C[C@@H]1COC[C@@](CO)(CN[C@@H](c2ccccn2)c2cc3ccccc3o2)N1C 1875399001 LELCUMUSTRCRNT-XGRCMKMKSA-N 381.476 2.588 0 50 GFAA C[C@H](c1nc(-c2cccc(S(C)(=O)=O)c2)nn1CC(C)(C)CO)C1CC1 1875330997 KWBPNTSOOGDQEN-ZDUSSCGKSA-N 377.510 2.881 0 50 GFAA O=C1Cc2ccc(NC(=O)[C@H]3CCN(C(=O)OCc4ccccc4)C3)cc2N1 895334581 JCLALBFZHWOMEI-INIZCTEOSA-N 379.416 2.778 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2nnc(C)s2)c1 854133 SBBJVIFRGLWZQP-UHFFFAOYSA-N 388.902 2.783 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CO)[C@@H]2c2ccccc2Cl)nn1C(F)F 2100555223 NDPPXVHDHZCHBS-GJZGRUSLSA-N 385.798 2.815 0 50 GFAA Cc1[nH]nc2ccc(C(=O)N3CCCN(C(=O)c4ccccc4F)CC3)cc12 2325757015 VLRGTCCYWJLMTE-UHFFFAOYSA-N 380.423 2.999 0 50 GFAA CN1CCc2nc(O)c(CNC(=O)N(C)Cc3cc4ccccc4[nH]3)cc2C1 2325780744 MROIIOLSEFOOJV-UHFFFAOYSA-N 379.464 2.598 0 50 GFAA O=C(CCn1ccc2cc(Cl)ccc21)N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O 2325785739 LPGLSAPGZPLMHQ-LSBZLQRGSA-N 386.883 2.837 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2N2CCN(C(C)=O)CC2)c(OC)c1 6702373 RPADEBKCRSMODO-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA CC[C@H](NC(=O)C1(N2CCN(CC)CC2)Cc2ccccc2C1)c1ccncc1 20208374 APTBICJSGHTNAU-QFIPXVFZSA-N 392.547 2.824 0 50 GFAA O=C(CCc1ccccc1)N1CCCN(C(=O)[C@H]2CCCc3[nH]ncc32)CC1 134479849 XXXLQWYNIZEYJE-SFHVURJKSA-N 380.492 2.523 0 50 GFAA CN(C)[C@H](CNC(=O)N1CCN(c2nc3ccccc3o2)CC1)c1ccco1 172514436 LQCZHFXCFNCROL-MRXNPFEDSA-N 383.452 2.555 0 50 GFAA Cc1cc(N2CCN(Cc3nc4ccccc4n3CC(C)C)CC2)nc(N)n1 65407057 NHORHBDVPYHWSB-UHFFFAOYSA-N 379.512 2.695 0 50 GFAA COc1cccc(-c2cn[nH]c2C2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)c1 67920110 HIXHQZWGOBEHQG-UHFFFAOYSA-N 378.432 2.793 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)N[C@H]3CCCn4nc(CC)nc43)c2C)cc1 252508699 XRBLCZDAUHEVEM-KRWDZBQOSA-N 393.495 2.616 0 50 GFAA Cc1cc(N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)n2ncnc2n1 475731955 PRMDLLRJWQQVAB-GFCCVEGCSA-N 376.342 2.669 0 50 GFAA O=C1CS[C@@]2(C(=O)N3CCCc4cccc2c43)N1c1ccc2c(c1)OCCO2 4771011 NTRCHTGZVDOZTA-NRFANRHFSA-N 394.452 2.683 0 50 GFAA CC(C)C(=O)N1CCC(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1 120965772 XOKRFMGBZWQTQZ-KRWDZBQOSA-N 375.488 2.805 0 50 GFAA O=C(c1ccncc1)N1C[C@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72168181 DJKFOQBGZQMJBA-DUXKGJEZSA-N 377.444 2.513 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2nccn2CC(F)(F)F)n1C 328654171 XHJGDFWLTUSUIX-AWEZNQCLSA-N 383.418 2.871 0 50 GFAA CC(C)c1ccc(Cl)c(S(=O)(=O)N2CC(=O)N(CC(F)(F)F)C2)c1 330538028 WOALAAOOJXSLON-UHFFFAOYSA-N 384.807 2.816 0 50 GFAA O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@H](N2CCCC2)C1 363099258 FOUUFXLIMINOEW-KBAYWCCJSA-N 399.579 2.891 0 50 GFAA CCN1CCC[C@H]1CN(C)C(=O)N[C@@H](c1ccccc1OC)c1nccn1C 363592790 LDWIXMYFRNGWQT-LPHOPBHVSA-N 385.512 2.644 0 50 GFAA Cn1nccc1[C@@H]1[C@@H](C(=O)Nc2ccc3[nH]ccc3c2)CCC(=O)N1C1CC1 367932419 LDLWRHXCTWKLKW-JXFKEZNVSA-N 377.448 2.982 0 50 GFAA C[C@H]1Cc2cc(S(=O)(=O)NC(=O)/C=C/c3cncc(F)c3)cc(Cl)c2O1 127371880 JSAZEJNANVNFNJ-PBKGFPTLSA-N 396.827 2.716 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnn(CC)c3C)C[C@H]2CCO)cc1 36385801 WKMKKECVIGGMJO-OAQYLSRUSA-N 386.540 2.679 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CCN1 262940077 UJWTYHHVRNCVIF-MNEFBYGVSA-N 389.499 2.867 0 50 GFAA Cc1cc(N2CCN(CCO)CC2)n2nc(-c3cccc(Cl)c3)c(C)c2n1 40216724 RTUUFZUHJUGQHC-UHFFFAOYSA-N 385.899 2.781 0 50 GFAA COc1c(C)cc(C)cc1CN1CCCn2nc(CNC(=O)N(C)C)cc2C1 82116406 WWNAJGMYHKBKCK-UHFFFAOYSA-N 385.512 2.686 0 50 GFAA Cc1ccc(C(=O)N2CCn3cccc3[C@@H]2c2ccccn2)cc1OCCN 426490743 RMIDBZJHGLGZSW-NRFANRHFSA-N 376.460 2.774 0 50 GFAA CN(Cc1cccc(OC[C@@H](O)CN2CCCCCC2)c1)C1CCOCC1 95527415 FJASVSISASXVDS-NRFANRHFSA-N 376.541 2.913 0 50 GFAA CCn1nccc1C(=O)N1C[C@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95356118 MULJWKOHTKKVOL-MISYRCLQSA-N 386.446 2.884 0 50 GFAA COc1cc(OCc2ccccc2)ccc1CN1CC[C@@]2(O)CCNC[C@H]2C1 91746401 ICABMKDQUSJDND-REWPJTCUSA-N 382.504 2.821 0 50 GFAA C[C@H](CC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)n1ccnc1 91621284 JXWNEEUPKGDVEX-GOSISDBHSA-N 395.507 2.661 0 50 GFAA C[C@@H]1[C@@H](N2C(=O)[C@@](NC(=O)c3ccco3)(C(F)(F)F)N=C2O)CCC[C@H]1C 245245576 DPNUGJSSHMLGNP-INLINHOESA-N 387.358 2.849 0 50 GFAA Cc1cc(C)n(C2CN(C(=O)c3cccc(-c4cncc(N(C)C)n4)c3)C2)n1 534636962 NERXMTPSBDHRNN-UHFFFAOYSA-N 376.464 2.720 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3ccccc3Cn3cccn3)C2)no1 371524813 UWROQJDSDMYFKY-SFHVURJKSA-N 380.452 2.712 0 50 GFAA COCc1nc2cccnc2n1C1CCN(S(=O)(=O)c2cccs2)CC1 32950468 IYYZLPNJSQGOGV-UHFFFAOYSA-N 392.506 2.665 0 50 GFAA CC(C)[C@H](CNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1cccnc1 185099697 IBMFUEYFGHKWML-AWEZNQCLSA-N 376.404 2.559 0 50 GFAA CC(C)CN1CCOC2(CCN(C(=O)c3cc4c(nc3O)CCCC4)CC2)C1 821285741 YOESKEWJXIDIOQ-UHFFFAOYSA-N 387.524 2.629 0 50 GFAA Cc1ccccc1N1CCN(C(=O)NCc2ccc(C(=O)N(C)C)o2)[C@H](C)C1 584901047 ZXTPWLIYOHMZDG-MRXNPFEDSA-N 384.480 2.710 0 50 GFAA Cc1nn(CCNC(=O)N2CCn3cccc3[C@H]2c2cccnc2)c(C)c1C 584894965 GOEOSYFWMGFFFP-HXUWFJFHSA-N 378.480 2.820 0 50 GFAA Cc1c(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3[C@H]2N2CCCCC2)c2cc(O)ccc2n1C 1565507234 OUTLTAXRVNGXFN-ZFCZOSEKSA-N 383.492 2.564 0 50 GFAA COc1cccc(S(C)(=O)=O)c1NS(=O)(=O)c1ccc(Cl)cc1C 170597350 FVDLCHPDWIEIRD-UHFFFAOYSA-N 389.882 2.861 0 50 GFAA Cc1ccc(CCC(=O)NCC(=O)N2CCC[C@@]2(CO)Cc2ccccc2)cc1 170609955 LBQUUSZKRZGQAS-DEOSSOPVSA-N 394.515 2.640 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)c2ccc(C)c3ncccc23)cn1 275263728 IDMOOOFKILRNON-QFBILLFUSA-N 386.477 2.568 0 50 GFAA c1cc2c(cc1CCN1CCC[C@@H](c3[nH]ncc3CN3CCOCC3)C1)CCO2 275884425 HCVKBSHAVPIZON-HXUWFJFHSA-N 396.535 2.599 0 50 GFAA Cc1cc(N2CCN(CC(=O)N(C)[C@H](C)c3cc4ccccc4o3)CC2)n[nH]1 187160307 YKOIJHHDIHJUGN-MRXNPFEDSA-N 381.480 2.806 0 50 GFAA Cc1ccc([C@H](CNC(=O)c2cn3ccnc3s2)N2CCOCC2)s1 188484717 IKEZTLZCVWSWIC-ZDUSSCGKSA-N 376.507 2.569 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)N(Cc1cnn(C)c1)C1CC1 1506422362 SBMXWVLCQUROQM-UHFFFAOYSA-N 378.479 2.798 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCc2csc(-c3cccs3)n2)C1 1506400599 BCABGZJABIMBCB-LBPRGKRZSA-N 387.552 2.564 0 50 GFAA Cc1cc(N2CCN(CCCn3ccnc3C)CC2)nc(-c2ccccc2O)n1 1529139242 MXYIZRBERJHIFH-UHFFFAOYSA-N 392.507 2.875 0 50 GFAA CC(=O)N1C[C@@H]2CN(c3ncnc4[nH]ccc34)C[C@@]2(CCc2ccccc2)C1 1772813196 VEHVKKFFUKTZPW-XMSQKQJNSA-N 375.476 2.875 0 50 GFAA CC[C@H](CO)NCc1ccc(OCC(=O)N[C@H](C)c2ccccc2)c(OC)c1 5027777 AVRKSDIAESDLTH-VQIMIIECSA-N 386.492 2.812 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(CCCn4cccn4)C3)C2=O)c1 12455778 LMMMPHYZPKRJTB-QFIPXVFZSA-N 382.508 2.797 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@@H](N1CCSCC1)C2 14534807 FCYDURMCDIWEFW-OAHLLOKOSA-N 388.537 2.674 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)Cc1ccc(CO)cc1)CC2 1857696636 JWVXGSKXLNSGAQ-UHFFFAOYSA-N 375.472 2.749 0 50 GFAA O=C(c1cc[nH]n1)N1CCCOc2cccc(c2)CC[C@H]2CCCCN2C(=O)C1 1857707229 JKIYARGAJZZYPT-GOSISDBHSA-N 396.491 2.648 0 50 GFAA COc1ccc(NC(=O)N2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)cc1Cl 1857732268 KADMHAPDSTZATK-XWESNNAXSA-N 379.888 2.922 0 50 GFAA COc1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)c(OC)c1 2890024 DPKRIZLCZDJBBB-INIZCTEOSA-N 387.413 2.826 0 50 GFAA O=C(O)COc1ccc(C(=O)N2CCC(c3ncc(Cl)cn3)CC2)cc1 952852384 HOHLREJABUMUAV-UHFFFAOYSA-N 375.812 2.613 0 50 GFAA CCOC(=O)c1ccnc(N2CCN(c3ccc(OC)cn3)CC2)c1Cl 1875357752 VHPKONOXOPIUGU-UHFFFAOYSA-N 376.844 2.642 0 50 GFAA C/C=C/c1cc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc(OC)c1OC 1875402478 HPSRALKRZHJPDA-XLROKWRRSA-N 385.464 2.503 0 50 GFAA CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 888100112 LMNIVYREMDXOGS-HIFRSBDPSA-N 392.512 2.863 0 50 GFAA Cc1cccc(NC2CCN(C(=O)Cn3cnc4c(C)cccc4c3=O)CC2)n1 1775996462 YPLXXNBQESXHTG-UHFFFAOYSA-N 391.475 2.511 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC2(CCc3c(O)nc(C)nc32)CC1 2100544801 JTSUUNIWWOPKOZ-UHFFFAOYSA-N 375.904 2.920 0 50 GFAA O=C([C@@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC([C@@H]2CCOC2)CC1 2325809777 KSFVXGUAOJORPG-IEBWSBKVSA-N 381.480 2.562 0 50 GFAA COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)ccc2OC)CC1 1073077 APSQLAUJELPOCU-UHFFFAOYSA-N 376.478 2.523 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)c1 1141756 LWDACKUDEQYRGA-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA COc1ccc(-c2onc(N3CCN(c4ccccn4)CC3)c2C(=O)O)cc1 2356142844 KIFBEMVAVOABBL-UHFFFAOYSA-N 380.404 2.770 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356152400 HOGFELBNNMWZEQ-DEOSSOPVSA-N 392.499 2.905 0 50 GFAA CCOc1ccccc1N1C(=O)C[C@@H](Nc2ccc(N3CCOCC3)cc2)C1=O 2987794 AKGUENMWHJKLQR-GOSISDBHSA-N 395.459 2.666 0 50 GFAA COc1ccc(CCN2C(=O)C[C@H](Nc3ccc(N(C)C)cc3)C2=O)cc1OC 101129360 DFJANFGJRJGXAO-SFHVURJKSA-N 397.475 2.552 0 50 GFAA O=C(c1cnn2cccnc12)N1CC[C@H]2[C@H](CCC(=O)N2CC2CCCCC2)C1 12039014 AYWVDLFSGAMEER-MJGOQNOKSA-N 395.507 2.763 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC(c2nc3c4ccccc4ncn3n2)CC1 2807914 RAEAYAHHPVUPAN-UHFFFAOYSA-N 393.472 2.846 0 50 GFAA CN(CC1CCN(Cc2ccccc2)CC1)C(=O)c1cc2c([nH]c1=O)CCC2 77440314 NAISMBDNRSPUEN-UHFFFAOYSA-N 379.504 2.848 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)[C@H]3CC34CCNCC4)CC2)OC1=O 77406050 FTTRCVZOQKEKLZ-QGZVFWFLSA-N 377.529 2.626 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@H]1CCO[C@@H](C2CC2)C1 157030576 XTNREYIMKPIGFL-LSDHHAIUSA-N 392.912 2.961 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 236582253 SGPVXEUUHMPDTF-LEWJYISDSA-N 392.455 2.561 0 50 GFAA Cn1nc(C(=O)N2CCOC[C@@H]2c2nc3ccccc3s2)cc1OC(F)F 374321727 BVVCHNPBXKVCRQ-GFCCVEGCSA-N 394.403 2.845 0 50 GFAA Cc1nc(NCCNC(=O)Nc2cccc(F)c2)cc(-n2cnc(C)c2C)n1 72117771 LCKQURSVVCZNKK-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)c1C 129011053 YFKIKNJIQXQZDY-UHFFFAOYSA-N 388.489 2.744 0 50 GFAA COc1cccc([C@@](C)(CC(=O)O)NC(=O)c2cc3c(nc2O)CCCC3)c1 263120228 GQYZUWJXXCKQAG-OAQYLSRUSA-N 384.432 2.795 0 50 GFAA O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccc(NC[C@H]2CCCO2)c(F)c1 129526989 SSXOGDHWVATEDQ-MRXNPFEDSA-N 396.426 2.709 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCN(C23CC4CC(CC(C4)C2)C3)CC1 17077624 XYUGYJFVVUTEEL-UHFFFAOYSA-N 379.526 2.567 0 50 GFAA CC(C)[C@H](C(=O)NCCc1nc2ccccc2[nH]1)N1Cc2ccccc2C1=O 223227163 MBDSIQKIUYRWIV-HXUWFJFHSA-N 376.460 2.902 0 50 GFAA COc1ccc(-n2ccc(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3)n2)cc1 288646790 QROWHMWFDBIULZ-ZDUSSCGKSA-N 382.386 2.637 0 50 GFAA Nc1cncc(-c2cccc(C(=O)N3CCC[C@H](CN4CCOCC4)C3)c2)c1 426513728 QSPKHOUFKXELNX-QGZVFWFLSA-N 380.492 2.515 0 50 GFAA COc1cccc(CCNC(=O)CN2CCO[C@]3(CCc4ccccc43)C2)c1 179097441 PGWSZWKAVSPXKV-HSZRJFAPSA-N 380.488 2.528 0 50 GFAA O=C(c1cccc(=O)[nH]1)N(CC1CCN(C2CCCC2)CC1)C[C@@H]1CCCO1 95530215 HDOVXVYEMFRHSN-IBGZPJMESA-N 387.524 2.651 0 50 GFAA COCC(=O)N1CCCN(C(=O)Nc2c(F)cccc2C(F)(F)F)CC1 95503784 UNQQOWNHGQFLFZ-UHFFFAOYSA-N 377.338 2.557 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Nc1ccc(Cl)cc1Cl 239425680 UZTJJCITPDODGP-NRULLWLTSA-N 391.254 2.985 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)Cc2c(C)nn(-c3ccccc3)c2C)on1 95390987 SVLHAJHXYZUVDT-UTKZUKDTSA-N 394.475 2.702 0 50 GFAA Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1CC(=O)N1CC[C@H](CN)C1 299738893 IBXMVNZVBPZKHY-CQSZACIVSA-N 380.414 2.858 0 50 GFAA CN1CCC[C@H](NC(=O)N(Cc2cccnc2)Cc2ccc3c(c2)OCO3)C1 534665455 QVLYZINSNBNPRD-SFHVURJKSA-N 382.464 2.616 0 50 GFAA CCC(=O)N[C@@H]1CC[C@@]2(OC)CCN(C(=O)c3cn(C)c4ccccc34)[C@H]2C1 534646007 DQBHNEYTUGZGFC-QOEFQVSFSA-N 383.492 2.857 0 50 GFAA Cc1ccc(CN(CCCO)C(=O)N[C@@H](C)c2cn3ncsc3n2)s1 534647336 PNKMMARLGQBZHR-LBPRGKRZSA-N 379.511 2.816 0 50 GFAA CCNC(=O)c1cc(NC(=O)N2CCC[C@H]2Cn2cccn2)ccc1Cl 299757266 KSMILNHTKAWERM-AWEZNQCLSA-N 375.860 2.983 0 50 GFAA COCCCn1c(C)cc(O)c([C@@H](CC(=O)OC)c2ccc(F)c(F)c2)c1=O 824396636 ZDOJEILPMARSIX-AWEZNQCLSA-N 395.402 2.872 0 50 GFAA COc1cccc(CN2CCC3(CC2)CN(C[C@@H]2CCOC2)CCO3)c1F 824794507 QHJGNQWFVJKXPC-KRWDZBQOSA-N 378.488 2.538 0 50 GFAA COc1ccc(Cn2nc(C)nc2[C@H]2CC(=O)N(Cc3cccnc3)C2)cc1 670453957 RJEBKEIXFGSIMU-SFHVURJKSA-N 377.448 2.555 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)Nc1ccc(OC[C@H]2CCCCO2)cc1 952979299 VVJUIIRTHDPEFA-LJQANCHMSA-N 393.443 2.983 0 50 GFAA Cc1cc(C(=O)Nc2ccccc2NC(=O)CN(C)C)ccc1N1CCOCC1 952969154 SETGLYJXILEFCF-UHFFFAOYSA-N 396.491 2.584 0 50 GFAA Cn1cc(CCNC(=O)c2c(O)n(C)c3ccccc3c2=O)c2ccccc21 888090094 BDARSSPCMWCPRB-UHFFFAOYSA-N 375.428 2.708 0 50 GFAA Cc1nc(N2CCC[C@H](CNC(=O)c3cc(C)oc3C)C2)c2cnn(C)c2n1 952963179 GBOGAJRCCZFZSU-OAHLLOKOSA-N 382.468 2.528 0 50 GFAA O=C(Cc1cccnc1)NC[C@H]1CCCN(C(=O)c2cccc3cc[nH]c23)C1 952970500 ISFGYOYJWFJKJC-QGZVFWFLSA-N 376.460 2.774 0 50 GFAA Cc1ccc(C(=O)NCCNC(=O)CCc2ncc(C(C)(C)C)o2)cc1F 170600171 XCDKUWLHAGFISL-UHFFFAOYSA-N 375.444 2.898 0 50 GFAA CC(C)(C)C1CCC(O)(CNC(=O)c2cc(N3CCOCC3)ccn2)CC1 189843767 BMWTVWQONPUQBJ-UHFFFAOYSA-N 375.513 2.615 0 50 GFAA Cc1csc([C@@](O)(CC(=O)N2CCC(n3cccn3)CC2)C(F)(F)F)n1 746847906 OHIMSSDOYZLYED-HNNXBMFYSA-N 388.415 2.652 0 50 GFAA COc1ccc(-c2noc(CN3C(=O)N[C@](C)(CC(C)C)C3=O)n2)cc1OC 198148782 ZEEOCNKHSPXVGS-LJQANCHMSA-N 388.424 2.610 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H]2CCCOC2)ccc1F 1704309056 WWPHYRJYPKPNSY-LBPRGKRZSA-N 377.416 2.712 0 50 GFAA COc1cc(C(=O)N2CCCN(C(=O)c3ccc(CSC)o3)CC2)ccn1 1704343855 GPGADYIOTDSVHJ-UHFFFAOYSA-N 389.477 2.535 0 50 GFAA CN(C)CCCOc1ccc(CN2CC(=O)N[C@@H](Cc3ccccc3)C2)cc1 1772701899 PRZKFVYNFBJDLL-NRFANRHFSA-N 381.520 2.560 0 50 GFAA Cc1cccc(CC(=O)N2C[C@@H]3CN(CCO)C[C@@]3(CCc3ccccc3)C2)c1 1772710525 SETGIZVRVOMYII-ZCYQVOJMSA-N 392.543 2.923 0 50 GFAA O=C(NC1CCCCCC1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 11874129 STTNIRJWNFKGEX-GOSISDBHSA-N 375.557 2.938 0 50 GFAA Cc1nc(CCNC(=O)c2cn(Cc3ccccc3Cl)nn2)nc2c1CCC2 12003120 OVCVRFWEIZMCJC-UHFFFAOYSA-N 396.882 2.539 0 50 GFAA Cc1cccn2cc(CNC(=O)[C@H]3CCC(=O)N(Cc4ccccc4F)C3)nc12 12197062 AOUOYGABGILRIM-KRWDZBQOSA-N 394.450 2.837 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN([C@H](C)CCO)CC2)c1 19745619 XXOVAZDOZTWMEZ-MRXNPFEDSA-N 376.497 2.545 0 50 GFAA C[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C[C@@H]1C(=O)O 1857529982 RWBHCNVTBCDYMT-LKTVYLICSA-N 399.274 2.777 0 50 GFAA Cc1ocnc1C(=O)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857715469 SRVGNSYRJIVBPG-NRFANRHFSA-N 391.431 2.661 0 50 GFAA CC(C)[C@H]1CN2C[C@H](NC(=O)Cc3csc(-c4ccccc4)n3)C[C@H]2CO1 1857736619 UEPNKQPVHBGEMS-NZSAHSFTSA-N 385.533 2.967 0 50 GFAA O=C([C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O)N1CC2(CCCO2)C1 913007459 QBKQCXNRGHHEIF-HXUWFJFHSA-N 376.456 2.645 0 50 GFAA Cc1nc(SCC(=O)Nc2cc(Cl)ccc2Cl)[nH]c(=O)c1CCO 11905696 NXIFJGHQGIDIKX-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA CCN(C(=O)[C@@H](C)OC(=O)c1cc(Cl)ccc1-n1cnnn1)c1ccccc1 915245072 ISQAMBNBOABHPV-CYBMUJFWSA-N 399.838 2.914 0 50 GFAA O=C(N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1)N1CC(N2CC[C@@H](O)C2)C1 876278976 JAMDQJUTAISAEU-XLIONFOSSA-N 397.523 2.645 0 50 GFAA Cc1cccc([C@@H](CNC(=O)N2CCOCC[C@H]2C2CC2)N2CCOCC2)c1 1875300358 AMSZJHZGXPCWPP-LEWJYISDSA-N 387.524 2.579 0 50 GFAA O=C(NCCc1nc(-c2ccc(Cl)cc2)n[nH]1)c1ccnc(C(F)(F)F)n1 1875316252 DKAGUUZBXVKNOD-UHFFFAOYSA-N 396.760 2.906 0 50 GFAA COC(=O)[C@H](OC)C1CCN(C(=O)CNc2cccc(C(F)(F)F)c2)CC1 1875308757 VFJWBYVAZBNDEP-MRXNPFEDSA-N 388.386 2.544 0 50 GFAA C=CC(=O)N[C@@H](CNC(=O)c1nnc2ccccc2n1)c1ccc(C(C)C)cc1 1875385923 FNNHMQDGPGFFNH-IBGZPJMESA-N 389.459 2.922 0 50 GFAA COC(=O)C1CC2(C1)CN(C(=O)NCc1ccc3ccccc3c1)C[C@@H]2C(=O)O 898814747 COCLZIRIMAQDBQ-WUZYXKQASA-N 396.443 2.635 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)Cn2nnc(-c3ccccc3F)n2)cc1 904532 OOJXGZIJAXKQGA-UHFFFAOYSA-N 383.383 2.683 0 50 GFAA CCN(CC)C(=O)Cn1c(S(=O)(=O)Cc2ccccc2)nc2ccccc21 1051894 VATXPZLVLYCVIZ-UHFFFAOYSA-N 385.489 2.879 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1)N1CCC(Oc2ccc(Cl)cc2)CC1 2325782255 HRCSXFCSNQGUEU-UHFFFAOYSA-N 383.839 2.999 0 50 GFAA Cn1cc(-c2cccc(CN[C@@H]3C[C@@H](Cn4cc(Cl)cn4)C[C@H]3O)c2)cn1 2325785528 CPCDCTIRBHCPMY-CDHQVMDDSA-N 385.899 2.866 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1occc1-c1ccc(F)c(F)c1 2325804964 FSMAHRWTAFOBHM-NXOUGTEYSA-N 387.386 2.991 0 50 GFAA CC(=O)N(C)c1ccc(C(=O)NS(=O)(=O)C2CC(c3ccccc3)C2)cc1 2325807086 ZCXGFZXOCRHJGB-UHFFFAOYSA-N 386.473 2.675 0 50 GFAA CCOc1ccc(NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 816920 BYSKTMXNOJTALY-AWEZNQCLSA-N 392.477 2.887 0 50 GFAA COC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc(C(=O)N(C)C)c1C 998606 LWKMPEQUPSLPDZ-UHFFFAOYSA-N 390.417 2.526 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCn3ccccc3=O)C2=O)cc1 2356142619 ZPTCJFMLDWRYKQ-QHCPKHFHSA-N 393.487 2.735 0 50 GFAA COc1ccc(NC(=S)NC(=N)N2CCN(Cc3ccccc3)CC2)cc1 3873651 KKUSHOPNGNEGDR-UHFFFAOYSA-N 383.521 2.734 0 50 GFAA NC(=O)[C@H]1CCO[C@@H]1C1CCN(C(=O)c2csc(C3CCCCC3)n2)CC1 412347862 XDRPMMQBBMCQIZ-DOTOQJQBSA-N 391.537 2.933 0 50 GFAA CO[C@@H]1CC[C@H]2OCCN(C(=O)CCc3nc(-c4cccs4)no3)[C@H]2C1 246231384 FUYOKUITOMSSFF-HZSPNIEDSA-N 377.466 2.526 0 50 GFAA COc1cccc(CCNC(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)c1 20996956 KKERGKYTDNQIKD-UHFFFAOYSA-N 375.432 2.789 0 50 GFAA O=C(Cc1n[nH]c2nc3ccccc3n2c1=O)c1ccc(Br)cc1 100366719 MCVZEOIOBMEPOB-UHFFFAOYSA-N 383.205 2.759 0 50 GFAA O=C(Nc1ccccc1)c1cc2n(n1)CCN(C(=O)COc1ccccc1)C2 65526431 KZBADICUXPHUCS-UHFFFAOYSA-N 376.416 2.557 0 50 GFAA Cc1n[nH]c(C)c1C[C@@H](C)N1CCn2nc(C(=O)Nc3ccccc3)cc2C1 67851507 UDAXDNONMLHTPR-CQSZACIVSA-N 378.480 2.922 0 50 GFAA O=C(C[C@@H]1NC(=O)N(Cc2ccccc2Cl)C1=O)N1CCc2ccccc2C1 170625303 QLTGDQXAXUXXQB-SFHVURJKSA-N 397.862 2.735 0 50 GFAA CNc1ncc(C(=O)N2CCC(n3cc(-c4ccc(C)cc4)nn3)CC2)cn1 20449223 NTQLEOOJVSEOLN-UHFFFAOYSA-N 377.452 2.563 0 50 GFAA COc1ccc(C[C@H](C)C(=O)NCC2(N3CCCCC3)CCN(C)CC2)cc1 136132124 NTXQJKYDWGKJIW-IBGZPJMESA-N 387.568 2.940 0 50 GFAA O=C(c1cc2cc(F)ccc2[nH]1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1ccccn1 67513602 ABTWYVBDDMOCHB-RBUKOAKNSA-N 394.406 2.590 0 50 GFAA CCCS(=O)(=O)N1CCC(CCOc2ccccc2)(C(=O)OCC)CC1 12299164 QNLJHKDJVDSFSR-UHFFFAOYSA-N 383.510 2.841 0 50 GFAA CCn1ccnc1CN1CCN(Cc2ccc(OC)c(C)c2C)[C@H](CCO)C1 39543034 FEQALAXBUNAZGR-HXUWFJFHSA-N 386.540 2.597 0 50 GFAA CC[C@H]1CN(C(=O)CCc2c(C)n[nH]c2C)CCC(=O)N1Cc1ccccc1 71747481 AKLKWQUQSVYJJY-IBGZPJMESA-N 382.508 2.999 0 50 GFAA O=C(Cn1nc(-c2ccco2)ccc1=O)NCCc1c[nH]c2ccc(Cl)cc12 71281931 YMFUSUDYCQETIP-UHFFFAOYSA-N 396.834 2.997 0 50 GFAA CN(C)c1nc(-c2cccnc2)nc2c1CCN(C(=O)c1ccccc1O)C2 72158513 DLPADSKNYRRTLI-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA CC(C)(C)OC(=O)N1CCO[C@H](CNc2nc(Cl)cc3nccnc23)C1 216472883 OFZCHVIWFAEDMH-LLVKDONJSA-N 379.848 2.726 0 50 GFAA CC[C@@H]1CCN(CC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)[C@H]1C 239352082 ABAQACVEQNENAL-QWHCGFSZSA-N 387.933 2.649 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCO[C@H](c3cccc(OC(F)F)c3)C2)cn1 262714340 CJEOHMSHUDZMLL-HNNXBMFYSA-N 378.331 2.595 0 50 GFAA C[C@H](NC(=O)N1CCc2ccnc(O)c2C1)c1cnn(Cc2ccccc2)c1 494808770 DBBPUMDCDVVKKF-HNNXBMFYSA-N 377.448 2.861 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)CCc2nc3cc(Br)ccc3s2)C1 238085255 VDLUMTZKBXNPOZ-VIFPVBQESA-N 383.267 2.925 0 50 GFAA CC[C@@H](NS(=O)(=O)CC[C@H]1CCCCN1C(C)=O)c1ccc(OC)cc1 242164623 WWOKAWYPENNVMX-IEBWSBKVSA-N 382.526 2.857 0 50 GFAA COc1cccc(NC(=O)Cn2nc(-c3ccc(F)cc3OC)ccc2=O)c1 49546134 RFBXOJBNKAFERM-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA COCCc1noc(CN(C)C(=O)NCc2cccc(-c3ccccn3)c2)n1 160231047 YJFKWXVPSCTPJY-UHFFFAOYSA-N 381.436 2.662 0 50 GFAA Cc1cc(NC(=O)Cn2nnc(-c3c(F)cccc3F)n2)n(-c2ccccc2)n1 48234126 JIBUWRANLGOJKD-UHFFFAOYSA-N 395.373 2.751 0 50 GFAA COc1ccc(CN(C)Cc2ccon2)cc1OC[C@H](O)CN1CCCCC1 95531804 URDKGGABNHFPTN-LJQANCHMSA-N 389.496 2.541 0 50 GFAA O=C([C@@H](O)c1ccccc1)N1CCC(c2nccn2Cc2ccccn2)CC1 95501790 FOKUUEDBAYXBMU-FQEVSTJZSA-N 376.460 2.766 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)C(=O)c3ccccc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95356348 LMYQNVMOBPYSHJ-BHDDXSALSA-N 390.483 2.967 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3cccc4c3ccn4C)C2)CCC1=O 92019366 SJRZTXOTMZAKBA-QFIPXVFZSA-N 383.492 2.670 0 50 GFAA COc1ccc(-n2ncc([C@@H](C)NC(=O)CN3CCCCCC3=O)c2C)cc1 91746445 RYJCPCWLSMAYNR-OAHLLOKOSA-N 384.480 2.769 0 50 GFAA COCCn1cnnc1[C@H](C)NC(=O)Nc1cc2c(C)cc(=O)oc2cc1C 96166248 QSMFDQMWKUBZKF-ZDUSSCGKSA-N 385.424 2.530 0 50 GFAA Cc1cc(N2CCC(N[C@@H](C)c3ncnn3C)CC2)nc(-c2ccccc2)n1 96153772 ZDMSSUYNJGJSNR-INIZCTEOSA-N 377.496 2.900 0 50 GFAA O=C(Nc1cccc(CN2CCCCC2)c1)N1CCN(c2ncccn2)CC1 95513099 APYKXHTYYQUBPW-UHFFFAOYSA-N 380.496 2.817 0 50 GFAA COc1ccc([C@H]2[C@H](C(=O)NC[C@@H]3CCCN4CCCC[C@H]34)CC(=O)N2C)cc1 253400199 DRUXYJWJUPVKGV-RYTRXMBJSA-N 399.535 2.595 0 50 GFAA biogenic CCc1[nH]nc2c1CN(C(=O)c1cccc(-c3c(C)ncnc3OC)c1)CC2 584888560 ICGKFQTVSOILEW-UHFFFAOYSA-N 377.448 2.945 0 50 GFAA Cc1cc(N2CCN(Cc3ccc([C@@H]4CCCCO4)o3)CC2)n2ncnc2n1 825138962 VMLHWJMLUAKUNJ-KRWDZBQOSA-N 382.468 2.590 0 50 GFAA C[C@@]12CC3CC(OCCNC(=O)[C@H]4CCCN(C(N)=O)C4)(C1)C[C@](C)(C3)C2 952981661 NAGZYSKZKFPAJZ-RKLZZMFGSA-N 377.529 2.659 0 50 GFAA COc1nc2c(cc1CNCc1ccc3nsnc3c1)C(=O)N(C(C)C)C2 952965694 BNBHIKDFTZMTNN-UHFFFAOYSA-N 383.477 2.749 0 50 GFAA O=C(NS(=O)(=O)C[C@H]1CCCCO1)c1csc(Cc2ccc(F)cc2)n1 170620489 NGMOKHAFRRMIBA-CQSZACIVSA-N 398.481 2.502 0 50 GFAA Cc1cc(C)c2c(OCC(=O)N[C@H]3C[C@@H]3c3ccc(F)cc3F)nn(C)c2n1 170626418 WFIDQCXZSKRFEZ-ZBFHGGJFSA-N 386.402 2.914 0 50 GFAA COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CC(=O)N1CCC(Cc2ccccc2)CC1 170604700 MTJZANLJPICYSM-SJBKTWHCSA-N 384.520 2.741 0 50 GFAA CC(=O)N(CCc1ccccc1)CC(=O)N1CC[C@@]2(C1)OCc1ccccc12 186937804 FOOTUIUTWIQLLN-QHCPKHFHSA-N 378.472 2.736 0 50 GFAA Cc1cc(C[C@H]2CN(C(=O)c3csc(Cc4ccccc4)n3)C[C@@H]2O)on1 1616078033 XSVLITOVINUABE-YJBOKZPZSA-N 383.473 2.706 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC2CCN(C(=O)c3ccncc3)CC2)n1 1506418772 IXIPTLVWKMWMGW-UHFFFAOYSA-N 379.386 2.593 0 50 GFAA O=C(N[C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21)c1ccc(F)cc1 12706222 KTODXFPVZDSSTD-SFHVURJKSA-N 384.455 2.632 0 50 GFAA O=C1N[C@H](c2ccc(O)cc2)[C@@H](C(=O)c2ccc(F)cc2)[C@@](O)(C(F)(F)F)N1 13563000 MPEPRMHZBVKOIL-JJRVBVJISA-N 398.312 2.635 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)c1 13692273 SVJRTHGKVDAFRZ-UHFFFAOYSA-N 393.443 2.783 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@@]1(O)CNCc1cccc(F)c1 14951937 OILNJVWALFDHCU-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA O=C(Nc1cccnc1)C1CCN(S(=O)(=O)CCCc2ccccc2)CC1 16650762 VSYDFFWLXQJECO-UHFFFAOYSA-N 387.505 2.695 0 50 GFAA Cc1cccn2c(CN[C@@H](C)Cc3cccs3)c(C(=O)N3CCOCC3)nc12 19229552 GYWSIDWFVKXFPN-INIZCTEOSA-N 398.532 2.897 0 50 GFAA CN1CCN(C(=O)c2cnn(-c3ccccc3)c2NC(=O)c2ccccc2)CC1 19797581 LYSVIRFSCHXRIA-UHFFFAOYSA-N 389.459 2.512 0 50 GFAA CCn1ccc(C(=O)N[C@H]2CCCN(c3cc(-c4ccc(F)cc4)n[nH]3)C2)n1 169753546 RYWDHHXIJZPICN-INIZCTEOSA-N 382.443 2.831 0 50 GFAA Cc1nc(-c2cn([C@H]3CCCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)no1 169777793 VLBMYVFUJNHIBQ-LBPRGKRZSA-N 390.806 2.906 0 50 GFAA Cn1cc(C(=O)Nc2ccc3c(c2)C(=O)N2CCC[C@@H]2C(=O)N3)c2ccccc21 206232774 YDYMIVDPQPTXQM-LJQANCHMSA-N 388.427 2.987 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(c4ncc(Cl)cn4)CC3)n[nH]c21 1857530966 IMJLZTOUHMBVAB-MNOVXSKESA-N 375.860 2.895 0 50 GFAA COCCCN=c1[nH]c(C)nc2c1CCC21CCN(Cc2ccncc2)CC1 1857684269 GEZQTAVDRRHKDL-UHFFFAOYSA-N 381.524 2.530 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)n1 1857695712 VGNRFTWFKBQCBH-QZTJIDSGSA-N 377.529 2.837 0 50 GFAA O=C1C[C@H]2[C@H](CCN2Cc2cnsc2)N1Cc1ccccc1-n1cccn1 1857703740 QSWSLTHSVJJXTQ-OALUTQOASA-N 379.489 2.704 0 50 GFAA CCc1ncc(C(=O)NC[C@H]2[C@H]3CN(CCC=C(C)C)C[C@]34CC[C@H]2O4)cn1 1857715973 PXUNWEQCFNLPGW-JZJXAQOMSA-N 384.524 2.605 0 50 GFAA COc1ccccc1Cn1nc(-c2ccccc2)nc1[C@H]1CC[C@@H](O)[C@H](N)C1 1857732864 KVYUAWDPAFNVAG-QXAKKESOSA-N 378.476 2.958 0 50 GFAA CC(=O)NC[C@@H]1CCCN(C(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)C1 124457507 JHKQLZMGHZCLNR-INIZCTEOSA-N 379.460 2.672 0 50 GFAA CCc1oc2ccccc2c1C(=O)N(CCCN(C)C)[C@H]1CCS(=O)(=O)C1 155458553 MOEDEMWSFZNQSS-HNNXBMFYSA-N 392.521 2.576 0 50 GFAA O=C(c1cnn(Cc2ccccc2Cl)c1)N1CCOC[C@H]1[C@@H]1CCCO1 376170666 GOQMBSLSTPUUQE-ROUUACIJSA-N 375.856 2.605 0 50 GFAA CCCOc1c(Br)cc(C(=O)N2CCC[C@H]2C(=O)O)cc1OC 262683702 XLXDTIPSPZBYHN-LBPRGKRZSA-N 386.242 2.936 0 50 GFAA CN(Cc1ccon1)C(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 265869752 VCVGMXVMRJXZTR-AWEZNQCLSA-N 398.341 2.520 0 50 GFAA OCc1cn(-c2ccc(NCc3c(Cl)cccc3N3CCOCC3)cc2)nn1 952845162 DHSVCFDHDBRJAT-UHFFFAOYSA-N 399.882 2.862 0 50 GFAA O=C(O)c1cnc([C@@H]2CCCN2C[C@H](O)COCc2ccc(Cl)cc2)nc1 1875282898 XLJUGIGBLISNQW-IRXDYDNUSA-N 391.855 2.543 0 50 GFAA O=C(c1csc(C2CCNCC2)n1)N1CCOC[C@H]1c1cccc(F)c1 876970757 YEIJYLMYPYCGSV-KRWDZBQOSA-N 375.469 2.963 0 50 GFAA CCc1ccnc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccc3n[nH]cc3c2)c1 1875310708 ZLUCIQHFHJUQAK-SFHVURJKSA-N 391.475 2.945 0 50 GFAA O=C1CCNc2ccc(C(=O)N3CC[C@H](n4cc5ccccc5n4)C3)cc2N1 1875329415 VBWGHONDNMQBMW-INIZCTEOSA-N 375.432 2.878 0 50 GFAA N[C@@H](Cc1ccc(NC(=O)c2ccccc2-n2ccc(C3CC3)n2)cc1)C(=O)O 1875305129 HTSPYSLOPGGGET-SFHVURJKSA-N 390.443 2.956 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2C[C@@H]3C[C@H](C2)CN3C(=O)OC(C)(C)C)cc1 1875373512 DBWZOLHRTCGVHT-QAPCUYQASA-N 399.491 2.917 0 50 GFAA CN(C)C/C=C/C(=O)NCc1ccc2c(c1)OCCN2C(=O)OC(C)(C)C 1875377247 WKOOIBGHIAIPCG-VOTSOKGWSA-N 375.469 2.555 0 50 GFAA COc1ccc(NC(=O)N[C@@H]2CCO[C@H]2c2ccncc2)cc1N1CCCC1=O 888100244 VUJANQUPJVBGJN-UZLBHIALSA-N 396.447 2.869 0 50 GFAA Cc1c(C(=O)NC2(c3ccccc3C(F)(F)F)CC2)nnn1[C@H]1CCNC1 888102064 XFZGUVSBGKILNJ-LBPRGKRZSA-N 379.386 2.559 0 50 GFAA O=C(Nc1ccc(I)cn1)c1ccc2c(c1)OCCO2 12651273 CBMQTMSKVYWKOQ-UHFFFAOYSA-N 382.157 2.710 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCC(=O)N1)C1CCN(C(=O)CCCCC(C)(C)C)CC1 1775991285 KIGUGBYFQBYAEC-NVXWUHKLSA-N 379.545 2.615 0 50 GFAA Cc1cccc(CC(=O)NC[C@H]2[C@@H]3CN(C(=O)[C@H]4C[C@@H]4C(F)F)C[C@H]23)c1Cl 2325794804 RVDSEFVJYIWJHG-UVPYHEFZSA-N 396.865 2.913 0 50 GFAA O=C(CN1CCc2[nH]nc(CO)c2C1)N1c2ccccc2CCc2ccccc21 2325803966 MXKFRIGTBSAEJU-UHFFFAOYSA-N 388.471 2.724 0 50 GFAA COC(=O)CCc1cc2c(nc1C)N(C(=O)N[C@@H](C)C1CCOCC1)CCC2 2325807391 WRJLXOVUAXMGIO-AWEZNQCLSA-N 389.496 2.773 0 50 GFAA O=C(Nc1ccc(CN2CCCC2)c(C(F)(F)F)c1)c1nc2ncccn2n1 894986487 NUXZMOZEOYPQAN-UHFFFAOYSA-N 390.369 2.991 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)c1ccccc1Cl 656012 IXEVGCGCECDJTE-UHFFFAOYSA-N 378.881 2.691 0 50 GFAA COc1cc(NC(=O)CSc2nnc(-c3cccnc3)n2C)cc(OC)c1 779278 PQLKYTUFTUQNDS-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccc(F)cc1 815554 JNFGRFDBKIJUSR-INIZCTEOSA-N 378.425 2.535 0 50 GFAA NC(=O)CSc1oc(-c2cccs2)nc1S(=O)(=O)c1ccccc1 2461017 UXJZKTCTBSACSW-UHFFFAOYSA-N 380.472 2.813 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@]12CCCN2CCOc1ccc(F)cc1 2356148407 UVSLEJYAAGHOEP-WOIUINJBSA-N 390.499 2.965 0 50 GFAA Cc1nonc1[C@H]1CCCN1C(=O)c1cc2c(s1)CCOC21CCNCC1 2356158236 FYOZJUWUZBLCGN-CQSZACIVSA-N 388.493 2.568 0 50 GFAA COc1ccc(C(=O)N/C(=C/c2ccc(Cl)cc2)C(=O)NCCCO)cc1 2994448 JUGRFCPKMNOIDI-QGOAFFKASA-N 388.851 2.618 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CN(c1ccc2c(c1)OCO2)S(C)(=O)=O 4821184 NBYMGQXCLWUWBJ-UHFFFAOYSA-N 396.852 2.782 0 50 GFAA NCc1cn(CC2CCN(Cc3ccc([C@@H]4CCCCO4)s3)CC2)nn1 23430868 AEOPRKZXOIGBHO-SFHVURJKSA-N 375.542 2.952 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C(=O)c3ccccc3C(C)=O)CC2)CC1 20906866 DHBFVEMMXDLCFQ-UHFFFAOYSA-N 399.535 2.686 0 50 GFAA CC1CCN(c2ccc(C(=O)N3CCC(CN4CCCC4=O)CC3)cn2)CC1 20601139 SCIWEUVZOQWGPQ-UHFFFAOYSA-N 384.524 2.793 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1cnn2ccccc12 470717885 NJUSBYYQALREHQ-QGZVFWFLSA-N 384.386 2.534 0 50 GFAA CC(C)[C@@H](CNC(=O)Cc1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 252492629 MQXZRYARAVTSNK-CQSZACIVSA-N 377.872 2.943 0 50 GFAA CCCOCCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1cc(F)cc(F)c1 4987298 GOBWECMOYZHYDG-MRXNPFEDSA-N 378.379 2.815 0 50 GFAA Cc1ccc2ccccc2c1CN1CCN(CC2CC2)[C@@H]2CS(=O)(=O)C[C@@H]21 72424746 JUDDGEMYVFAICC-YADHBBJMSA-N 384.545 2.841 0 50 GFAA CC(C)[C@H](C(=O)N[C@@H]1CCN([C@H](C(=O)O)C(C)C)C1=O)c1cccc(Cl)c1 478981525 IFVRFUWKNGBWSM-IKGGRYGDSA-N 394.899 2.906 0 50 GFAA O=c1cc(N2CCOCC2)cnn1[C@H]1CCCN(Cc2coc3ccccc23)C1 328602583 CEFYGCVITBNSPF-SFHVURJKSA-N 394.475 2.663 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@@H](CCc3c(F)cccc3F)C2)c(=O)[nH]1 71756885 GNOKRHOZLCPVIK-AWEZNQCLSA-N 375.419 2.770 0 50 GFAA CCCC[C@H](C(=O)Nc1cc(C)on1)N1CCN(CC2CCOCC2)CC1 172429080 WXKHYOALFAPQCW-GOSISDBHSA-N 378.517 2.525 0 50 GFAA CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)CCc1cc2n(n1)CCCNC2 72468166 SEPXURAYIHCDGW-UHFFFAOYSA-N 394.523 2.585 0 50 GFAA CCOc1cccc(-c2cccc(NC(=O)[C@H]3CC(=O)N(c4cn[nH]c4)C3)n2)c1 489557496 YTFSBIWJYMRQTJ-HNNXBMFYSA-N 391.431 2.862 0 50 GFAA C[C@]1(C(=O)Nc2nncn2-c2cccnc2)CCCN(C(=O)c2ccccc2)C1 377163179 QBWLZWDDAVDZBG-NRFANRHFSA-N 390.447 2.543 0 50 GFAA CCCc1c(NC(=O)N2C[C@@H](C)O[C@]3(CCOC3)C2)cnn1-c1cc(C)ccn1 373937205 VYOAEUPBQUZCDZ-IIBYNOLFSA-N 399.495 2.940 0 50 GFAA Cc1[nH]nc2ncc(C(=O)N3CCC([C@@H]4C(=O)Nc5ccccc54)CC3)cc12 373984341 ZTPAJVZOEBUFRT-SFHVURJKSA-N 375.432 2.854 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@H](CCc3c(F)cccc3F)C2)c(=O)[nH]1 71756884 GNOKRHOZLCPVIK-CQSZACIVSA-N 375.419 2.770 0 50 GFAA Nc1ccnc(-c2cccc(C(=O)N3CCC(C(=O)N4CCCC4)CC3)c2)c1 426478757 KZKHLTNMGZDBFQ-UHFFFAOYSA-N 378.476 2.805 0 50 GFAA Cc1cc(C(=O)N(CC(=O)O)C2CCOCC2)c(C)n1Cc1cccs1 237667847 CLSIZWKHNLVKRR-UHFFFAOYSA-N 376.478 2.921 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)Nc1cc(F)c2c(c1)NC(=O)CO2)C1CC1 97088235 XJVVPVOODFTWEE-UHFFFAOYSA-N 387.415 2.703 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCC[C@H](c4cc(O)ncn4)C3)c2)nn1 426485552 IQCLVGZKSKLDDY-KRWDZBQOSA-N 375.432 2.967 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1nn(Cc3ccccc3Cl)cc1Cl)[C@H]1CC[C@H]2O1 239433296 XMIXAOQJFLRXRZ-KBUPBQIOSA-N 392.242 2.905 0 50 GFAA Cc1cccc(CN(C[C@H]2CCCO2)C(=O)Cn2c(=O)[nH]c3ccccc32)c1 95505707 HZJUNKRDTDQNBF-GOSISDBHSA-N 379.460 2.846 0 50 GFAA CC[C@@H]1COCCN1C(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 236921569 VZPVMZIALWPLGX-GFCCVEGCSA-N 397.353 2.840 0 50 GFAA Cc1c(C(=O)N2CCNC(=O)[C@H]2c2ccc(F)cc2)c2cc(O)ccc2n1C 97259317 RRLIRZLALWWAIZ-LJQANCHMSA-N 381.407 2.645 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)CSc3ccccc3)C2)CCC1=O 91663794 LWUPLLWJNKUBDN-FQEVSTJZSA-N 376.522 2.656 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3noc4ccccc34)C[C@H]2N(C)C)cc1 95531293 FIBVMLYFOZCBRO-AZUAARDMSA-N 379.460 2.935 0 50 GFAA O=C(CCN1CCN(CC2CC2)[C@@H](CCO)C1)Nc1cccc2ccccc12 244817020 SSXBSOVBYKLSGS-FQEVSTJZSA-N 381.520 2.947 0 50 GFAA Cc1cc2ncn(C[C@H](O)CN3CCCN(c4ccccn4)CC3)c2cc1C 183827288 OTLUOAUMLKXYNA-LJQANCHMSA-N 379.508 2.621 0 50 GFAA O=C(NC[C@]1(O)CCCNC1)c1ccc(-c2ccc(OC(F)F)cc2)cc1 534674489 BNXOXZTTXFJFOY-FQEVSTJZSA-N 376.403 2.799 0 50 GFAA COC(=O)c1cn(CCc2nc3ccccc3n2C(C)C)cc2c(=O)[nH]nc1-2 263588410 TVVPZHLQLGMLFB-UHFFFAOYSA-N 379.420 2.636 0 50 GFAA Cc1ccc(S[C@@H](C)C(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)cc1 820621643 XRAOYLMUIQOYQL-KRWDZBQOSA-N 389.565 2.808 0 50 GFAA CCN1CCNC(=O)[C@H]1CC(=O)Nc1ccc(Oc2cccc(OC)c2)cc1 952968549 OZRHSLXYVOQMNL-LJQANCHMSA-N 383.448 2.636 0 50 GFAA O=C(NCCNC(=O)C1(N2CCCCC2)CCCCC1)c1ccc(F)cc1 952974128 IKZBTEHZTBMIJH-UHFFFAOYSA-N 375.488 2.861 0 50 GFAA Cn1cccc1-c1cc(C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)n[nH]1 952986046 IYOIMGQTCXCXOC-UHFFFAOYSA-N 391.435 2.850 0 50 GFAA Cc1ncsc1CCC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1ccncc1)C2 1565527391 OBOXRGNLCKVJNF-WBVHZDCISA-N 384.505 2.542 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1cccc(F)c1)c1ccccc1-n1cccn1 1565526178 USIGJUUZQCUKAM-ICSRJNTNSA-N 381.407 2.978 0 50 GFAA S=C(NCc1cccs1)N1CCOC[C@@H]1c1ncn(Cc2ccccc2)n1 789395303 PHPFWTGXPBPRGM-QGZVFWFLSA-N 399.545 2.836 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCOc2ccc(CO)cc2C1 1506402205 VIYUCLBDHLMCGU-UHFFFAOYSA-N 388.851 2.891 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)COc1ccc(Cl)c(Cl)c1 1704306010 UAKJWDOKJAARKM-UHFFFAOYSA-N 385.295 2.994 0 50 GFAA O=C(Cc1ccsc1)N1C[C@H]2CN(Cc3ccccc3Cl)C[C@]2(CO)C1 1772816051 FNHXKWBOYIELPX-YLJYHZDGSA-N 390.936 2.897 0 50 GFAA O=C(N[C@@H](Cn1cccn1)c1ccccc1)c1cn(CCc2ccccc2)nn1 11765842 CACBXGDKBNQOEA-FQEVSTJZSA-N 386.459 2.889 0 50 GFAA Cc1ccc2occ(CN3CCC(CCC(=O)N4CCOCC4)CC3)c(=O)c2c1 11815012 BZGRNGYPEUEION-UHFFFAOYSA-N 398.503 2.952 0 50 GFAA COc1ccccc1CN1CCC(CN(CC(C)C)C(=O)Cn2cncn2)CC1 12458689 JBNLQSOTJMOSND-UHFFFAOYSA-N 399.539 2.684 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3cnc4scc(C)n4c3=O)CC2)c1C 16649020 RTDSDFBCNIVBSL-UHFFFAOYSA-N 382.489 2.644 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c(F)ccc(F)c3F)C[C@@H]2CCO)CC1 19227198 CBVHPVIBZVPSHG-KRWDZBQOSA-N 399.501 2.845 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CC[C@@H](N(C)C)C3)nc2)cc1 19300424 CUBHOPPSAFTPKA-LJQANCHMSA-N 382.508 2.593 0 50 GFAA O=C(c1ccc(CN2CCOCC2)cc1)N1CCN(c2ccc(F)cc2)CC1 19334249 IVXWHDBTONAOMR-UHFFFAOYSA-N 383.467 2.620 0 50 GFAA COc1cc(C(C)=O)ccc1OC[C@H](O)CN1CCN(c2ccccc2C)CC1 19908939 UXIIGSSKBOZZIV-HXUWFJFHSA-N 398.503 2.768 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cccc(Cl)c3)C2)c1C 1857531464 YHOOXNMJISBYIY-QGZVFWFLSA-N 387.915 2.817 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCC[C@]3(CCc4c(O)nc(N(C)C)nc43)C2)c1 1857696750 AZSDCGBPKXBEFE-QHCPKHFHSA-N 394.519 2.914 0 50 GFAA Cc1cc(N2CCC3(CC2)OCCc2cc(-c4ncccn4)sc23)nc(=N)[nH]1 1857725500 ZDXYGOBDZMHJGY-UHFFFAOYSA-N 394.504 2.784 0 50 GFAA OCC[C@H]1CN2C[C@H](n3ccnc3-c3ccccc3C(F)(F)F)C[C@H]2CO1 1857733381 IPMWTEUCTJFZCG-ILXRZTDVSA-N 381.398 2.966 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccc4c(n3)CCC4)C[C@]23CC[C@H]1O3)c1ccco1 1875250009 QUZUYBJBCPDUOA-FIQUECFISA-N 379.460 2.577 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)CCO1 238143179 GTVGUNGAHKJYRE-GOSISDBHSA-N 378.384 2.934 0 50 GFAA Cc1nc[nH]c1C(=O)N1C[C@H]2COC[C@@H](C1)CN2Cc1oc2ccccc2c1C 1704309247 OQIXRTBMQUEZMT-SJORKVTESA-N 394.475 2.746 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3ccc(CC(=O)O)c(F)c3)cn2)C[C@H](C)O1 909847118 PRLSEWASUHYHHF-STQMWFEESA-N 387.411 2.714 0 50 GFAA Cc1cncc(CNC(=O)c2cnn3ccc(CNC(=O)OC(C)(C)C)cc23)c1 1875306588 LGEXKHOVDGRXDW-UHFFFAOYSA-N 395.463 2.992 0 50 GFAA CC(C)[C@H](C(=O)N[C@@H](C)C1CCN(C(=O)c2cc3cnccc3[nH]2)CC1)N(C)C 1875332431 RPCGUHJSKCVRPD-MGPUTAFESA-N 399.539 2.506 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cccc4[nH]ccc34)C2)c1C 1875397142 NLYCQWRPYXJCMJ-QGZVFWFLSA-N 392.507 2.645 0 50 GFAA CCS(=O)(=O)CCn1cc(C)c(-c2cc(F)cc(Cn3ccnc3)c2)n1 2325773001 HACWVPJLVKRITM-UHFFFAOYSA-N 376.457 2.677 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CCN1C(=O)c2ccccc2S1(=O)=O 1145848 QESBIOAOOVSXIS-UHFFFAOYSA-N 378.837 2.822 0 50 GFAA COc1ccc(Cc2nc(-c3ccnn3C(C)C)n(CCCO)n2)cc1OC 2356138584 OJDVPPSRWIGHEZ-UHFFFAOYSA-N 385.468 2.713 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@]23CCCN(Cc2ccccn2)C3=O)c(O)n1 2356148610 INDNUYJRIAJGMU-QFIPXVFZSA-N 394.475 2.596 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N1CC[C@](O)(c2ccccc2)[C@@H](O)C1 2356152733 YKQLCXAGXPWYLL-ICSRJNTNSA-N 375.852 2.508 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2cc(=O)n(C)c3ccccc23)C1=O 2356155514 GFLOWTBBMRKRQZ-QFIPXVFZSA-N 381.476 2.544 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 4904453 SVEXVGQTYPLFMA-INIZCTEOSA-N 378.519 2.774 0 50 GFAA O=C1N[C@H](CCc2ccccc2)C(=O)N1CC(=O)N1CCC[C@H]2CCCC[C@H]21 250289041 OKXRFDQHOMIIRC-GUDVDZBRSA-N 383.492 2.721 0 50 GFAA CN(C)S(=O)(=O)N1CCC(C(=O)Nc2ccccc2-c2ccccc2)CC1 10335877 JZKPBGSDJQPSNC-UHFFFAOYSA-N 387.505 2.811 0 50 GFAA CCOc1cc(Cl)c(CNCc2ccc(S(N)(=O)=O)cc2)cc1OC 55309617 GXPIADQARIJBDF-UHFFFAOYSA-N 384.885 2.685 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)Nc3nncn3Cc3ccccc3)CC2=O)cc1 117736939 UAUPPSREIKNYIH-QGZVFWFLSA-N 375.432 2.626 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@H]2CCO)cc1 104405820 MKPZJBWHZWTWFE-GOSISDBHSA-N 375.538 2.919 0 50 GFAA Cc1cccc(C(C)C)c1NC(=O)C(=O)[C@H]1C(=O)N(c2ccccc2)N=C1N 100721945 FZYNHJHLTGBGJP-MRXNPFEDSA-N 378.432 2.561 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(Cn4nc(C)c(C)c4C)[nH]c3C2)c1 65373449 CEIQMTNOUCJBIB-MRXNPFEDSA-N 379.464 2.658 0 50 GFAA Cc1nc([C@@H](C)NC(=O)c2cc(COc3cccc4cccnc34)on2)n[nH]1 67878343 JVKLAJKDZNXOGP-LLVKDONJSA-N 378.392 2.719 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCC[C@H](O)C4)nc3)n2)c1OC 20406262 PZYMTBHUUNYAOR-AWEZNQCLSA-N 382.420 2.777 0 50 GFAA Cc1n[nH]c(C)c1CNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 20599925 SGTSXPVQQVRODT-UHFFFAOYSA-N 396.491 2.736 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N(CC)[C@@H]3CCOC(C)(C)C3)cnn2c1 67742868 WSYZKYYRROVXPZ-QGZVFWFLSA-N 387.528 2.991 0 50 GFAA COc1cccc(CC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccc2)c1 219386713 WQWXQCRWLWCVFK-UXHICEINSA-N 378.472 2.887 0 50 GFAA COc1ccc([C@@H](C)CNC[C@@H]2CC(=O)N(C)[C@H]2c2c(C)nn(C)c2C)cc1 328621544 HUHOQUPROMXEGO-VELBRHGASA-N 384.524 2.958 0 50 GFAA CCCN(CCO)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71749844 BORVEZZBIDQPSZ-QHCPKHFHSA-N 380.488 2.765 0 50 GFAA O=C(NCc1cc(Cl)cc(I)c1)NC[C@@H](O)C1CC1 425841627 XSKPAUGRJRDKJQ-GFCCVEGCSA-N 394.640 2.515 0 50 GFAA CCOCC(=O)Nc1nn(-c2cccc(F)c2)c2cccc(N3CCOCC3)c12 72479403 AVIKPFKSXSFJEG-UHFFFAOYSA-N 398.438 2.976 0 50 GFAA NCCOc1ccc(Cl)cc1C(=O)N1CCCC[C@H]1CCn1cccn1 426431370 RPBPXHHAMAHXBY-INIZCTEOSA-N 376.888 2.959 0 50 GFAA CCCC[C@@H]1CN(c2ccc(Cl)cc2)C(=O)CN1C(=O)CCNC(C)=O 82087424 WQKGPTRDUYDISO-QGZVFWFLSA-N 379.888 2.600 0 50 GFAA COc1cccc(CCC(=O)N[C@@H]2COCC[C@@H]2OCc2cscn2)c1 222232111 GYFRGIMTSSHRHX-MSOLQXFVSA-N 376.478 2.575 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CN(Cc3ccc(Cl)cc3F)C[C@]2(C(=O)O)C1 96139759 VQUKILXOTNTJOQ-LIRRHRJNSA-N 380.847 2.624 0 50 GFAA Cc1ccccc1CSCCNC(=O)[C@@H](c1cccnc1)N1CCOCC1 95384638 FSGJCWNDXOMTIN-HXUWFJFHSA-N 385.533 2.813 0 50 GFAA O=C(CN1CCN(C/C=C/c2ccccc2)CC1)Nc1ccc2nsnc2c1 22752031 GGNHNKGGCVXJJC-QPJJXVBHSA-N 393.516 2.961 0 50 GFAA COc1ccc([C@@H](CC(=O)N2CC(N3CCOCC3)C2)c2ccccc2)cc1 95526746 CMRRTOCMZIFCFR-QFIPXVFZSA-N 380.488 2.760 0 50 GFAA O=C(O)c1ccc(CCNC(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1 299752587 UQSSFCGCHVWEIP-UHFFFAOYSA-N 387.823 2.540 0 50 GFAA CC(C)c1ccc(N2C(=O)[C@@H](CC(=O)NCCc3ccccn3)N=C2O)cc1 253394962 WDBRUMZDUCXSKV-GOSISDBHSA-N 380.448 2.583 0 50 GFAA CCS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 298921391 ATSQIUFTFIXPAN-GFCCVEGCSA-N 396.406 2.522 0 50 GFAA COc1ccccc1CNC(=O)c1nnn2c1CO[C@H](c1ccc(F)cc1)C2 263618745 VHTNWHUIQQGOKU-SFHVURJKSA-N 382.395 2.627 0 50 GFAA COCCn1ccc2c(OCC(=O)Nc3ccc4c(c3)OCC(=O)N4)cccc21 263588070 OSMMSGYYDRYLSF-UHFFFAOYSA-N 395.415 2.636 0 50 GFAA O=C(NCCc1cccnc1)c1cccc(-c2c(N3CCCC3)cnnc2O)c1 534676251 KLYNBEHUYGVDTD-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA Fc1ccccc1-c1cnnc(N2CCN(CCOc3ccccc3)CC2)n1 55271698 ZIJZZPMVNVBPTN-UHFFFAOYSA-N 379.439 2.879 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1ccccn1)c1c[nH]nc1-c1ccccc1F 1565511037 GUJMYJOJAKVSFY-IRXDYDNUSA-N 382.395 2.577 0 50 GFAA CC(=O)N[C@H]1CN(Cc2nc(O)c3sccc3n2)C[C@@H]1c1ccc(C)cc1 1565514978 DDSXBNNSJJKCQQ-WBVHZDCISA-N 382.489 2.809 0 50 GFAA CCOC(=O)[C@@](C)(NC(=O)CCc1ccc(OC)c(OC)c1)c1cccnc1 408516978 FAYMBBSISCEPFY-NRFANRHFSA-N 386.448 2.626 0 50 GFAA Cn1ccs/c1=N\C(=O)C1(NC(=O)Cc2c[nH]c3ccccc23)CCCC1 170618252 ABYMYBZPUGCTJX-QOCHGBHMSA-N 382.489 2.667 0 50 GFAA C[C@@H](CN1CCCCC1)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 171039059 UMHOEFMOEQHCDF-IBGZPJMESA-N 387.572 2.604 0 50 GFAA COc1ccc2c(c1)CCC[C@@H]2CNC(=O)c1c(C)nn(C)c1-n1cccn1 189120635 BERZHHTXCCJOPN-MRXNPFEDSA-N 379.464 2.773 0 50 GFAA O=C(NCc1cccc(COC2CCOCC2)c1)N1CCO[C@@H](C(F)F)C1 194241107 TUSAIORRKHVDNI-QGZVFWFLSA-N 384.423 2.558 0 50 GFAA Cn1nc(CNc2ccc(C(=O)N3CCOCC3)cn2)c2c(Cl)cccc21 1529145789 HHWIOTSFTZFGIT-UHFFFAOYSA-N 385.855 2.706 0 50 GFAA CCNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OCC)ccc1OC 13677054 YXDHCWBZSUGLGA-UHFFFAOYSA-N 378.450 2.644 0 50 GFAA Cc1c(-c2ccc(F)cc2)[nH]c2ccc(CNC(=O)CCn3cnnn3)cc12 14967093 MHHAREJFPKKKSW-UHFFFAOYSA-N 378.411 2.975 0 50 GFAA COc1cc(NC(=S)N2CCN(c3ccccn3)CC2)cc(OC)c1OC 18244293 GSQXNPXJZGHLQU-UHFFFAOYSA-N 388.493 2.626 0 50 GFAA COC(=O)c1ccc(CN2CCN(Cc3cccc(OC)c3)[C@@H](CCO)C2)cc1 19840224 LENUXIUHXOTTMO-NRFANRHFSA-N 398.503 2.551 0 50 GFAA CC(C)c1cc(C(=O)N2CC[C@@H](O)[C@@]3(CCCNC3=O)C2)c(O)c(C(C)C)c1 1857685389 UQSPMMXSLHYYJP-XMSQKQJNSA-N 388.508 2.742 0 50 GFAA CC(=O)N1CCC(C2CCN(c3nc(N(C)C)nc4c3CCCC4)CC2)CC1 1857735785 TUWAESVYMRNOAB-UHFFFAOYSA-N 385.556 2.896 0 50 GFAA CN1CC[C@](C)(C(=O)N2CCC(C3CCN(Cc4cccnc4)CC3)CC2)C1 1857739531 MQLIMPOMTAKEQH-QHCPKHFHSA-N 384.568 2.874 0 50 GFAA CCOC(=O)CC[C@H](C)Sc1nc2cc(S(N)(=O)=O)ccc2n1CC 225794309 IFXLIMBGTUUBKE-NSHDSACASA-N 385.511 2.528 0 50 GFAA O=C(NCC1CCN(CCO)CC1)N[C@H]1CCCc2cc(OC(F)F)ccc21 111845487 RFNLCKFLGNEGDQ-SFHVURJKSA-N 397.466 2.669 0 50 GFAA CC(C)n1cc(C(=O)NCc2ccsc2)c(=O)c(C(=O)NC(C)(C)C)c1 14995469 DGWDBVJLQIIONE-UHFFFAOYSA-N 375.494 2.949 0 50 GFAA O=C(Nc1cn(-c2ccccc2C(F)(F)F)nn1)N1CCC[C@](F)(CO)C1 1875270250 AGMQULOJGFRYMS-OAHLLOKOSA-N 387.337 2.614 0 50 GFAA O=C(NS(=O)(=O)c1ccc(F)cn1)c1cnc(Cc2ccccc2F)s1 1875328059 WJXYTYHFYJBVGV-UHFFFAOYSA-N 395.412 2.526 0 50 GFAA C[C@H](c1ccc(F)cc1)N1C[C@@H](C(=O)N[C@@H]2CCc3cc(CN)ccc32)CC1=O 1875301156 BQEIAZPFELDXED-YMTYPPQLSA-N 395.478 2.998 0 50 GFAA O=C(Cc1cccc2ccccc12)N1C[C@H]2CN(C(=O)c3ccon3)C[C@H]2C1 1875387747 VRPOSHDLRWUOCD-HDICACEKSA-N 375.428 2.601 0 50 GFAA Cn1cc(CNC(=O)N2CC[C@H](C3CC3)[C@H]2c2nc(O)n[nH]2)c2ccccc21 1875402222 CIRKKDUYYSQKRY-WBVHZDCISA-N 380.452 2.685 0 50 GFAA Cc1cc(C(F)(F)F)c2c(=O)n(CC(=O)NCc3ccccc3C)n(C)c2n1 888091099 NXMBOJRPGUOHBE-UHFFFAOYSA-N 392.381 2.687 0 50 GFAA O=C(NS(=O)(=O)c1cc(Br)cs1)[C@H]1CCOC2(CCC2)C1 893013314 KKIRNLLPUSNYOX-VIFPVBQESA-N 394.312 2.665 0 50 GFAA Cn1c(=O)c2cn3c(c2n(C)c1=O)[C@@H](c1ccccc1)CC(c1ccccc1)=N3 8375801 ZLWUCLYSRCRWMO-QGZVFWFLSA-N 384.439 2.827 0 50 GFAA Cc1cccc(CC(=O)NCC2[C@H]3CN(C(=O)[C@H]4C[C@@H]4C(F)F)C[C@H]23)c1Cl 2325794805 RVDSEFVJYIWJHG-WMHQRMGPSA-N 396.865 2.913 0 50 GFAA Cc1cc(F)cc(-n2cc(C(=O)N3CC4(CCNCC4)c4ccccc43)nn2)c1 2325824231 VJCJYBDVFMWBCJ-UHFFFAOYSA-N 391.450 2.996 0 50 GFAA CCc1nnc(N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)s1 755147 VUXXMANGOKCCMP-UHFFFAOYSA-N 392.492 2.556 0 50 GFAA COCCCNC(=O)CN(c1cc(C)cc(C)c1)S(=O)(=O)c1ccccc1 2958453 ZPBHXMRUACINPN-UHFFFAOYSA-N 390.505 2.651 0 50 GFAA CCOc1ccc(N(CC(=O)Nc2cc(C)ccc2OC)S(C)(=O)=O)cc1 2979804 BNRFFYLFEGODQX-UHFFFAOYSA-N 392.477 2.807 0 50 GFAA COc1cc([C@@H]2NC(=O)c3c(sc4c3CCN(C)C4)N2)cc(OC)c1OC 4854419 OXRWNDWIIGBRPZ-QGZVFWFLSA-N 389.477 2.616 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Oc1ccccc1 6241437 CKPUJIVAHYMOGN-UHFFFAOYSA-N 397.836 2.851 0 50 GFAA C[C@](O)(CNC(=O)[C@H](C1CC1)N1CCCC1)c1ccccc1Br 225623040 YIUUSSPKVBATOI-WMZOPIPTSA-N 381.314 2.647 0 50 GFAA CCOc1ccccc1CN(CC)C(=O)[C@H]1CC(=O)N(Cc2cccnc2)C1 55342819 OVINQBOZRHGGNL-IBGZPJMESA-N 381.476 2.878 0 50 GFAA CN1Cc2ccccc2C[C@@H]1CNC(=O)CCc1nnc(-c2ccsc2)o1 20254824 CKSJPRYONOCPHC-QGZVFWFLSA-N 382.489 2.904 0 50 GFAA O=C(NC1CCCCC1)C1CCN(S(=O)(=O)Cc2ccccc2F)CC1 24612556 MCKPICGMXJOHER-UHFFFAOYSA-N 382.501 2.816 0 50 GFAA O=C(C1CCOCC1)N1CC[C@]2(CCCN(CCCc3ccccc3)C2=O)C1 12572598 LQKVCOQTKNOKGF-HSZRJFAPSA-N 384.520 2.887 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528543 UNCZCFJIIYYLAS-GOSISDBHSA-N 395.507 2.583 0 50 GFAA Cc1ccn2c(C(=O)NCc3cccnc3Oc3ccccc3F)nnc2n1 67867869 UAFGDFQDKBUDJL-UHFFFAOYSA-N 378.367 2.689 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3N=C(C(F)F)C[C@]3(O)C(F)F)o2)n1 654139 HAWNSNAZLNDWFS-INIZCTEOSA-N 388.321 2.562 0 50 GFAA CC(C)CC(=O)N1CCC(O)(CS(=O)(=O)Cc2ccc(Cl)cc2)CC1 1384518 VHMKFHSUKHJWHI-UHFFFAOYSA-N 387.929 2.654 0 50 GFAA Cc1ccc(NC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)cc1S(N)(=O)=O 252500148 SNTKVPZCJSKAKB-LBPRGKRZSA-N 379.404 2.837 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2CCC(N(C)CC(=O)O)CC2)cc1OC 328636929 OJJPBEWDAFJVSH-UHFFFAOYSA-N 398.887 2.758 0 50 GFAA COCCn1ccc(NC(=O)N2CCC(CN3CCc4ccccc43)CC2)n1 150820164 VQNIJWPUVSYFGJ-UHFFFAOYSA-N 383.496 2.836 0 50 GFAA CC(=O)N1CCN(Cc2ccc3c(c2)CN(C(=O)C2CCCCC2)CCO3)CC1 14990518 LZCDYNIURRNOHS-UHFFFAOYSA-N 399.535 2.652 0 50 GFAA CC(C)(C(=O)N1CCC[C@H](Cn2cnc3ccccc32)C1)S(=O)(=O)C1CC1 376155265 JUCXBRIZCVIBRV-HNNXBMFYSA-N 389.521 2.631 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(C(=O)c2ccc(-n3cnnn3)cc2)C1 77393436 QWNQVWWBPSQUAM-QGZVFWFLSA-N 377.448 2.902 0 50 GFAA Cc1ncn(-c2cc(NCCNC(=O)Nc3cccc(F)c3C)ncn2)c1C 72115941 ILFMOHVSKSRKSM-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA COc1nc(C(=O)OCc2cc(=O)n3cc(C)ccc3n2)cc2ccccc12 128242207 ANXMGKVPSKMCDY-UHFFFAOYSA-N 375.384 2.917 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2ccc(Br)nc2)C1 174240004 KFRAAOBSCKAZDV-GFCCVEGCSA-N 384.274 2.973 0 50 GFAA Oc1cccc(CN2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)c1 96152741 HSOLAFWGLWCOTM-UHFFFAOYSA-N 378.480 2.943 0 50 GFAA CNC(=O)Cc1ccc(-c2ccc(C(=O)N3CCN4CCC[C@H]4C3)cc2)cc1 426684026 ZRBFLEJUXLYFQA-NRFANRHFSA-N 377.488 2.562 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@@H](c3nccn3CCN(C)C)C2)o1 95500124 WHKZNQHFUYPPNK-OAHLLOKOSA-N 376.526 2.921 0 50 GFAA Cc1cc(Cl)cc(C)c1NC(=O)N1CCCO[C@H](CN2CCOCC2)C1 96133218 MJPBVMKOIKZLMZ-QGZVFWFLSA-N 381.904 2.912 0 50 GFAA CCCCc1ncc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)[nH]1 95517149 BFCKVFMPRUDHCN-UHFFFAOYSA-N 396.539 2.761 0 50 GFAA O=C(CCc1ccncc1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 92038678 QULUBZAYYWSMPI-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N[C@H](c2ncnn2C)C(C)C)cc1Cl 95502469 FRCWDTDLQUCJJX-AWEZNQCLSA-N 378.864 2.737 0 50 GFAA O=C(NCCc1cccc(F)c1)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 247725534 DCIKJBDYHMYNOC-IYARVYRRSA-N 397.450 2.917 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(N2CCc3ccccc3C2)nc1 242864199 GHBXKPQYFOUNAK-UHFFFAOYSA-N 383.477 2.785 0 50 GFAA O=C(NCC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccc(Cl)c(Cl)c1 182114047 XFBJFWJDFBDUDV-ZDUSSCGKSA-N 382.251 2.595 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)N4CCc5ccccc54)c3CO2)cc1 263616537 JIAAYMLWVWEAOR-IBGZPJMESA-N 376.416 2.761 0 50 GFAA O=C(c1cccs1)N1CCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 278667031 QSJUTHPRXPZXJW-FQEVSTJZSA-N 399.560 2.797 0 50 GFAA Cn1cc(C(=O)NC[C@@H]2CC(Cc3ccc(F)cc3)=NO2)c(=O)c2ccccc21 299796673 PFPNTLYTIATYCB-KRWDZBQOSA-N 393.418 2.795 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCCC2)C1 298756508 NUWJMPCXEICKFI-QGZVFWFLSA-N 378.538 2.965 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)NCCc1nc2c(s1)CCC2 299778063 PIFUWKBBSMKAJI-UHFFFAOYSA-N 378.881 2.958 0 50 GFAA CCc1ccc2nc(C)cc(C(=O)N3CC[C@H]4OCc5cnnn5[C@H]4C3)c2c1 299800426 WOCLGWALUHLJRB-VQTJNVASSA-N 377.448 2.683 0 50 GFAA COCCN(Cc1cnn(C)c1)C(=O)[C@H]1C[C@@H](c2ccccc2)N2CCC[C@H]12 299798922 RYTMNTVRVVLROG-HBMCJLEFSA-N 382.508 2.621 0 50 GFAA CC1=C(c2ccccc2)[C@@H]1C(=O)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 827688902 SKSYKKZLCAHWPV-LTWUZEEKSA-N 375.476 2.941 0 50 GFAA Cc1noc(C)c1C(=O)NCC1CCN(C(=O)[C@H]2CCc3ccccc32)CC1 952983602 VWQXQXZBBFQCMS-IBGZPJMESA-N 381.476 2.990 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)c2ccccc2N2CCOCC2)CC1 952990919 XYVKEFRBHXZMCU-UHFFFAOYSA-N 380.492 2.579 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@@H]1C2)N1CCN(c2nnc(C(F)(F)F)s2)CC1 1565525604 HPXPNHAPBLKUME-AXFHLTTASA-N 375.420 2.577 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)C[C@H]3OCCc4ccccc43)CC2)n1 186487876 LIGOSQHHEXBAFY-HXUWFJFHSA-N 380.492 2.953 0 50 GFAA COc1ccc(-n2nnc(C(=O)N3CCOC[C@H]3c3nc(C)cs3)c2C)cc1 188624914 IBWCYZAGJXWVEV-INIZCTEOSA-N 399.476 2.563 0 50 GFAA Cc1noc(CN2CCN(CC3=Cc4cc(Cl)ccc4OC3)CCC2=O)n1 1529161367 GIWUGRITOICLPX-UHFFFAOYSA-N 388.855 2.542 0 50 GFAA O=C1CCCN1CCC(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1 12112261 WCUPFYRSUUOBDA-JOCHJYFZSA-N 387.499 2.653 0 50 GFAA c1ccc(-c2ncc(CNc3nc4nonc4nc3N3CCOCC3)s2)cc1 12576294 JFJIODOHNYWANT-UHFFFAOYSA-N 395.448 2.585 0 50 GFAA Cc1nn(C)cc1CN1CC(=O)N(C(C)C)C[C@@H](OCc2ccc(F)cc2)C1 14535833 GYINFKPHZVESFS-FQEVSTJZSA-N 388.487 2.506 0 50 GFAA CC[C@H](C)N1CCC2(CC1)C(=O)N(CCc1ccccc1)C(=O)N2CCOC 14745632 NSBQDZHGMNDMDF-SFHVURJKSA-N 387.524 2.773 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 169616047 AGBRNNFXUULIMS-VBQJREDUSA-N 382.313 2.930 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(N(C)C)cc4)C3)nn2)n1 169778168 FQXOXNHIBQBEAO-MRXNPFEDSA-N 395.467 2.605 0 50 GFAA Cc1nccc(N2CCC3(CC2)OCCc2sc(C(=O)NC4CC4)cc23)n1 1857682597 WYZWPHUHHOYGIS-UHFFFAOYSA-N 384.505 2.807 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)c3cccc(OC(F)(F)F)c3)C[C@]23CC[C@H]1O3 1857717916 FRFCFLPNWSOVMC-BVIKNXMNSA-N 384.398 2.766 0 50 GFAA Cc1cccc(-c2noc(CCC(=O)N[C@H]3C[C@H]4CO[C@H](C(C)C)CN4C3)n2)c1 1857721384 MHFMZYUJKOPHBR-FHWLQOOXSA-N 398.507 2.592 0 50 GFAA COc1cccc(OCC(=O)N2C[C@H](c3ccc(C)cc3)[C@@H](NC(C)=O)C2)c1 219612547 PXOUTZAXHCYWEB-RTWAWAEBSA-N 382.460 2.513 0 50 GFAA CCn1nc(C)cc1C(=O)Nc1ccnn1Cc1ccc(OC)c(OC)c1OC 624821374 GOBITVNQVYVQKF-UHFFFAOYSA-N 399.451 2.734 0 50 GFAA C[C@H]1CN(c2c(F)c(F)c3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)C[C@H](C)N1 6625891 QIPQASLPWJVQMH-IUCAKERBSA-N 395.381 2.639 0 50 GFAA biogenic,in-vitro O=C(O)CCN(C(=O)Cc1ccc(F)c(Br)c1)C1CCOCC1 238065634 LLSLNWPNFTUSDC-UHFFFAOYSA-N 388.233 2.613 0 50 GFAA O=C(c1ccnc(-c2ccc(Cl)cc2)n1)N1CCN(c2cnccn2)CC1 376640853 PJUMYRRMQSWMDZ-UHFFFAOYSA-N 380.839 2.549 0 50 GFAA Cc1cc(C)nc(-n2[nH]c(C(=O)N(Cc3ccc(F)cc3)CC3CC3)cc2=O)n1 900726738 DFKZPLLELRWCIJ-UHFFFAOYSA-N 395.438 2.764 0 50 GFAA C[C@H](NC(=O)c1cn(C)nc1-c1cnn(C)c1)c1ccc(C(F)(F)F)nc1 874645236 YODIPQLXYPDDRI-JTQLQIEISA-N 378.358 2.725 0 50 GFAA COc1cc(-c2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)ccc1O 952894473 NJGCUEICJVAUMO-CYBMUJFWSA-N 397.435 2.666 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H]2C(=O)N2CCOCC2)oc2c(Cl)cccc12 1875307579 RGXDBMYOMGZIAE-OAHLLOKOSA-N 376.840 2.858 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)Cc1ccc3c(c1)CCCC3)CCO2 1875396018 SPTXPAITLFOMHM-UHFFFAOYSA-N 390.549 2.597 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1cccc(-n2ccnc2)c1 1875401341 JKVGVWOLFJRZMQ-ZWKOTPCHSA-N 392.463 2.803 0 50 GFAA O=C(Nc1ccccc1C(F)F)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@H]3C2)C1 886093359 CWSQMMMAWLRORA-KFWWJZLASA-N 392.450 2.973 0 50 GFAA Cc1ccccc1CN1CCC(N2C(=O)N[C@@H]3CN(C(=O)C(C)C)CC[C@@H]32)CC1 888103302 CEPNZIFLNXJHTA-RTWAWAEBSA-N 398.551 2.610 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)C2Cc3ccccc3C2)CCCCN1 2100533003 UETCHDFPOVJESC-QFIPXVFZSA-N 397.563 2.775 0 50 GFAA O=C(CNC1CC1)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100556723 QRWVQVOWIRWKGA-QFIPXVFZSA-N 379.504 2.703 0 50 GFAA Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccc2c(O)nc(=O)n(C)c2n1 2325741453 XPRMJYGPCRSGCP-UHFFFAOYSA-N 387.399 2.657 0 50 GFAA CCc1nnc(=NCC(C)(C)CN(C)C(=O)c2occ3c2CCC3)[nH]c1CC 2325793506 XJTYLTMZOUYRAE-UHFFFAOYSA-N 385.512 2.710 0 50 GFAA Cc1cnn(Cc2ccccc2F)c1NC(=O)c1cc(C2CCNCC2)[nH]n1 2325795736 VVWDNRISRAODSE-UHFFFAOYSA-N 382.443 2.821 0 50 GFAA CN1CCC2(CC1)CN(C(=O)c1ccc3cnnc(O)c3c1)Cc1ccccc12 2325820846 PJRUYRPJDJHPTI-UHFFFAOYSA-N 388.471 2.955 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)CCC23CCC(CC2)C3)C[C@H](O)C1)c1cscn1 2325878123 FKEOXDBOTQIBCA-KMFGOTIKSA-N 391.537 2.585 0 50 GFAA CCCc1cc(N[C@H]2CCN(CCCc3ccccc3)C2=O)n2ncnc2n1 225456535 LIYSOOWPFSEHCU-SFHVURJKSA-N 378.480 2.722 0 50 GFAA O=C(c1cccc(Cl)c1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 1175377 CJARHNQLUPAFCY-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA CN(C[C@H]1Cc2ccccc2CN1C)C(=O)c1ccc(-c2cncc(N)n2)cc1 2356138249 JYSHCYXHADXRKQ-HXUWFJFHSA-N 387.487 2.855 0 50 GFAA CC(=O)Nc1ccc(-c2nnc(SCC(=O)NC3CCCCC3)n2C)cc1 2836240 VZMVRPDWOYBGJE-UHFFFAOYSA-N 387.509 2.982 0 50 GFAA C=CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3ccccc32)C2=C1CC(C)(C)CC2=O 2871335 YFTXDLSSAGWOJZ-QFIPXVFZSA-N 375.428 2.682 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)CC3=CSC4=NCCCN34)CC2)CC1=O 102758612 JLQCODIZKMQOMD-UHFFFAOYSA-N 390.553 2.524 0 50 GFAA CCn1cc2nc(SCC(=O)c3ccc(F)cc3F)n(CC)c(=O)c2n1 2802410 UBFCXSRULXYZQO-UHFFFAOYSA-N 378.404 2.886 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CCC[C@@H]2c2ccc(C(N)=O)s2)c1C 23398405 KYGDLEUNTIADOO-CQSZACIVSA-N 388.493 2.617 0 50 GFAA CCn1cc(CN2CCN(Cc3ccc(OC)c(C)c3C)[C@@H](CCO)C2)cn1 20912369 HQOKAUCQZBOJAF-NRFANRHFSA-N 386.540 2.597 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)[C@@H](c1ccc(N(C)C)cc1)CC(=O)N2 65404665 VSINZPVERZPTHC-CQSZACIVSA-N 389.477 2.607 0 50 GFAA CCn1cc2nc(SCC(=O)Nc3cccc(C)c3C)n(CC)c(=O)c2n1 2802827 WZDYVQUMZWXHJL-UHFFFAOYSA-N 385.493 2.980 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@H]1CCCN(Cc2csc([C@H]3CCCO3)n2)C1 328606724 SPDDQZIVOIEYTQ-XJKSGUPXSA-N 389.525 2.799 0 50 GFAA CN1CC2(CCN(C(=O)CO[C@@H](c3ccccc3)C(F)(F)F)CC2)CC1=O 72410731 CJIYUGVUJFKBBY-KRWDZBQOSA-N 384.398 2.778 0 50 GFAA CC(C)(C)NC(=O)C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72161499 BOJNGFRSSLNOCV-FQEVSTJZSA-N 379.504 2.959 0 50 GFAA CN1CCCN(C(=O)[C@H]2CCS(=O)(=O)c3ccccc32)c2ccc(F)cc21 367405890 SNZLDESXBSYBSW-INIZCTEOSA-N 388.464 2.960 0 50 GFAA CN(C)C(=O)[C@H]1CCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl 172998333 SGJMIERQDUYUBM-GFCCVEGCSA-N 392.809 2.635 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1 237734201 MMTHMLLIMQQASP-UXHICEINSA-N 394.471 2.546 0 50 GFAA CN1CCC[C@@H](CNC(=O)N2CCc3ccnc(O)c3C2)[C@H]1c1cccs1 372813424 FWGMMABANZRRTQ-YJBOKZPZSA-N 386.521 3.000 0 50 GFAA Cc1ccc2nc(Cn3nc([C@H]4CCCNC4)n(-c4ccccc4)c3=O)cn2c1 71765569 DQQSBADTOHSUOK-KRWDZBQOSA-N 388.475 2.505 0 50 GFAA COc1cccc([C@@H](O)CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c1 378146495 WSFSQMIYQDUDOA-PMACEKPBSA-N 382.460 2.540 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Nc3ccc(Cl)nc3)C2)CCC1=O 82096319 CWEZCTQNQDOOBE-SFHVURJKSA-N 380.876 2.618 0 50 GFAA O=C(O)COc1ccccc1CN1CCC2(CC1)Nc1ccccc1NC2=O 82091237 SBNKCJZBRREEJH-UHFFFAOYSA-N 381.432 2.549 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCCC[C@@H]3CO)csc2C1 426399361 GFOOJKDYCUBJMN-OAHLLOKOSA-N 389.521 2.898 0 50 GFAA COc1ccc(F)cc1CN1CCC[C@@H](c2nnc(Cn3ccnc3)n2C)C1 95363579 RAYSUUGNZKUFOA-OAHLLOKOSA-N 384.459 2.587 0 50 GFAA OC[C@H]1CN(c2nc3c(c(C(F)(F)F)n2)CCCC3)C[C@H]1CN1CCCCC1 92046560 ZJKWBWKMCCEKLN-HUUCEWRRSA-N 398.473 2.905 0 50 GFAA Cc1cnn(CCC(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)c1 95509944 JAQYUBMRFQROGN-MRXNPFEDSA-N 384.509 2.689 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@H]2CCCN(c3ccccn3)C2)s1 96153176 TZWZIUIDLFDASV-AWEZNQCLSA-N 377.539 2.757 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@@H]1CCCN(Cc2cc3ccccc3[nH]2)C1 426500299 OUZWUHKCEMBUNE-GOSISDBHSA-N 394.523 2.508 0 50 GFAA Nc1nccc(N2CCC(Oc3ccc(C(=O)N4CCCCC4)cc3)CC2)n1 95509069 RNTIVCMJSLBCQA-UHFFFAOYSA-N 381.480 2.733 0 50 GFAA Cc1ccccc1[C@@]1(O)CCN(C(=O)c2cnc(-c3cccs3)nc2O)C1 91643584 YNDDCTYWMJPXAQ-HXUWFJFHSA-N 381.457 2.953 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)C(=O)c2cccn2C)C1 95496787 PAZUQJBQCKNWMI-SFHVURJKSA-N 397.519 2.630 0 50 GFAA Cc1nn(C)cc1C(=O)N1CCC2(CC1)CC(=O)N(CCCc1ccccc1)C2 95365716 VOSUKDUSVWSAQT-UHFFFAOYSA-N 394.519 2.816 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCO[C@H](c2cccnc2)C1 297077153 OTKIIHFVMWTVSP-HKBOAZHASA-N 380.492 2.875 0 50 GFAA CC[C@H](NS(=O)(=O)c1ccc(NC(C)=O)c2ccccc12)[C@H]1C[C@H](O)C1 252519051 AVDSAIAWNYFOBQ-ZQIUZPCESA-N 376.478 2.626 0 50 GFAA COc1ccc([C@H](O)Cn2ccn3nc(-c4cccs4)cc3c2=O)cc1OC 263615147 AURAWSSYNCTLPB-MRXNPFEDSA-N 397.456 2.975 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3ccnc4ccccc34)cn12 1940198450 VIIAFKXHSBKYNN-LJQANCHMSA-N 375.432 2.897 0 50 GFAA C[C@H](NC(=O)c1coc(CN2CCOCC2)c1)c1ccccc1-n1cccn1 828207336 CQHNAQRJTPARHJ-INIZCTEOSA-N 380.448 2.789 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)N(C)C[C@H]2CCN(c3ccccc3)C2)cc1 952966908 XVQBZCOTOVDLBV-LJQANCHMSA-N 390.491 2.628 0 50 GFAA O=C(N[C@H]1COCC[C@@H]1Oc1ccc(CO)cc1)c1ccnc2ccccc12 1565514000 HSWRESFOSNGPNO-SFTDATJTSA-N 378.428 2.693 0 50 GFAA CC1(O)CN(C(=O)c2nn(-c3ccc(Br)cc3)c3c2CCCC3)C1 407983843 FVNHUSHXPXFYOE-UHFFFAOYSA-N 390.281 2.720 0 50 GFAA COc1ccc2cc(NC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)ccc2n1 170620600 DJWCGRJYRXZVDS-IYBDPMFKSA-N 381.432 2.747 0 50 GFAA CCCS(=O)(=O)NC1CCN(Cc2cc3c(cc2OCC)C[C@H](C)O3)CC1 192870953 DHZVYZDTDZKEHF-HNNXBMFYSA-N 396.553 2.703 0 50 GFAA CCOC(=O)N1CC[C@@H](N2CCCN(C(=O)c3ccc(Cl)cc3F)CC2)C1 1772805375 MLOXZXARZAJYAU-OAHLLOKOSA-N 397.878 2.858 0 50 GFAA CCOC(=O)N1CCN(c2ncc3c(n2)C[C@@H](c2ccccc2F)CC3=O)CC1 5274276 CDARTEVXBKYJBZ-CQSZACIVSA-N 398.438 2.807 0 50 GFAA O=C(CCc1nnc(CCc2ccccc2)o1)NC[C@H]1COc2ccccc2O1 12228450 WBSCMPFBHUFIKN-KRWDZBQOSA-N 393.443 2.744 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CNC[C@@H]1CCCO1 12306548 MNKFHWVEKYXYAZ-KRWDZBQOSA-N 398.532 2.979 0 50 GFAA COC(=O)c1ccc(CNCC[C@@H]2CCC(=O)N2CCCOC(C)C)cc1 15068227 PBRXNZQNEDPHSN-IBGZPJMESA-N 376.497 2.759 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCN(c2ccc(F)cc2)CC1 16623150 MKWOESUAUCAAMB-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)c2ccccc2[C@@H](N(C)C)[C@@H]3O)cc1 200594955 FHIPOPAIQATPLC-RTWAWAEBSA-N 380.488 2.846 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccc(Br)cc1)c1nc(-c2nnc[nH]2)no1 154666349 ORDQJJJIKCUMGB-LLVKDONJSA-N 391.229 2.744 0 50 GFAA O=C(c1cc(-c2ccccc2O)[nH]n1)N1CC[C@](O)(Cc2ccc(F)cc2)C1 1857527615 WCXGBOSREZEJPV-NRFANRHFSA-N 381.407 2.741 0 50 GFAA O=C(c1ccc(COc2ccccc2)cc1)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857669846 MUWOTAAZEFJIAV-PGRDOPGGSA-N 381.428 2.829 0 50 GFAA Cc1csc(CN2CC[C@@H](O)[C@]3(CCCN(C(=O)C4CCCC4)C3)C2)n1 1857687895 KUPFUGRIPNGGAJ-YLJYHZDGSA-N 377.554 2.817 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875246751 AHDDDQVVSCOVRG-ROUUACIJSA-N 398.850 2.700 0 50 GFAA O=C(c1cc(N2CCCC2=O)ccc1Cl)N1CCC(N2CCCC2=O)CC1 126541931 OZHCUTXNEYVTDC-UHFFFAOYSA-N 389.883 2.694 0 50 GFAA Cc1nc(C)n(-c2ccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)O)cc2)n1 237955522 HBCBVZGACBVHEQ-IBGZPJMESA-N 376.416 2.536 0 50 GFAA O=C(NC1CCCC1)c1cn([C@H]2CCCN(Cc3ccc4c(c3)OCO4)C2)nn1 12028630 FTGZCLONHRAGAY-KRWDZBQOSA-N 397.479 2.516 0 50 GFAA CC1CCN(C2CCC(NC(=O)N3CCC[C@@H]3[C@H]3COCC[C@H]3O)CC2)CC1 369174045 LHQPOGZRMONDKX-DPVAKWRKSA-N 393.572 2.601 0 50 GFAA COC(=O)CCCC(=O)N[C@H](c1ccc(Br)cc1)c1nccn1C 864097237 NNOJJVCXEKPIJE-MRXNPFEDSA-N 394.269 2.732 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@@H]2c2nccn2-c2ccc(F)cc2)cccc1=O 952890582 FBXOUZLVZZOKEX-SFHVURJKSA-N 380.423 2.933 0 50 GFAA O=C(c1ccc2c(O)ncnc2c1)N1CC[C@](O)(Cc2ccc(Cl)cc2)C1 1875297306 KNCKKFLWLWWRLF-FQEVSTJZSA-N 383.835 2.809 0 50 GFAA Cc1sc2nc(-c3cccnc3)nc(N3CCC(OCC(N)=O)CC3)c2c1C 1875255530 DUROAOUJUHVGKA-UHFFFAOYSA-N 397.504 2.841 0 50 GFAA O=C(CNC(=O)c1cscn1)Nc1ccc(-n2cnc3ccccc32)cc1 1875264948 BWQHUTSQNYTJCI-UHFFFAOYSA-N 377.429 2.851 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)c2nc3ccccc3s2)CC[C@@H]1C(F)(F)F 1875385856 DDLLJEFXLLORAX-JQWIXIFHSA-N 383.395 2.992 0 50 GFAA CCOc1cccc([C@@H](C)N[C@@H]2CCN(c3nc(C(N)=O)nc(C)c3C)C2)c1 1875397852 QMHPZJLQGQTQIH-NVXWUHKLSA-N 383.496 2.521 0 50 GFAA CNc1nc(C)ccc1C(=O)N1CC[C@@H](C2CC2)[C@H]1c1nnc(O)n1C(C)C 1875401951 XDHBXYFFGIVOFH-HOCLYGCPSA-N 384.484 2.923 0 50 GFAA C[C@@]12CC[C@@](CNC(=O)NCc3cc4c(cc3OC(F)F)OCO4)(CO1)C2 2325776175 ZTWZFMWQZSDOMA-ZWKOTPCHSA-N 384.379 2.775 0 50 GFAA CC[C@@H](C(=O)NCc1cccnc1)n1nc(C)n2c(cc3sccc32)c1=O 4911965 XOVPNCWVQIPPDQ-AWEZNQCLSA-N 381.461 2.682 0 50 GFAA CCCCNC(=O)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 6698941 WZQHXVVPUBARNK-UHFFFAOYSA-N 394.324 2.809 0 50 GFAA Cc1cc(S(=O)(=O)Nc2cccc(-n3cnc(N(C)C)n3)c2)ccc1F 225425910 MLOUEWDRWJZBBC-UHFFFAOYSA-N 375.429 2.582 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)nc1 225553415 ANBZRZINZXSZMQ-UHFFFAOYSA-N 387.383 2.532 0 50 GFAA c1cc2c(cc1-c1n[nH]cc1CN1CCCC[C@H]1CCN1CCOCC1)OCO2 20997243 COSVCNGTYPYPIP-IBGZPJMESA-N 398.507 2.882 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cnn(CC(F)(F)F)c1 118347319 CRHMCRJYLOLKFN-INIZCTEOSA-N 393.369 2.613 0 50 GFAA O=C(/C=C/c1cc(Cl)c2c(c1)OCCO2)N1CCOC2(CCOCC2)CC1 364263508 ZBHXKIPMZLWMIH-OWOJBTEDSA-N 393.867 2.923 0 50 GFAA COc1ccc2nc(CNC(=O)c3cc(COc4ccccc4F)[nH]n3)[nH]c2c1 11664577 KYIFEYZGNNXWCY-UHFFFAOYSA-N 395.394 2.943 0 50 GFAA O=C(c1c(F)cccc1Cl)N1CCc2c(nc(-c3cccnc3)[nH]c2=O)C1 71682191 UQDJLJNDPOPYQA-UHFFFAOYSA-N 384.798 2.823 0 50 GFAA CCn1cc(NC(=O)[C@H](C)n2ncc(Cl)c2C)c(C(=O)NCC(C)C)n1 2800040 XTFUZXGOTAEFEW-LBPRGKRZSA-N 380.880 2.647 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCn2cccn2)(Cc2ccccc2)c2ccccc21 71589516 RBWUPRPKQMDBAQ-QHCPKHFHSA-N 388.471 2.547 0 50 GFAA O=C1CN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)CN1CC(F)(F)F 489114719 WLVSVTLQMXBCOC-UHFFFAOYSA-N 388.349 2.830 0 50 GFAA CCC(=O)N1CCCC[C@@H]1C(=O)N1CC[C@](O)(Cc2cccc(Cl)c2)C1 331587974 XVMXFORROGRUAJ-XLIONFOSSA-N 378.900 2.637 0 50 GFAA CCN1CCN(S(=O)(=O)c2ccc(Oc3ccccc3OC)cc2)CC1 36086417 TUOHPINRADNWIR-UHFFFAOYSA-N 376.478 2.814 0 50 GFAA COc1nc2c(cc1CNC(=O)c1ccccc1O)C(=O)N(C1CCCC1)C2 71757083 NCNJQVWRDFZZFJ-UHFFFAOYSA-N 381.432 2.624 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)NCCc1c[nH]c2ccc(Cl)cc12 71281090 QXZKJNNQANKAGS-UHFFFAOYSA-N 380.835 2.890 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2C[C@@H](C)OC[C@@H]2c2ccccc2)c1 174005248 KPWQVMJOTSWKSS-OXQOHEQNSA-N 381.476 2.837 0 50 GFAA COc1ccc(F)cc1-c1nn(CC(=O)Nc2cnn(C)n2)c2ccccc12 48187984 CVHZDYBNXRTGQG-UHFFFAOYSA-N 380.383 2.618 0 50 GFAA NC(=O)[C@@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(F)cc1 132257043 RMSXKAKOOSFTOX-KRWDZBQOSA-N 387.411 2.969 0 50 GFAA Cc1cccc([C@H](C(=O)NCCc2csc(-c3ncccn3)n2)N(C)C)c1 95355031 JNCJVZIOTCPXMR-QGZVFWFLSA-N 381.505 2.870 0 50 GFAA Fc1cccc(Cc2noc(CN3CCN(CCOc4ccccc4)CC3)n2)c1 95528250 AAZHACHZVJEHLO-UHFFFAOYSA-N 396.466 2.996 0 50 GFAA COc1nn(C)c(C)c1NC(=O)N1CCC(N2CCc3ccccc3C2)CC1 96153174 SNNBXSRKSFUPMW-UHFFFAOYSA-N 383.496 2.792 0 50 GFAA COCCN(Cc1nc(C)no1)C[C@H]1CCCN(C2Cc3ccccc3C2)C1 95516755 HOWDJGRIUPSELM-GOSISDBHSA-N 384.524 2.706 0 50 GFAA Cc1cc(N2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)nc2cc(F)ccc12 91350681 VJZBYGAMEOFXLM-UTKZUKDTSA-N 387.499 2.982 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)N(C)Cc2ncc(Cl)n2C)C1 181495051 XNSZORJRUIDARR-ZDUSSCGKSA-N 377.876 2.502 0 50 GFAA CO[C@H]1Cc2ccccc2N(C(=O)Nc2ccc(C)c(N3C(=O)CNC3=O)c2)C1 297473373 JBMURYHRCLCHMO-INIZCTEOSA-N 394.431 2.661 0 50 GFAA Cc1ncsc1CCN(C)C(=O)NCc1nc(Cc2cccs2)no1 584886881 PYOQJMZLYCKEDX-UHFFFAOYSA-N 377.495 2.871 0 50 GFAA CC(C)Oc1cccc(CCNC(=O)N2CCC3(CC2)CN(C)C(=O)O3)c1 584888677 MKOZCNNQRIYPHM-UHFFFAOYSA-N 375.469 2.643 0 50 GFAA Cc1ccc2nc(SCCC(=O)N[C@@H]3CCS(=O)(=O)C3)cc(C)c2c1 670470285 RHSQCEQJZRMQCF-CQSZACIVSA-N 378.519 2.637 0 50 GFAA C[C@H]1CCc2[nH]nc(C(=O)NC3CCN(C(=O)c4ccccc4F)CC3)c2C1 1333085334 JEHLGDYGAYDQHE-ZDUSSCGKSA-N 384.455 2.708 0 50 GFAA CC(=O)Nc1cccc(CN2CCC[C@@H](c3[nH]ncc3CN3CCOCC3)C2)c1 275930205 KQDBUMDMSQOXEN-LJQANCHMSA-N 397.523 2.580 0 50 GFAA CCN(C(=O)c1ccc(CNC(N)=O)cc1)[C@H]1CCN(Cc2ccccc2)C1 186342355 LSZKEISTHGEYJB-FQEVSTJZSA-N 380.492 2.592 0 50 GFAA Cc1ccc(OCCN(C)c2nccc(N3CCC[C@@H](O)C3)n2)c(Cl)c1 1529174772 XWNBDZUEXXBSSG-OAHLLOKOSA-N 376.888 2.915 0 50 GFAA Cc1cc(Cl)c(Cl)cc1S(=O)(=O)N1CCC(CO)(CN(C)C)CC1 1772705063 VNOUWGAMGIGLRC-UHFFFAOYSA-N 395.352 2.627 0 50 GFAA CSCCNC(=O)c1cn(CC(C)C)cc(C(=O)N2CCCCCC2)c1=O 11881199 YRHQQOCWODOTJK-UHFFFAOYSA-N 393.553 2.613 0 50 GFAA CN1c2cc(C(=O)Nc3ccc4c(c3)OCCO4)ccc2C(=O)N2CCC[C@@H]21 169765941 OKHZYISOCSRJSD-LJQANCHMSA-N 379.416 2.722 0 50 GFAA CNC(=O)c1cccnc1N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857700501 VNUMLINPHRFHFO-JOCHJYFZSA-N 395.507 2.719 0 50 GFAA O=C(c1ccc[nH]1)N1CCOC[C@H](CN2CCC3(CC2)CNc2ccccc23)C1 1857710908 ALKMVVWLBYDADU-GOSISDBHSA-N 394.519 2.563 0 50 GFAA Cc1cc(C)n(CCCN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)n1 1857718591 MAGQBVDVLMUEBF-VWPQPMDRSA-N 380.492 2.664 0 50 GFAA Cc1occc1C(=O)NC[C@H]1[C@H]2CN(CCSC(C)C)C[C@]23CC[C@H]1O3 1857727476 TVLBPUMKFDDBHY-JRBPQWBISA-N 378.538 2.939 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N(Cc1cocn1)Cc1cocn1 1857728076 MMXVIUPWSAEPGC-UHFFFAOYSA-N 396.432 2.981 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)c2cnc(-c3cccnc3)nc2)C[C@@H]1O 212786487 QCAUQWOTYPBIQH-IRXDYDNUSA-N 380.473 2.899 0 50 GFAA O=S(=O)(NC[C@@H]1CCCNC1)c1c(Cl)cc(F)cc1Br 237706624 PJWJSIZKLICXAF-MRVPVSSYSA-N 385.686 2.520 0 50 GFAA O=C(CC1(C(=O)O)CCC1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 262490608 JGQJEMFGKJZMCL-UHFFFAOYSA-N 399.274 2.923 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1CCc2cccc(C(=O)O)c2C1 844157674 KEDFNLJLTISHRJ-OAQYLSRUSA-N 392.455 2.806 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=O)N[C@H]2C[C@@H](C)c3ccccc32)C1 1875255022 JFDPGHJAVZLCOZ-KNCCTNLNSA-N 392.463 2.844 0 50 GFAA COc1cc(OC)cc([C@]2(F)CCN(C(=O)[C@@H]3CCc4n[nH]c(C)c4C3)C2)c1 1875293718 AFGPFZNMLIXDII-SZNDQCEHSA-N 387.455 2.938 0 50 GFAA O=C(NC12COC(CO)(C1)C2)c1cc(-c2ccccc2)nn1-c1ccccc1 1875313472 RNUVOFVRFHHCTN-UHFFFAOYSA-N 375.428 2.563 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2Cc3ccccc3[C@H](C(=O)OC)C2)cc1 1875372154 XYUDWTSSNZZWQY-LJQANCHMSA-N 378.428 2.748 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)Cc1cc(-c2ccccc2)on1 1875400910 CFCLRBXAYOPQCP-QFBILLFUSA-N 393.447 2.718 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C(=O)[C@@H](N)c3ccccc3C(F)(F)F)C2)no1 884125947 MUDANGYMNYNILQ-LRDDRELGSA-N 382.386 2.878 0 50 GFAA CN1CCN(C(=O)NCCc2cn(C)c3ncccc23)[C@H](Cc2ccccc2)C1 1479144638 HZDRKRXTDZITJP-HXUWFJFHSA-N 391.519 2.684 0 50 GFAA COc1ccc(Cc2nnc(SCC(=O)Nc3ncc(C)s3)n2C)cc1 1142519 ZKKPJPOCFSHEDB-UHFFFAOYSA-N 389.506 2.910 0 50 GFAA O=C(N[C@H](CCCCNC(=S)NCc1ccccc1)C(=O)O)c1ccccc1 4724927 VHWLHWFSDVVBGZ-GOSISDBHSA-N 399.516 2.704 0 50 GFAA CCOC(=O)[C@@H](C(=O)CCCCSc1nc(N)nc2[nH]cnc12)C(C)C 6564663 LGCMPOVOCBYOQF-GFCCVEGCSA-N 379.486 2.602 0 50 GFAA COC(=O)c1ccc(N2CCOCC2)c(NC(=O)COc2ccccc2C)c1 7389682 WIVVPBAIAJUUSP-UHFFFAOYSA-N 384.432 2.636 0 50 GFAA Cc1ccc(C2(C(=O)NCc3cccnc3N3CCOCC3)CCOCC2)cc1 110198610 YTSYPNYGQRTMHF-UHFFFAOYSA-N 395.503 2.591 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)NCc3ccc4cc[nH]c4n3)C2)Oc2ccccc21 413590661 UIPHJKZJRZBKPX-OAQYLSRUSA-N 376.416 2.882 0 50 GFAA C[C@@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1Cc1ccc2c(c1)oc(=O)n2C 225422581 NNDCAHOMLCUQCB-ZIAGYGMSSA-N 375.469 2.961 0 50 GFAA Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(C(=O)CCC(=O)O)c1 469083995 UMBXTTAPGBUTHF-UHFFFAOYSA-N 391.401 2.542 0 50 GFAA O=C(O)Cc1cc(C2CCN(C(=O)c3c[nH]nc3C3CCCCC3)CC2)n[nH]1 67973677 OJSSPGWMWFOPJP-UHFFFAOYSA-N 385.468 2.827 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)[C@]2(C)CCCO2)CCO3)n1 67675764 ZJCPKHTVCDUFBA-NRFANRHFSA-N 383.448 2.756 0 50 GFAA O=C(Cn1cc(-c2ncccc2F)cn1)Nc1ccn(Cc2ccccc2)n1 63870444 XPIDMCDSUWNWLR-UHFFFAOYSA-N 376.395 2.968 0 50 GFAA O=C(c1cc2c([nH]c1=O)CCCC2)N1CCCN(Cc2ccc(F)cc2)CC1 68258795 XIOUOKNAERKHGZ-UHFFFAOYSA-N 383.467 2.741 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)[C@@H]1c1ccccc1 171851959 YRNCZPMYJUSSIA-UNMCSNQZSA-N 393.487 2.651 0 50 GFAA O=C(Cc1cnc2ccccc2c1)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O 252498491 RDEATQRGKXDQNG-FQEVSTJZSA-N 377.419 2.834 0 50 GFAA COc1ccc(CN2CCN(CC=C(C)C)[C@@H]3CS(=O)(=O)C[C@@H]32)c(C)c1C 72432370 YWXAJRDOOHCUTA-UXHICEINSA-N 392.565 2.561 0 50 GFAA C[C@@H](N[C@H]1CCOC2(CCOCC2)C1)c1cccc(N2CCCS2(=O)=O)c1 329195246 VGWKXFSRUQPTNY-AEFFLSMTSA-N 394.537 2.605 0 50 GFAA O=C(c1cccc(Cl)c1Cl)N1CCc2c(ncnc2N2CCOCC2)C1 77427321 XVGWBMBMMNWAOO-UHFFFAOYSA-N 393.274 2.819 0 50 GFAA O=C1NCCc2ccc(S(=O)(=O)Nc3ccc4[nH]c(C5CCC5)nc4c3)cc21 150790549 UGTUZHJYSUDDIG-UHFFFAOYSA-N 396.472 2.917 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3cnc(SC)nc3)CC2)OC1=O 77541367 CCSGYPHRJDYWLR-ZDUSSCGKSA-N 378.498 2.814 0 50 GFAA CCOc1c(CN(C)C(=O)c2ccc(-c3nnn(C)n3)cc2)cccc1OC 215058928 MPZXPZYMOUGSIV-UHFFFAOYSA-N 381.436 2.557 0 50 GFAA CC[C@H](CO)NC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 121718287 BDUOONNBKBROTQ-OAHLLOKOSA-N 391.431 2.635 0 50 GFAA C[C@@](CO)(CNC(=O)c1ccc(OCC(F)(F)F)nc1)Cc1ccccc1 241634568 PNMTZMMINFMQQG-SFHVURJKSA-N 382.382 2.994 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCC(CO)(C[C@H]2CCCCO2)CC1 13593520 NRUNYIORGZCADK-MRXNPFEDSA-N 376.453 2.981 0 50 GFAA CCc1cc(N2CCC(c3n[nH]c(=O)n3Cc3ccccc3)CC2)nc(C)n1 71754258 ZUWVJDAMPQHTPS-UHFFFAOYSA-N 378.480 2.665 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N1CCCN(Cc2cccs2)CC1 45424688 AKHCPZQQLIFFGJ-UHFFFAOYSA-N 383.521 2.856 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)N3CCc4ccccc4C3)n2)c1 44892451 BGRIVFJSQOIZCA-UHFFFAOYSA-N 375.428 2.504 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccc(Cl)cc2OC)C2CC(O)C2)cn1 222815924 RIZNRROAJNCORG-WFZFXDGQSA-N 376.840 2.994 0 50 GFAA O=C1CCc2cc(OCCCC(=O)N3CCO[C@H](c4ccco4)C3)ccc2N1 176741112 UTOKXILKUPWBCE-IBGZPJMESA-N 384.432 2.923 0 50 GFAA COC(=O)c1ccccc1-c1cccc(C(=O)N2CCNC(=O)[C@H]2C(C)C)c1 426593787 ODZAFAFKVXOIMW-LJQANCHMSA-N 380.444 2.737 0 50 GFAA CCOc1ccccc1CN1CCCn2nc([C@H](O)c3ccnn3C)cc2C1 221285979 VFOSRBVQOVOPBH-NRFANRHFSA-N 381.480 2.503 0 50 GFAA NC(=O)CC1CCN(C(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)CC1 290948718 MIKNPEHJWKRSPI-HXUWFJFHSA-N 386.540 2.586 0 50 GFAA NC(=O)c1c(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)sc2c1CCCCCC2 239402609 QVMVBPAPBMXUBR-UOVKNHIHSA-N 388.489 2.967 0 50 GFAA Cc1nc(CCC(=O)N2C[C@H]3CC[C@@H]2CN(CCCc2ccccc2)C3)n[nH]1 95524453 RITAUXPLSDPVTR-VQTJNVASSA-N 381.524 2.601 0 50 GFAA C[C@H]1Oc2ccc(NC(=O)NCCN3CCc4ccccc43)cc2N(C)C1=O 96152806 NCEAZAQLBKFEBD-CQSZACIVSA-N 380.448 2.615 0 50 GFAA COc1cc(CN2CCC(F)(F)CC2)ccc1OC[C@@H](O)CN1CCCC1 95506809 CPKBLKMDLRPVIZ-KRWDZBQOSA-N 384.467 2.762 0 50 GFAA Cc1nc(N(C)C)ncc1C(=O)N(CCc1ccccc1)CC1CCN(C)CC1 95500356 RLAJDUPUXUPUDT-UHFFFAOYSA-N 395.551 2.878 0 50 GFAA CO[C@H]1CCCN(C(=O)c2cnc(COc3ccc(C(C)(C)C)cc3)[nH]c2=O)C1 91494480 UHCWHPPDHJWOFW-KRWDZBQOSA-N 399.491 2.897 0 50 GFAA COc1ccc(-n2nc(C)cc2NC(=O)NCC2(Cn3cccn3)CC2)cc1 96140274 ADDZGCKUZJQWMW-UHFFFAOYSA-N 380.452 2.988 0 50 GFAA Cc1ccc(C(=O)N[C@H](c2cccnc2)C(F)(F)F)cc1N1CCNC1=O 91643452 CJPKEFZMIYFOLS-OAHLLOKOSA-N 378.354 2.953 0 50 GFAA O=C(CSc1ccccc1)N[C@H]1C[C@@H](c2cc(O)nc(N3CCCC3)n2)C1 253535507 XVOBVCYGGZIKRN-GASCZTMLSA-N 384.505 2.937 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCO[C@@H](C(=O)O)C3)c(F)c2)c(F)c1 299745923 UCHONCISJSVKOP-QGZVFWFLSA-N 377.343 2.566 0 50 GFAA CSCC[C@H](NC(=O)Cc1c(-c2ccc(Cl)cc2)n[nH]c1C)C(=O)O 253395624 AMRDJKIBUFTLAZ-AWEZNQCLSA-N 381.885 2.904 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)Cc1ccc2c(c1)CCO2 263585344 HQEGIQVTYMEHPQ-LEWJYISDSA-N 386.536 2.904 0 50 GFAA biogenic Cc1ccc(OC[C@@H](C)NC(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1 534637006 RDBRUJLPTLJJEZ-QGZVFWFLSA-N 385.464 2.913 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCCc3nc4c(s3)CCCC4)C2)no1 371378742 KZPVPKQTLRHYNE-CYBMUJFWSA-N 375.498 2.845 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)C2(c3ccccc3)CCN(C)CC2)cc1 824312922 FNYFYUOAMGQOMC-UHFFFAOYSA-N 381.476 2.874 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@@H]2CCCN(C(=O)c3cccc4c3NCCC4)C2)o1 825268467 GFISESNHZICMCA-INIZCTEOSA-N 396.491 2.932 0 50 GFAA COc1ccc2nc(CNC(=O)CCc3nc4ccccc4nc3OC)[nH]c2c1 670456400 MBOCEJILSNORRH-UHFFFAOYSA-N 391.431 2.772 0 50 GFAA COC(=O)c1cc(NC(=O)[C@@H]2CCOc3c(F)cccc32)cc(C(=O)OC)c1 1350595686 DMHCVRBUEOVARR-OAHLLOKOSA-N 387.363 2.904 0 50 GFAA C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)[C@@H]2CSCN2C(=O)C2CCCC2)C1 408260100 DCHCXDIXVODQDK-RFZNHBKKSA-N 394.581 2.866 0 50 GFAA Cc1ncc2c(n1)CCC[C@@H]2NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 742682508 SPAZQNOMOFSINP-HNNXBMFYSA-N 387.509 2.962 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)co1 190678967 FTHOGVFMEDCCDE-NSHDSACASA-N 382.404 2.581 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cn(C(c2ccccc2)c2ccccc2)nn1 11817847 HRSAGZFOFHLUSJ-SFHVURJKSA-N 396.516 2.760 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCCc3ncccc3C)CCC2=O)cc1 11820530 MRJNXDMHRQYRFG-LJQANCHMSA-N 395.503 2.539 0 50 GFAA CC[C@H](C)c1nn2c(=O)c(NC(=O)c3ccc(OC)c(OC)c3)cnc2s1 14291555 VICVMWDESMOFHR-JTQLQIEISA-N 388.449 2.934 0 50 GFAA COc1cccc(CN2C[C@@H](OCC3CC3)CN(C(=O)c3ccoc3)CC2=O)c1 14539621 IAZFTXNOVWXCHR-HXUWFJFHSA-N 398.459 2.568 0 50 GFAA CCOC(=O)c1cnn(-c2cccc(C)c2C)c1CNCc1cn(C)nc1C 15003974 JCFBUOSPZKSAEU-UHFFFAOYSA-N 381.480 2.998 0 50 GFAA COc1ccc2c(c1)O[C@H](C)CN(CCC(=O)NC1Cc3ccccc3C1)C2 15009221 BMBNUGULIPWOIA-MRXNPFEDSA-N 380.488 2.952 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2F)CCCN(S(=O)(=O)CC)C1 15073690 YFGHWBKLFIJNCO-KRWDZBQOSA-N 375.437 2.502 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)C2CCCCC2)CC12CCN(Cc1ccncc1)CC2 1857693429 WOANSCUJNGDKKL-IBGZPJMESA-N 385.508 2.787 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2C[C@@H]3OCCC(=O)N(C)[C@H]3C2)cc1 1857696084 MFULAYWYXFDKPW-SFTDATJTSA-N 378.472 2.658 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N(C)Cc1n[nH]c2c1CCCCC2 1857697654 GQGWGWLTTXLUOV-UHFFFAOYSA-N 389.525 2.552 0 50 GFAA N[C@@H]1CC[C@H](c2nc(-c3ccccn3)nn2-c2cccc3cccnc23)C[C@H]1O 1857717169 XNHBILVAXPQQNM-FRQCXROJSA-N 386.459 2.833 0 50 GFAA Cc1ccc2c(c1)N(C(=O)CCC(=O)N1CCN(c3ccccn3)CC1)CCC2 124245919 UXFFGEQYWBLWEN-UHFFFAOYSA-N 392.503 2.798 0 50 GFAA COC(=O)C1CCN(Cc2ccc3c(c2)CN(C(=O)C2(C)CC2)CCO3)CC1 11787659 QXCCJRIAEFSBKI-UHFFFAOYSA-N 386.492 2.593 0 50 GFAA COc1ccccc1[C@@H]1CCCN1S(=O)(=O)c1cnn(C2CCOCC2)c1 132972043 LSHXARMFAWPWQX-SFHVURJKSA-N 391.493 2.769 0 50 GFAA CCc1nc(C)c2c(C)c(C(=O)N[C@@H](C)CN(C)CCCN(C)C)sc2n1 1875268029 WRJMTCWMUIORDY-ZDUSSCGKSA-N 391.585 2.872 0 50 GFAA Cc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1CN1CCc2ccccc21 1875254964 PHHIWEQTGWJFEM-IBGZPJMESA-N 377.488 2.779 0 50 GFAA CSCc1n[nH]c(CNC(=O)N2CCC[C@H](c3cc(O)cc(F)c3)C2)n1 1875301753 SJSPYXPBYRBOGG-NSHDSACASA-N 379.461 2.602 0 50 GFAA C[C@H](NC(=O)N1CCS(=O)(=O)CC[C@@H]1C)c1ncc(-c2ccc(F)cc2)o1 1875300411 BWLLBWVCEYFJNV-STQMWFEESA-N 395.456 2.760 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)n[nH]c21 1875393274 CBBRSSXCNAQSSJ-CVEARBPZSA-N 397.523 2.606 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N2CCC[C@]23CCC[S@](=N)(=O)C3)n1 1875396232 ZMXDZFUHWPTZQP-PWECECGKSA-N 376.404 2.619 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@@H]1O[C@H](n2cc(F)c(N)nc2=O)CS1 40433930 AUTCQXVTOIJYOT-KKVJTYSWSA-N 399.488 2.557 0 50 GFAA in-vitro CCc1ccc(N2C(=O)NC(=O)[C@@H](Cc3ccc(OC)c(OC)c3)C2=O)cc1 1067811 CLCFTJMOSFZBJZ-MRXNPFEDSA-N 382.416 2.708 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)Nc1ccc(C(=O)N2CCOCC2)cc1 4803786 VLJQTYFWRCTGPU-UHFFFAOYSA-N 380.444 2.665 0 50 GFAA CCc1ncc2c(n1)CC[C@@H](C(=O)Nc1nnn(Cc3ccccc3F)c1C)C2 2325773513 LDJPIHQQUZIHBG-CQSZACIVSA-N 394.454 2.870 0 50 GFAA COC(=O)C1=C(C)NC(=O)C[C@@H]1c1cc(OC)c(OC)cc1Br 844432 PWHHWYFJZCZJKL-SNVBAGLBSA-N 384.226 2.517 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 1111627 VMDVNAVOFXPWEI-CQSZACIVSA-N 382.507 2.873 0 50 GFAA COc1cc(C)cc(CN2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)c1OC 2356158171 DOFXINXTAMDARC-NFBKMPQASA-N 399.487 2.893 0 50 GFAA O=C(NCc1ccccc1F)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 7960938 VCHLJOWSAHCDJW-AWEZNQCLSA-N 382.482 2.604 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)Nc1nncs1 55060480 FHWORDBLXRQSNO-AWEZNQCLSA-N 375.454 2.708 0 50 GFAA Cc1nc(C[C@H]2CCCN(CC(=O)Nc3ccc(N4CCCCC4)nc3)C2)no1 171404900 XYGZOWLCJMNNSC-QGZVFWFLSA-N 398.511 2.657 0 50 GFAA Cc1cccc(NC(=O)C[C@@H]2C(=O)N[C@@H]3CCCC[C@@H]3N2C(=O)c2ccco2)c1 9483606 YHVQUFHTUQQOGA-FGTMMUONSA-N 395.459 2.869 0 50 GFAA CCc1cccc(OC[C@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)c1 225835687 LJJFQKVVYXDNOJ-VGOFRKELSA-N 381.428 2.809 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N[C@H](CC(=O)O)C(F)(F)F)cc1C 55243293 BFVNLTCMDJXPDD-CQSZACIVSA-N 375.343 2.878 0 50 GFAA CCOc1ccc(CN2CCc3nnc([C@H](C)NC(=O)C(C)C)n3CC2)cc1 20599920 SBXPXZTVNZJMSY-INIZCTEOSA-N 385.512 2.568 0 50 GFAA O=C(N[C@H]1CCOC1)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 12386198 GFTSHFYREGBLLX-SFHVURJKSA-N 392.503 2.754 0 50 GFAA COc1cccc([C@@H]2CCN(Cc3cc4ccccc4n(C)c3=O)C[C@H]2O)c1 65420349 WRMBWEUZWDYOAF-RBBKRZOGSA-N 378.472 2.898 0 50 GFAA CC(C)(C)n1cc(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)nn1 252481722 CQXRRWCXDJFPSY-UHFFFAOYSA-N 377.439 2.706 0 50 GFAA CCc1ccccc1CN1CCC(N2CCC[C@@H](C(=O)NCCOC)C2)CC1 67855799 MICNIXVVKDMLAZ-OAQYLSRUSA-N 387.568 2.688 0 50 GFAA CN1CCCC[C@H]1C(=O)N1CCC2(CC1)CN(CCc1ccccc1)C(=O)O2 77456540 FGWGEDUBMZFSBU-IBGZPJMESA-N 385.508 2.527 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1 12299009 RETMDSQCZRYGBR-NRFANRHFSA-N 375.488 2.668 0 50 GFAA Cn1cnc2c(C(=O)N3CCCC[C@H]3c3nnc(C4CCOCC4)o3)ccnc21 329286603 GYSRBCWYYUWBES-HNNXBMFYSA-N 396.451 2.613 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCc3nc(-c4ccccn4)no3)cc2)n1 72477324 OENMPSIICPQEGP-UHFFFAOYSA-N 388.431 2.923 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)N1CCO[C@@H](C2CC2)C1 364497653 ZSHBJUWYDKNHKB-QGZVFWFLSA-N 399.447 2.548 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1)N1CCC(F)CC1 71777206 UWTWNVHYWJUGAY-IBGZPJMESA-N 388.531 2.719 0 50 GFAA C[C@H](C(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)n1c(S)nnc1-c1cccs1 239653958 BLWSQEOYKKCFLK-LYIQGSDWSA-N 378.523 2.786 0 50 GFAA CC(C)c1nc([C@@H]2CCCN2C(=O)CCn2cnc3ccccc3c2=O)no1 173080933 ZSVCLZPRJHKTKO-INIZCTEOSA-N 381.436 2.657 0 50 GFAA C[C@H](OCC(=O)N1CCc2c(ncn2CCc2ccccc2)C1)c1nccn1C 376991347 HOKAOZRGBOUIEN-KRWDZBQOSA-N 393.491 2.522 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1ccc2c(c1)OCCCO2 241588080 OZKMPPVQSRCDFR-UAGQMJEPSA-N 388.464 2.593 0 50 GFAA C[C@@H]1C[C@H](NS(=O)(=O)c2cc(Cl)c(Br)s2)CCN1C 123817884 GERDQMKLTKEWJC-HTQZYQBOSA-N 387.752 2.925 0 50 GFAA COc1ccc2c(C)cc(NC[C@H]3CCN(c4cnn(C)c(=O)c4)C3)nc2c1 77357775 LYAHJGCMZHSAHZ-OAHLLOKOSA-N 379.464 2.584 0 50 GFAA CC[C@H](O)c1cc2n(n1)CCN(C(=O)Cc1nc(-c3ccccc3)oc1C)C2 221289340 YUJUJPBPLKQMQR-IBGZPJMESA-N 380.448 2.875 0 50 GFAA Cc1ccc(-c2nc(CC(=O)N(C)CC3CCN(C[C@H](C)O)CC3)cs2)o1 176868690 ITFGQMXRCCFGHX-AWEZNQCLSA-N 391.537 2.805 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)N[C@H](C)c3ccc(C)nc3)CC2)c1 426422932 NFBTXIYYPWRIFM-MRXNPFEDSA-N 382.464 2.627 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Nc1ccc(Cl)c(Cl)c1 239415352 UFJHFFHNUULDFO-FDJUTITPSA-N 391.254 2.985 0 50 GFAA C[C@@H](NC(=O)CN1CCC(C(N)=O)CC1)C(c1ccccc1)c1ccccc1 91575366 ZVXUPSDUKFMCJO-QGZVFWFLSA-N 379.504 2.521 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)c2cncnc2C)C1 95509623 RQOFDMQLPRNJPK-GOSISDBHSA-N 382.508 2.820 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Nc1cccc(Cl)c1Cl 239425821 VHQHLRDEWOJBSN-VQKTXLSGSA-N 391.254 2.985 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(C(=O)Cn3ccccc3=O)CC2)C1 96162097 YEQPJWBULZFEMP-OAQYLSRUSA-N 393.531 2.967 0 50 GFAA O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCc2[nH]c(-c3ccccc3)nc2C1 95506114 CARPXOYCEGMWAJ-MRXNPFEDSA-N 378.476 2.753 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)c3ccc4c(c3)ncn4CCO)C2)c1 95363810 HYSOJZQEEMNULC-SFHVURJKSA-N 393.443 2.747 0 50 GFAA COc1ccc(S(=O)(=O)N(CCO)[C@H]2CCc3ccccc32)c(C)c1F 181695613 NQVHKNPCKRCXTK-INIZCTEOSA-N 379.453 2.813 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)NCc1ccccc1CN1CCCC1=O 240203820 JTSJTEFUUFZDNW-UHFFFAOYSA-N 380.444 2.787 0 50 GFAA CC[C@H]1CN(c2ccccc2)CCN1C(=O)NC1CCN(c2ncccn2)CC1 184430298 CEPDVJGXNXSAJV-IBGZPJMESA-N 394.523 2.756 0 50 GFAA O=C(NC1(CN2CCCCC2)CC1)N1CCN([C@@H]2CCc3ccccc3C2)CC1 534647209 OSVBQWKGPBEDQJ-JOCHJYFZSA-N 396.579 2.890 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)NCc3csc(-c4cnccn4)n3)oc2c1 825206907 ZSOVZFBKBXQCRW-UHFFFAOYSA-N 378.413 2.945 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)s1 952966977 GHXBBRDWJWLTOT-HNNXBMFYSA-N 393.534 2.591 0 50 GFAA CC(=O)Nc1nc(C(=O)N2C[C@H]3CCC[C@@]3(c3nc(C(C)C)no3)C2)cs1 276344440 SQVYCYHMNSCBIX-KZULUSFZSA-N 389.481 2.802 0 50 GFAA NS(=O)(=O)c1ccccc1N1CCN(Cc2cc3ccccc3s2)CC1 190324520 FMDHRPAJVVYWHJ-UHFFFAOYSA-N 387.530 2.871 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N1CCC([C@H](O)c2cccs2)CC1 1506398552 DKTKFWXOSLSIMK-FQEVSTJZSA-N 397.500 2.889 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N1CCC(O)CC1 1704311450 KFYVURNDMPHIPV-UHFFFAOYSA-N 379.844 2.650 0 50 GFAA O=C(CCc1ccccc1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(CO)C1 1772819850 VOVMVOMAPFIBDV-OFNKIYASSA-N 382.479 2.711 0 50 GFAA COc1cc(NC(=O)Cn2nc(-c3ccc(C)cc3)ccc2=O)cc(OC)c1 5396749 VHYHOCQFEGUGQL-UHFFFAOYSA-N 379.416 2.875 0 50 GFAA CCOCCCNC(=O)c1sc2ncnc(N[C@@H](CC)COC)c2c1C 11782454 JWOUIBJGKZSJOZ-ZDUSSCGKSA-N 380.514 2.993 0 50 GFAA Cc1cc(NC(=O)Cc2ccc(F)cc2)ccc1NC(=O)CN1CCOCC1 12843544 SRXXEVPEJIREMK-UHFFFAOYSA-N 385.439 2.586 0 50 GFAA COC[C@H]1CCCCN1Cc1nc(-c2ccc(OC)c(OC)c2OC)no1 14962630 LUTMKFVIUODRME-CYBMUJFWSA-N 377.441 2.763 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)Cc3n[nH]c4c3CCCC4)n2)cc1 19795136 KJEACNXNQZLUFV-UHFFFAOYSA-N 381.436 2.757 0 50 GFAA O=c1c2cc(-c3ccc(F)cc3)nn2ccn1C[C@H](O)c1ccc2c(c1)OCO2 169758086 QGEMQAQPDOSGGM-SFHVURJKSA-N 393.374 2.764 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2cc(C(F)(F)F)nc(C)n2)CC1 169776879 CAWSEQJKWQLAAN-UHFFFAOYSA-N 380.370 2.775 0 50 GFAA Cn1ccnc1[C@H](O)C1CCN(C(=O)NCc2ccnc3ccccc23)CC1 159023991 HRXKZZZOYQEXSU-LJQANCHMSA-N 379.464 2.624 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCCc3ccncc3)cc12 1857706338 GAKOZTYFAKFZJI-UHFFFAOYSA-N 385.533 2.999 0 50 GFAA CC[C@@]1(C(=O)NCCCn2cccn2)C[C@@H]2CC[C@H]1N2Cc1cccc(O)c1 1857707940 AMEOBYXMJABYQI-CZTZKLFOSA-N 382.508 2.928 0 50 GFAA O=C(Cc1ccc(F)cc1F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857730030 WRSLIZITGXDTHR-KNKQGSTJSA-N 398.409 2.808 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCO[C@@H](CO)[C@@H]2c2ccccc2Cl)cc1 1875249110 IHZAKAUYBUZBJL-ROUUACIJSA-N 389.835 2.701 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCNC[C@H]1c1cccc(F)c1 261688285 CFNWVHICPMSNHP-INIZCTEOSA-N 385.468 2.778 0 50 GFAA CO[C@@H](C)CS(=O)(=O)Nc1cc(-c2n[nH]c(C)n2)cc(C(F)(F)F)c1 864097400 RQUFGLQZFCZMQL-QMMMGPOBSA-N 378.376 2.576 0 50 GFAA O=C(N=c1ccn([C@@H]2CCNC2=O)[nH]1)Nc1ccccc1SCC(F)(F)F 1875289703 JXDDECJKZACHJX-LLVKDONJSA-N 399.398 2.664 0 50 GFAA COc1ccc2c(c1)CC[C@H](NC(=O)[C@@H](C)n1c(C)nc3ccccc3c1=O)C2 1875259190 LGPOMJUPGUYIPZ-KDOFPFPSSA-N 391.471 2.948 0 50 GFAA NC[C@H]1C[C@@H](O)CN1c1cc(Nc2ccc(OC3CCCC3)c(F)c2)ncn1 1875397088 KVQFZPZHRFZTQG-HUUCEWRRSA-N 387.459 2.579 0 50 GFAA CNS(=O)(=O)C[C@@H]1CCCN(C(=O)c2cc3cc(C)[nH]c3cc2Cl)C1 1875326576 MIRCKECIOPSHBJ-GFCCVEGCSA-N 383.901 2.531 0 50 GFAA Cc1ncc2n1CC[C@H](C(=O)NCc1noc(-c3ccc(Cl)cc3F)n1)C2 885703032 MBEMAWHTIQZIKG-NSHDSACASA-N 389.818 2.913 0 50 GFAA CN(C)C(=O)[C@H]1CN(C(=O)c2cccc(-n3cccc3)c2)c2ccccc2O1 1775996350 JESVLHHYUHYRCM-HXUWFJFHSA-N 375.428 2.973 0 50 GFAA CC(C)c1ocnc1C(=O)N(C)CC[C@@H](NC(=O)[C@H]1CCCCO1)C(C)C 1775997219 YDSNNSNKGKVZCS-HZPDHXFCSA-N 379.501 2.970 0 50 GFAA O=C(c1cccc2nccnc12)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 2100534445 INKDSSCBYCPTRO-IIBYNOLFSA-N 384.439 2.854 0 50 GFAA O=C(C1CCOCC1)N1CC[C@@]2(C1)C(=O)N(Cc1nccs1)c1ccccc12 2100545543 VOZCGHGELBXIPC-NRFANRHFSA-N 397.500 2.587 0 50 GFAA CCn1nc(C(=O)N2CCCN[C@H](c3ccccc3)C2)c(=O)c2ccccc21 2325783366 STPSOMQBTZNDQX-SFHVURJKSA-N 376.460 2.593 0 50 GFAA Cc1ccc(C(=O)Nc2cccc(S(N)(=O)=O)c2)c(Br)c1F 2325843033 QYPVLCISSDBRQK-UHFFFAOYSA-N 387.230 2.796 0 50 GFAA Cc1ccccc1OCC(=O)N1N=C(c2cccnc2)C[C@]1(O)C(F)(F)F 879324 PNJSFRGBXCQBFQ-KRWDZBQOSA-N 379.338 2.656 0 50 GFAA Cc1ccc2nc(N3CCN(c4cccc(Cl)c4)CC3)c3nnnn3c2c1 6901096 BKZYTVJAUXMMGL-UHFFFAOYSA-N 379.855 2.961 0 50 GFAA O=C1CCN(CC(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)C(=O)N1 109739051 YDRDSGCCTAYQJC-UHFFFAOYSA-N 398.385 2.576 0 50 GFAA Cc1noc(CCCC(=O)N2CC[C@@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C2)n1 225445783 NZXVXANQTJDFDQ-HUUCEWRRSA-N 378.473 2.559 0 50 GFAA O=C(CN1CC[C@H]2CCCC[C@H]2C1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 247806544 ZUTGZBUZGCQQJA-UXHICEINSA-N 399.535 2.572 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccccc1)CC2 20762216 TWAXKVFHZBGLEJ-GCJKJVERSA-N 394.471 2.808 0 50 GFAA biogenic c1ccc(C(c2ccccc2)c2noc3c2CN(CCc2nnn[nH]2)CC3)cc1 67691475 JXARMUGJEVDJBO-UHFFFAOYSA-N 386.459 2.969 0 50 GFAA C[C@](CO)(CNC(=O)CCCc1ccc2c(c1)CC(=O)N2)Cc1ccccc1 252496958 PWNNXMYRDMNOQE-HSZRJFAPSA-N 380.488 2.861 0 50 GFAA CN(C(=O)[C@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1)C1CCOCC1 12584034 FPJNXANQKDMGBG-INIZCTEOSA-N 378.900 2.759 0 50 GFAA Cc1nc2c(cnn2C(C)C)c(C)c1CCC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 252538921 NIYVTQHTXTYWMD-APLWCEOHSA-N 382.508 2.789 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)c3ccc(N4CCOCC4)cc3)n2)cc1 72434133 JNZNTFDGTUUIKK-UHFFFAOYSA-N 378.432 2.812 0 50 GFAA O=C(c1cccc(Oc2ccccc2)c1)N1CCN(C(=O)[C@@H]2CCCO2)CC1 6730811 VFXKJRSAYVWXFP-FQEVSTJZSA-N 380.444 2.942 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N[C@@H](C)Cc2cccnc2)o1 12320030 LJYVBFLXHLJTRO-INIZCTEOSA-N 394.475 2.938 0 50 GFAA Cc1cc(C(=O)N2CCN(C(=O)c3csc([C@H]4CCCO4)n3)CC2)c(C)o1 122784563 YSJSWYHNCOHIBR-MRXNPFEDSA-N 389.477 2.803 0 50 GFAA O=C([C@H]1COc2ccccc2C1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 70812062 UAIQAQTZWUOYTH-MRXNPFEDSA-N 377.444 2.744 0 50 GFAA O=C1c2ccccc2C(=O)N1CCNC(=O)C1(c2ccccc2)CC(F)(F)C1 368082992 HVFDGNLZOLOVPI-UHFFFAOYSA-N 384.382 2.766 0 50 GFAA Cc1ccccc1CN1CC[C@H](Cn2ccnc2-c2cc3n(n2)CCNC3)C1 72412274 XBEDIHUTGBDESA-SFHVURJKSA-N 376.508 2.680 0 50 GFAA O=C(O)c1cc(-c2ccc(-c3ccn[nH]3)cc2)cc(S(=O)(=O)NC2CC2)c1 71745526 BYLDXYYGBYITQW-UHFFFAOYSA-N 383.429 2.883 0 50 GFAA CS(=O)(=O)Nc1nc2c(s1)CN(C(=O)c1ccc3c(c1)CCC=C3)CC2 333198515 WXGIUHBGNUIBEO-UHFFFAOYSA-N 389.502 2.673 0 50 GFAA C[C@@H](NC(=O)c1ccc(NC(=O)c2scnc2C(C)(C)C)cc1)C(=O)O 262942405 MFLUVNQBKRJBLM-SNVBAGLBSA-N 375.450 2.896 0 50 GFAA CCS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H]2c2cc(C)on2)cc1 378473788 LMAHHRCTNWPWOY-QGZVFWFLSA-N 377.466 2.823 0 50 GFAA CCn1c(C)nnc1CN1CCC[C@H](c2n[nH]cc2NC(=O)c2ccccc2)C1 378541929 SUWQNIVNUZIRRK-KRWDZBQOSA-N 393.495 2.961 0 50 GFAA Cc1cc(N2CCN(CCO)CC2)n2nc(-c3ccc(Cl)cc3)c(C)c2n1 40217019 UVGXSZCYOJTFCS-UHFFFAOYSA-N 385.899 2.781 0 50 GFAA CCn1c(C)ccc(-c2noc(CCC(=O)Nc3ccc(OC)cc3)n2)c1=O 46020375 QXQDIVAPXSXWHD-UHFFFAOYSA-N 382.420 2.807 0 50 GFAA Cn1nc(C(=O)NC2CCCC2)c2c1CCN(Cc1cccc3nccnc13)C2 14538837 HVDFYDHUCLZBOI-UHFFFAOYSA-N 390.491 2.594 0 50 GFAA C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cccc(N2CCCC2)c1 176311082 UZTVTDOVCNXVEX-AWEZNQCLSA-N 388.493 2.817 0 50 GFAA O=C(NC[C@H]1CNCCO1)c1cccc(-c2ccc(OC(F)(F)F)cc2)c1 426642877 JLQNLOJUIKHVIY-QGZVFWFLSA-N 380.366 2.970 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCC(=O)Nc1ccccc1)CC2 176985741 NDMWPLVWCXLSDU-GFCCVEGCSA-N 392.381 2.664 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1c1nc(-c2ccc(=O)n(C)c2)no1 289008522 HRMBGMBVGCNBEI-INIZCTEOSA-N 394.431 2.811 0 50 GFAA Cc1ncsc1CCCNC(=O)N(C)C[C@H]1CC(=O)N(C2CCCC2)C1 426573166 NUHHXSNBAIIWJA-OAHLLOKOSA-N 378.542 2.817 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@@H]1CCCN(C/C=C/c2ccccc2)C1 426503161 JYINMSMFESQZRV-MVHVFESUSA-N 381.524 2.540 0 50 GFAA COc1cccc2ccn(CCC(=O)N3C[C@@H]4C[C@H](C3)Cn3c4cccc3=O)c12 230278504 KZHWIBBWFKDEHM-AEFFLSMTSA-N 391.471 2.848 0 50 GFAA biogenic COCCOc1cccc(NC(=O)N2CCCN(Cc3ccncc3)CC2)c1 95526630 RHIQWDKQZMXPOR-UHFFFAOYSA-N 384.480 2.847 0 50 GFAA Cc1ccc(C)c(C(=O)NCc2cc3n(n2)CCCN(C(=O)C2CCC2)C3)c1 91871739 RXPWHOSZKZRLPM-UHFFFAOYSA-N 380.492 2.962 0 50 GFAA CCn1c(CN2CCCC2)nnc1C1CCN(C(=O)CSC(C)C)CC1 96165697 JMRWQLFMOWWIBR-UHFFFAOYSA-N 379.574 2.741 0 50 GFAA COc1cc(N2CCN(C(=O)NCc3oc4ccccc4c3C)CC2)ncn1 183597654 GRLAKFVDFRKAFE-UHFFFAOYSA-N 381.436 2.572 0 50 GFAA CN1CC[C@@](C)(CN(C)C(=O)NCc2nc(-c3ccccc3Cl)no2)C1 534652341 KXGCSVIXLCMSKA-GOSISDBHSA-N 377.876 2.873 0 50 GFAA Cc1n[nH]c(C)c1[C@H](C)NC(=O)c1ccc(-c2cc(N(C)C)nc(N)n2)cc1 534640109 NGDQURGJUAJYIL-NSHDSACASA-N 379.468 2.623 0 50 GFAA Cc1cc(CNC(=O)c2ccc(-c3nc(N4CCCCC4)n(C)n3)cc2)on1 534635493 BEBUKWOLWMKDNC-UHFFFAOYSA-N 380.452 2.699 0 50 GFAA Cc1ccc(OCCN(C)C(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1 584901518 MWUWTRGETWPFAK-HXUWFJFHSA-N 375.513 2.659 0 50 GFAA Cc1cc(Sc2ncccn2)ccc1NC(=O)N1CCNC(=O)[C@@H]1C(C)C 170632107 PRHYFPONXNVRSC-INIZCTEOSA-N 385.493 2.925 0 50 GFAA CN(C(=O)c1ccc(-c2cncnc2)cc1F)c1ccc(S(C)(=O)=O)cc1 186700562 HNNZJLJHMAEHJX-UHFFFAOYSA-N 385.420 2.963 0 50 GFAA CN([C@H]1CCCc2c1cnn2C)S(=O)(=O)c1cccc2c1OC(C)(C)C2 192643204 TZBPVJWDKVCEIR-INIZCTEOSA-N 375.494 2.832 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)n1 1615734684 GORVVZSAUWONRJ-RXVVDRJESA-N 378.476 2.500 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3cc4ccc(Cl)cc4n3C)C[C@@H]12 1704343056 IWRLDHGOOHOOPJ-XLIONFOSSA-N 389.883 2.843 0 50 GFAA O=C(NCCC[C@H]1CCOC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704311392 HSMRQIPFMTZLRU-INIZCTEOSA-N 385.464 2.725 0 50 GFAA Cn1nnc2cc(-n3ccnc3-c3cc(Cl)ccc3OCC(=O)O)ccc21 1800414297 MQOWRNUVEHHZLR-UHFFFAOYSA-N 383.795 2.938 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)CCC(=O)N(C)C)c(F)c1F 11820518 ZLDBFINOVKMQME-UHFFFAOYSA-N 377.391 2.945 0 50 GFAA O=C(Nc1ccc(F)cc1)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1 12003528 UNDDCBIJXONYIF-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA O=C1CC[C@@H](C(=O)NC[C@@H]2Cc3cc(-c4ccsc4)cc(Cl)c3O2)N1 12048045 ZKXQZZIMUOQUDJ-ZFWWWQNUSA-N 376.865 2.767 0 50 GFAA COC[C@H](C)NC(=O)c1cn(C2CCCCC2)cc(C(=O)NCC(C)C)c1=O 12327478 QMYKGYDBYCKAMP-HNNXBMFYSA-N 391.512 2.504 0 50 GFAA CC[C@H](C)CN1CCC2(CC1)C(=O)N(CCOC)C(=O)N2Cc1ccccc1 14532130 YCIICRYCFCYZFR-SFHVURJKSA-N 387.524 2.978 0 50 GFAA CC(=O)c1ccccc1C(=O)N1CCC(n2nccc2NC(=O)C2CC2)CC1 15067954 GJFWETZEAJEUGW-UHFFFAOYSA-N 380.448 2.912 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCc1ccc(Cl)cc1)CCCC3 169778390 XHQFOGKWXQZWTM-UHFFFAOYSA-N 384.867 2.813 0 50 GFAA CC[C@]12COC(=O)N1CCN(Cc1c(-c3ccccc3)nc3ncccn13)C2 1857670899 IGXQKQFJXMPWIW-NRFANRHFSA-N 377.448 2.813 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1C(=O)Nc1ccc2c(c1)OCO2 1857674069 ZHVPRWICLNSEFS-WNKDZCFJSA-N 383.448 2.669 0 50 GFAA NC(=O)[C@@H]1CCCN(CCn2ccnc2-c2ccc(CC(F)(F)F)cc2)C1 1857694625 GMTUDKSBSVZMRG-MRXNPFEDSA-N 380.414 2.852 0 50 GFAA O=C(c1ccc(-c2ccc(F)cc2)cc1)N1CC[C@@H](O)[C@@]2(CCCNC2=O)C1 1857703595 OGTJEWAEVOVFPF-DENIHFKCSA-N 382.435 2.596 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N(C)CCc4ccccn4)CC3)nc2n1 1857740656 SKYACUHVCAGJNV-UHFFFAOYSA-N 379.464 2.844 0 50 GFAA O=C(O)c1cc2c(nc1N1CCN3[C@@H](c4ccccc4)COC[C@H]3C1)CCC2 1875242614 XSAWVDVBEWYVCB-YLJYHZDGSA-N 379.460 2.531 0 50 GFAA Cc1ccccc1[C@H](CN1CCn2nc(C(=O)O)cc2C1=O)N1CCC(C)CC1 1875250520 IGTLGHIMZYIYRU-FQEVSTJZSA-N 396.491 2.819 0 50 GFAA CC(C)CNC(=O)c1cn(C(C)C)cc(C(=O)NC2Cc3ccccc3C2)c1=O 15003666 UWJKKYYJZLITMS-UHFFFAOYSA-N 395.503 2.712 0 50 GFAA COc1cccc(OC(F)(F)F)c1S(=O)(=O)N1C[C@@H]2CSC[C@]2(C)C1 908445131 VKJLTULYEULHMB-YGRLFVJLSA-N 397.440 2.967 0 50 GFAA CC(C)Cn1nnc2c1C[C@H](c1nc(-c3cccc(-n4cccn4)n3)no1)CC2 952892728 GOXSVEUPBLSSGO-CQSZACIVSA-N 390.451 2.837 0 50 GFAA CCC[C@H]1CCCN(C(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)CC1 1875252849 CVAYMOQQWLUUCG-BTYIYWSLSA-N 386.496 2.853 0 50 GFAA Cn1cc(CCC(=O)N2C[C@]3(C(=O)O)C[C@]3(C(F)(F)F)C2)c2ccccc21 1875326602 QDWCEMBIMJBVQG-ROUUACIJSA-N 380.366 2.977 0 50 GFAA CN1C(=O)N[C@](C)(c2ccc(NS(=O)(=O)c3cscc3Cl)cc2)C1=O 1875317243 RYWSMPRMFUXEOU-OAHLLOKOSA-N 399.881 2.599 0 50 GFAA C[C@H](O)c1cn(Cc2ccc(C(=O)N[C@H](Cc3ccccc3)C3CC3)o2)nn1 1875317590 DTKKENSILILUKG-KBXCAEBGSA-N 380.448 2.724 0 50 GFAA O=C(CCc1cccc(C(F)(F)F)c1)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875403319 SQOOGUPXAYHDCC-USXIJHARSA-N 381.398 2.790 0 50 GFAA CCNS(=O)(=O)c1cccc(CNC(=O)C2(c3ccc(F)cc3C)CC2)c1 2325784890 RTRQVEUEIKFMNW-UHFFFAOYSA-N 390.480 2.780 0 50 GFAA COc1cc2cc(Cl)nc(N3CCN(Cc4ncc[nH]4)CC3)c2cc1OC 2325814027 GTAISBWFFNGQEX-UHFFFAOYSA-N 387.871 2.951 0 50 GFAA NC(=O)[C@@H](CC(=O)N[C@H](CO)c1cccc(O)c1)c1ccc(Cl)cc1Cl 2325851144 QEAGIDJZUQKMHI-GOEBONIOSA-N 397.258 2.508 0 50 GFAA CC12CN(C(=O)c3ccccc3)CC(C)(CN(C(=O)c3ccccc3)C1)C2O 984877 IDCSQVZKEKQZDW-UHFFFAOYSA-N 378.472 2.672 0 50 GFAA CCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1c(Cl)cccc1Cl 1076209 XBRZHVCHMWZBGR-UHFFFAOYSA-N 399.303 2.901 0 50 GFAA COC(=O)C1CCN([C@@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 2890130 FCWDBMFIAFLEGD-CQSZACIVSA-N 385.247 2.510 0 50 GFAA COCCN1C(=O)N(c2cccc(C)c2)C(=O)[C@H]1CC(=O)Nc1ccc(F)cc1 2891140 YHDDLOUMCRPKFH-GOSISDBHSA-N 399.422 2.947 0 50 GFAA O=C(O)CCC(=O)Nc1ccc(Cc2ccc(NC(=O)CCC(=O)O)cc2)cc1 4015450 VQMZZDYWICFBLU-UHFFFAOYSA-N 398.415 2.884 0 50 GFAA COc1ccccc1-c1nc(NC(=O)c2cn(C)c(=O)c3ccccc23)n[nH]1 170625094 YNKVMZUQGOOZAJ-UHFFFAOYSA-N 375.388 2.585 0 50 GFAA CN1Cc2ccccc2C[C@H]1CNCc1c[nH]nc1-c1ccc2c(c1)OCO2 20600267 JLWCKEKBWBREMI-IBGZPJMESA-N 376.460 2.952 0 50 GFAA Cn1ccnc1CN1CCN(C(=O)NCc2ccc(Cl)cc2Cl)CC1 106327667 IGXDOTMLJDREAN-UHFFFAOYSA-N 382.295 2.754 0 50 GFAA CCN(CCOc1ccccc1F)C(=O)[C@H](C)Sc1nc(C)cc(=O)[nH]1 55282433 OEDOVCQJZAFFOP-ZDUSSCGKSA-N 379.457 2.626 0 50 GFAA COCCC(=O)N1CCC[C@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 55385264 SCSYVCKGVWLWES-SFHVURJKSA-N 399.457 2.855 0 50 GFAA O=C(NCc1cccnc1N1CCc2ccccc2C1)c1c(O)cccc1O 67854951 LEDLDHDBJVITNP-UHFFFAOYSA-N 375.428 2.986 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1ccc(CO)cc1 67955939 ZVCDCTUYEWRURI-UHFFFAOYSA-N 376.460 2.578 0 50 GFAA C[C@@H]1CCN(CC(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c2ccccc21 249717830 JUWKRLZFRSLSMK-AEFFLSMTSA-N 390.549 2.959 0 50 GFAA O=C1NC[C@@H](c2ccccc2)Cc2[nH]c(Cc3nc(-c4cccnc4)no3)nc21 65526851 JNQASCJDDVLFCH-HNNXBMFYSA-N 386.415 2.515 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)N2CCO[C@@H](C(=O)C3CC3)C2)C[C@@H](C)O1 252535896 HCMLEMXKQCYXDR-ZRGWGRIASA-N 387.480 2.512 0 50 GFAA CN(c1cccc(NC(=O)c2ccc(Cn3ccnc3)cc2)c1)S(C)(=O)=O 38856625 AXUJRNALQKTAKI-UHFFFAOYSA-N 384.461 2.580 0 50 GFAA COc1ccccc1-c1cc(C(=O)O)cc(S(=O)(=O)N2CCSCC2)c1 71760370 CEJGVEUEHPKFLN-UHFFFAOYSA-N 393.486 2.798 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)Cc4cc(C)no4)CC3)CC2=O)c1 77376252 RPBZRJSHVZXSSY-UHFFFAOYSA-N 397.475 2.575 0 50 GFAA CS(=O)(=O)Nc1ccc(NC(=O)N2CCC(c3ccn[nH]3)CC2)cc1Cl 152178559 HGGQVNYKXFFALP-UHFFFAOYSA-N 397.888 2.846 0 50 GFAA O=C(CNC(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1)N1CCCCC1 363183175 OWKLOYVQMGSZBS-UHFFFAOYSA-N 397.479 2.638 0 50 GFAA CCOC(=O)N1CCC(N[C@@H]2CC[C@@H]2NC(=O)Cc2c[nH]c3ccccc23)CC1 72133495 TWXGNFGAGLGSRW-UXHICEINSA-N 398.507 2.568 0 50 GFAA C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H]1CCC(=O)N[C@@H]1C1CC1 367069257 UQGPCAXSPITCRU-ASUYLVSUSA-N 377.916 2.724 0 50 GFAA CC(C)C[C@H](NC(=O)CNC(=O)C1(Sc2ccccc2)CCCC1)C(=O)O 262685139 ABYUSSHGUFTYGN-INIZCTEOSA-N 392.521 2.823 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NC(=O)N1Cc2ccccc2C2(CCC2)C1 376381142 JUDITCXUPYBBIB-QGZVFWFLSA-N 381.480 2.907 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@@H](CNC(=O)[C@@H]2CCCN(C)C2)C3)n1 39393908 AKYRJSNWLNNYOH-QZTJIDSGSA-N 380.492 2.522 0 50 GFAA CC(=O)NCC[C@@H]1CCCCN1S(=O)(=O)c1ccc2nc(C)sc2c1 77537392 LXUMNMLCZFNBKF-AWEZNQCLSA-N 381.523 2.674 0 50 GFAA Cc1cccc2nc(CN3CCC[C@@H]3c3nc4c(n3C)CCCC4)cc(=O)n12 493676438 DHOUSVSDEYXCJK-LJQANCHMSA-N 377.492 2.952 0 50 GFAA COc1cc([C@@H]2CC(=O)Oc3c2c(=O)oc2ccccc32)ccc1OCC(=O)O 217912438 VHNSWJFYSRONMX-ZDUSSCGKSA-N 396.351 2.706 0 50 GFAA biogenic COc1cccc(CN2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)c1 71764799 HENSLMWPCSPDCQ-FQEVSTJZSA-N 385.552 2.994 0 50 GFAA Cc1cc(NC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)ncc1Br 176075047 PAGUVZCCWCPDAP-QMMMGPOBSA-N 380.164 2.502 0 50 GFAA O=C([C@@H](O)c1ccccc1Cl)N1CCC2(CC1)Nc1ccccc1NC2=O 82083615 JZPOOWUEKYEXRR-KRWDZBQOSA-N 385.851 2.799 0 50 GFAA COc1cccc(CCNC(=O)N2CCN(Cc3cccc(C)c3)C(=O)C2)c1 426662301 QZIPUIWWEPOFKS-UHFFFAOYSA-N 381.476 2.600 0 50 GFAA Cn1cc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)cn1 91416693 WRRBTZBTARMLJR-UHFFFAOYSA-N 380.492 2.508 0 50 GFAA O=C(CC[C@@H]1CCCN(C2CCNCC2)C1)N1CCN(Cc2ccccc2)CC1 95505589 YBDSJGGBWKNYNH-QFIPXVFZSA-N 398.595 2.575 0 50 GFAA CCS[C@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91563090 NLUNEWQTLVUIED-MRXNPFEDSA-N 375.538 2.954 0 50 GFAA CCCOc1ccc(NC(=O)N2CCCN(C(=O)COC)CC2)cc1Cl 95508290 OOPRUXXVRDJASI-UHFFFAOYSA-N 383.876 2.841 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)[C@H]2C[C@H](O)C2)cn1 252550123 RZSAEZZCMBLUHY-PJIJBLCYSA-N 382.420 2.624 0 50 GFAA COc1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)c2nonc12 824645566 VTGCYZCZTBPWJL-BRRVFRNMSA-N 394.435 2.757 0 50 GFAA Cc1n[nH]c(C)c1CCCN(C)C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 584896980 MPLLHFZHMQEDSG-ZDUSSCGKSA-N 392.525 2.765 0 50 GFAA CCc1ccccc1OCCN1CC[C@]2(O)CCN(C(=O)C3CCC3)C[C@@H]2C1 1565508473 ZXZYDQNNOGAMRF-REWPJTCUSA-N 386.536 2.713 0 50 GFAA COc1ccc([C@@H](CN2C(=O)[C@@H]3Cc4ccccc4CN3C2=O)N(C)C)cc1 170613692 USOXKHBRWBJRLW-VQTJNVASSA-N 379.460 2.687 0 50 GFAA CCn1c(S)nc2cc(C(=O)N[C@@H]3CCCCC[C@H]3OC)ccc2c1=O 170653348 UZPXGKVIPMIQIL-GDBMZVCRSA-N 375.494 2.783 0 50 GFAA COCCN(C)C[C@H]1[C@H]2CN(Cc3ccnc4ccccc34)C[C@]23CC[C@H]1O3 1704311629 OFCHOOQKQXPQIB-KKSHJYNMSA-N 381.520 2.792 0 50 GFAA CCc1ccc(-c2cc(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)n[nH]2)cc1 1704308705 HPLFRFHXTMZVGR-UHFFFAOYSA-N 380.496 2.875 0 50 GFAA Cc1c(C(=O)N2C[C@H]3CCC[C@](O)(c4ccccc4)[C@H]3C2)cnc2ccnn12 1704341610 XTASNQAURIEONA-WVBUVRCRSA-N 376.460 2.798 0 50 GFAA O=S1(=O)CC[C@@H](OCCOc2cccc(-c3cnc4ccccc4n3)c2)C1 1775979479 IPPZCIIOFPIQNL-QGZVFWFLSA-N 384.457 2.879 0 50 GFAA Cc1cccc(CCNC(=O)[C@H]2CCc3sc(N4CCOCC4)nc3C2)c1 1772806369 XHGZTVGAFGJUHF-KRWDZBQOSA-N 385.533 2.752 0 50 GFAA COc1ccc(CN2CCC[C@H](n3cc(C(=O)N4CCCC4)nn3)C2)cc1C 12330436 PHDNFCOHQQIUEU-SFHVURJKSA-N 383.496 2.668 0 50 GFAA CC(=O)N1CCN(C(=O)C[C@H](c2ccccc2)c2ccc3c(c2)OCO3)CC1 14981132 HXVGICNVIGHUQH-LJQANCHMSA-N 380.444 2.628 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2ccc(F)cc2)[C@@H](CCO)C1 19839316 AEJOAUNVBHAMBE-SFHVURJKSA-N 388.512 2.912 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)CCc3n[nH]c4c3CCCC4)C[C@H]12 1857712834 IRILEGMWIZHGQG-WLNNIECUSA-N 385.508 2.681 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCC2CC2)CC[C@@H]1NC(=O)CCc1ccncc1 1875240878 JGCJGDBCFBJTQN-UFYCRDLUSA-N 387.524 2.621 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCC[C@H](CCC(=O)O)C1)c1c(F)cccc1F 236687336 ZTHXNQCHVPWCOL-CJNGLKHVSA-N 382.407 2.636 0 50 GFAA O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)N1[C@H]2CC[C@H]1COC2 838094617 PSCNRWNAPWWFFI-GJZGRUSLSA-N 381.457 2.515 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1nnc(-c2ccc(F)cc2F)o1)C1CCCC1 864096373 ADFVNYQXNFLNEG-AWEZNQCLSA-N 387.408 2.962 0 50 GFAA CCN1CCN(C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)[C@@H](C)C1=O 1875263489 LIDHVRHXQPSNKM-INIZCTEOSA-N 380.492 2.969 0 50 GFAA O=C(NC1(c2ncon2)CCCC1)c1cnc2c(Br)cccn12 1875316628 CWVJYHXSNJZPCY-UHFFFAOYSA-N 376.214 2.679 0 50 GFAA FC(F)c1nnc2n1C[C@@H](CN=c1cc(Cl)nc([C@@H]3CCCO3)[nH]1)CC2 1875395083 KEFVQHZXVQMKLQ-ZJUUUORDSA-N 384.818 2.607 0 50 GFAA Cc1nc(C(=O)N(Cc2ccc(F)cc2)C2CC2)nc(N2CC[C@@H](N)C2)c1C 1875398238 IGFXWIMCZAVUGB-QGZVFWFLSA-N 383.471 2.575 0 50 GFAA O=C(NC[C@H](O)Cc1ccccc1F)c1cc(Br)c2nccn2c1 1303693288 KAYFRNNSWNFVRO-CYBMUJFWSA-N 392.228 2.569 0 50 GFAA COc1cccc([C@H](C)N2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)c1 887557228 DDKQNKULRPNWQZ-INIZCTEOSA-N 382.460 2.841 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)c2cc3c(C(C)C)nn(C)c3s2)o1 1775957504 YBQOKWNIPNAQQY-ZYHUDNBSSA-N 389.481 2.652 0 50 GFAA Cc1csc2c(C(=O)NC[C@@H]3CN(C)CCN3Cc3ccccc3)ncnc12 2325857161 RGZAYJRBHUWVCO-QGZVFWFLSA-N 395.532 2.546 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1=O 120206094 YIIDEKKXECQWBS-YOEHRIQHSA-N 399.878 2.640 0 50 GFAA C[C@@H]1CCCN(C[C@@H](C)NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)C1 245225353 SUFUKTFASVRDSI-SBHAEUEKSA-N 385.552 2.704 0 50 GFAA COc1cc(C(C)=O)ccc1OC[C@H](O)Cn1nc(C)c(Br)c1C 644409 PIAPEILCXSUDKS-CQSZACIVSA-N 397.269 2.914 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)NC(C)=C1C(=O)OCc1ccc2c(c1)OCO2 844459 NTLORAIHFWKAFT-IBGZPJMESA-N 396.399 2.795 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1 1118322 WMSTZWHOIUZSGT-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA O=C1N(CCO)CCC[C@@]12CCCN2Cc1cc(O)c2cccc(Cl)c2n1 2356166218 XOIIBCIYOXEZLK-HXUWFJFHSA-N 389.883 2.543 0 50 GFAA O=C(c1cccc(C(F)(F)F)c1)N1CCN(S(=O)(=O)c2ccccc2)CC1 3609697 VUWXTUCNQDCCDN-UHFFFAOYSA-N 398.406 2.852 0 50 GFAA CCOc1cc(-c2nnn(CC(=O)Nc3ccccc3CC)n2)ccc1OC 10337792 GSZGOGMUYNKPLR-UHFFFAOYSA-N 381.436 2.949 0 50 GFAA O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 100798673 RTARCSWGSRIDLF-ONIAQPFYSA-N 376.884 2.731 0 50 GFAA Cc1cc(-c2nc(-c3c(C)ncc4c3CCN(C(=O)NC(C)C)C4)no2)no1 23232064 XORPHYVLCPPWFO-UHFFFAOYSA-N 382.424 2.880 0 50 GFAA CSc1ncc(CN2CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C2)cn1 20536813 AXDDQEMNIWHXBB-UHFFFAOYSA-N 381.461 2.876 0 50 GFAA CCn1cnnc1CCNC(=O)c1csc2nc(-c3ccccc3C)cn12 67879318 IKFFRXZLHQAEEV-UHFFFAOYSA-N 380.477 2.955 0 50 GFAA CCNC(=O)C1(NC(=O)c2cncc(-c3ccc(N(C)C)cc3)c2)CCCC1 252485580 GZHONAISBJOKJZ-UHFFFAOYSA-N 380.492 2.993 0 50 GFAA COc1ccccc1CC(=O)N1CCC(NC(=O)Nc2ccncc2C)CC1 121565233 PCYPFDVVBXHSIS-UHFFFAOYSA-N 382.464 2.754 0 50 GFAA CCC[C@H](C)C(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccc(OC)cc2)C1 67934490 KSXVQZPLRIRWPM-AWEZNQCLSA-N 385.464 2.959 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)Nc3ccccc3F)CC2)n1 33318538 QPZUDVKTLZANJE-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA CN(Cc1cc(=O)n2ccccc2n1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1 328633413 LYPVKMNEWDCDGT-ZDUSSCGKSA-N 391.397 2.604 0 50 GFAA COc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2)c(OC)c1OC 12435607 YOXOIKPKFGIOPW-INIZCTEOSA-N 385.464 2.502 0 50 GFAA CC1([C@H]2CCCN(C(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)C2)OCCO1 363722531 KZLTWIVRIXVLCE-OALUTQOASA-N 386.492 2.683 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(CCc3ccccc32)C1 155414376 FKFILCBSCFLCND-ISKFKSNPSA-N 390.483 2.660 0 50 GFAA O=C(CCN1CCCCC1=O)N[C@@H]1CCCc2c1cnn2-c1ccccc1F 12704853 IGTKIOYTJGOEQA-QGZVFWFLSA-N 384.455 2.908 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](c3ccncn3)C2)nnn1-c1cccc2ncccc12 377223297 JLHSGTMKFMDQGV-INIZCTEOSA-N 399.458 2.934 0 50 GFAA CCCc1c(NC(=O)N2C[C@H](C)O[C@@]3(CCOC3)C2)cnn1-c1cc(C)ccn1 373937206 VYOAEUPBQUZCDZ-KKSFZXQISA-N 399.495 2.940 0 50 GFAA CCOc1ccnc(N2CCN(Cc3ncc(-c4cccc(F)c4)o3)CC2)n1 175194984 OSNAFOXNFSOOMY-UHFFFAOYSA-N 383.427 2.992 0 50 GFAA Cn1nccc1[C@H]1[C@H](NC(=O)Nc2ccsc2Cl)CC(=O)N1C1CC1 286037734 DOJPEJNIVURGID-BXUZGUMPSA-N 379.873 2.761 0 50 GFAA O=c1cc(-c2cccnc2)nc(-c2ccc(CN3CCC[C@@H](CO)C3)cc2)[nH]1 48130351 FRUPFJINPQVFHO-QGZVFWFLSA-N 376.460 2.703 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCCO[C@H](Cn2cccn2)C1 82137623 VNXCARZZHXPHBY-KRWDZBQOSA-N 382.489 2.862 0 50 GFAA O=C(NC1CCN(C(=O)c2ccncc2)CC1)c1cnc2ccc(F)cc2c1 179198724 MANTYYMCBNMCKF-UHFFFAOYSA-N 378.407 2.804 0 50 GFAA CN(C)c1cc(-c2ccc(C(=O)N3CCN(c4cccnc4)CC3)cc2)ncn1 426380761 YBDDAMISZNPQGV-UHFFFAOYSA-N 388.475 2.567 0 50 GFAA CN(C)CCN(C[C@H]1CCCN(Cc2ccccc2F)C1)C(=O)c1cnco1 95511827 RREJSJAIBZDJHY-KRWDZBQOSA-N 388.487 2.730 0 50 GFAA COCCN1CCC(CN(C[C@@H]2CCCO2)C(=O)c2cncc(Cl)c2)CC1 96132759 PXVGTKBNQGNVGO-IBGZPJMESA-N 395.931 2.715 0 50 GFAA CN(C)C(=O)N1CCn2nc(CNC(=O)c3ccc(C(C)(C)C)cc3)cc2C1 91907288 UWJZDBXMMYTWFO-UHFFFAOYSA-N 383.496 2.608 0 50 GFAA CN(C[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)Nc1ccc(-n2cncn2)cc1 95523168 FMYLKIYTHYSBEU-HNNXBMFYSA-N 382.468 2.522 0 50 GFAA COc1cccc(CN2CC3(CCN(c4ncnc5[nH]ccc45)CC3)CC2=O)c1 95525576 ALQOBCBVQOHUNS-UHFFFAOYSA-N 391.475 2.986 0 50 GFAA CN(C(=O)c1ccc2oc(Cc3ccc(Cl)cc3)nc2c1)[C@H]1COC[C@@H]1O 95507451 XACFLCUBSDIJLE-IRXDYDNUSA-N 386.835 2.904 0 50 GFAA O=C(CCC(F)(F)F)N1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91965844 HRGAKFZMLIXBGI-QGZVFWFLSA-N 386.418 2.526 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)C3(c4ccccc4)CCCC3)C2)CN1CCO 91998049 DENUQADBKXCHRV-JOCHJYFZSA-N 384.520 2.722 0 50 GFAA COc1ccc(OCC2CCN([C@@H](C)C(=O)Nc3nncs3)CC2)cc1 244748525 OJCLHLXJFUWWTE-ZDUSSCGKSA-N 376.482 2.665 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccco2)CN1Cc1c(F)cccc1Cl 64015475 TYWGQXRVHLTMIZ-NHYWBVRUSA-N 380.803 2.618 0 50 GFAA Cc1ccc([C@@H](C(=O)N2CCN(c3cccc(C(=O)O)c3)CC2)N(C)C)cc1 95522928 KYNNGGMWUQCFTA-FQEVSTJZSA-N 381.476 2.645 0 50 GFAA Cc1cc(C)n([C@@H](C)CNC(=O)Nc2ccc3c(c2)C(=O)N(C2CC2)C3=O)n1 299775412 CDRFXNCRDDPBJD-ZDUSSCGKSA-N 381.436 2.641 0 50 GFAA Cc1ccccc1NC(=O)N1CCOC2(CCN(Cc3cncnc3)CC2)C1 827970084 YBUVVVOACRFIBX-UHFFFAOYSA-N 381.480 2.684 0 50 GFAA CC(C)N1CCN(C2CCN(C(=O)c3ccn(-c4ccc(F)cc4)n3)CC2)CC1 270969506 WCGOAKBBDHZUDP-UHFFFAOYSA-N 399.514 2.642 0 50 GFAA CCS(=O)(=O)NC1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC1 192657371 ULADLLFBTXKVBA-UHFFFAOYSA-N 380.441 2.630 0 50 GFAA CCc1nccn1CCC(=O)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1616068126 GNDSRHROYLTGPZ-PXNSSMCTSA-N 378.476 2.758 0 50 GFAA COc1c(C)cc([C@@H](C(=O)O)N2CCN(C(=O)c3cccs3)CC2)cc1C 1506423826 XBQXHLGJJJEPNY-KRWDZBQOSA-N 388.489 2.957 0 50 GFAA CC(C)N1CCNC(=O)[C@@H]1CC(=O)Nc1ccc(-c2cccc(F)c2F)cn1 1529126650 LQJQFQQGOMMYIK-INIZCTEOSA-N 388.418 2.564 0 50 GFAA CN(C)C[C@]12CNC[C@H]1CN(C(=O)c1cccc(NCc3cccs3)c1)C2 1772707111 POFFVAMRLIHYQV-UWJYYQICSA-N 384.549 2.583 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN(C)Cc2ccccn2)cc1OC 11820900 LZJLWZPTOGUBLL-FQEVSTJZSA-N 387.524 2.804 0 50 GFAA O=C1CCCN1CC(=O)N1CC[C@]2(CCCN(CCC3CCCCC3)C2)C1 12056835 CLZXYXSQXHZBTE-QFIPXVFZSA-N 375.557 2.894 0 50 GFAA COc1c(C)cc(NS(=O)(=O)c2cc3c(cc2C)n(C)c(=O)n3C)cc1C 12445780 RLBCFQHEJKQNHH-UHFFFAOYSA-N 389.477 2.612 0 50 GFAA CCOC(=O)C1(Cc2cccc(C(F)(F)F)c2)CCN(S(C)(=O)=O)CC1 12708386 FQMBNTKLABXQCU-UHFFFAOYSA-N 393.427 2.853 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@@H]1c1ccc(SC)cc1 13153471 LYAQGMNUNZHKRV-WWNBULGVSA-N 394.489 2.575 0 50 GFAA O=C(c1cn([C@H]2CCCN(Cc3ccc(F)c(F)c3)C2)nn1)N1CCCC1 14991960 YFASBIPVOXWJLE-HNNXBMFYSA-N 375.423 2.629 0 50 GFAA CN(C)C(=O)CN1CCN(C(=O)C[C@@H](c2ccccc2)c2ccccc2F)CC1 15077172 ZILGWMNGTQHURB-FQEVSTJZSA-N 397.494 2.580 0 50 GFAA Cc1n[nH]c(CCC(=O)N2CCC[C@@H]2c2ccc(C(=O)NC3CCC3)s2)n1 19720770 NEDUQJBHUKQHGX-CQSZACIVSA-N 387.509 2.753 0 50 GFAA CCc1ccc(S(=O)(=O)NC[C@@H]2CCC[C@H](NC(=O)c3ccc[nH]3)C2)s1 1857671125 PESXNKVMWKXISP-KGLIPLIRSA-N 395.550 2.906 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)NCCc1ccnn1C)C2 1857685785 UAWFNRXPFVUJKP-ZDUSSCGKSA-N 385.493 2.612 0 50 GFAA CCc1cc(N2CCC3(CCc4c(O)nc(C)nc43)CC2)nc(N2CCCC2)n1 1857712507 PUQLRZXACSMANH-UHFFFAOYSA-N 394.523 2.928 0 50 GFAA CCn1cc(CN2C[C@@H]3[C@H](CNC(=O)C4(C)CCCC4)[C@H]4CC[C@]3(C2)O4)cn1 1857729151 KTLDNIVOJKALPV-JZJXAQOMSA-N 386.540 2.579 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cc(=O)c4ccccc4o3)C1)CC2 1857731313 PKACOCIICKKIPQ-JOCHJYFZSA-N 391.427 2.717 0 50 GFAA O=C(N1C[C@H]2c3ccccc3OC[C@@]2(C(=O)O)C1)C1(c2ccccc2F)CC1 247411554 PKKHAAOMPNMDID-AOMKIAJQSA-N 381.403 2.947 0 50 GFAA Cc1ccc(-c2cc(CN3CCCN(S(=O)(=O)C4CC4)CC3)on2)cc1 374843732 RWUJCXVERIOCNT-UHFFFAOYSA-N 375.494 2.650 0 50 GFAA COC(=O)CCCC(=O)N[C@@H](c1ccc(Br)cc1)c1nccn1C 864097236 NNOJJVCXEKPIJE-INIZCTEOSA-N 394.269 2.732 0 50 GFAA C[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 1875260386 LSQPEEAFZFSDQN-PBHICJAKSA-N 378.428 2.742 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3ccc(-c4cnco4)cc3)CC1)O2 1875394780 WMPRBDVGYZXWES-MRXNPFEDSA-N 394.431 2.566 0 50 GFAA C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC2(CCSCC2)C[C@H]1C(=O)O 1875305935 NDNHNRHYDKCPTO-CJNGLKHVSA-N 381.469 2.930 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)N(C)C)C3)c2ccc(F)cc2n1 1073379421 QNDVKAUKOLNTMH-ZBFHGGJFSA-N 384.455 2.900 0 50 GFAA CN(C)C(=O)[C@H](CNC(=O)Nc1ccc(N2CCCC2)nc1)c1ccccc1 2325800380 AOKQTXMNCJTKQD-GOSISDBHSA-N 381.480 2.675 0 50 GFAA Cn1cnc(C(=O)N[C@@H]2CC[C@@H](CCNC(=O)c3ccc4ccccc4n3)C2)c1 2325879704 DTSFMVGOFGZRRU-DOTOQJQBSA-N 391.475 2.687 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)N3CCN(c4ccccc4F)CC3)CC2=O)cc1 692031 QYXCKAZJEMRCFD-KRWDZBQOSA-N 381.451 2.836 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)Oc3cccc(N4C(=O)CCC4=O)c3)CC2=O)cc1 1124132 OLMPBROJNFBFQJ-HNNXBMFYSA-N 392.411 2.607 0 50 GFAA CC(=O)N1C(=O)N(c2ccccc2)[C@H]2[C@H]1N(c1ccccc1)C(=O)N2C(C)=O 1216562 GBFHVGKAHIMKKO-HDICACEKSA-N 378.388 2.616 0 50 GFAA O=C(c1ccc(N2CCOCC2)nc1)N1CCC2(CC1)OCCc1sccc12 2356146954 BJFWZHSCWWPHNA-UHFFFAOYSA-N 399.516 2.684 0 50 GFAA CN(C)c1ccc(-c2ccnc(N3CCC([C@H](O)c4nccn4C)CC3)n2)cc1 2356167719 ZPNXIRBXJRQVLW-FQEVSTJZSA-N 392.507 2.893 0 50 GFAA O=C(c1cc2ccccc2oc1=O)N(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 4991364 DUIYTPNGYJSNEK-QGZVFWFLSA-N 397.452 2.623 0 50 GFAA C[C@H](NC(=O)C1CCN(S(=O)(=O)N(C)C)CC1)c1ccc(C(C)(C)C)cc1 10276076 AQLDSMUWPXXPIB-HNNXBMFYSA-N 395.569 2.680 0 50 GFAA CN(Cc1nc2ccccc2[nH]1)C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O 53523493 AHNFIYQBLVGSBW-QFIPXVFZSA-N 396.466 2.688 0 50 GFAA COc1cc(CN[C@H]2CCCCNC2=O)ccc1OCCc1scnc1C 117391714 VMDWEAXBPLOLTN-INIZCTEOSA-N 389.521 2.840 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CC(=O)N[C@H](C)[C@H]1CCCO1 2780145 LOHRPVLZFPPFCC-VXNVDRBHSA-N 384.196 2.657 0 50 GFAA Cc1cccc(CN2CCN(c3ncnc4c(C)csc34)C[C@@H]2CCO)n1 72431911 DAXGAFNWSNMWPN-KRWDZBQOSA-N 383.521 2.776 0 50 GFAA Cc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)s1 7192685 RRJGEVWJBDIWIV-ZETCQYMHSA-N 382.536 2.863 0 50 GFAA Cc1onc(-c2ccccn2)c1C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O 152716614 FWEFUQNEUIRQAJ-HNNXBMFYSA-N 398.369 2.859 0 50 GFAA CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 154333566 XWNSEMFEYYFBKI-XZJROXQQSA-N 385.291 2.995 0 50 GFAA COC(=O)C1(NC(=O)OCc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1 75629638 NXTVRVJNFQHSRD-UHFFFAOYSA-N 392.452 2.856 0 50 GFAA CC(=O)N1CCc2ccc(S(=O)(=O)N3c4ccccc4C[C@H]3C)cc2CC1 283774388 BMWIKSPLEQRHCW-OAHLLOKOSA-N 384.501 2.774 0 50 GFAA CN1CCC[C@@H](CNC(=O)Nc2ccc3c(c2)CCCO3)[C@@H]1c1ccnn1C 284754236 ZEUDWEYFNPWSGT-OXJNMPFZSA-N 383.496 2.950 0 50 GFAA CN(C)C(=O)NC[C@@H]1C[C@H](F)CN1C(=O)C(C)(C)Oc1ccc2c(c1)CCC2 82083327 CLGHETVWIOBGJA-IRXDYDNUSA-N 391.487 2.543 0 50 GFAA CSCCN(C)C(=O)[C@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 82138544 OGLCGVWMNOXDCN-IBGZPJMESA-N 390.597 2.579 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(S(=O)(=O)c3ccccc3C(=O)O)C2)cc1 95367915 BEWCIEBKHJJJEC-OAHLLOKOSA-N 389.429 2.651 0 50 GFAA Cc1cccc(C(=O)N2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)c1 91643400 QCRURKOCMNECGI-UHFFFAOYSA-N 378.480 2.697 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(CCCOc1ccc(F)cc1)CCN2C 95361368 BLVAJMIBSLCRCT-NRFANRHFSA-N 377.504 2.613 0 50 GFAA C[C@@H](NC(=O)c1cnc(-c2ccncc2)nc1O)c1ccc2c(c1)OCCO2 91706350 OOXNMRQACXEKNY-GFCCVEGCSA-N 378.388 2.506 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(C)cc1C)CC2 95522301 ZHVPNYZLMUWRIH-UHFFFAOYSA-N 380.492 2.953 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3cc(C4CC4)n[nH]3)C2)CN1Cc1cccnc1 91724937 IFUSOBUDTYUUPB-QFIPXVFZSA-N 393.491 2.727 0 50 GFAA Nc1ncc(C(=O)N(Cc2cocn2)Cc2cocn2)c(-c2ccccc2)n1 97568991 VAGPKVAELXPIMB-UHFFFAOYSA-N 376.376 2.544 0 50 GFAA Cc1cccc(S(=O)(=O)N2CCC[C@@]3(C4=CCOCC4)COCC[C@H]23)c1 244858516 VMOYWMLPDBEKOY-PMACEKPBSA-N 377.506 2.902 0 50 GFAA CN(Cc1ccc2c(c1)OCO2)C(=O)c1cc(C(=O)O)nn1-c1ccccc1 299749916 MBAHOVHUDBXDHQ-UHFFFAOYSA-N 379.372 2.571 0 50 GFAA O=C(NCCc1ccco1)Nc1cc(C(=O)N2CCOCC2)ccc1Cl 299776949 IRHWWAWCONTRQP-UHFFFAOYSA-N 377.828 2.770 0 50 GFAA Cc1noc(C)c1-c1cc(-c2c(C)nn(C)c2C)nc(N2CCN(C)CC2)n1 823795788 UGRJFPHUPZKDDT-UHFFFAOYSA-N 381.484 2.518 0 50 GFAA CC1(C)CC(CC(=O)N[C@H]2CC(=O)N(c3ccc(F)cc3)C2)CC(C)(C)N1 952983704 XAIBMIDNYTWTOC-INIZCTEOSA-N 375.488 2.994 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N(C)Cc3c(C)nn(C)c3C)o2)c1C 952987671 KOGJTTQRSGBZKA-UHFFFAOYSA-N 378.454 2.722 0 50 GFAA CC(C)(C)OC(=O)N1[C@H](COC(=O)c2cccc(NC(N)=O)c2)COC1(C)C 170609375 BQHOHBJYMPPGMD-CQSZACIVSA-N 393.440 2.706 0 50 GFAA C[C@H]1C[C@H]1c1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)o1 170641638 LMDMHIBCJIJPFA-GXSJLCMTSA-N 396.852 2.866 0 50 GFAA CCC1(C(=O)NC)CCN(C(=O)CC(=O)Nc2cccc(Cl)c2C)CC1 1506398387 BEUGKKPJVLWGDU-UHFFFAOYSA-N 379.888 2.742 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NCC1(C)COC1 1704329694 YCRFFMLFVHFYBA-UHFFFAOYSA-N 379.844 2.820 0 50 GFAA CCc1cc(N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)nc(N2CCCC2)n1 1704345274 VTHFXEKLNJMYFJ-INIZCTEOSA-N 381.480 2.865 0 50 GFAA CN(Cc1ccccc1)[C@@H]1CCCN(C(=O)Cn2cnc3ccccc3c2=O)C1 12209116 GCPQNKZAUDIZLB-LJQANCHMSA-N 390.487 2.520 0 50 GFAA CCN(Cc1ccccc1)C(=O)C[C@H]1C(=O)NCCN1Cc1ccccc1C 12581521 BRMNTWHJTNNVGF-NRFANRHFSA-N 379.504 2.734 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCCc1ccccc1F)C2 14535205 WDZYXUQUVUKIIO-KRWDZBQOSA-N 384.499 2.968 0 50 GFAA Cc1cc(C)n(C(=O)[C@@H](Cc2ccccc2)N2C(=O)[C@H]3CCCC[C@H]3C2=O)n1 18107157 ZUPWIBSQWPGFOD-CEXWTWQISA-N 379.460 2.927 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(c3nc(N(C)C)nc4c3CCCC4)C1)CC2 1857674125 SBWMRYHADSUOJM-JOCHJYFZSA-N 394.523 2.710 0 50 GFAA N=c1[nH]c2cc(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)ccc2s1 1857719039 BKHUHCICXFOMQH-UHFFFAOYSA-N 393.472 2.748 0 50 GFAA COc1ccc(-n2nc(-c3ccccn3)nc2[C@H]2CC[C@@H](OC)[C@H](N)C2)cc1 1875248334 LKQSFOKQHMBXNT-POZUXBRTSA-N 379.464 2.948 0 50 GFAA O=C(CCn1ccccc1=O)N1CC[C@H](c2ccc3ccccc3c2)[C@@H](O)C1 210189234 GBFNPVOYHXDEDB-RTWAWAEBSA-N 376.456 2.769 0 50 GFAA Cn1c(CN2CC[C@](C(N)=O)(c3ccccc3)C2)nnc1-c1ccc(Cl)cc1 411967701 NDWOSNWFCCNMMD-OAQYLSRUSA-N 395.894 2.765 0 50 GFAA Cn1ccnc1C[C@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)C1 119985538 GKYKQIIARFBIRK-CQSZACIVSA-N 389.883 2.869 0 50 GFAA O=C(NCC1(c2cccc(Cl)c2)CC1)N1CCC[C@]2(CCS(=O)(=O)C2)C1 333808743 HQYKJEFEZDDDSK-SFHVURJKSA-N 396.940 2.982 0 50 GFAA COc1ccc(OC)c(COC[C@@H](O)CN2C(C)(C)CC(O)CC2(C)C)c1 12384388 AYBGXBXUZIHJMM-KRWDZBQOSA-N 381.513 2.595 0 50 GFAA CCCn1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c(C)n1 1704298899 OIPZHDMEZRZCTD-NRFANRHFSA-N 382.512 2.578 0 50 GFAA C[C@H]1CCCCN1c1cc(C(=O)N2CC[C@@H](NC(=O)CC(F)(F)F)C2)ccn1 1875259078 DBJCEXWVEKKJCT-DZGCQCFKSA-N 398.429 2.744 0 50 GFAA O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1C[C@@H](O)[C@H](C2CC2)C1 1875274738 WXHPWFOYLHRMKI-XJKSGUPXSA-N 376.254 2.682 0 50 GFAA CN(Cc1nc(C(F)(F)F)no1)C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1 1875256001 CCDBFOKULDUSHL-ZDUSSCGKSA-N 396.369 2.742 0 50 GFAA O=C(CCC12CCC(CC1)C2)NS(=O)(=O)c1sccc1C1OCCO1 1875395075 JNUCWCDHIPPUBA-UHFFFAOYSA-N 385.507 2.959 0 50 GFAA CC(C)C[C@@H](CNC(=O)[C@@H](C)n1cncn1)NC(=O)CC1(C)CCCCC1 1875329420 VEWIQNYYRDIUBF-SJORKVTESA-N 377.533 2.847 0 50 GFAA CCCn1ncnc1CNC(=O)CSc1nncn1-c1ccc(C(C)C)cc1 1875312751 SZLSGANXHUIEKN-UHFFFAOYSA-N 399.524 2.801 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)[C@H]3CCCc4n[nH]cc43)CC2)cn1 886055020 GSJWSCNZSLCCMN-RDJZCZTQSA-N 382.512 2.784 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1)c1ccccc1F 972545 YFMOXWXOUKODRG-UHFFFAOYSA-N 394.406 2.736 0 50 GFAA CCOC(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1cn(C)nc1C)CC2 14741609 VYCZXXINLIOIMY-UHFFFAOYSA-N 393.491 2.708 0 50 GFAA Cc1ccc(-c2nn(CC(=O)NC[C@H]3CCCO3)c(=O)c3ccccc23)cc1 1133448 CIIUBGOMDLKOOC-QGZVFWFLSA-N 377.444 2.667 0 50 GFAA COc1cccc(C(=O)C[C@@]2(O)C(=O)Nc3ccc(Br)cc32)c1 1135200 IKFMJNOEASPXEJ-KRWDZBQOSA-N 376.206 2.870 0 50 GFAA biogenic O=C(Cc1c[nH]nc1O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356155831 OGHBSSBPLCPALL-QFIPXVFZSA-N 389.459 2.621 0 50 GFAA O=C(Nc1ccnn1Cc1ccccc1C(F)(F)F)[C@H]1CCn2ncnc2C1 2356161060 DTXRFPORNSQLQT-LBPRGKRZSA-N 390.369 2.743 0 50 GFAA Cc1nnn(C23C[C@H]4C[C@@H](CC(NCCC(=O)Nc5ccccc5C)(C4)C2)C3)n1 102682903 VZLAQNBSEYYHQM-HTAFUYNTSA-N 394.523 2.956 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4ccccc4C)CC3)ncn2)n1 65361924 JWAOFTOVNWULBP-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA NS(=O)(=O)c1c(Br)cc(Br)cc1OC(F)(F)F 36533139 KIJCLGJIYPEWMQ-UHFFFAOYSA-N 398.982 2.758 0 50 GFAA O=C([C@H]1CCCN(C2CCN(C/C=C/c3ccccc3)CC2)C1)N1CCOCC1 67878151 QJECUACMGYWSIW-OIHWHRODSA-N 397.563 2.735 0 50 GFAA Cc1cccc(S(=O)(=O)CCCn2nc(C)c([C@@H]3COCCN3C)c2C)c1 1327943777 BZUIPICCQVXSME-IBGZPJMESA-N 391.537 2.675 0 50 GFAA CCCOC(=O)c1c(NC(=O)c2ccnn2C)sc(C(=O)OCC)c1C 2730369 ZLFGXOJJCJGVKN-UHFFFAOYSA-N 379.438 2.786 0 50 GFAA COc1ccc([C@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)cc1 10232634 KCOXGAOXTDQURU-KRWDZBQOSA-N 391.366 2.678 0 50 GFAA Cn1ccnc1[C@H](O)c1cc2n(n1)CCN(Cc1ccc(F)c(Cl)c1)C2 219587006 QKBPGAHIPNFGEQ-QGZVFWFLSA-N 375.835 2.507 0 50 GFAA CN1C(=O)[C@](CC(=O)NCc2cnn(C)c2)(Cc2ccccc2)c2ccccc21 71774867 OGTZRXGVSXEGBX-QHCPKHFHSA-N 388.471 2.584 0 50 GFAA CCS(=O)(=O)c1ccc(N2CCC(Nc3ncnc4[nH]ccc34)CC2)cc1 361816633 WJAINYMZPUPJIO-UHFFFAOYSA-N 385.493 2.832 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NCc1ccnc(N2CCCC2)c1 363096164 ZBDQKSWLMGBSTP-NRFANRHFSA-N 392.503 2.834 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)[C@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)n[nH]1 155859629 LKURDPHMCWAZIQ-ZLUUGNSVSA-N 398.551 2.973 0 50 GFAA CNc1nc(C)cc(N2CC[C@@H]3[C@@H](CCC(=O)N3CCc3ccccc3)C2)n1 72428390 ZOZYQFNIDNWFOB-RBUKOAKNSA-N 379.508 2.887 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)N1CCC[C@H](N2CCCC2)CC1 157680377 VWLHEMJOIAFPHU-IBGZPJMESA-N 384.524 2.626 0 50 GFAA NC(=O)C1(C(=O)N2CCC[C@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)CC1 72156719 LUZDXZAPWQROFH-INIZCTEOSA-N 376.456 2.625 0 50 GFAA O=C(NC[C@@H]1CCCCN1C(=O)c1cc2ccccc2[nH]c1=O)c1ccccc1 174592891 UUQHPQFOSCBICZ-SFHVURJKSA-N 389.455 2.953 0 50 GFAA O=C(N1CCOC[C@H]1c1nc(-c2ccccc2)no1)C(F)(F)C1(O)CCCC1 285808918 DRLFGPAEOHWZDB-AWEZNQCLSA-N 393.390 2.577 0 50 GFAA O=C(COc1cccc(F)c1)NCc1cc2n(n1)CCN(C1CCCCC1)C2 82097345 VLSXZDLVKLPGTE-UHFFFAOYSA-N 386.471 2.866 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC 44851786 DHHUUCMDMCHRGX-UHFFFAOYSA-N 398.503 2.899 0 50 GFAA CC(C)[C@@H](NC(=O)c1nn(C)c(=O)c2ccccc12)c1nc2ccccc2n1C 223238959 DAGYCVGXGNDPKK-GOSISDBHSA-N 389.459 2.947 0 50 GFAA Cn1cnnc1CN1CCCC[C@@H]1C(=O)Nc1ccc(Oc2cccnc2)cc1 95521701 WIBWMIRVKRZDRH-LJQANCHMSA-N 392.463 2.996 0 50 GFAA CNc1cc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95363850 CEGZJOSWOALEDJ-KSEOMHKRSA-N 392.503 2.834 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCCN(C)C)csc2C1 426370528 QWHVJAXTSVHLKR-UHFFFAOYSA-N 376.526 2.593 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N1CCO[C@@H](Cc2ccccc2)C1 180520797 VPCFCJSWNFOWRG-HNNXBMFYSA-N 395.381 2.886 0 50 GFAA O=C(CN1CCN(Cc2ccc(F)cc2Cl)CC1)NCc1ccccc1 97972169 BCEMUFJIKMWTQQ-UHFFFAOYSA-N 375.875 2.913 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@H](C)O)C3)CC2)ccc1Cl 92061513 RJTHRZJSQFSESV-HNNXBMFYSA-N 378.900 2.874 0 50 GFAA O=C(O)[C@H]1CC[C@H](CNS(=O)(=O)c2ccc(Br)cc2)CC1 245283688 OEXAASQOHMSUSV-XYPYZODXSA-N 376.272 2.618 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)Nc2nccs2)c1)N1CCC[C@@H]1CF 296786348 IAVHXCLDBIUTNT-GFCCVEGCSA-N 384.458 2.910 0 50 GFAA CC(C)c1nc(CCNC(=O)c2ccc(C(=O)N3CCOCC3)cc2)cs1 244816953 SRRUAFRYVLFODT-UHFFFAOYSA-N 387.505 2.711 0 50 GFAA CCCn1cc(C(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)cn1 182647008 DJRBZGSIBXLJDO-UHFFFAOYSA-N 384.480 2.726 0 50 GFAA COc1cccc(CN2CCC[C@H](n3cc(C(=O)N4CCCCC4)nn3)C2)c1 299780646 BDGQWLPHICLSPC-SFHVURJKSA-N 383.496 2.750 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)Nc1n[nH]c(C3CCC3)n1)CC2 184571760 MOOUMDUIENPSKS-JTQLQIEISA-N 380.374 2.933 0 50 GFAA O=C(NCCCc1nc2ccc(F)cc2[nH]1)N1CCN(c2ccncc2)CC1 534658779 JVLGYKCOUPTOAK-UHFFFAOYSA-N 382.443 2.561 0 50 GFAA O=C(NCC1CCN(Cc2cnc(C3CCCCC3)nc2)CC1)[C@@H]1CCOC1 827778545 HZYFYRKPJRCUMX-HXUWFJFHSA-N 386.540 2.889 0 50 GFAA Cc1noc(C)c1C(=O)NCC1CCN(Cc2cnc(-c3ccco3)nc2)CC1 828135320 JZTHWCDHZTZGNU-UHFFFAOYSA-N 395.463 2.983 0 50 GFAA O=C(CN1CCCCCC1)N1CCC(N2CCN(Cc3ccccc3)CC2)CC1 952864842 MJWSYSDKQVGPCJ-UHFFFAOYSA-N 398.595 2.671 0 50 GFAA CN(Cc1ccn(C)n1)C(=O)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1472340776 WXIAEBRBHSAJBJ-UHFFFAOYSA-N 379.342 2.981 0 50 GFAA COc1ccc(CCNC(=O)CN2CCCN(Cc3ccccc3F)CC2)cc1 1506417294 ICQDIYKJSAEIBN-UHFFFAOYSA-N 399.510 2.701 0 50 GFAA CN1C[C@@H](C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)Oc2ccccc21 1506425293 FFSNNPYWZKUPPE-IBGZPJMESA-N 393.447 2.705 0 50 GFAA Cc1ncc(CN(CCO)C(=O)[C@@H](C)n2c(CC(C)C)nc3ccccc32)[nH]1 1704309748 RYCCWNMKHJXPON-OAHLLOKOSA-N 383.496 2.848 0 50 GFAA c1ccc(-c2ncc3c(n2)[C@]2(CCCN(CCN4CCOCC4)C2)CC3)cc1 1704336126 GGNAMOJMGRAXMT-HSZRJFAPSA-N 378.520 2.756 0 50 GFAA O=c1nc(O)c2ccc(-c3ccccc3O)nc2n1Cc1ccc2c(c1)OCO2 1848443230 ZTJXAFCTQMNOJK-UHFFFAOYSA-N 389.367 2.647 0 50 GFAA Cc1c(Cl)cccc1NC(=O)C[C@H]1Cn2nc(-c3ccncc3)nc2NC1=O 1848442475 WYIRHSCXHFQBGL-ZDUSSCGKSA-N 396.838 2.899 0 50 GFAA COc1ccccc1-n1cc(CN2CCCN(C(=O)c3ccccn3)CC2)cn1 1772806197 VSANYQZZLBBGCG-UHFFFAOYSA-N 391.475 2.624 0 50 GFAA CN1C[C@H](CN2CCC(C(=O)NCc3ccccc3Cl)CC2)CCC1=O 1772817357 NGLDBFNOGQMTTK-OAHLLOKOSA-N 377.916 2.537 0 50 GFAA Cc1cccc(N2CCN(S(=O)(=O)c3ccc(N4CCCC4=O)cc3)CC2)c1 11907598 CLYSLXIFBYVLJK-UHFFFAOYSA-N 399.516 2.633 0 50 GFAA O=C(NCCCn1nnc2ccccc21)[C@@H]1CC(Cc2cccc(Cl)c2)=NO1 12167865 GFJYXKQOKAZNTO-IBGZPJMESA-N 397.866 2.979 0 50 GFAA Cc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)o1 12581608 YEXNTDNBBJUXOU-KRWDZBQOSA-N 386.496 2.589 0 50 GFAA Cn1cc(CNc2ccc(C(=O)N3CCCC[C@H]3CCn3cccn3)cn2)cn1 15062530 WTBHFWFIDWVYJO-IBGZPJMESA-N 393.495 2.709 0 50 GFAA Cc1cc(Br)cc(C)c1NC(=O)CSc1nc(O)cc(=O)[nH]1 16475222 VBNVLGWGYSPAEI-UHFFFAOYSA-N 384.255 2.586 0 50 GFAA O=C(c1coc(CN2CCN(C/C=C/c3ccccc3)CC2)n1)N1CCCC1 19219725 ANQGOQIBXBUDON-RMKNXTFCSA-N 380.492 2.742 0 50 GFAA COc1ccccc1CNC(=O)c1cc2c(N3CCSCC3)nc(C)cn2n1 169768814 DSEDYZQIXKEHKL-UHFFFAOYSA-N 397.504 2.530 0 50 GFAA O=C(NC1CCC1)[C@H]1CC[C@H]2OCCN(C(=O)CCc3ccccc3F)[C@@H]2C1 1875243579 NJCKRRRWZLYRSL-PWIZWCRZSA-N 388.483 2.823 0 50 GFAA C[C@@H](CN1CCOCC1)NC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 111456337 XNNJGVNPMPUZRC-HNNXBMFYSA-N 388.487 2.917 0 50 GFAA CC(C)[C@H](CNC(=O)c1cnc(-c2ccccc2F)s1)N1CCN(C)CC1 112914629 AXNMOFHBIACULO-KRWDZBQOSA-N 390.528 2.951 0 50 GFAA CC[C@H](O)CN1CCN(CC(=O)Nc2ccccc2Oc2ccccc2)CC1 118858520 WYDSILAZXVIVFH-SFHVURJKSA-N 383.492 2.806 0 50 GFAA COc1ccc(CCNC(=O)N2C[C@@H](C)OC3(CCOCC3)C2)c(Cl)c1 447950045 DZDOSOORUUZXTQ-CQSZACIVSA-N 382.888 2.871 0 50 GFAA O=S(=O)(c1cc(F)ccc1OCC1CC1)N1CCCc2ccnc(O)c21 952845289 VASXZRYUZMJVGA-UHFFFAOYSA-N 378.425 2.857 0 50 GFAA O=C(O)[C@@H]1C[C@H](O)CN1C(=O)CCc1c(-c2ccccc2)[nH]c2ccccc12 1875312972 DUZANTULFOFQDE-KXBFYZLASA-N 378.428 2.814 0 50 GFAA COCc1nc(=O)c2c(C)c(C(=O)Nc3ccc(C4(CO)CC4)cc3)sc2[nH]1 1875335101 SHZOJHFIRHHJTG-UHFFFAOYSA-N 399.472 2.716 0 50 GFAA Cc1cccc2c1C(=O)N(C)[C@@H](c1ccc(OCCN3CCOCC3)cc1)N2 888095841 HYLBKEVXCFLDJM-NRFANRHFSA-N 381.476 2.902 0 50 GFAA O=C(c1cnc2ccccc2n1)N1CCc2nc(Cc3ccccc3)nn2CC1 2100545270 MHEWOZCAHPRDJA-UHFFFAOYSA-N 384.443 2.511 0 50 GFAA CCN(CC)Cc1cc(C(=O)N2C[C@H]3COC[C@@]3(CO)C2)c(-c2ccccc2)o1 2100556398 MGVFMYPDAIEVQW-MBSDFSHPSA-N 398.503 2.869 0 50 GFAA CCOC(=O)Cc1ccccc1CCOC(=O)C[C@@H]1Oc2ccccc2NC1=O 2325737707 JZKWLFSGOQXMCF-IBGZPJMESA-N 397.427 2.668 0 50 GFAA CC(C)S(=O)(=O)CC[C@@H]1N=C([C@H]2CCOC2)c2ccc(Cl)cc2NC1=O 2325796285 GLGOCGALWNVTFC-WFASDCNBSA-N 398.912 2.700 0 50 GFAA O=C(NCC1(NC(=O)[C@@H]2C[C@@H]2F)CC1)c1cccc(Cl)c1Br 2325829798 SMQHCWMXZLYUMA-KOLCDFICSA-N 389.652 2.839 0 50 GFAA Cc1ccc(Nc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccccc2)cc1 638238 KAPVKPPTBLWBKT-UHFFFAOYSA-N 375.432 2.534 0 50 GFAA biogenic O=S(=O)(c1ccc(-c2csc(-c3cccnc3)n2)cc1)N1CCOCC1 1122411 SIUNNPDZIMVPSN-UHFFFAOYSA-N 387.486 2.893 0 50 GFAA Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)c1 1230419 QXFBNYRJWLNRHC-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O)c1ccc(F)cc1 2863549 PNUJUPQISZAOIL-MRXNPFEDSA-N 387.333 2.699 0 50 GFAA O=C(OCc1conc1C(F)(F)F)[C@@H](c1ccccc1F)N1CCOCC1 225858450 NZQCREOATFBVGK-CQSZACIVSA-N 388.317 2.949 0 50 GFAA COC(=O)c1ccc(CN(C)Cc2nnc(SCc3ccncc3)n2C)cc1 55357901 UURPOJAIKTVYHO-UHFFFAOYSA-N 397.504 2.921 0 50 GFAA CCc1nnc(NC(=O)CN2CCN(c3cc(Cl)ccc3C)CC2)s1 20213862 ABYVZZLPSPJYBJ-UHFFFAOYSA-N 379.917 2.823 0 50 GFAA O=C(NCC(=O)N1CCN(Cc2ccccc2)CC1)c1cc2ccccc2o1 20426456 UKWDEZQTIDDDSP-UHFFFAOYSA-N 377.444 2.507 0 50 GFAA COc1cccc(CN(C)C2CCCCC2)c1OC[C@H](O)CN1CCOCC1 39371736 SZPPXEZYQUSNOD-HXUWFJFHSA-N 392.540 2.532 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1cnn(Cc2cccc(C(F)(F)F)c2)c1 2805042 DMFSHGDUNNUPCX-UHFFFAOYSA-N 399.398 2.793 0 50 GFAA COC(=O)c1coc(CN2CCC[C@@]3(CCC(=O)N(C4CCCC4)C3)C2)n1 77440179 QPPFTLGRJMKQGF-HXUWFJFHSA-N 375.469 2.608 0 50 GFAA C[C@H](CO)N1CCCN(Cc2coc(-c3ccc(Br)cc3)n2)CC1 364900001 XXLAWTGHFQZKFI-CQSZACIVSA-N 394.313 2.993 0 50 GFAA COc1cccc(C[C@@H]2CN(C(=O)c3ccc(Cn4ccnc4)o3)CCO2)c1 71761954 QBRZRZPELPBWTE-LJQANCHMSA-N 381.432 2.617 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCc2cn[nH]c2)(Cc2ccccc2)c2ccccc21 71775677 VMQPNKFJNQIZQL-QHCPKHFHSA-N 388.471 2.616 0 50 GFAA O=S1(=O)CCC[C@@H](CS(=O)(=O)N2CCC[C@H]2CCC2CCCCC2)C1 333375399 DUITZYXTVRHPOW-MSOLQXFVSA-N 391.599 2.966 0 50 GFAA c1ccc(OCCN2CCN(Cc3cnc(-c4ccccn4)nc3)CC2)cc1 72425746 CKFSSFZLOURJTA-UHFFFAOYSA-N 375.476 2.735 0 50 GFAA COc1ccc(C)cc1CCNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 172701036 YGXCQILYGOPDKG-OAQYLSRUSA-N 386.467 2.875 0 50 GFAA CSCCCN1C(=O)CC[C@H]2CN(C(=O)c3cccc(C)c3O)CC[C@H]21 72424043 MJSPTCWWDQLMSV-DOTOQJQBSA-N 376.522 2.907 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H]2CN2CCOCC2)cnn1-c1ccccc1Cl 174491133 FARBPAQNJMCAFG-MRXNPFEDSA-N 388.899 2.771 0 50 GFAA O=C([C@H]1CCCN1Cc1ccccc1)N1CCn2c(nnc2-c2ccccc2)C1 175557352 XDFYNOOYKNJZJZ-HXUWFJFHSA-N 387.487 2.952 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c(C(=O)OC)c1C 17080798 OZSUIVWESWOGIQ-WDEREUQCSA-N 395.433 2.625 0 50 GFAA Cc1c(C(F)(F)F)nn(C)c1NC(=O)N1CCC[C@@H](c2nnc3n2CCC3)C1 287624190 PTUUNTASIBCTJP-LLVKDONJSA-N 397.405 2.697 0 50 GFAA CN(C)CCN(Cc1ccsc1)C(=O)c1ccc(-c2cnc(N)cn2)cc1 426404197 HCHQSKBBSAGMMF-UHFFFAOYSA-N 381.505 2.991 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1 46506905 BVFWQIVKWBKWTK-KRWDZBQOSA-N 375.446 2.900 0 50 GFAA CCc1oc(C(N)=O)cc1CN1CC[C@]2(OC)CC[C@H](OCC3CC3)C[C@H]12 426505878 RWNWKJPFWGTKKG-NBHGPNQESA-N 376.497 2.880 0 50 GFAA CO[C@@H]1CCCN(C(=O)c2ccc(-n3ncc(C(=O)O)c3C(F)(F)F)cc2)C1 177953585 BATDLEPQKHMBCB-CYBMUJFWSA-N 397.353 2.840 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2)c1 426494309 CXDFWBLLOYPIQI-UHFFFAOYSA-N 378.476 2.805 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4cnc(C)cn4)C3)C2)cn1 91391187 AVSIJVULTOUWGF-QFIPXVFZSA-N 393.491 2.533 0 50 GFAA CCc1c(C)cc(-c2nc(-c3c[nH]c4ccccc34)nn2CCO)c(=O)n1C 96153821 ANRHQSASZGSDND-UHFFFAOYSA-N 377.448 2.655 0 50 GFAA COc1cc(OC)nc(N2CCC(c3nccn3Cc3cccnc3)CC2)n1 95522655 UEDBGIWKTSXFJJ-UHFFFAOYSA-N 380.452 2.518 0 50 GFAA Cc1cccn2cc(C(=O)N[C@@H](c3ccc4c(c3)CCO4)[C@H]3C[C@@H](O)C3)nc12 244898839 ZCLRQLRRWOTEMG-QKLQHJQFSA-N 377.444 2.820 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)CO[C@H]2CCC[C@H](C)C2)cc1OC 299741685 ADIJIUFUQBNASN-BPUTZDHNSA-N 379.453 2.931 0 50 GFAA CN(C)C(=O)Cc1ccccc1NC(=O)NCC[C@@H]1COc2ccccc2O1 299797536 NDPMCMHRHSNVHM-MRXNPFEDSA-N 383.448 2.669 0 50 GFAA O=C(CCC(=O)N1CCC[C@@H](c2nnc3ccccn23)C1)Nc1cccc(F)c1 952860612 QJHFYLZGARXHFN-OAHLLOKOSA-N 395.438 2.993 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@@H](c1ccccc1)N1CCCN(C=O)CC1 273003118 UWZCBQUAIQJOQG-OAQYLSRUSA-N 381.476 2.848 0 50 GFAA CC(C)[C@@H](Nc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1)c1ccccc1 276068129 LUUJVAMMLNUWAX-LJQANCHMSA-N 387.505 2.761 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3nc4c(s3)CCCC4)CC2=O)cc1 1506398577 FCXZSQLMPMHRGV-UHFFFAOYSA-N 385.489 2.515 0 50 GFAA CNc1ncccc1C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704303247 XLOXELGREIUVSY-UHFFFAOYSA-N 397.475 2.845 0 50 GFAA COc1cccc(N2C[C@H](Nc3cc(C(=O)N4CCCCC4)ccn3)CC2=O)c1 1704336974 OEBZIRCJKFBCQB-QGZVFWFLSA-N 394.475 2.934 0 50 GFAA CCN(C)CCN(C)C(=O)c1c(N(C)C)noc1-c1ccc(F)c(OC)c1 1704302828 BXXDKPNCFRJURI-UHFFFAOYSA-N 378.448 2.579 0 50 GFAA O=C(CN1C(=O)c2cccc3cccc(c23)C1=O)OCc1ccc2c(c1)OCO2 5027525 NEGKSKWCJMLOHA-UHFFFAOYSA-N 389.363 2.908 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@@H](CNC(=O)c2cc(C)nn2C)C3)n1 11995245 YREHTSNMDVNFCD-CQSZACIVSA-N 395.438 2.675 0 50 GFAA O=C1NC(=O)[C@](Cc2ccccc2F)(C2CCN(Cc3ccccc3)CC2)N1 11999545 ITRHXSAECDOEAT-QFIPXVFZSA-N 381.451 2.859 0 50 GFAA COC[C@H](C)NC(=O)c1sc2ncnc(NCCc3ccccn3)c2c1C 12152062 HPHAHKAFQSTENK-LBPRGKRZSA-N 385.493 2.814 0 50 GFAA COc1ccccc1C(=O)Nc1ccc2c(c1)CN(C(=O)c1csnn1)CC2 12200419 XKYBIKRYARXURD-UHFFFAOYSA-N 394.456 2.998 0 50 GFAA CCOC(=O)[C@@]1(CCOc2ccccc2)CCCN(C(=O)c2ccc[n+]([O-])c2)C1 12459798 AJGGESKXOSATIT-JOCHJYFZSA-N 398.459 2.575 0 50 GFAA Cc1cccc(CC(=O)N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c1 14980926 BUICWEUWNMVLKF-IBGZPJMESA-N 383.536 2.519 0 50 GFAA O=C(CCN1CCCCO1)N1CCc2onc(-c3ccc(F)c(F)c3)c2C1 15079733 MJGHLZVKWRJATA-UHFFFAOYSA-N 377.391 2.922 0 50 GFAA CCNC(=O)c1nn(CC2CC2)c2c1CN(C(=O)c1ccc3[nH]ccc3c1)CC2 19885115 KOEQGPLCWGKBHP-UHFFFAOYSA-N 391.475 2.723 0 50 GFAA O=C(O)Cn1cc(C=C(Cl)c2nc(O)c3c4c(sc3n2)CCCC4)nn1 1857530194 SYVVACJNLHTONF-UHFFFAOYSA-N 391.840 2.689 0 50 GFAA O=C(c1ccc(-c2ccc(F)cc2)cc1)N1CC[C@H](O)[C@@]2(CCCNC2=O)C1 1857686268 OGTJEWAEVOVFPF-SIKLNZKXSA-N 382.435 2.596 0 50 GFAA COCCc1noc(CN2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)n1 1857699963 GPBMWTXSBZZYTB-QZTJIDSGSA-N 387.480 2.506 0 50 GFAA O=C1CCOC2(CCN(c3cc(C4CC4)ncn3)CC2)CN1Cc1nccs1 1857708492 WXDCYCHYNOELGA-UHFFFAOYSA-N 399.520 2.599 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cnc(-c4cccnc4)nc3C)CC2)O1 1875245796 RWXAZGVUCVTGNL-MSOLQXFVSA-N 396.491 2.772 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(F)cc4)[C@H]4CC[C@]3(C2)O4)nc1 1875247466 WNWLCHQIZVKEJL-JZJXAQOMSA-N 381.451 2.943 0 50 GFAA CCN(C(=O)c1coc(COc2ccc3c(c2)OCO3)n1)[C@H]1CCCC[C@@H]1O 212720756 MLMGPYYRQJIWMC-HOTGVXAUSA-N 388.420 2.748 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC[C@H](c2nccs2)C1 114741471 VYVUWOSTKHEOFS-ZDUSSCGKSA-N 380.491 2.873 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328620365 GYCKSAJJGSTZCK-IBGZPJMESA-N 377.448 2.772 0 50 GFAA COC(=O)[C@@H](NC(=O)CCc1c[nH]c2ccccc12)c1ccc(OC)c(O)c1 474576823 HYKSUBZXBWUFNM-FQEVSTJZSA-N 382.416 2.845 0 50 GFAA COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](c1cccs1)C1(CO)CCC1)C2 855116478 HCOJKIUQIJKVAP-IVSAIRAKSA-N 392.521 2.935 0 50 GFAA COC(=O)[C@@H](CCc1ccc(OC)cc1)NC(=O)c1ccc(C2(CN)CC2)cc1 1875317631 GDJLJTJLAVOGNE-HXUWFJFHSA-N 396.487 2.590 0 50 GFAA O=C(Cc1ccccc1OC1CCCC1)N1CCC(n2ccc(O)nc2=O)CC1 1875310315 MIAWCPDPMVLKDN-UHFFFAOYSA-N 397.475 2.677 0 50 GFAA CN1C(=O)N[C@](C)(c2ccc(NS(=O)(=O)c3ccsc3Cl)cc2)C1=O 1875316903 HTJBMZJCFICEHO-OAHLLOKOSA-N 399.881 2.599 0 50 GFAA O=C1C[C@@H](c2ccccc2)S(=O)(=O)N1C[C@@H]1OC(=O)C2(CCC2)C12CCC2 1875392093 RVUBXBIFMGFOAJ-HOTGVXAUSA-N 389.473 2.556 0 50 GFAA Cc1cc2c(cc(C(=O)N3Cc4nc(O)nc(O)c4C3)n2CC(F)(F)F)s1 1875302289 JBMAWLAKMVIBCB-UHFFFAOYSA-N 398.366 2.931 0 50 GFAA Cn1nc2c(c1NC(=O)C[C@H](CN)c1ccc(Br)s1)CCC2 2325768326 FLJRXQMYEBFQKT-SECBINFHSA-N 383.315 2.804 0 50 GFAA Cc1c(C(=O)N2CCN[C@@H](C)C2)sc2nc(Cc3ccccc3)nc(N)c12 2325795239 SCLJEGJUZHJQKD-LBPRGKRZSA-N 381.505 2.607 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1occc1-c1ccc(F)c(F)c1 2325800238 ZEJMQWIOCJBQMS-NXOUGTEYSA-N 387.386 2.991 0 50 GFAA C[C@H](CCc1ccccc1F)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 874889938 QVXBWNBAWXYXHM-GFCCVEGCSA-N 390.436 2.759 0 50 GFAA CCc1ccc(NC(=O)COc2ccc(S(=O)(=O)NC(C)C)cc2)cc1 1119351 UPAWLEWUZWZBRF-UHFFFAOYSA-N 376.478 2.953 0 50 GFAA NC(=O)CSc1oc(-c2ccc(F)cc2)nc1S(=O)(=O)c1ccccc1 2460994 QFGVILPHCQZKOJ-UHFFFAOYSA-N 392.433 2.891 0 50 GFAA CCCCc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)cc1 2760549 HGCSTPUTWFHMMU-UHFFFAOYSA-N 376.478 2.769 0 50 GFAA C[C@@H]1OC[C@H]2O[C@@H](O)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2O1 3956777 BALYQVSNDKYQHO-SHIYXCHUSA-N 386.444 2.636 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)Nc2cccc(SC)c2)nc1N 4820584 YGKKEBFIVCWQCV-UHFFFAOYSA-N 378.479 2.688 0 50 GFAA OCC[C@@H]1CN(Cc2cccc(-n3cccn3)c2)CCN1Cc1ccccc1 20997216 CBEJDQANZKCNQB-HSZRJFAPSA-N 376.504 2.941 0 50 GFAA COc1ccc(CNC(=O)Cn2nc(-c3ccc(Cl)cc3)ccc2=O)cc1 61718236 SEPVRHMZNQHVKN-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CCc4c(c(C(=O)O)nn4C)C3)coc2c1C 67956392 GUTZLWKIKLGVHU-UHFFFAOYSA-N 381.432 2.917 0 50 GFAA O=C(NCCCn1cccn1)c1cc(COc2cccc3cnccc23)on1 67908969 XTILROOQRLVATO-UHFFFAOYSA-N 377.404 2.818 0 50 GFAA Cc1ccc2nc(C)cc(C(=O)N3CCC[C@H](Cn4cc(C(=O)O)nn4)C3)c2c1 67805587 WUSMBLFWMQYPER-HNNXBMFYSA-N 393.447 2.694 0 50 GFAA Cc1cc(CNC[C@]2(O)CCCN(CCCc3ccccc3)C2=O)cnc1C 67947936 KPFJNAZCYIOHEY-HSZRJFAPSA-N 381.520 2.774 0 50 GFAA CN(Cc1cnc(S(=O)(=O)CC2CC2)n1CC1CCCCC1)[C@H]1CCOC1 20878048 QXQSBBXEVQWHHT-SFHVURJKSA-N 395.569 2.868 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(-c3cccc(CO)c3)nc2)CC1 67967920 MIVNTYYFCQEDAL-UHFFFAOYSA-N 393.487 2.716 0 50 GFAA CN(Cc1c(F)cccc1Cl)S(=O)(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 153361432 GFQIIPWDTGTLMN-VQISRLSMSA-N 376.881 2.559 0 50 GFAA O=S(=O)(c1cnc2n1CCC2)N1CCC(c2noc3cc(F)ccc23)CC1 329455622 PVLQOYPJHSZBTK-UHFFFAOYSA-N 390.440 2.678 0 50 GFAA CC(C)N1CCN(c2ccc(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc2)CC1 363201237 YEJCIDAABRRVFO-OAQYLSRUSA-N 397.523 2.845 0 50 GFAA CCOc1ccc(-n2ccc3c(cnc4c(C(=O)OC)c(C)nn43)c2=O)cc1 71375512 ZECPNAQZFRXEQY-UHFFFAOYSA-N 378.388 2.527 0 50 GFAA CC(C)[C@@H]1CN(CC(=O)Nc2cnn(C)c2)CCCN1Cc1ccc(F)cc1 71765061 NSBKORAZNABBBG-FQEVSTJZSA-N 387.503 2.730 0 50 GFAA O=C(Cc1ccccc1Cl)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 77504605 FMHPCYAWJAVJNM-UHFFFAOYSA-N 380.835 2.613 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1ccc(C(=O)O)cc1)CC2 237828185 CLVCYHAEPNRUMT-CYBMUJFWSA-N 393.365 2.923 0 50 GFAA Cc1ccn(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n1 71440367 MFMSBRRZDFNCIA-IBGZPJMESA-N 386.471 2.616 0 50 GFAA COc1ccc(NC(=O)N2CCC[C@H](CN3CCCC3=O)C2)cc1NC(C)=O 96164782 VPSJQHBXCQVGED-OAHLLOKOSA-N 388.468 2.520 0 50 GFAA O=C([C@@H]1CCCN2CCCC[C@H]12)N1CCC2(CC1)Nc1ccccc1NC2=O 91829514 JPFLORBMKWOMJO-VQIMIIECSA-N 382.508 2.676 0 50 GFAA Cc1c(NC(=O)CN(C)C)cccc1NC(=O)N(C)CC[C@H]1CCCCO1 96141924 HAUCWIBFMDJSAU-MRXNPFEDSA-N 376.501 2.918 0 50 GFAA CCN(C(=O)c1ccc(NC(=O)N2CCOC[C@H]2CO)cc1)c1ccccc1 95527391 SOMUJLYWZCHUKW-LJQANCHMSA-N 383.448 2.578 0 50 GFAA COc1ncccc1C(=O)N1CCC(c2nccn2Cc2cscn2)CC1 95498711 JDSZQQTZHWDOKO-UHFFFAOYSA-N 383.477 2.811 0 50 GFAA CC(C)c1ccc(N(CN2C(=O)CSC2=O)CN2C(=O)CSC2=O)cc1 334163569 XLOJLOPGABODAQ-UHFFFAOYSA-N 393.490 2.922 0 50 GFAA COc1ccc(-c2n[nH]c(C)c2CC(=O)N[C@@H](C(=O)O)c2ccccc2)cc1 334160687 JWCLYVRLQHFHLI-HXUWFJFHSA-N 379.416 2.878 0 50 GFAA CC(C)c1nc(CN2CCC3(CC2)CN(Cc2ccc(CO)o2)CCO3)co1 828827020 FFLLWRVOSMNQEY-UHFFFAOYSA-N 389.496 2.750 0 50 GFAA Cc1cc(C(=O)NCC2CCN(C(=O)[C@@H](O)c3ccc(F)cc3)CC2)c(C)o1 952990854 IXFQUDIVLDZXSO-IBGZPJMESA-N 388.439 2.738 0 50 GFAA COc1nccnc1N1CCC[C@H](CNC(=O)c2ccnc3ccccc23)C1 952974316 UANRJQMBZUNJKB-OAHLLOKOSA-N 377.448 2.680 0 50 GFAA COc1cccc(NC(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)c1 1565525419 ZFAYTPMIGHQNFE-QAPCUYQASA-N 380.448 2.859 0 50 GFAA Cc1ccc(CNc2ncnc(-n3cccn3)c2N)c(OC[C@@H]2CCCO2)c1 301772130 FZLYORNTGCVNGZ-INIZCTEOSA-N 380.452 2.723 0 50 GFAA CC1(C)CN(C(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)CCN1CCO 170086721 HAFJQOLPZAPLJV-UHFFFAOYSA-N 397.306 2.708 0 50 GFAA CCN1CCCN(C(=O)c2nn(-c3ccc(C)cc3F)c3c2CCC3)CC1=O 190473680 DPULJGJIIIGVJQ-UHFFFAOYSA-N 384.455 2.503 0 50 GFAA CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)C(C)(C)NC(=O)c1cccs1 1506419880 ZMRFBRSZEWHXJO-KRWDZBQOSA-N 385.533 2.772 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H]2CCCCN2C)ccc1F 1704335937 IKEVGPSGMDRYFQ-CQSZACIVSA-N 390.459 2.769 0 50 GFAA CO[C@@H]1CCC[C@]12CCCN(C(=O)CN(c1cccc(C)c1)S(C)(=O)=O)C2 1704337734 CIZAQFXFHGLZFD-UYAOXDASSA-N 394.537 2.569 0 50 GFAA CCCN1CC[C@H](NC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704309009 VBTPKZDQANJFPV-AWEZNQCLSA-N 390.459 2.769 0 50 GFAA CN(C)CC1(CO)CCN(S(=O)(=O)c2ccc(-c3ccccc3)cc2)CC1 1772707703 XQSFMCHWHUUHBF-UHFFFAOYSA-N 388.533 2.678 0 50 GFAA O=C(CCn1cnnn1)N1CCC[C@H](CCc2cccc(C(F)(F)F)c2)C1 11771687 SXMARKRBCFOFBQ-OAHLLOKOSA-N 381.402 2.953 0 50 GFAA COc1cccc(OCc2cc(C(=O)NC[C@H](C)Oc3cccnc3)no2)c1 11934998 QKUJEVJUOHCYIX-AWEZNQCLSA-N 383.404 2.855 0 50 GFAA CN(Cc1ccccc1)Cc1cc(C(=O)NCc2cnc3ccccn23)no1 11936494 ZPEZZCVTWXOXLI-UHFFFAOYSA-N 375.432 2.884 0 50 GFAA CC1CCN(C(=O)[C@@H]2CC(=O)c3sc(NC(=O)c4ccco4)nc3C2)CC1 12100185 LIZJULQNPXCXKX-LBPRGKRZSA-N 387.461 2.992 0 50 GFAA O=C1NCCN(Cc2ccc(-c3ccccc3)cc2)[C@@H]1CC(=O)N1CCCC1 12752714 YMWBQMJVMGZJNB-OAQYLSRUSA-N 377.488 2.667 0 50 GFAA OC[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1cnc(N2CCOCC2)s1 1857678992 PHTWCDZYMOBLPZ-DWLFOUALSA-N 399.560 2.938 0 50 GFAA Cc1cc(C)c(CNC(=O)[C@H]2CC(=O)N(c3nc4ccccc4s3)C2)cn1 1857722310 GSQDTYLFVKXNJU-AWEZNQCLSA-N 380.473 2.977 0 50 GFAA O=C([C@H]1CCOC1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857724171 OMAJGQZBLDXKPR-INIZCTEOSA-N 379.460 2.692 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)Cc4ccccc4)[C@H]4CC[C@]3(C2)O4)nc1 1875245359 WLLKRZLBZHFHAC-DZCCDHAISA-N 377.488 2.733 0 50 GFAA CCN(C)C(=O)[C@H]1CC[C@@H](NC(=O)c2cc(C3CC3)nc3ccccc23)[C@H](O)C1 1875247412 VGGCBRIVUBUVQV-NYSBEXSLSA-N 395.503 2.850 0 50 GFAA Cc1cc(F)cc2c1CN(C[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)CC2 800472653 WZLNTINERUFMIV-HXUWFJFHSA-N 377.481 2.803 0 50 GFAA C[C@]1(O)CCOC2(CCN(S(=O)(=O)c3cc4ccccc4s3)CC2)C1 1704345106 VYTHOKHKFLEOPH-KRWDZBQOSA-N 381.519 2.986 0 50 GFAA C[C@@H](NC(=O)NCC(=O)NCc1ccccn1)c1cccc(C(F)(F)F)c1 1875258338 NZQHSKXXIVMLQS-GFCCVEGCSA-N 380.370 2.777 0 50 GFAA COc1ccc(CN2C(=O)[C@@]34CC[C@@]3(CN(Cc3ccccc3)C4)C2=O)cc1 1875287671 UFISKFQKTYXRFN-ZRZAMGCNSA-N 376.456 2.846 0 50 GFAA CCc1nc(CN2CCC[C@H](Nc3ncnc(-c4cccc(F)c4)n3)C2)no1 1875269989 PGPSPOSHQJKJRF-HNNXBMFYSA-N 383.431 2.700 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@@H]2C[C@]23CCOc2ccccc23)c(F)c1 1875371244 UWCYLLUSZOBBNN-MBSDFSHPSA-N 394.446 2.985 0 50 GFAA O=C(NC12CCC(C(=O)O)(CC1)CC2)c1nc(-c2ccccc2)n2c1COCC2 1875304213 DFAAATNWHQOENJ-UHFFFAOYSA-N 395.459 2.988 0 50 GFAA CC1(C(=O)NCc2ccccc2CNC(=O)c2cc(O)ncn2)CCCCC1 2325872406 WDSPAMWNQNDKSL-UHFFFAOYSA-N 382.464 2.699 0 50 GFAA COc1cccc(CCC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356144532 BWVJLDVAPYCVGH-QHCPKHFHSA-N 394.519 2.990 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1 4839002 FVUJZBZIOHRDAB-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA O=C(N1CCCN(C(=O)C(Cl)(Cl)Cl)CC1)C(Cl)(Cl)Cl 4902634 PQOSJESPEBNTCQ-UHFFFAOYSA-N 390.909 2.788 0 50 GFAA CCCN(CC(=O)NCCc1nc2ccccc2s1)[C@@H](C)C(=O)OCC 225672259 QOIQBAFAFUSCKS-AWEZNQCLSA-N 377.510 2.619 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(C(=O)CSc2nnc(N)s2)C1 55414561 UMUDBYMUFVWMCT-ZDUSSCGKSA-N 378.523 2.838 0 50 GFAA COc1ccc(C)cc1N1C(=O)[C@@H]2C[C@H]1CN2Cc1nc2ccccc2n1C 55133669 PQNCJTYBXZESDO-KXBFYZLASA-N 376.460 2.880 0 50 GFAA CCCCn1c(CN2CCCC[C@H]2CC(=O)OCC)cnc1S(=O)(=O)CC 20232902 VQRNBIVXZXNYSO-INIZCTEOSA-N 399.557 2.785 0 50 GFAA C1=C(c2cnn(Cc3ccc4c(c3)OCO4)c2)CCN(Cc2ncccn2)C1 67726324 AAPKVYLGROWBBP-UHFFFAOYSA-N 375.432 2.739 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CN(C)Cc3ccccc3)C2=O)c1 67723184 OWUDEYCSVAHZAN-QFIPXVFZSA-N 386.467 2.820 0 50 GFAA O=C1N[C@](Cc2ccc(F)cc2)(C2CCNCC2)C(=O)N1Cc1ccccc1F 67490254 FLSRBDHKOCCMCE-JOCHJYFZSA-N 399.441 2.998 0 50 GFAA O=C(NCCNc1cc(-n2cccn2)ncn1)c1cccc(C(F)(F)F)c1 65364489 FROMLTUDZTVBGG-UHFFFAOYSA-N 376.342 2.523 0 50 GFAA O=C(Cn1nc(C(F)(F)F)cc1C1CC1)N1CCN(c2ccccn2)CC1 2756179 UKNRCTVUJAVEBK-UHFFFAOYSA-N 379.386 2.523 0 50 GFAA Cc1c(NC(=O)[C@@H]2CC(c3ccc(F)cc3)=NO2)c(=O)n(-c2ccccc2)n1C 5029722 ZHEHKKQLIQFSFK-SFHVURJKSA-N 394.406 2.755 0 50 GFAA CCn1c([C@H]2OCC[C@H]2c2ccccc2)nn(Cc2noc(C3CC3)n2)c1=O 328656920 ZUSBFCZPGDNWTR-RDJZCZTQSA-N 381.436 2.619 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1)c1ccc(F)c(F)c1 125941284 JOSGCVSQOOWGMC-QFBILLFUSA-N 388.414 2.809 0 50 GFAA COc1ccc(Cn2cc(NC(=O)[C@@H]3CCCN3Cc3ccccn3)cn2)cc1 367512546 DNPZPXDQCVIVBD-NRFANRHFSA-N 391.475 2.938 0 50 GFAA c1cnn(CCCN2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)c1 72158630 CHFVSXCXFYHYAB-VLCRHTCISA-N 380.492 2.564 0 50 GFAA Cc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1OCC1CCOCC1 132489032 NEIVQTMEERMZLH-QGZVFWFLSA-N 385.468 2.528 0 50 GFAA Cc1n[nH]c([C@H]2CN(C(=O)c3cc4ccc(OC(F)(F)F)cc4[nH]3)CCO2)n1 173085885 QWRHBFPPCVVENS-CQSZACIVSA-N 395.341 2.707 0 50 GFAA Cc1nc2n(n1)C[C@@H](NC(=O)NC[C@H]1CCCCN(Cc3ccccc3)C1)CC2 378110779 LRRLDWMFVZWBKR-UXHICEINSA-N 396.539 2.503 0 50 GFAA Cc1ccc([C@@H]2CN(Cc3cn(CCO)nc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72127441 PKECWJZUAZJKPE-YTFSRNRJSA-N 380.536 2.554 0 50 GFAA Cc1ccc(F)cc1C(=O)N1CCc2[nH]c(-c3ccc(C(N)=O)cc3)nc2C1 223391198 IUVNXMJTMIYVKM-UHFFFAOYSA-N 378.407 2.822 0 50 GFAA CNC(=O)c1cccnc1N1CC[C@]2(CCCN(CCc3ccccc3)C2)C1 426661985 HRYGSJMEIPIUCT-QHCPKHFHSA-N 378.520 2.976 0 50 GFAA C[C@@H]1Oc2ccccc2[C@H]1NC(=O)Nc1ccccc1N(C)S(C)(=O)=O 288820093 NXDCTSCGTPGQSI-SJCJKPOMSA-N 375.450 2.726 0 50 GFAA CSCC[C@@H](NC(=O)c1cc(-c2ccccn2)n[nH]1)c1nnc2ccccn12 223237103 XGCMVFAGNMSXJO-CQSZACIVSA-N 393.476 2.739 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCCN(c3nc4ccccc4s3)CC2)c(C)[nH]1 426438751 PFUMRQOUQCFBLF-UHFFFAOYSA-N 382.489 2.954 0 50 GFAA O=C(c1cc2cc(Cl)ccc2[nH]1)N1C[C@H](CO)[C@H](CN2CCCCC2)C1 91694259 PAZPVSVULCPUKZ-HZPDHXFCSA-N 375.900 2.988 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91391410 FYLDGFMIHGBPNV-SNVBAGLBSA-N 382.247 2.576 0 50 GFAA Cn1c(CN2CCC(O)CC2)nnc1[C@@H]1CCCN(CC2CCCCC2)C1 426374408 QSROMEHQZYYCSI-GOSISDBHSA-N 375.561 2.532 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCN[C@H](C)C4)csc3C2)nc1 426518842 SRMIAPBZHJDOJK-OAHLLOKOSA-N 384.549 2.698 0 50 GFAA O=C(Nc1ccccc1F)c1cccc(S(=O)(=O)NC2CCOCC2)c1 95380445 BDKOEIQLAOXYGN-UHFFFAOYSA-N 378.425 2.535 0 50 GFAA CCc1nc2cc(NC(=O)N3CCN(c4ncccn4)CC3)ccc2n1CC 96166886 QTCODNQMYFXIOX-UHFFFAOYSA-N 379.468 2.763 0 50 GFAA O=C(CCc1cn2ccccc2n1)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 91427105 VDGPCTLYNZPEEG-JOCHJYFZSA-N 380.492 2.518 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C)C3)cn1 91644584 OWAGEMGLBCBZRU-LJQANCHMSA-N 378.476 2.653 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95530639 FYCJGRXGEIZATC-CQSZACIVSA-N 383.477 2.811 0 50 GFAA CCc1ccc(S(=O)(=O)N2CC[C@H](Cc3cccc(C(N)=O)c3)C2)s1 91486656 XOFBMQJLIZLEST-CQSZACIVSA-N 378.519 2.663 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2cccc(C)c2)CC1 96149045 UDNRFPVSMPOELZ-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA Nc1cc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)ccn1 95352434 GLULAKASNHJFJC-UHFFFAOYSA-N 392.503 2.751 0 50 GFAA CC1(C)CN(C(=O)Nc2ccc(Cl)cc2OC(F)F)CCS1(=O)=O 184404627 VEUVISOOGUTIGK-UHFFFAOYSA-N 382.816 2.982 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H](C(=O)O)C2)ccc1OCc1c(C)noc1C 299741588 GPQZYLKTWKHDIN-OAHLLOKOSA-N 388.420 2.816 0 50 GFAA C[S@@](=O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 79670155 CEHRSUBRZOGRSW-CLYVBNDRSA-N 387.457 2.747 0 50 GFAA biogenic O=C(c1ccccc1N1CCOCC1)N1CCC[C@@H](OCc2cccnc2)C1 828182269 FZKYPQSJRUOFOP-LJQANCHMSA-N 381.476 2.740 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2)c1conc1-c1ccccc1 670452075 MRWXCGIASNEYAM-XFKLWTPLSA-N 390.447 2.806 0 50 GFAA CNC(=O)c1cccc(NC(=O)CCCn2nnc(-c3ccc(F)cc3)n2)c1C 952986000 VSMGAIOVZRRTKU-UHFFFAOYSA-N 396.426 2.566 0 50 GFAA Cn1cc(CCCN[C@@H]2CCOC[C@@H]2[C@@H]2CCCN2C(=O)OC(C)(C)C)cn1 222308863 BHLNBJBFWSGADB-OTWHNJEPSA-N 392.544 2.747 0 50 GFAA Cc1cccc(C)c1NC(=O)CN1CCN(c2nc(N)c3ccccc3n2)CC1 301889021 QEAWRUFEIJQMAO-UHFFFAOYSA-N 390.491 2.590 0 50 GFAA Cc1cc(C)cc(C(=O)NCC(=O)Nc2ccc3nnc(C4CCC4)n3c2)c1 190300365 HRPRKAGGAJIOCF-UHFFFAOYSA-N 377.448 2.982 0 50 GFAA COC(=O)c1ccc(/C=C/C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1 194611763 JRRLCNSWWPTUBY-VSRDTVRMSA-N 378.428 2.576 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCc2nc[nH]c2[C@@H]1c1cccnc1 1336001320 RKRVUPGDPSQOSE-IBGZPJMESA-N 375.432 2.572 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N3CCC(c4cc[nH]n4)CC3)o2)c1C 1506406501 MZDIIVRXJUCFNU-UHFFFAOYSA-N 376.438 2.843 0 50 GFAA CCN(Cc1cnn(CC)c1)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506399570 OPSUTHMNEAIOTA-UHFFFAOYSA-N 389.836 2.605 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(Cc3ncccc3C)CC2)c(Cl)cc1F 1506421154 YQSBTPBHJFIFPH-UHFFFAOYSA-N 397.903 2.997 0 50 GFAA CC[C@]1(C(=O)NCCc2ccccc2)C[C@H]2CC[C@@H]1N2C(=O)C1CCOCC1 1704309998 VQDYCKOTJLRIEE-QTEQDKRBSA-N 384.520 2.932 0 50 GFAA CCSc1nc2ncn(CC(=O)Nc3ccc(OC)cc3)c(=O)c2s1 1775984364 QTRJJASGUUSRPP-UHFFFAOYSA-N 376.463 2.612 0 50 GFAA CCn1cc(C(=O)N2CCN(c3ccccc3F)CC2)c(=O)c2ccc(C)nc21 5657628 NLKVNIXIRKRNTJ-UHFFFAOYSA-N 394.450 2.826 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@H]2CCC(=O)N(CCCc3ccccc3)C2)n1 12057162 FJRLFHDXHFFGHS-NRFANRHFSA-N 396.535 2.878 0 50 GFAA CC(C)/C=C/C(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCN(c2ccccn2)CC1 12186070 CPHLPXMWPNNSFV-OVKVCFKUSA-N 396.535 2.571 0 50 GFAA O=C(CCNC(=O)N1CCc2c([nH]c3ccccc23)C1)Nc1ccc(O)cc1 12296820 MKUFHIAGPSIIIO-UHFFFAOYSA-N 378.432 2.970 0 50 GFAA biogenic COCCN1CCC(CN(Cc2cnn(C(C)C)c2)C[C@@H]2CCCO2)CC1 12758862 KBNVAZBUEHFOEO-NRFANRHFSA-N 378.561 2.803 0 50 GFAA C[C@@H](NC(=O)c1cn(CCNC(=O)CC2CCCC2)nn1)c1cccs1 15070310 LPKFITNODCITRE-CYBMUJFWSA-N 375.498 2.527 0 50 GFAA COc1ccc(C(=O)N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)cc1 169772325 ZGDGAAYMOYAYRG-UHFFFAOYSA-N 380.370 2.775 0 50 GFAA COc1c(C)c2c(c(O)c1CC=C(C)CCC(=O)NCC(C)(C)O)C(=O)OC2 1857532074 JHBTTZMYBWSMDK-UHFFFAOYSA-N 391.464 2.536 0 50 GFAA O=C(O)[C@H]1CN(C(=O)C2CCCCC2)CC12CCN(Cc1ccncc1)CC2 1857693430 WOANSCUJNGDKKL-LJQANCHMSA-N 385.508 2.787 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)C3CC3)C[C@]23CC[C@H]1O3)c1cc2ccccc2o1 1857721914 MBYVKNDTTBWUBX-FIQUECFISA-N 380.444 2.579 0 50 GFAA COc1cccc2c1CCN(c1ncc(C(=O)N3CCOCC3)cc1Cl)C2 302142675 FVTKMEIKZRESIK-UHFFFAOYSA-N 387.867 2.779 0 50 GFAA COCCOC1CCN(c2cc(N[C@@H]3CCCO[C@H]3C(C)C)ncn2)CC1 328631396 KMUXQVOFYJWQJB-XLIONFOSSA-N 378.517 2.724 0 50 GFAA Cc1ccccc1-c1nc(CN2CCN(CC(=O)N3CCCC[C@H]3C)CC2)no1 122274908 CNNCVSIMGBFHMW-GOSISDBHSA-N 397.523 2.564 0 50 GFAA O=C(NCCF)c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1 437681245 WMOJOCZSTVGOJS-UHFFFAOYSA-N 376.395 2.636 0 50 GFAA CO[C@@H]1CCCN(C2CCN(c3ccc(CC(=O)N4CCCC4)cc3)CC2)C1 14984430 HJHIIJXJUOGPEP-JOCHJYFZSA-N 385.552 2.931 0 50 GFAA Cn1cc(-c2nnc3n2CCN(C(=O)CCCc2c[nH]c4ccccc24)C3)cn1 370956271 NKQUSOFFJJMGMO-UHFFFAOYSA-N 389.463 2.525 0 50 GFAA O=C(NCc1ccnc(OC2CCOCC2)c1)c1ccn(-c2ccccc2F)n1 264990975 RBQCOFYNCJITBK-UHFFFAOYSA-N 396.422 2.894 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCCO[C@H]1C1CCN(C(=O)C[C@@H]2CCCO2)CC1 837247781 XPSLCPOFSKEKQX-SCTDSRPQSA-N 396.528 2.866 0 50 GFAA O=C(NC[C@@H]1CNCc2ccccc21)[C@@H]1CCCN1c1ncnc2sccc12 1875268129 FZCNLFUTZATVQT-YJBOKZPZSA-N 393.516 2.663 0 50 GFAA O=C(NCCC1(CNC(=O)c2cnc(NC3CC3)s2)CC1)c1cncs1 1875338864 OCHITYHORLGCBQ-UHFFFAOYSA-N 391.522 2.504 0 50 GFAA COCCn1nc2c(c1C(=O)N1CC(c3ccccc3F)C1)C[C@H](C)O[C@@H]2C 1875316061 SJWUCXHYINVUSB-UONOGXRCSA-N 387.455 2.930 0 50 GFAA COC(=O)[C@H](NC(=O)CSc1nc(C)c(CCSC)[nH]1)c1ccccc1 4632328 NPHOFPLLBMKYQL-MRXNPFEDSA-N 393.534 2.746 0 50 GFAA C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1cnc2n1CCNC2 2325786370 GNNSNYBPMNHHQD-AWEZNQCLSA-N 377.448 2.783 0 50 GFAA CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCN(CC2CC2)c2ccccc21 2325863772 WETXREUMRBTJED-FQEVSTJZSA-N 377.488 2.997 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2c(C)noc2C)CC[C@H]1Nc1ncccn1 2356142543 XAWYYDVOSQBIOB-CGTJXYLNSA-N 387.484 2.774 0 50 GFAA Cc1ccccc1OCC(=O)N(Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1 6810965 FJTPPWXSBHVVQM-SFHVURJKSA-N 391.464 2.729 0 50 GFAA COc1ccc(Cc2cnc(NC(=O)c3cccc(-n4cnnn4)c3)s2)cc1 9764039 VMNCVBDTKLYYPT-UHFFFAOYSA-N 392.444 2.971 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3ccc(F)c(OC)c3)C2)CC1 23359955 KWZDLRXIDLBZMH-KRWDZBQOSA-N 379.476 2.573 0 50 GFAA CN1CCN(c2ncc(Cl)cc2C(F)(F)F)C[C@@]12CCNC(=O)CC2 107416790 ZBIWFRFVZJIKCG-OAHLLOKOSA-N 376.810 2.545 0 50 GFAA COc1ccc2c(C)cc(N3CCC[C@@H](Cn4cc(C(=O)O)nn4)C3)nc2c1 67955849 ZAVISBILIDDGKQ-CQSZACIVSA-N 381.436 2.758 0 50 GFAA COc1ccc(C(=O)N2CCN(c3cc(C)nc(N4CCCCC4)n3)CC2)cc1 64799764 RZLVAHIWSCXWKC-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA O=C(Nc1cc(Br)ccc1N1CCOCC1)N1CCC[C@@H]1CCO 429124915 XGCCFSUNWFMWTN-CQSZACIVSA-N 398.301 2.664 0 50 GFAA CN1C(=O)[C@@](CCC(=O)N2CCCNCC2)(Cc2ccccc2)c2ccccc21 71762735 AVPAHXAAHPBPEX-DEOSSOPVSA-N 391.515 2.746 0 50 GFAA C[C@H](Oc1cccc(F)c1)C(=O)N1CCN(c2ncnc3ccsc23)CC1 126607546 ZXLXTUBRGNGRTK-ZDUSSCGKSA-N 386.452 2.947 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCc2ccno2)(Cc2ccccc2)c2ccccc21 71498604 ZMVLNELDVBIJSC-JOCHJYFZSA-N 375.428 2.838 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3ccc(-c4ccccc4)[nH]c3=O)CC2=O)cc1 82121415 UEYNNCKXIUGDOP-UHFFFAOYSA-N 387.439 2.839 0 50 GFAA Cc1cccc(C(=O)N2CCC(c3nnc(CN4CCCCC4)n3C)CC2)n1 96140078 SRTNGADPFBIBAM-UHFFFAOYSA-N 382.512 2.524 0 50 GFAA O=C(NC[C@H](c1ccccn1)N1CCOCC1)Nc1ccc2ncsc2c1 95501117 KIFRGXIXVSSKNJ-QGZVFWFLSA-N 383.477 2.886 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2=O 95364073 XGJMNIUXTNPFOZ-RBUKOAKNSA-N 380.492 2.609 0 50 GFAA Cc1ccc(-c2nnn(CC(=O)N[C@@H]3CCCOc4c(F)cccc43)n2)cc1 181054882 JCRQBBRAIJTOJK-QGZVFWFLSA-N 381.411 2.818 0 50 GFAA COc1cccc([C@H]2CN(C(=O)Cc3cc(C)no3)[C@@H]3C4CCN(CC4)[C@H]23)c1 95354242 UUTVICKSMSDFNJ-CEMLEFRQSA-N 381.476 2.623 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)c2cc3ccccc3n2C)C1 95376140 MSVVGDNKOQZCLW-GOSISDBHSA-N 379.508 2.956 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCc1nc(-c2cccs2)no1 299750505 NPRUJWGNLPAVCD-AGIUHOORSA-N 375.450 2.975 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)N[C@@H]1CCC(=O)N(C)C1 299784805 ZYPZRNAUKUGZLE-CQSZACIVSA-N 375.860 2.636 0 50 GFAA CCN(Cc1noc(C2CC2)n1)C(=O)NCc1csc(-c2ncccn2)n1 584894958 STJFRRDFRWRNRT-UHFFFAOYSA-N 385.453 2.592 0 50 GFAA Cc1cc(C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)ccc1N1CCOCC1 952860281 KTDVOFHHZNUFOS-UHFFFAOYSA-N 393.487 2.905 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N1CCCO[C@H](CN2CCCCC2)C1 952970536 PLTXXYNOCIWTCQ-LJQANCHMSA-N 384.524 2.838 0 50 GFAA CCCOc1cc(C)ccc1NC(=O)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 170591914 QAZWQYCCXWQXAW-HNAYVOBHSA-N 396.509 2.642 0 50 GFAA Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)C(=O)CCc1ccccn1 275523969 PDOJIQHZPATDHN-RDJZCZTQSA-N 376.501 2.850 0 50 GFAA C[C@@H](NC(=O)NCc1ccc(N(C)C(=O)c2ccncc2)cc1)c1cnn(C)c1 743620627 OQIRCEFVDDIGMC-OAHLLOKOSA-N 392.463 2.652 0 50 GFAA CCN1C(=O)[C@H]2CN(C(=O)c3sccc3-c3ccc(F)cc3)CCN2C1=O 752509403 OMNUDTZELURJEV-OAHLLOKOSA-N 387.436 2.663 0 50 GFAA COCCN1CCC(C(=O)Nc2c(-c3ccccc3OC)c(C)nn2C)CC1 1529184979 GWVYKJHRYWRGBB-UHFFFAOYSA-N 386.496 2.701 0 50 GFAA Cc1cc(N2CCC3(CC2)C(=O)N(C)C(=O)N3C)nc2cc3c(cc12)CCC3 1704358240 HJIIDXFJMCJODU-UHFFFAOYSA-N 378.476 2.895 0 50 GFAA Cc1c(C(=O)N2CCC[C@H]2CO)sc2ncnc(NCCc3ccccn3)c12 12078434 BINTZUJEQJTBCS-HNNXBMFYSA-N 397.504 2.646 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@H]2CCOC2)c1 12430455 WJJFRVMOIDYLHZ-INIZCTEOSA-N 388.508 3.000 0 50 GFAA CCNC(=O)c1cn(Cc2ccccc2)cc(C(=O)NCc2cccs2)c1=O 14987711 PYOGVZSAAQCXLS-UHFFFAOYSA-N 395.484 2.638 0 50 GFAA NC(=O)CCN1CCN(C(=O)C[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 15064575 HJAPTTONOJPHOD-HXUWFJFHSA-N 399.922 2.882 0 50 GFAA Cc1ccc(C[C@]2(CCC(=O)NC[C@H](C)Oc3cccnc3)CCC(=O)N2)cc1 15066684 HXBQBYLWBAZZPD-MBSDFSHPSA-N 395.503 2.945 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCCN1CCOCC1)c1ccccc1F 19831359 MOHLHDFBECGAEQ-UHFFFAOYSA-N 385.439 2.530 0 50 GFAA CCN1CC[C@@H]2C[C@@H](N3CCOCC3)CC[C@@]2(C(=O)NCCc2ccccc2)C1 1857671976 AVFSWTASVUTZDJ-AOHZBQACSA-N 399.579 2.558 0 50 GFAA Cn1cnc(C(=O)N2CCC3(CCc4c(O)nc(-c5ccccc5)nc43)CC2)c1 1857735463 OSTXECSYOZCOGB-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA COC(=O)[C@]1(N(Cc2ccccc2)C(=O)Cc2cc(F)ccc2F)CCOC1 328589942 VEQAOIJUGVWYJA-NRFANRHFSA-N 389.398 2.868 0 50 GFAA CS(=O)(=O)CCCN[C@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 368351498 HMOBHFVGWZMVSC-XLIONFOSSA-N 393.480 2.601 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H]2CCCc3c2cnn3C)(c2ccccc2)CC1 847333070 WCXRVCZHCKPEFT-LJQANCHMSA-N 392.503 2.660 0 50 GFAA CO[C@H](C)CS(=O)(=O)Nc1cc(-c2n[nH]c(C)n2)cc(C(F)(F)F)c1 864097399 RQUFGLQZFCZMQL-MRVPVSSYSA-N 378.376 2.576 0 50 GFAA CC12CC(NC(=O)c3cccc(NCc4ccccn4)c3)(C1)C1(CCNCC1)O2 1875292432 IGQKVVRWNJXGSO-UHFFFAOYSA-N 392.503 2.867 0 50 GFAA CCc1nc(NC(=O)CSc2nncn2-c2ccc(C(C)C)cc2)nn1C 1875266844 QCEZGFRLOKEFHL-UHFFFAOYSA-N 385.497 2.812 0 50 GFAA O=C(CCc1ccccc1OC(F)(F)F)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875402469 HNJSQBOKZQNJNH-NUEKZKHPSA-N 397.397 2.670 0 50 GFAA CCC(=O)N(CCc1ccc(OC)cc1)[C@@H]1CC(=O)N(c2ccccc2)C1=O 715144 YOSVYZRIBXIDEC-LJQANCHMSA-N 380.444 2.808 0 50 GFAA CCO[C@H](C(=O)N1C[C@@H]2CN(Cc3nc4c(o3)CCCC4)C[C@]2(C)C1)C1CC1 2325793676 CZIIINYGUMLWND-XUEUYAKLSA-N 387.524 2.649 0 50 GFAA Cn1c(=O)c2c(nc(SCc3ccc(Cl)cc3Cl)n2C)n(C)c1=O 1093841 VYAIHDJAQYDYHN-UHFFFAOYSA-N 385.276 2.570 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2cc(C)ccc2C)S(C)(=O)=O)c1 1220427 AKLZVPAKOSUUAG-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA NC(=O)C1(N2CCCCC2)CCN(C(=S)Nc2ccc(F)c(Cl)c2)CC1 2355293 UXVLFTHSKCEEAG-UHFFFAOYSA-N 398.935 2.982 0 50 GFAA O=C(COc1ccc(Cl)cc1)NC(=S)Nc1ccc2c(c1)COC2=O 2836574 ZSEDLSLAXGFGHZ-UHFFFAOYSA-N 376.821 2.902 0 50 GFAA O=C(c1cnccn1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1ccccc1 2356153536 LCPDVLSGUUJQFA-ZFMNYDKASA-N 390.487 2.561 0 50 GFAA c1ccc(-c2cnn3cc(CN4CCc5nc(C6CC6)nn5CC4)cnc23)cc1 2356166379 VNDVTWUENMSRMD-UHFFFAOYSA-N 385.475 2.924 0 50 GFAA Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)N5CCN(CCO)CC5)(C4)C2)C3)cc1 100318544 GNUDEVGDKFGKOL-LMHXZZLNSA-N 397.563 2.905 0 50 GFAA CCn1cc(C(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)c(C(F)(F)F)n1 280619713 RKIILCVRRGIGKS-GFCCVEGCSA-N 387.383 2.570 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN([C@@H]2CCCC[C@H]2OC)CC1 20228041 DDSPTLXNWPWAQQ-QZTJIDSGSA-N 378.513 2.788 0 50 GFAA CC[C@@H](NCc1ccccc1OCCCN1CCN(C)CC1)c1ccnn1C 55369679 VUBAJLFBQJROGR-HXUWFJFHSA-N 385.556 2.677 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)cc1 247980336 IHIPNONWNDDBHH-NHCUHLMSSA-N 377.488 2.912 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(-c4noc(CC(C)C)n4)[nH]c3C2)c1 67457950 FUPFBKSYSLJKDD-CYBMUJFWSA-N 381.436 2.737 0 50 GFAA O=C(NCCc1nnc2n1CCCCC2)N1CC[C@H](Cc2ccc(F)cc2)C1 125101921 SMPFYMZDQDEKIA-QGZVFWFLSA-N 385.487 2.960 0 50 GFAA CC(C)C(=O)N1CCC(C(=O)NC2(c3ccc(F)cc3)CCOCC2)CC1 171715495 UTNCQBYOPGBHHA-UHFFFAOYSA-N 376.472 2.842 0 50 GFAA COc1cccc(/C=C/C(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)c1 253423183 XZQFOXCQGTWSIQ-VDZCTEQFSA-N 393.443 2.683 0 50 GFAA Cc1ccc(NC(=O)c2ccc(Cn3cccn3)cc2)cc1N1C(=O)CNC1=O 478198818 HKXUZBPAPHHNMO-UHFFFAOYSA-N 389.415 2.548 0 50 GFAA Cc1cc(C)n(CCNC(=O)Nc2nnc(-c3ccccc3C)s2)c(=O)n1 32598115 DSIYOWOOXZMPBP-UHFFFAOYSA-N 384.465 2.509 0 50 GFAA O=C(CN1CCC[C@H]1C(=O)O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 262603559 AHKRMOLLHWCPFL-RXVVDRJESA-N 391.471 2.965 0 50 GFAA CC1CCN(C(=O)COc2ccc(CN3C[C@@H]4CC[C@H](C3)CN4C)cc2)CC1 216346199 BHQSDRRQMAQKAI-SFTDATJTSA-N 385.552 2.850 0 50 GFAA O=C(NC[C@H]1CCN(C(=O)Cc2ccccc2)C1)Nc1ccc2c(c1)COC2 372435913 OEZZKKABHQZOGE-QGZVFWFLSA-N 379.460 2.930 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCN(Cc2ccc3ccccc3n2)C[C@H]1O 15073303 IOVJSJFVJVFMPA-DHIUTWEWSA-N 376.504 2.740 0 50 GFAA O=C(c1ccc(C[C@H]2CCCNC2)cc1)N1CCCN(c2ccncc2)CC1 72132099 AWCBMUSMOBZXJJ-HXUWFJFHSA-N 378.520 2.976 0 50 GFAA COCc1nn2c(ncc3c(=O)n(CC(=O)O)ccc32)c1-c1ccc(Cl)cc1 40397815 DBAIYPRUEGBFNP-UHFFFAOYSA-N 398.806 2.596 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)c2nc3cc(C)ccn3c2F)n1 426399307 YJJZVAGLNYARME-CYBMUJFWSA-N 387.415 2.721 0 50 GFAA CCNc1cc(C)nc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)n1 82230697 XFSOYXMQKINDRX-UHFFFAOYSA-N 377.851 2.972 0 50 GFAA Cc1ccc(C(=O)NCCC(=O)N2CC[C@@H](Cc3ccc(CO)cc3)C2)cc1 91690563 PXIBQLWGSAGTFY-FQEVSTJZSA-N 380.488 2.698 0 50 GFAA COc1cc2c(cc1CN1CCC(c3nnc(CN(C)C)n3C)CC1)CCC2 96133812 CQPKQGRQYAMTLR-UHFFFAOYSA-N 383.540 2.754 0 50 GFAA CCCNC(=O)c1ccc(NC(=O)NC2CCN(CCSC)CC2)cc1 97468135 FYEGZHRSLUHESX-UHFFFAOYSA-N 378.542 2.775 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NCCCc1nc3ccccc3n1C)C2 91519296 ZRYRXOAWIVASFW-MRXNPFEDSA-N 379.460 2.882 0 50 GFAA O=C(c1ccncc1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cn1ccc3ccccc31)C2 95387969 BKMRLROKSYFRLY-FXAWDEMLSA-N 388.471 2.800 0 50 GFAA Cc1nc(CN2CCC(Oc3ccc(C(=O)N4CCCCC4)cc3)CC2)n[nH]1 95501360 TVSPIXNZCOMDMY-UHFFFAOYSA-N 383.496 2.783 0 50 GFAA COc1ccccc1CNC(=O)c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2 263618744 VHTNWHUIQQGOKU-GOSISDBHSA-N 382.395 2.627 0 50 GFAA O=C([C@H]1CC(Cc2ccc3c(c2)OCO3)=NO1)N1CCC[C@@H]1c1nccs1 299778719 NDNOURHHAHQBOJ-RHSMWYFYSA-N 385.445 2.923 0 50 GFAA O=C(NCCc1nc(C2CC2)no1)N1CCO[C@@H](c2ccc(Cl)cc2)C1 584901673 HTRPYVROUODJQR-OAHLLOKOSA-N 376.844 2.926 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)NCc2ccc3c(c2)CCCO3)C1 584899087 XVOXHXVBZWDQFG-KRWDZBQOSA-N 382.464 2.550 0 50 GFAA O=C(Nc1ccc(OC[C@@H]2CCCCO2)cc1)c1ccnc(-n2cnnc2)c1 952966918 KTROFNIMLULNOS-SFHVURJKSA-N 379.420 2.863 0 50 GFAA CC(=O)Nc1ccccc1SCC(=O)N1CCC(CNC(=O)C2CC2)CC1 952982269 GBMTVNINYUDHEJ-UHFFFAOYSA-N 389.521 2.502 0 50 GFAA CC(C)CCO[C@H]1CCN(C(=O)[C@@H]2CCc3nnc(-c4ccc(O)cc4)n3C2)C1 170614662 SNJVWCBRYUCAEF-MJGOQNOKSA-N 398.507 2.877 0 50 GFAA Cn1c(CN2CCN(c3ncccc3F)CC2)nnc1-c1ccc(Cl)cc1 274512359 VTOJZEAEJFVEHJ-UHFFFAOYSA-N 386.862 2.992 0 50 GFAA CCCCn1cc(C(=O)NC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)c(C)n1 186125688 WPBCUCKHYZFFGH-INIZCTEOSA-N 393.871 2.880 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OC4CCCC4)c(F)c3)C(=O)[C@H]2C1 278264728 YCARLYMICNIYPI-MLGOLLRUSA-N 390.411 2.867 0 50 GFAA CCc1cc(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[nH]n1 186462203 BJYMPVAJWCGORD-CYBMUJFWSA-N 380.370 2.522 0 50 GFAA O=C(COc1ccc(F)cc1F)N1C[C@H](Cc2ccc3ccccc3n2)[C@@H](O)C1 1616126819 QDVQBKXYOUKEOB-YWZLYKJASA-N 398.409 2.954 0 50 GFAA CCN(CC)c1ccc(C(=O)N2CCCN(C(=O)c3cnc(C)cn3)CC2)cc1 1772706551 DXMNPRVCYVWXCO-UHFFFAOYSA-N 395.507 2.620 0 50 GFAA COc1ccccc1CCC(=O)N1CCCN(CCn2cc(Cl)cn2)CC1 1772701512 QMZFGXUQMQLQTR-UHFFFAOYSA-N 390.915 2.712 0 50 GFAA COc1ccc(OC)c(NC(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)c1 5399295 QWXLGLJAVXRHKN-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA O=C(CSc1ccccn1)N[C@@H]1CC(=O)N(CCc2cccc(Cl)c2)C1 11667869 XEXPRBDGVQYTEE-MRXNPFEDSA-N 389.908 2.787 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NC(=O)CN2CCOC2=O)cc1 11818514 WLPKYFLHBFUTEH-KRWDZBQOSA-N 382.464 2.763 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)N2CCSCC2)CC1 12468936 DCNWGKLMZOZGOL-UHFFFAOYSA-N 382.913 2.919 0 50 GFAA O=C(CCc1ccccc1C(F)(F)F)N[C@H]1C[C@@H](Cn2ccnc2)C[C@@H]1O 1857527201 DVGPWHCQGXNXRI-COXVUDFISA-N 381.398 2.790 0 50 GFAA O=C(O)CN1CCC2(CC1)OCCc1sc(C(=O)N[C@@H]3C=CCCC3)cc12 1857683792 YDJBXWHYYNCNGW-CQSZACIVSA-N 390.505 2.535 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1Cc1ccc(-c2ccccn2)nc1 1875398801 FOVKVBLNAYYRMG-APWZRJJASA-N 376.464 2.951 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)O 1875345651 DZWVVEOSFALQLP-SECBINFHSA-N 389.216 2.775 0 50 GFAA COc1cc([C@H]2CC(=O)Oc3c(O)cc4c(C)cc(=O)oc4c32)cc(OC)c1O 2049252058 IBWROUFDNDIFBH-GFCCVEGCSA-N 398.367 2.971 0 50 GFAA CN(Cc1ccccc1)CC1CCN(C(=O)c2cnc3ncnc(O)c3c2)CC1 2325800834 IDMNGJODNRZGLX-UHFFFAOYSA-N 391.475 2.715 0 50 GFAA C[C@@H](Cc1ccc(F)cc1F)C(=O)N1CC(N2CCN(C(C)(C)C)CC2)C1 2325810529 PQZOORXUXYLXFN-HNNXBMFYSA-N 379.495 2.770 0 50 GFAA CC(C)c1nc2ccccn2c1NC(=O)c1ccc2c(c1)CC[C@H](N)C(=O)N2 2325857560 GMOARKDCHMISCG-HNNXBMFYSA-N 377.448 2.922 0 50 GFAA Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)C1 880985550 WPJWJVOLCUIPIY-CQSZACIVSA-N 399.472 2.742 0 50 GFAA CC1(C)CNC(=O)[C@H]1NC(=O)CCc1nc2ccccc2n1-c1ccccc1 912635196 IZMKDQVCNMWNQD-HXUWFJFHSA-N 376.460 2.599 0 50 GFAA Cc1cc(C)n(C(=O)c2ccc(NC(=O)[C@H]3COc4ccccc4O3)cc2)n1 1079765 KMLJFXVJUCONBM-LJQANCHMSA-N 377.400 2.967 0 50 GFAA CC(C)n1ncc(=NC(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)[nH]1 2356170966 PRMZBNGJDIEVRO-UHFFFAOYSA-N 384.461 2.507 0 50 GFAA COc1cc(CN2CCN(Cc3cccc(F)c3)C[C@H]2CCO)cc(OC)c1 104396714 DCSAOWGOFPZAEE-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA CCCCn1c(CN2CCCC[C@@H]2CC(=O)OCC)cnc1S(=O)(=O)CC 20232896 VQRNBIVXZXNYSO-MRXNPFEDSA-N 399.557 2.785 0 50 GFAA COCCN1CCC(CN(C)[C@@H](C(=O)O)c2ccc(OC(C)C)cc2)CC1 55386501 UQGAOENYGUQGST-HXUWFJFHSA-N 378.513 2.890 0 50 GFAA CO[C@H](C)[C@H](N)C(=O)N1CCOc2c(O)cc(-c3ccc(C)s3)cc2C1 67784882 LUCIJDPFPSERSK-PXAZEXFGSA-N 376.478 2.512 0 50 GFAA OCC1CCN([C@H]2CCCN(C3CCN(CCc4ccccc4)CC3)C2)CC1 20534284 MNKHJOOYNKVLOH-DEOSSOPVSA-N 385.596 2.862 0 50 GFAA Cc1ccc(Cn2cc(-n3c(S)nnc3CCn3cc(C)cn3)cn2)cc1 2808501 HPCVEHWMCRIZLO-UHFFFAOYSA-N 379.493 2.857 0 50 GFAA CN1CCCN(Cc2cccc(OC[C@H](O)CN(C)C3CCCCC3)c2)CC1 39362707 PUHCWSFNGKMXRO-JOCHJYFZSA-N 389.584 2.828 0 50 GFAA Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1C 172865964 RXQSYRYCTYXBAC-LJQANCHMSA-N 391.464 2.816 0 50 GFAA Cc1cc(N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)nc(C(C)C)n1 71415729 NSXLSXNKKZKFGH-KRWDZBQOSA-N 385.556 2.868 0 50 GFAA Cc1cc(-n2cncn2)ccc1C(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 173088539 MMVMALRADLKYCY-INIZCTEOSA-N 395.507 2.686 0 50 GFAA CCSCCC(=O)N1CCC[C@@]2(CCC(=O)N(Cc3ccccn3)C2)C1 72406855 RKGKYHKBEJJUHX-HXUWFJFHSA-N 375.538 2.956 0 50 GFAA NC(=O)c1c(NC(=O)CCN2CC[C@@]3(CCCOC3)C2)sc2c1CCCC2 375282861 AMHVXUFJWNWRQV-FQEVSTJZSA-N 391.537 2.557 0 50 GFAA O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@H]1OCCc2ccccc21 237939415 SRZVEVGRLPUBAK-OALUTQOASA-N 382.391 2.733 0 50 GFAA CCN1CC2(CCN(C(=O)[C@@H]3CCCCN3Cc3ccccc3)CC2)OC1=O 77287658 LTIUNMAKBBYQPX-IBGZPJMESA-N 385.508 2.874 0 50 GFAA O=C(N[C@H]1CCCNC1)c1ccccc1SCC(=O)N1CCc2ccccc21 238033126 NRARTCGEJFTRHI-KRWDZBQOSA-N 395.528 2.850 0 50 GFAA Cc1ccc(N[C@@H]2CCCN(C(=O)c3ccnc(-n4cnnc4)c3)C2)cc1C 72157544 PCVBKWJBCASEEZ-LJQANCHMSA-N 376.464 2.996 0 50 GFAA CN(C)C(=O)N1CCC(N[C@@H](Cc2ccccc2)C(=O)OC(C)(C)C)CC1 133098728 GKSVFLVSGMUDHI-SFHVURJKSA-N 375.513 2.675 0 50 GFAA C[C@H](NC(=O)Nc1cnc2sccn2c1=O)c1nc2c(s1)CCCC2 426374422 SPOQUPYPLMZKSW-VIFPVBQESA-N 375.479 2.974 0 50 GFAA CC(C)(C)C(=O)COC(=O)c1ccccc1N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 239174568 QGBTWPVIZQOBMU-RPLLJCPNSA-N 383.444 2.994 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)N1CCCN(c2ccccc2)CC1 95508695 BILKKIOUDJWMHI-HXUWFJFHSA-N 377.488 2.741 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 95511585 JXHUUOZEPIOAEA-KRWDZBQOSA-N 384.480 2.583 0 50 GFAA CCCc1nc(C)c(CNC(=O)Nc2cc3[nH]c(=O)[nH]c3cc2OC)s1 96131580 BTSHLEHGAWTPJZ-UHFFFAOYSA-N 375.454 2.904 0 50 GFAA Cc1nnc(SCCCNC(=O)N(C)Cc2ccc3nonc3c2)s1 426531524 BXFQLFKCGKATBT-UHFFFAOYSA-N 378.483 2.707 0 50 GFAA COc1ccc(OC)c([C@H]2CCN(C(=O)c3ccc4c(c3)OCC(=O)N4)C2)c1 97797297 UBDWFGVDGNQENH-AWEZNQCLSA-N 382.416 2.664 0 50 GFAA CN1CCN([C@H]2CCN(Cc3cc(-c4ccccc4)no3)C[C@H]2CCCO)CC1 95386307 SOMKJGLNRDLXHR-OFNKIYASSA-N 398.551 2.552 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(Cc4noc(C(C)C)n4)C3)CCC2=O)cn1 91849177 XRRKCYQPTWEWFP-NRFANRHFSA-N 398.511 2.696 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1 91793030 ZJKFVOOJUOTIMD-QGZVFWFLSA-N 386.471 2.735 0 50 GFAA CC[C@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1)n1cccn1 91519243 UMEGZISHOLJPJB-LJQANCHMSA-N 395.507 2.661 0 50 GFAA CC[C@@H](C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1)n1cccn1 95526619 DSLAXVZHWRFUEU-IBGZPJMESA-N 378.480 2.880 0 50 GFAA CCn1c(C)ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccc2)C3)c1=O 95375184 GIKXEKQTVJFRSL-VQTJNVASSA-N 379.504 2.913 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@@H]2CC(=O)N(C)C2)CCO3)s1 67805013 QFNNLJMRPMJDDM-OAHLLOKOSA-N 386.473 2.628 0 50 GFAA O=C(NCCCn1cc(Cl)cn1)N1CCCN(Cc2cccs2)CC1 584897364 KJYORSOENWLONW-UHFFFAOYSA-N 381.933 2.906 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Br)N1C[C@@H](CO)[C@H](CCO)C1 1347591283 STOFSUOYZWFDED-ZJUUUORDSA-N 396.203 2.531 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N[C@@H](C)c2nc(-c3ccccc3C)no2)c1C 952978727 SGKMTKXWIPETTQ-ZDUSSCGKSA-N 381.436 2.938 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3Cc2cc(=O)c(OC)co2)cc1 1565531407 CONUAYNVJZINRW-MSOLQXFVSA-N 384.476 2.753 0 50 GFAA CC(C)c1noc(CCNS(=O)(=O)c2ccc(Cl)c3ncccc23)n1 109345626 VVYNQQMDFXFNEC-UHFFFAOYSA-N 380.857 2.916 0 50 GFAA Cc1ccc(Oc2ccc(NC(=O)C(=O)N[C@@H]3CCc4[nH]ncc4C3)cn2)cc1 167410569 YLZNTOFULSFNEY-OAHLLOKOSA-N 391.431 2.518 0 50 GFAA O=C(NC[C@H](O)c1c(F)cccc1Cl)[C@@H]1CCN(c2ccc(F)cc2)C1=O 741290844 JZAHLDCCQSJFJJ-BBRMVZONSA-N 394.805 2.821 0 50 GFAA Cc1noc2ncnc(N(C)CC3CCN(C[C@@H](O)c4ccccc4)CC3)c12 192451372 JFJWMHZZRYMALJ-GOSISDBHSA-N 381.480 2.808 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)Cc1cnc(NC[C@@H]2CCCO2)nc1 1506401511 SHOUMAOEXZOJNW-FQEVSTJZSA-N 378.480 2.885 0 50 GFAA COc1cccc(N2C[C@@H](NC(=O)CC(=O)Nc3cccc(C)c3C)CC2=O)c1 1506406268 ZNHVBBWYRRUIGJ-INIZCTEOSA-N 395.459 2.562 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CCC[C@@H](OCc3ccccn3)C2)CC1 1506415138 MATQISAMDRBICZ-OAQYLSRUSA-N 380.492 2.762 0 50 GFAA Cc1ccccc1SC1CCN(C(=O)[C@@H]2CCCN2S(C)(=O)=O)CC1 1506407459 OIYUVJBFIZABPK-INIZCTEOSA-N 382.551 2.502 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4ncc[nH]4)C[C@H]2CN(C2CCOCC2)C3)cc1 1772804224 JLOOBSNRFYNVIB-REWPJTCUSA-N 380.536 2.955 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)c2cn(CCC3CCCCC3)nn2)C1 11663619 PZEFLGFSLQJYGD-KRWDZBQOSA-N 398.511 2.717 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)N[C@H]1CCCN(CCc2ccccc2)C1 11878354 KZVKYXKUEVMIJR-IBGZPJMESA-N 392.503 2.543 0 50 GFAA COc1ccc(/C=C/C(=O)NCc2nnc(SCc3ccccn3)n2C)cc1 11912603 HHZXUHKNKPYNBZ-DHZHZOJOSA-N 395.488 2.841 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)CC2=CCCCC2)CC1)[C@@H]1CCOC1 12299310 LPVVZIGEGFUDAP-QGZVFWFLSA-N 386.496 2.912 0 50 GFAA CCOC(=O)c1nn(CCCc2ccccc2)c2c1CN(Cc1ncc[nH]1)CC2 14742316 FJMSZCZOURGOBE-UHFFFAOYSA-N 393.491 2.974 0 50 GFAA Cc1cnccc1CNC(=O)C1(N2C[C@H](C)O[C@H](C)C2)Cc2ccccc2C1 15071588 OGDYWPOXOCMFGS-HDICACEKSA-N 379.504 2.653 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccc(OC)cc4C)nnc23)n1 169776020 QOKMNULYTOCMAE-UHFFFAOYSA-N 392.419 2.589 0 50 GFAA CN1CCN(c2ncnc3ccc(-c4ccc([C@@H]5CNC(=O)C5)cc4)cc23)CC1 1875249183 JXVKTSAQQKUSDU-IBGZPJMESA-N 387.487 2.652 0 50 GFAA Cc1ccccc1-c1nc(CN2CCN([C@H](C)C(=O)NC3CCCC3)CC2)no1 127032070 OTODYNGVUVPRLY-QGZVFWFLSA-N 397.523 2.610 0 50 GFAA CC[C@H](OC)C(=O)Nc1cc(NC(=O)[C@H](CC)OC)nc(-c2ccccc2)n1 253630125 IYDCLUZACUBBHS-GJZGRUSLSA-N 386.452 2.871 0 50 GFAA CCO[C@H]1C[C@@H](NC(=O)NC2CCC(c3nc(C)no3)CC2)C12CCOCC2 369650200 VRXCWBYKMUUQRE-BACDZXNISA-N 392.500 2.678 0 50 GFAA O=S(=O)(NCc1cn2c(n1)CCCC2)c1ccc(Br)s1 263741417 FCNJOLXTIDLAHB-UHFFFAOYSA-N 376.301 2.522 0 50 GFAA CN1CCC(n2nnc3c2C[C@@H](c2nc(CCC(F)(F)F)no2)CC3)CC1 952894935 PPCXFALTTKSCSF-NSHDSACASA-N 384.406 2.695 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(CC(=O)NCC(F)F)CC2)n1 952892165 KXPSYNRAYBFLDD-UHFFFAOYSA-N 390.434 2.713 0 50 GFAA Cc1csc([C@](O)(CC(=O)Nc2ncc(Cl)cc2O)C(F)(F)F)n1 1875286550 VOOFQVZCPDXXGB-GFCCVEGCSA-N 381.763 2.984 0 50 GFAA O=C(O)c1cc(C2CCN(C[C@@H](O)COCc3ccc(Cl)cc3)CC2)[nH]n1 1875309746 LMJBQLGZDYVABW-MRXNPFEDSA-N 393.871 2.518 0 50 GFAA N=c1[nH]c(C2CC2)cc(=NC[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)[nH]1 1875337881 IHJSDAONMREVAY-HXUWFJFHSA-N 385.471 2.998 0 50 GFAA CC(=O)N1C[C@H]2[C@@H](NC(=O)c3ccc(Cl)c(N4CCCC4)n3)CCC[C@H]2C1 1875404532 LTZFXQWBLBHCSG-UXLLHSPISA-N 390.915 2.712 0 50 GFAA CCN(C(=O)Cn1c(CN2CCOCC2)nc2ccccc21)c1ccccc1 19939712 DAOIJSILDVRGQK-UHFFFAOYSA-N 378.476 2.922 0 50 GFAA CC(=O)c1ccc(N2CCN(C(=O)Cc3csc(C(=O)O)c3)CC2)c(F)c1 2325788097 LZLFPGCJJCFWAH-UHFFFAOYSA-N 390.436 2.679 0 50 GFAA Cc1ccc(-n2[nH]c(C(=O)N3CCC[C@H]3Cn3ccnc3C)cc2=O)cc1C 2325790056 JRRZECDLOLHSGJ-SFHVURJKSA-N 379.464 2.592 0 50 GFAA Cc1cc(Br)cc2cc(C(=O)NC[C@@H]3C[C@H]4C[C@@H]3[C@H](O)[C@@H]4O)oc12 2325797072 GLBSDSJDJVUEBH-GCBQJEFOSA-N 394.265 2.611 0 50 GFAA Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2ccc3n2CCNC3)c1C 2325800729 CYBRBOQFBOMZIE-UHFFFAOYSA-N 377.492 2.974 0 50 GFAA O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1c[nH]c2nc(Cl)ccc12 2325804659 CNEDYMQLVJMDMF-OAHLLOKOSA-N 384.867 2.713 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC2=NC[C@H]3CC[C@@H](C)CN23)cc1 2325863706 ULYWITCEURDXOG-SOLBZPMBSA-N 392.569 2.838 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NS(=O)(=O)c2ccc(Cl)cc2)c1 643515 FXOGBTZUZYXHKQ-UHFFFAOYSA-N 383.809 2.714 0 50 GFAA NC(=O)CSc1nnc(COc2cccc3cccnc23)n1-c1ccccc1 832568 HWIOXTPKGMSPSP-UHFFFAOYSA-N 391.456 2.972 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)ccc1Cl 2349839 LABDFAOKPOIAGQ-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA O=C(c1cc(O)nc2ccccc12)N1CCc2nc(-c3ccccc3)nn2CC1 2356151994 LHUFGFNWSFBCTO-UHFFFAOYSA-N 385.427 2.897 0 50 GFAA COc1cc(CNCCO)cc(I)c1OC1CCCC1 2863692 XQOSOYDUBZHFET-UHFFFAOYSA-N 391.249 2.703 0 50 GFAA COC(=O)c1cc(NC(=O)c2ccccc2NS(C)(=O)=O)ccc1Cl 6267396 RLHYRVGGTNVKCB-UHFFFAOYSA-N 382.825 2.750 0 50 GFAA Cc1ccccc1NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 6339544 AXPMMGQBXSEICW-UHFFFAOYSA-N 388.489 2.587 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)c1ccc(CSc2ncn[nH]2)o1 55089736 WOWMNTNRINYJRA-UHFFFAOYSA-N 386.412 2.978 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)[C@H]2OCCc3ccccc32)cc1 136714511 ZQVGBEFPYCAUSL-IBGZPJMESA-N 388.489 2.968 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H](Cn3ccnc3)C2)cc1NC(=O)[C@@H]1CCCO1 20821557 FHFUDHFEPARDCZ-PXNSSMCTSA-N 396.491 2.861 0 50 GFAA Cc1ncc2c(c1-c1noc(CCC(=O)Nc3cccc(F)c3)n1)CCNC2 20598825 DNINRQMJLBPHPA-UHFFFAOYSA-N 381.411 2.796 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)c2c[nH]c(=O)cc2O)CCO3)cc1 67726026 UCDPBVYHBBGPOL-UHFFFAOYSA-N 392.411 2.796 0 50 GFAA Cc1ccc(C)c(OCCN(C)C(=O)Cc2ccc(-n3nnnc3C)cc2)c1 63856689 HBEONHKIOLLUAC-UHFFFAOYSA-N 379.464 2.667 0 50 GFAA CC(C)N(C)C[C@H](C)C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67641923 UMAYRYYQJKHKPK-AWEZNQCLSA-N 385.464 2.931 0 50 GFAA O=C(CCc1ccccc1)N1CCC(C(=O)N2CCC3(CCNCC3)CC2)CC1 252482652 DLQNUEBSJJBUKY-UHFFFAOYSA-N 397.563 2.850 0 50 GFAA CN(C(=O)CN1CCN(Cc2cccnc2)CC1)[C@H]1CCCc2ccccc21 125314500 DIBZKTJASQXCRH-QFIPXVFZSA-N 378.520 2.735 0 50 GFAA COCc1nc2ncc3c(=O)n(-c4cccc(C(F)(F)F)c4)ccc3n2n1 71375693 CCAPELZNLRXDJB-UHFFFAOYSA-N 375.310 2.594 0 50 GFAA Cn1ccnc(N2CCC[C@H](NCc3ccc(Oc4ccccc4)o3)C2)c1=O 328629436 IFJSIGGSSJTQSR-INIZCTEOSA-N 380.448 2.924 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cccc(C)c3F)CC2)C1 71776503 YTGHKLBAUNWEMI-LJQANCHMSA-N 391.531 2.573 0 50 GFAA CC(C)[C@@H](NC(=O)CN1[C@@H](C)C[C@H](O)C[C@H]1C)c1ccc2c(c1)OCCCO2 241644366 PQESKIOZKOMVCP-UNMKOGDSSA-N 390.524 2.895 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N(CCC(=O)O)C3CCOCC3)c2)n1 237665687 IMUTUSGWZJRLCR-UHFFFAOYSA-N 385.464 2.644 0 50 GFAA C[C@@H](OCC(=O)N1CCc2c(ncn2CCc2ccccc2)C1)c1nccn1C 376991348 HOKAOZRGBOUIEN-QGZVFWFLSA-N 393.491 2.522 0 50 GFAA Cc1cc(C(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)c2c(C)noc2n1 41843766 IGGLWRYYGRDMSX-INIZCTEOSA-N 384.436 2.544 0 50 GFAA Nc1ncc(Cl)cc1S(=O)(=O)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1 178907315 CAAMSHXPKOMYAU-CYBMUJFWSA-N 393.856 2.846 0 50 GFAA Nc1ncc(Cl)cc1S(=O)(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1 178907300 CAAMSHXPKOMYAU-ZDUSSCGKSA-N 393.856 2.846 0 50 GFAA O=C(O)Cn1nccc1[C@@H]1CCCN(C(=O)Cc2c(F)cccc2Cl)C1 426415308 IKADPQTXEHVAHG-GFCCVEGCSA-N 379.819 2.709 0 50 GFAA COc1cc(N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)ncn1 91745294 CZJWTRGWTUJXOT-UHFFFAOYSA-N 380.492 2.937 0 50 GFAA Cc1nn(C)c(NC(=O)N2CCN(c3ncccn3)CC2)c1-c1ccccc1 95525879 AOYXALQGGJGGFH-UHFFFAOYSA-N 377.452 2.540 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)c1ccc3[nH]c(C)nc3c1)CC2 91536910 AJMHSJKAFCCQFN-UHFFFAOYSA-N 398.507 2.753 0 50 GFAA Cc1cc(CNC(=O)c2cnc(Cc3c(Cl)cccc3Cl)[nH]c2=O)n[nH]1 91943452 YYXUNSDASXGHSK-UHFFFAOYSA-N 392.246 2.629 0 50 GFAA Cc1cc(Cl)cc(Cl)c1CNC(=O)[C@@H]1CCC(=O)N(CCN(C)C)C1 91445109 VLXLMPTULBERDS-CYBMUJFWSA-N 386.323 2.718 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccccc3F)CC2)CN1CCc1c[nH]cn1 91877052 HXCUONSVONXQSL-UHFFFAOYSA-N 384.455 2.636 0 50 GFAA CCC(=O)N[C@@H]1CC[C@@]2(OC)CCN(C(=O)Cc3cccc(F)c3F)[C@H]2C1 534652436 SXRNTDHKRJMDEI-PTSWNOGYSA-N 380.435 2.572 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)C3CCOCC3)C[C@@H]1N(Cc1ccc(C)o1)CC2 534660426 MZPRGZNFPHYEAY-SLYNCCJLSA-N 376.497 2.643 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1ncn(-c2ccc(OC(F)F)cc2)n1 261490513 BHHLOFWBTHWWLG-UHFFFAOYSA-N 388.330 2.908 0 50 GFAA NCc1nc2c(s1)CCN(C(=O)[C@H]1CCn3c(cnc3C3CCCCC3)C1)C2 1333712121 UCPFSWYKSKLPCT-HNNXBMFYSA-N 399.564 2.993 0 50 GFAA CCSc1ccccc1NC(=O)C1CCN([C@@H]2CCS(=O)(=O)C2)CC1 952868006 VVECSZDOJFHMDS-OAHLLOKOSA-N 382.551 2.636 0 50 GFAA Cc1ccc(N2CCCN(C(=O)c3cnc(-c4ccccc4)nc3C)CC2)nn1 164092912 HSUPIQPBCHDLBW-UHFFFAOYSA-N 388.475 2.903 0 50 GFAA Cc1cc(N2CCOCC2)ccc1NC(=O)NCc1cccnc1-n1ccnc1 193353698 RATQEUUUPXYFTG-UHFFFAOYSA-N 392.463 2.734 0 50 GFAA COc1cccc(OC)c1CNC[C@@H]1C[C@H](CO)N(C)[C@@H]1c1ccccc1F 1615633401 HCRKDVZNWXNIGO-DMPWYTOCSA-N 388.483 2.986 0 50 GFAA CCN1CCNC(=O)[C@@H]1CC(=O)N(C)Cc1sc2ccccc2c1Cl 1506399062 XWXHUNWJVZAKDF-ZDUSSCGKSA-N 379.913 2.724 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCC(OCc3ccccn3)CC2)CC1 1506418532 QMMGJJURNUWAEX-UHFFFAOYSA-N 380.492 2.762 0 50 GFAA CCOC(=O)COc1ccc(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)cc1 1163085 ZNBPZRHKTUKNKE-WOJGMQOQSA-N 398.390 2.861 0 50 GFAA COc1cccc(CN(C(=O)c2cnc(C(N)=O)cn2)C2CCCCCC2)c1 1772711264 AGRIDJZJHBNLNL-UHFFFAOYSA-N 382.464 2.949 0 50 GFAA CCn1cc([C@@H]2C[C@H]3CN(Cc4ccc(OC)cc4)C(=O)[C@]34CCCN24)cn1 11764725 QRXVQTMSQHSEEK-VCOUNFBDSA-N 380.492 2.850 0 50 GFAA O=C(NCCc1cccc(C(F)(F)F)c1)c1cc(CN2CCC[C@H](O)C2)on1 11843335 FBVWNKKGVHGAAL-HNNXBMFYSA-N 397.397 2.623 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H]3CCCN(c4ncccn4)C3)cc2)n1 11873043 CZZVSEMRRYJEQN-HXUWFJFHSA-N 390.491 2.737 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(Cc3ccco3)CC2)C1 12449391 UAMKDVQJDVRKDC-SFHVURJKSA-N 382.508 2.667 0 50 GFAA COc1ccc(Cc2n[nH]c3c2CN(CCCn2cccn2)CC3)cc1OC 19536677 IFZIZGXSPSIMSN-UHFFFAOYSA-N 381.480 2.663 0 50 GFAA COc1cc(S(=O)(=O)N2CCN=C2c2ccccc2)c(OC)cc1Cl 19909323 XNZNNQGQYUJURS-UHFFFAOYSA-N 380.853 2.808 0 50 GFAA CCn1ccc(C(=O)N[C@H]2CCCN(c3cc(-c4ccc(OC)cc4)n[nH]3)C2)n1 169753938 FFSATHNZTCOSRY-INIZCTEOSA-N 394.479 2.701 0 50 GFAA NC(=O)[C@@H]1CCCN(CCCn2ccnc2-c2ccc3cccc(F)c3n2)C1 1857684197 CNUKAILEDJGLDQ-MRXNPFEDSA-N 381.455 2.825 0 50 GFAA CC(C)n1nccc1C(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3)C[C@]23CC[C@H]1O3 1857732508 UGQVOXXNHSYSNU-KLJZETAQSA-N 394.519 2.873 0 50 GFAA CCCC(=O)N1C[C@@H]2[C@H](CNC(=O)c3sccc3Cl)[C@H]3CC[C@]2(C1)O3 1857735645 IXDIQDNDRAAQJV-NMFBSDBYSA-N 382.913 2.937 0 50 GFAA O=C(c1ccc2c[nH]nc2n1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857739240 FYXVIGRNQRGVFN-PMACEKPBSA-N 391.475 2.636 0 50 GFAA COc1ccccc1C(=O)N1CCC[C@H](N(Cc2cncnc2)C(C)=O)CC1 328632934 LPEIGAIWCYTPMK-SFHVURJKSA-N 382.464 2.529 0 50 GFAA CCN1CCC[C@@H](CN(C)[C@H](C)C(=O)N2CCCCCC2)[C@@H]1c1cnn(C)c1 328631790 KWXGCGNSFMNWAI-SVFBPWRDSA-N 389.588 2.916 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)C2(c3ccc(Cl)cc3)CC2)N(c2ccncn2)C1 864336644 VIVYEASOGNHCGB-IRXDYDNUSA-N 386.883 2.572 0 50 GFAA COc1cccc(C(F)(F)CNC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)n1 952853103 IBLJZNQGTSGOLG-KBRIMQKVSA-N 377.366 2.959 0 50 GFAA O=C1NCCCN1CCCNC(=O)N1CCC[C@@H](c2c[nH]c3ccccc23)C1 1875296023 VRKPDQTZBGKNEW-MRXNPFEDSA-N 383.496 2.862 0 50 GFAA COC[C@@H](Cc1ccc(F)cc1F)NC(=O)[C@H]1CCCN1Cc1ccccn1 1875320014 CJTCZIYIMLQSPG-UYAOXDASSA-N 389.446 2.698 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCO[C@H](C(F)(F)F)[C@H]3C)ccc21 1875372056 VDEUGLZCLZHEII-PXAZEXFGSA-N 382.382 2.944 0 50 GFAA CC(C)Cc1ccc2c(N)c(C(=O)N3CC[C@H]([C@@H]4CNC(=O)C4)C3)sc2n1 1875313468 RJIUSSLIEFYQTC-STQMWFEESA-N 386.521 2.675 0 50 GFAA NC[C@H](NC(=O)NCc1cc2cc(Br)ccc2o1)C(F)(F)F 1875320132 HWWGNKXPCFNIHR-NSHDSACASA-N 380.164 2.884 0 50 GFAA CC(C)=CC(=O)NC[C@]1(C)CCCN(C(=O)[C@@H]2CCO[C@H]2c2ccncc2)C1 1775989236 HTWVYPWTYKXTRV-CBQOVEMMSA-N 385.508 2.870 0 50 GFAA N[C@H]1CCc2ncc(NC(=O)c3n[nH]c4cc(OC(F)(F)F)ccc34)cc2C1 2325727107 SBIHVWKBLLZZDN-JTQLQIEISA-N 391.353 2.925 0 50 GFAA COc1ccc(-n2[nH]c(=NC(=O)N3CC[C@@](N)(c4ccccc4)C3)cc2C)cc1 2325773105 SUGJSPCXQJVWSW-QFIPXVFZSA-N 391.475 2.703 0 50 GFAA CCc1csc(-n2cc(C(=O)N3CCN(c4ccncc4)[C@H](C)C3)cn2)n1 881633292 ULXRKIBJMHPBHJ-CQSZACIVSA-N 382.493 2.637 0 50 GFAA CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1-c1cccnc1 779280 FOJOTBSDRLRATR-UHFFFAOYSA-N 383.433 2.820 0 50 GFAA CCOC(=O)CN1C(=O)[C@](O)(CC(=O)c2ccc(C)cc2C)c2ccccc21 780150 ZMKSFOWJCZLVOI-QFIPXVFZSA-N 381.428 2.674 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1 789069 HXCORFNGPVTRJT-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA CCOC(=O)c1sc2ncn(CC(=O)OC3CCCCC3)c(=O)c2c1C 921158 UVCVRTIZDGEVQS-UHFFFAOYSA-N 378.450 2.819 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)Nc2cccc(C(C)=O)c2)S(C)(=O)=O)cc1 1115782 NZOMHXITBQRMKK-ZDUSSCGKSA-N 390.461 2.691 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc1 2356141618 JGCQLKMYRGFXTC-JOCHJYFZSA-N 379.508 2.729 0 50 GFAA Cc1oc(-c2ccc(F)cc2)nc1CN1CCC[C@]12CCCN(CCO)C2=O 2356144497 APTBTALQAMKIQA-NRFANRHFSA-N 387.455 2.738 0 50 GFAA O=C(CCc1nc(Cl)n[nH]1)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356145922 XTOJDEPMKNKCSU-UHFFFAOYSA-N 399.882 2.963 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1CCC[C@]2(CCc3c[nH]c(=N)nc32)C1 2356146665 PJYSLOUZNCGKLR-QFIPXVFZSA-N 375.476 2.728 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(C)nc43)C2)cc(OC)c1OC 2356155372 DWYGKZKZMZUXPA-JOCHJYFZSA-N 397.475 2.931 0 50 GFAA Cc1ccccc1N1CCN(S(=O)(=O)C[C@@]23CC[C@@H](CC2=O)C3(C)C)CC1 4412571 TZHZUCUJVSBWEW-UWJYYQICSA-N 390.549 2.842 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccncc2)cc1C(=O)Nc1ccccc1 6716005 VJKWXYIQGYDMBN-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@@H](N2CCN(c3ccc(F)cc3)CC2)C1 55309829 RPCNTXPPIKUDCX-JOCHJYFZSA-N 396.510 2.967 0 50 GFAA OCC[C@H]1CN(Cc2ccc3nsnc3c2)CCN1Cc1ccc(F)cc1 20543209 PTIUGRKZDFLXNX-SFHVURJKSA-N 386.496 2.899 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(NCCc3ccco3)nc2)CC1 20542259 ULFOBUYBLSWFTR-UHFFFAOYSA-N 396.491 2.804 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)C2CCOCC2)CCO3)n1 67513825 CVHRPUNNYSHGCC-UHFFFAOYSA-N 383.448 2.614 0 50 GFAA CCN(Cc1ccc(C(=O)Nc2c(C)noc2C)cc1)[C@@H]1CCS(=O)(=O)C1 65527808 QNGLTWAOCOLSLA-QGZVFWFLSA-N 391.493 2.553 0 50 GFAA C[C@@H](C(=O)Nc1nc2c(s1)COCC2)N1CCN(c2ccc(F)cc2)CC1 171869843 SBKNCMQOUFXCBR-ZDUSSCGKSA-N 390.484 2.504 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2cnc3c(c2)c(C)nn3C)n1C 328650270 VMPQXVUAKGURQJ-SFHVURJKSA-N 380.496 2.702 0 50 GFAA O=C(Nc1ccccc1F)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 72140702 WASUXTJZSMZBRR-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)COc3ccc(F)cc3F)CC2)oc1C 363510551 LENLTKNHZGNISQ-UHFFFAOYSA-N 393.434 2.977 0 50 GFAA Cc1ccnc(C2CCN(C(=O)CCc3nc(-c4ccccn4)no3)CC2)n1 363826148 LKAASCIQRNCPKZ-UHFFFAOYSA-N 378.436 2.569 0 50 GFAA O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1CCC[C@]2(C1)C(=O)Nc1ccccc12 72158753 UNSJDGXKUBKDIN-JOCHJYFZSA-N 388.427 2.908 0 50 GFAA COc1ccccc1CN1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71763838 ZENCUWWUELSXMY-HXUWFJFHSA-N 385.552 2.994 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@H](O)c3ccc(Cl)s3)c2c1 240278294 DQCNAPUOWFICCR-LBPRGKRZSA-N 383.882 2.894 0 50 GFAA Cn1ccc2ccc(NC(=O)N3CCC[C@H]3c3nc(C(=O)NC4CC4)no3)cc21 372831055 MGJLWADTUXEHKI-HNNXBMFYSA-N 394.435 2.823 0 50 GFAA Cc1cc(OCC(=O)O)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 262911578 CQGCXPSITPGQIU-JKSUJKDBSA-N 383.400 2.972 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N(CCC(=O)O)C[C@H]3CCCO3)c2)n1 237665762 JCMJQKCQKNOPOS-LJQANCHMSA-N 385.464 2.644 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NCc3ccsc3)cc12 14537655 HYDLWKSJQJYXLR-UHFFFAOYSA-N 388.449 2.618 0 50 GFAA O=C1N(Cc2noc(-c3ccccc3)n2)c2ccccc2NC12CCNCC2 82092850 OHZDDNHZUKKJKX-UHFFFAOYSA-N 375.432 2.818 0 50 GFAA C[C@@H](N1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1)C(F)(F)F 175962011 ZSJPYWUJMIMCRU-OAHLLOKOSA-N 384.446 2.933 0 50 GFAA CCc1nc(-c2ccc(C(=O)N[C@H]3CCS(=O)(=O)c4ccccc43)cc2)n[nH]1 178451750 IMQCIIAOEDGIAZ-INIZCTEOSA-N 396.472 2.683 0 50 GFAA Cc1ccc(N2C[C@H](NC(=O)c3cc(O)nc4cc(F)ccc34)CC2=O)cc1 426612544 OMWNYWJWEJCKGG-CQSZACIVSA-N 379.391 2.923 0 50 GFAA Cc1nn(CC(=O)N[C@@H](C)c2nc3c(s2)CCCC3)c(=O)c2ccccc12 223525544 DFOZTWTZXMWNMI-ZDUSSCGKSA-N 382.489 2.918 0 50 GFAA COc1ccc(OC)c(CNC(=O)N(C)C[C@@H]2Cc3ccccc3CN2C)c1 426566780 BGMQWBIRPXLRFB-IBGZPJMESA-N 383.492 2.902 0 50 GFAA O=C1CC2(CCN(S(=O)(=O)C3CC3)CC2)CN1Cc1ccc(Cl)cc1 95525210 CCUFIWCDXTUDDW-UHFFFAOYSA-N 382.913 2.647 0 50 GFAA C[C@@H](O)C(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 95531409 ZCBGTOWEZSSREC-CYBMUJFWSA-N 386.414 2.721 0 50 GFAA CNC(=O)c1cc2c(s1)CCN(C(=O)[C@@H]1CCCN(C3CCCC3)C1)C2 91305882 AOSUPTHAPKWPHI-CQSZACIVSA-N 375.538 2.647 0 50 GFAA Cc1c(CN2CC[C@H](N3CCN(C)CC3)[C@H](CCC(=O)O)C2)[nH]c2ccccc12 95357156 ZSOGOHDXHIVBIL-GCJKJVERSA-N 398.551 2.779 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CC[C@@H](Cc3ccc(CO)cc3)C2)CC1 91391314 HYJSCTPILZBYAM-FQEVSTJZSA-N 379.504 2.743 0 50 GFAA COC(=O)c1cc(C)ccc1S(=O)(=O)NCc1cn(C)nc1-c1ccccc1 182325362 JEFFAPZULOQVFM-UHFFFAOYSA-N 399.472 2.661 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)Nc1ccc2nsnc2c1 252550153 SBKNIWSNCQZMQL-CQSZACIVSA-N 381.417 2.810 0 50 GFAA COc1cc2c(cc1OC)CC(=O)N(CCC(=O)Nc1cccc(O)c1)C=C2 253408332 KQIJZUHZSYIPKL-UHFFFAOYSA-N 382.416 2.794 0 50 GFAA biogenic CN(C[C@@H]1COc2ccccc2O1)C(=O)NC1CCN(Cc2ccco2)CC1 534587700 VFTZYZVFGGAFPK-GOSISDBHSA-N 385.464 2.725 0 50 GFAA COc1ccccc1NC(=O)CN1CCC[C@H](CNC(=O)c2ccsc2)C1 952972630 VNRAGCLDQYSYCP-OAHLLOKOSA-N 387.505 2.837 0 50 GFAA COc1ccc2cc(C(=O)N3C[C@@H]4C[C@@H](C3)[C@H]3CCCC(=O)N3C4)n(C)c2c1 888088483 BRTJPWSEVDLZHZ-QILLFSRXSA-N 381.476 2.660 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)Nc1nnc(C)n1C 277208865 MDVCMBRWVCVPBF-WMZOPIPTSA-N 380.452 2.642 0 50 GFAA CC(C)c1nn(C)c(N2CCOCC2)c1CNC[C@H]1CCO[C@@H]1C(C)(C)C 189235003 PLXOWBQTJHQJEC-APWZRJJASA-N 378.561 2.921 0 50 GFAA OC1(c2cccnc2)CCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 1506406723 OBHZLCRZPAHCFH-QFIPXVFZSA-N 381.520 2.656 0 50 GFAA COc1ccc(CN(CC(=O)N2C[C@H](C)O[C@H](C)C2)Cc2ccccn2)cc1 1506396582 VLQDFRBBZBWYGY-HDICACEKSA-N 383.492 2.728 0 50 GFAA Cc1cccc(CCCNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2C)c1 1529195887 PKAUBINDRNLLML-YADHBBJMSA-N 380.488 2.951 0 50 GFAA CCCCOc1c(CN2CCC3(CC2)C[C@](C)(O)[C@@H](O)CO3)cccc1OC 1704313020 KNUWCNCFFZAWNE-FPOVZHCZSA-N 393.524 2.741 0 50 GFAA COCCC(=O)N1C[C@@H]2CN(Cc3ccccc3-c3ccccc3)C[C@]2(CO)C1 1772701608 LNADRGGQIWHUAR-XUZZJYLKSA-N 394.515 2.643 0 50 GFAA COCc1c(C(=O)NCc2ccccc2OC)nnn1-c1cc(C)cc(C)c1 12274069 QCCMRPZWDPSHNB-UHFFFAOYSA-N 380.448 2.969 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(c4cnccn4)C3)C2=O)c1OC 12714125 OMEQIMCXYOQNPD-NRFANRHFSA-N 382.464 2.513 0 50 GFAA O=C(c1coc(COc2cccc(F)c2F)n1)N1CCN(CC2CC2)CC1 12717123 ZWRCESJFLNHRPB-UHFFFAOYSA-N 377.391 2.700 0 50 GFAA CC(=O)c1cccc(N(CC(=O)N2CCCc3ccccc32)S(C)(=O)=O)c1 13676253 JTGPFNPCKYANCO-UHFFFAOYSA-N 386.473 2.635 0 50 GFAA CCCCCOc1cc(S(=O)(=O)N2CCC(C(N)=O)CC2)ccc1Cl 16651117 NCUAKFMJCOGPPX-UHFFFAOYSA-N 388.917 2.795 0 50 GFAA COCCOC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)[C@H]1c1cccc(N)c1 19881387 GUJDTMSUOZMUQI-IBGZPJMESA-N 388.464 2.645 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)[C@H]3CC[C@@H](O)CC3)C1)CC2 1857697150 XTRAGVUIAUCCPV-KIMHZCHSSA-N 387.524 2.837 0 50 GFAA O=C(NC1CCC1)[C@]12COC[C@H]1CN(Cc1ccc(-c3ccccn3)cc1)C2 1857707498 VFCXTKMZEAKFBK-AUSIDOKSSA-N 377.488 2.866 0 50 GFAA CC(C)Cc1ccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2cnn(C)c2)cc1 1857717445 SXNGNQGVALQTIE-SFTDATJTSA-N 384.524 2.763 0 50 GFAA CCOC(=O)N1CCC(NC(=O)c2sc(-c3ncccn3)nc2CC)CC1 1857717624 QJMUVZPQNJRHFA-UHFFFAOYSA-N 389.481 2.513 0 50 GFAA Cc1cccc2nc(C(=O)N[C@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)cn12 1857720951 RRAFOPZJUTUDID-CMKODMSKSA-N 376.460 2.587 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N[C@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1 1875245286 SVVRIILTALYLEK-OKZBNKHCSA-N 384.455 2.506 0 50 GFAA COCc1cc(CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)ccc1OC 1875245744 ONSJWIDILJYYTI-FYYLOGMGSA-N 399.487 2.722 0 50 GFAA COc1ccc(-c2nccn2C2CCS(=O)(=O)CC2)cc1Cn1cccn1 1875247390 LFJOYNUWSRAKQN-UHFFFAOYSA-N 386.477 2.553 0 50 GFAA OCCCN(Cc1ccccn1)Cc1cc2c(cc1Br)OCCO2 225519701 IDXVHCFIRRFEGF-UHFFFAOYSA-N 393.281 3.000 0 50 GFAA Cc1cccn2cc(COc3ccc(C(=O)NCC[C@H]4CCC(=O)N4)cc3)nc12 952845379 FTJBUVIWDRCHGW-QGZVFWFLSA-N 392.459 2.620 0 50 GFAA COC(=O)N1CCN(C(=O)c2cc3cccc(C(F)(F)F)c3nc2O)C[C@@H]1C 1875296226 KRAYFSQXAURLFC-JTQLQIEISA-N 397.353 2.872 0 50 GFAA CC(C)[C@@H](C(=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(O)nc1)c1ccccc1 1875328764 LQJPDKZYMUOCDK-UYAOXDASSA-N 381.476 2.900 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)C2(c3cc(C)no3)CC2)CC[C@@H]1c1ccc(F)cc1 1875383001 AZTXMSPAOBKBEH-MSOLQXFVSA-N 397.450 2.841 0 50 GFAA COC(=O)[C@@H](CNC(=O)[C@H](N)CC1CC(F)(F)C1)Cc1ccc(Cl)cc1 1875305071 FNCFQHKIXRVDCA-UKRRQHHQSA-N 388.842 2.551 0 50 GFAA COC(=O)c1cc(C2CCN(C(=O)c3cnn(-c4ccccc4)c3C)CC2)[nH]n1 1875302510 TVTAMAOEMQDKAP-UHFFFAOYSA-N 393.447 2.710 0 50 GFAA CC(C)Cn1cccc(C(=O)N[C@@H](CO)c2ccccc2C(F)(F)F)c1=O 886571051 HDPGBCSAVCNCKK-INIZCTEOSA-N 382.382 2.987 0 50 GFAA O=C(N[C@H]1CCCc2c1cnn2Cc1ccccc1)N[C@@H]1CCc2c[nH]nc2C1 1319170010 DRJLBNIICDJAJP-MJGOQNOKSA-N 390.491 2.889 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCO2)cccc1C(=O)N(C)[C@H]1C[C@H]2C[C@@H](O)C[C@H]2C1 2100483272 IINFYGXCPZCTNV-PHSQPZKOSA-N 386.492 2.734 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3ccccc3-n3cccn3)cn12 2100484024 ZQBTYCQHLMPQDZ-LJQANCHMSA-N 390.447 2.534 0 50 GFAA COCCn1c(N)c(C(=O)NCc2cccs2)c2nc3ccccc3nc21 2335645 CZPDFOGUMBHOHX-UHFFFAOYSA-N 381.461 2.805 0 50 GFAA O=C(c1cccnc1OCCO)N1CCC(Oc2ccc(Cl)cc2)CC1 2325782173 ANPJMSSFQOESMV-UHFFFAOYSA-N 376.840 2.790 0 50 GFAA COCC(C)(C)C(=O)N[C@H](CCN(C)C(=O)c1ccc2[nH]ccc2n1)C(C)C 2325793080 DYZSQLOSFMSVHR-OAHLLOKOSA-N 388.512 2.838 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3C[C@H]4[C@@H](CO)[C@@H]5CC[C@@]4(C3)O5)ncnc21 2356164307 NYEURZDPSKVZJU-NTPFDHPUSA-N 399.539 2.801 0 50 GFAA Cc1ccc(CN2CCN(Cc3c(C)nn(C)c3Cl)C[C@H]2CCO)cc1 58494574 MWDNVIMDGGXUNO-GOSISDBHSA-N 376.932 2.759 0 50 GFAA COc1ccc(C(=O)[C@H](C)OC(=O)c2ccc(NC(=O)CCC(=O)O)cc2)cc1 8473686 BWYMGXYAXXHOGE-ZDUSSCGKSA-N 399.399 2.927 0 50 GFAA O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NC1=NCCS1 9263898 GZPMHTAVTVDQGV-UHFFFAOYSA-N 385.474 2.838 0 50 GFAA O=C(Nc1cccc(Cn2cncn2)c1)N1CCN(Cc2cccs2)CC1 56733046 AXGLHXGAEUEQTR-UHFFFAOYSA-N 382.493 2.738 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCC[C@@H](Cn2cc(CCCO)nn2)C1 23398253 JMLFVDKCEAHRGU-CQSZACIVSA-N 377.876 2.801 0 50 GFAA CN(C)C(=O)c1ccc([C@@H]2CCCN2C(=O)CSc2nccn2C)s1 20860382 CRDXLDWFWIKUON-LBPRGKRZSA-N 378.523 2.639 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCc2[nH]nc(-c3ccccc3F)c2C1 20683414 DXEPJOMCFYPKAC-UHFFFAOYSA-N 376.395 2.765 0 50 GFAA CC(C)Cn1c(CN(C)[C@H]2CCOC2)cnc1S(=O)(=O)Cc1ccccc1 20256581 WVVVJBSOCOFQRU-SFHVURJKSA-N 391.537 2.734 0 50 GFAA CCc1ccc([C@H]2c3[nH]c4ccccc4c3CCN2C(=O)CNC(N)=O)cc1 12072601 MIUYMBPPFSZEQM-NRFANRHFSA-N 376.460 2.873 0 50 GFAA C[C@H](C(=O)Nc1nc2c(s1)COCC2)N1CCN(c2ccc(F)cc2)CC1 171869844 SBKNCMQOUFXCBR-CYBMUJFWSA-N 390.484 2.504 0 50 GFAA Cc1cccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1 30850280 CAXNKZDJSUGUIF-MRXNPFEDSA-N 378.519 2.774 0 50 GFAA COc1ccc2[nH]cc(CC(=O)NS(=O)(=O)Cc3ccc(C)cc3C)c2c1 252498877 ROTHMFCALHGEQZ-UHFFFAOYSA-N 386.473 2.982 0 50 GFAA COc1ccc(OC2CCN(C(=O)C[C@@H]3CN(C(C)C)CCO3)CC2)cc1 77520727 CFCYFQGSEXJORL-HXUWFJFHSA-N 376.497 2.564 0 50 GFAA Cc1cccc(NC(=S)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1 6334672 BYDQCQOKDBQRQM-UHFFFAOYSA-N 375.519 2.698 0 50 GFAA CN(C)[C@@H]1Cc2ccccc2N(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)C1 122815403 YDEUUUIFDXOCHF-OAHLLOKOSA-N 399.516 2.598 0 50 GFAA Fc1ccccc1N1CCN([C@H]2CCCN(CCn3cc(Cl)cn3)C2)CC1 72172407 UXLGQYKBDHZDRF-SFHVURJKSA-N 391.922 2.962 0 50 GFAA CC(C)(C(=O)N[C@@H]1CCN(c2ncccc2F)C1)c1ccc2c(c1)OCCO2 153463732 LNCIWFYQPCBKBQ-OAHLLOKOSA-N 385.439 2.665 0 50 GFAA Cn1cc([C@H](NC(=O)N2CC(O)(c3ccc(F)cc3)C2)c2ccccc2)cn1 365791002 AWDRAXFXLDFCKR-LJQANCHMSA-N 380.423 2.562 0 50 GFAA O=C(c1ncn(-c2ccccc2)n1)N1CCCC[C@@H]1c1nnc2n1CCCC2 158785524 PZSYKXJQDSXVFZ-MRXNPFEDSA-N 377.452 2.563 0 50 GFAA O=C(CN1CCN(Cc2cnc3ccccn23)CC1)Nc1ccccc1Cl 157426607 DMQGQBBHBIRRRZ-UHFFFAOYSA-N 383.883 2.744 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N(CCC(=O)O)C[C@@H]1CCCO1 237668952 DODWYUJHUUPROX-AWEZNQCLSA-N 378.450 2.736 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@@](CO)(c3ccccc3)C2)cc1F 374621708 WYAFOUUPZAMZHV-LJQANCHMSA-N 379.453 2.549 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CCN2CCC[C@@H]2CO)c2ccccc2)cc1 174867901 AGZXDBVEMYBRGB-TZIWHRDSSA-N 388.533 2.861 0 50 GFAA COc1ccc(CCN[C@@H]2CCCc3ccc(S(N)(=O)=O)cc32)cc1F 289912603 UTAHMMCGXFCENQ-GOSISDBHSA-N 378.469 2.691 0 50 GFAA Cc1c(C(=O)NCc2ccc(Cn3ccnc3)cc2)cnn1C1CCOCC1 179714370 PWXAIWCADGPHMI-UHFFFAOYSA-N 379.464 2.718 0 50 GFAA Cn1c(N2CC[C@H](O)C2)nc2cc(C(=O)N[C@H]3CCc4ccccc43)ccc21 95356092 LGGMUVCCHVKAQO-WMZOPIPTSA-N 376.460 2.562 0 50 GFAA O=C(Cc1cccc(Cl)c1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccn1)C2=O 91305222 UEIKQNWSQDJHTQ-QFBILLFUSA-N 383.879 2.927 0 50 GFAA O=C(c1cccc(=O)[nH]1)N(CC1CCN(C2CCCC2)CC1)C[C@H]1CCCO1 95530216 HDOVXVYEMFRHSN-LJQANCHMSA-N 387.524 2.651 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(Cc2cc(=O)c(OC)co2)C3)cc1 95392844 CONUAYNVJZINRW-ZWKOTPCHSA-N 384.476 2.753 0 50 GFAA CCCn1cnc2cc(NC(=O)N3CCc4[nH]nc(C(=O)OC)c4C3)ccc21 96161804 NGKGDIWNFFDMNY-UHFFFAOYSA-N 382.424 2.546 0 50 GFAA Cn1cc(C(=O)N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)cn1 92037434 ZUYNDUMGWHXLKU-VMPITWQZSA-N 378.476 2.588 0 50 GFAA CC(C)N(Cc1cc(-c2ccccc2)[nH]n1)C(=O)[C@@H]1CSC(C)(C)C(=O)N1 97301404 RIJVJZLKQBEXIC-KRWDZBQOSA-N 386.521 2.824 0 50 GFAA O=S(=O)(c1cccnc1)N1C[C@H]2CC[C@@H]1CN(Cc1ccc(F)cc1)C2 91645898 NXARFMOMISMOQJ-FUHWJXTLSA-N 375.469 2.506 0 50 GFAA CC[C@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)N2CCCOCC2)c1 95379341 GFDIAIZVEXNBOD-KRWDZBQOSA-N 380.510 2.502 0 50 GFAA O=C(NCc1nc(Cc2cccs2)no1)C1CCN(Cc2ccco2)CC1 952990653 VSVZMSHHJWPOCF-UHFFFAOYSA-N 386.477 2.843 0 50 GFAA Cc1cc(NC(=O)c2ccc(-c3nnn(C)n3)cc2)ccc1N1CCCC1=O 952989464 XETXEOGVCGFOFE-UHFFFAOYSA-N 376.420 2.565 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCC([C@@H](O)c2cccs2)CC1 952978565 APTRQPHNNMUOTI-GOSISDBHSA-N 380.535 2.870 0 50 GFAA O=C1C[C@H](C(=O)N2CCC3(CCc4ccccc43)CC2)CN1Cc1ccccn1 952968929 QQKFTLKAEHZHFX-IBGZPJMESA-N 389.499 2.937 0 50 GFAA Cc1nc(C2CC2)nc2sc(C(=O)NC[C@H](O)C3CCOCC3)c(C)c12 169990910 DOEZIAYTQBZDHD-AWEZNQCLSA-N 375.494 2.703 0 50 GFAA CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 170596161 RUCQOCCYDZRMGC-YLJYHZDGSA-N 399.516 2.560 0 50 GFAA C[C@H](NC(=O)[C@H]1COc2ccccc2C1)C(=O)Nc1cccc(N2CCCC2)c1 195356133 HGTWILMJLNDVRX-FUHWJXTLSA-N 393.487 2.981 0 50 GFAA COc1ccc(-n2ncnc2[C@@H]2CCCN(C(=O)c3cc(C)on3)CC2)cc1 1772804300 LMLCKIGWWJOBMU-OAHLLOKOSA-N 381.436 2.982 0 50 GFAA CC(C)=CCN1CCC[C@@]2(C(=O)NCc3nc(C)cs3)CCN(C)C[C@H]12 1772812443 LPSKCBCFWQGUPS-FXAWDEMLSA-N 376.570 2.820 0 50 GFAA O=C(Cc1nc2ccccc2[nH]c1=O)C(=O)Nc1ccc(Cl)cc1Cl 5399463 CUERPZAKBPSMDA-UHFFFAOYSA-N 376.199 2.980 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)[C@@H]1CCCCN1CCc1ccccc1 12076050 CPSUXSLRGDWKIO-FQEVSTJZSA-N 376.464 2.698 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN([C@H](C)CC(C)(C)O)CC1 12597466 NPJUCPYRQVYXKW-OAHLLOKOSA-N 390.524 2.980 0 50 GFAA CSc1nnc(CN(C)Cc2ccc3c(c2)OCO3)n1C[C@H]1CCCO1 14983998 VSWSLWJZLIVVGB-CQSZACIVSA-N 376.482 2.540 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)cc1 19221110 DTEXRXDZTXQYBR-QHCPKHFHSA-N 381.520 2.756 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4ccc(F)cc4)nnc23)n1 169776049 XOQNZWCKIAWAJU-UHFFFAOYSA-N 380.383 2.801 0 50 GFAA C/C=C/CCCC(=O)NC[C@H]1[C@H]2CN(CCn3nccc3C)C[C@]23CC[C@H]1O3 1857733275 CMUSZIALYBTMOF-NXWSUDGBSA-N 386.540 2.534 0 50 GFAA Cc1cccc(Cl)c1S(=O)(=O)N1CCN(C(=O)c2cscn2)[C@@H](C)C1 416500738 FHTJSDAWXCGYLV-LBPRGKRZSA-N 399.925 2.640 0 50 GFAA C[C@H](O)C1CCN(C(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1 118731367 GOVWWNRARWOAMJ-ZFWWWQNUSA-N 385.430 2.936 0 50 GFAA O=C(CCc1cccc2c1B(O)OC2)N1CCC(Nc2ccc(Cl)cc2)CC1 1875368577 BGIWSQBRVNCDCM-UHFFFAOYSA-N 398.699 2.593 0 50 GFAA C[C@H]1CCNC(=O)[C@H]1CNC(=O)NCc1c(F)cc(C(F)(F)F)cc1F 1875313137 HVHWPRGPZGKTOK-WPRPVWTQSA-N 379.329 2.555 0 50 GFAA Cc1ncsc1C(=O)N1CC2(CCN(C(=O)c3ccc(F)c(F)c3)C2)C1 1875309454 UOANOGRGAJONIS-UHFFFAOYSA-N 377.416 2.718 0 50 GFAA CC[C@@H](CC1CCCC1)C(=O)NCC1(C)CCN(C(=O)CN(C)C(C)=O)CC1 2325794113 QWZUHUWQKLVSRY-IBGZPJMESA-N 393.572 2.816 0 50 GFAA Cc1nnc([C@H](C)N2CCC[C@](C)(CNC(=O)c3nccc4[nH]ccc34)C2)o1 2325812130 VJMZPIMTRFQTDW-RNODOKPDSA-N 382.468 2.847 0 50 GFAA O=C(O)c1cn(CCCCNC(=O)c2cc(F)ccc2-c2ccccc2)nn1 2325870717 LXIPXKYHSFRNHK-UHFFFAOYSA-N 382.395 2.993 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@@]12CCCN2CCOCc1ccccc1 2356148946 BHBRZBYKNVNWEM-FUDKSRODSA-N 386.536 2.964 0 50 GFAA CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1-c1ccccn1 2522926 YIYRKNVSQSDBFM-UHFFFAOYSA-N 397.460 2.862 0 50 GFAA O=C(Cc1ccccc1)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 2850674 LXQNLKDSVAWVTK-UHFFFAOYSA-N 381.476 2.541 0 50 GFAA COC(=O)C1=C(CSc2nccn2C)NC(=O)N[C@@H]1c1cc(C)ccc1C 4809628 RPYKLMVYMGADHU-MRXNPFEDSA-N 386.477 2.610 0 50 GFAA CCOc1ccc(-c2noc(CCCC(=O)NCCCOC)n2)cc1OC 4866659 XYOCIRJIYIHZMF-UHFFFAOYSA-N 377.441 2.619 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2Cl)C1 4868037 XPEAOUXCAGEILO-SNVBAGLBSA-N 377.293 2.673 0 50 GFAA O=C(NCc1nnc(SCC(=O)N2CCCCCC2)o1)c1ccccc1F 4969365 YLZKJWLWGMPSCB-UHFFFAOYSA-N 392.456 2.633 0 50 GFAA O=C([C@@H]1[C@H]2CNC[C@H]21)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 102478295 ARPQKNKXDXCCCO-DZFIZOCASA-N 384.863 2.899 0 50 GFAA Cc1cc(C)cc(N2C(=O)C[C@H](Sc3nnnn3-c3ccccc3)C2=O)c1 100119002 ZRBULFJFAZMPTP-INIZCTEOSA-N 379.445 2.703 0 50 GFAA CN(Cc1ccc2nsnc2c1)C(=O)c1ccc(CSc2ncn[nH]2)o1 55414034 NEGIJKJGTAPKJG-UHFFFAOYSA-N 386.462 2.967 0 50 GFAA Cc1csc(CCCNC(=O)NCCNC(=O)c2ccccc2Cl)n1 171079158 ZPMHHKBVCHIPTG-UHFFFAOYSA-N 380.901 2.767 0 50 GFAA Cc1nc(NCCNC(=O)c2ccccc2C(F)(F)F)cc(-n2cccn2)n1 67601945 MFUPAGWASKEWMK-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA Clc1ccccc1Cn1ncc2c(NCCCN3CCOCC3)ncnc21 20590540 CPCJOBDMHIHWEP-UHFFFAOYSA-N 386.887 2.662 0 50 GFAA CC(=O)NCCC(=O)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67655037 OSRBGHGXTGYBBF-UHFFFAOYSA-N 388.851 2.960 0 50 GFAA COCCc1noc([C@H]2CCCN2CC(=O)N2CCCc3cc(C)ccc32)n1 65409127 YAZQWQWTRSJBLK-GOSISDBHSA-N 384.480 2.683 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)c2c(C)cc(C)n(C)c2=O)cn1 67649152 DNFCHHQZKJRRMR-UHFFFAOYSA-N 378.432 2.823 0 50 GFAA CCN(C(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1)[C@H](C)CS(C)(=O)=O 230125192 MVKLWVXGMQKNDO-PMPSAXMXSA-N 397.541 2.587 0 50 GFAA COc1ccc(-c2c3c(=O)n(Cc4ccccn4)ccc3nc3nc(C)nn23)cc1 36352629 SAASKNJQTXWTJE-UHFFFAOYSA-N 398.426 2.867 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)c2ccc(Cl)s2)cn1 328620146 GSYDVGMKMVFISY-SMDDNHRTSA-N 375.903 2.817 0 50 GFAA CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1noc2c1CCCC2 329776101 NTTFHPSYFQYZLW-UHFFFAOYSA-N 384.480 2.956 0 50 GFAA CN1C(=O)[C@@](CC(=O)NC(C)(C)C(=O)O)(Cc2ccccc2)c2ccccc21 71760817 HAAMLNGHEURTRY-JOCHJYFZSA-N 380.444 2.513 0 50 GFAA COc1ccc2c(c1)CN(C(=O)CCS(C)(=O)=O)[C@@H](C1CCCCC1)C2 364026274 UDQOXGZBYACJAS-LJQANCHMSA-N 379.522 2.964 0 50 GFAA Cn1cc([C@@H]2CN([C@@H]3CCN(c4ccc(F)cc4)C3=O)CC23CCOCC3)cn1 334058966 XLYMNZDQRWTTFD-VQTJNVASSA-N 398.482 2.561 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cccs1 238148512 VLVGCUXOAUHIFR-GXFFZTMASA-N 394.399 2.711 0 50 GFAA CCc1ccc([C@@H]2CNCCN2C(=O)c2cnc(O)c(Br)c2)cc1 262256376 QOIXWEAZFDUTGT-INIZCTEOSA-N 390.281 2.899 0 50 GFAA Cc1ccc(NC(=O)CN(C2CC2)[C@H]2CCc3ccccc32)cc1S(N)(=O)=O 157825886 OXKKODDXKDYPTM-IBGZPJMESA-N 399.516 2.733 0 50 GFAA CCOCc1cccc(NC(=O)C(=O)N2[C@H]3C=C(c4ccnn4C)C[C@H]2CC3)c1 375028709 YWVOQCJJKZVSBN-RTBURBONSA-N 394.475 2.742 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC[C@@H](O)c1ccccc1 47681027 FTTFGHLPOVQHFR-HXUWFJFHSA-N 381.476 2.846 0 50 GFAA Cc1nc(O)c2c(n1)CCN(C(=O)c1ccc(CN3CCCCC3)cc1)CC2 426723844 HSSXJUSYWGSMKU-UHFFFAOYSA-N 380.492 2.718 0 50 GFAA Nc1cc(-c2ccc(C(=O)N3CCCC[C@H]3CCn3cccn3)cc2)ncn1 426606777 RDNMNTHWVXUBQJ-SFHVURJKSA-N 376.464 3.007 0 50 GFAA O=C1CCC2(CCN(c3ncnc4[nH]ccc34)CC2)CN1CCc1ccccn1 95392704 IEXYDQCQDCSYSL-UHFFFAOYSA-N 390.491 2.805 0 50 GFAA Cn1cncc1-c1ccc(C(=O)N2CCCN(Cc3ccccn3)CC2)cc1 426489628 KTRUYMOGFHMNSR-UHFFFAOYSA-N 375.476 2.830 0 50 GFAA COc1cccc2[nH]cc(CCNC(=O)C3CCN(c4cnccn4)CC3)c12 179959789 LADQCCAYCCMMAK-UHFFFAOYSA-N 379.464 2.542 0 50 GFAA Cc1cccc2cc(C(=O)N3CC[C@H](N4CCN(C)CC4)[C@H](CCCO)C3)oc12 95357962 NHAZFCGQPMZTQZ-UXHICEINSA-N 399.535 2.592 0 50 GFAA COc1cccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 92098095 WCXGZXYLDXHHLO-UHFFFAOYSA-N 380.492 2.704 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3cccnn3)C2)CN1CCc1ccccc1 91475776 ABDPFFVOKQPOMQ-QFIPXVFZSA-N 378.476 2.564 0 50 GFAA O=C1NCCN1Cc1ccccc1NCc1nc(CCc2ccccc2)no1 184441288 NRNMFTXWSOJPCU-UHFFFAOYSA-N 377.448 2.992 0 50 GFAA COCCn1ccnc1CN1CCC[C@@H](CNC(=O)c2ccc(C)s2)C1 824466132 MCUSKTWOSQRDSI-INIZCTEOSA-N 376.526 2.541 0 50 GFAA O=C(NC[C@H](O)c1cccc(O)c1)NC1CCN(Cc2ccccc2F)CC1 584895159 RCERIWXFRJHNOU-FQEVSTJZSA-N 387.455 2.529 0 50 GFAA CCCc1ccc(CN2CC[C@]3(O)CCN(C(=O)N4CCCC4)C[C@@H]3C2)o1 1565505573 PAGMECZHVADGKG-UWJYYQICSA-N 375.513 2.707 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCC(Cn3ccnn3)CC2)ncn1 275709858 NZCPMOLXIXNEHX-FXAWDEMLSA-N 385.516 2.600 0 50 GFAA O=C(c1ccn(CC(F)F)n1)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 194044812 FBZJRPXCKDTSEK-UHFFFAOYSA-N 398.417 2.568 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H](CO)C(C)C)ccc1F 1704306500 NQFZXTPLSVMKCY-CYBMUJFWSA-N 379.432 2.550 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC[C@@H](C)N(C)C)ccc1F 1704315544 JQKXQZVOYFBQPC-GFCCVEGCSA-N 378.448 2.625 0 50 GFAA CC(=O)N1CCC(CC(=O)N2CCC[C@@H](C)C2)(N2Cc3ccccc3C2=O)CC1 1772501663 YJWVXPGGUXNTEX-QGZVFWFLSA-N 397.519 2.672 0 50 GFAA CCCO[C@@H]1CCCN(c2ccc(C(=O)N(CC)Cc3nccn3C)cn2)C1 11664492 OAJSTALJQYMTLV-GOSISDBHSA-N 385.512 2.873 0 50 GFAA COc1ccc(NC(=O)CSc2nnc(-c3ccccc3)c(=O)[nH]2)cc1OC 11990956 XECWFCDUZLBRFT-UHFFFAOYSA-N 398.444 2.580 0 50 GFAA COc1ccc(CCN2C[C@@H](NC(=O)Nc3ccccc3OC)CC2=O)cc1 12714401 YHJGTYSAVQVERK-INIZCTEOSA-N 383.448 2.669 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)N3CCC[C@H](O)C3)CC2)CC1 14959951 YRFSGOZUBHWLPQ-QHCPKHFHSA-N 399.579 2.655 0 50 GFAA CCS(=O)(=O)c1ncc(CN2C[C@H](C)O[C@H](C)C2)n1CCc1ccccc1 15041912 HZZDURLLDLPHJE-CALCHBBNSA-N 391.537 2.529 0 50 GFAA O=C(C1CCN(Cc2ccccn2)CC1)N1CCN(Cc2ccccc2)CC1 15856055 VZCMMFUFMPDVRR-UHFFFAOYSA-N 378.520 2.638 0 50 GFAA CN1CCN(Cc2nc(N)nc(Nc3ccc(Oc4ccccc4)cc3)n2)CC1 19944511 LWFZICWQFPFKDS-UHFFFAOYSA-N 391.479 2.737 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2CCCO2)cc1Oc1cccc(OC)c1CN 1857682724 MGFFETCPDCCURT-HNNXBMFYSA-N 386.448 2.864 0 50 GFAA CN1CCN(C(=O)C[C@@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)CC1 1857712814 IFROUEPWYREGJB-AWEZNQCLSA-N 376.888 2.862 0 50 GFAA Cc1ccnc(N2CCC(C3CCN(C(=O)[C@@H]4C[C@@H]5CC[C@H]4O5)CC3)CC2)n1 1857721322 JZCSZLGZKUYZBU-XUVXKRRUSA-N 384.524 2.808 0 50 GFAA COc1ccc(F)c(CN2C[C@@H]3[C@H](CNC(=O)C4(C)CC4)[C@H]4CC[C@]3(C2)O4)c1 1875241258 SDQWJQSESAFBST-ODULNIPZSA-N 388.483 2.730 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](NC34CC5CC(CC(C5)C3)C4)C2=O)c(OC)c1 4195783 QDMQGUGANXXLCL-DCJJRUGTSA-N 384.476 2.894 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(C(=O)N2CCC(Cc3ncc[nH]3)CC2)c1C 425302828 LGAVDVLISOAERD-UHFFFAOYSA-N 375.494 2.525 0 50 GFAA Cc1nc(SCC(=O)Nc2ccc(Cl)c(Cl)c2)[nH]c(=O)c1CCO 11905724 PKCOLAYMOUSEQT-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA O=C(C1CCN(c2cnccn2)CC1)N1CCN(c2ccc(Cl)cc2)CC1 132683903 GWLYYIPXIZGRMY-UHFFFAOYSA-N 385.899 2.695 0 50 GFAA CC(C)=CCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)Cc1cnc3c(C)cccn13)C2 248297195 YAYYNSYVQMBPPC-MSOLQXFVSA-N 380.492 2.601 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)cc1Cl)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 249515218 IWVVWAVDNJYPHA-ZTEQUAQWSA-N 381.803 2.749 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc4nccnc4c3)C1)CC2 1704301070 IPIRZQNZHOPNQO-QFIPXVFZSA-N 388.475 2.606 0 50 GFAA O=C(N[C@H](c1ccc(Cl)c(F)c1)c1nn[nH]n1)[C@@H]1CCOC2(CCCC2)C1 907414438 WRAWYTVKCLQIIA-IUODEOHRSA-N 393.850 2.937 0 50 GFAA CC(=O)NCC(=O)O[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 835542270 GYCLGOJUIVWEKF-IRXDYDNUSA-N 376.453 2.807 0 50 GFAA N[C@H]1CCCCCC[C@H]1C(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894170 MRYVULVLPAYMLK-MOPGFXCFSA-N 394.523 2.937 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)N3Cc4ccc(OC)cc4C3)CC2=O)c1 952993354 XZOMQASIJQLKOG-MRXNPFEDSA-N 381.432 2.535 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCN(C)C[C@H]1c1ccnn1C)c1cccc(-n2ccnc2)c1 1875267165 VBZRMHFTGYWFFO-PWIZWCRZSA-N 392.507 2.519 0 50 GFAA Cc1nc(C)c(C(=O)NCCCCc2cn(-c3ccccc3C(=O)O)nn2)s1 1875325283 VBBXTXYZRHDYJR-UHFFFAOYSA-N 399.476 2.792 0 50 GFAA COC(=O)c1cc(=NC(=O)N2CCCC[C@@H]2c2nc3ccccc3s2)[nH]n1C 2325761837 ZZBGYVWVDIFFAG-CYBMUJFWSA-N 399.476 2.997 0 50 GFAA COc1cc(F)ccc1S(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1 936474 JIFUXWHLHBMBTL-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA COc1cc([C@@H]2N[C@H](C(=O)O)Cc3c2[nH]c2ccccc32)cc(OC)c1OC 3882108 SAADZRJBOQGELC-YJBOKZPZSA-N 382.416 2.882 0 50 GFAA biogenic,in-vitro CN(Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1)C[C@H]1CCCCO1 55153714 ZVVXHFQPJSGBGD-GOSISDBHSA-N 383.558 2.868 0 50 GFAA O=C1N[C@](Cc2ccccc2)(C2CCNCC2)C(=O)N1C1Cc2ccccc2C1 67974868 ORGKEMRVBRQWFR-XMMPIXPASA-N 389.499 2.687 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNCc3cc(C)ccc3C)C2=O)c1 67805445 PSLBIWOAMVDLQE-QHCPKHFHSA-N 382.504 2.955 0 50 GFAA O=C(NCCNC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccccc1Cl 171607811 JEANCOUWOXLJAH-MRXNPFEDSA-N 392.931 2.730 0 50 GFAA CN(Cc1cnn(C)c1)C(=O)c1cc2cc(Br)ccc2oc1=O 651180 UDZPLMWXMIMTHC-UHFFFAOYSA-N 376.210 2.561 0 50 GFAA CC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)cc1 7058752 SYFDUWWGMIOVSZ-UHFFFAOYSA-N 380.416 2.678 0 50 GFAA Cc1nc(C2CCCC2)sc1C(=O)N1CCN(c2ncccc2C(N)=O)CC1 172916354 QRZUTDKFOLQAMT-UHFFFAOYSA-N 399.520 2.565 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(OC[C@@H]2CCCCO2)CC1 363357858 WUUXNXAQJFMIJL-IBGZPJMESA-N 399.495 2.527 0 50 GFAA CO[C@H]1[C@H](NC(=O)CCOc2ccccc2)c2ccccc2C12CCNCC2 72480784 JNEACNUPMWDUSD-YADHBBJMSA-N 380.488 2.963 0 50 GFAA C[C@H]1Cc2cc(S(=O)(=O)NC(=O)CCCc3ccccn3)cc(Cl)c2O1 127369080 FNPUZWFPPFQIMJ-LBPRGKRZSA-N 394.880 2.886 0 50 GFAA O=C(CN1CCN(c2ncccc2Cl)CC1)NCC1(c2ccccc2)CC1 155955451 TZUZLIHAZFGMQP-UHFFFAOYSA-N 384.911 2.705 0 50 GFAA CC(C)Oc1ccc2c(NC(=O)[C@@H](N)[C@@H](C)O)nn(Cc3ccccc3)c2c1 77426553 LGGXKGKNQCRBJK-KUHUBIRLSA-N 382.464 2.518 0 50 GFAA Cc1nc(CN2CCCN([C@H](C)C(=O)N3C[C@H](C)C[C@@H](C)C3)CC2)oc1C 370807980 GHSCVWMZEYEERW-JFIYKMOQSA-N 376.545 2.692 0 50 GFAA C[C@H]1CCCN1C(=O)Cn1c(-c2ccco2)nn(-c2ccc(Cl)cc2)c1=O 77285170 HMZDXNFOGLZRNN-ZDUSSCGKSA-N 386.839 2.958 0 50 GFAA O=C(CN1CCC[C@]2(C3=CCOCC3)COCC[C@@H]12)NCc1cccs1 1076111905 KHQHJGJXRLYLBV-UYAOXDASSA-N 376.522 2.582 0 50 GFAA CN(Cc1nc(-c2ccccn2)no1)C(=O)c1ccc(C(F)(F)F)nc1O 77406104 ZQHVJHWJHZEVBL-UHFFFAOYSA-N 379.298 2.523 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CC[C@H]3[C@H](CCCN3C3CC3)C2)c1 158141556 LXPMVMPUMCUDEW-APWZRJJASA-N 395.511 2.841 0 50 GFAA Cc1nsc(N2CCCN(S(=O)(=O)c3cccc(C(C)C)c3)CC2)n1 173878710 SFPDUODDGXZDBJ-UHFFFAOYSA-N 380.539 2.871 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(C[C@]1(c3cccc(F)c3)CCOC1)C2 72431698 MDXUUIKVTTWJER-OAQYLSRUSA-N 387.455 2.603 0 50 GFAA CCc1cc(C)c(C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)o1 160573606 USYXSFRCHHAUEV-UHFFFAOYSA-N 377.466 2.972 0 50 GFAA O=C1c2ccccc2C(=O)N1CN1CCN(Cc2c(F)cccc2Cl)CC1 20045345 OVBPZNWDQZVWBI-UHFFFAOYSA-N 387.842 2.850 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(F)(F)F)cc(-c3ccn(C)n3)nc21 20605471 YKXRVWBNSWUOOR-UHFFFAOYSA-N 385.371 2.520 0 50 GFAA CCCn1cnnc1CNC(=O)N(C)Cc1cccc(-n2nc(C)cc2C)c1 426567157 WIMFXVVCBZKBAF-UHFFFAOYSA-N 381.484 2.832 0 50 GFAA O=C(NCCC[C@H]1CCOC1)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91585957 LTFXGTFBQFVWNC-HIGJEIRPSA-N 385.508 2.784 0 50 GFAA COCCOc1ccc([C@@H](C(=O)O)N2CCN(c3ccc(C)cc3)CC2)cc1 95392449 GWFMCGWLBZWMOT-NRFANRHFSA-N 384.476 2.968 0 50 GFAA CCc1ncc(CN2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cn1 95386098 HTAGBLUXKMCYOO-CDNPAEQRSA-N 392.503 2.830 0 50 GFAA O=C(c1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)c1)N1CCCCC1 239322007 JAYJDNGAUOGCSR-RPZLJYRGSA-N 376.456 2.870 0 50 GFAA O=C(NCc1ccco1)c1ccsc1NC(=O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 239331255 KJDXXVXBZRNICE-UOVKNHIHSA-N 386.429 2.733 0 50 GFAA CN(Cc1cccc(-c2nnn[nH]2)c1)C(=O)c1ccc([C@@H]2CCCNC2)cc1 95388615 SFANMRCJHIMMAL-LJQANCHMSA-N 376.464 2.606 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(COc3ccccc3N3CCCCC3)n2C)C1 244734998 NRHVLVGWQVKKEG-QAQDUYKDSA-N 383.496 2.767 0 50 GFAA COc1cccc(N2CCN(CCC(=O)NCc3cccs3)[C@@H](C)C2=O)c1 244899757 ZPOXWTLYXPCJMA-HNNXBMFYSA-N 387.505 2.500 0 50 GFAA O=C(Nc1nc2ccccn2n1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 184323268 BPDSLIFZGVBUQW-LBPRGKRZSA-N 388.378 2.731 0 50 GFAA COc1ccc(-c2n[nH]c(C)c2CC(=O)N[C@@H](CO)Cc2ccccc2)cc1 252482995 DRZSIYZEQMQDNQ-GOSISDBHSA-N 379.460 2.656 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)c(OC)c1 263617576 ONLPTEBSJWBQAA-GOSISDBHSA-N 398.394 2.958 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)N1CCC[C@@H](c2ncc[nH]2)C1 534586963 BJUJBMPCHUQDKH-MRXNPFEDSA-N 380.452 2.515 0 50 GFAA NCCCOc1ccc(C(=O)N[C@@H]2CCCN(C(=O)c3cccs3)C2)cc1 299799542 HCBJBIPTLMWDMZ-MRXNPFEDSA-N 387.505 2.510 0 50 GFAA Cc1cc(-c2ccnc(-n3ncc(C(=O)N(C)CCO)c3C3CC3)n2)c(C)s1 299785681 RJROEHOTTARDQT-UHFFFAOYSA-N 397.504 2.949 0 50 GFAA O=C(Nc1ccnn1C[C@@H]1CC=CCC1)NC1CCN(c2cnccn2)CC1 299802160 XRCIDAGYLZEUGR-MRXNPFEDSA-N 381.484 2.820 0 50 GFAA O=C(NCCCn1cccn1)c1cccc(-c2cc(N3CCCC3)cnn2)c1 299793967 JDGKODYMNAFAEU-UHFFFAOYSA-N 376.464 2.760 0 50 GFAA O=C(NCc1nc(-c2ccccc2Cl)no1)N1CCC[C@]2(CCNC2)C1 827933719 CDVZSWCMCCUFAP-GOSISDBHSA-N 375.860 2.675 0 50 GFAA Cc1ccccc1[C@]1(O)CCN(C(=O)NCCc2noc(C3CCCC3)n2)C1 584901860 AJXABIGFYQYKDL-NRFANRHFSA-N 384.480 2.881 0 50 GFAA Cc1ccc2[nH]cc(CCNC(=O)C[C@@H]3CS(=O)(=O)c4ccccc4O3)c2c1 1336758704 CANWZOOUNPFJRF-MRXNPFEDSA-N 398.484 2.760 0 50 GFAA Cc1cc(OC[C@H](O)CNC(=O)CCc2n[nH]c3c2CCCC3)ccc1Cl 952965169 QMQQXWZCMHGHME-CQSZACIVSA-N 391.899 2.739 0 50 GFAA CCN(CC)C(=O)C1(N[C@H]2CCN(c3ccccc3OC)C2=O)CCCCC1 192674766 FDRGZIXFZLIKDZ-KRWDZBQOSA-N 387.524 2.961 0 50 GFAA CCN(CC)Cc1cc(CN2CCN3[C@H](COC[C@H]3C3CC3)C2)ccc1OC 1616078634 ADCAQZJZFCPBFJ-VXKWHMMOSA-N 387.568 2.832 0 50 GFAA Cc1ncc(CN(CCN(C)C)C(=O)c2ccc(CN3CCC(C)CC3)o2)[nH]1 1704304315 QATSCQFZTLMMGN-UHFFFAOYSA-N 387.528 2.747 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cncnc4)C[C@H]2CN(Cc2ncc[nH]2)C3)cc1 1772809342 TYDRSXCGVHOULL-GMAHTHKFSA-N 388.519 2.767 0 50 GFAA O=C(NCc1ccc(Cl)s1)[C@H]1CCC(=O)N(CCc2ccccn2)C1 11937194 QEWIECWZTJMODU-ZDUSSCGKSA-N 377.897 2.894 0 50 GFAA COc1ccc(CNC(=O)c2cn(C(C)C)cc(C(=O)NCC(C)C)c2=O)cc1 12055006 FVHMBLKVUVHRMJ-UHFFFAOYSA-N 399.491 2.754 0 50 GFAA CCC[C@H](CC(=O)OCC)NC(=O)c1cn(Cc2ccc(Cl)cc2)nn1 12387429 JGQWOJBMAVZXNO-OAHLLOKOSA-N 378.860 2.832 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)NCc3ccc4c(c3)OCO4)n[nH]2)c1 12444892 RFOGWVQEFVGITH-UHFFFAOYSA-N 393.399 2.850 0 50 GFAA COC[C@H](C)N1CCC(n2nccc2NC(=O)c2ccc3c(c2)OCO3)CC1 12708202 PXVRDACEXRQYAX-AWEZNQCLSA-N 386.452 2.536 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NC1Cc3ccccc3C1)C2 14751336 SIKYSHQTBNLERT-GOSISDBHSA-N 378.520 2.661 0 50 GFAA O=C1C[C@H](N2CCN(c3ccc(F)cc3)CC2)C(=O)N1c1cccc(Cl)c1 18137111 WKSCQRLRRZYKCY-SFHVURJKSA-N 387.842 2.933 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCCC23CCN(Cc2cccnc2N)CC3)cc(O)n1 1857700349 ACBCNOAPMUSXMZ-GOSISDBHSA-N 395.507 2.638 0 50 GFAA COc1cc(-c2nc(CNC(=O)[C@@H]3COc4ccccc4O3)c(C)o2)ccc1O 1857702805 PRMFPNUCEQVYCV-IBGZPJMESA-N 396.399 2.820 0 50 GFAA Cc1ccnn1CCC(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857717238 NUTLXUTYBBYVDK-UNMCSNQZSA-N 382.508 2.646 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC(C)C)CC[C@H]1NC(=O)c1cc(C2CC2)nn1C 1875247277 ISNRQQZGFULSIR-FRQCXROJSA-N 390.528 2.516 0 50 GFAA Cc1cc(Br)ccc1S(=O)(=O)N1CCCC[C@@H]1c1nc[nH]n1 133484809 ADZZRFHGSCIDDB-GFCCVEGCSA-N 385.287 2.792 0 50 GFAA COCCn1nc(C)c(S(=O)(=O)N2C[C@H]3CC[C@H]2c2ccccc23)c1C 952845209 JUXUOQKHKKOTHZ-QAPCUYQASA-N 375.494 2.769 0 50 GFAA O=C1C[C@H](CNC(=O)c2cnn3c(C(F)F)cc(-c4ccccc4)nc23)CCN1 1875312352 LPIFALWHEWUMJK-GFCCVEGCSA-N 399.401 2.590 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CC[C@H](C)S(=O)(=O)C1 888101717 PUWPKNSJQAWATC-LSTDLKDCSA-N 394.537 2.950 0 50 GFAA C[C@H](CC(=O)N[C@](C)(CNC(=O)c1cc(C2CC2)[nH]n1)C1CC1)c1ccncc1 1775997165 XHKCZWFAJMQCHF-JLCFBVMHSA-N 395.507 2.891 0 50 GFAA Cc1ccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC(C)CC3)n2)cc1 1857797734 HWCGIIKSIDBKRL-KRWDZBQOSA-N 393.491 2.905 0 50 GFAA Cc1cc2nsnc2c(S(=O)(=O)N2CCN=C2Cc2ccccc2)c1C 19874252 OBUWQUOEIIJJFP-UHFFFAOYSA-N 386.502 2.954 0 50 GFAA CCc1ncnc(N(C)CC[C@H](NC(=O)c2c(C)nn(C)c2F)C(C)C)c1F 2325794926 XARISGQXSMHPOY-AWEZNQCLSA-N 394.470 2.640 0 50 GFAA C[C@H]1Cc2ccccc2N(S(=O)(=O)c2cn(C)nc2Br)[C@H]1C 2325829550 MNXWPZPCXMJHTC-QWRGUYRKSA-N 384.299 2.959 0 50 GFAA CCOC(=O)CN1C(=O)[C@](O)(CC(=O)c2cc(C)c(C)cc2C)c2ccccc21 1064956 YMKWRUBKSNTRNS-QHCPKHFHSA-N 395.455 2.982 0 50 GFAA COC(=O)c1ccccc1NC(=S)N[C@H](NC(C)=O)C(Cl)(Cl)Cl 1232357 FBMQXFUTLGCCFL-NSHDSACASA-N 398.699 2.592 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(C(=O)O)[C@@H]3CC[C@]21C 1318483 RIUISGYIXPQHGQ-IZIWQKFHSA-N 392.492 2.669 0 50 GFAA O=C(c1conc1-c1ccccc1)N1CCc2nc(-c3cccnc3)nn2CC1 2356168009 LZAOEOWMEKCMSH-UHFFFAOYSA-N 386.415 2.694 0 50 GFAA CCCNS(=O)(=O)c1ccc(OCC(=O)NCCC2=CCCCC2)cc1 2857898 ZCLQIXFSPOJWSW-UHFFFAOYSA-N 380.510 2.760 0 50 GFAA CC[C@H](Oc1ccccc1OC)C(=O)Nc1ccccc1C(=O)N1CCOCC1 8478091 GSTPULJGDOFTKC-SFHVURJKSA-N 398.459 2.964 0 50 GFAA O=C1C[C@@H](CNC(=O)C2(c3cccc(Br)c3)CCCCC2)CN1 413882295 QEVDTOUEGXNOLA-CYBMUJFWSA-N 379.298 2.903 0 50 GFAA O=C(NC[C@H]1CSCCN1Cc1ccccc1)c1ccc(-n2ccnn2)cc1 225438962 GMEYKEMYOGCTOO-FQEVSTJZSA-N 393.516 2.615 0 50 GFAA O=C1CN(c2ccc(C(=O)N3CCC(CCc4ccccc4)CC3)cn2)CCN1 20295568 ZZRINIKFYJSVMX-UHFFFAOYSA-N 392.503 2.503 0 50 GFAA COc1ccc(S(=O)(=O)N(C[C@@H](O)CC(C)(C)C)C2CCN(C)CC2)cc1 225828930 NURMGQSXMPDELK-KRWDZBQOSA-N 398.569 2.577 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)N2CCC[C@@H](n3cncn3)C2)C[C@@H](C)O1 246754355 CITIFVOLDHOWJS-IXDOHACOSA-N 384.484 2.761 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccc(OCC)cc3)[C@@H](CCO)C2)CC1 20541765 ZJCZSTWPVBTVKY-QFIPXVFZSA-N 389.584 2.828 0 50 GFAA CCCN1CCC[C@H]1CNC(=O)[C@@H](NC(=O)c1c(F)cccc1F)C(C)C 253417567 ARQDAGYTWBDMRO-KSSFIOAISA-N 381.467 2.710 0 50 GFAA CN1C(=O)CO[C@@H](c2nc(C3(c4ccccc4)CCC3)no2)[C@H]1c1cnn(C)c1 351201121 BHMSDTJEULFJPK-QZTJIDSGSA-N 393.447 2.544 0 50 GFAA O=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1nccs1 67955337 NQDNRHGYPXCYOR-OAQYLSRUSA-N 398.532 2.956 0 50 GFAA CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1 155292263 FAFKKKSKWFCBIM-QRVBRYPASA-N 394.475 2.947 0 50 GFAA O=C(Nc1ccn2ccnc2c1)N1CCOC[C@@H]1c1ncnn1-c1ccccc1 368001286 YDJVZNQXFFJTOO-QGZVFWFLSA-N 389.419 2.520 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3cnc(NCC)nc3)CC2)OC1=O 72427236 HJXHZMMNUBZDLY-AWEZNQCLSA-N 375.473 2.524 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 72121776 DSIZCHYSSGNLOW-GOSISDBHSA-N 387.524 2.570 0 50 GFAA CCc1ccc(C(=O)O)cc1S(=O)(=O)NC[C@@H](c1ccco1)N1CCCC1 236973930 YURURMYNWGCFLH-INIZCTEOSA-N 392.477 2.656 0 50 GFAA CC(C)c1nnsc1CN1CCN(Cc2ccc(F)cc2)[C@H](CCO)C1 72431579 JJIGCRDSKKNKGZ-QGZVFWFLSA-N 378.517 2.869 0 50 GFAA Cc1nn(-c2ccc(Br)cc2)c(C)c1CNCC1(O)CCOCC1 237697182 WNWRPRFWONJNDB-UHFFFAOYSA-N 394.313 2.883 0 50 GFAA O=C(Nc1cc(N2CCCS2(=O)=O)ccc1F)c1noc2c1CCCCC2 129359882 SIDYCTOKNKRZEU-UHFFFAOYSA-N 393.440 2.875 0 50 GFAA O=C(Nc1ccc(CNC(=O)c2cnc3n2CCCC3)cc1)c1cccnc1 378230855 QTLSZNCYWPHAKT-UHFFFAOYSA-N 375.432 2.797 0 50 GFAA COc1ccccc1N1CC[C@@H](N(C)C2CCN(CC(F)(F)F)CC2)C1=O 452028032 BGIKICBBNCRXMZ-MRXNPFEDSA-N 385.430 2.759 0 50 GFAA Cc1ccccc1SCC(=O)N1CCC(N2CCC[C@H](C(=O)O)C2)CC1 219860199 BKZZDZSHIBQBNH-INIZCTEOSA-N 376.522 2.875 0 50 GFAA CCC[C@@H](NC(C)=O)C(=O)N1CCC(n2cc(C3CCCCC3)nn2)CC1 48360834 OBTNNBTYWSCDHH-GOSISDBHSA-N 375.517 2.794 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cc3ccccc3[nH]c2=O)[C@H](C)C1 72477364 WGYOPRRMFDEJBG-OAHLLOKOSA-N 377.444 2.888 0 50 GFAA CN(C)c1ncc(CN2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 72171126 QQPPJJSPXZYPOO-PWRODBHTSA-N 381.499 2.744 0 50 GFAA COc1cccc(-c2c3c(=O)n(Cc4ccccn4)ccc3nc3ncnn23)c1 40398269 FWLRRMBYKWLUPX-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA CCN1CCC(CCNC(=O)N2CCC(NC(=O)c3ccccc3)CC2)CC1 175956203 OTRHYUADGACTAE-UHFFFAOYSA-N 386.540 2.712 0 50 GFAA O=C1Cc2cc(CCCC(=O)N3CCC[C@@](O)(C(F)(F)F)CC3)ccc2N1 287775296 IFIDTDXNBKQXJW-SFHVURJKSA-N 384.398 2.810 0 50 GFAA CC(=O)c1ccc(OCC(=O)N2CC(=O)N(c3ccccc3C)C[C@H]2C)cc1 82133638 FBTDFLDRPCPDIN-MRXNPFEDSA-N 380.444 2.840 0 50 GFAA CC[C@H](O)c1cc2n(n1)CCN(Cc1ccc(OC)c(Cn3cccn3)c1)C2 221434955 ZRZSBAXGEKRMAP-FQEVSTJZSA-N 381.480 2.596 0 50 GFAA O=C(N[C@H](c1ccccc1)c1ccncc1)N1CCN(C2CCOCC2)CC1 426405727 OBUUIPZRNQWTIU-OAQYLSRUSA-N 380.492 2.677 0 50 GFAA CN1CCCN(Cc2nc(-c3ccncc3)nn2CCc2ccccc2)CC1 96141729 RFKYONXJRMPYDT-UHFFFAOYSA-N 376.508 2.720 0 50 GFAA O=C(Nc1ccc2ncccc2c1)N1CCN(Cc2ccco2)[C@H](CCO)C1 95508293 TWUXMXUQSBSONT-GOSISDBHSA-N 380.448 2.929 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CN2CCCOCC2)cc1 95513126 NTQFTIAFODHMNA-QFIPXVFZSA-N 384.520 2.781 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)c1 92020142 PWQSRQOPTCAENO-FQEVSTJZSA-N 384.520 2.948 0 50 GFAA COc1ccc(CN2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)cc1C 95364154 MXWHDLLFQYKFGA-GOSISDBHSA-N 380.496 2.757 0 50 GFAA CN1CCc2nc(NC(=O)c3cn(-c4cccc(Cl)c4F)nn3)sc2C1 180335217 JDFXHUABYVANKC-UHFFFAOYSA-N 392.847 2.757 0 50 GFAA Cc1ccccc1NC(=O)N1CCC[C@@H](c2nnc(Cn3ccnc3)n2C)C1 95364633 VYTLAIGFZNDANR-MRXNPFEDSA-N 379.468 2.780 0 50 GFAA Cc1ccc([C@@H](CNC(=O)c2ccccc2-c2ncc[nH]2)N2CCOCC2)o1 97474990 BVRHEOKNEXCWMS-GOSISDBHSA-N 380.448 2.781 0 50 GFAA COC(=O)[C@@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@@]12C 253604838 RKZIYOHKBLFLTH-YLDNAQMQSA-N 394.552 2.757 0 50 GFAA C[C@H]1NC(=O)N(c2ccccc2NC(=O)c2ccc(N3CCCC3=O)cc2)C1=O 952872760 BWHPQWMVJOVLRA-CYBMUJFWSA-N 392.415 2.510 0 50 GFAA O=C(c1ccn(C(F)F)n1)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565528749 DJTSSRRKKRICCR-PBHICJAKSA-N 386.446 2.982 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCC[C@H]2C[C@@H](O)c2ccco2)c1 268184042 JJDUFOHBWMGPNS-GOEBONIOSA-N 387.436 2.768 0 50 GFAA CC(=O)N1CCC(CC(=O)NC2CCCCC2)(N2Cc3ccccc3C2=O)CC1 888105535 NAHQBHMJIFBYOA-UHFFFAOYSA-N 397.519 2.863 0 50 GFAA COc1ccc2cc(CN[C@H]3CCCN(C(=O)c4ccco4)C3)c(O)nc2c1 952977512 KDUORJKKNDBPKF-INIZCTEOSA-N 381.432 2.936 0 50 GFAA N[C@@H](C(=O)N1CCC(NC(=O)c2ccccc2F)CC1)c1cccc(Cl)c1 170677421 YUQWMKDEJXXADM-GOSISDBHSA-N 389.858 2.900 0 50 GFAA COc1ccc2cc(NC(=O)N3CCC(N4CCO[C@@H](C)C4)CC3)ccc2n1 171280309 LKVLDIYCEHHIQG-HNNXBMFYSA-N 384.480 2.960 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC3CCN(C4CCN(C)CC4)CC3)[nH]n2)cc1C 189195311 RZSOAINKXCCTQA-UHFFFAOYSA-N 395.551 2.982 0 50 GFAA C[C@H](NC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1)c1cccc(Cl)c1 194092222 GRVVJDNGGXTCCY-NSHDSACASA-N 382.873 2.868 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N1CCC([C@@H](O)c2cccs2)CC1 1506423089 SJXPNQFQONHCSK-LJQANCHMSA-N 393.530 2.884 0 50 GFAA c1ccc(CN2CCCO[C@H](CN3CCC(N4CCSCC4)CC3)C2)cc1 1506426612 PTGHFDQFEIWNAK-JOCHJYFZSA-N 389.609 2.791 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@@H]2CCCN(Cc3cccnc3)C2)c1C 1506406713 RGEXBWMQLOAYLE-LJQANCHMSA-N 380.492 2.808 0 50 GFAA Cc1n[nH]cc1C(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 11663718 LBZOFAKPUXALDN-HXUWFJFHSA-N 388.418 2.651 0 50 GFAA O=C(Cn1cc(NC(=O)c2ccsc2)cn1)NC[C@H]1OCCc2ccccc21 11813401 CNIMJHJGYDQKJX-GOSISDBHSA-N 396.472 2.627 0 50 GFAA CC(C)c1ccc(CN2CCC(n3cc(C(=O)NCCN(C)C)nn3)CC2)cc1 12205926 RGZGMLPCRMMOHP-UHFFFAOYSA-N 398.555 2.530 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)CCc2cn[nH]c2)C1 12207148 WKFFMYRQFBEKAV-IBGZPJMESA-N 384.524 2.764 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN2Cc2cnc(C)n2C)cc1 12433651 AOWUPSCGJUTLGL-FQEVSTJZSA-N 378.480 2.826 0 50 GFAA CC(C)c1ccc(CN2CCC[C@]3(CCN(C(=O)C4=NNC(=O)CC4)C3)C2)cc1 12576431 KQXLGVTUGJFYSL-QHCPKHFHSA-N 396.535 2.891 0 50 GFAA Cc1cc(C(=O)N2CCC(CCC(=O)N(C)Cc3ccccc3)CC2)nc(N)n1 12585236 PCXAFCXLRCBCJV-UHFFFAOYSA-N 395.507 2.658 0 50 GFAA Cc1cnnn1-c1ccc(NC(=O)c2nnn(-c3ccccc3F)c2C)cc1 13684338 IOUHQTVWHJLPIX-UHFFFAOYSA-N 377.383 2.856 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@@](CO)(Cc2ccc(F)cc2)C1 14976326 SNRGWONRTJOVRS-JOCHJYFZSA-N 387.499 2.952 0 50 GFAA O=C(N[C@H]1CCOC1)C1CCN(C2CCN(CCCc3ccccc3)CC2)CC1 19300433 GKHWEMZSDQYBJR-QFIPXVFZSA-N 399.579 2.701 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19632822 BFUJHVVEMMWLHC-UHFFFAOYSA-N 388.851 2.792 0 50 GFAA biogenic,world CCOc1ccccc1C(=O)NCc1nnc2c(-c3nc(CC)no3)cccn12 169776002 MLUYZVFUVIPJIZ-UHFFFAOYSA-N 392.419 2.670 0 50 GFAA CCc1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)n1 169778655 VLTCEWHLJPFRSX-NSHDSACASA-N 390.806 2.770 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cc(N3CCCC3=O)cc(C(F)(F)F)c2)C1 136147831 FVZWTOPKMOSGPC-NSHDSACASA-N 384.354 2.769 0 50 GFAA Cc1nnc([C@H]2CN(CC(=O)N(C)Cc3cc(Cl)cc(Cl)c3)CCO2)o1 366748249 XGEQJMNKAQSCRT-OAHLLOKOSA-N 399.278 2.717 0 50 GFAA COc1ccc(CCNC(=O)N2CC[C@H](c3nccn3C)C2)cc1OC(F)F 372886398 XTIDGLSMJSXHBY-AWEZNQCLSA-N 394.422 2.772 0 50 GFAA COc1ccc([C@H]2CCCN2C(=O)NCC2CCN(C(C)=O)CC2)cc1OC 264424952 OWINWSZMUCWGDV-GOSISDBHSA-N 389.496 2.809 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)s1 1704301312 UKKDAVYBVXQIDD-FQEVSTJZSA-N 384.505 2.927 0 50 GFAA CCCCOc1ccc(OC)cc1NS(=O)(=O)c1cccc2nn(C)nc12 1875336146 SXSDFYZFCATKFL-UHFFFAOYSA-N 390.465 2.957 0 50 GFAA CCOC(=O)C[C@@H]1C(=O)N[C@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(Cl)cc1 4196065 KPQPVPCXNWMUJO-HRCADAONSA-N 393.871 2.937 0 50 GFAA Cc1cc(-c2ccc3c(C(=O)O)n[nH]c3c2)ccc1OCCN1CCOCC1 2325772315 WSKSLKAYISZCBV-UHFFFAOYSA-N 381.432 2.948 0 50 GFAA O=C(Cc1ccccc1)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 818940 JQPOQAOFXMBBJZ-UHFFFAOYSA-N 394.496 2.915 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2cc(C)nc3c2c(C)nn3C)C1=O 2356167405 YOBSWNHQVMZDKS-NRFANRHFSA-N 383.496 2.592 0 50 GFAA O=C(c1ccccc1Cl)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 2760506 MOQVVVRHOOYXIG-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA CC(C)c1ccc(NC(=O)CSc2nnnn2-c2ccc(C(N)=O)cc2)cc1 2848328 TURBIYGBXPGSKR-UHFFFAOYSA-N 396.476 2.615 0 50 GFAA Cc1cc(NC(=O)CSc2nnnn2-c2ccccc2)n(-c2ccccc2)n1 4820917 SBBRLVVFDJBWDK-UHFFFAOYSA-N 391.460 2.887 0 50 GFAA Cc1nnc(NC(=O)[C@H](C)Sc2nnc(-c3cccc(F)c3)n2C)s1 4993602 AMTRUONYQUGERW-QMMMGPOBSA-N 378.458 2.900 0 50 GFAA CCCCOc1ccccc1[C@@H]1NC(=S)NC(C)=C1C(=O)OCCOC 6592716 OFKVNDMJFAHFDV-KRWDZBQOSA-N 378.494 2.848 0 50 GFAA CC(C)N1CCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C[C@@H]1C 67676149 RURWTLHYQDTWKI-AWEZNQCLSA-N 387.436 2.537 0 50 GFAA CC1=C(C(=O)N(C)Cc2cnc3ccccn23)[C@H](c2cccs2)NC(=O)N1 65505684 AYWPAVKPTBUBHO-KRWDZBQOSA-N 381.461 2.682 0 50 GFAA COc1cc(C(=O)NCc2ccc(OCCN(C)C)cc2)cc(OC)c1OC 538509 FEZBIKUBAYAZIU-UHFFFAOYSA-N 388.464 2.583 0 50 GFAA biogenic,fda COCCCn1cnnc1[C@@H](C)NC(=O)c1cc2c(Cl)cccc2n1C 216104506 PPWQZSAKFKJFQP-GFCCVEGCSA-N 375.860 2.951 0 50 GFAA NC(=O)c1cccc(C[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C2)c1 72140089 MNNATKQZTFSXMX-HNNXBMFYSA-N 376.412 2.597 0 50 GFAA Cc1nccn1CCCN(C)C(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 153610214 BGTXYHNOPRDPNX-UHFFFAOYSA-N 392.385 2.953 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@H]2CCC[C@@H](C3CC3)C2)[C@@H]1c1cnn(C)c1C 328633695 SUIJNPILKUNEOS-MDPIYQRISA-N 388.556 2.823 0 50 GFAA COc1cc(-c2nccn2-c2cccc(NS(C)(=O)=O)c2)cc2c1OCO2 72420157 YXYPUMBSVBOHMQ-UHFFFAOYSA-N 387.417 2.648 0 50 GFAA COc1ccc2cc(NC(=O)[C@H]3OCC(=O)N(C)[C@H]3c3ccccc3)ccc2n1 435736898 CICCPNCWDGGDRF-SFTDATJTSA-N 391.427 2.780 0 50 GFAA CCOC1CC2(CCN(C(=O)[C@@H]3CCCN3C(=O)OCC(F)(F)F)C2)C1 376461193 LMWXEZZAPOTHJA-UYJPIKCFSA-N 378.391 2.567 0 50 GFAA CCOc1cc(C(=O)N[C@@H]2CCO[C@@H](CC(C)C)C2)ccc1OCC(=O)O 262717515 DCEOEAMITNOPSK-CVEARBPZSA-N 379.453 2.872 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 173771030 VIIBQWLASQMVEQ-XIKOKIGWSA-N 378.467 2.913 0 50 GFAA Cc1ccc(Cn2nc(C)c(/C=C/C(=O)N3CCO[C@H](CC(=O)O)C3)c2C)cc1 237842794 NYGGWTSGQILYRA-CSHXORCISA-N 397.475 2.572 0 50 GFAA c1ccc([C@H](Cn2ccnc2-c2ccc3c(c2)OCCO3)N2CCOCC2)nc1 71754779 DOYXVPNQAXRRSR-IBGZPJMESA-N 392.459 2.790 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cc(=O)n4cccc(C)c4n3)C2)nc1 174598757 JEUNQJMOONZLPN-QGZVFWFLSA-N 391.475 2.557 0 50 GFAA O=C(c1ccc(F)cc1)[C@@H]1[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@H]2[C@@H]2CCCN21 229885747 DMCLCFCWODYPFH-OKYOBFRVSA-N 396.393 2.800 0 50 GFAA O=C1CC2(CCN(c3ncnc4[nH]cnc34)CC2)CN1CCCc1ccccc1 95389477 VOHKTSPIUOTZDT-UHFFFAOYSA-N 390.491 2.805 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)Nc1ccc(OC)cc1)CC2 91746751 BQBLMJHWHPZPKZ-UHFFFAOYSA-N 375.469 2.578 0 50 GFAA O=C(NCc1noc(Cc2cccs2)n1)[C@H]1CCCN(Cc2ccco2)C1 95510080 KHDDICDBQGUFBK-AWEZNQCLSA-N 386.477 2.843 0 50 GFAA C[C@H](NC(=O)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O)c1ccncn1 91656453 KSCAWLFHOWHOFU-PXRHCINRSA-N 379.464 2.519 0 50 GFAA CN(C)c1nc(N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)ncc1F 95508841 OLROASKDSPDBCI-OAHLLOKOSA-N 381.459 2.706 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@H]2NS(=O)(=O)c1cn(C)cn1 91254482 CPQOYDFEAMCRLK-MRXNPFEDSA-N 399.520 2.906 0 50 GFAA COCC(=O)N1CC[C@]2(O)CCN(Cc3ccc(C)c4ccccc34)C[C@@H]2C1 95384792 IGAVFGBMADOYBQ-AUSIDOKSSA-N 382.504 2.580 0 50 GFAA O=C(NCc1ccccn1)c1cccc(OC2CCN(c3ncccn3)CC2)c1 95496481 MTERSLAPIDRZKC-UHFFFAOYSA-N 389.459 2.849 0 50 GFAA Cc1cccc(C)c1CC(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 181356533 KSTBKKHRZCSCAU-GOSISDBHSA-N 378.538 2.699 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)[C@@H](c3cccc(F)c3)N3CCOCC3)c2c1C 182643206 PPGNZNXMTJKQHU-QGZVFWFLSA-N 383.427 2.726 0 50 GFAA CN1C[C@H](CN(C)C(=O)NCc2ccccc2OCc2ccccc2)CC1=O 584891326 PHWJDVMLZIPVCI-GOSISDBHSA-N 381.476 2.885 0 50 GFAA Cn1cc(CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C2CC2)cn1 584904003 VSSHAIWIGDIYIH-UHFFFAOYSA-N 381.480 2.530 0 50 GFAA Cc1cc(C)n(CCCNS(=O)(=O)c2cc(-c3ccno3)sc2C)n1 670457468 DDHCCSFYZUVCRV-UHFFFAOYSA-N 380.495 2.893 0 50 GFAA COC(=O)C[C@@H](c1ccsc1)c1c(O)n(CCc2cnc[nH]2)c(C)cc1=O 888090402 WXVIHNMOJWTGRW-HNNXBMFYSA-N 387.461 2.585 0 50 GFAA Cn1cc(Cl)c(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)n1 1565528928 LPSPCJXQIDPBDK-PBHICJAKSA-N 384.911 2.777 0 50 GFAA Cc1ccc(C(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)cc1N1CCNC1=O 1506407893 KTYCYZZQEMSAPQ-IBGZPJMESA-N 394.475 2.741 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNc2cc(N3CCC(O)CC3)ncn2)C1 1529191189 UFFLKSDNXIHROQ-GOSISDBHSA-N 381.524 2.648 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCCc3ncccc3C)CCC2=O)cc1 11820529 MRJNXDMHRQYRFG-IBGZPJMESA-N 395.503 2.539 0 50 GFAA Cc1cccc(CC(=O)N2CC[C@@]3(CCCN(Cc4cccnc4)C3=O)C2)c1 11843751 GWYBZJPURBHJEG-QHCPKHFHSA-N 377.488 2.974 0 50 GFAA Cc1cc(C)n(-c2cccc(CN(C)Cc3nc(-c4cnccn4)no3)c2)n1 11933784 BEYJLPBTNMQZML-UHFFFAOYSA-N 375.436 2.961 0 50 GFAA CCOCCOc1ccccc1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 12404282 ZUXPQHHPZJHMML-UHFFFAOYSA-N 398.459 2.827 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)CSc2ccccn2)C1)c1ccc(F)cc1 12432080 VVMACAYQUATVAE-HNNXBMFYSA-N 387.480 2.981 0 50 GFAA CCc1ccc(CN(C)C(=O)C[C@@H]2C(=O)NCCN2Cc2ccccc2)cc1 12578822 OXXOMZLMEQSPDU-OAQYLSRUSA-N 379.504 2.598 0 50 GFAA CC[C@H](O)CNC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 12712226 GWCLPCFKZCMXCL-QFIPXVFZSA-N 387.568 2.559 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3ccccc3O)n2CC)s1 13124526 WPQYCXPXJFVSAQ-UHFFFAOYSA-N 390.494 2.815 0 50 GFAA O=C(NC(=S)Nc1cccnc1)c1ccccc1I 13282350 XUKMADIXJUJSPG-UHFFFAOYSA-N 383.214 2.813 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1c1ccc(F)cc1 18173721 RHOMTYKCHCJYAE-GOSISDBHSA-N 387.842 2.933 0 50 GFAA COc1cccc(OCc2nc(-c3cccnc3N(C)C)n([C@H]3CCOC3)n2)c1 1857679223 YYJYXBJKXYZEPD-HNNXBMFYSA-N 395.463 2.955 0 50 GFAA O=C(O)[C@H]1CN(CCCc2ccccc2)CC12CCN(Cc1cc[nH]n1)CC2 1857682479 LAMJWMKUXJVXDB-HXUWFJFHSA-N 382.508 2.641 0 50 GFAA COc1ccc([C@H](O)C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cc1 1857701344 SLOCIWKFZLNGJQ-QFIPXVFZSA-N 391.471 2.757 0 50 GFAA Cc1cncc(C(=O)N[C@@H]2C[C@@H](C(=O)NCc3cccc(C)c3C)CC[C@H]2O)c1 1875244299 GOUCZTABPBSETK-IOMROCGXSA-N 395.503 2.583 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(c4ccccn4)C[C@]34CC[C@H]2O4)ccc1F 1875250287 MKWHOBNDAHWQCI-ODULNIPZSA-N 381.451 2.943 0 50 GFAA CCCn1cc(CN2CCCN(S(=O)(=O)c3ccccc3Cl)CC2)cn1 153271924 BPYQIGFBNGTMOF-UHFFFAOYSA-N 396.944 2.843 0 50 GFAA NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1CCN(c2ccccc2F)C1 378132770 WXEFSQURADWXMQ-YOEHRIQHSA-N 389.858 2.518 0 50 GFAA COc1ccccc1N(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1CC1)CC2 901859822 GDFFPIDFLFQATM-UHFFFAOYSA-N 386.473 2.819 0 50 GFAA COc1cccc(C)c1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 1704330794 KHJNULSHAKRRLZ-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCCO[C@@H]1C1CCN(C(=O)C[C@H]2CCCO2)CC1 837247785 XPSLCPOFSKEKQX-ZHALLVOQSA-N 396.528 2.866 0 50 GFAA CO[C@@H](C)c1nc(-c2cc3c(nc2O)CCN(C(=O)OC(C)(C)C)C3)no1 952847835 CRIOIUXCHFYXON-JTQLQIEISA-N 376.413 2.838 0 50 GFAA C[C@@H](Oc1ccc(Br)cc1Cl)c1noc(Cn2cnnn2)n1 1875286196 NZBGMQDKALIGJR-SSDOTTSWSA-N 385.609 2.660 0 50 GFAA CN1CC[C@H](NC(=O)CN2CC[C@@H](c3ccccc3)NC2=O)c2ccccc21 1875267742 BRGPCFKDPKRCBH-OALUTQOASA-N 378.476 2.840 0 50 GFAA Cc1ccc(Cc2nc(-c3cn(CCO)nn3)n([C@@H]3CCOC(C)(C)C3)n2)cc1 1875336151 TWMUXPFRGYVNKY-QGZVFWFLSA-N 396.495 2.558 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCCN(C)C2)CC1 1875330399 QESPFIXXGDBHAL-NRFANRHFSA-N 396.535 2.550 0 50 GFAA Cc1cc(F)ccc1[C@@H]1C(=O)NCCN1S(=O)(=O)c1sccc1C1CC1 1875354879 RXHUUOQCUPNLLI-MRXNPFEDSA-N 394.493 2.935 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C(=O)[C@H](N)c3ccccc3C(F)(F)F)C2)no1 884125946 MUDANGYMNYNILQ-BLLLJJGKSA-N 382.386 2.878 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2C[C@@H]3CN(C)[C@H](c4ccccc4)[C@H]3C2)cc1 1775996515 AOGJJDLBSYGZPT-AVCGJXAMSA-N 392.503 2.818 0 50 GFAA Oc1nc(N2CCOCC2)nc2c1CCC21CCN(Cc2cccc(F)c2)CC1 2100537231 JXLAMDXTDDCUFT-UHFFFAOYSA-N 398.482 2.638 0 50 GFAA COc1cccc(N2CCN([C@H]3CC(=O)N(c4cccc(Cl)c4)C3=O)CC2)c1 18106598 HNXONMIMRURIJN-IBGZPJMESA-N 399.878 2.803 0 50 GFAA Cc1cc(CN(C)CCn2cnc3c(N)ncnc32)ccc1Br 2325761143 KXDPLMKOTCLDLH-UHFFFAOYSA-N 375.274 2.611 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1OC 791408 VIUKGOZKEBRKFS-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA O=C(CCN1C(=O)c2ccccc2C1=O)NC(=S)Nc1cccc(Cl)c1 941021 JMFVBEVXLZOVQT-UHFFFAOYSA-N 387.848 2.839 0 50 GFAA O=C(NCc1cccnc1)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)cc1 1110179 UMIUPTYUPYTYTA-ZWKOTPCHSA-N 381.432 2.841 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2cc(-c3ccc(Cl)cc3)[nH]n2)CC[C@@H]1O 2356142978 PEWOMOPKKOEJJK-QFBILLFUSA-N 391.855 2.808 0 50 GFAA O=C1NCCC[C@]12CN(Cc1cccc(OCc3ccccc3)c1)CC[C@H]2O 2356158641 SVUROKUOTSFIJF-FYYLOGMGSA-N 380.488 2.729 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)NCCc2cc[nH]n2)CC[C@H]1NC1CC2(CCCCC2)C1 2356166644 GYAKTADVZWNPCU-PWIZWCRZSA-N 388.556 2.955 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)N[C@@](O)(C(F)(F)F)[C@H]1C(=O)c1ccccc1 4144312 MTWSQTLPVMNEGM-VKJFTORMSA-N 394.349 2.799 0 50 GFAA COc1cc(-c2ccno2)ccc1S(=O)(=O)N1CCN(c2ccccc2)CC1 8607766 LRVVLBOHOWVFQF-UHFFFAOYSA-N 399.472 2.861 0 50 GFAA CN1C(=O)CCc2cc(NC(=O)c3ccc(=O)n(-c4ccc(F)cc4)n3)ccc21 171557156 MPPXKDWHBKBCEF-UHFFFAOYSA-N 392.390 2.533 0 50 GFAA CCOC(CC(=O)N1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1)OCC 225581347 NKJJSWSUMVCCFO-UHFFFAOYSA-N 394.487 2.778 0 50 GFAA CCCCc1ccc(-n2cc(CNC3CCN(S(C)(=O)=O)CC3)cn2)cc1 55211607 LXFRNLLTBCXVOL-UHFFFAOYSA-N 390.553 2.729 0 50 GFAA CCC(=O)Nc1cccc(OCC(=O)NCCCSc2nnc(C)s2)c1 55415068 RGSQAMNJEQFZBK-UHFFFAOYSA-N 394.522 2.872 0 50 GFAA CCN1C(=O)COc2cc3c(cc21)[C@@H](c1cccc(OC)c1OC)CC(=O)N3 65502868 ZHIHVFSDMJMXGD-CYBMUJFWSA-N 382.416 2.923 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(F)cc3C)CC2)C1 67840637 RLLFOSFNPIDWSM-IBGZPJMESA-N 391.531 2.573 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)c1ccnc2ccccc12 121973601 SKBXYPQGOSTOQD-AWEZNQCLSA-N 396.472 2.921 0 50 GFAA Cn1nc(-c2ccccc2)c2cc(C(=O)N3[C@H]4CC[C@@H]3CC(=O)NC4)sc21 65374194 XGRKWKOALHSPRI-KGLIPLIRSA-N 380.473 2.795 0 50 GFAA COc1cccc(OC[C@@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCC4)C2)c1 72422329 KJPDMZBXEAKWIT-OAHLLOKOSA-N 382.460 2.803 0 50 GFAA Cc1cccc2[nH]c([C@H]3CCCN(C(=O)c4cnc(C5CC5)[nH]c4=O)C3)nc12 77505688 QVMWLVNFIUJWLP-AWEZNQCLSA-N 377.448 2.852 0 50 GFAA CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2cc(C(N)=O)n(-c3ccccc3)n2)c1 437215988 FCFGAPUWTZYIRE-ZWKOTPCHSA-N 390.443 2.656 0 50 GFAA COc1ccc(-c2noc(CN(C)C[C@H]3CCCCO3)n2)c(OC)c1OC 12057968 BKUAYMMTEASFBE-CYBMUJFWSA-N 377.441 2.763 0 50 GFAA CN(Cc1ccccc1)C1(C(=O)NCCN2CCCC2)Cc2ccccc2C1 39388438 KPEWDZVNZFJVMN-UHFFFAOYSA-N 377.532 2.868 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCCC[C@@H]1CCC(=O)O)c1c(F)cccc1F 236684791 AOCJPLSBBSONEI-CJNGLKHVSA-N 382.407 2.778 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CCCNCC2)[C@H]1c1ccccc1OC 236774901 DLXWGVRQVUXGBE-GHTZIAJQSA-N 387.524 2.597 0 50 GFAA Cc1cc(N2CCC[C@H](NC3CCN(C(=O)CC(C)(C)C)CC3)C2)n(C)n1 333296635 GTHSMVONNHZTKU-SFHVURJKSA-N 375.561 2.714 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc2c(c1)CN(C(=O)NC1CCCC1)CC2 77341842 VUWPVZBKJYLANI-UHFFFAOYSA-N 379.526 2.726 0 50 GFAA O=C(NCc1csc(N2CCCC2)n1)[C@H]1CCC(=O)N(C2CCCC2)C1 215351308 ROGZYSWODOSDGM-AWEZNQCLSA-N 376.526 2.541 0 50 GFAA C[C@@H]1CCCN1C(=O)Cn1c(-c2ccco2)nn(-c2ccc(Cl)cc2)c1=O 77285166 HMZDXNFOGLZRNN-CYBMUJFWSA-N 386.839 2.958 0 50 GFAA CCc1ccc([C@@H]2CN(C(=O)c3ccc(-n4nnnc4C)cc3F)CCO2)cc1 451149623 RMUIBUWCURDGCJ-FQEVSTJZSA-N 395.438 2.886 0 50 GFAA Cc1cnc(-c2ccc(C(=O)N(C)Cc3cnn(C)c3C)cc2)nc1N(C)C 426612404 KCZMJFUZIOJCSB-UHFFFAOYSA-N 378.480 2.832 0 50 GFAA C[C@@H]1C[C@]2(C[C@](C)(C(=O)CSc3nc4ccccc4s3)OC2=O)C(=O)O1 229944214 UBMQUKPOVZTBAS-YZOQQBSESA-N 391.470 2.985 0 50 GFAA aggregator CC(=O)N1CCCn2nc(CNC(=O)N[C@H](C)c3ccc(Cl)cc3)cc2C1 82137656 QANIPHWRILCLJY-CYBMUJFWSA-N 389.887 2.849 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)N(C)Cc2nccn2Cc2ccccc2)n1 426697553 OGDHFIFFPMJTOA-KRWDZBQOSA-N 380.496 2.975 0 50 GFAA O=C(O)c1ccnc(N2CCC[C@]3(CCC(=O)N(Cc4ccccn4)C3)C2)c1 91468522 MCXVSVYLWNGKKV-NRFANRHFSA-N 380.448 2.584 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N(C/C=C/c1ccccc1)C[C@H]1CCCO1 91848720 GDBICLBUBCZDNB-SBLNNXNXSA-N 379.460 2.982 0 50 GFAA Cc1c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cnn1CCO[C@@H]1CCCCO1 179327152 MPTTZTSYNGCCBM-IEBWSBKVSA-N 391.512 2.956 0 50 GFAA COc1ccc(C(=O)NC[C@H]2COc3ccccc3C2)cc1N1CCOCC1 95512976 QIDCSPKKNJEBMN-INIZCTEOSA-N 382.460 2.513 0 50 GFAA O=C(CN1CC[C@]2(CCCN(CC3CCCCC3)C2=O)C1)NCc1ccco1 426387157 WCOJJXKIWFRBLP-JOCHJYFZSA-N 387.524 2.791 0 50 GFAA Nc1nnc(CCNC(=O)Nc2ccc(C(=O)OC3CCCC3)cc2)s1 96164448 JBGYNBAERHDGBG-UHFFFAOYSA-N 375.454 2.584 0 50 GFAA CN(C)c1ccc(C2(C(=O)NC3CCN(Cc4ccncc4)CC3)CC2)cc1 293308294 ZYXLUGWJDMWMCL-UHFFFAOYSA-N 378.520 2.960 0 50 GFAA O=C(CCc1ccccc1F)N[C@H]1C[C@@H](c2cc(O)nc(N3CCCC3)n2)C1 253535601 ICOAHPBNAGWGLE-IYBDPMFKSA-N 384.455 2.917 0 50 GFAA Cc1ccccc1[C@H](C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1)N(C)C 823652600 JVCLOQQAWOVZHU-JOCHJYFZSA-N 395.503 2.671 0 50 GFAA CCn1c([C@@H]2Cc3cc(F)ccc3NC2=O)nnc1N1C[C@@H](OC)CC[C@@H]1C 1356270299 LNKKUAMUFIOSCX-RCBQFDQVSA-N 387.459 2.719 0 50 GFAA O=C(CCN1CCCCCC1=O)NCc1ccc(C(=O)N2CCCCC2)cc1 952973837 GOBFDXRGXLKULX-UHFFFAOYSA-N 385.508 2.722 0 50 GFAA CC1=NO[C@@H](C(=O)N2CCC(CNC(=O)c3scc4c3CCCC4)CC2)C1 952979556 YTNUFSSNGWDLCA-QGZVFWFLSA-N 389.521 2.760 0 50 GFAA O=C(Cn1cnc2cnc(Cl)cc2c1=O)N1CCC(Cc2ccccc2)CC1 272819167 DWWDGOXUTVFEBP-UHFFFAOYSA-N 396.878 2.926 0 50 GFAA CCn1ncnc1[C@@H](C)NS(=O)(=O)c1cc(Cl)c(OC)cc1Cl 1506431793 ZLZYINWQJIUJNM-MRVPVSSYSA-N 379.269 2.653 0 50 GFAA CO[C@H]1CN(C(=O)c2cc(=O)c3ccc(C)cc3o2)C[C@H]1Cc1cc(C)no1 1704354013 WVFNJHPMKPNHIX-VLIAUNLRSA-N 382.416 2.728 0 50 GFAA Cc1ccc(CC(=O)N2C[C@@H]3CN(Cc4ccoc4)C[C@@]3(CCC(=O)O)C2)cc1 1775984209 KAXWLLLBBVGYRN-REWPJTCUSA-N 396.487 2.956 0 50 GFAA CC[C@H]1[C@@H]2OC(=O)[C@H](C)[C@H]2[C@H]2C[C@H]([C@@H]3C[C@H](C)C(=O)O3)N3[C@@H]4CCC[C@H]1[C@]23O4 1772820093 RRHMLMRBONYJOT-UMRAXGMHSA-N 389.492 2.699 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3cccc(C)n3)C[C@@]2(CCc2ccccc2)C1 1772808608 VTNCAHMOTLBSCC-QPPBQGQZSA-N 393.531 2.930 0 50 GFAA O=C1CCCCCN1CCc1nc(COc2ccccc2)nn1[C@@H]1CCOC1 1772807951 DAXNWXTVWSKZRP-QGZVFWFLSA-N 384.480 2.764 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cccc(OC)c3)C2)cc1 12021137 QBAGPNAAABXOLF-LJQANCHMSA-N 382.460 2.876 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)NC[C@H]1Cc2cccc(-c3ncccn3)c2O1 12079696 XBCBNLJZTFQAQA-MRXNPFEDSA-N 389.411 2.535 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)CCSC)C2)cc1OC 12204410 UKOYDAVGKJIOAX-QGZVFWFLSA-N 380.554 2.922 0 50 GFAA Cc1ccc(CCNC(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)cc1 12704290 JKKIOFNINFKYIQ-NRFANRHFSA-N 397.563 2.767 0 50 GFAA CC1CCN(S(=O)(=O)c2cc(C(=O)Nc3cccnc3)ccc2F)CC1 16623280 GPSKSJVLWKXMNC-UHFFFAOYSA-N 377.441 2.894 0 50 GFAA CCOc1ccc(-c2nc3s/c(=C\c4ccccc4OC)c(=O)n3n2)cc1 6355368 QPWAUZQRIOMNII-ATVHPVEESA-N 379.441 2.773 0 50 GFAA O=C(N[C@@H]1CN(c2cnc3ccccc3n2)CC[C@@H]1O)c1cc2ccccc2o1 1857670317 HLZPMTBDPZLGEH-MSOLQXFVSA-N 388.427 2.746 0 50 GFAA Cc1ccc(C)c(CN2CCOC3(CCN(c4cnccn4)CC3)CC2=O)c1 1857688000 OUWVNCGTBVITON-UHFFFAOYSA-N 380.492 2.882 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCc3cn[nH]c3)C1)CC2 1857697182 ZTGKYATVMCQMKI-NRFANRHFSA-N 383.496 2.642 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)NCCc3ccccc3F)CC2=O)s1 1857713145 FWMJWNLPZDNYHP-CYBMUJFWSA-N 376.457 2.512 0 50 GFAA O=C(c1cc2cc(F)ccc2[nH]1)N1C[C@@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857717444 SWTLZWPENZIDHU-KREFBHGWSA-N 380.419 2.516 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1cc(C(F)F)[nH]n1 1857731587 KRVICPUIKJKGLQ-DVOMOZLQSA-N 396.825 2.945 0 50 GFAA C[C@H]1CN2C[C@@H](NC(=O)c3cc(-c4cccnc4)nc4ccccc34)C[C@H]2CO1 1857736594 NTZZZZWULQYEPF-SZMVWBNQSA-N 388.471 2.888 0 50 GFAA C[C@H](CC(=O)OCC1c2ccccc2-c2ccccc21)C[C@H](N)[C@@H](O)CC(=O)O 232319641 NMCBHZITLTYUHZ-WVFSVQOHSA-N 397.471 2.921 0 50 GFAA Cc1ccccc1C1CC(N(C(=O)CCN2CCCS2(=O)=O)C2CC2)C1 329730103 PLTMHNIJCXAALJ-UHFFFAOYSA-N 376.522 2.658 0 50 GFAA Cc1ccc(NC(=O)[C@H](O)c2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C 813363618 NJXGXMUSZIDOHQ-MRXNPFEDSA-N 382.869 2.571 0 50 GFAA O=C1C[C@]2(CCN(C(=O)NCc3cnc(-c4ccc(Cl)cc4)s3)C2)CN1 375226560 IUTKBAPOZIOWLF-GOSISDBHSA-N 390.896 2.885 0 50 GFAA COCCN1CCN(C(=O)NCC2(c3ccc(F)cc3Cl)CC2)C[C@@H]1C 499158027 PQNXSPGPKSXTOF-AWEZNQCLSA-N 383.895 2.873 0 50 GFAA COc1ccc(C)cc1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 1704328973 QJDKKPZLXRQTQA-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA O=C(Nc1cccc2nsnc12)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 861601557 ARZUCUPMUZAGDG-MSOLQXFVSA-N 395.488 2.808 0 50 GFAA COc1cccc(CN(CCN(C)C)C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)c1 1875293468 RHXUFOJAGYSWAU-LSDHHAIUSA-N 386.496 2.645 0 50 GFAA CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)c2cc(C(F)(F)F)nn2C2CC2)C1 1875311227 QVBACEYKSSYMSE-IACUBPJLSA-N 384.402 2.614 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCCSC[C@H]2c2cnn(C)c2)cc1 1875373538 FDDCPKKUXDAZMS-SFHVURJKSA-N 384.505 2.889 0 50 GFAA C[C@H]1CCCN(c2cc(N[C@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)C1 1857797756 LRONAABOSXWKCB-HOCLYGCPSA-N 379.464 2.597 0 50 GFAA Cn1nnc(CS(=O)(=O)Cc2ccsc2C(F)(F)F)c1C(F)F 2325777203 MCLKRKJXGWCKSE-UHFFFAOYSA-N 375.344 2.948 0 50 GFAA COc1cccc(Br)c1C(=O)N1CC(N(C)C(=O)C2CCC2)C1 2325828418 GMDILQDFIHNDED-UHFFFAOYSA-N 381.270 2.541 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCCc3ccccc3)CC2)cc1 789524 BFOQFRWXNWXUBL-UHFFFAOYSA-N 386.517 2.755 0 50 GFAA COc1ccc(N(CC(=O)N2CCCC2)S(=O)(=O)c2ccc(F)cc2)cc1 1119742 TVBPSGLJNLTLIX-UHFFFAOYSA-N 392.452 2.652 0 50 GFAA COCCCNC(=O)CCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 2140823 GRODVGXGJHSECJ-UHFFFAOYSA-N 390.505 2.881 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356134131 ZTZSZQHQUIRGCJ-HSZRJFAPSA-N 392.503 2.933 0 50 GFAA Cc1cccc(C(=O)N2CCNC(=O)[C@H]2CC(=O)Nc2cccc(Cl)c2)c1 2434389 JZHPSJSYQOAEHL-QGZVFWFLSA-N 385.851 2.618 0 50 GFAA Cc1cc(C(F)(F)F)nc(SCCNC(=O)c2c(Cl)cnn2C)n1 2489011 JULDEOUEINUCMR-UHFFFAOYSA-N 379.795 2.713 0 50 GFAA CCOC(=O)c1sc(NC(=S)NC(=O)c2cccc(OC)c2)nc1C 2826452 PXFWBTOLJMMQOY-UHFFFAOYSA-N 379.463 2.764 0 50 GFAA COc1ccc(CCNC(=O)C(=O)Nc2cccc(Cl)c2C)cc1OC 2993434 WGCYFCOFKXRAHU-UHFFFAOYSA-N 376.840 2.963 0 50 GFAA CC(C)C[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)O 4700924 AYQHQTALHLLYTN-MOPGFXCFSA-N 382.460 2.643 0 50 GFAA COc1ccc(Nc2nc(N3CCO[C@@H](C)C3)cc(N3CCO[C@H](C)C3)n2)cc1 225387504 NTYFMQFJNOWBIE-IYBDPMFKSA-N 399.495 2.679 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@@H]3c4ccccc4C[C@H]3O)cc2)C[C@@H](C)O1 246151420 HKFZYLMENPVBJR-FHTPNYMGSA-N 380.488 2.684 0 50 GFAA COc1ccccc1[C@H](C)NC(=O)CN1C(=O)O[C@]2(CCc3ccccc32)C1=O 225825988 DQLRNVXJVLULQW-FPTDNZKUSA-N 394.427 2.693 0 50 GFAA O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCCN(CC(F)(F)F)CC1 115839473 TUMJNHYEGIEGHX-MRXNPFEDSA-N 384.446 2.935 0 50 GFAA O=C(c1cncnc1)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67724979 JHDDNRSODJRQHJ-UHFFFAOYSA-N 382.807 2.932 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCC[C@@H](c2[nH]ncc2-c2ccc(F)cc2)C1 67878565 BEFUEFLWASSEQI-CQSZACIVSA-N 380.427 2.916 0 50 GFAA CN1CCN(CCC(F)(F)F)CC12CCN(C(=O)COc1ccccc1)CC2 67886495 QVPMKZNBOYFYIW-UHFFFAOYSA-N 399.457 2.626 0 50 GFAA CNC(=O)c1ccc(C(=O)NCc2nc(C)c(-c3ccc(Cl)cc3)o2)cn1 473597844 HYQLVEBXKZWFMQ-UHFFFAOYSA-N 384.823 2.988 0 50 GFAA O=C(CN1C(=O)c2ccccc2C1=O)N1CCC[C@@H](Nc2ccc(F)c(F)c2)C1 11813191 OKGZPVNTNFDEGM-CQSZACIVSA-N 399.397 2.664 0 50 GFAA CN(C)CCCN1CC2(CCN(C(=O)c3cccc4ncccc34)CC2)OC1=O 77505609 IAOSWXCDODPGGU-UHFFFAOYSA-N 396.491 2.614 0 50 GFAA COCc1ccc(C(=O)N[C@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)o1 12054653 ISJAWASDOFLASC-HNNXBMFYSA-N 376.840 2.653 0 50 GFAA C[C@H]1C[C@H](c2ccc(F)cc2)CN1CC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 172328782 QXUSQGHFOWWGRV-ZFWWWQNUSA-N 395.434 2.868 0 50 GFAA O=C(c1cnc2nc(O)nc(O)c2c1)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 282359771 BFEQUYVQEWLCDL-RBVVOMGSSA-N 376.416 2.987 0 50 GFAA CCc1nnc(-c2ccc(NC(=O)N3CCC[C@H](Cn4ccnn4)C3)cc2)o1 127849954 GDEOWFROHLJSCX-AWEZNQCLSA-N 381.440 2.835 0 50 GFAA O=C(NCC1(CN2CCOCC2)CCCCC1)N[C@H]1CCc2c(O)cccc21 333205509 AONASIQZEMGENZ-IBGZPJMESA-N 387.524 2.961 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@H](c3nncn3C)C2)nn1-c1ccccc1F 173078671 DYSRNGIJUFTSTD-AWEZNQCLSA-N 397.458 2.507 0 50 GFAA Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)c1ccc(-c2cncnc2)cc1F 372283214 RQKBWZYNZVOHSY-HXUWFJFHSA-N 390.418 2.904 0 50 GFAA C[C@@]1(CNC(=O)CCn2c(S)nnc2-c2cccs2)CCCC[C@@H]1O 129923969 LLEIHDPQRYREGH-GUYCJALGSA-N 380.539 2.743 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)cc1 72117629 DRWWVDSCHWXDMC-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Fc1cccc(CN2CCN(Cc3cnc(NC[C@H]4CCCO4)nc3)CC2)c1 72163801 AKPZYGZSTYPJSP-HXUWFJFHSA-N 385.487 2.524 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)N[C@@H](CN3CCCC3=O)c3ccccc3)C2)n1 130862704 BJPHINPXLXFOAI-MSOLQXFVSA-N 397.479 2.631 0 50 GFAA O=C(O[C@H](CN1CCC2(CC1)OCCO2)C(F)(F)F)c1c(F)cccc1F 20405421 YMQYXOBNXVCJIH-CYBMUJFWSA-N 395.324 2.891 0 50 GFAA CCc1nnc(CNC(=O)N[C@@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)s1 291088428 SETJLBSBNUGAHH-GWCFXTLKSA-N 389.481 2.770 0 50 GFAA NC[C@@H]1CCN(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)C1 178525518 BIHIUUDIBJKSHN-SGQUHAKNSA-N 387.487 2.814 0 50 GFAA O=C(NCCn1cccn1)N1CCC(c2cc(Cc3ccccc3)[nH]n2)CC1 426700098 VHVNFUYUWHIQPE-UHFFFAOYSA-N 378.480 2.786 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@@H](O)C4)csc3C2)nc1 426535318 YRCRGJFCXYDTBQ-QGZVFWFLSA-N 385.533 2.861 0 50 GFAA CCOc1cc(CN(C)C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC 426538375 NXTMHRXYYVKXGK-INIZCTEOSA-N 391.512 2.882 0 50 GFAA CN1CCC2(CC1)CC(=O)N(CC(=O)N1CCC[C@H](c3ccccc3)CC1)C2 95518892 XVKTWUUCBUDGIG-FQEVSTJZSA-N 383.536 2.727 0 50 GFAA O=C(Nc1snnc1-c1ccccc1)N1CCCO[C@@H](Cn2cccn2)C1 95526886 IMYKYTAFMBEBQE-OAHLLOKOSA-N 384.465 2.725 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)Cc2ccc(F)c(F)c2F)C1 95359558 QWRIAKFGGOQJGU-HNNXBMFYSA-N 394.441 2.811 0 50 GFAA CC(C)(C)c1cc(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)[nH]n1 91625608 TUEQITHXFZMXTM-HNNXBMFYSA-N 386.471 2.901 0 50 GFAA CSCCC(=O)N1C[C@H](C2CC2)[C@@H](NC(=O)c2ccn(C(C)(C)C)c2)C1 95368784 HSNRWKZGDPAICC-SJORKVTESA-N 377.554 2.963 0 50 GFAA O=C1C[C@@H](N2CCN(Cc3ccccc3)CC2)C(=O)N1c1cccc(Cl)c1 97759516 OPMAZMCKYASYBJ-LJQANCHMSA-N 383.879 2.790 0 50 GFAA COC(=O)C[C@@H](c1c(O)ncc(C(=O)OC)c1O)c1ccnc2ccccc12 253623628 CEFAMFWUHYXRAW-CYBMUJFWSA-N 382.372 2.523 0 50 GFAA biogenic O=C(CN1CCC(c2ccccc2)CC1)NCCc1noc(C(F)(F)F)n1 299782538 NEXZSMMUKIIKNA-UHFFFAOYSA-N 382.386 2.627 0 50 GFAA O=C(NC[C@H]1CCOC1)c1cccn(Cc2c(Cl)cccc2Cl)c1=O 299777334 BZBHSEDCYOYIPQ-GFCCVEGCSA-N 381.259 2.970 0 50 GFAA COCCN1C[C@@H](C(=O)Nc2ccc(Oc3ccccc3OC)nc2)CCC1=O 952979339 VZWATUBVFLSWTI-HNNXBMFYSA-N 399.447 2.706 0 50 GFAA Cc1nc2ccc(C(=O)N3CC[C@H](c4ccc5c(c4)OCO5)[C@@H](O)C3)cc2o1 1565527475 BPXLWJZQLPZBLC-WBVHZDCISA-N 380.400 2.856 0 50 GFAA O[C@H]1CN(Cc2cccn2-c2ccncc2)CC[C@@H]1c1ccc2c(c1)OCO2 1565515547 XDKACTQDJODXRY-UXHICEINSA-N 377.444 2.951 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2 269921017 JBIBAKWYLJHICK-DFQSSKMNSA-N 399.491 2.767 0 50 GFAA C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCC(N(C)CC(=O)O)CC1 186625988 CZPGBTFHCVKSTG-LLVKDONJSA-N 389.279 2.768 0 50 GFAA Cc1noc([C@@]2(O)CCN(S(=O)(=O)c3cc4cc(Cl)ccc4s3)C2)n1 275216919 BREFMYHAZUOCCO-OAHLLOKOSA-N 399.881 2.528 0 50 GFAA CCCS(=O)(=O)NC1CCN(Cc2cc3c(cc2OCC)C[C@@H](C)O3)CC1 192870967 DHZVYZDTDZKEHF-OAHLLOKOSA-N 396.553 2.703 0 50 GFAA C[C@@H]1C[C@H](O)CN1C(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 788345637 UDNNZEZCXQTVOS-ZBFHGGJFSA-N 377.460 2.516 0 50 GFAA CC(C)N1C[C@H](C(=O)N2CCC3(CC2)OCCc2ccsc23)CCC1=O 1704299720 RFGWZGXGLCZNSN-MRXNPFEDSA-N 376.522 2.786 0 50 GFAA COc1cc(C(=O)NCCCSC)ccc1OC1CCN(C(C)=O)CC1 11954876 FMVFTDTWBQVUTH-UHFFFAOYSA-N 380.510 2.568 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@H]1c1cccc(F)c1 12382689 BUIRXUKDPLWXQU-NYUBLWNDSA-N 394.439 2.769 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CN1CCOC1=O 12385410 TYDSSTBTRXTWCO-KRWDZBQOSA-N 393.915 2.505 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)NC(C)C)c2)cc1 13678176 LZYAABZKTQFERE-UHFFFAOYSA-N 378.450 2.643 0 50 GFAA O=C(NC[C@H]1CCCO1)[C@@H]1C[C@H](CN2CCCC2)CN(Cc2ccccc2)C1 14541128 CUTZOYUNUWEFQO-YPAWHYETSA-N 385.552 2.516 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1ccccn1)C2 14745405 PWXBEEPCQXGOCH-MRXNPFEDSA-N 399.564 2.524 0 50 GFAA CO[C@@H](c1ccccc1)c1nnc(CCC(=O)N(CCO)Cc2ccccc2)o1 15066303 MGNTWIHJCFFSMS-NRFANRHFSA-N 395.459 2.759 0 50 GFAA COc1ccc(OC)c([C@H](O)Cn2ccn3nc(-c4cccs4)cc3c2=O)c1 169758082 UISQHGBJRIGYKB-QGZVFWFLSA-N 397.456 2.975 0 50 GFAA Cc1noc(-c2cn([C@@H]3CCN(C(=O)c4cccc(C(F)(F)F)c4)C3)nn2)n1 169780499 CXJPBZWXDKDYMQ-CYBMUJFWSA-N 392.341 2.743 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC2CC2)C[C@H]1NC(=O)c1ccc2nccnc2c1 1857707163 GZRHEVSCQWLSMZ-CWFSZBLJSA-N 396.491 2.602 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CCN(c2ccc(F)cn2)[C@H](C)C1 1857708517 XZGGEZLYMRAQAH-MRXNPFEDSA-N 394.450 2.581 0 50 GFAA CCc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3ccon3)[C@H]3CC[C@]2(C1)O3 1857713003 RCDONYLCTORIPE-XHYAQGIWSA-N 381.476 2.646 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857727269 ONLWKQHSXAZFJS-VIZSFHNOSA-N 392.455 2.626 0 50 GFAA O=C(NCc1ccc2nc[nH]c2c1)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857735902 VMZXCDKOMADZLW-ZDUSSCGKSA-N 391.456 2.842 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3cccc(C)c3C)CC2)c1 811953 VIWUXDOCLXAQAT-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA O=C(COCC(F)(F)F)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 134052133 AQHGLIMVFBLMHC-UHFFFAOYSA-N 379.342 2.635 0 50 GFAA Cc1nnc(NC(=O)[C@H]2Cc3ccccc3CN2C(=O)CC(C)C)n1C1CC1 375544350 VMZBJHXJDOKXBR-GOSISDBHSA-N 381.480 2.860 0 50 GFAA C[C@H]1CCS(=O)(=O)CCN1C(=O)N[C@H](C)c1ncc(-c2ccc(F)cc2)o1 1875300410 BWLLBWVCEYFJNV-QWHCGFSZSA-N 395.456 2.760 0 50 GFAA COCCn1nc(C(=O)N(C)Cc2ccc(F)cc2)c2c1[C@H](C)O[C@H](C)C2 1875301027 ANHCAXWZGFTSSA-KGLIPLIRSA-N 375.444 2.963 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@@H]4CC[C@H](C)C4)C3)CC2)cc1 1875328547 XTRFBKGHKSVDMU-FXAWDEMLSA-N 381.520 2.734 0 50 GFAA O=C([C@@H]1Cc2ccccc21)N1CCCN(Cc2ncnn2-c2ccccc2)CC1 1875325942 HDTQBFUGMMECHS-OAQYLSRUSA-N 387.487 2.642 0 50 GFAA NC(=O)Cc1cccc2c1CCN(Cc1nc(-c3cccc(Cl)c3)no1)C2 879227665 JQCVCUIOFURFRA-UHFFFAOYSA-N 382.851 2.976 0 50 GFAA Cc1nn(C)c(Sc2ccccn2)c1NS(=O)(=O)C[C@@H]1CCCCO1 888095866 COWLKPVRKLNTFP-ZDUSSCGKSA-N 382.511 2.586 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)[C@@H]1CCc2nncn2CC1 898687472 LXHSXUPNACHLNW-LLVKDONJSA-N 392.385 2.784 0 50 GFAA Cc1nc2c(C(=O)NCCc3csc(-c4cccnc4)n3)ccnc2n1C 2100547139 BVFLQQPNDKROCJ-UHFFFAOYSA-N 378.461 2.768 0 50 GFAA O=C(NCC[S@](=O)c1ccccc1F)c1ccc2c(c1)nc(O)n2C1CC1 2325757182 IRGUGFHCHXPPOY-MHZLTWQESA-N 387.436 2.754 0 50 GFAA O=C1[C@H](NC2CC(c3ccc(Br)cn3)C2)CCN1CC(F)(F)F 2325806000 KVGUHLDBSJZPOH-QEIKUCIBSA-N 392.219 2.843 0 50 GFAA O=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NCc1ccco1 801240 NYGYCESUHXMWFH-UHFFFAOYSA-N 392.477 2.586 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCO[C@H](c2ccccn2)C1 2356145205 GEXUZMPLZLOGQK-KRWDZBQOSA-N 399.516 2.508 0 50 GFAA COc1cc(-c2cc(=NC(=O)COc3cccc(C)c3)[nH][nH]2)cc(OC)c1OC 2356147849 SVCZAFWLOMSRKP-UHFFFAOYSA-N 397.431 2.850 0 50 GFAA CN1CCC[C@]2(CCCN2S(=O)(=O)c2ccc(Cl)cc2Cl)C1=O 2356167920 IXNRBQDVNNJWNG-HNNXBMFYSA-N 377.293 2.769 0 50 GFAA COc1c(I)cc(C=O)cc1I 7063077 KDZWGCFOYVWUNT-UHFFFAOYSA-N 387.942 2.717 0 50 GFAA CSc1ccc(OC[C@@H](O)CSc2nnc(-c3cnccn3)n2C)cc1 414122682 BHYSAASIWOPSSG-GFCCVEGCSA-N 389.506 2.526 0 50 GFAA Cc1cc(-c2cc(C(=O)N3CC(=O)N(C4CC4)C3)c3c(C)noc3n2)c(C)o1 225741187 ADQQWKZRSDGVDD-UHFFFAOYSA-N 380.404 2.812 0 50 GFAA CNC(=O)c1cc(NC(=O)N2CCN(c3cccc(OC)c3)CC2)ccc1F 50086295 LNLDWGPMACDURG-UHFFFAOYSA-N 386.427 2.548 0 50 GFAA COc1ccc(/C=C/CN2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1 65454362 FLGOBVXMVNXCBE-DUXPYHPUSA-N 376.464 2.506 0 50 GFAA CCCN1CCCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)CC1 67833707 YJKCPSNYGGPZLJ-UHFFFAOYSA-N 387.436 2.540 0 50 GFAA O=C(CCc1ccccc1)N1CCCN(Cc2nc3ccsc3c(=O)[nH]2)CC1 177287600 OPYUOKATXBJNMG-UHFFFAOYSA-N 396.516 2.652 0 50 GFAA O=C(NCCc1cn[nH]c1)c1cc(CN2CCC(Cc3ccccc3)CC2)on1 67820532 XOKLJDQRYUFYLZ-UHFFFAOYSA-N 393.491 2.825 0 50 GFAA O=C(Cn1cc(-c2ccccc2)nn1)NC1(c2cccc(F)c2)CCOCC1 121706097 PFHWMVPILAETHV-UHFFFAOYSA-N 380.423 2.906 0 50 GFAA COc1cc(C(=O)N[C@@H]2CCCN(C3CCN(C)CC3)C2)c2ccccc2n1 15073879 VGCNNFNPFDBMHS-MRXNPFEDSA-N 382.508 2.532 0 50 GFAA O=C(O)c1cc(I)c(F)c(I)c1 71793111 CVHNCPIADQEMFO-UHFFFAOYSA-N 391.905 2.733 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2ccncc2)c(C)o1 175664082 HZUKIRVLQVZOSG-MRXNPFEDSA-N 377.466 2.649 0 50 GFAA O=C1CCC[C@@H](CC(=O)NC2(c3cccc(C(F)(F)F)c3)CCOCC2)N1 289428939 NLDQGOFVNYPKRJ-HNNXBMFYSA-N 384.398 2.886 0 50 GFAA CC(C)c1nc([C@H]2CCCN2C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)no1 177531382 VEJRYRTVSOSXML-QLFBSQMISA-N 377.489 2.829 0 50 GFAA Cc1nn(CC(C)C)cc1S(=O)(=O)N(C)Cc1nn(C)c(Cl)c1Cl 20602622 GZXWYPYRHJHKKD-UHFFFAOYSA-N 394.328 2.709 0 50 GFAA CNc1cc(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)ccn1 91624827 AUJISBZCQQZXHX-UHFFFAOYSA-N 382.512 2.788 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(C(=O)C1=Cc3ccccc3OC=C1)CC2 95521591 GZCXHRVDWIMDPW-UHFFFAOYSA-N 376.460 2.705 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@@](C)(Cc4ccc5c(c4)OCO5)C3)nnc2n1 95500012 BHOUOPJBMXJXBB-NRFANRHFSA-N 393.447 2.646 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)COc2ccccc2Cl)C1 95518386 NAVLDYQSDDPWEU-HNNXBMFYSA-N 377.872 2.968 0 50 GFAA O=C(Nc1ccc2nncn2c1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 179483957 IFAUQHDLODBVRE-AWEZNQCLSA-N 383.839 2.874 0 50 GFAA O=C(c1ccnc(OC2CCCCC2)c1)N1CCC[C@H](CN2CCOCC2)C1 179931375 IXPZQWZDUYRXCV-GOSISDBHSA-N 387.524 2.978 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)N[C@@H](C)Cc2cccnc2)cc1 96138104 CRLUAOTVMGKLTM-AWEZNQCLSA-N 376.482 2.523 0 50 GFAA O=C(N[C@H]1C[C@@H](c2nnc(CO)n2C2CC2)C1)C1(c2ccccc2)CCCC1 244641231 GLULTCBRHGDOAX-WOVMCDHWSA-N 380.492 2.980 0 50 GFAA Cc1ccc(C(=O)N[C@H](c2ccc(F)cc2)[C@H]2C[C@@H](O)C2)cc1N1CCNC1=O 244724292 MRHNKCVMAOHNQM-IMFGXOCKSA-N 397.450 2.906 0 50 GFAA COc1ccc(-c2nnc(C)o2)cc1NC(=O)c1ccc2c(=O)n(C)cnc2c1 952869994 SOGWKYQSLQZHPG-UHFFFAOYSA-N 391.387 2.553 0 50 GFAA CCN1CCNC(=O)[C@@H]1CC(=O)Nc1ccc(Oc2cccc(OC)c2)cc1 952968545 OZRHSLXYVOQMNL-IBGZPJMESA-N 383.448 2.636 0 50 GFAA O=C(NC[C@H](Oc1ccc(F)cc1)C(=O)O)c1cc(-c2ccccc2F)on1 170592159 SEWROIPSKKYCAX-KRWDZBQOSA-N 388.326 2.882 0 50 GFAA NC(=O)CC1CCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)CC1 170709723 MQBTWKCLYCTBJE-UHFFFAOYSA-N 392.809 2.670 0 50 GFAA C[C@H](O)CN(C(=O)Nc1cc(Cl)ccc1Cl)C1CCS(=O)(=O)CC1 170091132 KRYKMMVSNCCNKA-JTQLQIEISA-N 395.308 2.785 0 50 GFAA O=C(c1ccccn1)N1CCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 193962384 BTDVANMGPLXFTK-UHFFFAOYSA-N 380.835 2.881 0 50 GFAA CCOC1CC(CNC(=O)c2sc(C)nc2CC(C)C)(N2CCOCC2)C1 195187478 LCTXWDOUDGYHFA-UHFFFAOYSA-N 395.569 2.650 0 50 GFAA Cc1cc(C(=O)Nc2ccc3c(c2)N(C)C(=O)[C@H](C)O3)ccc1N1CCOCC1 1506422414 PHCPOOYJNAMALG-HNNXBMFYSA-N 395.459 2.828 0 50 GFAA CN(CCOc1cccc(Cl)c1)CC(=O)Nc1nnc([C@@H]2CCCO2)s1 1529158627 HKCPEGNZHZHLFH-AWEZNQCLSA-N 396.900 2.992 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)c1cn(Cc2ccc(F)cc2)nn1 11879305 ZCSBYBWIUFCGIX-UHFFFAOYSA-N 394.450 2.944 0 50 GFAA COC(=O)c1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3F)C2)nc1 11958685 DKQGIKZIXMFYGR-QGZVFWFLSA-N 385.439 2.744 0 50 GFAA CCOC(=O)c1cnn(-c2ccccc2Cl)c1CN1CCC[C@@H](CO)C1 12098950 YQPMQJZWKMFJPR-CQSZACIVSA-N 377.872 2.907 0 50 GFAA O=C(N[C@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1coc2c1C(=O)CCC2 12373027 NPOXVPVLAHRKGR-ZDUSSCGKSA-N 386.835 2.983 0 50 GFAA CC(=O)Nc1ncc(S(=O)(=O)Nc2ccc(Br)cc2)s1 12379803 FFAVCURYBGNMDY-UHFFFAOYSA-N 376.257 2.665 0 50 GFAA O=C(c1c(F)cccc1Cl)N1CCN(S(=O)(=O)c2ccccc2)CC1 13328884 VGZHQLPVKWSGAS-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA COc1cccc(CN2CCC(n3cc(C(=O)N4CCCCC4)nn3)CC2)c1 14879776 WYSZPZRVWHXJHH-UHFFFAOYSA-N 383.496 2.750 0 50 GFAA CCN1CCC[C@@H]1CN(CC1CCN(CCOC)CC1)C(=O)/C=C/C(C)C 14960942 ADKGLTNAVQDMNV-MHNQQFQPSA-N 379.589 2.870 0 50 GFAA CC(=O)CCC(=O)N1CCC(n2nccc2NC(=O)c2ccccc2C)CC1 14979302 OURFPICXNQCLJR-UHFFFAOYSA-N 382.464 2.977 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCC2)N[C@@H]1CCCc2c1[nH]c1ccccc21 169774010 BZEQBCNFSGYIAR-LJQANCHMSA-N 376.460 2.797 0 50 GFAA CCn1ccc(C(=O)N[C@@H]2CCCN(c3ccc(Br)cc3)C2=O)n1 1857530172 TWALQBHSAXTSBB-OAHLLOKOSA-N 391.269 2.591 0 50 GFAA O=C(NCCc1ccccc1)[C@]12CCCCN1C[C@@H](Nc1ncccc1F)C2 1857691188 ZHCMFEPABUOIMF-PGRDOPGGSA-N 382.483 2.989 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCO[C@@H](CO)[C@@H]3c3ccccc3)c2)no1 1875248570 YCRHBEFLZSZVMI-OALUTQOASA-N 379.416 2.620 0 50 GFAA CCCCN1CCC[C@@]2(CCc3c2nc(C)[nH]c3=NCCCn2ccnc2)C1 1875248571 YEKCVYZMUAXYPW-JOCHJYFZSA-N 382.556 2.986 0 50 GFAA O=S(=O)(C[C@@H]1CCCCO1)Nc1cccc(-c2nnc3n2CCCCC3)c1 110096591 YTWUEYAWJPYZKP-KRWDZBQOSA-N 390.509 2.982 0 50 GFAA CC[C@H]1CN(c2ccccc2)CCN1C(=O)c1ccc(-n2nnnc2C)cc1F 450625725 FUCRTNIRJKAMTA-INIZCTEOSA-N 394.454 2.851 0 50 GFAA C[C@@H](NC(=O)N1C[C@@H](N)[C@H](c2cnn(C)c2)C1)c1cccc(OC(F)(F)F)c1 818649129 BEXFKMQLTTWFGC-XFBWCDHKSA-N 397.401 2.516 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccncc2)CN(C(=O)CC[C@]2(C)CCC(=O)N2)C1 952894318 ZFYRKZPOAVSFOL-QFIPXVFZSA-N 395.507 2.627 0 50 GFAA CC1(C)[C@H](CN)CC[S@@]1(=O)=NC(=O)c1csc(Nc2ccccn2)n1 1875358851 LRUBWIHNUYHBJF-FTJNGKRUSA-N 379.511 2.647 0 50 GFAA COc1ccc(CCN(c2cccc(C(C)=O)c2)S(C)(=O)=O)cc1OC 1875305997 OVRWDFMROYVOPB-UHFFFAOYSA-N 377.462 2.915 0 50 GFAA C[C@@H]1C[C@@H](C(=O)N2CCOC3(CCS(=O)(=Nc4ccccc4)CC3)C2)CO1 1875395760 LIHJTGUKBHRYDC-DCZRMELXSA-N 392.521 2.603 0 50 GFAA CCc1cc(C(=O)N(C)C[C@H](C)NC(=O)c2cc3ccccc3o2)cc(O)n1 1875303294 LQWGMZRGHURVAN-ZDUSSCGKSA-N 381.432 2.986 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)N1CC3(COc4ccccc4C3)C1)CC(=O)N2 2100539658 SBKMWTYQZXVGTK-KRWDZBQOSA-N 378.428 2.585 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCCc3nc4c(s3)CCCC4)cn12 2100557256 YYFBQCKWBHDJST-GOSISDBHSA-N 399.520 2.727 0 50 GFAA CCCN(CCc1cccc(F)c1)C(=O)Cn1nc(O)c2ccccc2c1=O 2325728764 JNYNPZXNFDLKHN-UHFFFAOYSA-N 383.423 2.723 0 50 GFAA COc1ccc2nc(C)c(C(=O)N3[C@H]4CC[C@H]3CC(O)(c3ccccc3)C4)n2n1 2325761996 OLOQLFYOORHVDZ-IRXDYDNUSA-N 392.459 2.701 0 50 GFAA COC(=O)CCn1c(SCc2cc(Cl)n(C)n2)nc2ccccc2c1=O 863269470 DYXXTAPLHKQXFB-UHFFFAOYSA-N 392.868 2.639 0 50 GFAA CCOc1ccc(NC(=O)CN(c2cccc(C(C)=O)c2)S(C)(=O)=O)cc1 1111241 FPLCVOQOVYXKIS-UHFFFAOYSA-N 390.461 2.693 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)C2(c3ccc(OC)cc3)CCCC2)C[C@H]1O 2356151363 FSEPQFCYSAITCW-GCJKJVERSA-N 389.492 2.971 0 50 GFAA COc1ccc(NC(=S)N[C@H](NC(=O)N(C)C)C(Cl)(Cl)Cl)cc1 3130675 ICUSXWNQFYTKHY-SNVBAGLBSA-N 399.731 2.949 0 50 GFAA O=C(CCNC(=O)OCc1ccccc1)NCCC(=O)OCc1ccccc1 4763728 HCEGGRLKILDMSE-UHFFFAOYSA-N 384.432 2.553 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3ccccc3F)[C@@H](CCO)C2)c1 23153348 YUORKXZTVCVYTI-IBGZPJMESA-N 388.483 2.912 0 50 GFAA CNC(=O)[C@H]1CCCN(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)C1 247485211 GFEUPPFRGLSWNY-LAUBAEHRSA-N 397.544 2.680 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(c2nccnc2N2CCCC2)C3)cc1 67473198 XZFFWGIKWDOOMW-UHFFFAOYSA-N 388.475 2.986 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)c1n[nH]c3c1CCC3)CC2)c1ccccn1 12446929 IZGVTXVUNCKFIA-UHFFFAOYSA-N 387.443 2.744 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3ccc4cccc5c4c3CC5)CC2)nn1 65362170 XBBKZRGVMFGQQF-UHFFFAOYSA-N 394.500 2.548 0 50 GFAA C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NC(=O)c1ccc(NC(N)=O)cc1 253418151 GYQYLMMDOQOUOD-XJKCOSOUSA-N 390.484 2.941 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2cc(-c3ccc(O)cc3)n[nH]2)CCC(=O)N1CC1CC1 71738536 AALHOVUMWDHLLX-FQEVSTJZSA-N 396.491 2.891 0 50 GFAA COc1cc2ncn(CCC(=O)Nc3ccc4[nH]ccc4c3)c(=O)c2cc1OC 32124282 NUWJHESSGPERPC-UHFFFAOYSA-N 392.415 2.924 0 50 GFAA biogenic CN(C)c1nnc(-c2ccc(NC(=O)NC[C@](C)(O)c3cccs3)cc2)o1 153607359 SDHWFMIFZHRTHB-SFHVURJKSA-N 387.465 2.893 0 50 GFAA O=C(CCc1ccccc1)N1CCC(C(=O)N2CCC[C@H]2CN2CCCC2)CC1 363136761 NFDAQLYBFXKINO-QFIPXVFZSA-N 397.563 2.945 0 50 GFAA COc1ccc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCSCC3)c2)cc1 71759685 BNCFMOCJWIINDT-UHFFFAOYSA-N 393.486 2.798 0 50 GFAA Cc1nn(CC(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)c(=O)c2ccccc12 46508393 MZIPKSCIHLHVEA-SFHVURJKSA-N 393.443 2.901 0 50 GFAA O=C(Cc1nc(CN2CC(=O)N[C@H]3CCCC[C@@H]32)cs1)Nc1ccccc1 132072194 BTUAGZXZKQDNFW-IRXDYDNUSA-N 384.505 2.567 0 50 GFAA O=C(N[C@@H]1CCOC2(CCCCC2)C1)N[C@@H]1CCCN(CC(F)(F)F)C1=O 130254606 CDAYHJCTYZXWSM-ZIAGYGMSSA-N 391.434 2.721 0 50 GFAA COc1ccccc1Nc1ncccc1C(=O)N1CCN(C2CCOCC2)CC1 176826822 RQMWILVLUZGCOF-UHFFFAOYSA-N 396.491 2.771 0 50 GFAA Cn1nccc1C1=CCN(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)CC1 288767329 CSRLRNAUGOBYIN-INIZCTEOSA-N 399.882 2.678 0 50 GFAA O=S(=O)(Cc1ccnc(-c2ccc(Br)cc2)n1)C[C@@H]1CCCO1 178588878 WOPJDLKWUMFJLU-HNNXBMFYSA-N 397.294 3.000 0 50 GFAA CC(C)(C)S(=O)(=O)CC(=O)NC[C@@H]1CCCCN(Cc2ccccc2)C1 291209020 NRQCXORNUOAQEM-SFHVURJKSA-N 380.554 2.618 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@H](O)C4)csc3C2)nc1 426535317 YRCRGJFCXYDTBQ-KRWDZBQOSA-N 385.533 2.861 0 50 GFAA O=C(NCCc1nc(O)c2ccccc2n1)N1CCC(Cc2cccnc2)CC1 426746352 VFSDSQMGNXKVSB-UHFFFAOYSA-N 391.475 2.937 0 50 GFAA O=C(c1ncc[nH]1)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1 95506097 ZIHIFCACTNJNFN-IBGZPJMESA-N 387.572 2.992 0 50 GFAA COc1cccc2c1OC[C@@H](CNC(=O)C1CCN(Cc3ccco3)CC1)C2 95507132 XZEWLLMWJREENF-MRXNPFEDSA-N 384.476 2.868 0 50 GFAA N[C@H](C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1)C1CCCCC1 95512117 WIZFHNOXZQNTQY-FQEVSTJZSA-N 381.524 2.940 0 50 GFAA CCn1cc(C(=O)N2CCC[C@H](c3nccn3Cc3cccnc3)C2)c(C)n1 95383698 LMNUPZPTWDXYJY-SFHVURJKSA-N 378.480 2.871 0 50 GFAA C=Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1 95501282 KHWMZTNSNXMUFP-UHFFFAOYSA-N 390.487 2.979 0 50 GFAA CCN(CC1CCN(CCc2ccccc2C)CC1)C(=O)Cn1ccccc1=O 95499794 HBILXDXWMNUBOZ-UHFFFAOYSA-N 395.547 2.960 0 50 GFAA COc1ccc(CCNC(=O)CCN2CCc3cc(OC)c(OC)cc3C2)cc1 243244246 KOJUPCWGUTWCFE-UHFFFAOYSA-N 398.503 2.820 0 50 GFAA biogenic CC[C@H](C(=O)Nc1ccc(OC)cc1)N1CCC(N2CCSCC2)CC1 244795801 RNXAXTBBTIJQPG-LJQANCHMSA-N 377.554 2.926 0 50 GFAA Cc1nc(C)n(C[C@H]2CCCN(S(=O)(=O)c3cnc4ccsc4c3)C2)n1 267611384 HQCKEAFWFMPHFZ-AWEZNQCLSA-N 391.522 2.606 0 50 GFAA O=C1[C@@H]2[C@@H](OCOCc3ccccc3)[C@@H]3C(=O)[C@H]4[C@H]5[C@@H]6[C@H]([C@H]1[C@H]1C=C[C@@H]4[C@H]61)[C@@H]2[C@@H]53 254380672 IMOUDSNFOYCYFR-JTDAVXDPSA-N 388.463 2.730 0 50 GFAA COC(=O)c1sccc1NC(=O)c1ncn(-c2ccc(OC(F)F)cc2)n1 261490671 VNQXIEIJEHKNHP-UHFFFAOYSA-N 394.359 2.969 0 50 GFAA COC(=O)c1c(NC(=O)[C@H]2CCCO2)c2cc(N)cnc2n1Cc1ccccc1 299798503 QCSZEIZZZWLFCV-MRXNPFEDSA-N 394.431 2.571 0 50 GFAA Nc1cc(O)nc(CCn2cnc3ccc(-c4ccc(F)cc4)cc3c2=O)n1 584904019 UWRUCFFSGWRZAW-UHFFFAOYSA-N 377.379 2.523 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)CCn2cnc3ccccc32)C1)c1ccoc1 952990727 YLHXEJANOMAVON-MRXNPFEDSA-N 380.448 2.688 0 50 GFAA CC(C)c1ccc(C(=O)N2C[C@H]3c4ccccc4OC[C@@]3(C(=O)O)C2)c(O)n1 1565512003 FGHLJODTGZNKSD-BTYIYWSLSA-N 382.416 2.614 0 50 GFAA O=C([C@@H]1CC12CCS(=O)(=O)CC2)N1CCOc2ccc(C(F)(F)F)cc21 274941480 QYRBNLFBAKAWEO-LBPRGKRZSA-N 389.395 2.646 0 50 GFAA O=C(NCCOc1cccnc1)c1ccc(-c2noc(C(F)(F)F)n2)cc1 170626742 GKOXCSGOHOLJQL-UHFFFAOYSA-N 378.310 2.959 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1CCCN(CC(F)(F)F)C1)C2 194188314 PMKSAJIFKSKORO-OAHLLOKOSA-N 383.414 2.804 0 50 GFAA O=C(c1cccnc1N1CCC2(CC1)Nc1ccccc1NC2=O)N1CCCC1 1704297095 HFSZEKZHSSOUSG-UHFFFAOYSA-N 391.475 2.721 0 50 GFAA COc1cc(O)cc(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1 1704299675 STKCFIBIIUTKDL-IIBYNOLFSA-N 378.428 2.625 0 50 GFAA OCCn1cnc2cc(-n3ccnc3-c3cnc(N4CCCC4)s3)ccc21 1772810708 OQZQTJRYWPJKKX-UHFFFAOYSA-N 380.477 2.938 0 50 GFAA O=C(N[C@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1cccc2nccnc12 12052388 HDJLHNVGFKGIHB-AWEZNQCLSA-N 380.835 2.814 0 50 GFAA Cc1nccn1CCCNC(=O)[C@H]1CCC(=O)N(CCCc2ccccc2)C1 12198895 JGHHTBSDJRHCPV-FQEVSTJZSA-N 382.508 2.569 0 50 GFAA Cc1cnc(CNC(=O)c2cn(C(c3ccccc3)c3ccccc3)nn2)cn1 12301054 FQRQWUYBITVKID-UHFFFAOYSA-N 384.443 2.944 0 50 GFAA CCN(C[C@H]1CCCO1)C(=O)CCc1nnc(CCc2ccc(OC)cc2)o1 12302485 MUUIXHRYMBXQPX-GOSISDBHSA-N 387.480 2.824 0 50 GFAA COc1ccc(CN2C[C@@H]3C[C@@H](c4cnn(C)c4C)N4CCC[C@@]34C2=O)cc1 12387325 FGBIZNDTFGPMLO-XJABCFGWSA-N 380.492 2.675 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CN3CCc4sccc4C3)C2=O)c1 12593131 WTRSYZDTUKXKIQ-OAQYLSRUSA-N 386.517 2.669 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)NCc2cnn(Cc3ccccc3)c2)nn1 14949118 NGQOCDJQXQHQKE-UHFFFAOYSA-N 386.459 2.810 0 50 GFAA COCc1ccc(CN2CCC[C@H](CNC(=O)c3ccc4c(c3)OCO4)C2)o1 19741559 ASEWWYIGZIOFIL-OAHLLOKOSA-N 386.448 2.797 0 50 GFAA COCCN1C(=O)C[C@@H](CNCC(C)=Cc2ccccc2)[C@@H]1c1cnn(C)c1 1857532000 FBQZHHYQWHAIAN-SIKLNZKXSA-N 382.508 2.649 0 50 GFAA O=C(C1CCCC1)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NCCCO)C2 1857697218 KTVAXYVEFRXSKR-MIZPHKNDSA-N 384.520 2.668 0 50 GFAA CSCC(=O)N1CCC2(CC1)CN(Cc1ccc(C)s1)C[C@H]2C(=O)O 1857704412 QUYJLUAHGRLFPX-HNNXBMFYSA-N 382.551 2.545 0 50 GFAA Cc1ocnc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857715470 SRVGNSYRJIVBPG-OAQYLSRUSA-N 391.431 2.661 0 50 GFAA Cc1cc2occ(CC(=O)N3C[C@@H]4[C@H](CO)[C@H]5CC[C@]4(C3)O5)c2cc1Cl 1857723638 OQJDPNAIFXGUAS-DKYLXPRQSA-N 375.852 2.935 0 50 GFAA Cc1ccc(F)cc1S(=O)(=O)N1CCO[C@@H](CN(C)C)[C@@H]1c1ccccc1 1857732486 SGLOCHVYYLETHJ-ICSRJNTNSA-N 392.496 2.827 0 50 GFAA Cc1cc(C)nc(N2C[C@@H]3[C@H](CNC(=O)c4ccccn4)[C@H]4CC[C@]3(C2)O4)c1 1875242921 IEGDTJRGBUZJFN-ODULNIPZSA-N 378.476 2.507 0 50 GFAA Cc1cncc(C(=O)NC[C@H]2[C@H]3CN(c4cc(C)ccn4)C[C@]34CC[C@H]2O4)c1 1875250805 INCCTPPZGRLARL-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA O=C1C[C@H](NC23CC4CC(CC(C4)C2)C3)C(=O)N1Cc1ccc2c(c1)OCO2 19881460 MGPNNRVETJVOFD-ATFGOMPUSA-N 382.460 2.601 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)C(C)(C)Oc2cccc(C)c2C)C[C@@H]1O 1704300556 YUCGJKAQDBTEDI-UWJYYQICSA-N 377.481 2.925 0 50 GFAA C[C@@H](C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1)n1cncn1 837230729 FSYVIOKXSHLGTM-RDJZCZTQSA-N 385.468 2.660 0 50 GFAA N[C@@H]1C[C@H](CNC(=O)c2csc(Cc3cccc(C(F)(F)F)c3)n2)C[C@H]1O 1875304995 BTFMDMGYVCVDFM-NJZAAPMLSA-N 399.438 2.581 0 50 GFAA O=C(Cc1ccc2nc(O)[nH]c2c1)N1C[C@@H](C2CCNCC2)c2ccccc21 1875318363 HJWPXRMABFRDPT-KRWDZBQOSA-N 376.460 2.941 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3cc(C(=O)OC)sc3C2)cc1 1875374046 YTTQWWVGVWQMFP-UHFFFAOYSA-N 384.457 2.882 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnoc1C1CC1 1875403155 PTHHWPGVFBJFCB-NIKGAXFTSA-N 392.459 2.985 0 50 GFAA CC[C@@H](c1ccccc1)c1nnc(N2CCO[C@@H](C)C2)n1CCCNC(C)=O 1764009230 KHFQCWCLCIZYEJ-LPHOPBHVSA-N 385.512 2.571 0 50 GFAA O=C1COc2c(cc(C(F)(F)F)cc2NC(=O)N2CC[C@@H](n3cccn3)C2)N1 886063007 ZRHGKMHJCIDQRL-LLVKDONJSA-N 395.341 2.712 0 50 GFAA COC(=O)c1nccc(N2CCC(C3(NC(=O)C[C@@H](C)C(C)C)CC3)CC2)n1 1775991207 JMRXTCUNEADXII-OAHLLOKOSA-N 388.512 2.811 0 50 GFAA COc1ccc([C@H]2[C@@H](CNC(=O)NCc3ccnc(N(C)C)c3)CCN2C)cc1 1775996458 XYVTWCZVIZIVOT-NQIIRXRSSA-N 397.523 2.648 0 50 GFAA Cc1cc(C(=O)NC[C@]2(C)CCCN(C(=O)COCC3CC3)C2)nn1C(C)C 2325794190 UPMBTWFFADCUST-NRFANRHFSA-N 390.528 2.558 0 50 GFAA O=C1NCc2c1cccc2C(=O)N1CCCC[C@H]1C(=O)OCc1ccccc1 2325885794 XKJQBILMTJAARC-IBGZPJMESA-N 378.428 2.668 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O 1150333 QFZQLWMUWHTMIR-AWEZNQCLSA-N 390.461 2.657 0 50 GFAA Cc1nc2ncccn2c1-c1csc(Nc2ccc(S(N)(=O)=O)cc2)n1 1895784 WBOPPPMMTZAUNV-UHFFFAOYSA-N 386.462 2.552 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@]12CCCN2CCOCc1ccccc1 2356148947 BHBRZBYKNVNWEM-MQSCRBSSSA-N 386.536 2.964 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)[C@@H]2CC(=O)OC23CCCC3)CC1 2356150852 CFATYPUZPGOELP-IBGZPJMESA-N 399.487 2.962 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3cc(CO)ccn3)C2)c2cccc(=O)n21 2356154588 BALAURWQMSSWPY-LQWHRVPQSA-N 395.503 2.972 0 50 GFAA COCCNC(=O)c1ccc(CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1 2648517 JQWYSEMOBVKLPU-UHFFFAOYSA-N 390.505 2.646 0 50 GFAA COc1ccc(CCNC(=O)C(=O)Nc2ccc(Br)cc2)cc1 4703143 XPFVKXYHYWTDPT-UHFFFAOYSA-N 377.238 2.755 0 50 GFAA biogenic CC(C)CNC(=O)c1ccccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 4742550 NYPZRFUEMLINMN-UHFFFAOYSA-N 389.477 2.696 0 50 GFAA Cc1ccccc1CN1CCN(Cc2cccn2-c2ncccn2)C[C@H]1CCO 104484602 PUYMCZJHVMXRAB-OAQYLSRUSA-N 391.519 2.645 0 50 GFAA COc1ccc(-c2ccnc3c2c(=O)[nH]c(=O)n3Cc2ccccc2)cc1OC 9482582 NQJGJVJITOCAEG-UHFFFAOYSA-N 389.411 2.817 0 50 GFAA COc1ccccc1NC(=O)CCNC(=O)[C@H]1CCCN(Cc2ccco2)C1 55414282 YMCPLNSRJCQOJF-INIZCTEOSA-N 385.464 2.645 0 50 GFAA COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)CN2CCC[C@@H](O)C2)cc1 227740815 AXQULSBJGPNGCV-DENIHFKCSA-N 393.487 2.830 0 50 GFAA CC(C)[C@H](CO)NC(=O)c1cc(CN2CCC(Cc3ccccc3)CC2)on1 67712970 MEZMZHPCFXNURW-NRFANRHFSA-N 385.508 2.876 0 50 GFAA CCN1CCC(N2C[C@H]3[C@@H](C2)OC(=O)N3CCCc2ccc(F)cc2)CC1 20854723 MQRZJFRNHFRCFZ-VQTJNVASSA-N 375.488 2.748 0 50 GFAA CN1CCC[C@H](NC(=O)NC[C@H]2CCN(c3cccc(Br)c3)C2)C1 252458586 VIVJEBCREQPPIC-ZBFHGGJFSA-N 395.345 2.669 0 50 GFAA CO[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccccc1)CNC(=O)[C@@H]1C[C@@H]1c1ccccc1 252511651 JAYXVKSAZONTGI-CSEOROSGSA-N 392.499 2.841 0 50 GFAA CC1(C)[C@@H](O)C[C@@H]1NC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 426075616 HCKDGCRSYCVAEM-GJZGRUSLSA-N 386.477 2.976 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)CN3CCC[C@H](C)C3)CC2)OC1=O 77469773 NROHDOFEWVJKNZ-KRWDZBQOSA-N 379.545 2.968 0 50 GFAA Cc1cc(-c2cn3cc(C(=O)N[C@@H]4C[C@@H]5CC[C@H]4C5)nc3c(=O)n2C)c(C)o1 72423745 BWPHIGFFQZQVFZ-IJEWVQPXSA-N 380.448 2.828 0 50 GFAA CCCN1CC2(CCN(C(=O)c3ccc(O)c(Cl)c3)CC2)C[C@@H]1C(=O)O 72431674 SVAAUWGFQGMUSN-OAHLLOKOSA-N 380.872 2.837 0 50 GFAA Cc1cc(C)cc(C(=O)NCC(=O)Nc2ccn(-c3ncccc3Cl)n2)c1 126482064 PGWSNXDLYWDEKJ-UHFFFAOYSA-N 383.839 2.906 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCN(CC2CCOCC2)CC1 172461252 CXMJHLJBHYXZND-UHFFFAOYSA-N 385.533 2.918 0 50 GFAA Cc1nc(C)c(CCNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)s1 173618460 WIFUKRPECPZIPK-SFHVURJKSA-N 377.485 2.631 0 50 GFAA CCCc1cc(=O)[nH]c(-c2ccccc2CN2CCC(N3CCOCC3)CC2)n1 48284572 ILIJUHLOFUMYDQ-UHFFFAOYSA-N 396.535 2.686 0 50 GFAA COCCN1CCC[C@@H](CN(C)C(=O)c2ccc(-c3cc(N)ccn3)cc2)C1 426398026 IKQRHYXZBPAPES-KRWDZBQOSA-N 382.508 2.761 0 50 GFAA Cc1[nH]c2c(F)cc(F)cc2c1CCNC(=O)N(C)CCc1cnn(C)c1 426444467 HGWGHYPSHYDFFG-UHFFFAOYSA-N 375.423 2.915 0 50 GFAA Cc1cc2cc(CNC(=O)C[C@H]3C(=O)NCCN3CC3CCCCC3)ccc2[nH]1 20911796 QHWDZGQBRYSWSS-NRFANRHFSA-N 396.535 2.863 0 50 GFAA Cc1nnc(-c2ccc(C)c(NC(=O)N3CCN(C4CCOCC4)CC3)c2)o1 97468049 OCYAPVOWXBSHBX-UHFFFAOYSA-N 385.468 2.682 0 50 GFAA Cn1cccc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91411315 NNQCYAAFCGGCER-UHFFFAOYSA-N 380.492 2.508 0 50 GFAA COc1ccc(NC(=O)N2CC[C@H](N(C)C)[C@H](CCC(=O)O)C2)cc1Cl 91426541 WRHNQHZAJAJTPQ-DOMZBBRYSA-N 383.876 2.997 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CCCN2c3ccccc3C[C@H]2C1 291808632 HQMYROAWIAOIMB-ICSRJNTNSA-N 393.487 2.938 0 50 GFAA NC[C@H]1CCN(C(=O)c2cnc(Cc3c(Cl)cccc3Cl)nc2O)C1 92099207 JJYLIPZSEGSUIC-SNVBAGLBSA-N 381.263 2.501 0 50 GFAA Cc1nc2cc(C(=O)N3CCC[C@H](c4nccn4CCN(C)C)C3)ccc2[nH]1 95530599 GETKRENWWGXDHV-KRWDZBQOSA-N 380.496 2.649 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(C(=O)NC2CCCCC2)cc1)c1ncc[nH]1 92022541 TWACOFSHGQXVJU-ZDUSSCGKSA-N 376.482 2.512 0 50 GFAA COc1cccc2[nH]cc(CC(=O)N[C@H](C)C3(N4CCOCC4)CCCC3)c12 182195936 HDKDDQFWFNCNLA-MRXNPFEDSA-N 385.508 2.869 0 50 GFAA COCCN1CCCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)CC1 299235031 UNLOPLQMCIXRFA-UHFFFAOYSA-N 384.451 2.851 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](O)[C@H](NC(=O)C(c2ccccc2)c2ccccc2)C1 1940194933 DGRGTNHRVRYUAD-XUVXKRRUSA-N 380.488 2.599 0 50 GFAA Cc1ccccc1CN1CCC2(CC[C@@H](CNC(=O)Cn3ccnc3)O2)CC1 299782022 FKXATPCJYACWTR-FQEVSTJZSA-N 382.508 2.522 0 50 GFAA Cc1ccc2nc(CNC(=O)N3CCC[C@H]3C(=O)N3CCCCC3)[nH]c2c1C 584884841 GOTVRJJIHDIYNQ-KRWDZBQOSA-N 383.496 2.866 0 50 GFAA Cc1c(NC(=O)c2ccccc2N2CCOCC2)cccc1-c1nncn1C 952982746 MMTXKNZMLBHCNF-UHFFFAOYSA-N 377.448 2.879 0 50 GFAA CCn1cc(-c2nn(C)cc2C(=O)NCC2([C@@H](O)c3ccccc3)CC2)cn1 275349481 QKLYCOQMEHYLMW-IBGZPJMESA-N 379.464 2.547 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NCc3ccc(-n4ccnc4)c(F)c3)c2c1 302660854 IGKWRZQZJJKYJU-UHFFFAOYSA-N 397.435 2.970 0 50 GFAA Nc1cc(OC(=O)c2ccccc2Cl)nn1S(=O)(=O)c1cccc(F)c1 170615633 RDCJLJCWZBLNDM-UHFFFAOYSA-N 395.799 2.714 0 50 GFAA C[C@H]1CN(CCN(C)C(=O)c2ccn(-c3ccccc3Cl)n2)C[C@@H](C)O1 194767907 UBGLSXQFFPVLSP-GASCZTMLSA-N 376.888 2.707 0 50 GFAA Cn1c(C2CCN(C(=O)CSc3nnc(N)s3)CC2)nc2ccccc21 1506412470 DHSAGBOSDBIBKB-UHFFFAOYSA-N 388.522 2.505 0 50 GFAA Cc1cc(C)n(C2CN(S(=O)(=O)c3cc(-c4ccno4)sc3C)C2)n1 1506426850 VNYMDXFCYJPNQQ-UHFFFAOYSA-N 378.479 2.770 0 50 GFAA CC(C)c1cc(C(=O)N(C)[C@H](C)c2ccc3c(c2)OCCO3)nc2ncnn12 1506402563 JTKMBKDPMZKNOT-CYBMUJFWSA-N 381.436 2.852 0 50 GFAA O=C(O)c1c(NCCN2CCC[C@H](CO)C2)noc1-c1ccc(Cl)cc1 1704307959 NSRVJWDYTPJLHV-LBPRGKRZSA-N 379.844 2.809 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)CCc3cc(Cl)no3)C1)CC2 1704344732 XSOGKVLDHUMMIQ-IBGZPJMESA-N 389.887 2.623 0 50 GFAA O=C1CC2(CCN(c3noc(-c4ccc(Cl)cc4)c3C(=O)O)CC2)CN1 1704307974 BAQSGPNOWXGEHF-UHFFFAOYSA-N 375.812 2.800 0 50 GFAA COC(=O)CN1C(=S)N(c2ccc(OC)cc2)C(=O)/C1=C/c1cccs1 981625 RYKZVHAUGZBNGK-GDNBJRDFSA-N 388.470 2.904 0 50 GFAA COCC(=O)N1CCC(Oc2ccccc2C(=O)NCc2cccs2)CC1 11714181 DAQARQSJLFVXRX-UHFFFAOYSA-N 388.489 2.694 0 50 GFAA NC(=O)CCC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-c2ccc(F)cc2)c1 11842827 AMLDLUQWDKXMLF-GOSISDBHSA-N 383.423 2.688 0 50 GFAA O=C1C[C@@H](NCc2ccc(-n3cccn3)cc2)CN1CCc1ccc(F)cc1 11879076 XOAARGWQIOQLQB-HXUWFJFHSA-N 378.451 2.945 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)NCC[C@@H]3CCCCO3)o2)c1 12072966 BEQMPYRGDSZQPK-KRWDZBQOSA-N 387.480 2.871 0 50 GFAA CC(C)CCN[C@H]1CCc2c(sc3ncn(Cc4cnn(C)c4)c(=O)c23)C1 12218561 AZFORPNMQQWQQL-HNNXBMFYSA-N 385.537 2.733 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2C)CCCN(C(=O)c2cc[n+]([O-])cc2)C1 12595030 HVLYYBINIQJLEB-JOCHJYFZSA-N 382.460 2.657 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)N3CCN(Cc4ccccc4)CC3)CC2=O)cc1 19831095 ONYXMKGELJCDCS-HXUWFJFHSA-N 377.488 2.692 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4ccccc4Cl)nnc3c2)n1 169776189 MWNPRWCHVCOJEV-UHFFFAOYSA-N 382.811 2.925 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857699898 COSCTMCVDGDKRJ-MRXNPFEDSA-N 396.495 2.918 0 50 GFAA COC(=O)CCCC(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1875246704 FSXZALZTKQAQCS-UHFFFAOYSA-N 389.496 2.629 0 50 GFAA O=C(c1ccc(-n2ccnc2)cc1)N1C[C@@H]2COc3ccccc3C[C@]2(CO)C1 247956102 VKAAVZFSKMGQFJ-AUSIDOKSSA-N 389.455 2.558 0 50 GFAA COc1ccc(CN2CCC(CNC(=O)N[C@H](C)c3cnn(C)c3)CC2)cc1 266532451 KTMWEXBUOUODPD-MRXNPFEDSA-N 385.512 2.701 0 50 GFAA Cc1cc([C@@H](O)CN(C)C(=O)c2csc(N3CCCCC3)n2)ccc1O 1875296416 WHBUNJJLJOKHAY-KRWDZBQOSA-N 375.494 2.953 0 50 GFAA C[C@H](NC(=O)[C@H]1CCN(C)C[C@H]1c1ccnn1C)c1cccc(-n2ccnc2)c1 1875267164 VBZRMHFTGYWFFO-FFZOFVMBSA-N 392.507 2.519 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1Nc1nccc2c(Br)cncc12 1875399285 VAMHSIHFAIZLLV-HFBAOOFYSA-N 388.269 2.840 0 50 GFAA Cc1cc(=NC(O)=C2N=NC3=C2CCCCC3)n([C@@H]2CCS(=O)(=O)C2)[nH]1 2083730284 NCFOPCPPQGSQNZ-GFCCVEGCSA-N 377.470 2.796 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N[C@@]1(C(=O)O)COc2ccccc2C1 2325756401 NHNWFGWJVAGFPT-HXUWFJFHSA-N 398.440 2.829 0 50 GFAA COc1ccc(N2CCC[C@@H](NC(=O)[C@@H](C)n3ccc(C4CC4)n3)C2=O)cc1 2325791086 RBSBVHUAYDMACT-AUUYWEPGSA-N 382.464 2.642 0 50 GFAA Cc1coc(C)c1C(=O)NC[C@]12CCC[C@H]1N(C(=O)CCc1ccn(C)n1)CC2 2325794181 UDSMAQQNDQRRMH-XMSQKQJNSA-N 398.507 2.764 0 50 GFAA COc1cccc(N(CC(=O)N2CCCC2)S(=O)(=O)c2ccc(C)cc2)c1 821256 SUTXASJGYBYQNZ-UHFFFAOYSA-N 388.489 2.821 0 50 GFAA NS(=O)(=O)c1ccc(NC(=S)N2CCC(Cc3ccccc3)CC2)cc1 986498 HZQDCAXBBSQDGT-UHFFFAOYSA-N 389.546 2.986 0 50 GFAA COc1ccc(N2C(=O)N(c3cccc(Cl)c3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 1153080 PONLFMUXXVZTLB-IRXDYDNUSA-N 392.864 2.961 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCC(N3CCC(C)CC3)CC2)cc1 1154725 FYLFWNQCPXSDQM-UHFFFAOYSA-N 379.526 2.530 0 50 GFAA COCCn1nc(CC(C)C)nc1[C@H]1OCC(=O)N(C)[C@@H]1c1ccccc1C 2356143755 VVZFPWJCNFWBKN-UXHICEINSA-N 386.496 2.702 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3ccc(-c4cncc(N)n4)cc3)CC2)nc1 2356156210 WYBFWXOAMAGYIX-UHFFFAOYSA-N 389.459 2.553 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3ccncc3OC)CC1)OCC2 2356168377 AUMIRPNRLUJKHC-UHFFFAOYSA-N 398.459 2.812 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)N1CC[C@H]2CCCC[C@H]2C1 247807032 BWWYBRYBOWYFEM-IXDOHACOSA-N 384.476 2.849 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(-c4noc(CC(C)C)n4)[nH]c3C2)c1 67457954 FUPFBKSYSLJKDD-ZDUSSCGKSA-N 381.436 2.737 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC[C@@H](CO)C3)nc2)cc1 67982512 WUGCSEFMDNUVJP-GOSISDBHSA-N 383.492 2.662 0 50 GFAA COc1ccccc1-c1cc(C(=O)NCCN2CCOCC2)c2ccccc2n1 20275104 NTTUPKBVQLZHQJ-UHFFFAOYSA-N 391.471 2.972 0 50 GFAA O=C1CN(C(=O)CN2CC[C@@H](Oc3cccc(Cl)c3)C2)c2ccccc2N1 120269223 VXFGGIZHFMGIMB-MRXNPFEDSA-N 385.851 2.778 0 50 GFAA CN(C(=O)CN1CCN(Cc2cccnc2)CC1)[C@@H]1CCCc2ccccc21 125314234 DIBZKTJASQXCRH-JOCHJYFZSA-N 378.520 2.735 0 50 GFAA CCOC(=O)CC(=N)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 4001989 FZPQOEYSYCUPKR-UHFFFAOYSA-N 378.782 2.806 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@@H](CCc3ccc(F)c(F)c3)C2)n1 71751990 AKQXFJXLFDOUCE-INIZCTEOSA-N 375.419 2.701 0 50 GFAA C[C@@H]1Oc2c(cccc2C(=O)NC2CCN(Cc3ccccc3)CC2)NC1=O 363571583 PZFYSYZHOHYPCD-HNNXBMFYSA-N 379.460 2.800 0 50 GFAA C[C@@H]1CN(C(=O)c2ccccc2SCC(=O)N2CCc3ccccc32)CCN1 155105713 LLCHWQRAHMNVBZ-MRXNPFEDSA-N 395.528 2.802 0 50 GFAA Cc1c(CN(C)C(=O)CC[C@]2(CCC(=O)O)CCC(=O)N2)[nH]c2ccccc12 218924917 FEPKWYFXKZLJME-NRFANRHFSA-N 385.464 2.729 0 50 GFAA Cn1cc([C@H]2CN([C@@H]3CCN(c4ccc(F)cc4)C3=O)CC23CCOCC3)cn1 334058967 XLYMNZDQRWTTFD-WOJBJXKFSA-N 398.482 2.561 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)/C=C/c1ccccc1Cl 129391600 VCOHPXVVXSQRDB-PLWJUESGSA-N 382.873 2.503 0 50 GFAA CCc1cccc2c(C3CCN(C(=O)c4nccnc4C(N)=O)CC3)c[nH]c12 174186202 DNYYJVZRLNLJFK-UHFFFAOYSA-N 377.448 2.639 0 50 GFAA COCc1ncc(C(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)s1 285327732 XYPKSFRIABCOBB-OAHLLOKOSA-N 395.912 2.746 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H](C)n3ccnc3C)n1)CCN(C(=O)C1CC1)C2 20295519 GWVBSMMITUXUOL-CYBMUJFWSA-N 392.463 2.849 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@@H](C(=O)c4ccccc4)N4CCC[C@H]4[C@@H]3C2=O)cc1 135956052 NMGOVUSWQPVCMX-MUGJNUQGSA-N 390.439 2.530 0 50 GFAA CCCOc1ccc(-c2cccc(C(=O)N(C)[C@H](C)C(=O)NC)c2)cc1CO 426494675 SCDUDRJCCDTKHC-OAHLLOKOSA-N 384.476 2.841 0 50 GFAA OC[C@]12COc3ccccc3[C@H]1CN(Cc1cc(F)ccc1-n1cccn1)C2 95387561 NRFLJBVTRVJTAQ-DENIHFKCSA-N 379.435 2.982 0 50 GFAA Cc1ccc(CCNS(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)s1 91746557 IKIDXPHAQQBIGD-UHFFFAOYSA-N 378.519 2.814 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(Cc1ccc(-n3ccnc3)cc1)CC2 95373276 IGWHKMDBEPTUTC-UHFFFAOYSA-N 395.551 2.639 0 50 GFAA O=C(NC[C@H](c1ccccc1)N1CCCCC1)N1CCC(n2cnnc2)CC1 426662517 VLWYEQLKYOGXEA-HXUWFJFHSA-N 382.512 2.852 0 50 GFAA CN(C)C(=O)c1cccnc1N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95505934 YLIKIXJRSWXJJU-KRWDZBQOSA-N 390.491 2.807 0 50 GFAA CCn1ncnc1[C@@H](C)NC(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl 97295320 QRJUJXBYIDWCJX-LLVKDONJSA-N 378.864 2.972 0 50 GFAA O=C1N(C2CCCC2)CCC[C@]12CCN(S(=O)(=O)c1ccc(F)cc1)C2 91380877 NKSVDOOVFGHBGN-LJQANCHMSA-N 380.485 2.772 0 50 GFAA CCOc1ccccc1CN(C(=O)c1ccc(Cn2cnnn2)cc1)C1CC1 97099175 ZUJQVFZJYVJEGN-UHFFFAOYSA-N 377.448 2.925 0 50 GFAA CCOc1cc(S(=O)(=O)Nc2ccccc2C(N)=O)c(OCC)cc1C 239760984 CJANISWNVKBHKC-UHFFFAOYSA-N 378.450 2.692 0 50 GFAA COCCN1CCC(CN(C[C@H]2CCCO2)C(=O)c2cc(Cl)cn2C)CC1 96151762 HCOWMDZPHXOAFZ-GOSISDBHSA-N 397.947 2.658 0 50 GFAA O=C(Nc1ncn(C2CCCCC2)n1)N[C@@H]1CCN(c2ccccc2F)C1=O 184603522 NFQYZRSGGWKDGP-OAHLLOKOSA-N 386.431 2.849 0 50 GFAA C[C@H](NC(=O)N1CCN(C(=O)c2cccs2)CC1)c1cn2ccsc2n1 534659595 SXSXMHNGBNZAFZ-LBPRGKRZSA-N 389.506 2.686 0 50 GFAA CCCc1cc(-c2ccc(C(=O)NCCc3nncn3CC)cc2)nc(C)n1 534670163 WHBBJSQZUKMNJY-UHFFFAOYSA-N 378.480 2.988 0 50 GFAA O=C([C@@H]1CC(Cc2ccc3c(c2)OCO3)=NO1)N1CCC[C@H]1c1nccs1 299779252 NDNOURHHAHQBOJ-YOEHRIQHSA-N 385.445 2.923 0 50 GFAA O=C(NC1CCN(Cc2ccc(-c3ccccc3)cc2)CC1)N[C@H]1CCNC1 828034776 UINXBDYGCODABK-QFIPXVFZSA-N 378.520 2.979 0 50 GFAA CC(C)n1nccc1S(=O)(=O)NCCCc1nc2ccc(Cl)cc2[nH]1 670437037 XZUBELBXHMMCCA-UHFFFAOYSA-N 381.889 2.905 0 50 GFAA CC(C)=CCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2 1565511926 HQDMRJODUIDCNZ-MSOLQXFVSA-N 384.476 2.764 0 50 GFAA Cc1cc(C(=O)NCC[C@H]2CCCCN2S(C)(=O)=O)c2ccc(F)cc2n1 952964726 DHTQCMNBZFHXHT-OAHLLOKOSA-N 393.484 2.616 0 50 GFAA CN(C)c1nccc([C@@H]2CN(C(=O)Nc3ccc(-c4cc[nH]n4)cc3)CCO2)n1 275413390 CSOGNJXEFXTLOH-SFHVURJKSA-N 393.451 2.538 0 50 GFAA Cc1cn(-c2ccccc2)nc1C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 186655683 GHHXNGRAEVQJQH-LJQANCHMSA-N 388.471 2.959 0 50 GFAA O=C(CN1CCO[C@H](c2ccc(F)cc2F)C1)N1CCc2sccc2C1 187269924 JLSXSDFVXWMGFM-KRWDZBQOSA-N 378.444 2.985 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCC([C@H](O)c2ccccn2)CC1 1506418458 TVZOAPWFDWMKGH-FQEVSTJZSA-N 390.505 2.841 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CCN(CC3CC3)CC2)s1 1506395242 FJBBVNMKGKUVRR-UHFFFAOYSA-N 381.523 2.736 0 50 GFAA CC[C@H](C)C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cnc(C)[nH]2)c1 1704311096 YAQJTGJTOQVZGZ-HNNXBMFYSA-N 385.512 2.907 0 50 GFAA CC(C)CCN1C(=O)CC[C@@H]2CN(C(=O)CCn3cc(Cl)cn3)CC[C@@H]21 213064799 HUVYFGLHRBLRDF-WBVHZDCISA-N 380.920 2.812 0 50 GFAA Cc1cc(C)n(CCNC(=O)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)n1 11933102 BTJCXTSUETVKQA-QGZVFWFLSA-N 388.899 2.708 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(Cc3cc4ccccc4[nH]3)CC2)O1)[C@H]1CCCO1 11995846 WAPJOWWYILVEMS-PZJWPPBQSA-N 397.519 2.977 0 50 GFAA COc1cc(CNCc2ccccc2F)ccc1OC[C@H](O)CN1CCCC1 12029943 LGPJXXJPGDCWLA-LJQANCHMSA-N 388.483 2.960 0 50 GFAA O=C(c1ccccc1OC1CCN(Cc2ccccn2)CC1)N1CCC[C@H]1CO 12304073 FWXSLTVTPONTDQ-IBGZPJMESA-N 395.503 2.722 0 50 GFAA COc1cc(CC[C@H](O)C[C@H](O)CCc2ccc(O)c(OC)c2)ccc1O 13377893 OELMAFBLFOKZJD-CALCHBBNSA-N 376.449 2.792 0 50 GFAA biogenic,in-vitro Cc1ccccc1N1C[C@@H](C(=O)N2CCN(c3ccccc3F)CC2)CC1=O 16576787 AIKUWYNHAALADF-KRWDZBQOSA-N 381.451 2.836 0 50 GFAA COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(CN2CCOCC2)cc1 19929093 WPNLXGOPALKJLW-UHFFFAOYSA-N 399.516 2.963 0 50 GFAA COc1ccc([C@H]2Cn3nnc(-c4noc(-c5cccnc5)n4)c3CO2)cc1 169769028 VUMBQEGLEJKKSB-MRXNPFEDSA-N 376.376 2.670 0 50 GFAA O=C(NCC1CC1)c1cc2c(s1)CCOC21CCN(Cc2cnc[nH]2)CC1 1857682095 HQHCKIGTVGPUAJ-UHFFFAOYSA-N 386.521 2.675 0 50 GFAA CCCCc1ccc(S(=O)(=O)N[C@H]2C[C@H]3CO[C@H](C4CC4)CN3C2)cc1 1857717439 SEUDWKMVLZUNRG-BJLQDIEVSA-N 378.538 2.559 0 50 GFAA COc1ccccc1CN1C(=O)O[C@H]2CN(C(=O)NCc3ccccc3)C[C@H]21 209413085 ACRNHQYNJHJGJV-MJGOQNOKSA-N 381.432 2.610 0 50 GFAA Cc1ccc(S(=O)(=O)N2CC[C@H](c3nccn3C)C2)cc1Br 407997895 MXIRTUCRQKGAPH-LBPRGKRZSA-N 384.299 2.669 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)CCC(F)(F)F)[C@H]3CC[C@]2(C1)O3 2100548132 VGELNXSBKFESGL-LUXYFRNMSA-N 383.414 2.833 0 50 GFAA O=C1CC[C@H](Nc2cc(N3CCCC3)nc(-c3ccc(Cl)cc3)n2)C(=O)N1 1857797824 YEZOXYAFERPYNK-AWEZNQCLSA-N 385.855 2.614 0 50 GFAA CCC(=O)NC[C@H]1CC2(CC2)CN1C(=O)Cc1cscc1Br 2325869632 WSLMMVTVIVDXFQ-GFCCVEGCSA-N 385.327 2.960 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)NCc2cc(C3CC3)on2)[C@H]1c1ccccc1 2356136582 ACNLOZHHPGFVCU-UXHICEINSA-N 383.448 2.545 0 50 GFAA COc1ccnc(C(=O)N2CCC[C@]23CCCN(c2ccc(C)cc2)C3=O)c1O 2356151007 MISMRQZQMMOPNZ-QFIPXVFZSA-N 395.459 2.906 0 50 GFAA COC(=O)/C(=C/c1ccc(OC)cc1)NC(=O)c1ccc(Br)o1 2836702 XZIKQAVNPHLTMC-XFXZXTDPSA-N 380.194 2.995 0 50 GFAA Cc1cc(Cl)c(S(=O)(=O)N(C)C)cc1OCC(=O)Nc1ccccc1 4842518 LOFPSJYLTLLSIO-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA O=C(Nc1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)C3)cc1)c1cccnc1 111846982 XMZVYFTYZKGHML-ROUUACIJSA-N 380.448 2.531 0 50 GFAA Cc1n[nH]c(C)c1CN(C)c1ccc(C(=O)NCC[C@H]2CCCCN2C)cn1 20209130 UPJITLSQIRSVPN-GOSISDBHSA-N 384.528 2.662 0 50 GFAA CNC(=O)[C@@H]1CCCN(CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)C1 247485206 GFEUPPFRGLSWNY-DYESRHJHSA-N 397.544 2.680 0 50 GFAA COc1cc([C@@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N(C)C(=S)N32)ccc1O 22204851 GVCLBNUGPADGCM-HNAYVOBHSA-N 393.468 2.955 0 50 GFAA OCC[C@@H]1CN(Cc2cnn(-c3ccccc3)c2)CCN1CCc1ccccc1 22913003 UUHOGEVTXLMLMK-XMMPIXPASA-N 390.531 2.984 0 50 GFAA O=S(=O)(CC12CCC(CC1)C2)NCCS(=O)(=O)c1ccc(Cl)cc1 329755833 YJEFQDUJGALWCM-UHFFFAOYSA-N 391.942 2.613 0 50 GFAA O=S(=O)(NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1)c1cccc(F)c1 328625297 KQTZSJRPXAQVRE-JTQLQIEISA-N 377.363 2.582 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(Cc1cnn(-c3cccc(F)c3)c1)C2 72409634 JMUAYPLLDJRGTI-UHFFFAOYSA-N 383.427 2.631 0 50 GFAA O=C(O)C1(n2ccc(-c3ccco3)n2)CCN(c2ncnc3c2CCC3)CC1 72409204 STQLZQATRLQYFB-UHFFFAOYSA-N 379.420 2.502 0 50 GFAA O[C@@H]1CNCC[C@H]1CNc1ccc(-c2nc(CCCc3ccccc3)no2)cn1 72140363 WMBVLDURVBICCY-PKOBYXMFSA-N 393.491 2.689 0 50 GFAA CCC[C@H](C)c1cc(NS(=O)(=O)c2ccc(C(=O)OC)cc2OC)n[nH]1 442829687 PUJBSVWUCCBROK-NSHDSACASA-N 381.454 2.909 0 50 GFAA COc1ccc(C(=O)NCc2cc3c(nc2OC)CN(C2CCCC2)C3=O)o1 71388531 NYYMHMYWGHDHMU-UHFFFAOYSA-N 385.420 2.520 0 50 GFAA CC1(C)CCc2sc(NC(=O)N3CC(=O)NC(=O)C34CCCCC4)nc21 333532373 MKEOUSIUMITMFA-UHFFFAOYSA-N 376.482 2.560 0 50 GFAA COc1ccc(CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1F 237256525 JFSNJABTKZRLHW-IBGZPJMESA-N 385.483 2.821 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)C[C@H]1C(=O)NCCN1CC(C)(C)C 72172979 RFWCRGKSSDPSNG-SFHVURJKSA-N 388.487 2.502 0 50 GFAA CCCN1CC2(CCN(C(=O)c3ccc(O)c(Cl)c3)CC2)C[C@H]1C(=O)O 72431675 SVAAUWGFQGMUSN-HNNXBMFYSA-N 380.872 2.837 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@@H](C)CN(C)c4ccccc43)ccc21 173506785 GDVMQPXDWJHAIE-HNNXBMFYSA-N 399.516 2.877 0 50 GFAA Cc1cnn(C2(C(=O)O)CCN(Cc3cn(C)nc3-c3ccccc3)CC2)c1 77506171 MRADPTAHPLUODC-UHFFFAOYSA-N 379.464 2.668 0 50 GFAA O=C(CCC1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1)N1CCOCC1 20537173 BFXWWODXFVJXJG-JOCHJYFZSA-N 385.552 2.612 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3cc(C4CC4)n[nH]3)C2)CN1Cc1cccnc1 91724938 IFUSOBUDTYUUPB-JOCHJYFZSA-N 393.491 2.727 0 50 GFAA Cc1nc(N2CCC(NC[C@H](O)c3ccc(O)cc3)CC2)c2ccsc2n1 96132279 QNGDGVWZBXHNFF-SFHVURJKSA-N 384.505 2.997 0 50 GFAA Nc1ncc(C(=O)N2CC[C@H](Cc3cccc(CO)c3)C2)c(-c2ccccc2)n1 91950685 MVCCJXGSMOAWGH-QGZVFWFLSA-N 388.471 2.923 0 50 GFAA O=C(Nc1cccc(-c2cnc[nH]2)c1)N1C[C@H]2C[C@@H](C1)[C@@H]1CCCC(=O)N1C2 97394444 LJSHQFUYIUXBAN-ALKREAHSSA-N 379.464 2.941 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)N[C@@H](C)Cn4cncn4)cc3o2)c1 95513330 WPVZJTAABKMXAM-ZDUSSCGKSA-N 377.404 2.913 0 50 GFAA Cc1c(Cl)cccc1C(=O)N1CC[C@H](N2CCOCC2)[C@H](CCC(=O)O)C1 95387589 WJQPQNYCVLDWAR-QAPCUYQASA-N 394.899 2.676 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc3sccc3[nH]1)CC2 95527779 CLHWJRSPSFBYBH-UHFFFAOYSA-N 397.504 2.879 0 50 GFAA O=C(NCc1ccccn1)C1CCN(Cc2ccccc2-n2cccn2)CC1 244866467 VWRKWUIHONNNEN-UHFFFAOYSA-N 375.476 2.796 0 50 GFAA O=C(Nc1ccc(-n2cccn2)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 296458480 VKCWHHGXOCTOHR-JKSUJKDBSA-N 375.432 2.685 0 50 GFAA O=C(O)c1sccc1S(=O)(=O)N[C@@H]1CCCN(Cc2ccccc2F)C1 828574608 JTSMWQMFMTYJQN-CYBMUJFWSA-N 398.481 2.528 0 50 GFAA CCCNC(=O)c1ccc(C)c(NC(=O)[C@@H]2CC(=O)N(Cc3ccncc3)C2)c1 952976248 HYZNCIFTMYJQNI-GOSISDBHSA-N 394.475 2.517 0 50 GFAA O=C(NCCC(=O)N(Cc1ccccn1)C[C@@H]1CCCO1)c1ccc(F)cc1 952984995 DLTWPVCSMXUOGA-IBGZPJMESA-N 385.439 2.548 0 50 GFAA c1coc(CN2CCC(N[C@H]3CCOC[C@@H]3OCc3cscn3)CC2)c1 1565527653 ODZOZKCJQIOPJD-OALUTQOASA-N 377.510 2.664 0 50 GFAA O=C(NCc1ccc(CN2CCOCC2)o1)[C@@H]1C[C@@H]1c1cccc(F)c1F 170595053 HBLGASAMKCYBIC-IAGOWNOFSA-N 376.403 2.810 0 50 GFAA O=C(Nc1ccc(-n2ncc3c(O)ncnc32)cc1)C(F)(F)C1CCOCC1 790290971 RRBZNUSOYAZRFN-UHFFFAOYSA-N 389.362 2.522 0 50 GFAA CC(C)c1cc(C(F)(F)F)nc(N2CCN(CC[C@H]3COCCO3)CC2)n1 1775978649 GTFQOFLBOJCUEQ-AWEZNQCLSA-N 388.434 2.546 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)CCc2cn[nH]c2)C1 12207153 WKFFMYRQFBEKAV-LJQANCHMSA-N 384.524 2.764 0 50 GFAA O=C(c1ccccc1)[C@H]([C@H](c1ccccc1)N1CCOCC1)N1CCOCC1 19364531 DILBRNVHMMLSJR-VXKWHMMOSA-N 380.488 2.644 0 50 GFAA Cn1ccc2cc(NC(=O)C[C@H]3NC(=O)N(CCc4ccccc4)C3=O)ccc21 206248271 KLCRIFMNNSASSD-GOSISDBHSA-N 390.443 2.670 0 50 GFAA Cc1c(CN2CCC3(CC2)OCCc2cc(O[C@@H]4CCOC4)ccc23)cnn1C 1857670078 OOKVMDRQPLJCFI-OAQYLSRUSA-N 397.519 2.960 0 50 GFAA CC1(C(=O)N2CCC3(CC2)CN(Cc2ccncc2)C[C@H]3C(=O)O)CCCC1 1857699307 LYSTVBWBGNCDND-SFHVURJKSA-N 385.508 2.787 0 50 GFAA Cc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3cncc(F)c3)[C@H]3CC[C@]2(C1)O3 1857724303 UCRKXVWOFBDMLK-ZZLPTCMGSA-N 395.478 2.939 0 50 GFAA O=C(c1ccc2c(c1)CCO2)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857740154 AYCHWSCVPDFJDY-NOXFTYBFSA-N 390.439 2.536 0 50 GFAA CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N1CCC(c2ccnn2C)CC1 124661069 GWYDXLCJVNPIPR-IBGZPJMESA-N 386.471 2.720 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCO[C@H](CC(=O)O)C1 237669472 ZKKOKBRYVANBAC-OAHLLOKOSA-N 391.855 2.517 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N2CCNC[C@H]2c2cccc(Cl)c2)[nH]n1 261774536 FWJBNQVQUWVEKS-SFHVURJKSA-N 398.898 2.867 0 50 GFAA O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc(-n2cccc2)cc(C(F)(F)F)c1 1875274056 DAOINFNKSBUKDB-GFCCVEGCSA-N 386.395 2.661 0 50 GFAA CC(C)(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@H]1NCc2n[nH]cc21 1875392739 RHJGOLKNKZFKQN-AHRSYUTCSA-N 381.524 2.607 0 50 GFAA CN1C[C@@H](c2ccnc(N(C)C)n2)C2(C1)CN(C(=O)C1CC3(CCCCC3)C1)C2 1875395598 GGVMHHWKPORBHY-SFHVURJKSA-N 397.567 2.761 0 50 GFAA CN(C)C(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)c1cccc(C(F)F)c1)C2 1875394387 HKMQBBPFDISVAU-MJBXVCDLSA-N 375.375 2.942 0 50 GFAA CC(=O)N[C@@H](CC(=O)Nc1ncc([C@@H]2CCCCN2)cn1)c1ccc(C)cc1 1875325882 WOWQSOKRPRQSIM-OALUTQOASA-N 381.480 2.806 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1NCc1ccc(OCc2ccncc2)cc1 1875400402 YOTBYTUZIGYCDE-CEMLEFRQSA-N 378.476 2.786 0 50 GFAA CCn1cccc1C(=O)N[C@H]1CCCCCN(C(=O)C[C@H]2CCCOC2)C1 1775991558 LBNIBEUJXAVTSX-MSOLQXFVSA-N 375.513 2.826 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)c1nc(-c2ccco2)oc1N1CCNCC1 1857800259 DCEVGSSVTRSTAG-UHFFFAOYSA-N 393.852 2.830 0 50 GFAA C=CC(=O)N(C)CCC(=O)N1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 2325901781 XNYWLXZVFZUZFK-LJQANCHMSA-N 389.883 2.649 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc1n(CCc3ccccc3)c(-c3ccccc3)cn21 8642814 SFRJQJXIXVZZCN-UHFFFAOYSA-N 385.427 2.586 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)COc3ccccc3)CC2)n1 9620676 BZBDOOFVMLJBTR-UHFFFAOYSA-N 395.507 2.503 0 50 GFAA CN1CCC(N2CCN(Cc3ccc(C(F)(F)F)cc3)C[C@@H]2CCO)CC1 20211877 BTCZTEWQZFUVRI-IBGZPJMESA-N 385.474 2.668 0 50 GFAA CCCn1ncc(CN2CCN(Cc3cccc(OC)c3)[C@H](CCO)C2)c1C 22853326 HQIADAZSCQKMEW-OAQYLSRUSA-N 386.540 2.679 0 50 GFAA CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CN1CCN(C)CC1 20449308 YHRSRXCTYZWAML-UHFFFAOYSA-N 387.505 2.778 0 50 GFAA Cc1cccc(CN2CCC[C@](O)(CN(C)Cc3ccc4nonc4c3)C2=O)c1 67649499 YURKHZZIMZJYNO-QFIPXVFZSA-N 394.475 2.517 0 50 GFAA C[C@@H]1C[C@@H]1c1ccc(/C=C/C(=O)N2CCN(CC(=O)N3CCCC[C@H]3C)CC2)o1 252452923 OPNBHGFMVUMHFF-ZYMBUUQJSA-N 399.535 2.961 0 50 GFAA CCc1cn[nH]c1C1CCN(C(=O)C2(S(=O)(=O)c3ccccc3)CC2)CC1 67834447 HWVBOGXCETYOAO-UHFFFAOYSA-N 387.505 2.685 0 50 GFAA CCOC(=O)Cc1nnc(NC(=O)[C@H](CC)Sc2nc(C)cc(C)n2)s1 2601422 ITPCQOIMWDURQN-NSHDSACASA-N 395.510 2.560 0 50 GFAA CCCN1CCN(C[C@@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)CC1 67694649 OVERTRPUXAPUEI-QHCPKHFHSA-N 387.568 2.691 0 50 GFAA Cc1nc(N2CCOCC2)ncc1-c1cc(=O)[nH]c(Nc2ccccc2Cl)n1 36235516 VYGKQEASXPOOIX-UHFFFAOYSA-N 398.854 2.769 0 50 GFAA Cc1c(NCC(=O)N2CCCc3ccccc32)cccc1C(=O)N1CCOCC1 121175792 LJDSQMZIQOWJPO-UHFFFAOYSA-N 393.487 2.859 0 50 GFAA Cc1ccc(OC2(C(=O)NCCc3nc4ccccc4[nH]3)CCNCC2)cc1 77564574 NBZBFUHHORREBV-UHFFFAOYSA-N 378.476 2.731 0 50 GFAA O=C(O)CCN(C(=O)/C=C/c1cc(Cl)c2c(c1)OCO2)C1CCOCC1 328595402 UFTUTUGZRVKCSJ-OWOJBTEDSA-N 381.812 2.564 0 50 GFAA Cc1ccc(NC(=O)NC[C@H]2CCCN(c3ccc4nc(C)nn4n3)C2)cc1 333394330 DBXTWMVNUIUZEJ-MRXNPFEDSA-N 379.468 2.779 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@@H](C)[C@H](C)N)ccc2C)cc1 262549597 XHOCKAHBWNRAMZ-KBPBESRZSA-N 391.493 2.726 0 50 GFAA Cc1ccsc1C(=O)NS(=O)(=O)c1cnc(Cl)c(Br)c1 241815953 SEKCMFSSJNSABG-UHFFFAOYSA-N 395.687 2.986 0 50 GFAA O=C(O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H]1OCCc2ccccc21 238209600 SRZVEVGRLPUBAK-RTBURBONSA-N 382.391 2.733 0 50 GFAA O=C(NCc1noc2c1CCCC2)N[C@H]1CCCN(c2ccccc2F)C1=O 287537198 CEPBOPMJFWOVRT-HNNXBMFYSA-N 386.427 2.687 0 50 GFAA O=C(CCN1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N2)Nc1cccnc1 426380686 RUORNTBOJUREAE-LJQANCHMSA-N 378.476 2.549 0 50 GFAA CCc1[nH]nc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)c1C 95368890 PJSPKHPIPQRJIM-QFBILLFUSA-N 378.520 2.984 0 50 GFAA Cc1nc(CCNC(=O)Nc2cccc(-n3cnnc3)c2)nc2c1CCCC2 97696144 KWYBECFXXSAWKL-UHFFFAOYSA-N 377.452 2.609 0 50 GFAA COc1cccc(C(=O)N2CCN([C@@H](C(=O)O)c3cc(C)cc(C)c3)CC2)c1 95383328 SACDSYJXALKLRY-HXUWFJFHSA-N 382.460 2.896 0 50 GFAA C[C@@H](C(=O)NC1CC1)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95520613 IJOXVNNSKIZEGS-HNNXBMFYSA-N 389.927 2.822 0 50 GFAA Cc1ncc(C(=O)N2CCN(c3nc(C(C)C)cc(C(F)(F)F)n3)CC2)cn1 92037461 WJOHRGPQFGNWDH-UHFFFAOYSA-N 394.401 2.680 0 50 GFAA CNc1nc(C)cc(N[C@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)n1 92038575 QOANZSYSETYFBH-INIZCTEOSA-N 397.527 2.703 0 50 GFAA CCn1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)n1 95386501 YIJMFVXCGUMCIW-UHFFFAOYSA-N 394.519 2.991 0 50 GFAA Cc1cccc(-c2n[nH]cc2C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)N(C)C)C3)c1 95367622 RXPWTAOWACUWRX-DOTOQJQBSA-N 381.480 2.603 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263619276 XWBUKVQNBSEVCH-UHFFFAOYSA-N 397.429 2.849 0 50 GFAA C[C@H]1CCCN1S(=O)(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 185231661 QADAIQXSDPBCPB-VIFPVBQESA-N 376.360 2.896 0 50 GFAA Cc1ccc(NC(=O)CN(C)C)cc1NC(=O)[C@H]1CC(=O)Nc2ccc(F)cc21 823676127 HBXKYCDBSDVIJO-INIZCTEOSA-N 398.438 2.699 0 50 GFAA CCCS(=O)(=O)NC1CCN(C(=O)c2c[nH]cc2-c2ccc(C)s2)CC1 188214278 URYOOSLSYJXCMU-UHFFFAOYSA-N 395.550 2.986 0 50 GFAA CCc1nc(CN2CCc3cc(OC)c(OC)cc3[C@H]2c2cccnc2)n[nH]1 1506428428 PVGOQFWICHOZOB-OAQYLSRUSA-N 379.464 2.927 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCC[C@@]2(CCc3c[nH]nc32)C1 1775984077 HDTUJUSHTCLIDJ-HXUWFJFHSA-N 387.867 2.883 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CNCCn2cccn2)cc1 12054357 AQOPSECYUKYRBY-JOCHJYFZSA-N 394.519 2.545 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C[C@@H]3CCOC3)CC2)c1 12074384 WZTYSKMVZGRDHM-KRWDZBQOSA-N 388.508 2.811 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(COc3ccccc3F)[nH]n2)C1 12301131 YKBUOMHTJZXJFS-CYBMUJFWSA-N 375.400 2.543 0 50 GFAA Cc1ccc(OCCN(C)C(=O)[C@@H]2CCC(=O)N(Cc3ccccn3)C2)cc1 12447856 RPRMJGWQJFRMAQ-GOSISDBHSA-N 381.476 2.666 0 50 GFAA CCOC(=O)c1cnn(-c2nc(-c3ccccc3)cs2)c1CNCCOC 12450964 XLPVVKZFXIEHDW-UHFFFAOYSA-N 386.477 2.909 0 50 GFAA CCCNC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cn2)ccc1OC 16625528 JSXUPBCNGMFGPS-UHFFFAOYSA-N 383.857 2.684 0 50 GFAA CN1CCc2nc3sc(C(=O)NCc4ccc5c(c4)OCO5)c(N)c3cc2C1 19683216 OZJOWTOZIZQGGE-UHFFFAOYSA-N 396.472 2.525 0 50 GFAA Cc1c(CC(=S)N2CCOCC2)nnn1-c1ccc(Br)cc1 19814047 CZZRUOMYGBKHFL-UHFFFAOYSA-N 381.299 2.540 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)Cc3cc(Br)cn3C)n[nH]c21 1857531443 VLPVADHEIWDGHQ-ZJUUUORDSA-N 381.274 2.805 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2)c1ccncc1 1857681242 FFNDGHGPZGBUOT-KXTWHKPSSA-N 391.471 2.687 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)c(C)n1 1857712238 GPSOHYLOZVDFIO-SFTDATJTSA-N 397.523 2.500 0 50 GFAA Cc1ccncc1C(=O)NC[C@H]1[C@H]2CN(Cc3cccs3)C[C@]23CC[C@H]1O3 1857724920 SDBRIAZIHFKLFL-QEUVDIPISA-N 383.517 2.861 0 50 GFAA O=C(c1cnc(O)c(Cl)c1)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1857734376 QSICWBSBHSRAPC-KDOFPFPSSA-N 383.835 2.664 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3ccc(OC(F)(F)F)cc3)C[C@H]2CO1 1857739708 PGPPEOQCYONZHF-ZOBUZTSGSA-N 397.397 2.845 0 50 GFAA CCCCN1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NCCn2ccnn2)C1 1875243148 SLQLWKUTLDUWCS-JOCHJYFZSA-N 395.555 2.559 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccnc4C)[C@H]4CC[C@]3(C2)O4)o1 1875249922 JZAIYKIZMHLEQJ-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA O=C(Nc1cccc(CN2CCC(CO)CC2)c1)c1cc(-n2cccn2)ccn1 121108214 OXBRYZDNGCWWOP-UHFFFAOYSA-N 391.475 2.724 0 50 GFAA CC(C)(C)C(=O)NC[C@H]1CCCN(CC(=O)Nc2nnc(C(C)(C)C)s2)C1 137384374 IBPUKZDTZJLWFL-CYBMUJFWSA-N 395.573 2.648 0 50 GFAA O=C(C[C@H]1Cc2ccccc2O1)NCCS(=O)(=O)c1ccc(Cl)cc1 1265339220 AZZABZWIRVOMOZ-OAHLLOKOSA-N 379.865 2.624 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(C(=O)[C@@H]3C[C@@]34CCNC4)CC2)n1 952894497 NNAZHTLNCAOPIW-FDDCHVKYSA-N 392.503 2.858 0 50 GFAA O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc(-n2cccc2)cc(C(F)(F)F)c1 1875274057 DAOINFNKSBUKDB-LBPRGKRZSA-N 386.395 2.661 0 50 GFAA O=C(NC[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)[C@@H]1NCCC12CC2 1875287799 ZYVWAGKGHHMXCR-UXHICEINSA-N 375.472 2.642 0 50 GFAA C[C@@H](C(=O)N1CCC[C@@H]1c1cn(C)c2ccccc12)n1cnc2c(N)ncnc21 1875312930 KMPRBNFMNNUDNV-SUMWQHHRSA-N 389.463 2.825 0 50 GFAA Cc1ccc(S(=O)(=O)NS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 1875333036 WEGCFWJMDPNTDD-UHFFFAOYSA-N 380.274 2.969 0 50 GFAA CC(C)C[C@@H](CNC(=O)C[C@H]1CCOC1)NC(=O)Cc1ccc2cnccc2c1 1875331575 ODEJZAUKTBMBBE-NQIIRXRSSA-N 397.519 2.851 0 50 GFAA Cc1oc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc1COc1ccccc1 1875402888 NHFYWTZQIQHISY-PWIZWCRZSA-N 395.459 2.933 0 50 GFAA Cc1nc2c(C(=O)N3CCC(c4nnc5n4CCCCC5)CC3)ccnc2n1C 2100543571 VKKGMNPJRZFPQM-UHFFFAOYSA-N 393.495 2.614 0 50 GFAA Clc1ccc(Cn2ncc3c(NCCCN4CCOCC4)ncnc32)cc1 20591577 HXQWFZLDHSYMBC-UHFFFAOYSA-N 386.887 2.662 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCC[C@](O)(c3ccc(Cl)cc3)C2)C1 2325889260 HVZRFVWXNUGMCN-FOIQADDNSA-N 376.884 2.575 0 50 GFAA O=C(O)Cc1occc1C(=O)N1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 911611518 GJSGWVRJLHSVPL-OCCSQVGLSA-N 383.322 2.874 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1ccccc1F 815549 NIRSXDJGQRURCT-CQSZACIVSA-N 378.425 2.535 0 50 GFAA Cn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nnc1-c1cccs1 1114782 QNINYIDPBUVIKH-UHFFFAOYSA-N 388.474 2.681 0 50 GFAA CSCC[C@@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1[C@H]2CCC(C)C 2356154465 WYIOEKZHAYWKKG-NTDBWNAOSA-N 391.581 2.852 0 50 GFAA CCCn1nc(N(Cc2cnc(C(F)(F)F)nc2C)S(C)(=O)=O)cc1C 2356155665 MCHMQWNJIYHRSA-UHFFFAOYSA-N 391.419 2.685 0 50 GFAA CCCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(Cl)cc1 4535713 UUBDERZQXXJNPI-UHFFFAOYSA-N 378.885 2.638 0 50 GFAA O=C(c1c(F)cccc1Cl)N1CCN(S(=O)(=O)c2cccs2)CC1 6935060 WOQUFURMFLBTCW-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA COC(=O)[C@@H]1CSCN1S(=O)(=O)c1ccc(SC(F)(F)F)cc1 225546988 FQHSXOQWCWMMGK-JTQLQIEISA-N 387.426 2.535 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CCN(c3ncncc3Cl)CC2)cc1 225533791 BBCSPXNFZHYBKB-UHFFFAOYSA-N 394.928 2.938 0 50 GFAA CCCCNC(=O)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1cccnc1 225726829 ZGRDMMNWVQSGHS-KRWDZBQOSA-N 376.501 2.592 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 71762526 QGAIRDQUNBKJLX-LJQANCHMSA-N 390.443 2.574 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(-c4ncon4)cc3)CC2)cc1F 171701849 OGKJHNXGIPXOQV-UHFFFAOYSA-N 394.406 2.782 0 50 GFAA CC(C)C[C@@H]1CN(c2ccc(C(=O)NCc3noc(C(C)C)n3)cn2)CCO1 67785205 QJXUQIDVHVBPCJ-MRXNPFEDSA-N 387.484 2.769 0 50 GFAA CC(C)c1nnc(S)n1CCNC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1 120228776 BQZQUVDNRXFELC-LBPRGKRZSA-N 389.308 2.847 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3c(F)cccc3F)CC2)C1 67434163 COQOYXKUBGUZGC-OAHLLOKOSA-N 377.479 2.920 0 50 GFAA O=C(N[C@H]1CCCN(C2CCCCCC2)C1)c1ccc(Cn2cnnn2)cc1 11813459 CXCWYZXUFVETCS-IBGZPJMESA-N 382.512 2.638 0 50 GFAA COc1ccc(-n2nnc(C(=O)N3CCN(C4CCC(C)CC4)CC3)c2C)cc1 172156978 BXSMGPLQJFROJZ-UHFFFAOYSA-N 397.523 2.921 0 50 GFAA Cc1ccc2c(c1)c1c3n2CCN(C[C@H](O)CNCCCN(C)C)[C@@H]3CCC1 4811610 MADDWMBZCFZGJC-XMSQKQJNSA-N 384.568 2.545 0 50 GFAA Cc1ccccc1-c1noc(CNC(=O)c2ccc(N3CCOCC3)cc2)n1 72436805 YRTBKYQGTSAUSQ-UHFFFAOYSA-N 378.432 2.812 0 50 GFAA CC(C)c1noc([C@@]2(O)CCN(S(=O)(=O)/C=C/c3ccccc3Cl)C2)n1 328610295 HGBJNUQERBELTC-PYUISTEWSA-N 397.884 2.740 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@H]1CC[C@H](CO)CC1 154745636 WUHFOAQLONPQBR-VDISTLRHSA-N 380.901 2.555 0 50 GFAA COc1ccc(C[C@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)CCO2)cc1 71551719 CQIPXENBLSMJSN-SFHVURJKSA-N 379.460 2.974 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@H](C(=O)N2CCC(c3ccnn3C)CC2)CC1=O 124354504 HKFAMGOWBOMOIE-QFBILLFUSA-N 380.492 2.736 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@H]1CCCN(CCCC2CCCC2)C1 72426187 OTVSSJFVTOXSAI-IBGZPJMESA-N 375.561 2.797 0 50 GFAA CC(C)N(C)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72170567 ZSEUHCQEPPJXEX-NRFANRHFSA-N 379.504 2.911 0 50 GFAA Cc1c(C(=O)N2CCN(c3cnc(C(=O)O)cn3)CC2)sc2ccccc12 263414270 NKOJWLUGSFBOJU-UHFFFAOYSA-N 382.445 2.660 0 50 GFAA CCc1cc(N2CCC(Nc3ccc(S(C)(=O)=O)cc3F)CC2)ncn1 288934145 QXSQVTYKHCRMEK-UHFFFAOYSA-N 378.473 2.663 0 50 GFAA COc1ccc(C2=NO[C@H](C(=O)Nc3ccc(Br)cn3)C2)cc1 20602420 SXTFYSNJRXUBFY-AWEZNQCLSA-N 376.210 2.984 0 50 GFAA Cn1cnnc1CN1CCC(C(=O)Nc2ccc(Oc3ccccc3)nc2)CC1 95528183 CELKLFNLNOBODI-UHFFFAOYSA-N 392.463 2.853 0 50 GFAA Cc1ccc2oc(N3CCC[C@@H](c4nnc(Cn5ccnc5)n4C)C3)nc2c1 95371820 ATKYOVSQZHARPU-OAHLLOKOSA-N 377.452 2.894 0 50 GFAA COc1cc(-n2cnnn2)ccc1NC(=O)N[C@@H]1CCCc2sc(C)nc21 97475105 RKONEBCXBSWHTQ-CYBMUJFWSA-N 385.453 2.635 0 50 GFAA C[C@]1(O)CCN(C(=O)c2cc(Br)c(O)c(Br)c2)C1 179528457 RWUKVKCDKWIODR-LBPRGKRZSA-N 379.048 2.514 0 50 GFAA COc1ccc(NC(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccn2)C3=O)cc1 92045668 QZGMUPDXLLNBGO-MAUKXSAKSA-N 380.448 2.745 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2ncc(F)cc2F)CC1 95376827 GQOMCZDBKXOQNE-UHFFFAOYSA-N 377.439 2.528 0 50 GFAA COC[C@H](NC(=O)Nc1cc(C)nn1Cc1cccc(C)c1)c1ccnn1C 96132253 KNJCVMATVOEKFJ-KRWDZBQOSA-N 382.468 2.791 0 50 GFAA O=C(O)[C@H](c1ccc(-n2cccn2)cc1)N1CCN(Cc2ccsc2)CC1 95358849 YLSORUQZQXGYOS-IBGZPJMESA-N 382.489 2.877 0 50 GFAA Cc1c(NC(=O)CN2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)cnn1C 244866621 VZGBVHDFDYWRDV-PZJWPPBQSA-N 378.476 2.671 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3c4ccccc4[C@H]([C@H]2C1=O)[C@@H]1C=CC=C[C@@H]31)c1ccncc1 240517143 NVMBSBHKEBHUNI-YUEHCAIXSA-N 397.434 2.581 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2[C@H](O)C[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254487957 FLMSQRUGSHIKCT-GALANVCXSA-N 390.520 2.575 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1cccs1 299752619 UUICLOMTJDKWNN-CYBMUJFWSA-N 393.852 2.877 0 50 GFAA O=C1c2ccc(C(=O)N3CCOc4ccccc43)cc2C(=O)N1C[C@H]1CCCO1 298539047 ZANBGGKYTPOHFM-OAHLLOKOSA-N 392.411 2.501 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1cc(Cl)cn1C)CC2 299440206 ZYMLTCFHQRJSIV-AWEZNQCLSA-N 392.839 2.910 0 50 GFAA O=C(c1ccc(O)c(Cl)c1)N1C[C@H]2CN(C3CCCCC3)C[C@@]2(C(=O)O)C1 534652277 LLDSKEZCEQXPAA-JLTOFOAXSA-N 392.883 2.837 0 50 GFAA Cc1ccoc1C(=O)NCC1CCN(c2ncc(C(=O)O)cc2Cl)CC1 952976658 OABYSPQYJFSMGM-UHFFFAOYSA-N 377.828 2.981 0 50 GFAA Cc1cccc(OCCCCC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)c1 275558462 FNPYDEMYGDKUPY-SFHVURJKSA-N 397.523 2.649 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)Nc1ccn(C)n1)CC2 275520150 DASWSGGCPSDSGS-INIZCTEOSA-N 387.509 2.917 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)co1 190678982 FTHOGVFMEDCCDE-LLVKDONJSA-N 382.404 2.581 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCO2)cccc1C(=O)Nc1c2c(nn1C)CSC2 1529161791 QAJWJYJSANOKJS-MRXNPFEDSA-N 386.477 2.845 0 50 GFAA COc1cc(CN2C[C@H]3C[C@H](O)[C@H]3C2)ccc1OCc1cccc(C(=O)O)c1 1772700279 BMBYQONLSFHQBV-QYZOEREBSA-N 383.444 2.785 0 50 GFAA Cc1noc(C)c1C(=O)N1CCCN(Cc2nnc(-c3ccccc3)o2)CC1 1772700963 HGWAUUQGDWTBMR-UHFFFAOYSA-N 381.436 2.690 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(F)cc3)n2)cc1OC 5388659 QOSITMIFRYSIPR-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA CC[C@@H](O)C1CCN(Cc2nc(-c3ccc(OC)c(OC)c3OC)no2)CC1 11934826 BVAPORCNPDHGCY-OAHLLOKOSA-N 391.468 2.745 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)[C@@H]1CCCN(C2CCN(C(C)C)CC2)C1 12718210 NAPXSLPESJVIDQ-LJQANCHMSA-N 389.588 2.612 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCCN(C)CC3)nc2)cc1 12747018 HQFQYSXDBFXZAH-UHFFFAOYSA-N 382.508 2.595 0 50 GFAA COc1c(C)c2c(c(O)c1CC=C(C)CCC(=O)N1CCOCC1)C(=O)OC2 1857532080 XRBCEKJGFJYNJE-UHFFFAOYSA-N 389.448 2.507 0 50 GFAA CCOCCC(=O)N1CCC[C@@]2(CN(Cc3ccccc3Cl)CC[C@H]2O)C1 1857684498 QCAWZZMGDNURDM-TZIWHRDSSA-N 394.943 2.942 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc3[nH]ccc3c1)CC2 1857694634 GRNCNNJERBTDGR-SFHVURJKSA-N 393.491 2.690 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC[C@H]1O 1857721558 VQEPOALQJICOHA-VWNXMTODSA-N 397.515 2.895 0 50 GFAA CCC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@](CO)(c3ccccc3)C2)c1 225769047 XGFUFELVNCNYDK-QFIPXVFZSA-N 382.460 2.907 0 50 GFAA CCCOc1ccc(CNC(=O)c2cc(S(=O)(=O)NC)ccc2C)c(C)c1 252478531 AOZNHGSAJHKNQC-UHFFFAOYSA-N 390.505 2.930 0 50 GFAA CN1C[C@@H](C(=O)N[C@@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)CCC1=O 818725638 OZCXIJDWEJPGFY-KXBFYZLASA-N 392.459 2.537 0 50 GFAA O=C(Nc1ccc2nc(Cc3ccc(F)cc3)[nH]c2c1)[C@H]1CCS(=O)(=O)C1 864097004 HLZUMKADEBGMQQ-ZDUSSCGKSA-N 387.436 2.666 0 50 GFAA COC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ccccc2F)C[C@H]1C 1875262039 CGGJLQTWPBGFRT-APWZRJJASA-N 399.466 2.830 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)N2CCc3c(cc(F)cc3C(=O)OC)C2)c1 1875371621 HFSXGKCILBJVSS-UHFFFAOYSA-N 398.390 2.641 0 50 GFAA COc1ccc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1OC 792240 XXBOUUDAEGAJES-OAHLLOKOSA-N 386.423 2.555 0 50 GFAA O=C(CCCNC(=O)c1cccs1)NCC(=O)N[C@H]1CCCc2ccccc21 2325783493 AJEXIQRCDSBFQE-KRWDZBQOSA-N 399.516 2.568 0 50 GFAA N=C1Nc2nc3cc4c(cc3n2[C@@H](c2ccc3c[nH]nc3c2)N1)OCCCO4 877843358 QABRVODNYZYJOO-KRWDZBQOSA-N 375.392 2.571 0 50 GFAA Cc1ncccc1C(=O)N[C@@H]1CC2(CN(C(=O)C(C)(C)C(C)C)C2)n2ccnc21 2332237971 SIEOHJLYEGTFAY-QGZVFWFLSA-N 395.507 2.681 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)N3CCN(c4ccccc4F)CC3)CC2=O)cc1 692033 QYXCKAZJEMRCFD-QGZVFWFLSA-N 381.451 2.836 0 50 GFAA CCc1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(OC)ccc2OC)cc1 1063587 ZCLUODHQKNNDOB-UHFFFAOYSA-N 392.477 2.525 0 50 GFAA CS(=O)(=O)c1ccc2nc(NS(=O)(=O)Cc3ccccc3)sc2c1 1182700 KRNVHUZWKGTHLP-UHFFFAOYSA-N 382.488 2.642 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)NCc2ccccc2Cl)cc1C 2860540 IBHHJEFACGLHJD-UHFFFAOYSA-N 396.896 2.594 0 50 GFAA O=C(CCN1C(=O)c2ccc(Br)cc2C1=O)NC1CCCCC1 6700790 RHWJLGRICVVAAT-UHFFFAOYSA-N 379.254 2.884 0 50 GFAA COc1ccc(NC(=O)c2nnc(CN(CCO)[C@@H]3CC[C@H](C)C3)s2)cc1 225668354 DSHSBABRMKTSKS-DZGCQCFKSA-N 390.509 2.782 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Oc1cccc2cccnc12 104294997 JNZQRBWGCFZPOE-PSJNWGMYSA-N 388.423 2.583 0 50 GFAA Cc1occc1C(=O)Nc1ccc(C(=O)N2CCC[C@H](CCC(N)=O)C2)cc1 55370417 URBMPVOOOMGDDN-OAHLLOKOSA-N 383.448 2.958 0 50 GFAA CCCC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)N(CC(C)C)C2)cc1OC 55576398 IGDHJGRFAXOUPZ-AWEZNQCLSA-N 375.469 2.877 0 50 GFAA Cc1ccc(N2CCC3(CC2)c2ccccc2[C@@H](n2ccnc2C)[C@@H]3O)nn1 23310964 IGOQMOOJABTMKE-RTWAWAEBSA-N 375.476 2.792 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3ncc[nH]3)n[nH]2)c(Cl)c1 67691995 MXBLZKLBQLLMFC-UHFFFAOYSA-N 375.816 2.646 0 50 GFAA O=S1(=O)CC[C@@H](n2cnc(-c3ccccc3)c2-c2cnn3cccnc23)C1 65434553 IUYAGEXFVDJRGM-OAHLLOKOSA-N 379.445 2.619 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c1 118799424 BGDQTSWHFRAXBF-HNNXBMFYSA-N 384.411 2.991 0 50 GFAA COCc1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1 252508872 XWJDUJWKRLXGBB-HNNXBMFYSA-N 380.491 2.686 0 50 GFAA COc1ccc(CCNC(=O)c2nc(-c3cccnc3Cl)no2)cc1OC 12371318 JQFXEBPXZODLBT-UHFFFAOYSA-N 388.811 2.775 0 50 GFAA O=C(Nc1ccc(O)cc1)C1CCC(Cn2c(=O)[nH]c3ccccc3c2=O)CC1 36366072 UJLTYLJWUKHAMT-UHFFFAOYSA-N 393.443 2.841 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCC(NC(=O)C3CC3)CC2)ncn1 435344187 SYNWMJRSRCKZRZ-YLJYHZDGSA-N 387.528 2.587 0 50 GFAA O=C(c1ccnc(-n2cnnc2)c1)N1CCO[C@H](CCCc2ccccc2)C1 71748859 WSKINRLAZQXRNF-LJQANCHMSA-N 377.448 2.526 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)[C@@H]3C[C@@H]3c3cccnc3)cc(Cl)c2O1 127367726 ZGEQMSSRRRYPOO-VCTAVGKDSA-N 392.864 2.667 0 50 GFAA CC(C)[C@H]1CN(CCC(=O)NC2CC2)CCC(=O)N1Cc1ccc(F)cc1 71750685 IGVAXQZXTBONPZ-LJQANCHMSA-N 375.488 2.553 0 50 GFAA COc1cc2c(cc1CNC(=O)c1sc3ncn(C)c(=O)c3c1C)CCC2 215459131 WZPGUTBCXREYCV-UHFFFAOYSA-N 383.473 2.731 0 50 GFAA COc1ccnc(N2CCN([C@H](C)c3nc(-c4ccccc4C)no3)CC2)n1 173883294 ZPHOLTODYQVEQD-OAHLLOKOSA-N 380.452 2.727 0 50 GFAA CC(=O)c1csc(C(=O)NS(=O)(=O)c2cnc(Cl)c(Cl)c2)c1 242106286 WIKIOOVQONQJLM-UHFFFAOYSA-N 379.246 2.771 0 50 GFAA C[C@H]1CCC[C@@H](C)N(C(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)C1 176614675 IRUQYTGFTPWFHL-QWHCGFSZSA-N 381.436 2.739 0 50 GFAA Cc1oc(-c2cnn(C)c2)nc1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1 176888063 PJHKUOAQLVHYSG-UHFFFAOYSA-N 393.447 2.874 0 50 GFAA CN(C)c1ccnc(C(=O)N2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)c1 195496463 AXCPGVXHYMTVRB-CYBMUJFWSA-N 387.871 2.687 0 50 GFAA NC(=O)C[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)C1 245428331 IUMXZWNRUYDOMJ-LSDHHAIUSA-N 378.904 2.606 0 50 GFAA O=C(c1ccc(-c2ncccc2C(=O)N2CCCCC2)cc1)N1CC[C@@H](O)C1 426547602 JLADYGDANICNOB-GOSISDBHSA-N 379.460 2.582 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CCC(=O)N(CCc4cccnc4)C3)CC2)n1 91587263 FTRZTCRPRFNGKD-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA Cc1ccc(NC(=O)N2CCN(Cc3ccccc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 95500772 BYNDCRMNCGOGCI-UXHICEINSA-N 399.516 2.510 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)N(CC1CC1)C3=O)OCCCO2 95362418 BUIUBMBSXSQIQM-FUHWJXTLSA-N 386.492 2.689 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(S(=O)(=O)N3CCCC3)CC2)C1 92038694 WXKUKAXTNFBUCV-LJQANCHMSA-N 377.554 2.529 0 50 GFAA Cc1nn(C)c(Cl)c1S(=O)(=O)N1CCC[C@H](c2cccc(C(=O)O)c2)C1 95377026 RYUYMSDVCGCEHL-AWEZNQCLSA-N 397.884 2.648 0 50 GFAA CCc1nnsc1C(=O)N1CC[C@@]2(CCCN(C3CCCCC3)C2=O)C1 91416906 FVKYDIKPBQHYQB-IBGZPJMESA-N 376.526 2.888 0 50 GFAA CCc1cc(N2CCN(Cc3cc(=O)c4cccc(Cl)c4[nH]3)CC2)ncn1 91645289 RQSHTSHDRXNABU-UHFFFAOYSA-N 383.883 2.856 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)Nc3ccccc3)C2)CN1CCc1c[nH]cn1 91270175 PMBLCZSFCMARMA-NRFANRHFSA-N 381.480 2.889 0 50 GFAA COc1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)ccc1F 95503225 ILUXAAPBFVXWNT-UHFFFAOYSA-N 398.482 2.843 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)ccn1 95500183 UKQQUQWHQIRRMG-QGZVFWFLSA-N 377.448 2.750 0 50 GFAA Cc1cnn(CCC(=O)N2CCC(c3nccn3Cc3cscn3)CC2)c1 95522679 GDBPPHHTKADMJU-UHFFFAOYSA-N 384.509 2.689 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(Cc1c[nH]nc1-c1ccc(F)cc1)C2 95367218 ZULSVBCLEDPBES-UHFFFAOYSA-N 383.427 2.835 0 50 GFAA Cc1noc(C)c1CN1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 252013382 UHCOTWPPYFVWFL-IYARVYRRSA-N 375.513 2.800 0 50 GFAA Cc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@H](CC(=O)O)C2)cc1C 299751817 RWZZPWWCRCTFLY-QGZVFWFLSA-N 381.428 2.850 0 50 GFAA Cc1cc(C)c(C(=O)Nc2cccc(N3CCCCS3(=O)=O)c2)c(O)n1 252498951 RRSPKLDCLJLPNP-UHFFFAOYSA-N 375.450 2.586 0 50 GFAA O=C(NC1(CN2CCCCC2)CC1)N1CCN([C@H]2CCc3ccccc3C2)CC1 534647210 OSVBQWKGPBEDQJ-QFIPXVFZSA-N 396.579 2.890 0 50 GFAA CS(=O)(=O)N1CCCC[C@H]1CCNC(=O)Nc1ccc2ncsc2c1 299759888 OLVNNMMTXSAAPY-ZDUSSCGKSA-N 382.511 2.622 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3Cn3cccn3)C2)no1 825307341 VBMAKMZUOAOQCH-GOSISDBHSA-N 393.491 2.870 0 50 GFAA O=C(N[C@H]1CCCN(Cc2cccc(O)c2)C1)c1ccc(SCCO)cc1 670456651 ZZSPBWCITXGWHJ-SFHVURJKSA-N 386.517 2.871 0 50 GFAA COCc1nc(OC)c2c(C)c(C(=O)N3CCOC4(CCCC4)C3)sc2n1 268991904 HBJPGIHQPGBNME-UHFFFAOYSA-N 391.493 2.940 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(N2CCNC2=O)ccc1Cl 268944374 LYHLCOAGOHEJGD-QGZVFWFLSA-N 399.834 2.521 0 50 GFAA C[C@H]1C[C@H](O)CN1C(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 788345635 UDNNZEZCXQTVOS-HOCLYGCPSA-N 377.460 2.516 0 50 GFAA CO[C@H]1CN(C(=O)CCc2nc3ccc(F)cc3[nH]2)C[C@H]1Cc1cc(C)no1 1529142061 DEFZUIUGHCJJLQ-ACJLOTCBSA-N 386.427 2.647 0 50 GFAA CCN1CC[C@H](NC(=O)c2c(NCCOC)noc2-c2ccc(Cl)cc2)C1 1704313927 SMZJYNSLGKKXPX-HNNXBMFYSA-N 392.887 2.877 0 50 GFAA Cc1nc(N2CCCN(C(=O)c3ccccc3-n3cncn3)CC2)sc1C 1772813771 SNVDYNQZCSKUIA-UHFFFAOYSA-N 382.493 2.693 0 50 GFAA O=C(O)CC[C@@]12CN(Cc3cccnc3)C[C@H]1CN(C1Cc3ccccc3C1)C2 1772711920 LPDJGMJCHVBEKG-URXFXBBRSA-N 391.515 2.848 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)Nc3ccc(N4CCOCC4)cc3)CC2=O)cc1 5659185 VYMRBPUVDOEGQC-KRWDZBQOSA-N 379.460 2.823 0 50 GFAA CC[C@@H](C)C(=O)NCc1nnc2n1CCN(Cc1cc(C)c(OC)cc1C)CC2 12041775 SBUBNZVVEQCRHW-OAHLLOKOSA-N 399.539 2.624 0 50 GFAA Cc1oc(-c2ccc(F)cc2)nc1CN1CCC[C@H](C(=O)N2CCOCC2)C1 12075329 MJSWGIUSMCULJR-KRWDZBQOSA-N 387.455 2.860 0 50 GFAA Cc1cc(CNC(=O)c2sc3ncnc(NC[C@H]4CCCO4)c3c2C)on1 12150134 MHZMFUVSPODWDO-GFCCVEGCSA-N 387.465 2.817 0 50 GFAA COc1ccc(OCc2cc(C(=O)NCC3CCOCC3)n[nH]2)c(Cl)c1 12307362 AUXYYUWFQKCDCU-UHFFFAOYSA-N 379.844 2.807 0 50 GFAA O=C1N(Cc2cccnc2)CCC[C@]12CCN(C1CSCCSC1)C2 12308378 QQZBEEJJUXFTBE-LJQANCHMSA-N 377.579 2.745 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N1CCC(C(=O)N2CCCC2)CC1 12382893 AOINSGIGXSOGRN-UHFFFAOYSA-N 394.537 2.842 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N4CCCN(C=O)CC4)cc3o2)cc1 12430962 MRCVDFQWMUKSSM-UHFFFAOYSA-N 393.443 2.732 0 50 GFAA CCN1CCC(N2CC(=O)N(CC(C)C)C[C@H](OCc3ccccc3)C2)CC1 14534571 CJNJLVIILFQIKA-JOCHJYFZSA-N 387.568 2.856 0 50 GFAA O=C(CCc1ccccc1)Nc1ccnn1C1CCN(C(=O)[C@H]2CCCO2)CC1 14956725 IHVMBQGYGXYARC-LJQANCHMSA-N 396.491 2.797 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)CCc3ccccc3)C[C@]23CC[C@H]1O3)C1CCC1 1857718558 KIPFXHABHBAIGD-DZCCDHAISA-N 382.504 2.542 0 50 GFAA Cc1nc(CN2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)cs1 1857733656 STGIKIAXJBHKPA-JRBPQWBISA-N 377.554 2.983 0 50 GFAA N=c1nc(O)c2c([nH]1)C1(CC2)CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 1857737803 DHKQUPWTKWQYNC-UHFFFAOYSA-N 392.381 2.734 0 50 GFAA Cc1c(Cl)c(C(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)nn1C 421500100 CPZHJCWJTHFPPF-CQSZACIVSA-N 396.825 2.581 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)n[nH]1 330460121 JVXAYUXQXNAMKS-UHFFFAOYSA-N 378.835 2.924 0 50 GFAA CC1=C(CCN2CCC[C@@H](n3cc(C(=O)NCCO)nn3)C2)C(C)(C)CCC1 14977287 FZYVMXDWJODIHH-QGZVFWFLSA-N 389.544 2.554 0 50 GFAA O=C(C1CCN(c2cc(-c3ccccc3)nc3ncnn23)CC1)N1CCCC1 247855328 KHSURUPMIIVSET-UHFFFAOYSA-N 376.464 2.630 0 50 GFAA CC(C)c1ncc(S(=O)(=O)N2Cc3ccccc3OC3(CCOCC3)C2)[nH]1 921325301 FYWWMQSNJLJJOM-UHFFFAOYSA-N 391.493 2.666 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1CCc2c(cccc2C(=O)O)C1 856968570 NUPOXVDPMQMFKU-OAQYLSRUSA-N 392.455 2.806 0 50 GFAA CCS(=O)(=O)N[C@@H]1CCCN(C(=O)C2CCC(c3ccccc3)CC2)C1 1875260781 UYJLINDXBQCMMR-CTWPCTMYSA-N 378.538 2.891 0 50 GFAA C[C@@H]1COC[C@@](CO)(CN[C@H](c2ccccn2)c2cc3ccccc3o2)N1C 1875399000 LELCUMUSTRCRNT-HVETUWLQSA-N 381.476 2.588 0 50 GFAA O=C([C@H](Cc1ccc(F)cc1)c1ccccc1)N1CC[C@@](CCO)(C(=O)O)C1 1875313919 XYNOFRIUDSATHP-KNQAVFIVSA-N 385.435 2.838 0 50 GFAA CCc1occc1C(=O)N[C@@]12CCC[C@@H]1N(c1c(C)c(C)nc3ncnn13)CC2 1775991843 NIUKKBVLSAFFRH-LAUBAEHRSA-N 394.479 2.828 0 50 GFAA CC(C)n1cc2c(n1)[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)CCC2 1319949832 NIFBLBVJWHPVNN-KRWDZBQOSA-N 390.509 2.572 0 50 GFAA Cc1oc2ccccc2c1CNc1cc(N2C[C@H](O)C[C@@H]2CN(C)C)ncn1 2325785668 IDUHNAAGJADVLK-HZPDHXFCSA-N 381.480 2.645 0 50 GFAA O=C(N[C@@H](CNC(=O)[C@H]1CCCC12CC2)C1CCCC1)c1cnn2ncccc12 2325794430 BJFJBHMBBPWFBE-MSOLQXFVSA-N 395.507 2.714 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)[C@H](N)Cc1cccnc1F 2325808341 RQXQVNJGDPXWMG-GFCCVEGCSA-N 395.360 2.644 0 50 GFAA O=C(Cn1cc(NC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)cn1)NC1CCCC1 145571487 SYLOBKZYFGQTQQ-KRWDZBQOSA-N 388.855 2.538 0 50 GFAA Cc1noc([C@H]2CCCN2C(=O)c2c(OCc3ccccc3)c(=O)ccn2C)n1 2356152284 WZGAQTVJRXMGBO-MRXNPFEDSA-N 394.431 2.633 0 50 GFAA O=C(c1ccnnc1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1ccccc1 2356155259 DOZZMJWYDUIXSX-ANULTFPQSA-N 390.487 2.561 0 50 GFAA CN(C(=O)c1ccccc1OC(F)(F)C(F)F)[C@@H]1C[C@@H]2CNC(=O)C[C@@H]2C1 2356165086 SOGUNYXIXWFPCK-TUAOUCFPSA-N 388.361 2.910 0 50 GFAA COC(=O)COc1cccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c1 2846419 RUTSEMMRLHBQOF-UHFFFAOYSA-N 375.377 2.517 0 50 GFAA COC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccc(OC)cc2)CC1 4704863 AHHPDCUWINYMDS-UHFFFAOYSA-N 396.443 2.973 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCC[C@H](C(=O)NCc3ccco3)C2)c(C)c1 4837802 OLHKMCLSZSNKIH-KRWDZBQOSA-N 390.505 2.922 0 50 GFAA CCn1cc([C@H]2C[S@](=O)CCN2c2ncnc3c2oc2ccccc23)cn1 225410462 WLFHPWTUNGNLSJ-YVORESIASA-N 381.461 2.902 0 50 GFAA Cc1ccc(S[C@@H](C)C(=O)N2CCC(CN3CCN(C)CC3)CC2)cc1 57065989 SEBKZSXUMUFOAH-SFHVURJKSA-N 375.582 2.962 0 50 GFAA CCN1CCN(Cc2cc(C(=O)N(C)[C@@H]3CCCc4ccccc43)no2)CC1 67885027 UOKOQSXWCYWZAK-OAQYLSRUSA-N 382.508 2.962 0 50 GFAA C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]3CC[C@@]4(OCO[C@]45COCO5)[C@@H]3CC(=O)[C@@H]12 25631515 NJDQZPLIXBEZLQ-WFRLUTSDSA-N 390.476 2.831 0 50 GFAA CCc1nnnn1-c1ccccc1NC(=O)CCCc1nc(C(C)(C)C)no1 118741301 HRHPLGFMDNFQMQ-UHFFFAOYSA-N 383.456 2.867 0 50 GFAA O=C(c1csnn1)N1CCc2[nH]nc(COc3cccc(Cl)c3)c2C1 23543509 CQXIDBCVHMROOK-UHFFFAOYSA-N 375.841 2.692 0 50 GFAA O=C(C[C@@H]1COCCN1Cc1ccc2occc2c1)NCCc1ccccn1 72407217 IPCSCUQFOFFFFY-HXUWFJFHSA-N 379.460 2.778 0 50 GFAA CO[C@@H]1CC[C@H]2OCCN(C(=O)c3ccc4c(c3)[nH]c(=O)n4C3CCCC3)[C@@H]2C1 126208564 FSKNPEBFMBFIMO-NSISKUIASA-N 399.491 2.853 0 50 GFAA CCc1nccn1CCC(=O)N1CCC(=O)N(Cc2ccccc2)[C@H](CC)C1 71711962 SNSQFEXWXYPTHR-LJQANCHMSA-N 382.508 2.875 0 50 GFAA O=S(=O)(C[C@H]1CCCO1)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 172368283 LAKHGLQAUCWJPN-LLVKDONJSA-N 377.344 2.676 0 50 GFAA CCN(CC)CCN1C(=O)CC[C@@H]2CN(Cc3ccc(OC)cc3F)CC[C@@H]21 14883800 NQCOSWZBCWQWCL-NQIIRXRSSA-N 391.531 2.989 0 50 GFAA CN1C[C@]2(CCCN(Cc3cnc4c(-c5ccccc5)cnn4c3)C2)OC1=O 72409629 MIAACKNSBRZWQE-NRFANRHFSA-N 377.448 2.813 0 50 GFAA COc1coc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1=O 282243888 ICVZCKBWYIGJNB-LLVKDONJSA-N 383.231 2.964 0 50 GFAA C[C@H]1CN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)CCN1 72163970 GEFWOZBUHRNWLR-IBGZPJMESA-N 377.532 2.519 0 50 GFAA COc1ccc2c(c1)C1(CC1)CN(C(=O)Nc1cnn(-c3ncccn3)c1)C2 377748207 RVCWNCSMRVOKTR-UHFFFAOYSA-N 376.420 2.750 0 50 GFAA Cn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1ccc(-c2cn3cccnc3n2)cc1 375465944 RPIBZYVKBCEPQU-SJLPKXTDSA-N 388.431 2.846 0 50 GFAA O=C(OC[C@@H]1CCCCN1Cc1cc2ccccc2nc1O)N1CCOCC1 375791992 ZNSLIULDDZFWRS-SFHVURJKSA-N 385.464 2.764 0 50 GFAA CC[C@@H](O)CN1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)CC1 175334926 FVYBYAVYJNZHLA-QGZVFWFLSA-N 388.443 2.933 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)CC[C@]1(CCC(=O)O)CCC(=O)N1 220036134 CWVFJMDBKWZXKB-FQEVSTJZSA-N 389.427 2.559 0 50 GFAA COc1ccc(C(=O)[C@H](O)[C@H](c2ccc(C)cc2)N2CCOCC2)cc1OC 20390206 ZTYFVEASKFFIJK-RBBKRZOGSA-N 385.460 2.629 0 50 GFAA Nc1cnc(-c2cccc(C(=O)N3CCC([C@H](O)c4ccccn4)CC3)c2)cn1 426615016 CQLHWHDLQDISMT-NRFANRHFSA-N 389.459 2.707 0 50 GFAA CC(C)(C)CN1CCC[C@@]2(CCN(c3cc(C(=O)NC4CC4)ccn3)C2)C1=O 426685213 AZWFIAJBLFBGLC-QFIPXVFZSA-N 384.524 2.839 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)C2CCN(C(=O)c3ccc(F)cc3F)CC2)C1 290548603 HOJJOAJNBTXCNM-NRFANRHFSA-N 394.462 2.828 0 50 GFAA O=C1COc2cc(NC(=O)N3CCC[C@@H](C(=O)c4ccccn4)C3)ccc2N1 97568765 SKPLQMKYJNWBEV-CYBMUJFWSA-N 380.404 2.539 0 50 GFAA O=C1N(CC2CCC2)CCC[C@@]12CCN(Cc1nnc(-c3cccnc3)o1)C2 91859899 MONKRQRIRFZLPP-NRFANRHFSA-N 381.480 2.746 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@H](N)C4)csc3C2)nc1 426433648 LRFYGYIQABMQAZ-INIZCTEOSA-N 384.549 2.827 0 50 GFAA O=C(Nc1ccccc1F)N1CC[C@]2(CCCN(C3CCOCC3)C2=O)C1 91620736 GZHOVLIEVPBLMH-HXUWFJFHSA-N 375.444 2.851 0 50 GFAA CN1CCN(c2cccc(NC(=O)NC[C@H]3OCCc4ccccc43)c2)C1=O 95509766 NNZJAYLSGROXKK-LJQANCHMSA-N 380.448 2.994 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)NCc1nc3ccc(C)c(C)c3[nH]1)CC(=O)N2 91651493 JHIZUKHVGQZPCP-OAHLLOKOSA-N 378.432 2.931 0 50 GFAA CCCNC(=O)c1cccc(S(=O)(=O)N(CC)[C@@H]2CCOC(C)(C)C2)c1 97657211 CSBTVPQCPSHITH-MRXNPFEDSA-N 382.526 2.795 0 50 GFAA C[C@H](N)C(=O)N1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95497128 AKBVNLZZPCEIHD-SFHVURJKSA-N 385.552 2.834 0 50 GFAA CCc1ncc(CN2CCC3(CCC(=O)N(Cc4cnc(C)cn4)C3)CC2)cn1 91943124 SEBQOJGKPXGMPO-UHFFFAOYSA-N 394.523 2.542 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91757630 SWWYFZRHCXMVIH-UHFFFAOYSA-N 386.464 2.519 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)Nc2cc(N3CCOCC3)ccc2Cl)[nH]n1 97572366 FNMLAVLFDHQRLR-GFCCVEGCSA-N 377.876 2.961 0 50 GFAA CCOc1ccccc1[C@@H](CC)NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 299650370 NKMLJJBOWYGFIJ-MRXNPFEDSA-N 387.480 2.907 0 50 GFAA COc1ccc(CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)O 299753450 YGEGAJGHJTXGDK-FQEVSTJZSA-N 396.443 2.763 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1)NC1CCCCC1 55357742 RDPLCSBXMSHCRI-QGZVFWFLSA-N 381.879 2.619 0 50 GFAA COc1ccc(-c2csc3ncn(CCc4cnn[nH]4)c(=O)c23)c(OC)c1 584903121 ATWVENZTBQVUHJ-UHFFFAOYSA-N 383.433 2.503 0 50 GFAA COc1ccc(CCN(C[C@H]2CCCO2)C(=O)NC2(C(=O)O)CCCC2)cc1 670474318 LEBZGZGXDQMMSR-GOSISDBHSA-N 390.480 2.826 0 50 GFAA Cn1nc([C@H]2CCCO2)cc1NC(=O)N1CCN(CCc2ccccc2)CC1 279080806 UJIVGLFMNGVMGT-LJQANCHMSA-N 383.496 2.664 0 50 GFAA COC(=O)c1cccc(S(=O)(=O)Nc2cc(C)nn2-c2ccc(F)cc2)c1 171149012 QXAVAMYDUCGAHP-UHFFFAOYSA-N 389.408 2.907 0 50 GFAA Cc1ncc2c(n1)CCC[C@H]2NC(=O)CCCc1nc(O)c2ccccc2n1 734795493 ANXAELCWCVCQMP-GOSISDBHSA-N 377.448 2.950 0 50 GFAA Cc1c(C(=O)N2CCC(c3nc(C(C)C)no3)CC2)sc2[nH]cnc(=O)c12 1506408302 XDLOCBHBFCOAAP-UHFFFAOYSA-N 387.465 2.819 0 50 GFAA COc1ccc([C@@H](O)Cn2cc(C(=O)NCc3cccc(Cl)c3)nn2)cc1 1775973244 NQSVRXRVXMUXHU-SFHVURJKSA-N 386.839 2.604 0 50 GFAA O=C(CCN1CCCO1)N(CC1CCN(C2CCCC2)CC1)C[C@@H]1CCCO1 11874446 OKDMFHQWVDLTFN-NRFANRHFSA-N 393.572 2.676 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)c2ocnc2C)CC1 12297960 FCBRVAYQYMVUJY-UHFFFAOYSA-N 391.475 2.943 0 50 GFAA Cc1nonc1CN(C)C(=O)c1cc(COc2cccc(C(F)(F)F)c2)[nH]n1 12300471 BZRFUZQBVHHJPC-UHFFFAOYSA-N 395.341 2.971 0 50 GFAA CC1(C)C(C(=O)N[C@@H]2CCCc3nc(N4CCC(CO)CC4)ncc32)C1(C)C 12577481 AOHBFKTXACVAJT-MRXNPFEDSA-N 386.540 2.861 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N[C@H]1CCCN(C2CCN(C)CC2)C1 12588373 LFQDQSKPGLEHAK-KRWDZBQOSA-N 379.932 2.702 0 50 GFAA O=c1cc(CSc2ccccn2)nc(N2CCN(Cc3ccccc3)CC2)[nH]1 13639798 ZDBCEWQSNZFZNM-UHFFFAOYSA-N 393.516 2.779 0 50 GFAA COC(=O)COc1ccccc1/C=C1/NC(=O)N(c2cccc(Cl)c2)C1=O 14009769 WJUBZRMOYGWKJM-OQLLNIDSSA-N 386.791 2.989 0 50 GFAA CC(=O)Nc1cc(-c2ccc(=O)n(CC(=O)Nc3ccccc3F)n2)ccc1C 16626735 LIUQNQGQPNOTDT-UHFFFAOYSA-N 394.406 2.955 0 50 GFAA Cc1cc(C)c2nc(O)c(-c3nccn3CCN3CCC[C@@H](C(N)=O)C3)cc2c1 1857682325 VLLHEZOFQDOHBL-MRXNPFEDSA-N 393.491 2.618 0 50 GFAA Cc1cccc(CC(=O)NC[C@H]2[C@H]3CN(C(=O)c4ccoc4)C[C@]34CC[C@H]2O4)c1 1857717333 KUZQOSYVWLISSH-DZCCDHAISA-N 394.471 2.567 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)[C@@]12CCCCN1C[C@@H](NC1CCCC1)C2 1875244890 YYGSEXZSIUIIAN-AVRDEDQJSA-N 385.508 2.561 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3coc(-c4ccccc4)n3)C[C@H]2CO1 1875246252 COUIFRPEYRBLOK-BZSNNMDCSA-N 380.448 2.602 0 50 GFAA CC(C)(NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)NCC1CCCC1 126854027 VDWWDKSOXPFKTG-LJQANCHMSA-N 399.535 2.740 0 50 GFAA CNC(=O)c1cn(CCC(C)C)cc(C(=O)N[C@@H](C)c2cccs2)c1=O 14953654 CNAYPTGOJXZGEN-ZDUSSCGKSA-N 375.494 2.807 0 50 GFAA O=C(Cn1cc(C2CC2)nn1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 152153447 CWGXAJIQBISMOO-MRXNPFEDSA-N 380.370 2.774 0 50 GFAA CN1CCN(C(=O)c2cc(-c3ccco3)n(-c3ccc(Cl)cc3)n2)CC1=O 152725859 AJAAFUZVLKESNM-UHFFFAOYSA-N 384.823 2.700 0 50 GFAA Cc1c(CN2CCC3(CC2)OCC[C@@](C)(O)[C@@H]3O)[nH]c2ccc(Cl)cc12 1704311072 WSVZXAXUYXAGJK-RBUKOAKNSA-N 378.900 2.997 0 50 GFAA O=C1C[C@H](C(=O)N2CCC[C@H]2c2nc(C(=O)O)cs2)c2ccc(F)cc2N1 828317497 DWXXGZALOLHLIA-FZMZJTMJSA-N 389.408 2.770 0 50 GFAA Cn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)NCCCc1c[nH]nc1C(F)(F)F 1875395309 AKPICNNHENFEJI-FABXCBLPSA-N 381.402 2.579 0 50 GFAA C[C@@H]1C[C@@H](CNC(=O)c2cc3cnccc3[nH]2)CN1C(=O)c1coc(C2CC2)n1 1875309656 HGCMECNOZMIRSK-OLZOCXBDSA-N 393.447 2.709 0 50 GFAA Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2cn(C)nc2C2CC2)[C@H](C)CO1 1875393196 JAXQZXMZSHVWCV-PBHICJAKSA-N 375.494 2.757 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCC2(CC1)C[C@@H](N)c1ccccc1O2)c1ccccc1 1875301341 GGLBUSCSHDPYDH-CTNGQTDRSA-N 393.487 2.708 0 50 GFAA Cc1nc(C2CCN(C(=O)c3ncoc3-c3ccccc3)CC2)c2n1CCNC2 1875393177 INWZKDBWAWXXQX-UHFFFAOYSA-N 391.475 2.970 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](N(CCc3ccccc3)C(C)=O)C2=O)cc1 1022668 QFHHPDSLYUNOOV-FQEVSTJZSA-N 380.444 2.808 0 50 GFAA Cc1nc[nH]c1CN1C[C@H](CC(=O)N(C)[C@H](C)c2cccnc2)OCC12CCC2 2325785324 QCTWTKFKGKAHAT-MJGOQNOKSA-N 397.523 2.846 0 50 GFAA C[C@@H](OC(=O)c1cccc(N2CCCC2)c1)C(=O)N1CC(=O)Nc2ccccc21 850247209 WROUPNKMIJBZNH-OAHLLOKOSA-N 393.443 2.817 0 50 GFAA COc1ccc(CCS(=O)(=O)NCCCc2ccc3c(n2)NCCC3)cc1 2325860817 VWHPJKYCTOWMQI-UHFFFAOYSA-N 389.521 2.543 0 50 GFAA COc1ccc(N(CC(=O)N(C)C)S(=O)(=O)c2ccccc2)cc1Cl 817221 JUWXYRWEFNJXEO-UHFFFAOYSA-N 382.869 2.632 0 50 GFAA CCSCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc2c(c1)OCO2 2473574 IIHRYXVXHUVJDZ-MRXNPFEDSA-N 378.450 2.682 0 50 GFAA COc1ccc(COC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc3c(c2)OCO3)cc1 4644569 WUPFNPAVVOETND-IBGZPJMESA-N 396.399 2.795 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H]1Oc2ccccc2O[C@H]1C 4867089 CLJQWQMNTFSHPW-VOJFVSQTSA-N 387.388 2.657 0 50 GFAA O=S(=O)(Nc1nc2ncccn2n1)c1c(Cl)cccc1C(F)(F)F 225408103 UMVHISGKTLBDNH-UHFFFAOYSA-N 377.735 2.597 0 50 GFAA CCOC(=O)C1(CCOC)CCN(C(=O)[C@H](c2ccccc2C)N(C)C)CC1 55255597 JSTNZUQBKVOMBO-IBGZPJMESA-N 390.524 2.806 0 50 GFAA O=C1CC[C@H]2C(=O)N(CC(=O)N(C3CCCCC3)C3CCCCC3)C(=O)[C@H]2C1 100564888 HFEILMMQYYVLAH-MOPGFXCFSA-N 388.508 2.835 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CN3CCCCCCC3)C2=O)c1OC 67758126 FDZYOEPOVYSVJR-JOCHJYFZSA-N 390.524 2.823 0 50 GFAA O=C(CN1CCC(N2CCC[C@@H](CO)C2)CC1)Nc1ccc(Cl)cc1F 65398876 XOFWIGXXNUGWEY-CQSZACIVSA-N 383.895 2.586 0 50 GFAA Cc1cccn2c(NC(=O)N3C[C@H](CO)OC[C@H]3C)c(-c3ccccc3)nc12 119110112 UFLCKBYGIPAFPE-NVXWUHKLSA-N 380.448 2.923 0 50 GFAA Cc1nccnc1-c1ccn(CC(=O)Nc2ccnn2C[C@@H]2CC=CCC2)n1 20661436 PFNUHCVAZAPNOA-MRXNPFEDSA-N 377.452 2.840 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)cc1 65365132 IXHGZYBAIUGAOH-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA O[C@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)cn1 252488154 ILVGFILWSLNOHJ-YOEHRIQHSA-N 385.302 2.538 0 50 GFAA C[C@@H]1CCCN(CCNC(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1 252474957 PJJKHFJPTSLZAU-HZPDHXFCSA-N 380.483 2.822 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@@H](c1cccc(F)c1)CC(=O)N2 33271391 HAXAUELTKHPMEL-CQSZACIVSA-N 377.383 2.540 0 50 GFAA CCCn1c(=O)n(C)c(=O)c2c(SC3CC(OCC)C3)nc(C(C)C)nc21 253433126 SKIHARMWWYJFPZ-UHFFFAOYSA-N 392.525 2.683 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)on1 77405976 XBQGMCQRUGNWFK-QGZVFWFLSA-N 375.444 2.646 0 50 GFAA COc1ccc2cc([C@H]3CN(C(=O)c4cc(=O)c(OC)c[nH]4)CCO3)ccc2c1 71388528 QBQRHIWRLVOTHI-OAQYLSRUSA-N 394.427 2.759 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)Nc3cc(C(N)=O)ccc3C)c2C)cc1 242302173 YQBCCYXIGPHAMY-UHFFFAOYSA-N 377.448 2.857 0 50 GFAA O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@H]1C[C@@H]1C1CCCCC1 159101296 HQRSASTTYSUHMY-CVEARBPZSA-N 375.450 2.758 0 50 GFAA Cc1ccc(Nc2ccc(NCCNC(=O)c3sc(C)nc3C)nn2)nc1 72434091 LAMHFVDPCFWZHF-UHFFFAOYSA-N 383.481 2.839 0 50 GFAA N[C@@H]1CCO[C@H]1C1CCN(C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 333836470 UIXSXBYCYZDKFT-YRPNKDGESA-N 391.487 2.584 0 50 GFAA Cc1nc(CN2CCCN([C@H](C)C(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)oc1C 370807982 GHSCVWMZEYEERW-SOLBZPMBSA-N 376.545 2.692 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)CCc3cccc(F)c3)CC[C@H]21 72474170 OCOVOBKLXRFAAY-PKOBYXMFSA-N 376.472 2.634 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O 130054060 XOXPGJGUAOYWSW-AWEZNQCLSA-N 375.519 2.590 0 50 GFAA COC(=O)CC[C@H]1CN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC[C@H]1N1CCOCC1 15006792 PRHAPVBPPRASMO-XSDIEEQYSA-N 390.568 2.955 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CN2CCCC2)CCC(=O)N1Cc1ccc(F)cc1 71745420 SJLACNQTNUXIOT-IBGZPJMESA-N 375.488 2.507 0 50 GFAA Cc1ccnn1CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 72167986 TZOHNRHQPANLFA-IBGZPJMESA-N 386.471 2.616 0 50 GFAA CCc1nn2c(nnc3c(=O)n(CCCOC)ccc32)c1-c1ccc(F)cc1 40391620 BAARXRPOEQXADT-UHFFFAOYSA-N 381.411 2.844 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3nnc(C(C)C)s3)n2)cc1 44900431 WFJVJXHAYNJFKF-UHFFFAOYSA-N 385.449 2.533 0 50 GFAA O=C1CCC(C(=O)N[C@H]2CCCCN(Cc3ccc4ccccc4c3)C2)=NN1 82120446 OJBASZDPRWJJCH-IBGZPJMESA-N 378.476 2.577 0 50 GFAA O[C@@H](COc1ccc(CN2CC(N3CCCCC3)C2)cc1)CN1CCCCC1 95497109 WTSXKEPVOCXBGX-JOCHJYFZSA-N 387.568 2.582 0 50 GFAA COc1ccc(CN2CC(c3cccnc3)C2)c(OC[C@@H](O)CN2CCCC2)c1 95507732 UUUJOXVFIXUYHM-NRFANRHFSA-N 397.519 2.525 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@@H]1CCNC1)CC2 95530881 ROLYVRAPGIHVKI-QGZVFWFLSA-N 381.451 2.501 0 50 GFAA Cc1nc(C)c(CN2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)s1 230200353 PMVWZEWBUREMEZ-HXUWFJFHSA-N 376.570 2.669 0 50 GFAA CCCc1cc(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)cs1 91643273 DWECOHPGUKDSDG-QAPCUYQASA-N 394.537 2.728 0 50 GFAA CO[C@@]12CC[C@@H](NC(C)=O)C[C@@H]1N(Cc1cn(C)nc1-c1ccccc1)CC2 534585469 IKQYQQSTSDHENI-RZUBCFFCSA-N 382.508 2.735 0 50 GFAA COc1ccc(/C=c2\sc3n(c2=O)[C@H]2c4ccccc4O[C@@](C)(N=3)[C@@H]2C)cc1 390834927 SPPATLZLYNEZKJ-MODWIKPWSA-N 392.480 2.715 0 50 GFAA Cc1csc2nc(Cl)c(CN3CCC(CNC(=O)[C@@H]4CCOC4)CC3)n12 827778587 NRXPNSQCJSICNN-CQSZACIVSA-N 396.944 2.722 0 50 GFAA COCCNc1nc(-c2ccc3c(c2)OCO3)cc(-c2c(C)nn(C)c2C)n1 824444948 AVQCYFJXLQTITI-UHFFFAOYSA-N 381.436 2.948 0 50 GFAA CCc1nnc(CNC(=O)N2CC[C@@H](c3cc(OC)ccc3OC)C2)s1 584894895 WQQRCQSMWTUWCR-GFCCVEGCSA-N 376.482 2.817 0 50 GFAA Cc1cc2cccc(C(=O)NC[C@@H]3CCCN(CCn4cnnc4C)C3)c2o1 952981701 OUTBCOQWWCYEER-KRWDZBQOSA-N 381.480 2.783 0 50 GFAA CC1CCC(N2C[C@@H](C(=O)N3Cc4cnnn4Cc4ccccc43)CC2=O)CC1 189002025 HYJTXMCIZAQYDU-NXYGQSRBSA-N 393.491 2.600 0 50 GFAA CCCn1c(C(=O)N2CCN(c3nccc(OC)n3)CC2)cc2ccccc21 190220240 NWMJXOHAZGRVRE-UHFFFAOYSA-N 379.464 2.812 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)CN1C[C@H](c2ccccc2)CC1=O 1506417720 BHSSTJJMJWVXRW-OAHLLOKOSA-N 380.423 2.677 0 50 GFAA CN(CC(=O)Nc1nnc([C@H]2CCCO2)s1)Cc1cccc(-n2cccn2)c1 1529119175 CJVZDGRTABLDGG-MRXNPFEDSA-N 398.492 2.646 0 50 GFAA O=C(O)/C=C/C(=O)Nc1ccc(Oc2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1 799486 YVWVFWWPASMBBP-WGDLNXRISA-N 396.355 2.638 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)[C@H]3CCCO3)CC2)c2cc(F)ccc2n1 1704309264 MCXCPNVDTHKEGF-LJQANCHMSA-N 385.439 2.536 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC[C@@H]1CCCO1 1704330245 HIIAFCPMKNPEJD-AWEZNQCLSA-N 379.844 2.962 0 50 GFAA CCc1cc(N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)nc(N2CCCC2)n1 1704345275 VTHFXEKLNJMYFJ-MRXNPFEDSA-N 381.480 2.865 0 50 GFAA Cc1ccc(-c2n[nH]cc2CN2CCCN(C(=O)[C@H]3CCCN3C)CC2)cc1 1775979353 UKAQBQRISSLWQR-HXUWFJFHSA-N 381.524 2.514 0 50 GFAA COC[C@@H](C)NC(=O)c1sc2ncnc(NCCN3CCCCC3)c2c1C 11783239 KPCJTZLAGYCRKN-CYBMUJFWSA-N 391.541 2.662 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@@H]1CCCN(CCc2ccccc2F)C1 14981181 NWHPPDLWPNBJOT-KRWDZBQOSA-N 378.488 2.882 0 50 GFAA CN(Cc1ccon1)c1ccc(C(=O)N2CCC(CCn3cccn3)CC2)cn1 15069229 XJWTVFJMXIKCML-UHFFFAOYSA-N 394.479 2.845 0 50 GFAA Cc1cnc(C)c(-c2cccc(-c3ccn(CC(=O)NC[C@@H]4CCCO4)n3)c2)n1 19595517 QFWZAEQUCFYZPX-IBGZPJMESA-N 391.475 2.919 0 50 GFAA Cn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)NCc1cncc(Br)c1 1857530436 OHCYOSUVZNQERX-YLQAJVPDSA-N 375.270 2.562 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857678246 KARMCSXJERBNIV-HXUWFJFHSA-N 386.835 2.935 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H]2CN(Cc3ccc(Cl)cc3)CC(=O)N2[C@@H]1CC(C)C 1857695210 ZNFUGRSTLQNXFI-GUDVDZBRSA-N 391.943 2.924 0 50 GFAA Cc1nccc(N2CCC3(CC2)CN(Cc2cccc(F)c2)C(=O)CCO3)n1 1857712566 DESOMGIHNZYZKP-UHFFFAOYSA-N 384.455 2.712 0 50 GFAA C/C=C/CCCC(=O)NC[C@H]1[C@H]2CN(Cc3cnn(CC)c3)C[C@]23CC[C@H]1O3 1857722431 HXRICBAHKOUZAA-HJHULCFJSA-N 386.540 2.745 0 50 GFAA Cc1cc(Br)ccc1NC(=O)CNC(=O)CCC1CCNCC1 237567544 YXVQFKSFDIGDKY-UHFFFAOYSA-N 382.302 2.592 0 50 GFAA O=C(O)[C@@H]1CCCCN1C(=O)c1cn(-c2ccc(Br)cc2)cn1 238046928 WLUXZVWLIYFQAN-AWEZNQCLSA-N 378.226 2.714 0 50 GFAA CCc1nsc(N2CCCN(C(=O)Nc3ccc(OC)c(OC)c3)CC2)n1 266362097 SDMLIUKDDOGGRA-UHFFFAOYSA-N 391.497 2.862 0 50 GFAA CCc1nc(CNC(=O)N2CC(O)(c3cccc(Br)c3)C2)cs1 856860203 WLTNADNWJAEGPX-UHFFFAOYSA-N 396.310 2.881 0 50 GFAA Fc1cnc(N2CC[C@@](c3nc(-c4cccnc4)no3)(C(F)(F)F)C2)cn1 952895729 WYHKILUHKADUEW-OAHLLOKOSA-N 380.305 2.771 0 50 GFAA CCOC(=O)C12COC(C(=O)N3CC(Cc4cccc(C(F)(F)F)c4)C3)(C1)C2 1875284469 VKRFTQWGLWIWMO-UHFFFAOYSA-N 397.393 2.819 0 50 GFAA CCC[C@H](CC)C(=O)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(C)n2)C1 1775990974 GRLUROXIBPNFMT-UWJYYQICSA-N 375.513 2.872 0 50 GFAA O=C(O)c1cnn(C[C@@H]2C[C@@H](O)[C@H](NCc3ccc(Oc4ccccc4)o3)C2)c1 2325786181 MZIMOLKYPBSEIF-GDIGMMSISA-N 397.431 2.896 0 50 GFAA COC(=O)c1cncc2c(N3CCN([C@@H](C)c4ccccn4)CC3)nccc12 2325802650 RVAYYKHWWWAABF-HNNXBMFYSA-N 377.448 2.695 0 50 GFAA O=C1CN(C(=O)CN[C@@H](CC(F)(F)F)c2cc(Cl)cc(Cl)c2)CCN1 2325827050 UCQFYDGBIXPKIT-LBPRGKRZSA-N 398.212 2.535 0 50 GFAA CC(C)C[C@@H](C(=O)N1CCOCC1)N1C(=O)c2cc(Cl)c(Cl)cc2C1=O 991265 WWPXRYYAMKUCBA-HNNXBMFYSA-N 399.274 2.863 0 50 GFAA Cc1cc(C)n(C[C@H](O)CN(c2ccccc2)S(=O)(=O)c2ccccc2)n1 1177345 JIWKLZZNYQBJOH-IBGZPJMESA-N 385.489 2.756 0 50 GFAA O=C(c1ccc(NC(=O)C2(c3ccccc3)CCOCC2)cc1)N1CCOCC1 2846325 SVDOJLYQFAISKN-UHFFFAOYSA-N 394.471 2.846 0 50 GFAA CC(C)n1nccc1-c1nc(CC(N)=O)nn1-c1ccnc2cc(Cl)ccc12 2356155129 YIFGPKCVGNYYRG-UHFFFAOYSA-N 395.854 2.941 0 50 GFAA O=C(Cn1nc(C(F)(F)F)c(Cl)c1C1CC1)NCCCN1CCCC1=O 2774928 JVMDDNGDEBHADR-UHFFFAOYSA-N 392.809 2.561 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccccc2Cl)cc1C 4839854 KGMUFFJCGJECGM-LBPRGKRZSA-N 382.869 2.963 0 50 GFAA Cc1nc(CCNCc2cn(CCC(N)=O)c3ccccc23)nc2c1CCCC2 55035709 NBTDZMLQCSXLNZ-UHFFFAOYSA-N 391.519 2.826 0 50 GFAA CN(Cc1cc[nH]n1)C(=O)c1ccc([C@H]2CCCN2Cc2nccn2C)s1 20536418 HKCQFXOIWXXTEA-OAHLLOKOSA-N 384.509 2.814 0 50 GFAA Cc1cc(C)c(NC(=O)c2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c(C)n1 65385916 ABAKFIAEPBSPHR-LJQANCHMSA-N 380.492 2.956 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CNCCN3CCCCC3)C2=O)cc1 67851404 OFPPFISPDJHSKU-HSZRJFAPSA-N 387.568 2.739 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]12)n1c(S)nnc1-c1cccs1 252515561 LPGQDESJQXVDIX-YVECIDJPSA-N 378.523 2.930 0 50 GFAA COc1ccc(NC(=O)c2nnc(CN(CCO)[C@H]3CC[C@@H](C)C3)s2)cc1 252527925 DSHSBABRMKTSKS-HIFRSBDPSA-N 390.509 2.782 0 50 GFAA Cc1cc(-c2nc(C3CC3)no2)ccc1NC(=O)N1CCS(=O)(=O)C[C@@H]1C 252527559 CWESILDHOOGSFE-LBPRGKRZSA-N 390.465 2.573 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 2809386 DOLNZHMTHIGWGW-HUUCEWRRSA-N 390.484 2.795 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@H](N(C)CCN(C)C)C2)c(-c2ccccc2)n1 72170253 ZYTLNWDDDCWDEJ-LJQANCHMSA-N 381.524 2.550 0 50 GFAA CCNC(=O)C[C@H]1COCCN1C(=O)CSc1cn(CC)c2ccccc12 72428881 JAAYXQJUEOIVMO-HNNXBMFYSA-N 389.521 2.507 0 50 GFAA C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)Cn1cnc2c(oc3ccccc32)c1=O 155059187 YRGLLODSXJWBOP-AWEZNQCLSA-N 391.427 2.938 0 50 GFAA COc1cccc(C[C@@H](NC(C)=O)C(=O)Nc2ncc(-c3ccccc3)cn2)c1 484702651 KITYWTSGJUWUFY-HXUWFJFHSA-N 390.443 2.838 0 50 GFAA NC(=O)[C@H]1CCC[C@@H](NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 172442295 YTZWMQNIYYKSGR-LSDHHAIUSA-N 395.438 2.576 0 50 GFAA CCCNC(=O)CCCC(=O)N1CCC(Oc2cnc3ccccc3n2)CC1 376030779 TUGWYCIUHOPMRY-UHFFFAOYSA-N 384.480 2.696 0 50 GFAA CC(=O)N1c2ccccc2C[C@H]1c1nc(-c2cnc(OCC(F)F)cn2)no1 373143292 DPFGOABNHPBHIV-AWEZNQCLSA-N 387.346 2.821 0 50 GFAA C[C@H](CNC(=O)c1ccc(C(=O)N(C)C)cc1)c1nc(-c2ccccc2)no1 125802795 JYPNBSSGKSCYJT-CQSZACIVSA-N 378.432 2.972 0 50 GFAA CN(C)c1noc([C@@H]2CCCN2CC(=O)Nc2nc(-c3ccco3)cs2)n1 374531650 RVCZSQLKVDYHMI-LBPRGKRZSA-N 388.453 2.628 0 50 GFAA CCc1nc2ccccc2c(C(=O)N2CCN([C@H]3CCNC(=O)CC3)CC2)c1C 333736479 KVAKZERAXSDZGI-QGZVFWFLSA-N 394.519 2.532 0 50 GFAA Cc1nn(C[C@@H](O)CO)c2nc3ccccc3c(NCCc3ccccc3)c12 43191064 OAQHCUINGLIUAN-QGZVFWFLSA-N 376.460 2.901 0 50 GFAA Cc1noc(C)c1[C@H]1CCCN1C(=O)NCCc1nc(-c2cccnc2)no1 426397996 BXADAXZZNAYOBG-OAHLLOKOSA-N 382.424 2.826 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(C(=O)c3ccn(C)n3)CC2=O)cc1 426549042 BGNPHHGNELLJFK-HXUWFJFHSA-N 388.471 2.829 0 50 GFAA Cc1cc(C)nc(N2CCN(C(=O)c3ccc([C@@H]4CCCNC4)cc3)CC2)n1 95352412 FYFXZTVDZWJBPF-HXUWFJFHSA-N 379.508 2.523 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c(F)c1 95515415 LIZWXOKNMWYBRB-UHFFFAOYSA-N 396.466 2.783 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)ccc1O 91746047 WSFXASFFEFPOPC-GOSISDBHSA-N 386.492 2.724 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@@H](O)c3cccc(Cl)c3)CC2)CC1=O 91624908 CEUBCHUTRLJMIR-SFHVURJKSA-N 378.900 2.871 0 50 GFAA NC(=O)c1ccc(CN2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)cc1 91819314 MTZMJCCJTBEKKA-XMSQKQJNSA-N 375.516 2.849 0 50 GFAA CCc1cccc(CC)c1NC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O 239433125 XFZPBVOYCCNMOD-WDYSCTGBSA-N 378.472 2.803 0 50 GFAA COc1ccc(F)c(CN2CCC(c3nnc(CN4CCCC4)n3C)CC2)c1 96130737 XVDHBVRZPNBRPN-UHFFFAOYSA-N 387.503 2.938 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](CNC(=O)c2cc3ccccc3[nH]2)C1 95507063 NKUXEIWGUFFMJW-HNNXBMFYSA-N 392.459 2.854 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NS(=O)(=O)c1ccc2c(c1)CCO2 181797706 FZJPNEMLHDCCIS-UHFFFAOYSA-N 385.449 2.657 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)c1cn(-c2cccc(Cl)c2F)nn1 183559960 STIROQYPFWENAK-UHFFFAOYSA-N 397.801 2.571 0 50 GFAA Cc1nccn1CCc1nnc(N2CCOC[C@@H](C3CCC3)C2)n1CC1CC1 1345827006 INPJLNKZRFSSGI-IBGZPJMESA-N 384.528 2.689 0 50 GFAA CC(=O)N1CCC(NC(=O)CCC(=O)c2ccc(Br)cc2)CC1 170086027 MCSRDVUDZQYNRD-UHFFFAOYSA-N 381.270 2.539 0 50 GFAA Cc1cccc(CN2C[C@@H]3CN(C/C=C/c4ccc(F)cc4)C[C@@]3(CO)C2)n1 1772815912 COVCMUDJCZLBFC-LFQREDMNSA-N 381.495 2.969 0 50 GFAA COc1ccc(OC2CCN(C(C)=O)CC2)c(C(=O)N(C)Cc2ccccn2)c1 11665092 OQPHNIZPMOJULF-UHFFFAOYSA-N 397.475 2.752 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(Cc3c[nH]cn3)C2)c(OC)c1 11933161 BGVVZZBQGASZRG-INIZCTEOSA-N 386.496 2.736 0 50 GFAA COc1ccc(CCc2nnc(CCC(=O)NCCCc3cccnc3)o2)cc1 11936927 LSHKQXSQJMCTMA-UHFFFAOYSA-N 394.475 2.940 0 50 GFAA CC[C@H](C)C(=O)NCc1nnc2n1CCN(Cc1ccc(Cl)cc1)CC2 12154450 IIIKBEMZTNEDNF-AWEZNQCLSA-N 375.904 2.652 0 50 GFAA COCC(=O)N1CCC(Oc2ccccc2C(=O)NCc2cccc(C)c2)CC1 12572134 JIZRSGMFZUMNKG-UHFFFAOYSA-N 396.487 2.941 0 50 GFAA CC(C)OCCCN[C@@H]1CCc2c(c(C(=O)NCc3cccs3)nn2C)C1 14541176 SUMGPLDFLHDMTI-OAHLLOKOSA-N 390.553 2.674 0 50 GFAA CC(C)(C)[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)Cn1nc(O)ccc1=O 15062496 FQKFHEMPFQCSBL-HXUWFJFHSA-N 380.448 2.602 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCN(c2ccccc2)CC1)[C@H]1CCCO1 16475203 KAKYLUFIDAHFNU-HXUWFJFHSA-N 379.460 2.767 0 50 GFAA CN(c1ccc(C(=O)NCc2ccccn2)cc1)S(=O)(=O)c1cccs1 16625863 PVYXYNRVEBZVDD-UHFFFAOYSA-N 387.486 2.898 0 50 GFAA Cc1n[nH]c(C)c1CNC(=O)c1nnn(Cc2ccccc2)c1-c1ccncc1 206647315 QJTUZTWWHUZUSV-UHFFFAOYSA-N 387.447 2.658 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2cccn2)C[C@@H]1O)c1ccc(F)c(COCC2CC2)c1 1857532755 QNVFKPHGGPCYFP-YSSFQJQWSA-N 387.455 2.518 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NC2CCN(c3ccc(F)cc3)CC2)CC[C@@H]1N 1857715475 TWEQENNCLUXUHW-YSSFQJQWSA-N 377.504 2.833 0 50 GFAA CS(=O)(=O)Cc1noc(NC(=O)N[C@H](c2cccc(F)c2)C2CCCC2)n1 119979742 AHUBFHJUJCMZHY-HNNXBMFYSA-N 396.444 2.806 0 50 GFAA O=C(N[C@@H](CCc1c[nH]nc1C(F)(F)F)C(=O)O)C1CC2(C1)CC21CCC1 1875320998 QCKHYEGVMVTOLP-JKGQDXBKSA-N 385.386 2.901 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)N1CCC(Cc2ccccc2)CC1 1875399281 UWJPFVHCHKZHAG-NJDAHSKKSA-N 382.508 2.687 0 50 GFAA COc1ccccc1-n1nnnc1SCC(=O)Nc1ccc(F)cc1F 1423862 PUZHFRWKLRQDLH-UHFFFAOYSA-N 377.376 2.680 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@]2(C1)C(=O)N(Cc1ccccn1)c1ccccc12 2100557308 QIQDBOODFCELMU-XMMPIXPASA-N 398.466 2.736 0 50 GFAA Cc1ccc2[nH]c(C(=O)N3CCC(CN)(c4ccccc4)CC3)cc(=O)c2c1 2325769227 ZFJOZOQKUBFUER-UHFFFAOYSA-N 375.472 2.969 0 50 GFAA CC(C)(C)OC(=O)N1CC2(CC[C@H](COC(=O)c3ccc4n[nH]cc4c3)O2)C1 849614407 UPPLQLDKXQOATQ-OAHLLOKOSA-N 387.436 2.888 0 50 GFAA C[C@H](NC(=O)[C@@H]1Cc2ccc(Cl)cc2C(=O)O1)[C@@H](O)c1c(F)cccc1F 2325860444 IPCZQTSLBGQUJS-WIVTXXNASA-N 395.789 2.938 0 50 GFAA C=CC(=O)N(C)CC(=O)Nc1cc(Br)cc(Br)c1O 2325888945 UQCQYEJASQHVBX-UHFFFAOYSA-N 392.047 2.500 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)cc1 2325889711 LJHNDZPPRSOMGJ-UHFFFAOYSA-N 395.434 2.573 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3oc(-c4cccc(Cl)c4)nc3c2)C(=O)N1 1857798119 POKCCFLZBDZPHL-ZDUSSCGKSA-N 383.791 2.683 0 50 GFAA COc1ccc(OCC(=O)NC(=S)Nc2cc(OC)ccc2OC)cc1 674786 JNZXTAACKZRTPF-UHFFFAOYSA-N 376.434 2.604 0 50 GFAA COC(=O)[C@H](CC(C)C)NC(=O)c1ccccc1I 1000448 VGEHSOPFWIXDQB-LBPRGKRZSA-N 375.206 2.609 0 50 GFAA COc1ccc(CN2Cc3nnc(-c4ccc(O)c(OC)c4)n3[C@@H](C)C2=O)cc1 2356146877 YMLFRHSBIBWRPU-ZDUSSCGKSA-N 394.431 2.771 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)s1 2356148507 BSIFUSJWFFIDER-FTRWYGJKSA-N 391.537 2.661 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)N(Cc2ccccc2)Cc2ccccc2)CC1 4958074 HWWRYKRZNWMPKW-UHFFFAOYSA-N 386.517 2.887 0 50 GFAA Cc1nnc(-n2nc(C)c(SCC(=O)Nc3ccc(F)cc3)c2C)nc1O 8670100 HOQAAHQSUZRRTO-UHFFFAOYSA-N 388.428 2.558 0 50 GFAA Cc1c(C(=O)N2CCCC[C@H]2CN2CCOCC2)cnn1-c1ccccc1F 110956418 PQFBXELXOZLTON-KRWDZBQOSA-N 386.471 2.647 0 50 GFAA CCCc1cc(C(=O)N2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccccn2)cs1 67967363 BJHOUDKYZBGSIR-ZWKOTPCHSA-N 385.489 2.984 0 50 GFAA CC[C@@H](C)C(=O)C(=O)NC[C@@H]1Cc2c(F)ccc(-c3nc(C)cnc3C)c2O1 20449125 NUICAKHNYJKLNM-RISCZKNCSA-N 385.439 2.934 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c1 67629702 HDGGRMRFVMOYFE-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA COc1ccc([C@H](CO)N(C)C[C@@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)cc1 253426030 XMBYMXNNXLCEBH-PLMTUMEDSA-N 376.497 2.917 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 29657387 APTBAVPAIGTNTO-UHFFFAOYSA-N 382.508 2.912 0 50 GFAA CN(Cc1cnc(NC[C@H]2CCCO2)nc1)Cc1nc(-c2ccccc2)no1 72144433 GDYRSXHKWDJXAS-QGZVFWFLSA-N 380.452 2.750 0 50 GFAA CC1=NN(C(=O)c2ccc(Cn3nc(C)c(Cl)c3C)o2)[C@](O)(C(F)F)C1 6526485 QCFQATGASYHWIW-MRXNPFEDSA-N 386.786 2.970 0 50 GFAA CCNC(=O)c1ccc(N2CCC[C@H](Nc3ccc4c(c3)OCCO4)C2)nc1 72163993 ZVIMWAFEFWOFAT-KRWDZBQOSA-N 382.464 2.683 0 50 GFAA O=C(CN1CCN(Cc2ccc([C@H]3CCCCO3)o2)CC1)N1CCCCC1 72454480 XOEZRPOMTFLQJP-LJQANCHMSA-N 375.513 2.651 0 50 GFAA COc1cc(C(=O)N2CCC(CC(=O)O)CC2)cc(OC)c1Br 261740178 NXKVNBVRQBOOHB-UHFFFAOYSA-N 386.242 2.793 0 50 GFAA Cc1nc2ccccc2n1C1CCN(C(=O)NCc2nnc3ccccn23)CC1 370490693 IKELPCIUNHTIQA-UHFFFAOYSA-N 389.463 2.934 0 50 GFAA CCN1CCN(Cc2ccc(NC(=O)c3cccc4[nH]c(=O)oc34)cc2)CC1 157673321 NPTHBACHPOBREI-UHFFFAOYSA-N 380.448 2.511 0 50 GFAA Cc1ccc(F)c(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)c1 173297735 OQRTVAUBCUSBRZ-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@H]1C[C@H]1C1CCCCC1 159101518 HQRSASTTYSUHMY-HOTGVXAUSA-N 375.450 2.758 0 50 GFAA CN(C[C@H]1Cc2ccccc2CN1C)C(=O)c1ccc(-c2cnc(O)nc2)cc1 426528080 SNZZVLAZYWRVQG-OAQYLSRUSA-N 388.471 2.978 0 50 GFAA O=C1C[C@H](N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)C(=O)N1c1ccccc1 19848234 QDAYJKBPVWIXSM-IOFSEFHDSA-N 393.531 2.905 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)cs1 292125749 PDJDKTYTYAGTJY-SECBINFHSA-N 376.912 2.918 0 50 GFAA O=C1CN(CCCNC(=O)c2cccc(-c3ccc4occc4c3)c2)CCN1 426438944 VJMLHPUITNPUPN-UHFFFAOYSA-N 377.444 2.652 0 50 GFAA Cc1cc(=O)c(C(=O)N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)c[nH]1 95360179 QQRRNJHFWKOKKS-MAODMQOUSA-N 399.441 2.664 0 50 GFAA CCOc1ccc(CN2C[C@@H]3c4ccccc4OC[C@]3(C(=O)O)C2)cc1CO 95512871 BPAOJCXEMKCHOL-XMSQKQJNSA-N 383.444 2.640 0 50 GFAA CCCCN1CCn2nc(CNC(=O)[C@@H]3CCOc4ccccc4C3)cc2C1 426622906 HPFDIWUHAPYXPJ-GOSISDBHSA-N 382.508 2.756 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NCCN3CCC[C@H](C(N)=O)C3)cc2)cc1F 426398004 CZMICMKQECYPNA-IBGZPJMESA-N 383.467 2.728 0 50 GFAA CCOc1ccc(NC(=O)N2CCC3(CC[C@H](CNC(C)=O)O3)CC2)cc1 97088501 MVZQKLDUDNXFDQ-GOSISDBHSA-N 375.469 2.767 0 50 GFAA CCc1nnc(CN2CCC(Oc3ccc(C(=O)N4CCCC4)cc3)CC2)o1 95507625 LEVGCLKFFKVBGM-UHFFFAOYSA-N 384.480 2.911 0 50 GFAA O=C(O)c1ccccc1-n1nc(-c2ccncc2)nc1CN1CCCCC1=O 95531192 DRQCOYMDEZOSDK-UHFFFAOYSA-N 377.404 2.540 0 50 GFAA COc1c(C)cc(NC(=O)NC[C@@H](c2ccncc2)N2CCOCC2)cc1C 95502311 MKAIPJGDALJMGN-IBGZPJMESA-N 384.480 2.902 0 50 GFAA O=C(O)CN(Cc1ccccc1)C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 299745863 SZEFZNAOMMCXEE-UHFFFAOYSA-N 387.823 2.597 0 50 GFAA CN(C)C(=O)CCc1ccccc1NC(=O)N1CCC[C@@H](c2ccncn2)C1 299764143 UISVGSKKWYDPKO-QGZVFWFLSA-N 381.480 2.909 0 50 GFAA O=C(Cn1ccnc1-c1ccccc1)N[C@@H]1CCCN(C(=O)c2ccco2)C1 827861437 IWXZPCOJGYYVKN-QGZVFWFLSA-N 378.432 2.564 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)c1cc2cc(C3(O)CCNCC3)ccc2o1 828146809 ACDWYSOFICXCAR-UHFFFAOYSA-N 380.400 2.985 0 50 GFAA COc1ncnc(C)c1-c1ccc(C(=O)N2CC(n3nc(C)cc3C)C2)cc1 584888803 DNBGVUYBASNBOZ-UHFFFAOYSA-N 377.448 2.971 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3ccc4c(c3)N(C)C(=O)CO4)cc2)CC1 952987551 FDIVKIGJCAAUDT-UHFFFAOYSA-N 395.459 2.767 0 50 GFAA Cc1cc(C(=O)NCC2CCN(c3ccc(-c4ccccc4)nn3)CC2)nn1C 952860284 KWRGERQDUZULBV-UHFFFAOYSA-N 390.491 2.832 0 50 GFAA CC(=O)N(c1ccccc1)c1nc(COC(=O)c2csc(=O)[nH]2)cs1 170619475 DMGDVINCQQRHFR-UHFFFAOYSA-N 375.431 2.935 0 50 GFAA Cc1nn(C)c(C)c1CN1CCN(C(=O)[C@H](C)c2cn(C)c3ccccc23)CC1 185422659 IZGWEFVDAFWPRF-MRXNPFEDSA-N 393.535 2.977 0 50 GFAA CC(C)n1cc(C(=O)N2CCN(CC(=O)Nc3ccccc3Cl)CC2)cn1 188608002 XWALDJGOJUKYOE-UHFFFAOYSA-N 389.887 2.514 0 50 GFAA COc1cccc(C(C)(C)CNC(=O)N2C[C@@H](OC)C[C@@H]2c2nc(C)no2)c1 190139805 QFJVOXVULJRMQF-DLBZAZTESA-N 388.468 2.836 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)CC1 190729958 FFHMHRBHLSSZIZ-JXQTWKCFSA-N 398.491 2.922 0 50 GFAA O=C1CO[C@H](C(=O)N(Cc2ccccc2)C2CCCC2)[C@@H](c2cccnc2)N1 1529120363 XUYNCMUZGIPXLL-RTWAWAEBSA-N 379.460 2.609 0 50 GFAA OCCN1C[C@H]2CN(Cc3nc4ccccc4[nH]3)C[C@@]2(CCc2ccccc2)C1 1772804946 FGNIRRQXFMYWGJ-GBXCKJPGSA-N 390.531 2.922 0 50 GFAA COc1ncccc1C(=O)N[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 12072720 WQMXVXIGTQTUMH-CYBMUJFWSA-N 380.370 2.903 0 50 GFAA CN(C(=O)CCCN1CCCC1=O)[C@@H]1CCCN(CCCc2ccccc2)C1 12300439 QUHBPLRFIQGTLW-OAQYLSRUSA-N 385.552 2.945 0 50 GFAA Cc1c[nH]c(C(=O)N2CC[C@]3(CCCN(Cc4ccc(F)c(F)c4)C3=O)C2)n1 12446351 REYUBJHUZHMUKA-HXUWFJFHSA-N 388.418 2.651 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4cnc(OC)nc4)C3)C2)c1 12459371 DJHWZFREQFDXBK-JOCHJYFZSA-N 396.491 2.622 0 50 GFAA Cc1occc1C(=O)N1CC(=O)N(Cc2ccccc2)C[C@H](OCC2CC2)C1 14535633 PMTNKLMQOOGOIG-IBGZPJMESA-N 382.460 2.868 0 50 GFAA Cc1cccc(CN2CCC3(CC2)C(=O)N(CCc2ccccc2)C(=O)N3C)n1 14542763 CFJYBBNJUYNPLB-UHFFFAOYSA-N 392.503 2.861 0 50 GFAA COc1ccc(NC(=O)C2=C(C)Nc3nnnn3[C@H]2c2ccccc2F)cc1 16577374 CIDZTJQBUXJMGX-KRWDZBQOSA-N 380.383 2.748 0 50 GFAA CCOC(=O)c1c(CN2CCOCC2)n(C)c2cc(Br)c(O)cc12 19881520 CJTVYSKUXCBBOA-UHFFFAOYSA-N 397.269 2.655 0 50 GFAA COCCn1nc(C(=O)NCCOc2ccccc2C)c2c1[C@H](C)O[C@H](C)C2 1857532831 HLJXNDPYQPCUNJ-CVEARBPZSA-N 387.480 2.669 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cc(C)nc4onc(C)c34)C[C@H]21 1857697748 KWZKTGLBMFKQED-HYEYJGRESA-N 383.448 2.913 0 50 GFAA COc1ccc(Cn2nc(-c3ccccc3)nc2[C@H]2C[C@H](N)[C@@H](O)C2)cc1OC 1857734624 XHXJYSWRFZHIRG-BZSNNMDCSA-N 394.475 2.576 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)c2cccc(N3CCNC3=O)c2)C[C@@H]1O 210069601 LKJMKWJQQVACAJ-IRXDYDNUSA-N 385.489 2.577 0 50 GFAA Cc1nc(C)n(C[C@@H]2CCCN(C(=O)c3cccc(CN4CCCC4=O)c3)C2)n1 116777549 JKBDLSKPCRBHRW-LJQANCHMSA-N 395.507 2.570 0 50 GFAA Cn1cc(CN2CCCN(C(=O)Cc3c[nH]c4ccc(Cl)cc34)CC2)cn1 121492432 HWVNCPZEOLHWHL-UHFFFAOYSA-N 385.899 2.832 0 50 GFAA COc1ccc(-c2ccc3c(c2)C[C@@H](CNC(=O)c2csc(C)n2)O3)nn1 12040315 SEIWYWZMUFEGJV-AWEZNQCLSA-N 382.445 2.651 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2cc(-c3cccc(F)c3F)n[nH]2)CC1 134365072 AKBSXZRGBDERLQ-UHFFFAOYSA-N 377.395 2.687 0 50 GFAA CN(C)CCN(C)[C@@H]1CCCN(C2CCN(c3ccc(F)c(F)c3)CC2)C1 20601309 WUWXBWQFXQJWKC-LJQANCHMSA-N 380.527 2.891 0 50 GFAA O=C(Nc1ccc(-n2cccn2)nc1)N1CCN(c2ccncc2Cl)CC1 153463286 YOKMOWKFPRSZTM-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)Cc3cccc(OC(C)C)c3)Cc3c[nH]nc32)n[nH]1 1875393398 MGVYQVDTYCCJTR-QGZVFWFLSA-N 394.479 2.594 0 50 GFAA OC[C@H]1CCN(c2ccc3nnc(-c4ccncc4)n3n2)C[C@@H]1c1ccccc1 1875307715 SESRGIXBZGCUER-RTBURBONSA-N 386.459 2.789 0 50 GFAA CC1(c2cc(=NC(=O)NC[C@]3(CO)CC34CCOCC4)[nH]o2)CCCCC1 1875404341 FXANUXXXLADYKQ-FQEVSTJZSA-N 377.485 2.619 0 50 GFAA CN(C)C(=O)COc1ccc(NC(=O)N(C)CC2=CCCOC2)cc1Cl 888101933 QLABSEJRBDDVRX-UHFFFAOYSA-N 381.860 2.617 0 50 GFAA C[C@H](Sc1nncn1C)c1cccc(NC(=O)c2cnn(CCN(C)C)c2)c1 2325800913 MLXWQZURKVMKHH-AWEZNQCLSA-N 399.524 2.679 0 50 GFAA CCOC(=O)CN1C(=O)[C@@](O)(CC(=O)c2ccc(Cl)cc2)c2ccccc21 894968 UYDFRFAQGBIOAH-HXUWFJFHSA-N 387.819 2.710 0 50 GFAA COC(=O)c1cc(NC(=O)COc2ccccc2Cl)cc(C(=O)OC)c1 1075253 DLMALBBNONSHAS-UHFFFAOYSA-N 377.780 2.931 0 50 GFAA CC(=O)[C@H](NC(=O)CN1C[C@@H](C)Oc2ccc(Br)cc21)C(C)C 225536145 PJXSJBRMTQLPBJ-PIGZYNQJSA-N 383.286 2.766 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)CN2CC3(CCCCC3)CC2=O)C1 23192232 OWHARRUOTHTZLQ-KRWDZBQOSA-N 383.492 2.686 0 50 GFAA CCn1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)c1C 23359114 AZFXPKIPPTXXFP-SFHVURJKSA-N 378.467 2.558 0 50 GFAA CCCN1C(=O)[C@H](Cc2nc3ccccc3c(=O)n2CCCO)c2ccccc21 101413315 FJPNDICDILVVGJ-GOSISDBHSA-N 391.471 2.862 0 50 GFAA COc1ccc(-c2n[nH]c(NC(=O)CC3(n4cccc4)CCOCC3)n2)cc1 409413054 ANVWUZSCHHEDFC-UHFFFAOYSA-N 381.436 2.816 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccccc3OCC)[C@@H](CCO)C2)CC1 22919408 LPPQBFKMIXRZEI-QFIPXVFZSA-N 389.584 2.828 0 50 GFAA CN1C[C@@H](NC(=O)c2cccs2)C[C@H]1C(=O)NCCc1ccccc1Cl 67724201 QGYWKIRBHUFSPC-HOCLYGCPSA-N 391.924 2.563 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CN(C)Cc3ccccc3)C2=O)c1OC 67695512 DKOIZMXACMFFFI-HSZRJFAPSA-N 398.503 2.689 0 50 GFAA CN(c1ccc(Cl)c(C(=O)N2CCc3ccccc3C2)c1)S(C)(=O)=O 67603684 CHFQQPAZBIRQJQ-UHFFFAOYSA-N 378.881 2.934 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@@H](C)c2ccon2)n1Cc1ccccc1 12314948 MHFWKAGQIBMQMX-HNNXBMFYSA-N 388.493 2.906 0 50 GFAA CCOc1ccccc1NC(=O)[C@@H](C)N1CCn2c(nnc2C(F)(F)F)C1 150908829 GOTDUNCUDOIHTK-LLVKDONJSA-N 383.374 2.538 0 50 GFAA O=S(=O)(N1CCCCCC1)N1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 155263958 BFEBWZWIPOBUFE-HOTGVXAUSA-N 392.443 2.934 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C 332900589 UTKRUJSBTCAXFB-MTFMMBMASA-N 383.492 2.535 0 50 GFAA CCOc1ccc(CNC(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1OC 363374534 ZMHVELCAEONMLZ-UHFFFAOYSA-N 399.495 2.721 0 50 GFAA COc1ccc(-n2ccc(CNC(=O)Nc3cnn(C[C@@H]4CCCO4)c3)n2)cc1 363445600 ZGQFOIPYYVOXTN-IBGZPJMESA-N 396.451 2.578 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2ccc(C(F)(F)F)nc2)C1=O 157124836 SHDVZUXKHRIBHR-LBPRGKRZSA-N 379.338 2.644 0 50 GFAA COc1ccc(C)cc1NS(=O)(=O)c1ccc(Cc2cc(C)n[nH]c2=O)cc1 33026609 JESUBJXZRFILOE-UHFFFAOYSA-N 399.472 2.787 0 50 GFAA Cc1ncc(S(=O)(=O)N2CCC3(CC2)C[C@H]3N(C)Cc2nccs2)s1 374745145 UNTSTDBNZKCAMG-CYBMUJFWSA-N 398.579 2.583 0 50 GFAA O=C(NCCSc1cnn[nH]1)N1CCC[C@@H](COc2cccc(F)c2)C1 426613674 SLOUXSXGOPDDNJ-CYBMUJFWSA-N 379.461 2.537 0 50 GFAA NC(=O)c1ccc(-c2nc(C[C@@H]3CCOC3)n(CCc3ccccc3)n2)cc1 96130405 KOIBJMZWHPBTRI-KRWDZBQOSA-N 376.460 2.866 0 50 GFAA Cc1nn(C)c(Cl)c1S(=O)(=O)N1CCC[C@@H](c2cccc(C(=O)O)c2)C1 95377027 RYUYMSDVCGCEHL-CQSZACIVSA-N 397.884 2.648 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(-n3cccn3)cc2)C1 95524405 RGYLZRBFMDBMOI-GOSISDBHSA-N 379.464 2.735 0 50 GFAA O=C(C1CCCC1)N1C[C@@H]2CN(Cc3ccc(Cl)cc3)C[C@]2(C(=O)O)C1 96179895 ZIMPWPMKOLLZJP-JXFKEZNVSA-N 376.884 2.875 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(S(=O)(=O)N3CCCC3)CC2)C1 96151289 NXYZIXKVKUHZDY-FQEVSTJZSA-N 391.581 2.919 0 50 GFAA O=C(NCc1cccnc1-n1cncn1)[C@H](c1ccc(F)cc1)N1CCCCC1 952966913 XVVYVNCYBOTLIW-IBGZPJMESA-N 394.454 2.645 0 50 GFAA O=C(c1ccc2nn[nH]c2c1)N1C[C@@H]2CC[C@H]1CN(Cc1ccc(F)cc1)C2 1565527418 NHPYADRZRLIQAL-QAPCUYQASA-N 379.439 2.834 0 50 GFAA C[C@H](CN1CCCCC1)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1 171039065 UMHOEFMOEQHCDF-LJQANCHMSA-N 387.572 2.604 0 50 GFAA O=C(Nc1cc(Cl)cc(Cl)c1)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 170591904 QEFRMGMUXSBBSS-SWLSCSKDSA-N 393.292 2.851 0 50 GFAA COc1ccc2c(NC(=O)[C@H]3CCCN3C(=O)Cc3cccs3)n[nH]c2c1 194789888 KNAJBRBUJIGNBH-MRXNPFEDSA-N 384.461 2.805 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1csc(C)c1 797193820 QNLHNCPDDFWRQF-UHFFFAOYSA-N 389.882 2.854 0 50 GFAA COc1cccc(CN(C)C(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2C)c1 1529125640 UNZCIQIAFTXFEG-RTWAWAEBSA-N 382.460 2.561 0 50 GFAA O=C1CO[C@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)C2)CN1 1772807982 DKIXVDAYQWJNOM-LJQANCHMSA-N 376.884 2.659 0 50 GFAA O=C(CSc1nc(=O)c2c3c(sc2[nH]1)CCCC3)NCc1ccco1 5093146 QRMHFQGFENDMSB-UHFFFAOYSA-N 375.475 2.865 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)[C@H]1CC(=O)N(c2ccccc2)C1 11865979 SCIWDUXQDNVHBG-IBGZPJMESA-N 377.488 2.820 0 50 GFAA Cc1nnc(SCC(=O)N(C)[C@H]2CCCN(Cc3ccccc3F)C2)o1 12439628 WKIPBUZTWPDLAO-HNNXBMFYSA-N 378.473 2.732 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1)c1cc(CN2CCC[C@H](O)C2)on1 12595955 MPNBVSAIIQAZFX-AWEZNQCLSA-N 383.370 2.580 0 50 GFAA Cc1nnc(SCC(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)o1 12712183 VQUYEIXWPDBQOE-AWEZNQCLSA-N 387.440 2.989 0 50 GFAA Cc1cccc(CC(=O)N2CCC(n3cc(C(=O)NC4CCCC4)nn3)CC2)c1 14970685 KFEPNMFHTFYCAY-UHFFFAOYSA-N 395.507 2.665 0 50 GFAA CSc1ccccc1NC(=O)N1CCC(n2cc(C[C@@H](C)O)nn2)CC1 19731737 RFUAZWQUFHUFDE-CYBMUJFWSA-N 375.498 2.792 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4cc(F)cc(F)c4)CC3)nn2)n1 169780222 FEWKHEKBGBGRHH-UHFFFAOYSA-N 388.378 2.646 0 50 GFAA CC(C)c1nc(CCNC(=O)[C@]23COC[C@H]2CN(Cc2ccco2)C3)cs1 1857704713 CFJWODSVDRFCFN-FOIQADDNSA-N 389.521 2.667 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(NCc4ccncc4)cc3)C[C@@H]2O)on1 1857710490 ZMLUWMWOKWTUQX-NQIIRXRSSA-N 392.459 2.666 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1 1857733931 GGODYPLJWINWJA-VWNXMTODSA-N 392.499 2.915 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H]2C(=O)O)nn1-c1ccc(Br)cc1 237691532 OLBHAQLTVDJTRD-CQSZACIVSA-N 378.226 2.632 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)C2(Cc3ccccc3)CCC2)N(c2ccncn2)C1 864337801 JMGLYWIFHMVKFG-OALUTQOASA-N 380.492 2.600 0 50 GFAA O=C(Nc1cnn(Cc2cn3ccccc3n2)c1)[C@H](O)c1ccccc1Cl 1875254765 PMQFLXRTLBDWPE-GOSISDBHSA-N 381.823 2.905 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1)N1CC[C@H]2[C@H](O)C[C@H]21 1875329111 FFPKLKBCZFRSKB-KZNAEPCWSA-N 378.407 2.669 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2cccc(-c3noc([C@@H]4CCCO4)n3)c2)cn1 1875385134 NFRDQIMCHPMDOA-XOVJRCOKSA-N 381.436 2.585 0 50 GFAA C[C@@H](NC(=O)N1CCC2(CC1)C[C@@H](C(N)=O)CO2)c1ccc(C(F)(F)F)cc1 1875300389 BDTCVSXISSMIJG-TZMCWYRMSA-N 399.413 2.832 0 50 GFAA CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NC[C@H]1COC(C)(C)CO1 1875345432 XPFUQADAJQUHLF-IRXDYDNUSA-N 396.915 2.795 0 50 GFAA COC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1ccc(OC)c(OC)c1 1148080 CJWGRKNBQPORGM-INIZCTEOSA-N 376.434 2.527 0 50 GFAA FC(F)(F)c1cccc(-n2cc(-c3csc(N4CCNCC4)n3)nn2)c1 2325752464 KRHUJEWMPJBZAV-UHFFFAOYSA-N 380.399 2.819 0 50 GFAA CN(c1ccnc(NCc2nc3cc(F)c(F)cc3[nH]2)n1)[C@H]1CCCNCC1 2325806039 NTVXYQVZUGOJIC-LBPRGKRZSA-N 387.438 2.822 0 50 GFAA CN(C)Cc1ccc2c(c1)CCN(S(=O)(=O)c1ccc3c(ccn3C)c1)C2 2325859943 QOHDJSBGFXLRHC-UHFFFAOYSA-N 383.517 2.987 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1OC 893057 TZQJHWGBHZSMTF-UHFFFAOYSA-N 388.851 2.955 0 50 GFAA COCCn1cncc1CN1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356151322 CTZRFEMKLIJDOT-QFIPXVFZSA-N 382.508 2.687 0 50 GFAA c1cc(-n2nc(C3CCOCC3)nc2[C@@H]2CCCN(C3CCOCC3)C2)ccn1 2356154497 XXPRADYJAKZOCB-GOSISDBHSA-N 397.523 2.915 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc(Cl)c2C)cc1 2872248 XPPZZLRKHPDKMW-GFCCVEGCSA-N 382.869 2.963 0 50 GFAA COc1ccc(C(=O)NCC(=O)OCc2cccc(Br)c2)cc1 2879703 KYWXRBWROIWDIS-UHFFFAOYSA-N 378.222 2.931 0 50 GFAA CCOC(=O)c1ccc(N2CCOCC2)c(NC(=O)c2ccc3c(c2)OCO3)c1 6698156 CNQQTTWKLCZOFI-UHFFFAOYSA-N 398.415 2.681 0 50 GFAA Cc1ccc([C@H](NC(=O)CCn2c(C)cc(C)nc2=O)c2ccncc2)cc1 55089346 FMTPFDSEBHAKNY-NRFANRHFSA-N 376.460 2.859 0 50 GFAA CCCCCC(=O)N[C@@H](NC(=S)N1CCOCC1)C(Cl)(Cl)Cl 8680629 KNTDLMGIWNBELZ-NSHDSACASA-N 390.764 2.586 0 50 GFAA COC1(c2nc(C3CC3)no2)CCN(CC(=O)N(C)Cc2ccccc2C)CC1 225838874 HRXINJDOZPGAQY-UHFFFAOYSA-N 398.507 2.852 0 50 GFAA c1ccc(CN2CNC3=N[C@H](c4ccco4)n4c(nc5ccccc54)N3C2)nc1 20102182 GECLOLVUJSUFOX-IBGZPJMESA-N 385.431 2.768 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)cc2c1C 67921745 YGZIHMSNFJQQNZ-KRWDZBQOSA-N 376.460 2.845 0 50 GFAA c1ccc(C(c2ccccc2)c2n[nH]c3c2CN(CCc2nnn[nH]2)CC3)cc1 67473217 PQKNQXUYAKIXJB-UHFFFAOYSA-N 385.475 2.704 0 50 GFAA Cc1c(C(=O)NCc2cccnc2N2CCN(C)CC2)n(C)c2ccccc12 67689041 IYKZRESECAYKPQ-UHFFFAOYSA-N 377.492 2.564 0 50 GFAA CCCNC(=O)c1cc(=O)n(CC(=O)Nc2ccc(F)cc2)c2ccccc12 12411155 OETMNDQEYVELFN-UHFFFAOYSA-N 381.407 2.919 0 50 GFAA biogenic,in-vitro CN1C[C@]2(CCCN(c3cc(Sc4cccs4)nc(N)n3)C2)OC1=O 72447734 HJAWTLOIJSEAON-INIZCTEOSA-N 377.495 2.693 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)[C@H]3CC(=O)N(C4CC4)C3)cc2)C1 230169257 WYMCGQXZFBZLBA-QKLQHJQFSA-N 383.536 2.792 0 50 GFAA Cc1cc(CNC(=O)N2CCC(S(N)(=O)=O)CC2)ccc1-c1ccccc1 365720086 PTQFXNISZYYLRX-UHFFFAOYSA-N 387.505 2.625 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2cccc3c[nH]nc23)CC1 328631306 KHFMPOXNKLJGRQ-FQEVSTJZSA-N 378.480 2.756 0 50 GFAA CNC(=O)c1ccc(CN2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)o1 72126543 KDAWRJPCXHMSPH-CEWLAPEOSA-N 383.467 2.841 0 50 GFAA CC(=O)Nc1ccc(-c2cn([C@H]3CCCN(C(=O)c4ccco4)C3)nn2)cc1 82096217 UVKMUQLYCXTXMO-KRWDZBQOSA-N 379.420 2.974 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CCCN2c3ccccc3C[C@H]2C1 291808626 HQMYROAWIAOIMB-AZUAARDMSA-N 393.487 2.938 0 50 GFAA Cc1c(O)nc(-c2cccc(CN3CCN(C)C(=O)[C@H]3C)c2)nc1C(F)(F)F 19836368 BPQGCJHSHDQYDV-GFCCVEGCSA-N 394.397 2.839 0 50 GFAA C[C@H](NC(=O)N1CCC2(CC1)CN(C)C(=O)O2)c1cnn(-c2ccccc2)c1 426490572 RTJRNEBKCNIXKM-HNNXBMFYSA-N 383.452 2.560 0 50 GFAA COc1c(C)cc(C)cc1CN1CC[C@H](N2CCN(C)CC2)[C@H](CCCO)C1 91933068 TXYHYHXDAINNTL-IRLDBZIGSA-N 389.584 2.522 0 50 GFAA COc1ccc(N2C[C@@H](NC(=O)c3ccc(-c4cc[nH]n4)cc3)CC2=O)cc1 92061980 GYYWHARDHFTVRF-INIZCTEOSA-N 376.416 2.621 0 50 GFAA COC(=O)N1CCN(C(=O)Nc2ccc(OC[C@@H]3CCCCO3)cc2)CC1 95526297 YZRRBGUSRDGTTM-KRWDZBQOSA-N 377.441 2.550 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCC[C@H](OCc2ccccc2)C1 97288710 SLFDJDYKRTUJGY-FQEVSTJZSA-N 377.448 2.543 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)NCc1nn(C)c3ccc(C)cc13)CC(=O)N2 91985840 SEHRPQPVYKGFNS-HNNXBMFYSA-N 378.432 2.633 0 50 GFAA COc1c(C)cnc(CNC(=O)Nc2ccc(CN3CCOCC3)cc2)c1C 95501229 HLOVJQIFJLKOAO-UHFFFAOYSA-N 384.480 2.861 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](N)C2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 95507826 QTNMRRSXDYAMML-KRWDZBQOSA-N 383.467 2.605 0 50 GFAA Cc1cc(N2CCC(Oc3ccc(C(=O)N4CCCC4)cc3)CC2)nc(N)n1 95527928 LYAUMBDMFBTHPI-UHFFFAOYSA-N 381.480 2.651 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@H](c3nccn3CCN(C)C)C2)o1 95500125 WHKZNQHFUYPPNK-HNNXBMFYSA-N 376.526 2.921 0 50 GFAA CCOc1c(Br)cc(C(=O)N2CC[C@@](C)(C(=O)O)C2)cc1OC 299745628 RMNGQJZREHAVJZ-MRXNPFEDSA-N 386.242 2.793 0 50 GFAA CC(=O)N1CCC(NC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1 184604583 YBRVKGSUHFCMRG-OAHLLOKOSA-N 398.429 2.594 0 50 GFAA O=C1c2c(-c3nc(-c4ccccc4)no3)nnn2CCN1Cc1ccccc1F 263619536 ZDDRNUUDNUSCOD-UHFFFAOYSA-N 390.378 2.790 0 50 GFAA Cc1ccc2nc(C)c(C)c(C(=O)N3CCC[C@H](C(=O)N4CCOCC4)C3)c2c1 825206783 FJZXUUNHGGWGKF-SFHVURJKSA-N 395.503 2.871 0 50 GFAA COc1cccc(-c2cc(CNC(=O)N3CCC(c4nc[nH]n4)CC3)no2)c1 584890076 IGQHFSBWLLHREI-UHFFFAOYSA-N 382.424 2.558 0 50 GFAA Cc1ccc2nc([C@@H](NS(=O)(=O)c3cc(C(N)=O)cs3)C(C)C)[nH]c2c1 670454149 GCTWDHJMYVVIQJ-HNNXBMFYSA-N 392.506 2.707 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cccs2)C1 43608436 OHIVRAHOVGCJHO-RDJZCZTQSA-N 384.567 2.732 0 50 GFAA COc1ccc([C@@H](NC(=O)N2CCO[C@](C)(C(F)F)C2)c2nccn2C)cc1 888102067 XTHHXRXHZAJOBH-BEFAXECRSA-N 394.422 2.584 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1CCC[C@H](OCc2ccccn2)C1 952977271 AHUUDUMQFDJRBG-SFHVURJKSA-N 377.444 2.604 0 50 GFAA Cn1cnc2cc(C(=O)Nc3ccccc3OC[C@H]3CCCO3)ccc2c1=O 952986444 ISQJEMDVUIAHQM-OAHLLOKOSA-N 379.416 2.744 0 50 GFAA O=C(c1cc2ncccn2n1)N1C[C@H]2C[C@H](c3ccccc3)CC[C@@]2(C(=O)O)C1 1565509202 MDUVGZPSJXXEFD-DRSNIGMVSA-N 390.443 2.840 0 50 GFAA O=C(NC[C@@H](Oc1ccc(F)cc1)C(=O)O)c1cc(-c2ccccc2F)on1 170592161 SEWROIPSKKYCAX-QGZVFWFLSA-N 388.326 2.882 0 50 GFAA Cc1ccccc1-n1cc(CN(C)c2cncc(C(=O)N3CCCC3)n2)cn1 1506414868 UOUKZUUWANMNPC-UHFFFAOYSA-N 376.464 2.843 0 50 GFAA COc1ccc(F)cc1[C@H](C(=O)O)N(C)Cc1nc(O)c2sccc2n1 1506395400 HODKBBNSDFUUSH-CQSZACIVSA-N 377.397 2.802 0 50 GFAA O=C1C[C@@H](C(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)C2(CCCC2)O1 1506420120 VDHNGASIWUEJRU-ONUXSRJRSA-N 386.536 2.975 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(C2CCN(Cc3ccco3)CC2)CC[C@@H]1O 1529155576 UOGLGUVBOVZCEQ-XZOQPEGZSA-N 384.520 2.532 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2sccc2Cl)cc1OC 1529191667 BDYNXQJJKQCMES-HZPDHXFCSA-N 397.880 2.993 0 50 GFAA CCCNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@]3(CCC[C@H]3OC)C2)cc1 1704298552 HVZGXAQBZOFFFQ-QUCCMNQESA-N 394.537 2.796 0 50 GFAA Cc1nc2c([nH]1)CN(C(=O)[C@H]1CCc3sc(-c4ccncc4)nc3C1)CC2 1772819540 OAPKGQQEVZBIRP-AWEZNQCLSA-N 379.489 2.926 0 50 GFAA COc1cc(OC)cc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2ccccc2OC)c1 5482503 DWDYFJSJEAIZJS-LJQANCHMSA-N 397.431 2.979 0 50 GFAA N=c1n(CCO)c2ccccc2n1CCOc1ccc(Br)cc1 19814965 DPLWQLLECMDNHA-UHFFFAOYSA-N 376.254 2.756 0 50 GFAA CCCS(=O)(=O)CCN1C[C@H]2CCC[C@]2(c2nc(-c3ccccc3)no2)C1 1857533347 LGEBRZSCUIMPCJ-XLIONFOSSA-N 389.521 2.915 0 50 GFAA CC[C@@]1(C(=O)NCCc2cnc[nH]2)C[C@@H]2CC[C@H]1N2C(=O)c1cc(C)oc1C 1857674602 PPVXACGRRUDCOZ-YRISNDGFSA-N 384.480 2.752 0 50 GFAA CS(=O)(=O)c1ccc(COc2ccc3c(c2)CCOC32CCNCC2)cc1 1857674666 SCDODMGOQGUHJZ-UHFFFAOYSA-N 387.501 2.821 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N(C)CC4(CO)CCC4)CC3=O)sc2c1 1857722890 RUVKNVOEEFRYKO-CQSZACIVSA-N 387.505 2.579 0 50 GFAA Cc1noc(C)c1C(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3)C[C@]23CC[C@H]1O3 1857736574 NHPKVAKJUBPENC-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA CC(C)C(=O)Nc1ccc(S(=O)(=O)N2CCCC[C@H]2c2ccnn2C)cc1 451490448 LZBRAWWQUQJDMI-SFHVURJKSA-N 390.509 2.931 0 50 GFAA C[C@H](N1CCN(C[C@@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1)C(F)(F)F 240555613 GWQAPVMHOQGERQ-DZJNRPSUSA-N 390.490 2.925 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccnc(-n2ccnc2)c1 267482499 VELUGSFGGNTOHP-XLIONFOSSA-N 375.476 2.908 0 50 GFAA C[C@@H](NCc1ncnn1C(C)(C)C)c1cc(F)ccc1N1CCC(O)CC1 801529199 LUOSYXQXALUNTO-CQSZACIVSA-N 375.492 2.984 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@@H]4[C@H](C3)CC4(F)F)nn2C)cc1OC 1875298015 LWROFPIPSNAVNT-QWHCGFSZSA-N 377.391 2.832 0 50 GFAA CN(Cc1ccc2cnccc2c1)C(=O)Cc1ccccc1NS(C)(=O)=O 1875342890 LWJZUVWCPXPDFS-UHFFFAOYSA-N 383.473 2.807 0 50 GFAA CN1CCC[C@@]2(CCN(C(=O)Nc3cn(CC(F)(F)F)nc3C3CC3)C2)C1=O 1875319170 RGHISMVIQUTMQW-KRWDZBQOSA-N 399.417 2.799 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)NC[C@H](O)c3ccnn3C)cc12 886260865 IXZPOCVNYUQGII-KRWDZBQOSA-N 395.488 2.651 0 50 GFAA O[C@@H]1COC[C@H]1N1CCC(NCc2cccc(OCc3ccccc3)c2)CC1 2325808046 YOKRDEJVBUSWNH-DHIUTWEWSA-N 382.504 2.579 0 50 GFAA C[C@H]1C[C@@H](NC(=O)c2cccnc2Oc2ccccc2C(N)=O)c2nccn21 2325855877 SGSKYULCGWOUOH-SWLSCSKDSA-N 377.404 2.605 0 50 GFAA C[C@@H]1Cc2cc(-c3ccc(CNC(=O)c4c(CN)cnn4C)cc3)ccc2O1 876891798 GJZAJSXKLQRKJA-CQSZACIVSA-N 376.460 2.799 0 50 GFAA COc1cc(OC)c(C2=NO[C@H](C(=O)NCc3cccnc3)C2)cc1Cl 1059199 LYCMVYUUMBKSEA-KRWDZBQOSA-N 375.812 2.562 0 50 GFAA Cc1cccnc1-n1c(CN2C(=O)c3ccccc3C2=O)nc2ccccc2c1=O 1211981 GMFOBNBUCAYWBU-UHFFFAOYSA-N 396.406 2.885 0 50 GFAA CCCN1CCC[C@]2(CCCN2Cc2cc(=O)n3cc(Cl)ccc3n2)C1=O 2356134949 JVWVUFYTIJJVJF-FQEVSTJZSA-N 388.899 2.715 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2cccc(Cn3cccn3)c2)CC[C@H]1O 2356149626 MQACRAKDCZENNK-DENIHFKCSA-N 399.491 2.645 0 50 GFAA Cc1ccc(CSCCNC(=O)CN(c2ccccc2)S(C)(=O)=O)cc1 2985197 YGFTXFSJLDDVAL-UHFFFAOYSA-N 392.546 2.811 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccccc2SC)cc1 4778222 PDUGEPQDLIAYLT-GFCCVEGCSA-N 380.491 2.723 0 50 GFAA CCCC(=O)Nc1cccc(C(=O)NC[C@@H](c2cccnc2)N2CCOCC2)c1 55090178 MYEUBEGKQKETEH-FQEVSTJZSA-N 396.491 2.624 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@@](CO)(CCc2ccccc2)C1 67772582 KHBOCNGSFUQMGE-JOCHJYFZSA-N 378.476 2.885 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)Nc3cccc(Cl)c3)CC2)ncn1 65365426 IXNMIPAIRSRSNR-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)NC[C@H]1CCN(c2ccccc2)C1 249527338 VERXALFPWOYLTN-HZPDHXFCSA-N 384.446 2.696 0 50 GFAA COc1ccc(NC(=O)CN2CCN(Cc3cccc(F)c3)CC2)c(OC)c1 20247454 CDYDRHPQLDTAOV-UHFFFAOYSA-N 387.455 2.599 0 50 GFAA CNS(=O)(=O)CC(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 435364637 DQZTXSAIJDOMPJ-UHFFFAOYSA-N 389.408 2.654 0 50 GFAA CCS(=O)(=O)CCn1ccc(NC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)n1 252478179 AFEGVPMTVVJBMF-LLVKDONJSA-N 396.435 2.513 0 50 GFAA COC(=O)[C@H]([C@@H](C)O)N(Cc1ccccc1)C(=O)[C@H](C)Sc1ccccn1 328596478 ULIMKDYRBNAYJV-VKJFTORMSA-N 388.489 2.513 0 50 GFAA COc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCC[C@]2(CC=CCC2)C1 364119810 HHTCJMDXNQMMMT-LJQANCHMSA-N 379.478 2.833 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(c3ncnc4sccc34)CC2)C1 71721378 JWYAYLKUERHQLW-AWEZNQCLSA-N 385.537 2.651 0 50 GFAA O=C(C1CCN(CC(F)F)CC1)N1CCOC[C@H]1Cc1c[nH]c2ccccc12 377153539 VVJQNMZVZDZDKN-QGZVFWFLSA-N 391.462 2.915 0 50 GFAA Cc1nc(CN2CCC[C@@H](N(C)C(=O)Cc3cccc(OC(C)C)c3)C2)no1 371013700 ULHIOJCUCOTQSE-GOSISDBHSA-N 386.496 2.831 0 50 GFAA CCc1nccn1CC(=O)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72170571 LXGZMMRTBIOGGM-GOSISDBHSA-N 376.460 2.516 0 50 GFAA Cc1c(C(=O)N2CCC[C@H]2CN2CCOCC2)cnn1-c1cccc(Cl)c1 174482332 WLDGILSIQHFWDJ-SFHVURJKSA-N 388.899 2.771 0 50 GFAA Cc1ccc(NC(=O)N(C)Cc2nc3c(s2)CCCC3)cc1-n1cnnn1 175611415 HGUXSSVNQZXHRU-UHFFFAOYSA-N 383.481 2.970 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCc4n[nH]cc4C3)csc2C1 426425519 WTORMKVJDMXWGW-UHFFFAOYSA-N 397.504 2.833 0 50 GFAA OCCCNc1nc(N2CCN(c3ccccc3F)CC2)nc2ccccc12 41150400 AYFMALJCEPIKAL-UHFFFAOYSA-N 381.455 2.890 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1nn(Cc2ccccc2Cl)cc1Cl 226567715 XMIXAOQJFLRXRZ-KBXIAJHMSA-N 392.242 2.905 0 50 GFAA CCc1cc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)no1 82171060 GVWAIEDSBKNBSE-OAQYLSRUSA-N 382.464 2.677 0 50 GFAA O=C(CN1CCc2ccccc2C1)N[C@H]1CCCN(Cc2cccnc2)CC1 82120565 FWWAGBDNHFXQGV-QFIPXVFZSA-N 378.520 2.611 0 50 GFAA CCCC(=O)c1cn(CC(=O)N2CCC3(CC2)CNC(=O)O3)c2ccccc12 426382940 QKXIWWYPEGSWJS-UHFFFAOYSA-N 383.448 2.725 0 50 GFAA Cc1cccc([C@@H](C(=O)NCCc2csc(-c3ncccn3)n2)N(C)C)c1 95355030 JNCJVZIOTCPXMR-KRWDZBQOSA-N 381.505 2.870 0 50 GFAA CCN1CCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)CC1(C)C 91745798 QURPEVRKLOZWNH-UHFFFAOYSA-N 387.436 2.539 0 50 GFAA CCSCCC(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 92107509 QRQHSCNYUOIMNK-UHFFFAOYSA-N 389.565 2.999 0 50 GFAA Cc1nc(CCNC(=O)c2cc(-c3ccc(O)cc3)n[nH]2)nc2c1CCCC2 91551293 FSXJQNPXKYHBFT-UHFFFAOYSA-N 377.448 2.732 0 50 GFAA C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)COc1cccc2c1NC(=O)CO2 180754626 GPEULJDZNNXSFU-LLVKDONJSA-N 376.359 2.894 0 50 GFAA CN1CCN([C@@H](c2ccc(F)c(Cl)c2)c2sc3ncnn3c2O)CC1 252510012 ZACGPQOXINEQDK-ZDUSSCGKSA-N 381.864 2.626 0 50 GFAA O=C(O)C[C@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1cccs1 299752620 UUICLOMTJDKWNN-ZDUSSCGKSA-N 393.852 2.877 0 50 GFAA O=C(NCCCSc1ccccc1)N1CCN([C@@H]2CN3CCC2CC3)CC1 534589143 SCOMKXKJIPAPOA-HXUWFJFHSA-N 388.581 2.590 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CC[C@H](c3ccc(F)cc3)[C@@H](O)C2)CC1 1565525561 QLUSVCMYJKVRLR-RTWAWAEBSA-N 383.467 2.676 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)CCc2nc3cc(Br)ccc3s2)C1 269209480 VDLUMTZKBXNPOZ-SECBINFHSA-N 383.267 2.925 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CC[C@@](O)(c3nc(C4CC4)no3)C2)s1 275390527 ZMOKHRWVSOTTJQ-KRWDZBQOSA-N 397.522 2.588 0 50 GFAA CS(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc(F)c(Cl)c1 169964802 JRWHDHTWKGKFMJ-MRXNPFEDSA-N 382.844 2.804 0 50 GFAA CC1(C)CC(=O)CN1S(=O)(=O)Cc1ccc(Cl)cc1Br 170619780 GZZTYQHXMCZSIX-UHFFFAOYSA-N 380.691 2.986 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)[C@H]2Cc3ccccc3CN2)CC1 1704312300 IKJLVCHCFGJHOV-JOCHJYFZSA-N 392.499 2.800 0 50 GFAA O[C@@H]1CCCN(c2ccnc(NC3CCN(Cc4ccc(F)cc4)CC3)n2)C1 1704297862 DVRXZYVCFLHKNH-LJQANCHMSA-N 385.487 2.653 0 50 GFAA O=C(c1ccc2c3c([nH]c2c1)CCCC3)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1704353656 QUQOSBLHBOUNTQ-QVKFZJNVSA-N 376.460 2.512 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)Cc3ccccc3C)C2)nn1 12005481 SEMUFCIXTPJANO-GOSISDBHSA-N 397.523 2.550 0 50 GFAA COc1cccc(N2C(=O)CN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]2C)c1 12203390 NMAUUJKYGYMAGY-INIZCTEOSA-N 390.443 2.758 0 50 GFAA Nc1ncc(CN2CCC[C@@H](CNC(=O)c3cccc4ccccc34)C2)cn1 12385910 JVTQNAKCOGOQDS-INIZCTEOSA-N 375.476 2.854 0 50 GFAA CCN(Cc1cnn(C)c1)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 12447224 CFKGJOLWKACXBF-UHFFFAOYSA-N 393.557 2.623 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NC(=O)CCN3CCCC3=O)C2)cc1 12590935 KVMSHSGVGUKGBJ-OAQYLSRUSA-N 385.552 2.978 0 50 GFAA O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cn(CCCc2ccccc2)nn1 14972688 LVVJNSNJQXPHPS-OAQYLSRUSA-N 389.503 2.915 0 50 GFAA CC(C)c1nnc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)s1 169772904 GWJKFHBNRQSWKM-SECBINFHSA-N 388.428 2.669 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cccc(N4CCCC4=O)c3)C[C@H]12 1857701439 VHPNFQQKSRZPJC-HRDWYUFVSA-N 396.487 2.887 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CC3CCC3)C[C@]23CC[C@H]1O3)c1ccc(F)c(F)c1 1857714924 SKMABPLAGPSLKN-VXIWKAIFSA-N 376.447 2.974 0 50 GFAA NC(=O)c1cncc(N2CCC(C3CCN(CCc4ccccc4)CC3)CC2)n1 1857720949 RPSVKACGABQDQK-UHFFFAOYSA-N 393.535 2.747 0 50 GFAA Cc1nn(CC(=O)Nc2nc3c(o2)C[C@@H](C(C)C)CC3=O)c(=O)c2ccccc12 1875241226 RCIJNLYRPQYHTN-ZDUSSCGKSA-N 394.431 2.733 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4ccc(F)cc4Cl)[C@@H]2CC(=O)N13 1875248450 QYJCHWJQEZQXNB-FCEWJHQRSA-N 380.847 2.606 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N3C[C@@H]4CC[C@H]3CN(Cc3cscn3)C4)c2n1 216573653 MYPVNMYDYBFBGR-WBVHZDCISA-N 396.520 2.539 0 50 GFAA Cc1ccc(C)c(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1 5016060 QAJJQBNEYVCHCQ-IBGZPJMESA-N 379.460 2.884 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@@H](C(=O)O)c3ccccc3)cc2)C[C@H](C)O1 237628392 HGGONKLSTKVCMH-TWOQFEAHSA-N 382.460 2.852 0 50 GFAA CN1C[C@H](C(=O)N[C@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)CCC1=O 818725636 OZCXIJDWEJPGFY-DNVCBOLYSA-N 392.459 2.537 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2ccc(C(F)F)cc2F)N(c2ccncn2)C1 864340209 WNMXJHHTEJSSFR-STQMWFEESA-N 380.370 2.577 0 50 GFAA COc1ccc2c(c1)CC[C@@H](NC(=O)[C@H](C)n1c(C)nc3ccccc3c1=O)C2 1875259189 LGPOMJUPGUYIPZ-KBXCAEBGSA-N 391.471 2.948 0 50 GFAA CCOc1cc(C(=O)N2C[C@H]3C[C@H]2[C@@H]3c2ocnc2C(=O)N(C)C)ccc1C 1875394579 NWRWOXMLSLWJIF-HLLBOEOZSA-N 383.448 2.712 0 50 GFAA COCCN1CCC[C@H](Nc2ncnc3cc(Br)c(OC)cc23)C1 1875336268 BEVVFAXFRBHYSU-LBPRGKRZSA-N 395.301 2.924 0 50 GFAA N[C@@H](C(=O)N1CCC[C@@H](NCC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 1875315031 FSSPCQJURMDKGQ-CHWSQXEVSA-N 383.336 2.848 0 50 GFAA C[C@H](Cn1cccn1)OC(=O)[C@@H]1CC(=O)Nc2ccc(Br)cc21 2325750153 ZFANNUDTFCZNTL-ZWNOBZJWSA-N 378.226 2.703 0 50 GFAA O=C(CC1(O)CCC(O)CC1)Nc1c(O)cc(Br)cc1Cl 2325755004 DEJXLPYVYSNAOP-UHFFFAOYSA-N 378.650 2.803 0 50 GFAA COC(=O)c1cncc2c(N3CCN([C@H](C)c4ccccn4)CC3)nccc12 2325802651 RVAYYKHWWWAABF-OAHLLOKOSA-N 377.448 2.695 0 50 GFAA COc1ccccc1C(=O)NC(C)(C)CNC(=O)[C@@H](Cc1ccccc1)OC 2325879400 UCANJVSTSUTOGS-LJQANCHMSA-N 384.476 2.578 0 50 GFAA COC(=O)c1ccc(COC(=O)CCS(=O)(=O)c2ccc(C)cc2)cc1 1127642 JPPSVRZIGGQPOP-UHFFFAOYSA-N 376.430 2.689 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@]23CCCN(c2ccc(C)cc2)C3=O)cc1=O 2356168694 BCWZDETVUNROAV-QHCPKHFHSA-N 393.487 2.978 0 50 GFAA CCNC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C(=O)NCC2CCCC2)c1 225852131 VSZRJQDBBXOZMX-UHFFFAOYSA-N 388.512 2.951 0 50 GFAA C[C@H]1CCCN(C(=O)C(=O)O[C@H](C)C(=O)Nc2ccc(Br)cc2)C1 225840763 XOASAVYKWWHDFQ-NWDGAFQWSA-N 397.269 2.578 0 50 GFAA CCOC(=O)Nc1ccc(NC(=O)NCCOCC(OCC)OCC)cc1 225852110 ITNFNXBJFPDEBQ-UHFFFAOYSA-N 383.445 2.792 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(CCCn2cccn2)CCO3)n1 67804539 DCKISIASTGXZSN-UHFFFAOYSA-N 379.464 2.947 0 50 GFAA CN(CC(C)(C)CN1CCOCC1)[C@H]1CCCN(C2Cc3ccccc3C2)C1 23372838 UBGSCDBDPNCBJV-QFIPXVFZSA-N 385.596 2.908 0 50 GFAA CNc1ncccc1C(=O)N1CCCn2nc(-c3nc4ccccc4[nH]3)cc2C1 67955772 LUNXNQPDTDHJSZ-UHFFFAOYSA-N 387.447 2.909 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCCN(Cc2cccn2-c2ncccn2)C1 20914520 RHEXUNVELNDWKN-HXUWFJFHSA-N 376.508 2.801 0 50 GFAA O=C(NCCNc1cc(-n2cccn2)ncn1)Nc1ccc(F)c(Cl)c1 65363300 BRQYPJKEVLOIKJ-UHFFFAOYSA-N 375.795 2.688 0 50 GFAA CC(C)c1nc(C(=O)N2CC[C@H](c3cnn(C)c3)C2)nn1-c1cccc(F)c1 117675037 BSLAPEJJEWPRLT-AWEZNQCLSA-N 382.443 2.893 0 50 GFAA O=C(Cn1cccn1)NCc1nc(-c2cccc(F)c2)c(-c2ccccn2)[nH]1 67983152 MJIKLPMHRXFUMY-UHFFFAOYSA-N 376.395 2.791 0 50 GFAA Cc1ncccc1O[C@@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1 328615377 AVEYMHAEMSGADC-GFCCVEGCSA-N 387.383 2.646 0 50 GFAA C[C@H](N[C@H]1CCOC2(CCOCC2)C1)c1cccc(N2CCCS2(=O)=O)c1 329195254 VGWKXFSRUQPTNY-WMZOPIPTSA-N 394.537 2.605 0 50 GFAA CN(C)Cc1ccc(CSCCNC(=O)[C@@H]2COc3ccccc3O2)o1 215488468 XHPNBRDPEAINCK-SFHVURJKSA-N 376.478 2.531 0 50 GFAA CCc1nnsc1C(=O)Nc1ncnc2c1c(C)c(C)n2C[C@H]1CCCO1 153531375 MBXBTBSDUKUMNX-GFCCVEGCSA-N 386.481 2.893 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCCN2C[C@@H](C)C[C@@H](C)C2)cc1C(=O)O 237512077 HLVRRMDXYUQHCH-GASCZTMLSA-N 382.526 2.730 0 50 GFAA Cc1noc(C)c1[C@@H](C)CC(=O)N1CCC(CNC(=O)c2ccccn2)CC1 492849747 CYYBJXDFITWFTB-AWEZNQCLSA-N 384.480 2.849 0 50 GFAA O=C(N[C@H]1CC(=O)N(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 72172700 OYIVWJIEVCIXLU-KRWDZBQOSA-N 378.407 2.542 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCOCC1 71747040 OSGVWUSUMDTNIE-UHFFFAOYSA-N 384.505 2.543 0 50 GFAA O=C(Cc1csc(NC(=O)c2cccs2)n1)N[C@@H]1c2ccccc2C[C@H]1O 175317831 FHVATDKXBKYHFH-RHSMWYFYSA-N 399.497 2.774 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)c1ccc(Cl)cc1Cl 195359475 WGFHSIVDHDSQFC-WUDKWMPASA-N 377.227 2.691 0 50 GFAA COCc1nc(NCc2ccccc2-n2ccnc2C)cc([C@@H]2CCOC2)n1 426388410 MONRRNRIFXRERK-QGZVFWFLSA-N 379.464 3.233 0 50 GFAA O=C(Cn1nccc1[C@@H]1CCCNC1)NCc1csc(Cc2ccccc2)n1 426698254 MHCQGZZAEKTRRD-QGZVFWFLSA-N 395.532 2.714 0 50 GFAA O=C(NCc1noc(Cc2ccccc2)n1)C1CCN(Cc2ccco2)CC1 95391302 UDRLISYFPRENRX-UHFFFAOYSA-N 380.448 2.782 0 50 GFAA Cc1ccncc1C(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 91757365 SLAAXTIEYCEBDV-UHFFFAOYSA-N 378.476 2.830 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4cccc(O)c4)C3)CCC2=O)cn1 91574272 PQBXIJZZWKWRKG-JOCHJYFZSA-N 394.475 2.536 0 50 GFAA Cc1cc(C)n(CCNC(=O)Nc2cc(N3CCOCC3)ccc2Cl)n1 96136053 VKLKSYKJGNBGKU-UHFFFAOYSA-N 377.876 2.812 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Cc3ccccc3Cl)C2)CCC1=O 91575441 MWYKQSKVBJIUSK-HXUWFJFHSA-N 378.900 2.760 0 50 GFAA COCc1nc(N2CCCN(c3ccc(F)cc3)CC2)cc([C@H]2C[C@H](N)C2)n1 244734534 NHHJDHUIZVLJJG-JCNLHEQBSA-N 385.487 2.684 0 50 GFAA COCc1nc(O)cc([C@H]2C[C@H](NC(=O)c3cc4ccc(OC)cc4n3C)C2)n1 253535226 KTNOMKGAJQKEAL-HDJSIYSDSA-N 396.447 2.505 0 50 GFAA CC(=O)C[C@@H]1COCCN1C(=O)c1cccc(OCc2cn3ccccc3n2)c1 183865219 MBKPSCJWWAGOST-LJQANCHMSA-N 393.443 2.733 0 50 GFAA CNC(=O)C1(NC(=O)c2cccc(-c3cccc([C@H](C)O)n3)c2)CCCCC1 534632950 MTLNHXJNXMEDPG-HNNXBMFYSA-N 381.476 2.981 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1-c1cccc(C(=O)N2CCNC(=O)C2)c1 534592730 HHBPIXPDZBFXAH-UHFFFAOYSA-N 388.471 2.787 0 50 GFAA Cc1cc(CC(=O)NCC2CCN(C(=O)c3cccc4c3NCCC4)CC2)on1 827861834 TVHZUHGVFWSFJT-UHFFFAOYSA-N 396.491 2.552 0 50 GFAA COCC(=O)Nc1ccc(OC)cc1NC(=O)c1ccc(-n2ccnc2)cc1 824313224 VYHXZMKHBUEBFX-UHFFFAOYSA-N 380.404 2.718 0 50 GFAA Cc1cc(C)n(CCCC(=O)NCC2(N3CCOCC3)CCCCCC2)n1 584886524 VFQPMYGDHOTUGX-UHFFFAOYSA-N 376.545 2.822 0 50 GFAA Cc1cccc(-c2ccccc2C(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1 670445208 MGNOAUUSUAKVOV-IBGZPJMESA-N 379.504 2.979 0 50 GFAA COc1cc(Br)cc(NC(=O)N2CC[S@@](=O)CC[C@H]2C)c1 408041990 JFKPSHIQEQFXBL-UZJPJQLHSA-N 375.288 2.833 0 50 GFAA CN1CC[C@H](NC(=O)N2CCc3ccnc(O)c3C2)[C@H]1c1ccc(F)c(F)c1 277101044 OZQFWZKIQMFLHD-ZWKOTPCHSA-N 388.418 2.579 0 50 GFAA CCN1CCCN(C(=O)N[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)CC1=O 189874347 DYNINBVTFMILEV-GFCCVEGCSA-N 391.859 2.715 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCCN(C(=O)c2ccco2)CC1 1506397311 AVIZLSYXGKHFJT-UHFFFAOYSA-N 391.431 2.802 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(Cc3ccc4c(c3)OCCO4)C1)CC2 1704338049 KDRNZENIXWDGAI-JOCHJYFZSA-N 380.492 2.794 0 50 GFAA CCN(CCn1cccn1)C(=O)[C@H]1CCC(=O)N(CCCc2ccccc2)C1 11714041 FQKLDVNXLGUHBJ-FQEVSTJZSA-N 382.508 2.603 0 50 GFAA CCN(Cc1ccccc1)C(=O)C[C@]1(c2cccc(F)c2)CC(=O)N(C)C1=O 11997142 BXUWLKVGDYRLTK-QFIPXVFZSA-N 382.435 2.891 0 50 GFAA O=C(NC1CC1)C1CCN(C2CCN(C(=O)c3cc(F)ccc3F)CC2)CC1 12112240 ABUFISBHKQXEIP-UHFFFAOYSA-N 391.462 2.560 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCc2ccc(OC)cc2)c1=O 14884481 KNBLZSVRIZRWCG-UHFFFAOYSA-N 397.475 2.652 0 50 GFAA CC(C)C(=O)NCCc1nnc(SC[C@@H]2CCCO2)n1-c1ccccc1F 14999978 CDVOYHVUDYJYQJ-AWEZNQCLSA-N 392.500 2.992 0 50 GFAA CCOCCCNC(=O)c1cn(C2CCCC2)cc(C(=O)N[C@@H](C)CC)c1=O 15001372 ZJUJPESLVJZXSO-HNNXBMFYSA-N 391.512 2.648 0 50 GFAA O=C(NCCCN1CCOCC1)c1cccnc1-c1nc2ccccc2s1 16490107 UUSLIRFZLRJAFT-UHFFFAOYSA-N 382.489 2.810 0 50 GFAA CCOc1cc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)ccc1Br 18152903 POMZXPCROGGSES-PHIMTYICSA-N 378.288 2.646 0 50 GFAA COc1cccc(C[C@@]2(CO)CCCN(S(=O)(=O)Cc3ccccc3)C2)c1 19535858 UPPZKWAOFVAJPD-NRFANRHFSA-N 389.517 2.842 0 50 GFAA O=C(c1cccc(Cl)c1)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857667807 NDYXTAAWUQHKPO-OALUTQOASA-N 384.863 2.982 0 50 GFAA CC(C)CCCN1CC2(CCN(C(=O)c3ccncc3F)CC2)OCCC1=O 1857726063 VKJNPWQFCJTMEU-UHFFFAOYSA-N 391.487 2.881 0 50 GFAA O=C1CCO[C@H]2CN(c3ncnc4cccc(F)c34)C[C@@H]2N1Cc1ccccc1 1857729923 JBVAFONBUCOJNE-OALUTQOASA-N 392.434 2.775 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857735853 CNFWXLLGPRXSJU-GMAHTHKFSA-N 380.488 2.999 0 50 GFAA Cc1ccc(C)c2c(=O)cc(CN3CC[C@@H](O)[C@](CC4CC4)(C(=O)O)C3)[nH]c12 1875248151 ZPRSQRUNFBXEMK-XMSQKQJNSA-N 384.476 2.583 0 50 GFAA O=C1CC[C@@H]2CN(c3nc4ccccc4o3)CC[C@@H]2N1CCCn1ccnc1 216209823 IMZPBEZGFUTPKH-AEFFLSMTSA-N 379.464 2.932 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccc1 248051503 XGJMNIUXTNPFOZ-MOPGFXCFSA-N 380.492 2.609 0 50 GFAA C[C@H](COC(=O)c1ccnc(C(F)(F)F)c1)N1C(=O)c2ccccc2C1=O 809003146 QHZBYSVYJFXULQ-SNVBAGLBSA-N 378.306 2.942 0 50 GFAA FC(F)Cn1ncnc1CN1CC[C@@](c2nc(C3CC3)no2)(C(F)(F)F)C1 952891119 AGVRMTPRLWEDIY-CQSZACIVSA-N 392.332 2.510 0 50 GFAA O=C(Cn1nc(C(F)F)c2c1CCC2)N=c1ccn(-c2ncccc2Cl)[nH]1 1875317150 PJSSAPYUHMUYBL-UHFFFAOYSA-N 392.797 2.604 0 50 GFAA CN1CCC(n2nc([C@@H]3CCOC3)nc2-c2n[nH]c3c2CC(F)(F)CC3)CC1 1875331381 XQVIQFZDZMQWHM-GFCCVEGCSA-N 392.454 2.563 0 50 GFAA CCCC1(C(=O)NC[C@@]2(C)CN(C(=O)c3cnn(C(C)C)c3)CCO2)CCC1 1775993116 ZRLIYODVXSXNHQ-FQEVSTJZSA-N 390.528 2.782 0 50 GFAA C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)NCc1ccccc1CN(C)C(=O)C1CC1 1775996893 MAHJRGYJZCFYNS-VLIAUNLRSA-N 380.492 2.760 0 50 GFAA COC(=O)c1cc(C(=O)Nc2cc(C(=O)OC)n(Cc3ccccc3)c2)ccn1 2325745670 RUGWCCQACSSQJX-UHFFFAOYSA-N 393.399 2.757 0 50 GFAA CC(C)c1[nH]nc(C(N)=O)c1NC(=O)c1n[nH]c2ccc(C(F)(F)F)cc12 2325852427 FHEYBHINVDAYPT-UHFFFAOYSA-N 380.330 2.779 0 50 GFAA Cc1n[nH]c(C)c1CCc1nnc2n1[C@@H](C)C(=O)N(Cc1cccc(F)c1)C2 2356142622 ZRYNEWBGYUNOMT-AWEZNQCLSA-N 382.443 2.646 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2c[nH]nc2C2CCCCC2)C1=O 2356154499 XZAOMQYJQGIAIX-NRFANRHFSA-N 388.512 2.701 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCN[C@H](c2ccccc2)C1 2356158256 ZXYSCSXHMMRYBD-SFHVURJKSA-N 397.544 2.686 0 50 GFAA Cc1ccn(CCC(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)n1 55037011 HOJVLPVWXQGNDN-OAQYLSRUSA-N 395.551 2.703 0 50 GFAA COc1ccc(Cl)cc1NC(=O)N1CCC(C(N)=O)(N2CCCCC2)CC1 9875279 UKPRWQGEKGZONK-UHFFFAOYSA-N 394.903 2.686 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)/C=C/c2cncc(F)c2)c1 133962217 QDPNKIADFDSOFA-GORDUTHDSA-N 382.800 2.595 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1cccc(I)c1)[C@H]1C=C[C@H]2C12CC2 101376624 GVCLEJYIORRMRZ-MQYQWHSLSA-N 391.208 2.993 0 50 GFAA Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NC[C@H](C[C@H](C)O)c1ccccc1)C2=O 247693658 SXBRAVPNPXGHLK-JZXOWHBKSA-N 394.471 2.650 0 50 GFAA Cc1c(O)cccc1C(=O)N1CCc2nnc(CCc3ccccc3)n2CC1 67884008 SYBPBVQGDPLINR-UHFFFAOYSA-N 376.460 2.776 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20149561 VBTINEYMQZBFCA-IBGZPJMESA-N 382.460 2.917 0 50 GFAA Cc1cc(CNC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)on1 252484830 GJBJJOIXOAURGB-UHFFFAOYSA-N 378.454 2.526 0 50 GFAA COc1nc2c(cc1CN[C@H](C)C1CCC1)C(=O)N(CCc1ccccn1)C2 71750426 LBTAHGDBZZSTMW-OAHLLOKOSA-N 380.492 2.962 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)cc1OC 39516297 ZRXUZYATBUVKKV-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA O=C(CCCc1ccccc1)N1CCN(C(=O)CC2C[C@@H]3CC[C@H](C2)N3)CC1 154493889 MNZODQUPCWIYSU-SEJPIABJSA-N 383.536 2.601 0 50 GFAA COCc1noc(CN[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)n1 366426216 YJDOHVGNLPHONC-LPHOPBHVSA-N 399.422 2.896 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cccc3nonc23)C[C@H]1CCO 36385803 XXLBMFOSCVWZAC-LJQANCHMSA-N 396.491 2.690 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)NC[C@H](c1ccccn1)N1CCOCC1 216535915 KKLBSEGGTBLSTR-OAQYLSRUSA-N 378.476 2.685 0 50 GFAA CCn1cc([C@@H]2CS(=O)(=O)CCN2Cc2cccc3c2OC(C)(C)C3)cn1 377839784 MGXDCSJHSJFQGD-SFHVURJKSA-N 389.521 2.588 0 50 GFAA CCN1C[C@@]2(CCCN(C(=O)c3cc(-c4ccccc4O)n[nH]3)C2)CCC1=O 72418063 FMFGGDCSUWEWHJ-OAQYLSRUSA-N 382.464 2.647 0 50 GFAA C[C@@H]1CN(CCCCNC(=O)c2cc(N(C)C)c3ccccc3n2)C[C@@H](C)O1 241657590 PXNHVQLROSGRQR-IAGOWNOFSA-N 384.524 2.920 0 50 GFAA CS(=O)(=O)c1ccc(-c2nccn2-c2ccccc2CN2CCOCC2)cc1 72148520 SELREVCQDHZXTK-UHFFFAOYSA-N 397.500 2.775 0 50 GFAA CN(C)C(=O)NCc1cc2n(n1)CCCN(Cc1ccc(Cl)cc1F)C2 82137346 VREPKIKJVLUONR-UHFFFAOYSA-N 379.867 2.853 0 50 GFAA NC(=O)COc1ccc([C@@H]2CC(=O)Nc3c2ncn3-c2cccc(Cl)c2)cc1 40284244 MTTMGNGCMKKWBJ-INIZCTEOSA-N 396.834 2.864 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2CC(=O)N(C3CC3)C2)cc1NC(=O)c1ccccc1 176804307 CZWSAPIXTCHMHB-QGZVFWFLSA-N 377.444 2.740 0 50 GFAA C[C@@H](Cc1cccnc1)NC1CCN(c2cccc(N3CCNC3=O)c2)CC1 142803319 COXLFNDTECQCNW-KRWDZBQOSA-N 379.508 2.801 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2cccc(C)n2)CC3)cn1 91915271 CVPHGDJWVYEYIU-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA CCn1cnnc1CN1CCC(Oc2ccc(C(=O)N3CCCC3)cc2)CC1 95526191 JTVCLVGXVLHUTA-UHFFFAOYSA-N 383.496 2.577 0 50 GFAA Cc1ncoc1C(=O)N1CCc2[nH]nc(-c3cccc4c3OC(F)(F)O4)c2C1 23158782 DMLUEIQQGYGZEG-UHFFFAOYSA-N 388.330 2.893 0 50 GFAA CN(C)CCN1C[C@]2(CCCN(C(=O)c3cnc4ccccc4c3)C2)CCC1=O 95513188 JDNBZLLXBVBYGJ-QHCPKHFHSA-N 394.519 2.641 0 50 GFAA O=C(N[C@H]1CCS(=O)(=O)C1)N1CCCC(c2ccccc2)(c2ccccc2)C1 91320044 QPRFTVSDMVQSTM-FQEVSTJZSA-N 398.528 2.965 0 50 GFAA CC(=O)Nc1sc(NC(=O)c2n[nH]c3c2COCC3)nc1-c1ccccc1 1940193510 IPJYIMGANGRTEX-UHFFFAOYSA-N 383.433 2.817 0 50 GFAA Cc1cc(Cl)ccc1NC(=O)N1C[C@H]2COCC[C@@]2(O)[C@@H]2COCC[C@@H]21 299783587 WJZCQABXWOQTFO-PZFZOXMESA-N 380.872 2.669 0 50 GFAA NS(=O)(=O)c1ccc(Cl)c(NC(=O)N[C@@H]2COC3(CCCCC3)C2)c1 299761259 TWPPMIVNLOYKNR-NSHDSACASA-N 387.889 2.601 0 50 GFAA CC(C)c1nccc(CN2CCOC3(CCN([C@H]4CCSC4)CC3)C2)n1 822280241 RFBNPXUZTOWGRB-SFHVURJKSA-N 376.570 2.772 0 50 GFAA COc1cccc2c1OC[C@@H](NS(=O)(=O)c1ccc(-c3cc(C)no3)o1)C2 824804793 MMTVYISJCFIWQI-ZDUSSCGKSA-N 390.417 2.534 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)c2ccc3c(c2)CCCO3)C1)c1cncc(F)c1 826630314 OERAAGOISJWQOP-OAHLLOKOSA-N 397.450 2.828 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)S(=O)(=O)c1ccsc1C(=O)O 1506421376 OYLGHTUMSXFFHC-UHFFFAOYSA-N 393.490 2.884 0 50 GFAA O=C(NCC1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1)c1cscn1 952860239 IXDVDJYKBYBSKB-UHFFFAOYSA-N 399.925 2.627 0 50 GFAA Cc1nccn1CCC(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565512709 SHGPTSDLXFJIHL-NQIIRXRSSA-N 378.520 2.672 0 50 GFAA O=C(Cc1cccs1)NCC1CCN(Cc2nc(-c3ccco3)no2)CC1 952869763 ZXCDHPVLDGROAM-UHFFFAOYSA-N 386.477 2.962 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C)CC1 186638150 UTEGLOXZSLGFCL-AWEZNQCLSA-N 382.888 2.813 0 50 GFAA CCS(=O)(=O)N1CC(CNC(=O)c2cc(-c3ccco3)nc3ccccc23)C1 188538860 HOENILCJTLOCLZ-UHFFFAOYSA-N 399.472 2.506 0 50 GFAA Cc1cc(C(=O)N(Cc2cccnc2)C[C@@H]2CCC(=O)N2)cc2sc(N)nc12 1506423862 GPKKRYLHTBHYIO-HNNXBMFYSA-N 395.488 2.503 0 50 GFAA O=C(CCn1c(O)nc2ccccc21)N(Cc1ccncc1)C[C@@H]1CCCO1 1506399039 XLHJBOIPGRGKHK-KRWDZBQOSA-N 380.448 2.735 0 50 GFAA COc1ccc(N(CC(=O)Nc2cc(Cl)ccc2OC)S(C)(=O)=O)cc1 1172601 WWHCZSLSBOLRIQ-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA O=C(c1nn(Cc2ccccc2)c2ncccc12)N1CCC[C@@H](C2(O)CC2)C1 1772813151 XLEUOUVGUQIBLW-QGZVFWFLSA-N 376.460 2.857 0 50 GFAA O=C(c1cccnc1)[C@H]1CCCN(Cc2nc(-c3ccc4c(c3)OCO4)no2)C1 11712006 FDNYZRCUYUXALB-INIZCTEOSA-N 392.415 2.955 0 50 GFAA C[C@@H](Cn1cncn1)NC(=O)c1cc(COc2cccc(C(F)(F)F)c2)on1 12466317 KFIQPPPUQCZNBO-NSHDSACASA-N 395.341 2.682 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@@H](NCCOC(C)C)C2 14731448 CUZMNPONZODXDN-MRXNPFEDSA-N 388.512 2.640 0 50 GFAA O=C(c1cccc2c1OCCO2)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1857710398 VJTUOBRETXLHPG-OXQOHEQNSA-N 390.439 2.682 0 50 GFAA O=C(Cc1ccccc1)NC[C@H]1[C@H]2CN(c3ccncc3F)C[C@]23CC[C@H]1O3 1857714527 CLCQCPPONNPRKZ-VTAPXXACSA-N 381.451 2.563 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NC[C@H]1Cc2ccccc2CN1C 1857729375 YCAOKSXSDIXEJK-MRXNPFEDSA-N 393.516 2.949 0 50 GFAA OCCOc1cccc(CN2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1 1857740996 XCIIKCKJDFQZLF-QHCPKHFHSA-N 395.503 2.911 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1I)C(=O)O 2385585 CAPUJMUOMAUNOD-NSHDSACASA-N 391.205 2.812 0 50 GFAA in-vitro NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc2c(s1)CCCC2 151810740 OULXTEQKAJGXHM-UHFFFAOYSA-N 385.489 2.815 0 50 GFAA CN1CCN(C(=O)c2csc(Br)c2)C[C@@H]1c1nc(C2CC2)no1 367475574 CUCSLOYGDWNBGI-LLVKDONJSA-N 397.298 2.900 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCc2ccccc2[C@@H]1C(N)=O)c1ccc(Cl)cc1 370787772 HMKTYDLNSRUHOS-AZUAARDMSA-N 399.878 2.519 0 50 GFAA COC1(c2noc([C@@H]3CCc4nnn(C5CCN(C)CC5)c4C3)n2)CCCC1 952894733 QAMCMLOTHFXURR-CQSZACIVSA-N 386.500 2.616 0 50 GFAA O=C(NCc1ccnc(N2CCC[C@@H](O)C2)c1)c1ccc(NC2=NCCC2)cc1 1875270745 JPTGEVKWJRIOMG-LJQANCHMSA-N 393.491 2.577 0 50 GFAA CCc1nnc2n1C[C@H](NC(=O)N1CCC[C@H](c3cc(O)cc(F)c3)C1)CC2 1875293918 HSCDANQGMMUKQZ-XJKSGUPXSA-N 387.459 2.589 0 50 GFAA COc1ccc([C@H]2CCN(C(=O)c3cn4cc(CN)ccc4n3)[C@H]2C)cc1F 1875292359 FTBRUDLKGMKITL-BBRMVZONSA-N 382.439 2.959 0 50 GFAA Cc1ccoc1CC(=O)N1CCC(c2nc(C(F)(F)F)n3c2CNCC3)CC1 1875392956 AUVSEBZLVKTDEE-UHFFFAOYSA-N 396.413 2.855 0 50 GFAA Cc1ccc(C(=O)N(C)[C@@H](C)CCNC(=O)c2cccc3nc[nH]c23)c(N)c1 1875349562 BQHZOFWBNVLOHE-AWEZNQCLSA-N 379.464 2.734 0 50 GFAA NS(=O)(=O)c1cc(C(=O)Nc2nc(C3CCC3)cs2)cc2c1CCC2 1322029515 NVRZUCLSPKWWET-UHFFFAOYSA-N 377.491 2.799 0 50 GFAA O=C(NC1CCN(c2cccnn2)CC1)c1ccc(-c2cnc3cnccn23)cc1 2100482465 AZEKEWFAXBCZFI-UHFFFAOYSA-N 399.458 2.585 0 50 GFAA O=C1C[C@H](C(=O)Nc2c(-c3ccccc3)cnc3ncnn23)C2(CCCC2)O1 2100540753 OPARGAIDGUFTOP-OAHLLOKOSA-N 377.404 2.606 0 50 GFAA O[C@]1(Cn2cnc3c(N4CCC=C(c5ccccc5)C4)ncnc32)CCSC1 2325815507 UAULOZDRBDSZKT-NRFANRHFSA-N 393.516 2.988 0 50 GFAA N[C@@H](C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1)C1CCOCC1 2325855785 OQYZCKLYBOZWJY-GOSISDBHSA-N 377.448 2.831 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)CC1 2325883981 PIQAGJZHWXCZHR-AEFFLSMTSA-N 397.302 2.835 0 50 GFAA COC(=O)[C@@H]1C(=O)C[C@H](c2ccc3c(c2)OCO3)[C@H]1c1ccc2c(c1)OCO2 639896 LGIWOAOMGYWGOB-SMHULIPUSA-N 382.368 2.773 0 50 GFAA Cc1cnc(C)c(N2CCN(c3noc(-c4ccccc4)c3C(=O)O)CC2)n1 2356137165 QYARKTLAUNCACX-UHFFFAOYSA-N 379.420 2.773 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)CCn3c(O)nc4ccccc43)C1)CC2 2356138688 FKIPMWDKHNSLJP-QFIPXVFZSA-N 391.475 2.737 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@H](c3cc(OC)cc(OC)c3)C2)cc1 225498041 ZQUFNENEXXKCAW-IBGZPJMESA-N 390.461 2.823 0 50 GFAA C[C@H](C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)Cc1cccc(F)c1F 912934644 ULNVGBQUIGXFBG-WBMJQRKESA-N 395.427 2.908 0 50 GFAA CN(C)C1(CNC(=O)c2ccn(-c3ccc(F)cc3F)n2)Cc2ccccc2C1 464402284 IOSWNTUTQPJBCY-UHFFFAOYSA-N 396.441 2.980 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c(F)ccc(F)c3F)C[C@H]2CCO)CC1 104430836 CBVHPVIBZVPSHG-QGZVFWFLSA-N 399.501 2.845 0 50 GFAA CN(Cc1ccc(-c2nc(O)cc(C(F)(F)F)n2)cc1)C[C@H]1COCCO1 20861267 TXFXMGPQODKBEG-AWEZNQCLSA-N 383.370 2.715 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(C)o3)[C@@H](CCO)C2)c(OC)c1C 20912265 ROEZIAAPEVHJSD-IBGZPJMESA-N 388.508 2.982 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)[C@]2(C)CCCO2)CC1 67934044 WBEBJNDPZHNFJQ-QHCPKHFHSA-N 394.519 2.902 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)CC[S@]1=O 253424850 LEAIVVMXLVBJDW-DLUDVSRJSA-N 398.550 2.778 0 50 GFAA Cc1cc(NC(=O)C(=O)N[C@@H]2CCc3cn[nH]c3C2)ccc1Oc1cccnc1 252537026 KEOXKKCZIYBYGT-MRXNPFEDSA-N 391.431 2.518 0 50 GFAA C[C@H](C(=O)NC1CCCC1)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171806168 NKLDZNAIJBKXEH-QGZVFWFLSA-N 394.519 2.887 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3c(C)cccc3C)CC2)C1 67772872 GZKGBPCQKADDCM-HXUWFJFHSA-N 387.568 2.742 0 50 GFAA CCN1CCN(c2nccc(C3(c4ccccc4Cl)CCNCC3)n2)CC1 72479824 LRIZELVZCWOHHA-UHFFFAOYSA-N 385.943 2.941 0 50 GFAA COc1ccc2cc(NC(=O)[C@@H]3OCC(=O)N(C)[C@H]3c3ccccc3)ccc2n1 435736895 CICCPNCWDGGDRF-LEWJYISDSA-N 391.427 2.780 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)[C@@H]1CC(Cc2ccc3c(c2)OCO3)=NO1 12279755 FGBXTGZHUBASFB-KRWDZBQOSA-N 399.472 2.754 0 50 GFAA O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@H](N2CCCC2)C1 363099260 FOUUFXLIMINOEW-WIYDYVBHSA-N 399.579 2.891 0 50 GFAA NC(=O)c1ccc(-c2noc([C@@H]3CCCN(C(=O)Cc4ccccc4)C3)n2)cc1 363948191 QFYMDVFVOGKFNS-GOSISDBHSA-N 390.443 2.784 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)N1CCC[C@@](O)(CN(C)C)C1 72141884 AOLWVJHHAVZFOG-LJQANCHMSA-N 377.872 2.832 0 50 GFAA CN(Cc1cnc(NC[C@@H]2CCCO2)nc1)Cc1nc(-c2ccccc2)no1 72144432 GDYRSXHKWDJXAS-KRWDZBQOSA-N 380.452 2.750 0 50 GFAA O=C(CCN1CCN(c2cc(F)ccc2F)CC1)NC(=O)Nc1ccccc1 495251689 SFLMFWSWIYOKDS-UHFFFAOYSA-N 388.418 2.825 0 50 GFAA Cn1cc(NC(=O)N[C@@H]2CCCC[C@H]2S(C)(=O)=O)c(C2CCCCC2)n1 333681581 PNODJWSOHXTHFL-GDBMZVCRSA-N 382.530 2.945 0 50 GFAA Cc1nc2n(n1)C[C@H](NC(=O)NC[C@@H]1CCCCN(Cc3ccccc3)C1)CC2 378110780 LRRLDWMFVZWBKR-VQTJNVASSA-N 396.539 2.503 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)c(F)c1 242155929 WUKBNEMERJCYHZ-UHFFFAOYSA-N 386.832 2.990 0 50 GFAA O=C(c1ccc(Br)nc1)N1CCN(c2ccc(Cl)cn2)CC1 173348715 VDDKKWVXBYQRGJ-UHFFFAOYSA-N 381.661 2.855 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@H](Cn2cc(C3CCCC3)nn2)C1 48090846 FHGORRZYJHYCIF-HNNXBMFYSA-N 379.468 2.531 0 50 GFAA CS(=O)(=O)c1cnc(COc2cccc(Cl)c2)nc1[C@H]1CCCNC1 71770894 RXXZUHDQECAEML-LBPRGKRZSA-N 381.885 2.580 0 50 GFAA COC1(c2nc(Cc3ccccc3)no2)CCN(Cc2cn(C)nc2C)CC1 284610137 XHSJMKZZMJPCCT-UHFFFAOYSA-N 381.480 2.840 0 50 GFAA CCc1ccccc1NC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@@H]2OC(C)(C)O[C@@H]12 229966359 FMWYZWRRCNHKLR-XSDHEKCYSA-N 377.437 2.584 0 50 GFAA CO[C@H](C)c1nc(CS(=O)(=O)c2nnc(C)n2Cc2ccccc2)cs1 176945827 LVZUIFWZUZPAKE-GFCCVEGCSA-N 392.506 2.773 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)c1ccccc1N1CCOCC1 194727837 ZDOXOCWKRSLDCI-UHFFFAOYSA-N 376.460 2.698 0 50 GFAA CC(C)C(=O)NCC(=O)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2)C1 426392636 ATRLCTSMNPRRQC-HSZRJFAPSA-N 385.552 2.706 0 50 GFAA NC(=O)[C@H]1CCCN(Cc2cc(Cl)ccc2OCCCn2ccnc2)C1 223797970 HEFQWIUCYCMLMJ-HNNXBMFYSA-N 376.888 2.703 0 50 GFAA O=C(O)Cn1nccc1[C@@H]1CCCN(C(=O)C2=Cc3ccccc3OC=C2)C1 426575039 ONXSQICMVHOYOF-QGZVFWFLSA-N 379.416 2.663 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(C(=O)Cc3cccs3)CC2)CC1=O 91621142 COGJSECGSGVDAC-UHFFFAOYSA-N 387.505 2.937 0 50 GFAA OCCC[C@@H]1CN(Cc2c(Cl)cncc2Cl)CC[C@@H]1N1CCOCC1 91966569 FMLYUUSZOYHYTB-KDOFPFPSSA-N 388.339 2.684 0 50 GFAA CSCc1ccc(C(=O)N2C[C@@H]3CN(C4CCCC4)C[C@]3(C(=O)O)C2)o1 96137706 DPZHEXOOZVFVIM-DJJJIMSYSA-N 378.494 2.544 0 50 GFAA CCc1c(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)csc1C 91860514 SZAYJTHXFCGMGG-APWZRJJASA-N 380.554 2.554 0 50 GFAA O=C(Cc1ccccc1O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 91526214 SZEGURHEZHQBNN-UHFFFAOYSA-N 382.508 2.986 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC(c2nccn2Cc2ccncc2)CC1 95530998 HIIBZBJGPZWQGG-UHFFFAOYSA-N 378.480 2.778 0 50 GFAA COCCN(C)C[C@@H]1CN(c2cc(C)c3ccc(SC)cc3n2)C[C@@H]1CO 92081814 HJHKQUUVHQZXGP-IAGOWNOFSA-N 389.565 2.888 0 50 GFAA Cc1cnc(C(C)(C)NCC(=O)Nc2cc(-n3cnnn3)ccc2Cl)s1 183975203 FSQCKIAVQVBSCN-UHFFFAOYSA-N 391.888 2.544 0 50 GFAA COc1ccccc1-c1nc(C(=O)N(CCC(=O)O)C[C@@H]2CCCO2)cs1 299753846 ZOBDJMRJCSSPML-ZDUSSCGKSA-N 390.461 2.915 0 50 GFAA Cc1oc(CNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1C(=O)O 299750889 OQHBMPZHQUWRRZ-NVXWUHKLSA-N 390.823 2.775 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)Nc4ccccc4OC)c3CO2)cc1 263615858 FONDKAZCSGJEDU-SFHVURJKSA-N 380.404 2.819 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)NCc1cccc(-c2nn[nH]n2)c1 534670826 NNDJILVUVFSXPU-UHFFFAOYSA-N 383.481 2.544 0 50 GFAA C[C@@H](OC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)NC(=O)Nc1ccccc1 222025385 CTZAOWQTDUCFMH-WSACYYNKSA-N 386.448 2.598 0 50 GFAA CC(C)CN1CC[C@H](C(=O)N2C[C@@H]3[C@@H](CC[C@H]3NC(=O)OC(C)(C)C)C2)C1 222298768 UTBBBJFCODTSID-WNRNVDISSA-N 379.545 2.726 0 50 GFAA CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)N(Cc1cccnc1)Cc1ccco1 170596631 LTLWTWLDYKGEQE-HNNXBMFYSA-N 383.370 2.907 0 50 GFAA COC(=O)C[C@@H](NC(=O)C(=O)Nc1nc(C(C)(C)C)cs1)c1ccccc1 170609834 OYXUGRNCJAAPJB-CYBMUJFWSA-N 389.477 2.800 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@H](c1ccccc1)[C@H]1CCCO1 170680081 FIKKBHRRTJQLKI-RTBURBONSA-N 377.448 2.987 0 50 GFAA Cc1nccn1C[C@H](C)CNC(=O)[C@H]1Cc2cc(Br)ccc2O1 194140967 YJWPDJBGXURLKJ-BDJLRTHQSA-N 378.270 2.710 0 50 GFAA Cc1noc([C@@H]2CCCN2S(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n1 1506408867 MWXWTUCUGJLJTL-ZDUSSCGKSA-N 393.494 2.972 0 50 GFAA O=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC1CCCC1 663962 BUNFBQGOHLPLSR-UHFFFAOYSA-N 380.510 2.735 0 50 GFAA Cc1cc2n(n1)CCN(C(=O)[C@H]1CCc3sc(-c4ccncc4)nc3C1)C2 1772816726 TXXHOVSDKAGWSV-HNNXBMFYSA-N 379.489 2.857 0 50 GFAA O=C(c1c(F)cccc1F)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697937 YBWPLOVZYRXBPI-UHFFFAOYSA-N 396.401 2.856 0 50 GFAA Cc1cc2c(c(-c3cnccn3)c1)O[C@@H](CNC(=O)Cn1cnc3ccccc31)C2 11995248 UQMVMPWDQUZXCY-QGZVFWFLSA-N 399.454 2.922 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(-n3cccn3)c2)o1 12053295 VJNWZNMTIRZQJM-MRXNPFEDSA-N 380.404 2.717 0 50 GFAA C[C@@H](CN1CCCC1)CN(C)C(=O)c1cn(Cc2ccccc2Cl)nn1 12072941 CZJNLAKMSKKHSH-OAHLLOKOSA-N 375.904 2.784 0 50 GFAA CCN1CCN(C(=O)[C@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1 14955335 AXFLSTBLNZEBSO-INIZCTEOSA-N 397.441 2.608 0 50 GFAA Cc1c(CC(=O)NC[C@H]2COCCO2)c2c(n1CC(C)C)CC(C)(C)CC2=O 15063547 IUXDMOPYNCRQLW-INIZCTEOSA-N 390.524 2.682 0 50 GFAA CCN(CC1CCN(C2CCN(C)CC2)CC1)C(=O)[C@@H]1CCCCCN1C 19223659 HMHAGHVURVZHOS-NRFANRHFSA-N 378.605 2.516 0 50 GFAA COCCNC(=O)CN(c1ccccc1Cl)S(=O)(=O)c1ccc(C)cc1 2959021 YBNRPYBGZRSLSP-UHFFFAOYSA-N 396.896 2.606 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cccc(N4CCCC4)c3)CC2)c2n1CCNC2 1857528783 USUIOJAKHODKOT-UHFFFAOYSA-N 393.535 2.915 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2cc(Cl)cn2)C[C@@H]1O)c1cncc(-c2ccoc2)c1 1857531177 HKSCPVDSBFJAFM-IGNZVWTISA-N 386.839 2.761 0 50 GFAA O=C(c1cscn1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857695621 RIFYEPPVWCANMM-HXUWFJFHSA-N 393.472 2.821 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)CCC(=O)NC1CCCC1)CC2 1857695666 SYQJDWGCBYJWLN-UHFFFAOYSA-N 394.519 2.853 0 50 GFAA COC(=O)CCCC(=O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857710999 GIIKHCDJPSJRLI-QZTJIDSGSA-N 375.465 2.604 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccs4)[C@H]4CC[C@]3(C2)O4)n1 1857723853 ZHTYNRJXXLOSER-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA Cc1ccc(F)cc1CNC(=O)[C@@H]1CC(=O)N(c2nnc(C(C)C)s2)C1 1857726856 GJJRSFSTCPHUIE-CYBMUJFWSA-N 376.457 2.778 0 50 GFAA CN1C[C@H](C(=O)N2CCCN(c3ccc(F)c(F)c3)CC2)c2ccccc2C1=O 375204488 HMYSOFFJBAZPCH-SFHVURJKSA-N 399.441 2.873 0 50 GFAA COCCn1ncc2c1[C@@H](NC(=O)c1cc(Nc3ccccc3)ncn1)CCC2 1875258358 LVLIHYBHCYXOAE-KRWDZBQOSA-N 392.463 2.871 0 50 GFAA CCN1CCN(C(=O)c2cc(Cl)ccc2OC[C@@H]2C[N@@]2CC2CC2)CC1 1875383827 BJUHJPFUZVQMCY-BXKMTCNYSA-N 377.916 2.591 0 50 GFAA CCCN1CCC[C@@]2(CCCN2S(=O)(=O)Cc2ccc(F)cc2F)C1=O 2356151226 YFGWMYSSWOBKIZ-GOSISDBHSA-N 386.464 2.662 0 50 GFAA Cn1cccc(CN2CCC[C@]23CCCN(CCc2ccccc2)C3=O)c1=O 2356153129 SSKBJYRGCCVCFI-QHCPKHFHSA-N 379.504 2.585 0 50 GFAA COC(=O)[C@H](NC(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1)c1cncn1C 225556398 ILJNQJOVELLWKE-FOIQADDNSA-N 393.443 2.885 0 50 GFAA C[C@H]1CN(C(=O)Nc2cccc(N3CCOC3=O)c2)CCN1CC(F)(F)F 135540550 OFCSTZDZQWYNQO-LBPRGKRZSA-N 386.374 2.744 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4ccccc4)CC3)ncn2)n1 65363664 UUSJTULARXPLJM-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA O=S(=O)(c1ccc(-c2ccn[nH]2)o1)N1CCCC[C@H]1CCN1CCCC1 77504759 JLAVNUXXAGSLLA-HNNXBMFYSA-N 378.498 2.699 0 50 GFAA CSCC[C@@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccc2c(c1)OCO2 218321244 DQJNYIPQJDIJKT-OAHLLOKOSA-N 388.493 2.672 0 50 GFAA NC(=O)[C@@H]1C[C@H](C(=O)O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21 253185542 PZLZBGBHBUGRNT-YJYMSZOUSA-N 394.427 2.586 0 50 GFAA CCC(=O)N1CCCC[C@H]1C(=O)N1CC[C@@](O)(Cc2cccc(Cl)c2)C1 331587965 XVMXFORROGRUAJ-FXAWDEMLSA-N 378.900 2.637 0 50 GFAA CCN1C(=O)CC[C@H](C(=O)N2CCC(n3cncc3C)CC2)[C@H]1c1ccncc1 329074970 PJEVJXVDXVNMDK-PZJWPPBQSA-N 395.507 2.750 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@@H]32)c1 72430797 UFVHLDNOOFFQKB-HOJAQTOUSA-N 384.520 2.863 0 50 GFAA C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H]1CCC(=O)N[C@H]1C1CC1 367069258 UQGPCAXSPITCRU-DUXSXAKTSA-N 377.916 2.724 0 50 GFAA COc1ccc(CN2CCN(Cc3cccnc3)CC2)cc1Cn1cccn1 215684658 HSDNLGNJPVYSAY-UHFFFAOYSA-N 377.492 2.653 0 50 GFAA O=S(=O)(c1cccc(-c2ccccc2)c1)N1CC2(CCNCC2)[C@@H]2COC[C@@H]21 333660406 LLLOIXWSKIJTIT-RTWAWAEBSA-N 398.528 2.743 0 50 GFAA CCN1CC2(CCN(Cc3cc(=O)n4c5c(cccc35)CCC4)CC2)OC1=O 72425099 FUUGNIXOSVDEAN-UHFFFAOYSA-N 381.476 2.754 0 50 GFAA O=C1CCc2cc(OCCCC(=O)N[C@H](Cc3ccccc3)C(=O)O)ccc2N1 262389944 FNLNTLRNCMIUCU-LJQANCHMSA-N 396.443 2.542 0 50 GFAA COc1ccc2cc(CN3CCO[C@H](C(N)=O)C3)c(-c3cccs3)nc2c1 72480956 UVBDRNULUOHAHG-KRWDZBQOSA-N 383.473 2.658 0 50 GFAA NC(=O)COc1cccc([C@@H]2CC(=O)Nc3c2ncn3-c2ccc(Cl)cc2)c1 40283832 ITWVUGJNPOEXMG-INIZCTEOSA-N 396.834 2.864 0 50 GFAA Cc1nc(-c2cccs2)sc1C(=O)N1CCN(C[C@@H]2CCOC2)CC1 178087327 KCDRWFIIDYKENR-AWEZNQCLSA-N 377.535 2.974 0 50 GFAA c1cnc(N2CCC(N3CCN([C@H]4CCc5ccccc5C4)CC3)CC2)nc1 95519283 JZQHXKMCTUOGES-QFIPXVFZSA-N 377.536 2.621 0 50 GFAA CC1(C)CN(c2ccc(C(N)=O)nn2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 293201174 URJDOXMVDKCHHG-AWEZNQCLSA-N 380.370 2.951 0 50 GFAA COc1ccccc1[C@@H]1CN(C(=O)CCc2cc(Cl)no2)C[C@H]1C(=O)O 91644091 KFXOEGXIQAZECS-UONOGXRCSA-N 378.812 2.596 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(-c3noc(C4CCC4)n3)[nH]c2C1 95357270 VYORWYVLWRPZNT-GFCCVEGCSA-N 379.420 2.806 0 50 GFAA CN(C)C(=O)[C@@H]1CC[C@](C)(C(=O)NCCc2nc3ccccc3n2C)C1(C)C 91997212 MPBZRAMUEUPPTP-OYHNWAKOSA-N 384.524 2.763 0 50 GFAA Cc1ccc(-n2cnnn2)cc1NC(=O)N1CCCC[C@@H]1CCn1cccn1 299775519 JXJZCRYHSAQQRL-MRXNPFEDSA-N 380.456 2.644 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N(C)Cc2cccc(C(F)(F)F)c2)C1 952989539 SKMUXBUZNPHCDG-CQSZACIVSA-N 380.432 2.740 0 50 GFAA CC(=O)N1CC[C@@H](NC(=O)c2cccc(-n3cccn3)n2)c2ccc(F)cc2C1 185521877 AQFDVYZQGOWRAN-GOSISDBHSA-N 393.422 2.630 0 50 GFAA CC(C)(C)c1cnc(CN2CCC[C@H](c3[nH]ncc3CN3CCOCC3)C2)o1 276124394 XZBIBJQUFAIRBU-INIZCTEOSA-N 387.528 2.907 0 50 GFAA CCS(=O)(=O)C1CCN(C(=O)c2csc(Cc3ccc(F)cc3)n2)CC1 195300006 FPMGKKPZXAIAFA-UHFFFAOYSA-N 396.509 2.912 0 50 GFAA COc1ccc(-c2noc(CN3C(=O)N[C@@](C)(CC(C)C)C3=O)n2)cc1OC 198148791 ZEEOCNKHSPXVGS-IBGZPJMESA-N 388.424 2.610 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529186360 CEJXFFYHZJJZPM-UTKZUKDTSA-N 379.460 2.834 0 50 GFAA COc1ccc(NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1OC 1145905 YIFKWOYNXNFAJB-UHFFFAOYSA-N 392.477 2.546 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)CC(=O)Nc2nc3ccccc3s2)cc1 814436 LGKLNUZYFCCZFX-UHFFFAOYSA-N 375.475 2.864 0 50 GFAA CCc1nc(C)cn1S(=O)(=O)c1ccc(I)cc1 1156659 KBFIHFHPIHAQIM-UHFFFAOYSA-N 376.219 2.596 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)Nc1ccc2c(c1)OCO2 5388479 CDSPMGLBYRCMRK-UHFFFAOYSA-N 383.791 2.931 0 50 GFAA O=C(NCCc1nnc2n1CCN(CC1CCCCC1)CC2)c1ccc(F)cc1 11783366 ZZRVMPSOFNRTCT-UHFFFAOYSA-N 399.514 2.828 0 50 GFAA COC[C@@H]1CCN(C(=O)c2cc(COc3ccc(OC)cc3Cl)[nH]n2)C1 11818988 YJKAMGQPKPVGDX-GFCCVEGCSA-N 379.844 2.759 0 50 GFAA CCOC(=O)C[C@H]1CCCCN1C(=O)c1cn(CCCc2ccccc2)nn1 11843008 AZZFTSUVVYUOHY-GOSISDBHSA-N 384.480 2.859 0 50 GFAA COC(=O)c1cccc(C(=O)N2CCC[C@@H](Nc3ccc4c(c3)OCCO4)C2)c1 11932950 LJOZKHONZCYMME-GOSISDBHSA-N 396.443 2.961 0 50 GFAA CC(C)CCN1CCNC(=O)[C@H]1CC(=O)NCc1ccccc1C(F)(F)F 12075444 ZCBLUEJZULCHDZ-MRXNPFEDSA-N 385.430 2.558 0 50 GFAA COCCNc1ncnc2sc(C(=O)N(C)Cc3nccs3)c(C)c12 14953035 CDGLCLPMASXHDY-UHFFFAOYSA-N 377.495 2.787 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)NCCN2CC[C@@H](c3ccccc3)C2)nn1 14953759 OAQSQIORBCRHMZ-OAQYLSRUSA-N 389.503 2.854 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)[C@H](C)c4ccccc4)nnc23)n1 169781030 HWQAVRYSNPURLU-CYBMUJFWSA-N 376.420 2.762 0 50 GFAA CCNC(=O)C[C@@H]1C(=O)N(c2ccc(F)cc2)C(=O)N1Cc1ccc(F)cc1 2884257 NUXYKGUPCQEZTC-QGZVFWFLSA-N 387.386 2.828 0 50 GFAA CC(C)(C)c1ccc(COC(=O)CNC(=O)CNC(=O)Cc2ccccc2)cc1 2886496 KJWKLZJQULLXEC-UHFFFAOYSA-N 396.487 2.502 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 1464636 DJGDSNJZNRODIA-JMSVASOKSA-N 388.342 2.991 0 50 GFAA COc1c(N2C[C@H]3NCCC[C@@H]3C2)c(C)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 1857526844 AYDPRSBEZLFMKY-CXAGYDPISA-N 397.475 2.540 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCNC(=O)[C@H]1c1cccc(F)c1 1857671288 SIKRQEVSCGTPSL-GOSISDBHSA-N 396.397 2.977 0 50 GFAA O=C(c1ccc2nccnc2c1)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857690416 BNOYDATWIKZELJ-JOCHJYFZSA-N 388.427 2.519 0 50 GFAA Cc1ccc(F)cc1CN1CCC2(CC1)CN(Cc1ncc[nH]1)C[C@@H]2C(=O)O 1857696030 IVDATRNKXJLRMP-GOSISDBHSA-N 386.471 2.656 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)N(C)Cc3[nH]c4ccccc4c3C)CC2=O)s1 1857741268 LAGKCZMTENNULQ-CYBMUJFWSA-N 383.477 2.648 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)cc1 213183387 LTFDPYANKUKVKL-MOPGFXCFSA-N 381.428 2.985 0 50 GFAA CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(N)=O)cn2)C1 773191194 WMOHHPLXOOMKOJ-OAHLLOKOSA-N 377.448 2.570 0 50 GFAA CCNC(=O)Nc1cccc(NC(=O)c2ccc3c(c2)NC(=O)CCN3C)c1 266170025 SUSXOGPBCUOJBK-UHFFFAOYSA-N 381.436 2.859 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CCC(c3cnn(C)c3)CC2)c1 266467587 VFIJEZMQDWSIAC-UHFFFAOYSA-N 380.456 2.505 0 50 GFAA COc1ccc([C@H]2CCCN2C(=O)Nc2cnn(CCN3CCOCC3)c2)cc1 266977367 RIXPFSVPRJQBGY-HXUWFJFHSA-N 399.495 2.593 0 50 GFAA O=C(O)C[C@H](NC(=O)Cc1cc(F)cc2c1OCOC2)c1ccc(F)cc1F 909344120 XDIIVPHOCVDKIE-INIZCTEOSA-N 395.333 2.845 0 50 GFAA COC(=O)c1ccc2sc(N3CCc4c(CC(N)=O)cccc4C3)nc2c1 1875286982 PQIIIJBKXQYVOK-UHFFFAOYSA-N 381.457 2.673 0 50 GFAA CCCN(C(=O)[C@@H]1CCn2nccc2C1)C1CCN(c2cc(C)nc(C)n2)CC1 1875306432 FZDDBVCCHPUDNT-GOSISDBHSA-N 396.539 2.760 0 50 GFAA CCOc1ccc(OCC)c(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1 1065334 JWESFDVCOBFJHL-UHFFFAOYSA-N 390.505 2.995 0 50 GFAA Cn1c(=O)c2c(nc(Oc3ccccc3)n2Cc2ccccc2Cl)n(C)c1=O 1138283 UPROIKSDTLRJAO-UHFFFAOYSA-N 396.834 2.928 0 50 GFAA CN1CCc2c(cccc2S(=O)(=O)NCc2cccc(-c3ncc[nH]3)c2)C1 2325761334 ZNIOGGYGRCEJKE-UHFFFAOYSA-N 382.489 2.543 0 50 GFAA Cc1ccc([C@@H](CC(=O)O)NC(=O)c2nn(-c3ccccc3F)ccc2=O)cc1 2325876790 BLXFOAZWWPHBDW-MRXNPFEDSA-N 395.390 2.626 0 50 GFAA CC(C)=CCN1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CN(C)Cc1cnn(C)c1 2356133955 PAQUVBQWMNVDNP-UEQSERJNSA-N 394.563 2.895 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2nc(-c3ccc(C)cc3)no2)C1=O 2356156991 ZHMNUHCWAKGIIS-OAQYLSRUSA-N 384.480 2.648 0 50 GFAA CN(C[C@H]1COCCO1)C(=O)c1coc(COc2ccc(F)cc2Cl)n1 67724998 JCJMARHLINCJJA-LBPRGKRZSA-N 384.791 2.534 0 50 GFAA Cc1nonc1[C@H]1CCCN1C(=O)c1cc(CN(C)Cc2ccccc2)on1 67677856 HUCPLYWYZBZQDC-GOSISDBHSA-N 381.436 2.975 0 50 GFAA CC(C)c1nc(CNCc2c(C(=O)N3CCOCC3)nc3ccccn23)cs1 20540502 CPGIXUSGCYCOAV-UHFFFAOYSA-N 399.520 2.676 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(N2CCOCC2)c(Cl)c1 10009528 MHJBOMQPKOOPCR-UHFFFAOYSA-N 398.850 2.525 0 50 GFAA C[C@@H](O)Cc1cn(C2CCN(CC(C)(C)CN3CCCCCC3)CC2)nn1 63855628 AOJIKDPSJISXKV-GOSISDBHSA-N 377.577 2.741 0 50 GFAA COCCC(=O)Nc1nn(Cc2ccccc2)c2cccc(N3CCOCC3)c12 72421572 UWNTYXOGTVCPCI-UHFFFAOYSA-N 394.475 2.896 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)ccc1F 328618781 FCMXBZWUMTURAD-LLVKDONJSA-N 391.390 2.890 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2c2ncc(Br)cn2)n1C 328631261 QSEOSGMPVSOPDJ-ZDUSSCGKSA-N 378.274 2.669 0 50 GFAA COc1ccc(OC)c(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCC3)c2)c1 72147010 TZGWYYJWVKGOGJ-UHFFFAOYSA-N 391.445 2.854 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)ncn3)CC2)cc1F 38528333 KVGJJXILZNQAOB-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)nn1 35597973 CCWQWBMLUOLRSM-UHFFFAOYSA-N 387.292 2.603 0 50 GFAA C[C@H]1CN(S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)[C@H]1c1ccccc1 451285365 QTRXTOLKRYRSAV-KBXCAEBGSA-N 379.503 2.613 0 50 GFAA Cc1ccc(N2CC[C@@H](NS(=O)(=O)c3cccc4cnccc34)C2=O)cc1 173392547 KOUSXJBMLBZNJS-GOSISDBHSA-N 381.457 2.627 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)N1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1 71760733 LZVBBQZLKCLPHR-IBGZPJMESA-N 390.443 2.574 0 50 GFAA CCc1nc(NC(=O)NC[C@@H]2CCCN2c2cc(NC)ncn2)sc1C 174354041 QISQNWCEDKKQQV-LBPRGKRZSA-N 375.502 2.636 0 50 GFAA CCCc1cc(C(=O)OCC)c(NC(=O)[C@@H]2[C@H](C(=O)O)[C@H]3CC[C@H]2O3)s1 138680639 WZHXSPWZDFLGBW-YIYPIFLZSA-N 381.450 2.694 0 50 GFAA CC(C)OCCN1CCC(NC(=O)CN2CCOc3ccc(Cl)cc32)CC1 176679899 SFQUEEVWWHBOAC-UHFFFAOYSA-N 395.931 2.544 0 50 GFAA Cc1cccc(-c2noc(CNC(=O)c3ccc(N4CCOCC4)cc3)n2)c1 82230246 NRQJHJNWWUVRRZ-UHFFFAOYSA-N 378.432 2.812 0 50 GFAA Cc1cccc(CN2CCN(S(=O)(=O)c3c(C)nn(C(F)F)c3C)CC2)c1 20044959 KLQWUHPXGIUOQC-UHFFFAOYSA-N 398.479 2.710 0 50 GFAA CCc1oc(C(=O)N2CC[C@]3(OC)CC[C@H](O)C[C@H]23)cc1CN(CC)CC 426406347 WTKGMJWOZIKXBS-NBHGPNQESA-N 378.513 2.828 0 50 GFAA CC[C@H](OC)C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91636655 VTTRJBZJXGPGFW-KRWDZBQOSA-N 380.435 2.731 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2ncc(F)cc2F)C1 95508805 LKTKCOGCWNASIQ-CQSZACIVSA-N 377.439 2.528 0 50 GFAA CCn1ccnc1C1CCN(C(=O)CCc2nc(-c3ccncc3)no2)CC1 95509452 RLQIGIGLOZVUTL-UHFFFAOYSA-N 380.452 2.687 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1-c1ccc(C(=O)N2CCC[C@@H](C(N)=O)C2)cc1 534671762 FPDBVNFKBLJWEK-CYBMUJFWSA-N 380.370 2.741 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(Oc2cccnc2)CC1 534580317 VFJZGLWKBRCRID-IBGZPJMESA-N 380.492 2.909 0 50 GFAA CCN1CCC(CNC(=O)[C@H]2C[C@@H](c3ccccc3)N3CCC[C@H]23)(N(C)C)CC1 299782467 WZMZTKNZIQSNQJ-BDTNDASRSA-N 398.595 2.744 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)c2cc(OC)c(OC)cc2OC)c1 952990922 XYYKMQGKDCRAOV-UHFFFAOYSA-N 388.420 2.858 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)c2cnn(-c3ccccn3)c2C)n1 952988372 LLNFODHEJIJYHQ-MRXNPFEDSA-N 396.451 2.515 0 50 GFAA CCN1C(=O)CCc2cc(NC(=O)Cn3ccc(=O)c4ccccc43)ccc21 185581214 FKHNNWHITYJDPH-UHFFFAOYSA-N 375.428 2.939 0 50 GFAA CCCCNC(=O)C1(NC(=O)c2cc(N(C)CCOC)ccn2)CCCCC1 170601889 DQEFSPAFFYBPGD-UHFFFAOYSA-N 390.528 2.513 0 50 GFAA COc1ccc(N(CC(=O)Nc2c(C)cccc2C)S(C)(=O)=O)cc1OC 652435 UFEASGJPFVHFIZ-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC2(CO)CCCCC2)ccc1F 1704315468 GAHUXMUIZXYNSI-UHFFFAOYSA-N 391.443 2.980 0 50 GFAA Cc1c(Cl)ccc(S(=O)(=O)N2C[C@@H]3CCCN3C(=O)[C@H]2C)c1Cl 1772707483 ODAYUGFBHFRGJA-MNOVXSKESA-N 377.293 2.686 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@H]1c1nc2ccc(F)cc2[nH]1 1772804061 FAAJSSZQDCNFNR-HNNXBMFYSA-N 385.399 2.504 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCCN4CCOCC4)C3)C2)c1 11818717 VORCEGZNKJEZEB-XMMPIXPASA-N 399.579 2.922 0 50 GFAA COc1cccc(OCc2nc(C(=O)N3CCN(c4ccccn4)CC3)co2)c1 12023891 WZVQGHCEADAUPO-UHFFFAOYSA-N 394.431 2.620 0 50 GFAA Cc1cc(C)n(-c2cccc(CN(C)C(=O)c3cn(C[C@@H]4CCCO4)nn3)c2)n1 12704227 TUKLYNRNLLQOMC-IBGZPJMESA-N 394.479 2.532 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)c4ccccn4)C3)C2=O)c1 15079505 NYXJXEINBNFRGG-JOCHJYFZSA-N 397.450 2.884 0 50 GFAA O=C(NCc1ccco1)C1CCN(S(=O)(=O)CCCc2ccccc2)CC1 16652460 BOVPCPURRPDWNI-UHFFFAOYSA-N 390.505 2.570 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(N[C@H]4CC=CC[C@H]4C(N)=O)CC3)cc2)n1 19144816 XPWYWRHVSBRBEI-YADHBBJMSA-N 393.535 2.868 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)c1 902627 BOFWNPXLFXOZJI-AWEZNQCLSA-N 379.445 2.900 0 50 GFAA aggregator Cn1c(=O)oc2cc(S(=O)(=O)Nc3ccccc3Br)ccc21 968778 MPQFBLYUVDFJGJ-UHFFFAOYSA-N 383.223 2.695 0 50 GFAA Fc1ccc(OCc2nc(-c3cnc4cccnn34)n([C@H]3CCOC3)n2)cc1 1857670496 QHMVGIAMZQAFOU-AWEZNQCLSA-N 380.383 2.667 0 50 GFAA Cc1cncc(N2CCC3(CC2)OCCc2cc(O[C@H]4CCN(C)C4)ccc23)n1 1857678149 CGZIMPFLOCMEGK-FQEVSTJZSA-N 394.519 2.936 0 50 GFAA COc1cc2c(cc1-c1nccn1C1CCN(c3ncccn3)CC1)OCCO2 1857698120 XZPTZJXLLPKVSA-UHFFFAOYSA-N 393.447 2.961 0 50 GFAA OC[C@H]1CCN(Cc2cccc(OCCCCN3CCCCC3)c2)C[C@H]1O 1857715102 BMNXZBPAIOFWCL-IFMALSPDSA-N 376.541 2.507 0 50 GFAA CN(CCNC(=O)[C@@H]1CC(=O)N(c2nc3ccccc3s2)C1)c1ccccc1 1857716787 FCPXTRKIDJNTKY-OAHLLOKOSA-N 394.500 2.902 0 50 GFAA CCOc1cc2c(cc1CN1C[C@@H]3[C@H](CNC(C)=O)[C@H]4CC[C@]3(C1)O4)CCC2 1857724819 FJGRDSCKPZOSER-ZZLPTCMGSA-N 384.520 2.690 0 50 GFAA C[C@]1(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCCN1C(=O)c1ccccc1 116632258 PFEDXFJQLSYEPG-DNVCBOLYSA-N 397.441 2.682 0 50 GFAA O=C(CS(=O)(=O)C1CC1)N1CC2(CCC2)c2cc(Br)ccc21 333445085 QJVAREWZWOKLIS-UHFFFAOYSA-N 384.295 2.795 0 50 GFAA CN1C[C@@H]2COC[C@H](C1)N(C(=O)c1ccc(CSc3ccccn3)cc1)C2 1704311334 FUAKXSWSVGGCLK-HKUYNNGSSA-N 383.517 2.777 0 50 GFAA O=C(N[C@@H]1CCCc2c(F)cc(F)cc21)N1CCC[C@H](c2nc(O)n[nH]2)C1 922649139 SNAUJARVOVIHSF-ZUZCIYMTSA-N 377.395 2.755 0 50 GFAA CN[C@H](Cc1ccccc1)C(=O)N1CCC2(CC1)C[C@@H](N)c1ccccc1O2 1875276708 ROOBXCKYCKLHOK-WOJBJXKFSA-N 379.504 2.661 0 50 GFAA COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C(F)(F)F)nn2C2CC2)C1 1875311004 JDJYEWCRMHXJIP-GHMZBOCLSA-N 388.390 2.834 0 50 GFAA CCn1nc2c(c1C(=O)NCCOc1ncccc1Cl)C[C@H](C)O[C@@H]2C 1875314456 YMTFAEAUMAIUDR-NWDGAFQWSA-N 378.860 2.782 0 50 GFAA Cc1ccccc1CC(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C(=O)c1occ2c1CCOC2 1775993026 YSHMDBGGSXZAOB-DFQSSKMNSA-N 394.471 2.765 0 50 GFAA CN1CCCc2ccc(NC(=O)NCCn3cnc4sccc4c3=O)cc2C1 2325799253 AHVZVWNMIYNOMM-UHFFFAOYSA-N 397.504 2.658 0 50 GFAA CCc1ccc(-c2noc(-c3cccc(S(=O)(=O)N4CCOCC4)c3)n2)cc1 113736088 XQIRXOUQQYKDAV-UHFFFAOYSA-N 399.472 2.987 0 50 GFAA C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCC[C@H]2CCNC2)cc1 246366032 AFBJFHPFOVQJIM-KZNAEPCWSA-N 387.524 2.584 0 50 GFAA Cc1cc2cc(CNC(=O)C[C@H]3C(=O)NCCN3Cc3cccs3)ccc2[nH]1 55344208 VOFROPVCSLLSDW-IBGZPJMESA-N 396.516 2.545 0 50 GFAA Cc1cc(NC(=O)Cn2cc(-c3cccc(-c4noc(C)n4)c3)cn2)n(C)n1 23310500 MTBYOSIZQOSGIU-UHFFFAOYSA-N 377.408 2.589 0 50 GFAA COc1ccc([C@H](NC(=O)NC2(c3noc(C)n3)CCC2)c2nccn2C)cc1 116525146 PONJOBGBDQVUPN-INIZCTEOSA-N 396.451 2.588 0 50 GFAA CCOC(=O)C[C@H]1COCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 20205038 KAQJBIQDFCBFEU-AWEZNQCLSA-N 399.369 2.909 0 50 GFAA O[C@@H](COc1ccccc1-c1cccc(-c2cc[nH]n2)c1)CN1CCOCC1 23312241 WDOUCRRHAIVHGG-LJQANCHMSA-N 379.460 2.816 0 50 GFAA C[C@@H](CCN1CCC(CNC(=O)c2cnn(C)c2)CC1)OCc1ccccc1 252494154 NMHSTOKTHAKNOA-SFHVURJKSA-N 384.524 2.857 0 50 GFAA Cn1ccc2ccc(CN3CCN(Cc4ccc5c(c4)OCO5)C(=O)C3)cc21 215125136 TVZYTWXPKAGGKF-UHFFFAOYSA-N 377.444 2.751 0 50 GFAA Cc1cnc(C(=O)N2CC[C@@]3(CCCN(CCCc4ccccc4)C3=O)C2)cn1 12577393 VWMMKODFKQFSGY-QHCPKHFHSA-N 392.503 2.873 0 50 GFAA CN1CCC[C@@H]1[C@H]1CCCN1C(=O)NCC1CCN(CC(F)(F)F)CC1 364009121 ZPTRZXSZYKCPRS-HZPDHXFCSA-N 376.467 2.529 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CCN([C@H]1CC(=O)N(Cc2ccccc2)C1=O)C3 30904006 RSECRWAEPKOIBM-NRFANRHFSA-N 389.455 2.862 0 50 GFAA biogenic COc1cc(C(F)(F)F)ncc1NC(=O)N[C@@H]1CCN(c2ccccn2)C1 241338610 MCJONUYYCSPWQZ-LLVKDONJSA-N 381.358 2.904 0 50 GFAA COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1CC(=O)Nc1ccc2c(c1)OCCCO2 241588079 OZKMPPVQSRCDFR-OIISXLGYSA-N 388.464 2.593 0 50 GFAA CC(C)N(CCNC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N(C)C1CC1)C(C)C 378487555 GLZTUOJPXGSIDG-GOSISDBHSA-N 378.561 2.538 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)NCc2cccc(C(N)=O)c2)c1 378407615 YGKDTTPBAMOCFN-FQEVSTJZSA-N 393.487 2.713 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)n[nH]1 130691516 ZGUICBRSTIPFJO-LBPRGKRZSA-N 397.410 2.730 0 50 GFAA COC(=O)c1c(NC(=O)CSc2nnc(C)n2C)sc2c1CCCC2 17077808 NNUWOOMBNSLXPT-UHFFFAOYSA-N 380.495 2.581 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CC[C@H](n2cc(Cl)cn2)C1 291000432 QZLLQULRBFNNEF-ROUUACIJSA-N 386.883 2.544 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N(C)Cc1nnc(-c2ccccc2)o1 426547555 FNMWTPUPFCYDKY-HNNXBMFYSA-N 392.415 2.830 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2cc(Br)nn2-c2ccc(C)cc2)C1 178985298 PQKXBHKTLBUONO-ZDUSSCGKSA-N 377.286 2.625 0 50 GFAA O=C(NCc1cnn2cccnc12)Nc1ccc(OC[C@@H]2CCCCO2)cc1 96180490 ZXTIMHFIOQSGMN-SFHVURJKSA-N 381.436 2.999 0 50 GFAA Cc1cccnc1C[C@H](C)NC(=O)Nc1ccc2c(c1)C(=O)N(C1CC1)C2=O 96138795 PUVJEILIDYJYPY-ZDUSSCGKSA-N 378.432 2.901 0 50 GFAA Cc1ccccc1COC1CN(C(=O)CN2C[C@H](c3ccccc3)CC2=O)C1 95529203 VDSPKUPBDLYGMB-HXUWFJFHSA-N 378.472 2.739 0 50 GFAA O=S1(=O)CCC[C@@H](CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1 293399264 RCQALJOYCMOINF-FQEVSTJZSA-N 376.566 2.799 0 50 GFAA COc1ccc(-c2ccccc2)cc1NC(=O)N1CCN2CCN(C)C[C@H]2C1 96141411 KKBFWOZCKQXXEE-IBGZPJMESA-N 380.492 2.826 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccc(F)c(Cl)c3)C2)CCC1=O 91858163 AXPOIFNRPFBOSS-IBGZPJMESA-N 382.863 2.970 0 50 GFAA O=C(NCc1ccnc(O[C@@H]2CCOC2)c1)Nc1cnn(-c2ccccc2F)c1 163379197 YFJFWCUSVJAYTL-MRXNPFEDSA-N 397.410 2.896 0 50 GFAA NC(=O)c1ccnc(N2CCC3(CC2)CC(=O)N(Cc2ccc(Cl)cc2)C3)c1 95501175 HMIQYIDYWXVYIN-UHFFFAOYSA-N 398.894 2.853 0 50 GFAA COC(=O)c1cn(-c2ccc(Oc3ccccc3OC)nc2)cc2c(=O)[nH]nc1-2 253414684 YFNQQUFNZCLSHZ-UHFFFAOYSA-N 392.371 2.648 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccco1)c1ccc(NC(N)=O)cc1 299026089 PZEPWSNVLUMGTR-CZUORRHYSA-N 384.436 2.642 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)N(C)C)cc1 534590159 ACCWLWBIIFOYAN-GOSISDBHSA-N 382.464 2.775 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCN(C3CCCCC3)C(=O)C2)c1 823531401 OOEUEJWSCVCTCX-UHFFFAOYSA-N 385.508 2.971 0 50 GFAA O[C@H]1CN(Cc2cnc(-c3ccccn3)nc2)CC[C@@H]1c1ccc2c(c1)OCO2 1565517184 XPTLPLPEPHIBED-MJGOQNOKSA-N 390.443 2.618 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565516724 KPHNHMIHYZLEHP-UTKZUKDTSA-N 380.492 2.588 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(c3nc(-c4ccccc4)no3)C2)N1Cc1cscn1 1565528433 UHMWLNJSWKTYLP-ZBFHGGJFSA-N 381.461 2.821 0 50 GFAA COc1ccccc1NC(=O)CN1CCC[C@@H](CNC(=O)c2ccsc2)C1 952972624 VNRAGCLDQYSYCP-HNNXBMFYSA-N 387.505 2.837 0 50 GFAA O=C1C[C@H](c2ccccc2)N(C(=O)c2ccn(-c3ccc(F)cc3F)n2)CCN1 185191806 LQWXMBLWYMXLOR-LJQANCHMSA-N 396.397 2.854 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1CCN(c2ncccc2Cl)CC1 952989647 WSHOUJJALVMOPP-UHFFFAOYSA-N 380.839 2.549 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)c2cccc3cc(C)cnc23)cn1 275322163 PCBVWHCKEPWOOV-QFBILLFUSA-N 386.477 2.568 0 50 GFAA C[C@@H](NC(=O)[C@H]1COc2ccccc2C1)C(=O)Nc1cccc(N2CCCC2)c1 195356139 HGTWILMJLNDVRX-SJLPKXTDSA-N 393.487 2.981 0 50 GFAA CCOCC(=O)N1CCC(C(=O)Nc2nnc(-c3ccc(C)cc3)s2)CC1 1529158784 LPDUPMIZLHFWCN-UHFFFAOYSA-N 388.493 2.727 0 50 GFAA CCC[C@]1(CO)CN(c2cc(Sc3ccc(F)cc3)nc(N)n2)CC[C@H]1O 1529172330 KJKPTHMJWXKIQG-DNVCBOLYSA-N 392.500 2.699 0 50 GFAA CC(=O)N[C@H](CC(=O)Nc1cccc2c1NC(=O)CO2)c1ccc(F)cc1F 1462384279 INPJSEVKIVWGHO-OAHLLOKOSA-N 389.358 2.502 0 50 GFAA O=C(C[C@@]1(O)C(=O)Nc2ccc(I)cc21)c1cccs1 1159827 DIUYCMRYPRTQIP-AWEZNQCLSA-N 399.209 2.765 0 50 GFAA c1ccc(CC[C@@]23CNC[C@@H]2CN(c2ccc(CN4CCOCC4)cn2)C3)cc1 1772712301 NKGUVJVUKXZVPY-VWNXMTODSA-N 392.547 2.572 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCCN(C(=O)c2ccc(Cl)o2)CC1 1772708825 CLBSIGOCNHVVBX-UHFFFAOYSA-N 392.887 2.591 0 50 GFAA O=C([C@@H]1C[C@H](Sc2ccc(F)cc2)CN1)N1CCN(c2ccccc2)CC1 11782435 ADWZMYDJMYNMOF-PMACEKPBSA-N 385.508 2.997 0 50 GFAA CN(C)c1ccccc1C(=O)N1CCC(n2nccc2NC(=O)C2CC2)CC1 11938331 JHMIQPQNNFOPPM-UHFFFAOYSA-N 381.480 2.775 0 50 GFAA CN(Cc1nc(-c2cnccn2)no1)CC1CCN(Cc2ccccc2)CC1 12002366 YVGVQDJRWHJHSE-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)CCc2ccco2)C1 12195669 VEJFQXYXVOEBSM-QGZVFWFLSA-N 384.480 2.669 0 50 GFAA CC[C@@H](C(=O)Nc1ccc(NC(C)=O)cc1)N(c1ccccc1)S(C)(=O)=O 13711487 LHCGUVQYZWULIY-SFHVURJKSA-N 389.477 2.828 0 50 GFAA Cn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](NCCCc1ccncc1)C2 14732161 RAMACLZQDAVWLG-LJQANCHMSA-N 395.551 2.911 0 50 GFAA Cc1ccccc1CC(=O)N1CCC(n2cc(C(=O)NC3CCCC3)nn2)CC1 15066661 XCMCJYNSMKMOQJ-UHFFFAOYSA-N 395.507 2.665 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)NCCNC(=O)[C@H](CC)Oc1ccccc1 4646640 SVZQXGIJKCQXMN-PMACEKPBSA-N 384.476 2.934 0 50 GFAA CC(C)(Oc1cccc2ccccc12)C(=O)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857669854 UDZIGRVYKWRMRD-KSFYIVLOSA-N 383.444 2.947 0 50 GFAA COc1ccc(-n2ccnc2-c2nccn2[C@H]2COC3(CCNCC3)C2)cc1 1857697538 XTRSHEZCABLMBM-QGZVFWFLSA-N 379.464 2.828 0 50 GFAA COc1cccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c1OC 1857730599 XEEOOVXQXAKQJK-PMACEKPBSA-N 384.476 2.848 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCc3c2[nH]c2ccccc32)c(C)n(C)c(=O)c1C(N)=O 1875249015 DYHUKWDRDWNAIM-OAHLLOKOSA-N 392.459 2.641 0 50 GFAA Cc1cc(S[C@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)ncn1 12000674 JSNBWMRMUOVFOA-SNVBAGLBSA-N 376.507 2.944 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)N1c1ccc(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 249992325 MEXOGPOPICBMII-NNKBLXFJSA-N 390.439 2.678 0 50 GFAA CCc1c(C(=O)N2CCC[C@@H](N)C2)cnn1-c1ccc(Br)cc1 158212592 OIXGJUWDKWULNH-CYBMUJFWSA-N 377.286 2.761 0 50 GFAA CC(C)(CS(C)(=O)=O)NC(=O)c1cc2ccc(C(F)(F)F)cc2nc1O 935386019 HCLGXJOBTJHKMI-UHFFFAOYSA-N 390.383 2.512 0 50 GFAA COc1ccc(CCCN(C)C(=O)c2ccc3[nH]nc(C(=O)O)c3c2)cc1OC 1875299975 FKSNMLACWBNLSW-UHFFFAOYSA-N 397.431 2.983 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ncccc1-c1ccccn1 2325785691 JFWZIOOXQRNCAU-FSPWUOQZSA-N 397.866 2.563 0 50 GFAA COc1ccc(C(=O)N/C(=C\c2ccccc2)C(=O)N[C@H](C(=O)O)C(C)C)cc1 2999558 CKSSKKOBJMOSRS-LJLZWOEMSA-N 396.443 2.692 0 50 GFAA biogenic Cc1noc(NC(=O)CN2C(=O)CN(C)C2=O)c1-c1cccc(C(F)(F)F)c1 2356151016 MSOZCDWYVCYIFM-UHFFFAOYSA-N 396.325 2.501 0 50 GFAA CCOC(=O)Cc1c(C)[nH]c2cc(-c3ccc(Br)cc3)nn2c1=O 4846078 RIPYYJJEDQWYQB-UHFFFAOYSA-N 390.237 2.866 0 50 GFAA Cc1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 8423812 FADUEKOLCPWRGP-UHFFFAOYSA-N 384.910 2.857 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC2CCN(C)CC2)CN1Cc1cccc2ccccc12 20917032 ZFIJTWHNBJLVCK-GMAHTHKFSA-N 394.563 2.603 0 50 GFAA Cc1cc(Br)c2c(c1)[C@](O)([C@H]1C(=O)Nc3ccccc31)C(=O)N2C 101015844 IOKGCPVYEXWMOL-KDOFPFPSSA-N 387.233 2.657 0 50 GFAA COc1cccc(CNc2nc3[nH]c(C)c(Cc4ccccc4)c(=O)n3n2)c1 100281037 NMZNKIYLVVWLEO-UHFFFAOYSA-N 375.432 2.938 0 50 GFAA O=C(O)c1cn(C2CN(C(=O)OCC3c4ccccc4-c4ccccc43)C2)nn1 117966681 VBUVQKCBQJHALG-UHFFFAOYSA-N 390.399 2.782 0 50 GFAA O=C1CC[C@@H](NCc2ccc(-n3cncn3)cc2)CCN1Cc1ccccc1 67695273 JEJCMUSCDNZOGO-HXUWFJFHSA-N 375.476 2.938 0 50 GFAA C[C@@H]1CCCN(S(=O)(=O)N2CCCC[C@H]2[C@@H](C)NC(=O)OC(C)(C)C)C1 229823719 ANOGRMAOSNIZQI-OAGGEKHMSA-N 389.562 2.731 0 50 GFAA COCc1nc2cccnc2n1C1CCN(C(=O)COc2ccccc2)CC1 11784534 LGUAYVKIBSBCAU-UHFFFAOYSA-N 380.448 2.820 0 50 GFAA CCn1cc([C@H]2CS(=O)(=O)CCN2C(=O)c2ccc(C(C)C)s2)cn1 331645080 QBMUFALKNVWAMP-CQSZACIVSA-N 381.523 2.700 0 50 GFAA C[C@H](C(=O)NCCc1nc(C(=O)O)cs1)N1C(=O)c2cccc3cccc1c23 219932403 SSUQWLHQAWOLDI-LLVKDONJSA-N 395.440 2.702 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)CCc3cc(O)no3)CC2)OC1=O 77436502 YHQAYSDEARKOAL-UHFFFAOYSA-N 379.457 2.562 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)cc1F 71388835 BFUITAIJGGWVJN-QGZVFWFLSA-N 389.515 2.789 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(c3ncnc4ccsc34)CC2)C1 71615079 LAXQJAAQGLMYGH-AWEZNQCLSA-N 385.537 2.651 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(N2CCNC2=O)ccc1F 154700473 PODTUSOCZXGHSY-UHFFFAOYSA-N 396.466 2.750 0 50 GFAA CC[C@@H]1CCCCN1C(=O)[C@H](C)N1CCCN(Cc2nc(C)c(C)o2)CC1 370812320 VBXQGDPXKIHVBE-PKOBYXMFSA-N 376.545 2.979 0 50 GFAA CSc1cccc(CN2CCOC[C@@H]2CC(=O)NCCc2ccncc2)c1 72422654 RORCFNKTPUBBMT-IBGZPJMESA-N 385.533 2.753 0 50 GFAA Cc1nccn1CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71751504 IUGYHDFQLCGNGZ-LJQANCHMSA-N 386.471 2.616 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2nc3ccc(Cl)cn3c2F)C1 215657826 AHHAITGHAKTHKN-LBPRGKRZSA-N 380.851 2.847 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)c3ccc4c(c3)OCCCO4)n2)c1 44902363 ZAGKEHKRCDLWBE-UHFFFAOYSA-N 392.411 2.963 0 50 GFAA Cc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1OCC1CCOCC1 132489209 NEIVQTMEERMZLH-KRWDZBQOSA-N 385.468 2.528 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@@H](Cn2cc(C3CCCC3)nn2)C1 48090847 FHGORRZYJHYCIF-OAHLLOKOSA-N 379.468 2.531 0 50 GFAA Cc1nc2ccc(S(=O)(=O)N[C@@H]3CCOC4(CCOCC4)C3)cc2s1 82125223 BSAJTNLLQDTTDY-CYBMUJFWSA-N 382.507 2.611 0 50 GFAA O=C(NCCCn1ncc2ccccc21)N1CCC(O)(c2cccnc2)CC1 426722369 FCEBDBCDDGTHIW-UHFFFAOYSA-N 379.464 2.515 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CCCN(Cc3ccc(-n4ccnc4)nc3)C2)n1 177034573 HLGCJKIDXQESCV-SFHVURJKSA-N 376.464 2.821 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(n2cnnc2)CC1 426597351 DJTOJNMVVYTWHJ-IBGZPJMESA-N 382.512 2.537 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(C)cc1F)CC2 95509788 RKNHMCWVGNFPGD-UHFFFAOYSA-N 384.455 2.783 0 50 GFAA O=C(CCC1CCN(CCc2ncc[nH]2)CC1)N1CCN(c2ccccc2)CC1 95504943 WPGRJGIMCLWAJA-UHFFFAOYSA-N 395.551 2.793 0 50 GFAA O=C(Cn1ccnc1-c1ccccc1)NC1CCN(Cc2cccnc2)CC1 92078413 CXUIKGRXELZPBX-UHFFFAOYSA-N 375.476 2.726 0 50 GFAA C[C@@H](c1ccccc1)N1C(=O)C[C@@H](Nc2ccc(N3CCOCC3)cc2)C1=O 96203286 GRZHBPUNYRXKMH-OXJNMPFZSA-N 379.460 2.824 0 50 GFAA CSc1nccc(N2CCC3(CCC(=O)N(Cc4cnc(C)cn4)C3)CC2)n1 91690122 JNXAJFXHXYOEJW-UHFFFAOYSA-N 398.536 2.706 0 50 GFAA C[C@@H](CNC(=O)N1CCC(NC(=O)C2CC2)CC1)c1nc(-c2ccccc2)no1 179335105 PTDHMCCBFWWUCW-AWEZNQCLSA-N 397.479 2.540 0 50 GFAA CC1(C)SC[C@H](C(=O)N(Cc2ccccc2)Cc2nccs2)NC1=O 97776239 CNSOWFNDTICTGX-CQSZACIVSA-N 375.519 2.682 0 50 GFAA COCCN1C[C@]2(CCCN(Cc3ccc(-c4cc[nH]n4)s3)C2)CCC1=O 91412517 CIRWXIUWBGISPS-HXUWFJFHSA-N 388.537 2.989 0 50 GFAA O=C(O)COc1ccc(Cl)cc1CN1CCOc2ccc(CO)cc2C1 244723593 MEFDUYAXWHZOGI-UHFFFAOYSA-N 377.824 2.690 0 50 GFAA O=C(CCc1ccccn1)N1CCC[C@H](N2CCN(c3ccc(F)cc3)CC2)C1 55227628 YUHBVLMJSBYFBB-QFIPXVFZSA-N 396.510 2.967 0 50 GFAA CNc1ncc(CN(C)C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC)cn1 299759371 RHGFHUJHFFMLOC-UHFFFAOYSA-N 384.440 2.701 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@H]1CCOC[C@@H]1OCc1ccccn1 1565510222 PGULSMCYYYIVOF-WMZOPIPTSA-N 376.840 2.848 0 50 GFAA CN(C)CCOc1cccc(-c2noc([C@H]3CCCN(C(=O)C4CC4)C3)n2)c1 273861851 MERNRZJCXCGMIO-KRWDZBQOSA-N 384.480 2.793 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2cc3ccccc3o2)[C@@H]1c1cnn(C)c1C 275387502 ZDURMWUTAACGMV-HTAPYJJXSA-N 396.491 2.801 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)c1cnc(C)cn1)CC2 275863441 ZLJDNGZNCHIHON-GOSISDBHSA-N 384.505 2.890 0 50 GFAA Cn1c(=O)n(C)c2cc(C(=O)OCC3CCSCC3)c(Br)cc21 170649673 YFCSRFRCNCMTRC-UHFFFAOYSA-N 399.310 2.940 0 50 GFAA Cn1ncc2c(O)nc(CCC(=O)N3CCC(c4ccc(F)cc4)CC3)nc21 752456972 PLUFJEUFOXZYPJ-UHFFFAOYSA-N 383.427 2.547 0 50 GFAA CCOC(=O)C1=C(CSc2ncnc3sc(C)cc23)NC(=O)N[C@H]1C 781896969 FBTCIACGVLISIY-VIFPVBQESA-N 378.479 2.610 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(N3C[C@H](C)O[C@H](C)C3)CC2)cc1F 1529195878 PCBIKSBKDVVKTD-KSMMKXTCSA-N 380.460 2.534 0 50 GFAA CC(C)[C@H](C(=O)Nc1c2c(nn1C)CSC2)n1cnc2ccccc2c1=O 1529152009 ISGCKBCVNFZQJL-MRXNPFEDSA-N 383.477 2.713 0 50 GFAA CNC(=O)Cn1cc(NC(=O)C(C)(C)Oc2cc(C)c(Cl)c(C)c2)cn1 1529126066 UHOXMBCAJJFFLL-UHFFFAOYSA-N 378.860 2.695 0 50 GFAA CC(C)c1cc(C(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)nc(N)n1 1704297840 DHGFTHBCKNNNPM-FOIQADDNSA-N 391.475 2.718 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3c(Cl)cnn3C)CC1)OCC2 1704306291 UIGQQYPSUNQNAF-UHFFFAOYSA-N 375.856 2.786 0 50 GFAA O=C(NCc1nc(C2CC2)no1)[C@H]1CCc2sc(-c3ccncc3)nc2C1 1772810002 BWSZLKLQMNLXMF-ZDUSSCGKSA-N 381.461 2.887 0 50 GFAA CCc1cc(N2CC(=O)N[C@@H](Cc3ccccc3)C2)nc(N2CCCCC2)n1 1772710116 RILNBKYIBZVUSO-IBGZPJMESA-N 379.508 2.577 0 50 GFAA COCC(=O)N1CCc2ccc(NC(=O)CCc3ccccc3OC)cc2C1 11713664 BCQBVKASPBWYGF-UHFFFAOYSA-N 382.460 2.798 0 50 GFAA O=C(NCCc1cnccn1)c1coc(COc2ccc(F)cc2Cl)n1 11841790 ZDSRXOMSZNUVOT-UHFFFAOYSA-N 376.775 2.809 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H](N(C)CCCN(C)C)C2)cc1Cl 19338493 PJYWIAMFZDOOLW-MRXNPFEDSA-N 387.977 2.685 0 50 GFAA CCOc1ccc(CC(=O)N2CCC3(CC2)NC(c2ccccc2)=NO3)cc1 169755016 MBJLXFJCMWPFRL-UHFFFAOYSA-N 379.460 2.928 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC[C@H](c5cc[nH]n5)C4)CC3)nc2n1 1857708226 WOABLCWPPRGZHY-INIZCTEOSA-N 394.479 2.877 0 50 GFAA Cn1cnc2cc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)ccc21 1857738901 CZWJDZIEAMCQRP-LVCYWYKZSA-N 376.460 2.518 0 50 GFAA Cc1cc(C)c(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c(C)c1 112506102 YENPLBZLGCYNEW-FQEVSTJZSA-N 395.551 2.997 0 50 GFAA O=C(CCCc1cccs1)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1 1704314499 TUPOKWQQYCOWTK-GHTZIAJQSA-N 387.501 2.978 0 50 GFAA Cc1nc(-c2cc(NS(=O)(=O)C[C@@H]3CCCO3)cc(C(F)(F)F)c2)n[nH]1 864097416 RXWDPEKLYSCRFH-ZDUSSCGKSA-N 390.387 2.720 0 50 GFAA O=C(Nc1cccnc1Sc1ccccc1)NC1CCS(=O)(=O)CC1 1875265209 NQKNYZAKOOREHH-UHFFFAOYSA-N 377.491 2.932 0 50 GFAA COC(=O)[C@H](Cc1ccccc1)OC(=O)c1ccc([C@@H]2CCCC(=O)N2)cc1 2325780611 AUNUMYCGFDWJLX-OALUTQOASA-N 381.428 2.969 0 50 GFAA Cc1ccc(OCc2ccc(C(=O)N[C@@H]3C[C@@H](Cn4cccn4)C[C@H]3O)o2)cc1 2325785867 RDEWGAFDVICFJV-NSISKUIASA-N 395.459 2.933 0 50 GFAA CC[C@@H](C)OCC(=O)NCC1(NC(=O)c2cnn3cccc(Cl)c23)CCC1 2325793436 UTNRIHKZFIEXLT-CYBMUJFWSA-N 392.887 2.572 0 50 GFAA O=C(N=c1ccn(-c2ccc(Cl)cc2Cl)[nH]1)c1c[nH]nc1[C@@H]1CCNC1 2325857658 KJLODGXCAAGKDQ-SNVBAGLBSA-N 391.262 2.653 0 50 GFAA O=C1NCc2cccc(C(=O)N3CC[C@@]4(CCN(Cc5ccccc5)C4)C3)c21 2325887733 ODHUBZKZUQCIEM-HSZRJFAPSA-N 375.472 2.668 0 50 GFAA O=C1CC[C@H]2C(=O)N(CC(=O)N(C3CCCCC3)C3CCCCC3)C(=O)[C@@H]2C1 2282136 HFEILMMQYYVLAH-RTBURBONSA-N 388.508 2.835 0 50 GFAA O=C(O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1 4676887 KECSIUYPOBCMOK-UHFFFAOYSA-N 384.251 2.725 0 50 GFAA COc1ccc(CNS(=O)(=O)C[C@@]23CC[C@@H](CC2=O)C3(C)C)cc1OC 4795677 ZWRXMUKUJAIOEJ-LIRRHRJNSA-N 381.494 2.519 0 50 GFAA COc1coc(C(=O)N2CCC[C@@H](c3[nH]ncc3Cc3ccccc3)C2)cc1=O 67696662 KVAXFIDZPUHXPL-MRXNPFEDSA-N 393.443 2.982 0 50 GFAA CN(C)CCOc1cccc(CN2CCN(CC(C)(C)C)[C@H](CCO)C2)c1 104329781 DVRMFYKLSVJFKY-HXUWFJFHSA-N 377.573 2.542 0 50 GFAA CC1=C(C(=O)N2CCc3c([nH]c4ccccc34)C2)[C@H](c2cccnc2)NC(=O)N1 67851226 MXGWCYSLGIRUCM-FQEVSTJZSA-N 387.443 2.776 0 50 GFAA CSCC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cccnc3)n2)C1 20999096 CZKTXNIKHIACSY-UHFFFAOYSA-N 381.461 2.750 0 50 GFAA CCNC(=O)c1ccc(N2CCN(Cc3ccc(OC)c(C)c3C)CC2)nc1 67821295 GAJWAJFEZVYQTE-UHFFFAOYSA-N 382.508 2.779 0 50 GFAA C[C@H]1CCC[C@H](NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)CC1 468092995 BAGAJSHKQJWJRF-HOTGVXAUSA-N 381.542 2.898 0 50 GFAA COc1ccc(CN2CCC[C@@H]2C(=O)NC2CC2)cc1OCc1cccnc1 121492814 KINGXZIKSLCBLG-LJQANCHMSA-N 381.476 2.912 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)NS(=O)(=O)Cc1ccc(F)cc1F 121532826 ULHWINKQIITSFI-QGZVFWFLSA-N 381.400 2.615 0 50 GFAA Cc1nc(N(C)CCN2CCCC[C@@H]2C)nc2cc(S(C)(=O)=O)ccc12 67724743 IOWPSRCOURLRMV-AWEZNQCLSA-N 376.526 2.652 0 50 GFAA C[C@H](NC(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1)c1cccnc1 281502902 JPYFUOZCEFMESQ-URLQWDBASA-N 398.511 2.564 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3N=NN(CC(=O)Nc4ccc(Cl)cc4)[C@H]3C2=O)cc1 2783396 RRACYGINEVLGTQ-IAGOWNOFSA-N 397.822 2.580 0 50 GFAA C[C@H](CCN1CCC(CNC(=O)c2cnn(C)c2)CC1)OCc1ccccc1 252494153 NMHSTOKTHAKNOA-GOSISDBHSA-N 384.524 2.857 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c(C)c1 72437740 WHBBXNUEXNIACN-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CC(C)[C@@H]1CN(CCC(=O)NC2CC2)CCC(=O)N1Cc1ccc(F)cc1 71750684 IGVAXQZXTBONPZ-IBGZPJMESA-N 375.488 2.553 0 50 GFAA Cc1ccc(NC(=O)c2coc(-c3ccccc3)n2)cc1N1C(=O)CNC1=O 478219124 VTCBQUYZZWVJEH-UHFFFAOYSA-N 376.372 2.959 0 50 GFAA C[C@]1(C(=O)N2CCN(C3c4ccccc4-c4ccccc43)CC2)CCC(=O)NC1 282571194 BTENNRCYJSJTCO-DEOSSOPVSA-N 389.499 2.817 0 50 GFAA O=C(Nc1ccccc1Cl)Nc1ccnn1C1CCN(C(=O)CCO)CC1 71551778 VFQKXGOPPJYKTH-UHFFFAOYSA-N 391.859 2.726 0 50 GFAA CN(C)c1noc(CNC(=O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)n1 365793792 ITPWHJPCOPJSOI-GFCCVEGCSA-N 390.513 2.560 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN(C(=O)OCc2ccccc2)C1 72194254 BOZPQGHPJKFXML-CVEARBPZSA-N 392.452 2.711 0 50 GFAA CCc1nc(C)c([C@H](C)N(C)S(=O)(=O)c2cnc3c(c2)c(C)nn3C)s1 173229807 QSEBGUSAQBJCSO-LBPRGKRZSA-N 393.538 2.986 0 50 GFAA Cc1cc(C(=O)N2CCN(c3nsc4ccccc34)CC2)c(=O)n(C)c1C 426606725 IRJPYLAIAVGVKQ-UHFFFAOYSA-N 382.489 2.574 0 50 GFAA CO[C@@H]1COC[C@H]1n1cc(C(=O)Nc2nc3c4c(ccc3s2)CCCC4)nn1 290188937 SRAMOTLAXPBTGK-HUUCEWRRSA-N 399.476 2.605 0 50 GFAA CCN(CC)Cc1cc(C(=O)N2CCC3(CCC(=O)N(C)C3)CC2)c(C)o1 91872654 QRTBCLXGJXYZRW-UHFFFAOYSA-N 375.513 2.904 0 50 GFAA Cc1ccccc1OC1CCN(C(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)CC1 91625326 HMADVMLQJJOZML-SFHVURJKSA-N 393.487 2.809 0 50 GFAA Cc1nc2c(c(NCCS(=O)(=O)CC(C)C)n1)Cc1ccccc1OC2 96148263 OOOCKBWIANOUMQ-UHFFFAOYSA-N 375.494 2.751 0 50 GFAA Cc1noc(CN2CCC[C@@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n1 95508023 UPPVEKHLOLTHKQ-AWEZNQCLSA-N 378.423 2.965 0 50 GFAA CCCSc1ccccc1N1CCN(CCCCN2C(=O)CNC2=O)CC1 96027638 UQGYNNRHIHTDFA-UHFFFAOYSA-N 390.553 2.643 0 50 GFAA COc1ccccc1-n1cc(C(=O)NCCSc2nnc(C)s2)cn1 91657217 JCLGCSBORGRMAT-UHFFFAOYSA-N 375.479 2.563 0 50 GFAA O=C(NC1CCCCC1)[C@H](Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 240499997 NQFNXZYBAQVKDT-SQEGATDGSA-N 392.499 2.854 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)Nc1ccc(OC)cc1 252347087 UKXUAQJQENTZMU-IWMITWMQSA-N 395.503 2.879 0 50 GFAA CCC[C@@H](NS(=O)(=O)c1cc(C)oc1C)C(=O)N1CCc2sccc2C1 183155920 HUQWCQCTYFWVSV-OAHLLOKOSA-N 396.534 2.990 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N[C@H](c1ccccn1)[C@H]1C[C@H](O)C1 252550816 SYCOTMJKFIZVMZ-YRVVQQKDSA-N 388.851 2.677 0 50 GFAA O=C(c1cccc(-c2ccc(O)cn2)c1)N1CCC(O)(CN2CCCC2)CC1 534633518 FGPPVHNPRGRYJI-UHFFFAOYSA-N 381.476 2.517 0 50 GFAA CCNC(=O)c1cc(NC(=O)N2CCC[C@@H]2Cn2cccn2)ccc1Cl 299757268 KSMILNHTKAWERM-CQSZACIVSA-N 375.860 2.983 0 50 GFAA O=C(/C=C/c1nc2ccccc2s1)NC[C@H](c1cccnc1)N1CCOCC1 828019335 QEAYVHLZUCZAGV-LKGOPFMKSA-N 394.500 2.894 0 50 GFAA CC(C)(C)OC(=O)N1CCC(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)CC1 62211901 GOUCKFWZYOLRAN-UHFFFAOYSA-N 397.516 2.713 0 50 GFAA in-vitro C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ncc(C(F)(F)F)s3)CC2)C1 302766514 LTHCBVLATWZZER-CHWSQXEVSA-N 390.475 2.788 0 50 GFAA CCC[C@@]1(C)C(=O)NCCN1C(=O)c1nc(C(C)C)n(-c2cccc(F)c2)n1 189807858 RYRKDNPBUOTGQQ-FQEVSTJZSA-N 387.459 2.661 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)N3CCCN(c4nccs4)CC3)c2O1 192605569 DYHHBTRHSUIVCB-UHFFFAOYSA-N 393.534 2.758 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)O)[C@H]1CCCN(Cc2cccc(F)c2)C1 194928163 MTWZCXZERNTIAN-ICSRJNTNSA-N 384.451 2.850 0 50 GFAA CCC1=NO[C@@H](CN2CCC(CNC(=O)c3c(OC)cccc3OC)CC2)C1 1506417507 LCLUCLNWBQSZIZ-QGZVFWFLSA-N 389.496 2.701 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3nccnc3N(C)C)CC1)OCC2 1704309541 XBWZYONKOITIQK-UHFFFAOYSA-N 384.480 2.628 0 50 GFAA CC(C)CCn1c(Sc2nc3ccccc3o2)nc2c1c(=O)[nH]c(=O)n2C 3037948 FNGLLPPNVFOTGL-UHFFFAOYSA-N 385.449 2.762 0 50 GFAA O=C(O)[C@H]1COCCN(C(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)C1 1775976970 CLWUNJYRELGHOU-QGZVFWFLSA-N 391.427 2.713 0 50 GFAA Cc1cc(C)n2cc(CNC(=O)CC[C@]3(Cc4ccco4)CCC(=O)N3)nc2c1 12053224 VBHRWHNVVGCRCM-JOCHJYFZSA-N 394.475 2.832 0 50 GFAA CN(C)S(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc(-c2cccc(F)c2)cc1 12074949 OPKNNTFBYVNYJL-GOSISDBHSA-N 391.468 2.702 0 50 GFAA CCOc1ccc2nc(N3CCC[C@@H]3C(=O)N3CCC(OC)CC3)nc(C)c2c1 12244858 MOFUZGHEEXLIKO-HXUWFJFHSA-N 398.507 2.943 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@@]1(O)CNCc1cc(F)ccc1F 14971319 WMPQSVQHNBZTRW-HXUWFJFHSA-N 396.384 2.886 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@@H](C(=O)c2ccc(C(F)(F)F)cc2)C1 14976871 KIHCHHUPRPMMKC-CYBMUJFWSA-N 386.370 2.873 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCN(c2ccccc2)CC1)[C@@H]1CCCO1 16475200 KAKYLUFIDAHFNU-FQEVSTJZSA-N 379.460 2.767 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@H](NCc1ccncc1)C2 19227511 UHJVNXBITAOPIO-SFHVURJKSA-N 393.491 2.810 0 50 GFAA COc1cccc(C(=O)N2CCC3(CC2)NC(=O)N(c2cccc(F)c2)N3)c1 169764161 GKFUKRBJRLRMMY-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA O=C(Cc1cccc(F)c1)NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12 169776293 CUMUJMYLEHAGCW-UHFFFAOYSA-N 392.394 2.655 0 50 GFAA CNC(=O)c1cc(-n2ccnc2-c2cc3c(cc2OC)OCCO3)ccc1F 1857683590 JUNKOROZYNWBNK-UHFFFAOYSA-N 383.379 2.818 0 50 GFAA O=C(O)[C@H]1CN(Cc2ncc[nH]2)CC12CCN(C/C=C/c1ccccc1)CC2 1857686353 RZPJBNFFSZQZFG-ZLHKHBAESA-N 380.492 2.722 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NC3(c4cc(F)cc(F)c4)CC3)CC2=O)s1 1857712149 RVDLEYCTXZPQMJ-JTQLQIEISA-N 392.431 2.537 0 50 GFAA O=C(NCC[C@H]1C[C@@H](O)C1)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1875243348 CPDWSOOAKCWALM-KCQAQPDRSA-N 377.872 2.975 0 50 GFAA CC(=O)N1CCC[C@@]2(CCc3c(N(C)Cc4c[nH]nc4C)nc(C4CC4)nc32)C1 1875242067 LZNOWBQTQJFXEB-JOCHJYFZSA-N 394.523 2.848 0 50 GFAA CC(C)=CCN1CCN(CCSc2ccccc2)[C@@H]2CS(=O)(=O)C[C@@H]21 248291167 TUYJOJUOUDHWTP-RBUKOAKNSA-N 380.579 2.528 0 50 GFAA C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCCN1C(=O)CSC1=O 263874103 NHALXKZIZIFPKI-MRVPVSSYSA-N 377.249 2.572 0 50 GFAA COC(=O)Nc1ccccc1C(=O)N(C)[C@@H]1CCN(c2ccccc2F)C1=O 264912488 NPDCIWXKQVAAKY-QGZVFWFLSA-N 385.395 2.882 0 50 GFAA Cc1onc(OC(F)F)c1NC(=O)Cn1cnc2sc(C)c(C)c2c1=O 839338216 YHVPGPHPGXIPOU-UHFFFAOYSA-N 384.364 2.611 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1ccc(C)cc1C(=O)C(F)(F)F)[C@H]1CCOC1 864096437 GAGPQKDVMQPVCN-SMDDNHRTSA-N 395.399 2.533 0 50 GFAA O=C(NCCn1cnc2c1CCCC2)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 1875320027 CVRYXFSIHKENDY-QRFRQXIXSA-N 394.523 2.506 0 50 GFAA Cc1cccc(OC[C@H](O)CNC(=O)[C@H](Cc2ccc(O)cc2)C(F)(F)F)c1 1875318102 FGNYTIHTHABJME-AEFFLSMTSA-N 397.393 2.978 0 50 GFAA Cc1ccc(N2CCC(NC(=O)N3CC(C)(C)[C@H]3c3nccn3C)CC2)nc1 886088715 PJJSHJDYRJNMHT-GOSISDBHSA-N 382.512 2.885 0 50 GFAA CC[C@H](C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 917475 AJPCSRPWKHUIQF-IBGZPJMESA-N 388.489 2.840 0 50 GFAA Cc1ncnc(O)c1CCC(=O)Nc1ccccc1NC(=O)c1ccncc1 2325730465 DDTMUXMBLUREDT-UHFFFAOYSA-N 377.404 2.709 0 50 GFAA Cc1c(F)ccc2[nH]c(C(=O)NCC[C@](O)(c3nccn3C)C(F)(F)F)cc12 2325769788 NUPZYYKCORONPG-KRWDZBQOSA-N 398.360 2.919 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@H](NC(=O)N2[C@H]3CCC[C@H]2CC(O)C3)C1=O 2325776132 PVMLADIFMRWAKK-BQFCYCMXSA-N 389.471 2.717 0 50 GFAA CC(=O)O[C@H]1C=C[C@@H](OC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)C1 2325790831 OTWNKRUUKQMIRX-JJXSEGSLSA-N 396.237 2.725 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(Cl)cc2)S(C)(=O)=O)c(OC)c1 827502 NASBQDHNBZPPDF-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2cc3ccccc3n(C)c2=O)C1=O 2356147522 AAIPBRYXQUDKFX-QFIPXVFZSA-N 381.476 2.546 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C(=O)c4ccccc4OC(F)(F)F)C[C@@H]13)O2 2356163813 RTAATJPQYWJWFP-OAOQPFQOSA-N 384.398 2.766 0 50 GFAA C/C=C/Cn1c(=O)c2c(nc3n([C@H](C)c4ccccc4)c(C)cn23)n(C)c1=O 10233477 KGGVSLGVYGNHFW-LLYBFZRZSA-N 377.448 2.643 0 50 GFAA CCOc1ccc(OC[C@@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)cc1 225835865 WWKCPAAOUHAXQF-KSFYIVLOSA-N 397.427 2.646 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3ccccc3SC)C2)CC1 55108252 FLKNJTIDGZBRER-MRXNPFEDSA-N 391.537 2.787 0 50 GFAA CCn1ncnc1-c1c(-c2ccccc2)ncn1C(C)(C)CN1CCOCC1 65459751 KZCHVDUOQSQCBH-UHFFFAOYSA-N 380.496 2.896 0 50 GFAA CC(C)(CN1CCC[C@@]2(CCN(C(=O)C3CCCCC3)C2)C1)N1CCOCC1 67758814 PARHUBPCCGSPAW-HSZRJFAPSA-N 391.600 2.992 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C[C@@H](C)O1 229763973 KYBWEQXGFHZWMO-NUJGCVRESA-N 385.508 2.887 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@H]3CCN(c4ccccc4)C3)c2c1 252484593 FZWMWQULKZSLSS-OAHLLOKOSA-N 382.489 2.972 0 50 GFAA Cc1ccc(Nc2nc(-c3cnc(N4CCOCC4)nc3C)cc(=O)[nH]2)c(C)c1 36235520 KWKOTDKKCAASCT-UHFFFAOYSA-N 392.463 2.732 0 50 GFAA CC[C@H](C(=O)N1N=CC[C@@]1(O)C(F)(F)F)n1nc(C)c(Br)c1C 6489482 ZNAZRCMTGQELQR-BXKDBHETSA-N 397.195 2.683 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCC[C@@H](N4CCCC4)CC3)ccc2N1 172610662 PHWFRCUZSWQCLD-QGZVFWFLSA-N 391.537 2.600 0 50 GFAA O=C(NO[C@@H]1CC=C[C@@H]1N1C(=O)c2ccccc2C1=O)OCc1ccccc1 39345915 RWGAQOXHOHROMA-ZWKOTPCHSA-N 378.384 2.838 0 50 GFAA CN(C[C@@H]1CCOC1)C(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 237232259 RIIGMEHUKSAZCO-NSHDSACASA-N 397.353 2.698 0 50 GFAA Cn1ccc(C(=O)Nc2nccn2Cc2ccc(Br)cc2)cc1=O 126761958 GHYAZWDVPYQYMN-UHFFFAOYSA-N 387.237 2.645 0 50 GFAA C[C@@H](c1ccsc1)N1CCN(C(=O)c2ccc(=O)n(-c3ccccc3)n2)CC1 128660212 KKKUXLZJDZXYIO-INIZCTEOSA-N 394.500 2.813 0 50 GFAA Cc1nc2ccc(NC(=O)[C@H](C(C)C)S(=O)(=O)C3CCCCC3)cn2n1 333914786 YRSWATNFCPRPBM-KRWDZBQOSA-N 378.498 2.748 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)N1CCC[C@@H](N2CCCC2)CC1 157680527 VWLHEMJOIAFPHU-LJQANCHMSA-N 384.524 2.626 0 50 GFAA CCOC1CC2(CCN(C(=O)C[C@@H]3CCCN(C(=O)NCC(C)C)C3)C2)C1 375858740 VSQBNFRCNIPONN-XPQZIERPSA-N 379.545 2.872 0 50 GFAA COCCCN1C[C@]2(CCCN(C(=O)c3cccc4nccnc34)C2)CCC1=O 77454318 KETCLYHAMXZOHV-QFIPXVFZSA-N 396.491 2.511 0 50 GFAA Cc1nn(C)cc1[C@H](C)NC(=O)N1CCc2c(cccc2N2CCOC2=O)C1 176352678 JKJCMEHCKMIOBU-ZDUSSCGKSA-N 383.452 2.514 0 50 GFAA C[C@H]1Oc2ccccc2[C@@H]1NC(=O)Nc1ccccc1N(C)S(C)(=O)=O 288820098 NXDCTSCGTPGQSI-SJKOYZFVSA-N 375.450 2.726 0 50 GFAA CN1C(=O)C2(CCN(C(=O)[C@H]3COc4ccccc4C3)CC2)c2ccccc21 426574860 HZLMFYZCPKHEPP-QGZVFWFLSA-N 376.456 2.775 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@@H]2CCC(=O)N(Cc3cccc(F)c3)CC2)C1 43027825 RKPPZEBBFMRDRW-PKOBYXMFSA-N 376.472 2.982 0 50 GFAA CN(C(=O)c1ccccc1SCC(=O)N1CCc2ccccc21)[C@H]1CCNC1 179079347 YNKAIRIFDZYSFG-KRWDZBQOSA-N 395.528 2.802 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCN(Cc3csc(C)n3)CC2)c(C)c1 95359699 HWDIUSBJIRWAAD-GOSISDBHSA-N 375.494 2.712 0 50 GFAA Cc1n[nH]cc1CN(C)Cc1cccc(OC[C@@H](O)CN2CCCCCC2)c1 95523981 RUWKHOVQUAIIKS-NRFANRHFSA-N 386.540 2.966 0 50 GFAA O=C(c1cc(-c2ccccc2)no1)N1C[C@H]2CC[C@@H]1CN(c1ncccn1)C2 91562994 YXLSNPKFPHJMML-DOTOQJQBSA-N 375.432 2.873 0 50 GFAA O=C(O)[C@]12COc3ccccc3[C@H]1CN(Cc1cnc(N3CCCCC3)nc1)C2 95504482 BNHJRMYFMOJWJC-XMSQKQJNSA-N 394.475 2.530 0 50 GFAA COCCN1CCC[C@@]2(CCN(c3ccnc4c(F)cc(F)cc34)C2)C1=O 95362162 HCUQEANACGFJLN-FQEVSTJZSA-N 375.419 2.978 0 50 GFAA COCc1nn(C)cc1C(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1 294561094 URHVBVYGAAKTEV-UHFFFAOYSA-N 376.888 2.568 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(c2ccc(Cl)c(C(=O)O)n2)C1 95530838 OGOYKKHELPNWEU-ZDUSSCGKSA-N 377.876 2.575 0 50 GFAA O=C(NCc1ccccc1CN1CC[C@H](O)C1)Nc1ncn(C2CCCCC2)n1 184579280 YYHZTBKDVZWDSE-IBGZPJMESA-N 398.511 2.672 0 50 GFAA O=C(Nc1ccccc1N1CCOC1=O)N1CCN(c2cccc(O)c2)CC1 299798923 PIZAOBBZULJNKB-UHFFFAOYSA-N 382.420 2.703 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)NCc3ccccc3Cl)CC2)nc(C)n1 825261490 USPLZRKSRYQSBA-UHFFFAOYSA-N 386.883 2.915 0 50 GFAA CCc1nccc(CN2CCN(c3cc(C)nc(-c4ccccc4O)n3)CC2)n1 952992131 ZFQWBNNLYRSNTO-UHFFFAOYSA-N 390.491 2.832 0 50 GFAA COc1cccc2[nH]cc(CC(=O)N3CCS(=O)(=O)c4ccccc4C3)c12 170599308 JOUVLDQRHVCFSE-UHFFFAOYSA-N 384.457 2.535 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@@H](c2ccccc2F)C1 171155502 DWSAHPUUQKHTPN-GOSISDBHSA-N 381.411 2.690 0 50 GFAA CC(C)c1[nH]ncc1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 193529456 HTUZKNCAMDGTKA-UHFFFAOYSA-N 378.835 2.924 0 50 GFAA Cc1ncc(C(=O)NS(=O)(=O)c2cc(F)c(F)c(Br)c2)s1 760429024 UPDPHXJTKKVIPW-UHFFFAOYSA-N 397.222 2.611 0 50 GFAA O=C1CCCN1Cc1ccccc1CNC1CCN(C(=O)c2cccnc2)CC1 1506427707 ZEEWZQQAAMQWNY-UHFFFAOYSA-N 392.503 2.598 0 50 GFAA O=C1Nc2ccc(Br)cc2/C1=c1/sc2nc3ccccc3n2c1=O 627771 IMHRPPWIKVEAGD-YPKPFQOOSA-N 398.241 2.542 0 50 GFAA CCN(CC)CCn1c(=N)n(C[C@@H](O)c2ccc3c(c2)OCO3)c2ccccc21 780170 LUISFFOEAJFISL-LJQANCHMSA-N 396.491 2.726 0 50 GFAA COc1ccc(CCNC(=O)C2CCN(Cc3cccnc3)CC2)cc1OC 795466 TZWCZKDDAQNJEK-UHFFFAOYSA-N 383.492 2.670 0 50 GFAA COC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 1164652 QXIPZHVWNQPHSX-UHFFFAOYSA-N 393.440 2.515 0 50 GFAA CCc1ccc(CN2C[C@H]3CN(Cc4ccc(C(=O)O)o4)C[C@@]3(CO)C2)s1 1772805740 RLVXDZZBQRXJNK-VLIAUNLRSA-N 390.505 2.528 0 50 GFAA O=C(NCc1ccccc1C(F)(F)F)c1cc(CN2CCC[C@@H](O)C2)on1 11818704 DWSKDXNMRGGBPH-CYBMUJFWSA-N 383.370 2.580 0 50 GFAA CC(C)c1nc(CNC(=O)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)no1 11874029 DACIOYFJHNFNHX-AWEZNQCLSA-N 390.871 2.901 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)N3c4ccccc4C[C@@H]3C)c2)C1=O 12003300 RTLYDQFQCNZRIU-KGLIPLIRSA-N 384.457 2.591 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCc1cccc(F)c1F)C2 14746017 FEUQUQNMXLASEE-HNNXBMFYSA-N 388.462 2.972 0 50 GFAA O=C(CCN1CCCC1=O)N[C@@H]1CCCc2c1cnn2-c1ccc(F)cc1F 14950738 FPMHYCQEXLXUMZ-MRXNPFEDSA-N 388.418 2.657 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cc(C2CC2)[nH]n1 15076131 ZZAQQFOIQZQNAP-UHFFFAOYSA-N 376.464 2.686 0 50 GFAA COC(=O)/C=C1/N=C(Nc2nc(C)cc(C)n2)N(c2ccc(Cl)cc2)C1=O 18285010 UNBZOCBBNUFZOI-NTEUORMPSA-N 385.811 2.618 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4cc(Cl)ccc4F)CC3)nn2)n1 169777294 VJOTVUQIMHYBRU-UHFFFAOYSA-N 390.806 2.906 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)c4cccc(F)c4)CC3)nn2)n1 169780216 LXFQEHQUIKUHEC-UHFFFAOYSA-N 384.415 2.897 0 50 GFAA COc1cc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)c(OC)cc1Cl 4511984 WTLWAEXPTZQHDO-UHFFFAOYSA-N 387.823 2.785 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NS(=O)(=O)Cc2ccccc2)cc1 2833165 DOROHNBSMKASOK-UHFFFAOYSA-N 382.507 2.707 0 50 GFAA CCNC(=O)N1CCC2(CC1)CC(=O)N(Cc1cccc(Cl)c1)CCO2 1857694749 VXPOTCUKZCRVQN-UHFFFAOYSA-N 379.888 2.653 0 50 GFAA CN(C)Cc1nc(C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cs1 1857699884 CDGVSJVPSKLLHB-UHFFFAOYSA-N 395.532 2.846 0 50 GFAA COc1cccc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1OC 1857707509 VKFBHGKZCFNKIR-JOCHJYFZSA-N 396.443 2.593 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)N3CCC(C(F)(F)F)CC3)CC2=O)s1 1857734292 OQHGGMRPPASZCS-SNVBAGLBSA-N 390.431 2.815 0 50 GFAA O=C(Nc1ccccc1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1 3483286 FTFGENAWRXGSHR-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)C2(c3ccc(Br)cc3)CCOCC2)C1 237638857 IUQQJEQKZLGVMC-KRWDZBQOSA-N 396.281 2.821 0 50 GFAA O=C(CCc1nc(C2CCCC2)no1)N1CCC([C@H](O)C(F)(F)F)CC1 131540928 LVQAIJXVIDVZRF-HNNXBMFYSA-N 375.391 2.822 0 50 GFAA C[C@@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(C(F)(F)F)cc3)CC2)C1 1704297979 BDEISTGPKUJTPM-OAHLLOKOSA-N 393.427 2.790 0 50 GFAA O=C(O)[C@@H](c1ccc(F)cc1Cl)N1CCC2(CCS(=O)(=O)CC2)C1 1875290851 FNZSDGRRSHNFET-CQSZACIVSA-N 375.849 2.506 0 50 GFAA O=C1COc2cc(NCc3cccc(C(=O)Nc4cccnc4)c3)c(O)cc2N1 1875391022 PEQFLCKGVKABGK-UHFFFAOYSA-N 390.399 2.983 0 50 GFAA CN(CCc1ccc2c(c1)CCO2)CCN(C)C(=O)c1cc(C(C)(C)C)nn1C 1875333953 QUHUHFGRMGYUST-UHFFFAOYSA-N 398.551 2.899 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(CCO[C@H]3CCCC[C@@H]3C)C2)ccn1 886072079 NTPADHSHVRPWRP-DQLDELGASA-N 375.513 2.766 0 50 GFAA Cn1cnc2c(c1=O)CCN(C(=O)N[C@@H]1CCCc3c(F)cc(Cl)cc31)C2 1775957858 QDQYRQVQOSZPRQ-MRXNPFEDSA-N 390.846 2.718 0 50 GFAA CCCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Cl)c(O)c(OC)c1 4009218 KJEDDZJAUHIKPP-HNNXBMFYSA-N 398.843 2.652 0 50 GFAA Cc1ccc(NC(=O)C(=O)N2CCC(c3cnn(C)c3)CC2)c(OC(F)F)c1 2325767235 JDBRLMXHESVYKE-UHFFFAOYSA-N 392.406 2.675 0 50 GFAA Cn1ccnc1[C@H]1CNCCN1C(=O)c1cc2c(Cl)cc(Cl)cc2[nH]1 2325795288 WQBOFVNWQFJQJM-OAHLLOKOSA-N 378.263 2.995 0 50 GFAA NC[C@H](CC(=O)N=c1ccc2cc[nH]c2[nH]1)c1ccc(Br)s1 2325860245 AESIHBYNCOJGSC-JTQLQIEISA-N 379.283 2.880 0 50 GFAA O=C1NCCC[C@]12CCCN2S(=O)(=O)c1cccc2cccc(Cl)c12 2356135747 RNAOILRZVLOJDJ-SFHVURJKSA-N 378.881 2.927 0 50 GFAA COc1cc(-c2o[nH]c(=NCCNc3ncccc3C)c2C(=O)O)ccc1F 2356161395 UKXQIIUJGATHRC-UHFFFAOYSA-N 386.383 2.837 0 50 GFAA O=C(c1coc(COc2ccc3ncccc3c2)n1)N1[C@H]2CC[C@@H]1C[C@H](O)C2 102850607 BBJORACCOCYTOO-ZSHCYNCHSA-N 379.416 2.930 0 50 GFAA CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)cc1 462773248 CEPHUBWPZXRCEX-UHFFFAOYSA-N 384.461 2.650 0 50 GFAA COc1ccccc1/C=C/CN1CCNC(=O)[C@H]1CC(=O)NC1CCCCCC1 55211798 GHVFHKXARCHJNP-CSNYQSHPSA-N 399.535 2.738 0 50 GFAA Cc1ccc2[nH]c(CN3CCN(C4CCN(C)CC4)[C@@H](CCO)C3)c(C)c2c1 20877449 DLZDJEJIOPDFID-FQEVSTJZSA-N 384.568 2.748 0 50 GFAA COc1cc(/C=c2/sc3nc4cc(C)c(C)cc4n3c2=O)cc(OC)c1O 22078997 OLJJERGZWSRBGL-RQZCQDPDSA-N 382.441 2.797 0 50 GFAA COc1cc(OC)c(CN2CCN(C3CCCCC3)[C@@H](CCO)C2)c(OC)c1 23128805 PEGYMLLXHLOHCT-SFHVURJKSA-N 392.540 2.914 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3ccc(OCC)cc3)CC2)nc(C)n1 65365553 DQNJBZYYPTWOJB-UHFFFAOYSA-N 384.484 2.970 0 50 GFAA C[C@@H](C(=O)N1CCCCC1)N(c1cccc(C(F)(F)F)c1)S(C)(=O)=O 65364733 JDGQQHMPAVXXSZ-LBPRGKRZSA-N 378.416 2.872 0 50 GFAA Cc1ccc(N2CCN(C(=O)CCn3cnc4ccccc4c3=O)CC2)c(C)c1 32092423 JPFDRICRYPEGEX-UHFFFAOYSA-N 390.487 2.752 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)N1CC[C@@H](N2CCCC2)C1 363459333 KHCSRXFCEAJKGP-DOTOQJQBSA-N 378.467 2.671 0 50 GFAA O=C(c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)N1CC[C@]2(CCOC2)C1 154947711 BQNAVBWHXRRGSX-INIZCTEOSA-N 384.333 2.678 0 50 GFAA Cn1ccnc(N2CCC[C@H](NC(=O)Nc3ccc(F)c(C4CC4)c3)C2)c1=O 366944061 BBROABWVKQKACR-HNNXBMFYSA-N 385.443 2.587 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc(OCCN(C)C)cc3)CC2=O)cc1 72142014 TYSOUUSHVGNWDV-UHFFFAOYSA-N 381.520 2.780 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@H]3[C@H](CCCN3Cc3ccccc3)C2)cc1 156677987 IHIPNONWNDDBHH-RTWAWAEBSA-N 377.488 2.912 0 50 GFAA c1cc2nnnn2nc1N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 370981548 BSNLMVDLUMWYBT-AWEZNQCLSA-N 382.472 2.799 0 50 GFAA COc1cccc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCSCC3)c2)c1 71551644 WAOAEJAVZRBROY-UHFFFAOYSA-N 393.486 2.798 0 50 GFAA Cc1ccc(C[C@@H](C)NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)s1 282296736 WWPASODGKFTCJR-CQSZACIVSA-N 399.582 2.587 0 50 GFAA COC(=O)c1c(C)nn2c1ncc1c(=O)n(-c3cc(Cl)ccc3OC)ccc12 71384771 RHTWWHABFSXMAQ-UHFFFAOYSA-N 398.806 2.790 0 50 GFAA Cc1cc(O)cc(=O)n1CCCC(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1 226847871 QJHDHVZJZUNXCS-GOSISDBHSA-N 380.448 2.883 0 50 GFAA Cc1c(NC(=O)[C@@H]2COc3ccccc3C2)cccc1C(=O)N1CCOCC1 193702361 BQWOTVCYLBVVJU-KRWDZBQOSA-N 380.444 2.657 0 50 GFAA CCOC(C(=O)NCC1(O)CCN(C)CC1)(c1ccccc1)c1ccccc1 426490516 PUCKLSFQNCFIBW-UHFFFAOYSA-N 382.504 2.540 0 50 GFAA COCCN1CCC[C@H](CN(C)c2ncnc3c2Cc2ccccc2OC3)C1 97547746 MPDUBDSCJWBPBJ-QGZVFWFLSA-N 382.508 2.754 0 50 GFAA O=C(CCC1CCN(C(=O)CCO)CC1)NCc1cccc(C(F)(F)F)c1 95515135 KLMAGDMXGZDRSR-UHFFFAOYSA-N 386.414 2.723 0 50 GFAA Cc1cccc(N2C[C@@H](C(=O)NCc3cn(C)nc3C(F)(F)F)CC2=O)c1C 178953702 NKHGYENPMASTKD-ZDUSSCGKSA-N 394.397 2.725 0 50 GFAA CC(C)N1CC2(CCC1=O)CCN(C(=O)c1ccc(Cn3cccn3)o1)CC2 95504399 NTABDKPLWVYTFQ-UHFFFAOYSA-N 384.480 2.778 0 50 GFAA Cc1cc(Br)c(S(=O)(=O)Nc2ccccc2C(N)=O)cc1C 239367146 AHSFSANFGDPLAL-UHFFFAOYSA-N 383.267 2.966 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3ccc[nH]3)C2)c(OC)c1 95504593 AAFQVVIBDGLTCY-MRXNPFEDSA-N 399.491 2.981 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)ccc1F 95502930 VIJYWFWDLTZCTG-UHFFFAOYSA-N 396.466 2.783 0 50 GFAA COc1ccc(C(=O)N2CCC([C@@H](C)N3CCN(C)CC3)CC2)cc1Cl 91410050 HNFBVCLMEQLUBD-OAHLLOKOSA-N 379.932 2.837 0 50 GFAA CNc1cc(C)nc(N2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)n1 91595570 RLVHFMMOSGFHGQ-NRFANRHFSA-N 380.496 2.631 0 50 GFAA CCn1nc(C)c(CC(=O)N2CCC[C@@H](N(C)Cc3ccccn3)CC2)c1C 294385657 DRKGLPLHKHTCPR-HXUWFJFHSA-N 383.540 2.970 0 50 GFAA O=C(Nc1ccnn1Cc1ccccn1)N1CCC(OC[C@@H]2CCCCO2)CC1 181152436 MQZMKKHPHVSFON-IBGZPJMESA-N 399.495 2.908 0 50 GFAA O=C(NCC1(c2cccc(F)c2F)CCCC1)N1CCOC[C@H]1c1nc[nH]n1 298143538 APFDIECLUZTNMT-HNNXBMFYSA-N 391.422 2.678 0 50 GFAA CCN(CC)[C@H](CNC(=O)N1CCC(O)(c2cccnc2)CC1)c1ccco1 534578492 BFWZXWUQHAEJGZ-GOSISDBHSA-N 386.496 2.751 0 50 GFAA COc1ccc([C@H]2Cn3cnc(C(=O)NCCc4c(C)noc4C)c3CO2)cc1 263616924 LFKFZRQXFJXQGE-LJQANCHMSA-N 396.447 2.741 0 50 GFAA CN(C[C@H]1Cc2ccccc2O1)C(=O)c1ccc2nnc(-c3cccn3C)n2c1 1940196651 XXQMHVJZHMVXLC-QGZVFWFLSA-N 387.443 2.811 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)N1CC[C@@]2(CN(C)C(=O)O2)C1 72172915 ISOGHLPWROTHCS-GOSISDBHSA-N 375.812 2.970 0 50 GFAA CO[C@H]1[C@H](NC(=O)COc2ccccc2)c2ccccc2C12CCN(C)CC2 299760528 VUWUMGMSCBWMGG-YADHBBJMSA-N 380.488 2.915 0 50 GFAA Cc1ccc(S[C@@H](C)C(=O)N2CCN(c3ccc4nccn4n3)CC2)cc1 299791054 CICVGOZHKGNHGD-INIZCTEOSA-N 381.505 2.867 0 50 GFAA CC1(C(=O)NC2CCN(C[C@@H]3CCOC3)CC2)CCN(Cc2ccccc2)CC1 184799356 GKBMITNSFLKNAK-NRFANRHFSA-N 399.579 2.906 0 50 GFAA CCCOc1cc(C)ccc1NC(=O)N[C@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 170591918 QAZWQYCCXWQXAW-KXBFYZLASA-N 396.509 2.642 0 50 GFAA Cc1cn2c(CN(C)C(=O)c3cc(N4CCOCC4)ccn3)c(C)nc2s1 194524925 NHBOFHVCZOUPRK-UHFFFAOYSA-N 385.493 2.516 0 50 GFAA CC(C)c1nnc(CN2CCN(CCOc3ccccc3Cl)CC2)n1C 195046576 OAICCUURQGFCLU-UHFFFAOYSA-N 377.920 2.789 0 50 GFAA CCSc1ccc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCNC)C2)s1 220273526 SAMRERKYBBSCCS-KGLIPLIRSA-N 381.567 2.533 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCC2(CC1)OCCc1ccsc12 1704339578 MXMWSWOVHLMMMQ-UHFFFAOYSA-N 376.522 2.931 0 50 GFAA CCc1cccc(C)c1NC(=O)CN(C)S(=O)(=O)c1ccc(OC)cc1 1147981 KQHGYWVKWYJODJ-UHFFFAOYSA-N 376.478 2.825 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(C(=O)NC(C)C)C[C@]2(CCc2ccccc2)C1 1772808006 DXUXSRXSUCQVMN-UGKGYDQZSA-N 387.524 2.534 0 50 GFAA Cc1ccc2nc(C)cc(C(=O)N3CCCN(C(=O)[C@H]4CCOC4)CC3)c2c1 1772705914 DQWCNJXBSDQUBH-KRWDZBQOSA-N 381.476 2.563 0 50 GFAA Cc1c(C(=O)NCc2ccncc2)sc2ncnc(NC[C@H]3CCCO3)c12 12026467 MISFTRIFDHVMPX-CQSZACIVSA-N 383.477 2.916 0 50 GFAA O=c1c2c3c(sc2ncn1CCCO)C[C@H](NCCc1ccccc1)CC3 12055093 DGDBWIXVJRNUQE-MRXNPFEDSA-N 383.517 2.530 0 50 GFAA O=C(c1cn(Cc2ccc(F)cc2)nn1)N1CCC(CN2CCCCC2)CC1 12197217 MYWZSCNNQWVBNU-UHFFFAOYSA-N 385.487 2.804 0 50 GFAA CC1(C)C(=O)NCCN1C(=O)C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2 12440405 CEAUWVOOKDBVRZ-KRWDZBQOSA-N 380.444 2.674 0 50 GFAA CC(C)CCN1CCc2nnc([C@@H](C)NC(=O)CCc3ccccc3)n2CC1 14881449 BJQZWOUCANHSGO-GOSISDBHSA-N 383.540 2.992 0 50 GFAA O=C(NC1CCN(c2cc(C(F)(F)F)ncn2)CC1)c1ccc2c(c1)OCO2 169780306 IYRCDCJMEYUBON-UHFFFAOYSA-N 394.353 2.623 0 50 GFAA O=S(=O)(c1cccc(F)c1)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857672624 UXXNTMLKGJRKII-SXLOBPIMSA-N 375.465 2.973 0 50 GFAA CO[C@H]1C[C@@H](C(=O)NCc2sc(C)nc2C)CC[C@@H]1Nc1ncc(F)cn1 1857684453 OKMUVPIPAXSDPO-QEJZJMRPSA-N 393.488 2.601 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3)c1ccccc1F 1857719700 SXLNSKTWXSVUKE-DKYLXPRQSA-N 387.480 2.692 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)[C@@H](O)c1ccccc1 1857721798 GZCVQKFJILWGDO-HAGHYFMRSA-N 386.879 2.704 0 50 GFAA O=C(c1c[nH]nc1[C@@H]1CCOC1)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 330320493 FDYKBWCSLQTNNI-JKSUJKDBSA-N 392.463 2.719 0 50 GFAA CN1CCN(C(=O)c2cc(-c3ccco3)n(-c3cccc(Cl)c3)n2)CC1=O 152830202 KBPNALQGFVHOMI-UHFFFAOYSA-N 384.823 2.700 0 50 GFAA O=C(NCCC(=O)N1CC[C@]2(CCCOC2)C1)NC12CC3CC(CC(C3)C1)C2 375387219 AMBADNBSQQPOFZ-HUFQKIGGSA-N 389.540 2.674 0 50 GFAA C[C@H](Oc1ccc(Br)cc1Cl)c1noc(Cn2ncnn2)n1 1875285921 GRRIVSBMXIDISS-ZETCQYMHSA-N 385.609 2.660 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@H](Cc2cccc(Cl)c2)C1 1875255556 XRNBBZCAQOGLLC-CQSZACIVSA-N 396.896 2.902 0 50 GFAA Cn1[nH]c([C@@H]2CCCN2C(=O)OC(C)(C)C)nc1=NC(=O)NC1CCCCC1 1875339452 KBCGHUYWVYVKRF-AWEZNQCLSA-N 392.504 2.763 0 50 GFAA CCC1(CC)[C@@H](NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C[C@H]1OC 133270875 MRXTWPOBAHMLPT-LSDHHAIUSA-N 375.494 2.546 0 50 GFAA O=C(c1cccn1C1CC1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356147117 IUPSJNNYLUWFBA-JBYIUTFZSA-N 385.508 2.724 0 50 GFAA O=S(=O)(NC[C@@H](c1ccco1)S(=O)(=O)c1ccccc1)c1ccccc1 4519385 AQNZQKBRMKIMMH-SFHVURJKSA-N 391.470 2.773 0 50 GFAA O=C(c1cncc(O)c1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356168427 CYBCPCHICKZOQI-QFIPXVFZSA-N 379.460 2.627 0 50 GFAA COc1ccccc1NC(=O)/C(=C/c1ccc(OC(C)=O)c(OC)c1)NC(C)=O 4957553 UECUGPRTNVXKFD-BOPFTXTBSA-N 398.415 2.745 0 50 GFAA COc1ccc(CNC(=O)[C@H](C)N2CC(c3nc4ccccc4[nH]3)C2)cc1OC 225467102 KXGPSKLYWYLJJZ-AWEZNQCLSA-N 394.475 2.684 0 50 GFAA Cc1nonc1C(=O)N1CCC[C@H]1c1ccc(C(=O)NCc2ccoc2)s1 20138265 HFDPHAZOWIECHN-ZDUSSCGKSA-N 386.433 2.940 0 50 GFAA CCOCCc1nnc(NC(=O)N(C)Cc2ccccc2-n2cccn2)s1 23232100 GCVMKRZTRGJKMW-UHFFFAOYSA-N 386.481 2.967 0 50 GFAA O=C(c1cccc2c1NCCC2)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65527297 KTCFAOQZNQXIHD-FUHWJXTLSA-N 380.444 2.764 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)cc1Cl 67613497 QFUYWJVTLOMKPU-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA NC(=O)c1ccc(CN2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)CC2)cc1 171960344 CDTYDBHSZWIYCU-UHFFFAOYSA-N 388.471 2.739 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNCc2ccc(F)cc2Cl)CC1 39485796 ZQUGBJPLLLTBHI-UHFFFAOYSA-N 376.863 2.832 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc3ncccc3c2)c1 72147412 QZMBKEUFVGPXKM-UHFFFAOYSA-N 386.429 2.525 0 50 GFAA CC(C)[C@H]1CN(CC(=O)NC(C)(C)C)CCC(=O)N1Cc1ccc(F)cc1 71746470 UKKFJYQDZKHVSE-GOSISDBHSA-N 377.504 2.799 0 50 GFAA O=C1CCCN1CC(=O)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2)C1 12715584 WNRMSRXBJMBCHQ-HSZRJFAPSA-N 383.536 2.556 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c(CC(=O)Nc3ccc(C(=O)O)cc3F)c2C)n1 261918980 IMNULSDLMNTBSN-UHFFFAOYSA-N 397.410 2.914 0 50 GFAA CCCN(C)C(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72133477 PRRBZISASFBUDM-JOCHJYFZSA-N 393.531 2.877 0 50 GFAA CC(=O)c1ccc(N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)nc1 71763739 KTCTUTLFYSKZEP-LJQANCHMSA-N 384.524 2.587 0 50 GFAA CN(C(=O)c1nn(-c2ccc(F)cc2)cc1Br)C1CCNCC1 237117508 VNTCFHKUUXKARL-UHFFFAOYSA-N 381.249 2.598 0 50 GFAA O=C(Cn1c(S)nnc1-c1cccs1)N[C@H]1CCOC2(CCCC2)C1 159572236 QTAKWQPOADCQHL-LBPRGKRZSA-N 378.523 2.903 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)ccc1-n1cncn1 237846746 PJXIWUMXVQSQOI-UHFFFAOYSA-N 390.443 2.834 0 50 GFAA COC1(c2nc(CC(F)(F)F)no2)CCN(C(=O)c2csnc2C)CC1 284393664 IAFMKTAVFHYQBV-UHFFFAOYSA-N 390.387 2.717 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1CC[C@H](C)[C@H](n2ccnc2)C1)c1ccc2c(c1)OCCO2 245559323 BNDDBLWYCSSWKF-LSTDLKDCSA-N 398.507 2.803 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)n[nH]2)cc1 426412664 DSVJNRPNCSPXMZ-OAHLLOKOSA-N 375.494 2.536 0 50 GFAA NC(=O)N1CCC[C@H](C(=O)NCC2CCC(c3nc4ccccc4[nH]3)CC2)C1 97088363 SXFXARWDLGXQBZ-GPANFISMSA-N 383.496 2.744 0 50 GFAA COc1cccc(Oc2ccc(NC(=O)NCC3(CO)CCOCC3)cn2)c1 96131990 LSLZUKSNUSDIIN-UHFFFAOYSA-N 387.436 2.793 0 50 GFAA O=C1NCCN(C(=O)c2ccc3nccn3c2)[C@H]1c1ccccc1C(F)(F)F 182566926 KEQCZCSDQPRXPW-INIZCTEOSA-N 388.349 2.666 0 50 GFAA COc1ccc(CNC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)cc1C(=O)O 299748504 HGRWHCWBUVMLBZ-IBGZPJMESA-N 396.443 2.546 0 50 GFAA CC(C)C[C@@H](NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)c1cccnc1 821004150 RORUMRCARUZJHD-GOSISDBHSA-N 375.494 2.995 0 50 GFAA CC(C)n1cnnc1CCNC(=O)N(Cc1cccnc1)Cc1cccnc1 827884143 FADUTXSBIUIEOZ-UHFFFAOYSA-N 379.468 2.604 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N[C@@H](C)c3nncn3C(C)C)c(C)s2)n[nH]1 670467538 CYGIKLQDWWGOCA-NSHDSACASA-N 394.526 2.967 0 50 GFAA Cc1nc(NC(=O)c2cc(F)ccc2NC(=O)N2CCN(C)CC2)sc1C 886024624 UFSZGPSHGCZAQN-UHFFFAOYSA-N 391.472 2.931 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N2CCCC[C@H]2c2ncc[nH]2)cc1Cl 277567448 XLLQGNMTLKXWHH-AWEZNQCLSA-N 396.900 2.903 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](NC(=O)c2cccs2)CN1CC1CCCC1 96133240 DPRPBKZCVWPPGF-SJORKVTESA-N 377.554 2.979 0 50 GFAA C[C@@H](C(=O)N1CCC(n2cc(Cl)cn2)CC1)n1nnc(-c2ccccc2)n1 170593392 IXHSKGYMKXLFCL-ZDUSSCGKSA-N 385.859 2.615 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)CCN2CCN(C)CC2)cc1NC(=O)c1ccco1 170598021 FDBLHGFTIVLTRF-QGZVFWFLSA-N 398.507 2.596 0 50 GFAA NC(=O)[C@@H]1CC(C(=O)NCc2cccc3ccccc23)=NN1c1ccc(F)cc1 170596987 RWGTYEOCNJHZCF-FQEVSTJZSA-N 390.418 2.715 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]23CCOC3=O)ccc1OCc1cscn1 170601332 PPGVRTCTPCUWDU-IBGZPJMESA-N 388.445 2.652 0 50 GFAA C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ncc(C(F)(F)F)s3)CC2)C1 302766511 LTHCBVLATWZZER-BETUJISGSA-N 390.475 2.788 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)Cc3ccc(F)c(Cl)c3)CCO2)cn1 189226865 GFFZDAXKPBUROY-INIZCTEOSA-N 387.864 2.599 0 50 GFAA Cc1ccc(C(=O)N(Cc2ccncc2)C[C@H]2CCCO2)cc1N1CCNC1=O 1506396388 HWEMXQOLVPWRFE-LJQANCHMSA-N 394.475 2.741 0 50 GFAA CCc1cc(CN(C)C(=O)[C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)on1 1529159145 PFDHZUAJGKZQKC-UXHICEINSA-N 385.464 2.573 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(-c3ccccc3)cc2)C[C@@H]1NS(C)(=O)=O 220253555 TVSHMNRILXDBBL-UXHICEINSA-N 386.517 2.999 0 50 GFAA O=C(NCc1nc(O)c2ccccc2n1)[C@@]1(Cc2ccccc2)C[C@H]2CC[C@@H]1N2 1704303895 DIMCOYDJQJNYKA-ICPLQIHGSA-N 388.471 2.705 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1I 831842 BMAYXBZBSAWBFN-NSHDSACASA-N 385.201 2.732 0 50 GFAA COc1ccc(NC(=O)Nc2ccc(N3CCOCC3)c3nonc23)c(OC)c1 5041894 LYBDJIUGNNFQJA-UHFFFAOYSA-N 399.407 2.721 0 50 GFAA CC(C)=CCN1CCc2nnc([C@@H](C)NC(=O)CCc3ccccc3)n2CC1 11841807 ONGXFJFAEBXGSY-GOSISDBHSA-N 381.524 2.912 0 50 GFAA COc1ccc(-n2ccnc2CN[C@@H]2CC(=O)N(Cc3ccc(F)cc3)C2)cc1 12303218 DZYITPLCKYISQR-GOSISDBHSA-N 394.450 2.911 0 50 GFAA COc1cc(CNCCc2ccncc2)ccc1OC[C@H](O)CN(C)C(C)C 12305245 QJCVLEYMNJBZBZ-HXUWFJFHSA-N 387.524 2.502 0 50 GFAA COC(=O)c1ccc(CN2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)cc1 15072361 ONDHTRVEEFRDNK-HXUWFJFHSA-N 388.508 2.761 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)COc2cccc(Cl)c2)c1 945335 DYJKPJFGYPLVNL-UHFFFAOYSA-N 377.780 2.931 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)[C@@H](O)Cc1ccccc1)CC2 1857730136 YZEXCMZHWSQBAC-NRFANRHFSA-N 375.472 2.618 0 50 GFAA Cc1c(C(=O)N2CCCC[C@H]2CN2CCOCC2)cnn1-c1ccc(F)cc1 110954342 ATLVAQJNRZXFEY-IBGZPJMESA-N 386.471 2.647 0 50 GFAA Cc1cc(C(=O)N2CC[C@H](NS(C)(=O)=O)C2)sc1-c1ccc(F)cc1 116834939 ORPFZHFZTVHRIG-AWEZNQCLSA-N 382.482 2.626 0 50 GFAA CC(C)n1cc(Br)cc1C(=O)N(CCC(=O)O)C[C@@H]1CCCO1 236686535 ORQBBWISBGMVGT-ZDUSSCGKSA-N 387.274 2.927 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3C[C@H](C(=O)O)[C@@H](c4ccccn4)C3)[nH]n2)cc1 248123929 ZACNIXOGWNESHW-HOTGVXAUSA-N 376.416 2.721 0 50 GFAA Cc1cc(N2CCN(CCO)CC2)n2nc(C)c(-c3ccccc3Cl)c2n1 20547928 TVLGYAUQRMHPRD-UHFFFAOYSA-N 385.899 2.781 0 50 GFAA CCOc1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1OC 363343477 UQZBTSYPLSWBOO-MRXNPFEDSA-N 386.448 2.998 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)NC1CCN(c3ccc(C)cn3)CC1)CO2 157895584 KDNDTWPTDOLZQO-KRWDZBQOSA-N 381.476 2.735 0 50 GFAA CO[C@@H](CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(C)C 266695030 OHUZXSJAIHZAOM-ZBFHGGJFSA-N 384.423 2.680 0 50 GFAA COc1ncc(COC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c(C)n1 838087365 BNMQUWWOLIXGLG-VNQPRFMTSA-N 391.468 2.872 0 50 GFAA CCc1nnc(-c2ccc(NC(=O)N3CCN(CC)[C@]4(CCOC4)C3)cc2)o1 1875274250 YPNABXMLGJHFFT-HXUWFJFHSA-N 385.468 2.628 0 50 GFAA CCc1c(-c2nc(Cn3cncn3)nn2[C@@H](C)C(C)C)nnn1-c1ccccc1 1875349447 XIAHRSUZROCMGK-HNNXBMFYSA-N 391.483 2.945 0 50 GFAA O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCOCCC12CCOCC2 1875302117 ANZZYACMZRNSPR-UHFFFAOYSA-N 389.427 2.606 0 50 GFAA CCNC(=O)c1ccc(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)nn1 895691101 CFNRFBLFTQDROD-UHFFFAOYSA-N 395.385 2.688 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CC[C@@H](c4nc(C)no4)C3)no2)cc1OC 1857798777 ARQFRJOSJBJDRG-CYBMUJFWSA-N 384.392 2.680 0 50 GFAA CCN1CCN(c2ccc(NC(=O)NCc3ccn4cnnc4c3)cc2C)CC1 2325810705 YVSQAPOVNWOXPX-UHFFFAOYSA-N 393.495 2.501 0 50 GFAA CN1CCC[C@@]2(CCCN2Cc2ccccc2OCC(=O)N2CCCCC2)C1=O 2356148883 YNVCTCCKQHVCME-HSZRJFAPSA-N 399.535 2.665 0 50 GFAA CCn1c(SCC(=O)Nc2nnc(C)s2)nnc1-c1ccc(F)cc1 4736214 GSVIHQIUFRLQRP-UHFFFAOYSA-N 378.458 2.995 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@@H](Cn2cccn2)C1)c1ccsc1 111087347 WTPOHSICBYYTFX-MRXNPFEDSA-N 396.472 2.738 0 50 GFAA CSc1nc(-c2ccco2)nc(C)c1C(=O)N1CC[S@](=O)C[C@H](C)C1 225460907 PTPLDUYCFQSIFC-NDHGSNPTSA-N 379.507 2.608 0 50 GFAA Cc1c(N(Cc2ccc(F)cc2)S(C)(=O)=O)c(=O)n(-c2ccccc2)n1C 8041586 BDIDRNFVYPTOEA-UHFFFAOYSA-N 389.452 2.590 0 50 GFAA COc1ccccc1CCNC(=O)CN1CCN(c2cccc(C)c2C)CC1 55070091 VRKHLDLAENYRRT-UHFFFAOYSA-N 381.520 2.793 0 50 GFAA Cn1cc(N2CC[C@H](NC(=O)c3cccc(OCc4cccs4)c3)C2=O)cn1 117693132 OYWYFQVWUUSYBB-SFHVURJKSA-N 396.472 2.596 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c1 65362611 JOMSRKJZLARCKU-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA Cc1nc(NC(=O)CN2CCc3ccccc3C2)nc2c1C(=O)CC(C)(C)C2 35810148 AVOAHVSWPURMFF-UHFFFAOYSA-N 378.476 2.937 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cscn2)C[C@H]1c1ccc(Br)cc1 425257415 QUZMJFRPXIHNOT-NWDGAFQWSA-N 381.251 2.846 0 50 GFAA O=C(Cn1cnc2cnccc2c1=O)N1CCC(CCc2ccccc2)CC1 126540693 UMMGZIGIMZUKSY-UHFFFAOYSA-N 376.460 2.663 0 50 GFAA CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)c2n[nH]c3c2CCC3)CC1 126441535 CPHRMBOQEHGRPB-AWEZNQCLSA-N 385.487 2.670 0 50 GFAA C[C@H](OC(=O)CCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C 241409072 NEJXFSGIOQYHAZ-LVQVYYBASA-N 388.464 2.857 0 50 GFAA CN1C(=O)[C@](CC(=O)N(C)C2CCNCC2)(Cc2ccccc2)c2ccccc21 71774413 AHTSDOAIEBDHHW-DEOSSOPVSA-N 391.515 2.744 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3c(F)cccc3Cl)CC2)n1 72441818 NJDZLVHMARTKEH-UHFFFAOYSA-N 377.851 2.606 0 50 GFAA Cn1ccnc1CCNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 128817539 SPBMKXXKRAJOIR-UHFFFAOYSA-N 399.838 2.558 0 50 GFAA CC(=O)N1CCC(NC(=O)CN2CCC[C@@H](c3ccc(F)cc3)CC2)CC1 378498391 TVTIDBBLBKBSRU-QGZVFWFLSA-N 375.488 2.522 0 50 GFAA CCOc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2cccn2C)cc1OCC 175990035 DHVKSWMQLQHANF-SFHVURJKSA-N 399.491 2.916 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1CC(=O)N(C2CC2)C1 176768731 NQNNESFLJDKWQG-JTQLQIEISA-N 377.803 2.936 0 50 GFAA COc1ccc([C@H]2CCCCCN2C(=O)CCN2CCCS2(=O)=O)cc1 194531081 RARCLHFLPZRSLQ-GOSISDBHSA-N 380.510 2.565 0 50 GFAA O=C(NCC1(N2CCOCC2)CCCCCC1)N1CCC[C@H](c2cc[nH]n2)C1 426510324 YSMJVOJZRVFAJV-SFHVURJKSA-N 389.544 2.724 0 50 GFAA COc1cncc(-c2ccc(C(=O)N[C@H]3COC[C@@H]3N3CCCCC3)cc2)c1 426545022 IWYDZJHDKGXZPF-SFTDATJTSA-N 381.476 2.740 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1Cc2ccccc2[C@@H](O)C1 82126080 CIIMSADNCKBTHY-INIZCTEOSA-N 382.445 2.690 0 50 GFAA COCCn1ccc(C(=O)N[C@H]2C[C@H](c3ccc(Br)cc3)C2)n1 291368363 XRTZHGDYJYHHPB-CTYIDZIISA-N 378.270 2.968 0 50 GFAA CCCn1ccnc1CN1CCC[C@@H](c2nnc(CN3CCCCC3)n2C)C1 426615151 MLPWKDNWPMDREV-GOSISDBHSA-N 385.560 2.787 0 50 GFAA Cn1cc(SCC(=O)NC2CCN(c3cnccn3)CC2)c2ccccc21 426615645 ZRSYBVIYNFNSNF-UHFFFAOYSA-N 381.505 2.846 0 50 GFAA COC(=O)N1CCCc2cc(NC(=O)N[C@H]3c4ccccc4C[C@@H]3O)ccc21 96138332 BOZKZLJHKUFHEQ-OALUTQOASA-N 381.432 2.985 0 50 GFAA Nc1nnc(CCNC(=O)C[C@H](c2ccccc2)c2ccc3c(c2)OCO3)s1 95523197 XBRBCGSMMLEWNL-OAHLLOKOSA-N 396.472 2.730 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3cccc(O)c3)C2)CN1CCc1ccccn1 95503090 YMEZNTPSRJUBMG-QHCPKHFHSA-N 393.487 2.875 0 50 GFAA CCn1ccnc1[C@H]1CCCN(C(=O)CCc2nc(-c3cccnc3)no2)C1 95508240 CBMMGIBEDWVUEH-INIZCTEOSA-N 380.452 2.687 0 50 GFAA NC(=O)CN1CC2(CCC1=O)CCN(CCc1cccc3ccccc13)CC2 92047034 FNKZCWCRRLXPDL-UHFFFAOYSA-N 379.504 2.572 0 50 GFAA C[C@@H](N)C(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95506218 ONYSXBPQXPLEQQ-CYBMUJFWSA-N 393.915 2.729 0 50 GFAA CCCn1nccc1S(=O)(=O)N1CCC[C@H](c2cccc(C(=O)O)c2)C1 95354797 IXOBFRPYTWOIKK-INIZCTEOSA-N 377.466 2.560 0 50 GFAA O=C(c1ccccc1)N1C[C@@H]2CC[C@H](C1)N(C(=O)COCc1ccccc1)C2 95385938 UZOUICNXVPWQEH-PZJWPPBQSA-N 378.472 2.966 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)NCc1noc([C@@H]2CCCO2)n1 96150556 YSRKVCNIRKNIHB-AWEZNQCLSA-N 382.424 2.952 0 50 GFAA COCC(=O)Nc1ccc(Cl)c(NC(=O)NCCN2CCCCCC2)c1 96153285 KGKCIVHDFDWQKB-UHFFFAOYSA-N 382.892 2.922 0 50 GFAA COCCn1ccc2c(OCC(=O)Nc3ccc4c(c3)NC(=O)CO4)cccc21 263587875 MFRVVAUQXFLZLW-UHFFFAOYSA-N 395.415 2.636 0 50 GFAA CC(C)C(=O)N1CCC[C@@H](NS(=O)(=O)c2ccccc2C(F)(F)F)C1 670452771 KNAZEMYTSZHQFE-GFCCVEGCSA-N 378.416 2.631 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@H]2CC(=O)Nc2ccc3scnc3c2)o1 952984888 UDALIXRFKDHBMK-MRXNPFEDSA-N 384.461 2.527 0 50 GFAA CN(Cc1cc(-c2ccccn2)no1)C1CCN(C(=O)c2cccnc2)CC1 952967679 NCUXWASSLYXEBN-UHFFFAOYSA-N 377.448 2.868 0 50 GFAA Cc1ccccc1CN(C[C@H]1CCCO1)C(=O)c1cnc2ccccn2c1=O 952967468 LMUKIOZOTQLRAN-GOSISDBHSA-N 377.444 2.824 0 50 GFAA C[C@H](C1CC1)n1cc(NC(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)cn1 189784627 IPTMIJVIVBQHOY-MRXNPFEDSA-N 396.495 2.642 0 50 GFAA C[C@H](CN1CCCC1=O)NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F 193414667 WXXFFQAGGQPNNO-GFCCVEGCSA-N 380.370 2.632 0 50 GFAA CC(C)n1ncc(C(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)c1N 757911429 BVGGGRKKXBHYSJ-KRWDZBQOSA-N 391.903 2.503 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N[C@@H]3c4ccccc4C[C@H]3O)c(C)s2)n[nH]1 1506400341 CTRQKKBPRHRQEJ-CRAIPNDOSA-N 389.502 2.692 0 50 GFAA COCCN(CCCOc1ccc(C(N)=O)cc1)CCOc1ccccc1F 1506340640 NGBZBZMPPVXPTM-UHFFFAOYSA-N 390.455 2.721 0 50 GFAA Cc1ccc(-c2nnc(NC(=O)c3cn([C@H]4CC[C@@H](N)CC4)nn3)s2)cc1 1529166853 AJHBXFSVNRZCQG-OKILXGFUSA-N 383.481 2.800 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)NCc2nonc2C)cc1 1704312559 FNWVTUWHJMVYNW-UHFFFAOYSA-N 383.408 2.572 0 50 GFAA CC(C)Cn1c(CN(CC2CCC2)C[C@H]2CCCO2)cnc1S(C)(=O)=O 11664500 PFABZSITJNKZDQ-GOSISDBHSA-N 383.558 2.724 0 50 GFAA NC(=O)[C@@H]1CCCN(Cc2nc(C(c3ccccc3)c3ccccc3)no2)C1 11753968 LYDLEXGWWZYMNU-GOSISDBHSA-N 376.460 2.947 0 50 GFAA Cc1cc(CNC(=O)c2sc3ncnc(NC[C@@H]4CCCO4)c3c2C)on1 12150133 MHZMFUVSPODWDO-LBPRGKRZSA-N 387.465 2.817 0 50 GFAA CC(=O)N1CCC(N2CC[C@]3(CCCN(CCCc4ccccc4)C3=O)C2)CC1 12315685 SLKYGVSLBCXXHM-XMMPIXPASA-N 397.563 2.945 0 50 GFAA O=C(Cc1c[nH]c2ccccc12)N1CCN(Cc2ccc3c(c2)OCO3)CC1 12922548 XAOKLUUVMABQIQ-UHFFFAOYSA-N 377.444 2.784 0 50 GFAA CC(=O)N[C@@H](CC(C)C)c1nnc2n1CCN(Cc1ccc(F)cc1F)CC2 14987925 TZMUMDANZYWFNJ-SFHVURJKSA-N 391.466 2.838 0 50 GFAA Cc1ccc(CCNC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1 169768851 RVCIMHGCAGEDJK-UHFFFAOYSA-N 395.532 2.872 0 50 GFAA O=C(c1ccco1)N1CC[C@@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169778046 AHXHYZRYRCEQHG-CQSZACIVSA-N 376.376 2.675 0 50 GFAA CCOC(=O)N1CCN(c2nc(C)c3c(n2)C[C@@H](c2ccco2)CC3=O)CC1 2237330 CPIOTALASNSZDX-CQSZACIVSA-N 384.436 2.569 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2ccc(Br)cc2F)cc1C(N)=O 4858370 KKVQNDQRSWKGCK-UHFFFAOYSA-N 387.230 2.796 0 50 GFAA Cc1nc(CN2CCC3(CC2)CN(CCC(C)C)C[C@H]3C(=O)O)n(C)c1C 1857681661 BPAVCMALHMFTBV-SFHVURJKSA-N 376.545 2.682 0 50 GFAA CN1CCC2(CCc3c2nc(-c2ccccc2)[nH]c3=N[C@@H]2CC[C@H](O)C2)CC1 1857692859 XNRLGARQPLBPMQ-MSOLQXFVSA-N 378.520 2.800 0 50 GFAA O=C(NCC1(C(=O)O)CC1)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 263389835 COVINGRMDRHKFQ-CYBMUJFWSA-N 385.247 2.579 0 50 GFAA O=C(NCC1CCN(C(=O)c2ccccc2)CC1)NCC1(O)CCCCCC1 163899921 SAAMEJCGFSVDTM-UHFFFAOYSA-N 387.524 2.923 0 50 GFAA CCc1nc(CN2CC[C@](c3nc(-c4ccncc4)no3)(C(F)(F)F)C2)n[nH]1 952891512 FJLMFUCSBPLTDP-INIZCTEOSA-N 393.373 2.518 0 50 GFAA O=C(O[C@@H]1CCN([C@H]2CCCc3ccccc32)C1=O)c1nc[nH]c2nccc1-2 1875267224 VZOXWKRAHHUJOZ-DLBZAZTESA-N 376.416 2.745 0 50 GFAA Cc1cccc(C)c1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875301940 XSCTUWJLGRNMOF-GOSISDBHSA-N 381.524 2.781 0 50 GFAA CO[C@H](C(=O)O)C1CCN(C(=O)C2(c3ccc(C)c(C)c3)CCOCC2)CC1 1875305433 DJRVDOOGCGLBRE-IBGZPJMESA-N 389.492 2.690 0 50 GFAA CC[C@H](C)n1nc(C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)CCCCOC)cc1C 1775991640 LVDRMUBVVZQNQO-JQHSSLGASA-N 390.528 2.795 0 50 GFAA COc1ccc(CNC(=O)Cn2cc(-c3cccc(Cl)c3)nn2)cc1OC 2325776466 PAVMMYKKJKPBLT-UHFFFAOYSA-N 386.839 2.932 0 50 GFAA COC[C@H](NS(=O)(=O)C[C@@H]1CCC2(CCC2)O1)c1ccc2[nH]ccc2c1 2325783956 NUTMBXJYJDJRAR-WMZOPIPTSA-N 378.494 2.877 0 50 GFAA COc1cnn2c1CN(C(=O)N[C@@H](C)c1cnn(-c3ccc(F)cc3)c1C)CC2 2325795962 IFPFUDYXMBGCSC-ZDUSSCGKSA-N 398.442 2.811 0 50 GFAA CN1C(=O)[C@@H](C(=O)NCc2ccc(N=c3cc[nH]cc3)cc2)Cc2ccccc21 2325859550 AKMDSDLXPBVNJN-HXUWFJFHSA-N 386.455 2.699 0 50 GFAA O=C(c1cnn(Cc2ccccc2)c1)N1CCc2nc(-c3ccccc3)nn2CC1 2356133946 OUSQFKDPBBUPJL-UHFFFAOYSA-N 398.470 2.888 0 50 GFAA O=C(Nc1ccccc1Cl)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 3022069 ZPHHXRHSHVIJQS-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA CN(C[C@H]1Cc2ccccc2O1)C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356163398 BEIOLKOPJMRKFG-QGZVFWFLSA-N 398.528 2.975 0 50 GFAA CC(C)[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)CN1C(=O)NC(=O)C1(C)C 55155025 ZEJZTRYFHBWKQT-SFHVURJKSA-N 382.464 2.580 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)CC1 55071461 NILNHPQCGJFXDF-SFHVURJKSA-N 384.480 2.547 0 50 GFAA CCC(=O)Nc1cccc(OCC(=O)NCCC2=CSC3=NCCCN23)c1 102798872 SHKLUMFZLPRGAX-UHFFFAOYSA-N 388.493 2.570 0 50 GFAA Cc1ccc(-c2cn(C3CCN(c4nc(C)ccc4C(N)=O)CC3)nn2)cc1 55200084 ULUNTQIAGDHRNP-UHFFFAOYSA-N 376.464 2.897 0 50 GFAA OCC[C@@H]1CN(Cc2cnc(N3CCCC3)s2)CCN1Cc1cccs1 23375231 VPGLRPVEQSSRCZ-MRXNPFEDSA-N 392.594 2.874 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@@H]2COCCO2)CCO3)s1 67817805 RTLKLKNYVFKMBH-INIZCTEOSA-N 375.446 2.566 0 50 GFAA O=C1N[C@@](Cc2ccccc2Cl)(C2CCNCC2)C(=O)N1Cc1cccnc1 67789524 OEGRKTJJCYCYIW-NRFANRHFSA-N 398.894 2.768 0 50 GFAA Cn1ccnc1CN1CCC2(CC1)c1ccccc1[C@@H](N1CC=CCC1)[C@@H]2O 20859441 YKSSJDBKXAMTSB-YADHBBJMSA-N 378.520 2.631 0 50 GFAA CCc1ccc([C@H](COC)NC(=O)Nc2ccc(N3CCOCC3)nc2C)o1 119364606 YLPHJVQDPRYKEY-KRWDZBQOSA-N 388.468 2.891 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4ccccc4)CC3)nc(C)n2)n1 65364558 GSSBDHCQIZDYKI-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA CC(C)N1CCC[C@H]1C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67954801 RQUOCAKAVKGYKA-INIZCTEOSA-N 383.448 2.828 0 50 GFAA O=C(Nc1cccc(Cl)c1)N1CCN(c2ccc(-n3cccn3)nn2)CC1 65364934 LYWBNBCKOHGAQB-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA C[C@@H]1CN(C)[C@H](C)C[C@H]1Nc1cnc(N2CCOCC2)c(Br)c1 253430859 MBEQOAGNOIHSSM-XJKCOSOUSA-N 383.334 2.821 0 50 GFAA CCn1nccc1N1CCC[C@H](NC(=O)CCc2ccc(Cl)s2)C1=O 241466042 NUCCXWPOSZQRGU-ZDUSSCGKSA-N 380.901 2.862 0 50 GFAA COc1cccc(C(=O)c2ccc(C(=O)N[C@@H]3CCc4nnc(C)n4C3)cc2)c1 363999580 NZXWQBKSPQRLMZ-GOSISDBHSA-N 390.443 2.571 0 50 GFAA COc1ccc(CS(C)(=O)=O)cc1NCc1cc(-c2cnn(C)c2C)no1 285254494 WWIWFMCZZOEUSB-UHFFFAOYSA-N 390.465 2.549 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(C(=O)c1cccc(OC(F)F)c1)C2 72469622 QMCVIYBQXQWHMM-UHFFFAOYSA-N 379.363 2.548 0 50 GFAA Cc1cc(CN(CC(C)C)C(=O)c2cc(C(N)=O)c[nH]2)nc(N2CCCCC2)n1 486106872 PCLOZKOIZIRGLN-UHFFFAOYSA-N 398.511 2.501 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)c1cc(=O)n(-c2ccccc2)[nH]1 215843317 QPTSHOBQFSJCQE-UHFFFAOYSA-N 377.444 2.644 0 50 GFAA O=C(CCn1ccnc1)Nc1cccc(C(=O)N2CCC(NCC3CC3)CC2)c1 238092081 VGCPNJVPEORGFY-UHFFFAOYSA-N 395.507 2.516 0 50 GFAA CCc1ccc([C@H]2CNCCN2C(=O)c2cnc(O)c(Br)c2)cc1 262256378 QOIXWEAZFDUTGT-MRXNPFEDSA-N 390.281 2.899 0 50 GFAA C[C@@H]1CCN(C(=O)c2ccn([C@H]3CCCNC3)n2)CCN1Cc1ccccc1 262871939 XWAXWNFFNOEKMJ-QUCCMNQESA-N 381.524 2.544 0 50 GFAA CC[C@@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2ccccc2O1 173611495 YRBFHIQRIWIVNW-LJQANCHMSA-N 393.487 2.873 0 50 GFAA CCN1CCN(c2ccc(Cl)cc2NC(=O)N2CC[C@](C)(C(=O)O)C2)CC1 263499058 SEBKUIUXTVNWKL-IBGZPJMESA-N 394.903 2.810 0 50 GFAA CCc1ccc(CN2CCC[C@H](c3nnc(CN4CCOCC4)n3C)C2)cc1 426584695 MGRKFSBDUAOYGA-FQEVSTJZSA-N 383.540 2.589 0 50 GFAA CCN(CC)C(=O)c1cccc(S(=O)(=O)N(C)CC[C@H]2CCCCO2)c1 95361750 QDOSCTIWFKHJMB-QGZVFWFLSA-N 382.526 2.748 0 50 GFAA Cn1nc2cccc(NC(=O)NCCN3CCC[C@H](c4ccccc4)C3)c2n1 97522580 UWAAQWMEVFPGQB-KRWDZBQOSA-N 378.480 2.969 0 50 GFAA O=C(NCc1ccccc1)c1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4C[C@H]2C[C@@H]43)cc1 239235491 WBHWYBPZICVMDL-ZKIDJSGLSA-N 390.439 2.753 0 50 GFAA Cc1nn(C)c(=O)c(-c2nc(CN3C[C@@H](CO)c4ccccc43)cs2)c1C 292624128 IAIXTLSUEYTVIT-AWEZNQCLSA-N 382.489 2.617 0 50 GFAA Cc1cccc([C@H](C)Nc2ncc(C(C)(C)C(=O)O)c(N3CCOCC3)n2)n1 96141937 NIOHMJIYRCCZRR-AWEZNQCLSA-N 385.468 2.552 0 50 GFAA CCCN1C[C@H](NC(=O)Nc2ccnn2Cc2ccccc2Cl)CC1=O 96166080 DPJSDRJQJFNSSF-CQSZACIVSA-N 375.860 2.717 0 50 GFAA COc1ccc([C@H](NC(=O)Cc2cc(F)c(F)c(F)c2)[C@H]2C[C@@H](O)C2)cn1 244840378 UMFKTQQUUFNJHK-QUJCMNEKSA-N 380.366 2.678 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)NC[C@H]1CCCO1)CC2 298246096 YBMSOGBAJCHMKX-QZTJIDSGSA-N 391.537 2.840 0 50 GFAA CCc1c(OCC(=O)Nc2ccc(Br)cc2F)c(=O)ccn1C 263588262 QXWMCKGQNVHUAE-UHFFFAOYSA-N 383.217 2.867 0 50 GFAA C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)NCc1ccc(N2CCCC2=O)cc1 299788348 RXQJBRRXVFEEFL-CQSZACIVSA-N 382.416 2.626 0 50 GFAA COc1ccc(-c2n[nH]cc2C(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 299754417 LDGNSWUYSRTOMX-ZBFHGGJFSA-N 390.443 2.507 0 50 GFAA biogenic C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccnc(-c3cc[nH]n3)c2n1 725326543 YBXRSCXGRPSTMW-CYBMUJFWSA-N 375.436 2.646 0 50 GFAA Cc1ccc2c(c1)[C@H](NC(=O)N(C)C1CCS(=O)(=O)CC1)CC(C)(C)O2 584903113 UQRQZACJVBKHTR-MRXNPFEDSA-N 380.510 2.816 0 50 GFAA CC(C)n1ncc2c1[C@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)CCC2 1338005561 RBILUHWYUBKDKI-QGZVFWFLSA-N 390.509 2.572 0 50 GFAA COc1cc(OC)cc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccn2)C3)c1 1565515762 JUANCUCEGROSJD-APWZRJJASA-N 381.476 2.835 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3CCC[C@H](Nc4ccccc4)C3)CC2)n1 164054899 GKDKNRYIVNROPB-IBGZPJMESA-N 395.507 2.805 0 50 GFAA O=C(NC1CCN(CCc2ccccc2)CC1)N[C@@H](CO)Cc1ccc(F)cc1 270879442 DTLSSHJJPFUSJZ-JOCHJYFZSA-N 399.510 2.735 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)CCN2CCN(C)CC2)cc1NC(=O)c1ccco1 170598020 FDBLHGFTIVLTRF-KRWDZBQOSA-N 398.507 2.596 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1cc(Cl)nc(N(C)C)c1)C[C@@H]2O 170626324 RBUAAUVGBFJSFL-ZDUSSCGKSA-N 391.855 2.508 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)c3ccc(C)c4ncccc34)CCO2)cn1 189221948 CFUUFITVHQPJRD-KRWDZBQOSA-N 386.477 2.522 0 50 GFAA O=C(O)CNC(=O)c1ccc(NC(=O)C2(c3ccc(F)cc3F)CCC2)cc1 190882106 KGDZLDCXAMYPLA-UHFFFAOYSA-N 388.370 2.840 0 50 GFAA Cc1noc2ncnc(N(C)C[C@H](O)COc3ccccc3C(F)(F)F)c12 193390355 ZZKDEPBIUHVWMM-NSHDSACASA-N 382.342 2.821 0 50 GFAA Cc1ncc2c(n1)CCC[C@@H]2NC(=O)CCCc1nc(O)c2ccccc2n1 734795494 ANXAELCWCVCQMP-SFHVURJKSA-N 377.448 2.950 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1CN1CCN(CCO)[C@H](C)C1 779215806 ZNFAMJXVVSQGFQ-CYBMUJFWSA-N 383.323 2.986 0 50 GFAA O=C(c1cccnc1)N1CCC(N[C@H](Cn2ccnc2)c2ccccc2)CC1 1506407115 IOGBHOUJNNXUTH-OAQYLSRUSA-N 375.476 2.914 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1C[C@@H](O)[C@H](Cc3ccccn3)C1)c(C)n2C 1529126955 UVAPDKHJMUJFSC-FOIQADDNSA-N 379.460 2.566 0 50 GFAA O=C(c1c(N2CCOCC2)noc1-c1ccccc1)N1CCC[C@@H](CCCO)C1 1704307762 DQYJJRHRUQNERG-KRWDZBQOSA-N 399.491 2.803 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@@H](OC)C2)ccc1F 1704310817 UGZRONZOLHTNNC-CYBMUJFWSA-N 377.416 2.806 0 50 GFAA COc1cc(-c2onc(N3CCC[C@@H](CNC(C)=O)C3)c2C(=O)O)ccc1F 1704310533 ZVDCLUPMIWSVTR-LBPRGKRZSA-N 391.399 2.540 0 50 GFAA CCC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 811952 CYXDWBPFJLDJNY-UHFFFAOYSA-N 391.468 2.685 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)NCCCn1ccnc1)C2 1772818408 SERSGCZJDKNNTQ-AWEZNQCLSA-N 385.493 2.923 0 50 GFAA CCN1CCC[C@H]1CN(CC1CCN(CCOC)CC1)C(=O)c1ccoc1 12055874 WOMFGZFSODPOJN-FQEVSTJZSA-N 377.529 2.565 0 50 GFAA COc1ccc(CNCc2c(C(=O)N3CCCC3)nc3ccccn23)cc1OC 12314185 XINYBEIEEIUNFZ-UHFFFAOYSA-N 394.475 2.877 0 50 GFAA O=C1CCC(C(=O)N2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)=NN1 12477064 IBLJJXFQHIDJQO-IBGZPJMESA-N 391.471 2.702 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C2CCN(C(C)=O)CC2)CC1 12711170 KIBJOVDRVOZDQK-UHFFFAOYSA-N 387.568 2.892 0 50 GFAA COc1ccc(CNC(=O)CN2Cc3cc(C)ccc3O[C@H](C)C2)cc1OC 14991526 QXSIOJSYESBPRT-MRXNPFEDSA-N 384.476 2.912 0 50 GFAA COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)c1 2993142 LTJCQUJJUOADTJ-CQSZACIVSA-N 390.461 2.575 0 50 GFAA O=C1CCCN1c1ccc(N2CCC(NCc3noc(C4CC4)n3)CC2)cc1 19852377 WEESCFSKPQKGQP-UHFFFAOYSA-N 381.480 2.832 0 50 GFAA CCOCCC(=O)N1[C@H]2CC[C@@H]1[C@](CC)(C(=O)NCc1csc(C)n1)C2 1857672981 KUZUUHJZFNOHDB-FRQCXROJSA-N 379.526 2.654 0 50 GFAA CC(=O)Nc1ccc2nc(-c3nccn3C3CCN(CCO)CC3)ccc2c1 1857673560 OCRDYACXKUZFIG-UHFFFAOYSA-N 379.464 2.686 0 50 GFAA Cc1cc(C(F)(F)F)nc(N2CCN(c3ncnc4ccc(C)nc34)CC2)n1 1857696734 AHWLDUJVPKVDDC-UHFFFAOYSA-N 389.385 2.777 0 50 GFAA O=C(c1ccc(F)cc1F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857726735 ATBSCGKROSRSOD-OPYAIIAOSA-N 384.382 2.879 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)C3(C)CCCC3)CC(=O)N2[C@H]1c1ccccc1 1857736273 IKLKUFWQSUFWCN-LNLFQRSKSA-N 384.476 2.540 0 50 GFAA CO[C@H](CN1CCN(c2ccnc(N(C)C)n2)CC1)c1ccc(Cl)cc1 225770790 UIKCVGCDPCZBEE-QGZVFWFLSA-N 375.904 2.706 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cc2c(s1)CCC2 266347594 NGPKWUYMDCPMKZ-ZDUSSCGKSA-N 379.507 2.662 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)NS(=O)(=O)c2sccc2C)n1 802869712 JNGFWKBPDPIBKY-UHFFFAOYSA-N 391.474 2.678 0 50 GFAA Cc1cnc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)nc1 952894320 NFJDDYOTYFFZJO-MRXNPFEDSA-N 376.342 2.940 0 50 GFAA CCn1ccc(C(=O)N2C[C@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C[C@H]2C)n1 1875309967 WQMIQOSWHUTXGF-KGLIPLIRSA-N 397.454 2.804 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1NCc1cnc2cnccn12 1875398839 GUDFXIVWWRCDHB-NSISKUIASA-N 388.475 2.522 0 50 GFAA COc1cc(Cn2c(-c3ccccc3Cl)noc2=O)ccc1S(C)(=O)=O 1875391717 XPLUNLNYEPYPPC-UHFFFAOYSA-N 394.836 2.617 0 50 GFAA Oc1n[nH]c([C@H]2[C@H](C3CC3)CCN2c2nc(C3CC3)ncc2Br)n1 1875399701 HRAPZHYUAIWKLC-CMPLNLGQSA-N 391.273 2.918 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1 1107644 WKDDIFAPTRLANM-UHFFFAOYSA-N 388.807 2.881 0 50 GFAA CCc1nc([C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)n(-c2cnn(C)c2)n1 2100556412 MPRCXQCXEXXGNS-UXHICEINSA-N 394.479 2.613 0 50 GFAA CCc1c(C(=O)N[C@@H]2CCc3nc(C)[nH]c3C2)cnn1-c1ccc(OC)cc1 2325781340 GZVYGRZTNWFFNX-CQSZACIVSA-N 379.464 2.762 0 50 GFAA COc1nc2c(cc1CN1CC3(COc4ccccc4C3)C1)C(=O)N(C(C)C)C2 2356166654 HIJYWLBETBVXRZ-UHFFFAOYSA-N 393.487 2.892 0 50 GFAA CCOc1ccc(-c2noc(CCCC(=O)NC[C@H]3CCCO3)n2)cc1OC 4838285 AJZHZSFQJLVVRM-OAHLLOKOSA-N 389.452 2.762 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(C(=O)c2nc3ccccc3c(=O)[nH]2)CC1 20909667 QQTDZIPCMYOYID-UHFFFAOYSA-N 382.851 2.847 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN2CC[C@](O)(c3ccccc3C)C2)cc1 65529335 ZNUFHHJXBYEZSR-JOCHJYFZSA-N 381.476 2.510 0 50 GFAA COCC(=O)Nc1cccc(NC(=O)NCc2ccc3c(c2)OCCCO3)c1 67258359 UOTZRUYFMVUZQN-UHFFFAOYSA-N 385.420 2.755 0 50 GFAA Cc1c([C@@H]2CC(=O)Nc3cc4c(cc32)OCO4)c(=O)n(-c2ccccc2)n1C 65435373 XYZBMJVUAVYLSV-OAHLLOKOSA-N 377.400 2.687 0 50 GFAA CCN1CCN(C(=O)Cc2ccc(NC(=O)c3cc(C(C)=O)cs3)cc2)CC1 430570886 KRSOTPHXYUETFP-UHFFFAOYSA-N 399.516 2.910 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2cccc(C(=O)N(C)C)c2)n1C 328624802 COZHWXLQRALJBE-IBGZPJMESA-N 382.508 2.814 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3ccccn3)C[C@@H]21 329058102 TXWTWOPBOZIBOG-JKSUJKDBSA-N 398.511 2.502 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN2C(=O)[C@@H](C)Cc2c(C)nn(C)c2C)cc1 363253297 LFUYVDLJTYLQFJ-VBKZILBWSA-N 398.507 2.854 0 50 GFAA Cc1nnc(SCC(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)s1 7192681 RRJGEVWJBDIWIV-SSDOTTSWSA-N 382.536 2.863 0 50 GFAA O=C(c1ccc(F)c(Cl)c1)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 72149272 YNIBZYZGKRFJOZ-UHFFFAOYSA-N 384.798 2.823 0 50 GFAA Cc1cc(F)ccc1-n1cc(O)c(C(=O)Nc2ccc3c(c2)CCN3C(N)=O)n1 155858578 VRLXOYMHEASVKK-UHFFFAOYSA-N 395.394 2.719 0 50 GFAA Cc1ccccc1OCC(=O)N1CCOC[C@@H]1CC(=O)Nc1ccccc1F 72468101 PZOQXNMSDWROPT-INIZCTEOSA-N 386.423 2.769 0 50 GFAA CC(C)CNC(=O)C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72158442 HXVUEDVBYYBQSM-NRFANRHFSA-N 395.503 2.942 0 50 GFAA COC(=O)[C@@H]1CCN(C(=O)c2cn(-c3cccc(C)c3)nn2)c2ccccc21 130656065 XRIYQZKQUMDACI-QGZVFWFLSA-N 376.416 2.883 0 50 GFAA CC[C@@]1(C)CC(=O)c2cc(NC(=O)NCCSc3cn[nH]n3)ccc2O1 97436822 WBPRNEDZJRYQKB-KRWDZBQOSA-N 375.454 2.852 0 50 GFAA O=C1N=C(O)N(CCc2ccccc2)C(=O)[C@@]12Cc1ccccc1N1CCC[C@H]12 230002695 PKDMPKKQKSVHJU-WMZHIEFXSA-N 389.455 2.723 0 50 GFAA biogenic COc1cc2c(cc1OC)CN(C(=O)[C@H](C)n1cnc3ccccc3c1=O)CC2 334162506 VVWBHBHGQHTYIE-AWEZNQCLSA-N 393.443 2.560 0 50 GFAA CO[C@@]12CC[C@@H](NC(C)=O)C[C@@H]1N(C(=O)c1csc3c1CCCC3)CC2 534672441 JWMMYUPRYPGROS-HEFCMCLBSA-N 376.522 2.915 0 50 GFAA CN1CCN(c2ccc(C(=O)NCc3ccccc3-n3ccnc3)cc2)CC1 823792652 BNELVXAYRNNFNL-UHFFFAOYSA-N 375.476 2.554 0 50 GFAA Cn1cc(CCNC(=O)C2CCN(c3cnccn3)CC2)c2ccc(F)cc21 187473697 OWRWVLLDPRXAHL-UHFFFAOYSA-N 381.455 2.683 0 50 GFAA CN1CC[C@@H](NC(=O)N2CCc3ccnc(O)c3C2)[C@@H]1c1ccc(F)c(F)c1 277101025 OZQFWZKIQMFLHD-MSOLQXFVSA-N 388.418 2.579 0 50 GFAA Cn1nc(Br)c2c(NCc3nc4ccc(F)cc4n3C)ncnc21 170595669 CYEGTRVXROCUEX-UHFFFAOYSA-N 390.220 2.764 0 50 GFAA CCOc1ccc(S(=O)(=O)NC[C@@H](C)N2CCCCC2=O)c2ccccc12 194597950 GYNZNFXXTZZSFF-OAHLLOKOSA-N 390.505 2.918 0 50 GFAA Cc1cnn(-c2ccc(S(=O)(=O)Nc3nnc(C(C)(C)C)o3)cc2F)c1 194791034 UWQPRFIYGLWZCI-UHFFFAOYSA-N 379.417 2.801 0 50 GFAA COc1cccc(CN2CCN(CC(F)(F)F)CC2)c1OCCn1ccnc1 1506420631 AUTFDAGIELLIJU-UHFFFAOYSA-N 398.429 2.651 0 50 GFAA Cc1nc(N2CCC[C@@H](CNC(=O)Cc3cccnc3)C2)nc2c1CCCC2 1506424188 ZEEKQIDFIMUKRC-SFHVURJKSA-N 379.508 2.634 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N(C)Cc1nc(O)c2sccc2n1 1506414625 RFJPFGYVDCNALF-UHFFFAOYSA-N 393.490 2.843 0 50 GFAA Cc1ncccc1Oc1ncnc(N2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)c1C 1704336987 OWZODGKDAFYAGU-UTKZUKDTSA-N 397.479 2.656 0 50 GFAA COC(=O)c1ccccc1NC(=O)[C@H](C(C)C)N1C(=O)c2ccccc2C1=O 1134193 XFXPTUAXCNPABR-KRWDZBQOSA-N 380.400 2.733 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3C[C@@H]4COCC[C@]4(C(=O)O)C3)cc2)c1 1772700875 JHYOWZIUVHFYLN-GCJKJVERSA-N 381.428 2.926 0 50 GFAA CC(=O)N1C[C@@H]2CN(C(=O)Cc3c(C)noc3C)C[C@@]2(CCc2ccccc2)C1 1772708729 JAECZNAZIBSJOB-NFBKMPQASA-N 395.503 2.774 0 50 GFAA COc1ccc(OCc2cc(C(=O)NCc3cnn(C)c3C)n[nH]2)c(Cl)c1 11936626 BBVQIEIFUDMVNF-UHFFFAOYSA-N 389.843 2.623 0 50 GFAA CCOC(=O)CN(C)C(=O)c1cc(COc2cccc(C(F)(F)F)c2)on1 12386790 DVFURWJOGNBPMU-UHFFFAOYSA-N 386.326 2.908 0 50 GFAA O=C(COC[C@@H]1CCCCO1)NCc1cccnc1N1CCc2ccccc2C1 12439360 YXAJCNQYJWUIRH-NRFANRHFSA-N 395.503 2.846 0 50 GFAA CN(C)C(=O)CN1CCN(C(=O)C[C@H](c2ccccc2)c2ccccc2F)CC1 15077175 ZILGWMNGTQHURB-HXUWFJFHSA-N 397.494 2.580 0 50 GFAA COCCN(CCOC)C(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857671968 AKRLQQZTSJQORY-CQSZACIVSA-N 395.887 2.819 0 50 GFAA COCCNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1ccccn1 1857696745 AYLUNPYXIYAYQI-QZNHQXDQSA-N 379.504 2.810 0 50 GFAA O=C1CC2(CCN(c3cnccn3)CC2)OCCN1C/C=C/c1ccccc1 1857703291 PMKXZQJROWIWPI-QPJJXVBHSA-N 378.476 2.778 0 50 GFAA CCCc1cnc(C)nc1N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857718243 QAPCYSDCAZDBSD-PMACEKPBSA-N 380.492 2.744 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(Cc3cc4ccccc4n(C)c3=O)C1)CC2 1857729266 CDZMRKAUTLDIMQ-QHCPKHFHSA-N 390.487 2.823 0 50 GFAA Cc1cc(=O)oc2cc(OCC(=O)Nc3sc4c(c3C(N)=O)CCC4)ccc12 939395 NSMAQWHYKDSTCZ-UHFFFAOYSA-N 398.440 2.768 0 50 GFAA CN(Cc1ccc(C(=O)N(C)C)[nH]1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1 328656023 YZNYIZGQBYLKAN-LBPRGKRZSA-N 383.418 2.626 0 50 GFAA NC(=O)c1nccnc1C(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 366410750 XGBBHAJOUBESPA-UHFFFAOYSA-N 379.247 2.902 0 50 GFAA Cn1cc(C(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)c(C2CCCCC2)n1 262141735 MAKDLDZTSDLPKU-UHFFFAOYSA-N 384.436 2.535 0 50 GFAA COc1ccnc(N2CCN(C(=O)Nc3ccc(C)c(NC(C)=O)c3)CC2)c1 264287207 YBISCYMPMXEGGX-UHFFFAOYSA-N 383.452 2.711 0 50 GFAA CC(=O)N[C@]1(c2noc(C)n2)CCN(c2ccnc3ccc(OC(C)C)cc23)C1 827958034 QBODOIBZJRQRJM-OAQYLSRUSA-N 395.463 2.955 0 50 GFAA Cc1cc([C@H](C)NC(=O)NCCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc(C)c1F 1875265250 WCNQIDZVEFKFLJ-OLEVXBPZSA-N 399.466 2.610 0 50 GFAA CN1CC[C@H](N(C)C(=O)c2nn(-c3ccc(F)cc3)c3c2CCCCC3)C1=O 1875256617 DKSYHACSJUBLSW-SFHVURJKSA-N 384.455 2.583 0 50 GFAA COC(=O)C1=CN(C[C@@H]2CCCO2)C=C(C(=O)OC)C1c1ccc(C)s1 729588 XTKOBRUTCSFRCO-ZDUSSCGKSA-N 377.462 2.749 0 50 GFAA Cn1nc2c(c1S(=O)(=O)Nc1ccc(SC(F)(F)F)cc1)COCC2 2325777699 VWEHNIPKQUKKCY-UHFFFAOYSA-N 393.412 2.906 0 50 GFAA C[C@H]1CN(c2cccc(CN(C)Cc3ccc4cc[nH]c4n3)c2)S(=O)(=O)C1 2325779653 VWTWZGCEESNIFJ-HNNXBMFYSA-N 384.505 2.981 0 50 GFAA CCc1cc2ccc(Br)c(C)c2nc1N1C[C@@H](CO)[C@H](CO)C1 2325784206 IEKZAOKKWLCJLA-GJZGRUSLSA-N 379.298 2.905 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSC1=N[C@H](c2ccccc2)CC(=O)N1 652301 COAPWAOOJUTNQF-INIZCTEOSA-N 397.456 2.762 0 50 GFAA CCCC(=O)N1CCN(c2ccc(NC(=S)NC(C)=O)cc2Cl)CC1 1127722 SWFWKOPQFRHHSU-UHFFFAOYSA-N 382.917 2.622 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc(Cl)c2C)cc1 2872249 XPPZZLRKHPDKMW-LBPRGKRZSA-N 382.869 2.963 0 50 GFAA N=c1nc(N2C[C@@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2[C@H]3CC2CCCCC2)cc(N)[nH]1 2356158489 MEKDVPWTALHRIU-OWSLCNJRSA-N 398.555 2.648 0 50 GFAA COc1cccc(N2CCN(C(=O)c3ccc(-c4n[nH]c(C)n4)cc3)CC2)c1 462056090 RVYXKUPAQOLCTO-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)N1CCC[C@@H](c2ccn[nH]2)C1 114900051 SDPGAMCMUHVZEC-LLVKDONJSA-N 384.408 2.818 0 50 GFAA CCCCc1nnc(NC(=O)CN2CCC[C@H](n3ccnc3CC)C2)s1 137201379 UIBRQGICFVOFBO-AWEZNQCLSA-N 376.530 2.915 0 50 GFAA Cc1cc(NC(=O)C(=O)N2CCC[C@@H](c3[nH]ncc3-c3ccccc3)C2)no1 67741864 VJYJVUZKXPLCJA-OAHLLOKOSA-N 379.420 2.718 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2C(=O)Cc2ccc(C(F)(F)F)cc2)O1 252535694 GPFKJJXEHUOTTM-MWNCTCPHSA-N 385.382 2.958 0 50 GFAA NC(=O)COc1cccc(NC(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)c1 431629693 FSCCSJOYYRSWIK-UHFFFAOYSA-N 389.411 2.800 0 50 GFAA NC(=O)N[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccs1 229850361 IDNLVKRPZVTUBI-IAGOWNOFSA-N 386.521 2.628 0 50 GFAA COCc1nc2n(n1)C[C@H](NC(=O)NC1(c3ccccc3)CCCCC1)CC2 151175223 GTFQCIPEPMKZEO-QGZVFWFLSA-N 383.496 2.898 0 50 GFAA CN(C)S(=O)(=O)c1cccc(Cn2nc(C(F)(F)F)c3cnccc32)c1 122443331 WQMBSNBZJIMQHW-UHFFFAOYSA-N 384.383 2.749 0 50 GFAA C[C@H]1C[C@@H](c2ccc(F)cc2)CN1CC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 172328791 QXUSQGHFOWWGRV-DZGCQCFKSA-N 395.434 2.868 0 50 GFAA Cn1cc(C(=O)N2CC[C@H](c3cccc(Oc4ccccc4)c3)C2)c(O)nc1=O 360388605 HITXGDQYBKHGQY-INIZCTEOSA-N 391.427 2.908 0 50 GFAA Cc1cccc2nc(CNC(=O)[C@H]3CCN(c4ccc(F)c(F)c4)C3=O)n(C)c12 157812326 YHNUKWJLVXVWPR-CQSZACIVSA-N 398.413 2.829 0 50 GFAA CC(C)[C@@]1(CO)CCN(C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)C1 378049861 PUHVUNYGXRUBGO-FQEVSTJZSA-N 379.522 2.884 0 50 GFAA O=C(CN1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1)N1CCc2ccccc2C1 378413258 UQHYBVDUNGWBIF-OAQYLSRUSA-N 395.547 2.686 0 50 GFAA Cc1ccc(N2CC[C@@H](NC(=O)c3cccc(-c4nnc(C)o4)c3)C2=O)cc1 173243595 QIGTUKCFZHUMCM-GOSISDBHSA-N 376.416 2.889 0 50 GFAA COc1ccc(-c2noc(CN(C)c3cc(C4CC(O)C4)nc(C)n3)n2)cc1 220514003 DPPPTUXZEKTVBE-UHFFFAOYSA-N 381.436 2.718 0 50 GFAA Cc1nn2c(nnc3c(=O)n(C[C@@H]4CCCO4)ccc32)c1-c1ccc(F)cc1 40392064 JIQSPJYSYFXHDT-HNNXBMFYSA-N 379.395 2.733 0 50 GFAA CN1CCN(c2ccccc2CN2CCC[C@@H]2c2ccc(C(N)=O)s2)CC1 20448687 NBVPISBNWALXAW-GOSISDBHSA-N 384.549 2.936 0 50 GFAA Cc1cccc(-c2ncc(C(=O)N3CCO[C@@H](c4ccccc4)C3)c(=O)[nH]2)c1 82166280 USKKABGYMVUNIC-LJQANCHMSA-N 375.428 2.959 0 50 GFAA O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1ccccc1Cn1cncn1 178215238 QJQYEJWKSODCRE-SFHVURJKSA-N 395.850 2.515 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N1CC[C@@H](n2cc(Cl)cn2)C1 290872237 FNLNEOSECSSMSG-CQSZACIVSA-N 381.885 2.807 0 50 GFAA CCn1nc(C)c(S(=O)(=O)Nc2ccc3c(c2)CN(CC(F)F)C3)c1C 290877340 BLCDMUYHQAOLTL-UHFFFAOYSA-N 384.452 2.901 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C(=O)N1CN(C(=O)C(F)(F)F)c1ccccc1 239046275 FMKSDXUBMCDTLT-WGGGBPLMSA-N 390.361 2.593 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)C2CC2)C1)c1cccc(-c2ccccc2CO)c1 426701705 ULWCVFAGMASCKD-FQEVSTJZSA-N 378.472 2.977 0 50 GFAA COc1ccccc1OCC(=O)NC[C@@H]1CCCN(Cc2cncs2)C1 95522329 HEYXGIQFSNEXDJ-HNNXBMFYSA-N 375.494 2.559 0 50 GFAA Cc1nc2c(c(NCC[C@H](C)N3CCN(C)CC3)n1)Cc1ccccc1OC2 95512393 GXCBANUWTCWKGE-INIZCTEOSA-N 381.524 2.706 0 50 GFAA CC(C)(C)c1ccc(OC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc1 239173609 OHACCAFHDGWNAZ-FKAIMOKRSA-N 379.456 2.943 0 50 GFAA COc1cc(C(=O)N2CCC(c3nccn3Cc3cscn3)CC2)ccn1 95499611 BQJPAGXLHHDHEI-UHFFFAOYSA-N 383.477 2.811 0 50 GFAA Cc1cccc(N2C[C@H](NC(=O)C3CCN(Cc4ccco4)CC3)CC2=O)c1 95383044 ZZTGGATWYUVJCJ-GOSISDBHSA-N 381.476 2.722 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(c1nc3ccccc3o1)CC2 92080736 YORGVWJQVGHETN-UHFFFAOYSA-N 377.448 2.841 0 50 GFAA COc1ccc(-c2cccc(-c3ccn(CCCN4CCOCC4)n3)c2)nn1 23505623 GAHPXTKJVJHANI-UHFFFAOYSA-N 379.464 2.738 0 50 GFAA O=C1NCCN(C(=O)c2c[nH]nc2-c2cccc(F)c2)[C@@H]1c1cccc(F)c1 92045586 MKEUHKLGMIRWOS-GOSISDBHSA-N 382.370 2.668 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)CCc2ccccc2Br)CC1 186663663 PUWQREZIJZFYBW-HNNXBMFYSA-N 397.313 2.779 0 50 GFAA O=C([C@@H]1COc2ccccc2O1)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 170654084 BGKYDJGRAYTHGG-INIZCTEOSA-N 393.365 2.589 0 50 GFAA COc1ccc(-c2ncc(C(=O)N3CCN(c4ncc(F)cn4)CC3)s2)cc1 273762836 XBMNJWWBJUMTSP-UHFFFAOYSA-N 399.451 2.710 0 50 GFAA CCOc1nc(C)ccc1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1C 276728960 HZNFLZONDIBQRE-UHFFFAOYSA-N 383.448 2.822 0 50 GFAA C[C@H]1C[C@@H](O)CN1c1cnn(CCOc2ccc(Cl)cc2)c(=O)c1Cl 170088633 QPLRDDVAKQRSJZ-WCQYABFASA-N 384.263 2.589 0 50 GFAA C[C@H]1CN(C(=O)NCCc2csc3ccccc23)CCN1CC(C)(C)O 187624162 VOMWOBCRQOBLIR-HNNXBMFYSA-N 375.538 2.930 0 50 GFAA CCCc1cnc(C)nc1N1CCCN(C(=O)c2ccc(N(C)C)nc2)CC1 1772809180 OFXJXJWQTINNAS-UHFFFAOYSA-N 382.512 2.551 0 50 GFAA COCC(=O)N1C[C@H]2CN(c3ncccc3F)C[C@@]2(CCc2ccccc2)C1 1772819361 SFPLOAQUZQURBW-PGRDOPGGSA-N 383.467 2.765 0 50 GFAA CN(C[C@H](O)COc1cccc(CNCCn2cccn2)c1)C1CCCCC1 11759399 IRKOJTUCCFIYSL-NRFANRHFSA-N 386.540 2.677 0 50 GFAA COC(=O)CCNC(=O)c1csc2nc(-c3ccc(OC)c(F)c3)cn12 12300834 FCPVOBBOCCZTMY-UHFFFAOYSA-N 377.397 2.503 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(Cc2ccon2)CC1 12708437 WYJLKBVEACEFGR-UHFFFAOYSA-N 381.436 2.969 0 50 GFAA CC[C@@H](C)C(=O)C(=O)N1CCc2c(cnc(C)c2CNC(=O)c2ccsc2)C1 14883037 KYKAHQPGQDVDAS-CYBMUJFWSA-N 399.516 2.881 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)c1 19773787 YESGYCDXEGRRIY-KRWDZBQOSA-N 376.522 2.834 0 50 GFAA CNC(=O)Cc1cccc(-n2ccnc2-c2cc3c(cc2OC)OCCO3)c1 1857681161 AQESEZSSCSSDIP-UHFFFAOYSA-N 379.416 2.608 0 50 GFAA O=C(N[C@H]1CCC[C@@H](CNC(=O)c2cscn2)C1)c1cncc(Cl)c1 1857707279 LMJYFPJDAYFQKX-RISCZKNCSA-N 378.885 2.910 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCC2(CC1)C[C@H](O)C[C@H](C(C)(C)C)O2 1857710680 JXDJVOSZCXCSQF-RHSMWYFYSA-N 376.497 2.910 0 50 GFAA Cc1cc2c(cn1)CN(C(=O)C1CCN(c3nc4nc(C)ccc4o3)CC1)C2 1857713900 WYBBCVLJXQWNPC-UHFFFAOYSA-N 377.448 2.993 0 50 GFAA COc1ccccc1Cc1nc([C@H]2COCCN2C)n(Cc2ccccc2)n1 1857721631 YWOFEWKDKBXFRU-LJQANCHMSA-N 378.476 2.929 0 50 GFAA Cc1ccc2cc(-c3nccn3[C@H]3C[C@H]4CO[C@@H](CCO)CN4C3)c(O)nc2c1 1857724403 BYUXZISOEBDXEN-BZSNNMDCSA-N 394.475 2.509 0 50 GFAA C[C@H](CNC(=O)c1ccco1)Oc1cccc(CN(C)Cc2cnccn2)c1 12279671 AEPHCIGNVHIPIJ-MRXNPFEDSA-N 380.448 2.899 0 50 GFAA CN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1cccc(N3Cc4ccccc4C3)c1)C2 248011826 FFDCRAFAXCTFHL-CTNGQTDRSA-N 375.472 2.900 0 50 GFAA O=C(c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N1CCOC[C@H](CO)C1 1875297934 IWHGXHRKPGLRDE-NSHDSACASA-N 386.395 2.910 0 50 GFAA Cn1cc([C@H]2CCCCN2C(=O)Cn2cc(NC(=O)CC(C)(C)C)cn2)cn1 1875254261 XKQUJLWKUCHPRB-QGZVFWFLSA-N 386.500 2.745 0 50 GFAA COC(=O)c1nc2cc(NC(=O)[C@@H]3CCN(c4ccccc4F)C3)ccc2[nH]1 1875311410 YHJNPHHWCQUVKV-GFCCVEGCSA-N 382.395 2.954 0 50 GFAA CSCC[C@H](O)C(=O)NCC1(NC(=O)c2ccc(C)s2)CCCCC1 1875361443 SHWILHGSDFOESJ-AWEZNQCLSA-N 384.567 2.719 0 50 GFAA Cc1ccccc1C1CCN(C(=O)c2nc(C)c(C)c(N3CC[C@@H](N)C3)n2)CC1 1875401640 NMJVRHXQHGFBBV-LJQANCHMSA-N 393.535 2.959 0 50 GFAA O=C1CC[C@H](C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCCC4)n2cccc21 886040543 FSEFTZZKGXRLFQ-QGZVFWFLSA-N 376.416 2.691 0 50 GFAA CC(=O)NCc1ccnc(CNC(=O)Cc2nc(-c3ccccc3)oc2C)c1 2100557430 SHXQYGWTOONSRK-UHFFFAOYSA-N 378.432 2.540 0 50 GFAA CN(CC1CCN(c2ccncc2)CC1)C(=O)c1cc(O)c2cnn(C)c2c1 2325748140 IECHYTJTHOTOTH-UHFFFAOYSA-N 379.464 2.663 0 50 GFAA O=C(NC[C@H](NC(=O)[C@H]1CCCCS1)c1ccccc1)[C@@H](O)C1CCCC1 2325860459 IXKKADMKSPHYAH-OTWHNJEPSA-N 390.549 2.797 0 50 GFAA CCOC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@@H]1c1ccc2c(c1)OCO2 803072 YENNMAHIHWJEKX-LJQANCHMSA-N 390.399 2.996 0 50 GFAA COc1ccc(CC(=O)N2N=C(c3ccncc3)C[C@@]2(O)C(F)(F)F)cc1 871856 ZZOOMAJLKRZFMO-QGZVFWFLSA-N 379.338 2.520 0 50 GFAA CCN1C(=O)[C@@](O)(CC(=O)c2ccc3c(c2)OCCO3)c2cc(Cl)ccc21 4840951 VGLZLCCXEWMBPL-HXUWFJFHSA-N 387.819 2.938 0 50 GFAA O=C(CN1CCC(Nc2cc(N3CCCCC3)ncn2)CC1)Nc1ccccc1 110126232 JKISZFQTFPQIAO-UHFFFAOYSA-N 394.523 2.982 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(-n2cncn2)c1 115368393 HQLPVJNMDWASMS-IBGZPJMESA-N 375.476 2.562 0 50 GFAA COc1ccc(Cl)cc1NC(=O)Cn1cc(I)cn1 1432970 KGXMWLSSJJNVFM-UHFFFAOYSA-N 391.596 2.788 0 50 GFAA O=C1CC2(CCN(C(=O)c3cnccn3)CC2)CN1Cc1ccc(Cl)cc1 77378623 OYVCLCPVLVIFEQ-UHFFFAOYSA-N 384.867 2.785 0 50 GFAA Cc1ccc(F)c(-n2cc(O)c(C(=O)NC[C@](C)(O)c3ccc(F)cc3)n2)c1 253418087 DIFUWSRWXYOOGP-FQEVSTJZSA-N 387.386 2.802 0 50 GFAA CC(C)NC(=O)Cn1c(Cc2ccccc2)nn(-c2ccc(Cl)cc2)c1=O 77387316 CKKXBRWVGMJNMS-UHFFFAOYSA-N 384.867 2.803 0 50 GFAA CS[C@@H](C)C(=O)N1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 77515801 NVBPMPCDPUHUMK-HNNXBMFYSA-N 378.494 2.630 0 50 GFAA CCc1nc2ccccc2c(C(=O)N2CCN([C@@H]3CCNC(=O)CC3)CC2)c1C 333736478 KVAKZERAXSDZGI-KRWDZBQOSA-N 394.519 2.532 0 50 GFAA CCN(C)Cc1cc2n(n1)CCCN(C(=O)CCC(=O)c1ccc(F)cc1)C2 72426402 CXBQRTBSEHHORJ-UHFFFAOYSA-N 386.471 2.869 0 50 GFAA COc1cccc(-c2nsc(NS(=O)(=O)c3cn(C(C)C)cn3)n2)c1 129367114 JTJAMMDAQTUXDK-UHFFFAOYSA-N 379.467 2.792 0 50 GFAA CC[C@@H]1CN(C(=O)c2cnn3cc(C)cnc23)CCC(=O)N1Cc1ccccc1 71575546 SINHZEJQXZEXAQ-GOSISDBHSA-N 391.475 2.691 0 50 GFAA O=C(Nc1cccc(C(=O)N[C@H]2COc3ccccc3[C@H]2O)c1)c1cccnc1 378142008 WPRPDLJNZZPMEE-AZUAARDMSA-N 389.411 2.558 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1n[nH]c2c1CCCC2 15079073 RORFIBBGDOIZJC-UHFFFAOYSA-N 390.491 2.687 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c1C 239309617 HTFLFHNBDXCEQG-YWPYICTPSA-N 378.469 2.906 0 50 GFAA CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H](S(C)(=O)=O)C1 239722361 CCMADLNTILRFON-UONOGXRCSA-N 396.488 2.591 0 50 GFAA CC(C)c1ccc(NC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)cc1 242273583 YEDCKXAVVKNGCZ-UHFFFAOYSA-N 376.478 2.898 0 50 GFAA C[C@H](C(=O)NCc1cccnc1OC1CCCC1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 242273611 YEKOVALBLFTBDI-ZTFGCOKTSA-N 399.491 2.583 0 50 GFAA CCc1nnc(-c2cccc(NC(=O)CCn3c(=O)n(C)c4ccccc43)c2)o1 175360995 GBJVABMAZQFADI-UHFFFAOYSA-N 391.431 2.981 0 50 GFAA Cc1cc(C)n(CCCNC(=O)N2CCC[C@@H](c3nnc4ccccn34)C2)n1 43099314 ZUAQXSOSCVTHJJ-QGZVFWFLSA-N 381.484 2.522 0 50 GFAA CCN1C(=O)[C@@H]2[C@H]3c4ccccc4C=NN3[C@H](C(=O)c3ccc(C)cc3)[C@@H]2C1=O 43191185 CRRARLBQFDLNJC-NMLBUPMWSA-N 387.439 2.572 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)Cn1nc(-c2ccccc2)ccc1=O 176858953 OSANHRHUQXSOHL-UHFFFAOYSA-N 394.500 2.904 0 50 GFAA NC(=O)CN1CCC(NC(=O)c2ccc(-c3ccc4cc[nH]c4c3)cc2)CC1 426613520 BJAJOCQFQNBLEK-UHFFFAOYSA-N 376.460 2.514 0 50 GFAA O=C(c1ccc(-c2nc3ccccc3n2CCO)cc1)N1CCCC[C@@H]1CO 426425496 TWCOFEVTTUTRLX-GOSISDBHSA-N 379.460 2.683 0 50 GFAA CCN(CCN1CCCC1)C(=O)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1 91445253 OFSKQYHRECARTC-GOSISDBHSA-N 375.488 2.509 0 50 GFAA Cc1ccc(C(=O)N(C)Cc2cccc(-n3cccn3)c2)cc1N1CCNC1=O 91746671 DPYMNKHFCAXNOC-UHFFFAOYSA-N 389.459 2.983 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)NCCN3CCC[C@H](C(N)=O)C3)c2)c1 95516451 QXZHJZOCRHJXCV-IBGZPJMESA-N 380.492 2.981 0 50 GFAA CC[C@@H](C(=O)Nc1nccs1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 244899363 ZIPSVZMZPZUNCE-HNNXBMFYSA-N 385.493 2.840 0 50 GFAA O=c1c(=Cc2ccco2)sc2n1[C@H](c1ccccc1)C(c1ccccc1)=NN=2 252680086 VQLHHFPYONZRRL-HXUWFJFHSA-N 385.448 2.959 0 50 GFAA Cc1ccsc1[C@@H](CNC(=O)Nc1ccc2c(c1)OCC(=O)N2C)N(C)C 534631821 JYFHLIOEGRLHNM-OAHLLOKOSA-N 388.493 2.836 0 50 GFAA COc1ccc(CCN2C(=O)CC[C@@H]3CN(C(=O)c4ccco4)CC[C@@H]32)cc1 299780494 CPTQRFSFHHOVSH-MJGOQNOKSA-N 382.460 2.984 0 50 GFAA Cc1noc2nc3c(c(C(=O)Nc4ccc(Oc5nn[nH]n5)cc4)c12)CCC3 828136884 LIGIKCGAWRURAK-UHFFFAOYSA-N 377.364 2.578 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)COCc2nc3ccc(C)cc3[nH]2)cc1 952986907 JDMUMYCXXMFOPJ-UHFFFAOYSA-N 382.420 2.612 0 50 GFAA Cc1c(CN2CCCN(Cc3cccnc3)CC2)c(=O)n(-c2ccccc2)n1C 952988773 PBKPPRDVBMNMCB-UHFFFAOYSA-N 391.519 2.587 0 50 GFAA COCCNCCNC(=O)c1csc(-c2cc(Br)cs2)n1 170591328 AUAVVKBOJFCKBO-UHFFFAOYSA-N 390.328 2.600 0 50 GFAA COc1cccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)N(C)C)c1 192770760 HQDPAOAOCGHRMC-LEWJYISDSA-N 395.503 2.719 0 50 GFAA Cn1ncc2c(O)nc(CCC(=O)N3CCC(=Cc4ccccc4F)CC3)nc21 757002304 RZEJFNRPZMZMIR-UHFFFAOYSA-N 395.438 2.847 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCC(O)(c2ccccn2)CC1 1506397126 ZCDPKXCNYODXFW-QGZVFWFLSA-N 376.840 2.853 0 50 GFAA COc1cc(S(=O)(=O)N2CCC[C@]3(CCC[C@H]3OC)C2)c(OC)cc1C 1704342141 IPWXPFRRIYXFCN-RTBURBONSA-N 383.510 2.982 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c(C)c1 1704303470 ZVKVCCHEUQCGGX-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA OC1CCN(C[C@H](O)COc2cccc(CNCCCC3CCCC3)c2)CC1 11768654 AYJVKGVYCIKGKY-QFIPXVFZSA-N 390.568 2.943 0 50 GFAA Cc1c(C(=O)N2CC[C@H](N(C)C)C2)sc2ncnc(NCc3ccco3)c12 12079364 UPGATYPOKCOUCH-ZDUSSCGKSA-N 385.493 2.981 0 50 GFAA Cc1c[nH]c(C(=O)N2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)n1 12203416 PCNDRNMCWBAFQG-HXUWFJFHSA-N 388.418 2.651 0 50 GFAA CCOc1ccc2nc(NC(=O)CSc3nc(C)cc(=O)[nH]3)sc2c1 13424178 RECIXDIJWMHPDH-UHFFFAOYSA-N 376.463 2.818 0 50 GFAA Cc1cnc(-n2ncc(C(=O)N(C)CCO)c2C2CC2)nc1-c1cccs1 14986791 BVBFCWSILJWWIZ-UHFFFAOYSA-N 383.477 2.641 0 50 GFAA Cc1ccccc1N1CCN([C@@H]2CCCN(C(=O)c3snnc3C)C2)CC1 15061795 JJQGANCYICPSBF-QGZVFWFLSA-N 385.537 2.582 0 50 GFAA CCOc1ccc(-n2nnc(C(=O)Nc3cc(OC)ccc3OC)c2N)cc1 16625828 GEBMOYSOCZXUQK-UHFFFAOYSA-N 383.408 2.518 0 50 GFAA CC(=O)Nc1cc(-c2ccc(=O)n(CC(=O)Nc3ccc(F)cc3)n2)ccc1C 16661407 PKIGGLXWCLERIC-UHFFFAOYSA-N 394.406 2.955 0 50 GFAA O=C1CO[C@@H](COc2ccc(F)cc2)CN1C1CCN(c2nccs2)CC1 1857672414 BOVNAXQNIDGXON-QGZVFWFLSA-N 391.468 2.557 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1C 1857675119 LIWGPTOIAOCCKC-JOCHJYFZSA-N 395.459 2.724 0 50 GFAA Cc1[nH]nc(CCC(=O)N[C@H]2CC[C@@H](NC(=O)CCOc3ccccc3)C2)c1C 1857697779 MGSYPBNOKDRKKY-ZWKOTPCHSA-N 398.507 2.582 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC3(CCc4c(O)nc(C5CC5)nc43)CC2)n1 1857715101 BKWYLPJZLMIXQC-UHFFFAOYSA-N 395.507 2.770 0 50 GFAA Cc1n[nH]cc1-c1nc([C@H]2CC[C@H]3OCCN[C@@H]3C2)n(Cc2ccccc2)n1 1857735492 PTHCRYNVBZPQEA-QXAKKESOSA-N 378.480 2.649 0 50 GFAA Cc1cccc(N2C[C@@H]3[C@H](CNC(=O)Cc4ccccc4)[C@H]4CC[C@]3(C2)O4)n1 1875239802 XROQEUBLEKUZOM-DZCCDHAISA-N 377.488 2.733 0 50 GFAA Cc1ccc(C(=O)N2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)c(=O)n1C 209863252 KNYWBUOKSHFVEG-CTNGQTDRSA-N 376.456 2.838 0 50 GFAA CC1=C(C(N)=O)[C@H](c2ccc(F)cc2)N2NC(c3ccccc3Cl)=NC2=N1 940686 INUZFGARJMTFHT-INIZCTEOSA-N 383.814 2.916 0 50 GFAA c1cc(N2CCCC2)nc(C2CCN(Cc3nc4c(s3)CNCC4)CC2)n1 952892712 PLZUAYCBOWGULU-UHFFFAOYSA-N 384.553 2.559 0 50 GFAA Cc1c(NC(=O)CCn2c(=O)n(C)c3ccccc32)cccc1-c1nnco1 1875253887 XEYUSMZISQRNSI-UHFFFAOYSA-N 377.404 2.727 0 50 GFAA O=C(NC1(CN2CCN(c3ccc(F)cc3)CC2)CC1)[C@@H]1CCc2cccnc21 888100773 QWSWKEDUWXZDPC-HXUWFJFHSA-N 394.494 2.722 0 50 GFAA CC(C)(C)N1C[C@@H](CN2C(=O)CCN(CC[C@@]3(C)CC3(F)F)C2=O)CC1=O 2325779605 RJBUYSQNDOCTHM-ACJLOTCBSA-N 385.455 2.723 0 50 GFAA CN(C)CCN1CCCN(C(=O)c2c(-c3ccccc3)nn3ccccc23)CC1 2325858202 DCTOLSZZXXYGMO-UHFFFAOYSA-N 391.519 2.711 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Nc2cc(Cl)ccc2OC)C1=O 2356151651 RWGKHDFNYSFWKZ-IBGZPJMESA-N 395.887 2.984 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)Cc2cccnc2)n1Cc1ccccc1 55166499 MSKVYRLTPAPTJP-UHFFFAOYSA-N 384.505 2.752 0 50 GFAA CCCCn1c(CN2CCN(C3CCCCC3)CC2)cnc1S(=O)(=O)CC 20119061 XSKBCXLXAGBXNU-UHFFFAOYSA-N 396.601 2.927 0 50 GFAA CCc1nc(NC(=O)c2ccc([C@H]3CCCN3C(=O)CSC)s2)nn1C 20232875 IANROEYUTZUREK-LLVKDONJSA-N 393.538 2.718 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)c(C)c1 67601822 GZXAACXJIOUULT-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA O=C1N[C@@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccccn1 67909054 YYDSJIUZNHFYIW-QFIPXVFZSA-N 378.476 2.505 0 50 GFAA O=C1N[C@](Cc2ccc(F)cc2)(C2CCNCC2)C(=O)N1Cc1cccc(F)c1 67692214 GOZZCAFGLCXHJP-JOCHJYFZSA-N 399.441 2.998 0 50 GFAA Fc1ccccc1Cc1noc(CN2CCC(N3CCSCC3)CC2)n1 23337550 DLFLVFJSYVDQAQ-UHFFFAOYSA-N 376.501 2.813 0 50 GFAA O=C(c1ncccc1N1CCCCC1)N1CCc2[nH]nc(-c3ccno3)c2C1 23506371 RPQWQVGKDLPCMZ-UHFFFAOYSA-N 378.436 2.649 0 50 GFAA Cc1ccc2c(c1)CC[C@@H](C(=O)Nc1ccc(F)cc1NS(C)(=O)=O)O2 281218644 OFDTXZMXKUTNHR-KRWDZBQOSA-N 378.425 2.838 0 50 GFAA O=C(c1cc2ccccn2c1)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328636019 VHMVUEKGYSDLOY-IBGZPJMESA-N 377.448 2.543 0 50 GFAA CN(C)[C@H]1Cc2ccccc2N(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)C1 122815623 YDEUUUIFDXOCHF-HNNXBMFYSA-N 399.516 2.598 0 50 GFAA O=C(N1CCCC1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nc3c([nH]2)CCCC3)C1 329056815 YAYBTAYBGKUSLH-QFBILLFUSA-N 399.539 2.880 0 50 GFAA O=C([C@@H]1CC12CCCC2)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 329393405 USOOAKSFEYCKRH-MSOLQXFVSA-N 388.533 2.950 0 50 GFAA CC(C)Cc1ccc(CN2CCn3nc([C@H](O)c4nccn4C)cc3C2)cc1 218794395 BYJJQVARKSBWHS-NRFANRHFSA-N 379.508 2.913 0 50 GFAA COc1cccc([C@H]2C[C@@H](C)CN2C(=O)NCCNC(=O)c2cccnc2)c1 363736342 GQHAQPLODRDBSK-DNVCBOLYSA-N 382.464 2.613 0 50 GFAA CN(C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1)C1CCNCC1 237093801 OAOMIXQWZFAHFY-GOSISDBHSA-N 389.499 2.821 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(C(=O)C3CC3)CC2)CN1Cc1ccc(O)c(Cl)c1 72412005 LMECMQZKBYSOMP-INIZCTEOSA-N 392.883 2.723 0 50 GFAA N[C@H]1CCCN(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)C1 157824770 DRTGVXNMAHHYAW-ZJVMWOEPSA-N 387.487 2.956 0 50 GFAA O=C(NS(=O)(=O)Cc1c(F)cccc1F)c1cnc([C@@H]2CCCO2)s1 129441710 BPCLOVZKNTUOPZ-LBPRGKRZSA-N 388.417 2.533 0 50 GFAA OC[C@]1(O)CCCN(Cc2cccc(OCCCN3CCCCC3)c2)CC1 72165281 ZWCAAVLARGUCDU-QFIPXVFZSA-N 376.541 2.651 0 50 GFAA COc1ccc(F)c(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c1 71738752 UHKVMJHRIGLTNW-INIZCTEOSA-N 389.515 2.789 0 50 GFAA C[C@H](Oc1cccnc1)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 175323869 RKANCRNMWSTUJA-NSHDSACASA-N 384.827 2.994 0 50 GFAA CN(CC(=O)Nc1ccc(N2CCCCC2)nc1)C[C@H]1COc2ccccc2O1 175484518 PQLKFZYJDMVXHM-SFHVURJKSA-N 396.491 2.782 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(C(=O)c3cnccn3)CC2=O)cc1 82137387 WOLJUKUORNMTHG-HXUWFJFHSA-N 386.455 2.885 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(S(C)(=O)=O)cc1 130543946 NQFJZKJWQHYPAK-UHFFFAOYSA-N 386.473 2.887 0 50 GFAA COCCCONC(=O)N1CCC2(CC1)C[C@@H]2N(Cc1ccsc1)C(C)=O 287781299 AMVNUVXTDARXIQ-KRWDZBQOSA-N 395.525 2.629 0 50 GFAA CCCCCC[S@](=O)[C@H]1CS(=O)(=O)C[C@H]1[S@@](=O)CCCCCC 195812693 XLALDRNIXLZYLY-KFVVBQDRSA-N 384.629 2.810 0 50 GFAA COc1cccc(CN(C(=O)NCCc2nncn2C)C2CCCC2)c1OC 426548809 PYWXMXOKDYUKIJ-UHFFFAOYSA-N 387.484 2.529 0 50 GFAA Cc1nnc(CN2CCC3(CC2)CC(=O)N(Cc2cc(F)cc(F)c2)C3)o1 95384513 USUMQYIZEXYTTM-UHFFFAOYSA-N 376.407 2.671 0 50 GFAA CCn1nccc1S(=O)(=O)N1CCC[C@@](C)(Cc2ccc3c(c2)OCO3)C1 91288629 RSCGCXBLMHAPJZ-IBGZPJMESA-N 391.493 2.665 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCN2C(=O)c2c[nH]c(=O)c3ccccc23)s1 97785590 RKEAFQJJJHZUHK-OAHLLOKOSA-N 381.457 2.927 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3nc4ccccn4c3F)C2)CN1CC1CC1 92064806 ABTRGOIPOVAWSK-OAQYLSRUSA-N 384.455 2.728 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](c3ccc(C(=O)O)cc3)C2)cc1 95390252 WEAKDCRWKAHODA-KRWDZBQOSA-N 387.457 2.808 0 50 GFAA CCCCn1ccnc1[C@@H]1CCCN(C(=O)Cn2c(=O)oc3ccccc32)C1 95530660 BKCLBPPJTXRAAX-MRXNPFEDSA-N 382.464 2.997 0 50 GFAA Cc1noc2ncnc(N[C@H]3CC(C)(C)Cc4nc(N5CCOCC5)ncc43)c12 92098261 VVMLFEYXIJHONQ-AWEZNQCLSA-N 395.467 2.678 0 50 GFAA CN(CCC(=O)O)C(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 299753896 ZSCZOOIQWQMNAP-CJNGLKHVSA-N 386.370 2.548 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCCN(c3ccc(-c4ccccc4)nn3)CC2)n1 371577694 OVLHYQORBVIPPU-UHFFFAOYSA-N 390.491 2.696 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN(c3ccccn3)C2)cc1C(=O)N(C)C 824699827 RAYGYFXHIARMHL-HNNXBMFYSA-N 382.464 2.647 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2ccccc2[C@@H](O)C1 584903959 HJSCZHSCUFNKKM-FQEVSTJZSA-N 379.460 2.681 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)NS(=O)(=O)Cc1ccccc1Cl 170656503 DICFLZCRIVYNQJ-QGZVFWFLSA-N 379.865 2.990 0 50 GFAA COCCOc1ccc(N[C@H]2CCCN(c3ccn(C)n3)C2=O)cc1Cl 170644334 BHDDKPDFKDFZRC-HNNXBMFYSA-N 378.860 2.706 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N3CCC(CS(N)(=O)=O)CC3)s2)c(C)c1 170624927 NRKXRKISCDYHHD-UHFFFAOYSA-N 393.534 2.568 0 50 GFAA COc1ccc(CCC(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)cc1OC 269436208 MPATWCRCNKYBFQ-KRWDZBQOSA-N 385.464 2.634 0 50 GFAA Cc1nn(C)c(C)c1CN1CCN(C(=O)[C@@H](C)c2cn(C)c3ccccc23)CC1 185422641 IZGWEFVDAFWPRF-INIZCTEOSA-N 393.535 2.977 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)c2cc3c(nc2O)CCCC3)n1 1506425049 LICDAYCGAMZZRJ-INIZCTEOSA-N 386.452 2.605 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@H](OCc3ccccn3)C2)nn1 11937944 NMWGSIPJMONZTP-FQEVSTJZSA-N 391.475 2.851 0 50 GFAA CCCc1noc(CN(C)C(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)n1 12749634 LTNUYHDCINJXPT-MRXNPFEDSA-N 376.501 2.799 0 50 GFAA Cc1c(C(=O)NC(C)(C)CO)cnn1-c1ncc2c(n1)-c1ccccc1CCC2 14997500 GXOHOKVTNPCBHF-UHFFFAOYSA-N 391.475 2.627 0 50 GFAA COc1ccc2c(c1)O[C@@H](C)CN(CCC(=O)NC1Cc3ccccc3C1)C2 15009224 BMBNUGULIPWOIA-INIZCTEOSA-N 380.488 2.952 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1ccc(F)cc1F 15062388 OOYVKFFUGUQHSR-SFHVURJKSA-N 384.390 2.544 0 50 GFAA Cc1noc(-c2cccn3c(CNC(=O)c4ccc5ccccc5n4)nnc23)n1 169780447 BKGCUNDXBDDCMC-UHFFFAOYSA-N 385.387 2.566 0 50 GFAA CC(C)n1cnnc1CN(C)C(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857667580 DUXYSLVTPBSEGH-HNNXBMFYSA-N 397.483 2.660 0 50 GFAA CCOCCn1nc(CC)nc1C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857679340 UUSLLMYSLHBNRI-OAHLLOKOSA-N 384.484 2.872 0 50 GFAA CN(C)c1nc(N2CCCCC2)c2c(n1)C1(CC2)CCN(C[C@H]2CCCO2)CC1 1857694481 PNCMNCMREGIVNT-GOSISDBHSA-N 399.583 2.992 0 50 GFAA CCOC(=O)c1nc(=NCc2cc(=O)c3ccccc3[nH]2)cc(C(C)(C)C)[nH]1 871073628 GFXALOVGMYONTL-UHFFFAOYSA-N 380.448 2.826 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)C(C)(C)Cc2ccccc2)N(c2cc(C)ncn2)C1 1875392047 QNRVMCOYDAIQIT-OALUTQOASA-N 382.508 2.764 0 50 GFAA O=C(NC1CC1)N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)nc3ccccc23)C1 1875310115 FDGXZSZYFOSJQB-GFCCVEGCSA-N 392.381 2.930 0 50 GFAA O=C1CCN(C[C@]23C[C@H]2COC32CCC2)C(=O)[C@H](Cc2cc3ccccc3o2)N1 1875404477 KHETZGLBNCHAML-SGXKBVARSA-N 394.471 2.652 0 50 GFAA O=C(N[C@H]1CC[C@H](C(=O)O)CC1)C1CCN(C(=O)c2ccccc2Cl)CC1 2100483099 RCEYBURYPNZETN-SHTZXODSSA-N 392.883 2.952 0 50 GFAA O=C(c1cc2cc(F)ccc2[nH]c1=O)N1CCC[C@](CO)(c2ccccc2)C1 879887081 WKWCBQNDWZCRGX-QFIPXVFZSA-N 380.419 2.834 0 50 GFAA CCS(=O)(=O)Nc1ccc(Cc2ccc(NS(=O)(=O)CC)cc2)cc1 1114761 MVLYSBYAJPLNHC-UHFFFAOYSA-N 382.507 2.801 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(OC)c(Cl)c2)S(C)(=O)=O)cc1 1169129 QTIGJDLPMSTVSF-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)N1C[C@H](O)C[C@@H](O)C1 2356154072 HGJMCAYCPJAYKD-WOJBJXKFSA-N 391.471 2.561 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(c3cccc(OC)c3)CC2)cc1 6314208 CBJJOWRPBGXYPZ-UHFFFAOYSA-N 376.478 2.605 0 50 GFAA COc1ccc(CN2C[C@H]3[C@@H](C2)OC(=O)N3Cc2ccc(OC)c(OC)c2)cc1 55225492 NDMAXYSMTSSVIV-GHTZIAJQSA-N 398.459 2.918 0 50 GFAA O=C(c1ccc2nnc(S)n2c1)N1CCC[C@H]1c1cccc2c1OCCO2 225803056 ZTLRDFLCSQDCBR-AWEZNQCLSA-N 382.445 2.767 0 50 GFAA Cn1nccc1C(=O)N1CCC[C@@H]1c1ccc(C(=O)Nc2cnns2)s1 20993861 ACELTTURNTYDCR-SNVBAGLBSA-N 388.478 2.563 0 50 GFAA COc1ccc([C@@H]2[C@H](C(=O)Nc3cnn(C)c3)c3ccccc3C(=O)N2C)cc1 61720675 PEOSYHQRGDORMT-WOJBJXKFSA-N 390.443 2.978 0 50 GFAA Cn1cc(-c2cc(C(=O)N3CCN(c4ccccn4)CC3)c3ccccc3n2)cn1 63857696 YYBFEAWPPKKWSQ-UHFFFAOYSA-N 398.470 2.993 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1 2573745 RQAHJROJUAPOQU-VMPITWQZSA-N 399.516 2.724 0 50 GFAA Cc1nc2cc(C(=O)N3CCN(Cc4ccc(C)c(C)c4)C(=O)C3)ccc2[nH]1 77517439 ZKCMMUBCYYVUFX-UHFFFAOYSA-N 376.460 2.973 0 50 GFAA CCN(Cc1cccs1)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C 366348643 NIVOEDRZBLDIAH-VQIMIIECSA-N 386.521 2.972 0 50 GFAA Cc1nc(C)c(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)s1 187777864 VWNVJQBPNLYUNW-UHFFFAOYSA-N 377.417 2.593 0 50 GFAA C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H]1CCC(=O)N[C@H]1C1CC1 367069259 UQGPCAXSPITCRU-VOWSPCBNSA-N 377.916 2.724 0 50 GFAA CN(C[C@H]1CCCN1c1cccnn1)C(=O)c1ccccc1Oc1cnn(C)c1 283292616 SZONWQMDUWQJAM-MRXNPFEDSA-N 392.463 2.743 0 50 GFAA O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCNC[C@H]1c1cccnc1 261890662 ZPYHJEVPFKLRKU-CTNGQTDRSA-N 382.483 2.606 0 50 GFAA c1ccc2[nH]c([C@H]3CCCN(Cc4cnc(N5CCOCC5)nc4)C3)nc2c1 72425262 ZZBXBSNCVYFUJW-KRWDZBQOSA-N 378.480 2.569 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@@](C)(O)c1cnn(C)c1 157565804 KUTLBLQSWUIKRR-GOSISDBHSA-N 392.818 2.814 0 50 GFAA COC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2c(Br)c(C)nn12 13645805 JHMXVLXRZPRXIE-UHFFFAOYSA-N 390.193 2.983 0 50 GFAA O=C1N[C@H](CCc2ccccc2)C(=O)N1CC(=O)N1CCC[C@H]2CCCC[C@@H]21 129484790 OKXRFDQHOMIIRC-QRVBRYPASA-N 383.492 2.721 0 50 GFAA COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)N1[C@H]2CCC[C@H]1CC2 378032769 LFPPJYIXTLKNID-IRXDYDNUSA-N 386.496 2.632 0 50 GFAA Cn1ccnc1-c1cccc(C(=O)NC2CCN(C(=O)C3CCCC3)CC2)c1 426473000 WCGOKUKNZODAHL-UHFFFAOYSA-N 380.492 2.998 0 50 GFAA Cc1cc(C)c(Cn2cncn2)cc1CN1CCC[C@H](c2ccn(CCO)n2)C1 426421095 IHUNQIOJDCSPIC-IBGZPJMESA-N 394.523 2.512 0 50 GFAA CNC(=O)c1cccnc1N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95526820 LVVQVVFQMBTVBN-CQSZACIVSA-N 382.493 2.527 0 50 GFAA O=C1CC[C@@]2(CCCN(S(=O)(=O)c3c(F)cccc3F)C2)CN1C1CC1 91663431 IYXSHSZXHIVOEB-GOSISDBHSA-N 384.448 2.521 0 50 GFAA CC(C)n1cc(CN2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cn1 92037928 IDLHDGUKDYWKLW-NRFANRHFSA-N 384.528 2.634 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(c1nc(C)c(C)cc1C#N)C2 95375338 SDHWUXLNPCYIMP-XPNTWCBSSA-N 398.551 2.914 0 50 GFAA CC[C@]1(C)CC(=O)c2cc(NC(=O)N3Cc4nc(C)[nH]c(=O)c4C3)ccc2O1 96148416 ZFRLURQZMICWIG-HXUWFJFHSA-N 382.420 2.760 0 50 GFAA O=C1CCCCCCN1CC(=O)N1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1 181331988 IRAVWCMAZCEAEF-SFHVURJKSA-N 395.507 2.970 0 50 GFAA COCCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)C1(c3ccccc3)CCCCC1)C2 95519704 JMASONCKDIFZHO-AZUAARDMSA-N 384.520 2.984 0 50 GFAA O=c1c2ccccc2nc(O)n1C[C@H]1CC[C@H](C(=O)NCc2ccccn2)CC1 245256355 PONKMAIPWZDOKA-WKILWMFISA-N 392.459 2.620 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)CO[C@@H]2CCC[C@@H](C)C2)cc1OC 299741684 ADIJIUFUQBNASN-BMFZPTHFSA-N 379.453 2.931 0 50 GFAA CCc1ccc(CN(C)Cc2cnc(S(=O)(=O)CC)n2CCOC)cc1 55183403 IGLPHYFCCSWNOM-UHFFFAOYSA-N 379.526 2.518 0 50 GFAA c1ccc(-c2cnn3cc(CN4CCN(C[C@@H]5CCCO5)CC4)cnc23)cc1 67954477 PYYSKKYUFKVVRK-FQEVSTJZSA-N 377.492 2.693 0 50 GFAA CCc1noc(CCNC(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2)n1 299793236 HTKHVQAMXVSOOP-AWEZNQCLSA-N 385.468 2.868 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)N3CCN(c4ccncc4)CC3)CC2)cc1 825168546 UDGFMQHNABJFNW-UHFFFAOYSA-N 392.503 2.591 0 50 GFAA O=C1N[C@@H](C(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)Cc2ccccc21 827780160 YALNABPSVVQAEF-QGZVFWFLSA-N 382.851 2.620 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2cccs2)C1)c1cc(=O)n(-c2ccccc2)[nH]1 670444059 XBJYIWTVAVDRHL-OAHLLOKOSA-N 382.489 2.622 0 50 GFAA COc1ccc([C@H]2CN(c3noc(-c4ccccc4)n3)C[C@@H]2NC(C)=O)cc1 1565526960 NUONREVPXLXCRF-MOPGFXCFSA-N 378.432 2.854 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)C[C@@H]1CC(=O)O 204044028 PNXCGQIZIZHADE-HNNXBMFYSA-N 378.425 2.719 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)c2ccc(OC(F)F)cc2)N1 1506411028 NTCQQAZZMACMJF-HNNXBMFYSA-N 375.375 2.604 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCN(C(=O)c2cccs2)CC1 1506400994 HOMAWPMLYTZFDC-INIZCTEOSA-N 394.880 2.994 0 50 GFAA O=C(C1CCN(C(=O)C2(Nc3ccccc3)CCCC2)CC1)N1CCOCC1 1506414632 RLNJIPUAXMVRJI-UHFFFAOYSA-N 385.508 2.509 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529139252 NOHWCVIWGZIBEN-XMSQKQJNSA-N 392.503 2.580 0 50 GFAA O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2Br)CC1 262442516 BNDHOIBONUDGKQ-UHFFFAOYSA-N 382.663 2.588 0 50 GFAA Cc1nc(C(=O)N2CCC[C@H](c3nc(C4CCOCC4)n[nH]3)CC2)cs1 1772705590 JYRXZWGQVVCOMC-ZDUSSCGKSA-N 375.498 2.874 0 50 GFAA COc1ccccc1CN1CCCC[C@@H]1CCn1cc(C(=O)NC2CC2)nn1 11882236 RZGOGROBQUOKIY-GOSISDBHSA-N 383.496 2.624 0 50 GFAA COCc1ccc(CN[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)o1 11949015 OYFZQEIPZMXQJB-SFHVURJKSA-N 386.496 2.856 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)CSC 11956624 KTAYDEPLQBDCNT-KRWDZBQOSA-N 376.566 2.704 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N1CCC(C(=O)NC(C)C)CC1 12382895 OBAPCTJPHBGLDE-UHFFFAOYSA-N 382.526 2.744 0 50 GFAA O=C(NC[C@@H]1CCCO1)[C@@H]1C[C@H](CN2CCCC2)CN(Cc2ccccc2)C1 14541127 CUTZOYUNUWEFQO-VSKRKVRLSA-N 385.552 2.516 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2cc[nH]n2)CC[C@@H]1NC1Cc2ccccc2C1 1857684944 KWQSWONWTNNHRK-NYVOZVTQSA-N 396.535 2.747 0 50 GFAA CC(=O)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NCCc1ccncc1)C2 1857700109 NDNIIDZAATUZHX-QZNHQXDQSA-N 377.488 2.753 0 50 GFAA Cc1cccnc1C(=O)N1CCC[C@@]2(CN(CCc3ccccc3)CC[C@H]2O)C1 1857707452 SYLVOMFUHAPRMJ-ZJSXRUAMSA-N 393.531 2.922 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cn([C@H]3CC[C@@H](N)CC3)nn2)C[C@@H](c2ccccc2)O1 1857715311 MBILBRACMTXDJE-JYRKZWEQSA-N 397.523 2.959 0 50 GFAA O=C(CCc1nc(Cl)n[nH]1)N1CC[C@H](c2ccc3ccccc3c2)[C@@H](O)C1 209777984 SOZJSRVITYWNEV-SJORKVTESA-N 384.867 2.921 0 50 GFAA CNC[C@@H]1CCCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 237215095 SVQLGWAOYQQZBA-HNNXBMFYSA-N 398.956 2.885 0 50 GFAA Cc1ccc2cccc(C(=O)N3CCN(CC(=O)NC4CCCCC4)CC3)c2n1 132843019 UWOQWSAWHXGCDE-UHFFFAOYSA-N 394.519 2.750 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)N(Cc2ccccc2)C[C@H](O)c2ccccc2)C1 806972699 HMCQDHMZXRYDMW-RTWAWAEBSA-N 395.503 2.943 0 50 GFAA Cc1nnc([C@@H]2CCCN2C(=O)[C@H]2C[C@@](F)(CNC(=O)OC(C)(C)C)C2)o1 1875293291 KTYDSRCXBCBJMN-LXIYXOSZSA-N 382.436 2.685 0 50 GFAA C[C@H]1CN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)Cc2cncnc21 1875290784 CQHABAYKJCVANJ-ZDUSSCGKSA-N 375.436 2.833 0 50 GFAA Cc1nc(C(N)=O)nc(N2CC[C@@H](N[C@@H](C)c3ccc4ccccc4n3)C2)c1C 1875397573 FJGNNZMJEBWWHO-DOTOQJQBSA-N 390.491 2.670 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)c1ccc(-n2cccn2)cc1 1875389337 KYDAQPPSCQHQPT-NRFANRHFSA-N 386.455 2.742 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875394293 CSIJBCZSUVNFRR-UONOGXRCSA-N 384.480 2.839 0 50 GFAA CN(C[C@@H]1CCCN(C(=O)c2cnc3cc[nH]c3c2)C1)C(=O)CC[C@H]1CCOC1 1875338638 FKOFLHLJZYCYJB-IRXDYDNUSA-N 398.507 2.690 0 50 GFAA N=c1[nH]c2cccc(C(=O)N3CCc4nc[nH]c4[C@@H]3c3ccncc3)c2s1 2100473541 QRIWVWMTRZXCFZ-INIZCTEOSA-N 376.445 2.615 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)c2cccnc2Oc2ccccc2C(N)=O)c2nccn21 2325855876 SGSKYULCGWOUOH-IUODEOHRSA-N 377.404 2.605 0 50 GFAA O=C(COc1ccc(Cl)cc1Cl)OCn1nnc2ccccc2c1=O 953966 SYOPTQDIGUZNNM-UHFFFAOYSA-N 380.187 2.678 0 50 GFAA O=C(NCCc1ccn(-c2ccc(F)cc2)n1)c1ccc(NCC2CC2)nc1 469699930 IDAOTOFLIMUVOO-UHFFFAOYSA-N 379.439 3.201 0 50 GFAA O=C(Nc1ccccc1)C(=O)Nc1ccc(O)cc1I 225434458 GOQFMRYDWIIISL-UHFFFAOYSA-N 382.157 2.574 0 50 GFAA C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cccc2c1OC(F)(F)O2 414369430 JFGXSVJNIYJUDA-NSHDSACASA-N 384.404 2.849 0 50 GFAA CCCN(Cc1ccc(OC)cc1)C(=O)[C@H]1CC(=O)N(Cc2ccncc2)C1 55212097 HKIIHFIAGHCTFY-IBGZPJMESA-N 381.476 2.878 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c[nH]c4ccccc34)C[C@H]2CCO)CC1 104645720 PDQMUDHQFJKERN-OAQYLSRUSA-N 384.568 2.909 0 50 GFAA Cc1cc(CN2CCN(c3ncccc3C(=O)N3CCCC3)CC2)ccc1O 65452623 GMKCRDBNTKZVME-UHFFFAOYSA-N 380.492 2.654 0 50 GFAA O=C(N[C@H]1CCc2c[nH]nc2C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1 468089824 ZIXHXLIDZCLQIH-KRWDZBQOSA-N 384.443 2.945 0 50 GFAA CN(Cc1cccc(C(=O)Nc2cn(C)nn2)c1)C[C@@H]1Cc2ccccc2O1 67934591 QFBNCTXMDVZOIN-SFHVURJKSA-N 377.448 2.503 0 50 GFAA O=C(c1coc(COc2ccccc2)n1)N1CCC(Nc2ncccn2)CC1 67948032 ZGKOTWBNVSVLJA-UHFFFAOYSA-N 379.420 2.760 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(C)o3)[C@H](CCO)C2)cc1CO 22852901 PCAPUKHDLROHKM-HXUWFJFHSA-N 388.508 2.548 0 50 GFAA CCCCN1CCN(C(=O)c2ccc(OCC(=O)N3CCCCC3)cc2)CC1 65492660 ZDASLLQLINCWCM-UHFFFAOYSA-N 387.524 2.636 0 50 GFAA CCn1cc(C2=NO[C@@H](C(=O)Nc3cc(C)nn3-c3ccccc3)C2)c(C)n1 4101813 UYIDJKQTKALBFC-GOSISDBHSA-N 378.436 2.837 0 50 GFAA Cc1c[nH]c(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)c1 72144563 LLLXXLHCWJGCDS-ZLGUVYLKSA-N 379.460 2.754 0 50 GFAA C[C@H](NC(=O)CC(C)(C)C)C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 363781709 QLSLQEHBFFZZSD-UONOGXRCSA-N 381.467 2.848 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCC2)cc1CCC(=O)N1CCC[C@H](C)C1 72437619 VUOBDASNYGRCRP-INIZCTEOSA-N 394.537 2.671 0 50 GFAA COCc1nc2ncc3c(=O)n(-c4cc(Cl)ccc4Cl)ccc3n2n1 71375438 UKIRKQWCXUCVCV-UHFFFAOYSA-N 376.203 2.882 0 50 GFAA Cc1ccc(-c2cncc(C(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)c2)cc1 130092745 KWBONXHTQDSIND-INIZCTEOSA-N 377.366 2.950 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4ccc(Cl)c(Cl)c4)ccc3n2n1 71376397 OOBUVSZZFQJDMS-UHFFFAOYSA-N 379.232 2.852 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)NCc2cnc3cnccn23)n1 221447029 HWJAPCMOTFZBSS-UHFFFAOYSA-N 376.420 2.727 0 50 GFAA Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N3CCN4CCC[C@H]4C3)c12 20606156 DTEXTVRNUSPOTI-AWEZNQCLSA-N 381.505 2.925 0 50 GFAA Cc1cccc(-c2noc(CCCC(=O)NCc3cnc4cnccn34)n2)c1 426497012 UBFJHYXZIXSHRP-UHFFFAOYSA-N 376.420 2.727 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)NCCN2CCCc3ccccc32)c1 96166418 HWHGSELMZQWJCV-UHFFFAOYSA-N 377.452 2.545 0 50 GFAA CCCc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)n(C)n1 95383921 WRVQQNTVZUIELZ-QFBILLFUSA-N 380.492 2.749 0 50 GFAA Cc1cc(Cl)cc(C)c1NC(=O)N1CCCO[C@@H](CN2CCOCC2)C1 96133219 MJPBVMKOIKZLMZ-KRWDZBQOSA-N 381.904 2.912 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(CCn1c(=O)oc3ccccc31)CC2 96163261 BTOIMKMMJOMQMH-UHFFFAOYSA-N 395.507 2.577 0 50 GFAA Cc1nc(CN2CCC(C(=O)Nc3cccc(-c4nnc(C)s4)c3)CC2)n[nH]1 95522865 OKCCIECJKWTZJZ-UHFFFAOYSA-N 397.508 2.791 0 50 GFAA O=C(NCCCn1ccnc1)Nc1cc(C(=O)N2CCCC2)ccc1Cl 95526229 LIKBWZKQRIGDMN-UHFFFAOYSA-N 375.860 2.984 0 50 GFAA O=C(c1ccccc1)N1CCC(c2nnc(Cn3ccnc3)n2C2CC2)CC1 96133604 WLDIJYCAAJKBTL-UHFFFAOYSA-N 376.464 2.878 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2cccc(-c3ccc(C)cc3)c2)C[C@@H]1CO 91270195 HRNCJSNFMYGEMT-DHIUTWEWSA-N 396.531 2.921 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(C(=O)c2cc3sccc3[nH]2)C1 95353346 SYMNBOOVPKOMKR-ZDUSSCGKSA-N 395.492 2.623 0 50 GFAA Cc1nc(C)n(CCCNC(=O)N(C)Cc2cnn(-c3ccccc3C)c2)n1 534583430 WCUZHPKVLUAZCL-UHFFFAOYSA-N 381.484 2.621 0 50 GFAA CO[C@@]12CC[C@@H](NC(C)=O)C[C@@H]1N(Cc1cc(O)c3cccc(F)c3n1)CC2 534575985 BZUZAQBCRJGYES-XWRIVVANSA-N 387.455 2.728 0 50 GFAA Cc1ncc(CC(=O)N2CCC(c3[nH]ncc3-c3ccccc3C)CC2)c(=O)[nH]1 67868135 YXLICEHBFIZRPQ-UHFFFAOYSA-N 391.475 2.726 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cc(C(=O)O)cc(Br)n2)CC1 725347971 WUZPBMUBRISULG-UHFFFAOYSA-N 386.246 2.599 0 50 GFAA Cc1c(NC(=O)CN(C)C)cccc1NC(=O)[C@@H]1CC(=O)OC12CCCCC2 823678321 IWSKICDMRIYXJS-HNNXBMFYSA-N 387.480 2.700 0 50 GFAA COc1ccccc1N1CCN(C(=O)NCc2nn(C)c3ccc(C)cc23)CC1 584894380 HKMOPGQVWHYOIR-UHFFFAOYSA-N 393.491 2.922 0 50 GFAA Cc1nc(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCCCCC2)cn1C 670473707 YJZWCDKYIAIILC-SFHVURJKSA-N 376.526 2.624 0 50 GFAA O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccnc1SC/C=C/c1ccccc1 670452700 GOPLEXYGNQBPHS-CDVVCGDMSA-N 388.514 2.804 0 50 GFAA COc1cc2c(cc1OC)[C@H](NC(=O)[C@@H](C)n1cnc3ccccc3c1=O)CC2 888105476 BUFFYWYYCSRTHZ-FZKQIMNGSA-N 393.443 2.778 0 50 GFAA CN(C)c1nc2cc(NC(=O)N[C@H]3CCCO[C@@H]3c3cnn(C)c3)ccc2o1 275867928 KCBKIKWIUDKXQK-WMLDXEAASA-N 384.440 2.669 0 50 GFAA CC(C)(C)n1ncc2c(=O)[nH]c(N(CCCO)Cc3cccc(Cl)c3)nc21 193481654 JTUHTFRHODODOW-UHFFFAOYSA-N 389.887 2.917 0 50 GFAA O=S(=O)(c1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1)N1CCCC1 194002406 NSDRNHYXFLQXIC-VAMGGRTRSA-N 390.549 2.908 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NC[C@H]3CN4CCC[C@@H]4CO3)c12 747344147 VEYZLGSUCRJDPU-SJORKVTESA-N 392.459 2.791 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)NCCCc2ccccn2)[C@H]1c1ccccc1 1529158427 CHDASSFIXOLANA-RTWAWAEBSA-N 381.476 2.508 0 50 GFAA CCCSc1nnc(NC(=O)[C@@H](CC)Sc2nnc(N)s2)s1 1772493172 OFYQOTFFENARQK-ZCFIWIBFSA-N 376.558 2.983 0 50 GFAA O=C(c1ccccc1OC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](O)C1 11667824 WVWVONMNJQYZMW-LJQANCHMSA-N 395.503 2.722 0 50 GFAA COc1cc(C(=O)N(CCO)Cc2ccccc2)ccc1OC1CCN(C)CC1 12004804 FYIXRZQTXJZHHA-UHFFFAOYSA-N 398.503 2.803 0 50 GFAA CSc1cccc(CNC(=O)[C@H]2CCC(=O)N(CCc3ccccn3)C2)c1 12448960 UGWYILKQROOGCF-KRWDZBQOSA-N 383.517 2.901 0 50 GFAA Cc1nn(C)cc1CN1CC(=O)N(C(C)C)C[C@H](OCc2ccc(F)cc2)C1 14535834 GYINFKPHZVESFS-HXUWFJFHSA-N 388.487 2.506 0 50 GFAA Cc1cccc(CS(=O)(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)c1 16579749 KNORJGZEVDWRPT-QGZVFWFLSA-N 388.489 2.846 0 50 GFAA COCC[C@H]1CN(c2nccc(-c3cnn(-c4ccccc4C)c3)n2)CCO1 19145902 BQVLWKHKSHLSJV-SFHVURJKSA-N 379.464 2.879 0 50 GFAA COc1cc(CN2CCN(C(=O)c3cccc(F)c3)CC2)cc(OC)c1OC 19549826 DTCJWUGDBXTGEG-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA CC(C)c1nnc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)s1 169772905 GWJKFHBNRQSWKM-VIFPVBQESA-N 388.428 2.669 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1C[C@@H]2CCOC[C@]2(CO)C1 1857669663 KSUOUPSXLXAIMV-WMZHIEFXSA-N 381.472 2.779 0 50 GFAA O=C(c1ccc2nc(C(F)(F)F)[nH]c2c1)N1C[C@@H](O)[C@H](Cc2ccncc2)C1 1857712952 OWWUNWFPUQHNMV-CZUORRHYSA-N 390.365 2.652 0 50 GFAA O=C(Cc1ccc(O)cc1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857735911 JSEWPKKMAFOLIB-GMAHTHKFSA-N 380.488 2.999 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1cncn1COCc1ccccc1)C(=O)O 2555012 LPVKZCHCZSFTOJ-MRXNPFEDSA-N 375.425 2.578 0 50 GFAA in-vitro CN1CC[C@@H](NC(=O)NC2CCN(Cc3ccncc3)CC2)[C@H]1c1ccccc1 245696890 YJFPBKJERAXYDO-FGZHOGPDSA-N 393.535 2.791 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)N2Cc3cnn(-c4ccccn4)c3CC(C)(C)C2)CCN1C 952890934 NYJFMCZBCSULTB-AEFFLSMTSA-N 396.539 2.844 0 50 GFAA Cc1c(C(=O)N(C)CC2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)cnn1C 1875330406 QIXIKBZMUYNJIS-UHFFFAOYSA-N 393.491 2.834 0 50 GFAA CO[C@H](C)C(=O)N(Cc1scnc1C)C[C@@H]1CCN(C(=O)CCC2CC2)C1 1775989603 QNWKNQARCJIZRA-NVXWUHKLSA-N 393.553 2.854 0 50 GFAA CS(=O)(=O)N1CC[C@]2(C1)C(=O)N(C/C=C/c1ccccc1)c1ccccc12 2100534458 JIFAMDLHSDBXKL-TYOLEZHBSA-N 382.485 2.650 0 50 GFAA COc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@@H]2C(=O)c2ccccc2)cc1 4144365 RUVFDGOFCYCCJZ-MPGHIAIKSA-N 394.349 2.799 0 50 GFAA O=C(O)[C@H](Cc1csc(Br)c1)NC(=O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 2325875917 FTEPQQCFVSEAMR-KQAFNVIJSA-N 384.295 2.915 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N=[S@](C)(=O)c2ccc(Br)cc2)C1 2325889349 LTMCCQOWKUGWTC-SFDCACGMSA-N 399.310 2.857 0 50 GFAA CN(C)c1cccc2c(S(=O)(=O)N[C@H](Cc3ccccc3)C(=O)O)cccc12 625681 GPIOGTIFRDHWSB-GOSISDBHSA-N 398.484 2.880 0 50 GFAA in-vitro CC(C)(C)N1C(=O)c2ccc(S(=O)(=O)c3ccc(C(=O)O)cc3)cc2C1=O 1202422 OPRFEEBWEMRLOC-UHFFFAOYSA-N 387.413 2.612 0 50 GFAA C[C@@H](Nc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1)c1ccccc1 1265654 JTKSXPSGYYQWQT-CQSZACIVSA-N 375.432 2.645 0 50 GFAA CSCCNC(=O)CN(c1cc(C)ccc1C)S(=O)(=O)c1ccccc1 2824757 LFMOLSFUZAMSFI-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3cnn(-c4ccccn4)c3C)C1)CC2 2356141493 DUEDKTZWVDIHRQ-JOCHJYFZSA-N 388.475 2.794 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cnn(-c4ccccn4)c3C)C1)CC2 2356141494 DUEDKTZWVDIHRQ-QFIPXVFZSA-N 388.475 2.794 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1C(=O)NC1CCCCC1 4850715 NVWAVKALXFNMIH-INIZCTEOSA-N 380.510 2.515 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cc(Cl)ccc2OC)cc1 4866146 JVBLZIOSHRASJY-NSHDSACASA-N 398.868 2.663 0 50 GFAA Cc1ccnc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)c1 6701699 CYXYHICFGYVJPX-OAHLLOKOSA-N 379.869 2.835 0 50 GFAA COc1cc(CN2CCN(CC=C(C)C)[C@H](CCO)C2)cc(OC)c1OC 104466641 RVXBOXUSJNJHQC-GOSISDBHSA-N 378.513 2.547 0 50 GFAA O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCCN(CC(F)(F)F)CC1 115839471 TUMJNHYEGIEGHX-INIZCTEOSA-N 384.446 2.935 0 50 GFAA NCc1cc(NC(=O)c2ccccn2)cc(C(=O)Nc2cnc3n2CCCC3)c1 67740012 XESANISPBZGFGT-UHFFFAOYSA-N 390.447 2.578 0 50 GFAA Cc1c(CNCc2ccccc2Cn2cccn2)c2ccccc2n1CC(N)=O 67673069 JHWDCFVDJAQDKR-UHFFFAOYSA-N 387.487 2.970 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4ccc(F)cc4)CC3)ncn2)n1 65362099 SSTWATDAWBYJTA-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N2CCC(Nc3ncccn3)CC2)c1 67514614 ORDCNYWMWYOHQF-UHFFFAOYSA-N 378.436 2.592 0 50 GFAA CN1CCC(N2CCC(CN(Cc3ccncc3)C3CCOCC3)CC2)CC1 20599172 UGUWDFMKCOXFTR-UHFFFAOYSA-N 386.584 2.869 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(Cn3nc(C)c(C)c3C)[nH]c2C1 65371662 ZVGWVKKDZNKTDQ-HNNXBMFYSA-N 379.464 2.658 0 50 GFAA Cc1ccc(C)c(OCc2cc(C(=O)NCCc3cn4cccnc4n3)no2)c1 12299703 CXVDAUDNYNORJW-UHFFFAOYSA-N 391.431 2.886 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1 125980855 MDOSCAZUKAOLJJ-FQEVSTJZSA-N 393.487 2.700 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@@H]2[C@@H]3CCCC[C@@H]3C2(C)C)[C@@H]1c1cnn(C)c1 328635421 URYFRDNELPUNIR-WYBOHUHJSA-N 388.556 2.761 0 50 GFAA CCN1CC2(CCN(Cc3cc4c(cc3OC)OCCCO4)CC2)OC1=O 72419054 ADGPGAPXXREAQC-UHFFFAOYSA-N 376.453 2.663 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2ccnc(N3CCCC3)n2)CC1 72115461 NQLGNOLLPKOKRT-UHFFFAOYSA-N 380.496 2.993 0 50 GFAA Cn1ncnc1[C@@H]1COCCN1c1nc(C(F)(F)F)c(Br)s1 333499191 HOGUNNGGIRHOCF-LURJTMIESA-N 398.208 2.631 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@@H]1CN[C@H]1CCc2cc(F)c(F)c(F)c21 449322252 OPWZFLBCMQXKBL-BNOWGMLFSA-N 376.444 2.789 0 50 GFAA O=CN[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN(CC2CC2)CC1 242047875 VQTOMCAAFZMDDD-GOSISDBHSA-N 398.334 2.641 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cn1)N1CCCN2c3ccccc3C[C@H]2C1 377842696 LENMPPVTPUIDGF-IBGZPJMESA-N 393.491 2.587 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H]1CC(=O)N(C2CC2)C1 176779453 LYOISWPCMKBQJZ-CYBMUJFWSA-N 389.452 2.663 0 50 GFAA O=S(=O)(NCc1ccncc1OC[C@H]1CCOC1)c1cccc2cnccc12 288679992 UICCWVOURSDZHO-HNNXBMFYSA-N 399.472 2.524 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC(N)CC4)csc3C2)nc1 426523740 WGYLSJPOGURCQK-UHFFFAOYSA-N 384.549 2.827 0 50 GFAA Cc1ccc2nc(COc3ccccc3C(=O)N3CC[C@H](C(=O)O)C3)cn2c1 178269414 SZTHPSHMXWUJTP-HNNXBMFYSA-N 379.416 2.768 0 50 GFAA O=C(O)[C@@H](c1cccc(CO)c1)N1CCC(O)(c2ccc(Cl)cc2)CC1 95366137 QFQXJMLKIUNCHD-GOSISDBHSA-N 375.852 2.942 0 50 GFAA CCc1cc(C(=O)N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C)C3)[nH]n1 91269914 XUPMJIGQGQFDDT-SFHVURJKSA-N 380.492 2.840 0 50 GFAA COC[C@@H](c1ccccn1)N(C)C(=O)c1cnc(-c2ccc(C)cc2)[nH]c1=O 91487125 ZUNPDXUSAIGHLG-SFHVURJKSA-N 378.432 2.600 0 50 GFAA COc1cccc(CN2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)c1 91390903 DRSAFBKTVLSQMF-UHFFFAOYSA-N 382.508 2.866 0 50 GFAA O=C(c1ccc(-c2nc[nH]n2)cc1)N1C[C@H]2CC[C@@H]1CN(Cc1cccnc1)C2 95391218 CZAYGDOXOADOAU-FXAWDEMLSA-N 388.475 2.603 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(Cc3ccc(-n4ccnc4)cc3)C2)CC1 95500562 WPRCCOJBRFHHCT-HXUWFJFHSA-N 395.551 2.639 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCc1nc(C)c3c(n1)CCCC3)C2 95358537 PQUNLQVJPNABTG-INIZCTEOSA-N 381.476 2.582 0 50 GFAA COc1nc2c(cc1C(=O)N1CCc3nnc(-c4ccccc4)n3CC1)CCC2 91644201 MGKWVBRWAWEZFF-UHFFFAOYSA-N 389.459 2.536 0 50 GFAA Cn1nc(-c2cccnc2)cc1NC(=O)NCc1nncn1C1CCCCC1 96132808 STECPNAZSYWLET-UHFFFAOYSA-N 380.456 2.901 0 50 GFAA O=c1cc(CCn2cccn2)nc(-c2ccc(CN3CCC(F)CC3)cc2)[nH]1 48371853 GQYBEOIBVDCVKQ-UHFFFAOYSA-N 381.455 2.810 0 50 GFAA Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1cc2ncc(CCO)cn2n1 670453178 UVNYZDZUSCTTDP-QGZVFWFLSA-N 380.448 2.605 0 50 GFAA O=C(CC1=CSC2=NCCCN12)N1CCC[C@H]1c1nc(-c2ccncc2)no1 952965290 TWJQAXBUVBVRRV-HNNXBMFYSA-N 396.476 2.835 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@H](Nc2cc(N3CCOCC3)ncn2)C1 302897115 PIYKAYRTXVCQDB-HNNXBMFYSA-N 389.887 2.666 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@@H](C)CN4CCN(C)CC4)CC3)oc12 188586951 PGVGNTAKKFKTAC-KRWDZBQOSA-N 399.539 2.661 0 50 GFAA CCOc1ccc([C@H](C)NS(=O)(=O)c2ccc(C(=O)NC)cc2)cc1F 1506399094 AKANIGXYVXKIGO-LBPRGKRZSA-N 380.441 2.624 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)N1CCC(C(=O)N2CCCC2)CC1 1506430894 DEUOFTSQVMWCKT-UHFFFAOYSA-N 391.899 2.838 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)n1 1529119391 GORVVZSAUWONRJ-NQIIRXRSSA-N 378.476 2.500 0 50 GFAA Cc1ccn2c(NC(=O)[C@H]3CC(=O)N(c4ccc(C(C)C)cc4)C3)nnc2n1 1529186664 JRIAPLYJVLETEK-HNNXBMFYSA-N 378.436 2.548 0 50 GFAA COc1ccccc1/C=C(/NC(=O)c1ccc(C)cc1)C(=O)N1CCOCC1 2157261 KSJBDAMLXRBDIX-XDJHFCHBSA-N 380.444 2.633 0 50 GFAA CCc1c(C)nn(CC(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1C 1704277919 SYRDIVZVPQGDEH-XMSQKQJNSA-N 392.503 2.673 0 50 GFAA COC[C@H]1CCCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704328524 KHIRDBYWTFNIJE-INIZCTEOSA-N 385.464 2.677 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)o1 11817774 RREJTKCEOMBEGW-OAHLLOKOSA-N 386.452 2.545 0 50 GFAA Cc1nonc1CC(=O)N1CCc2[nH]nc(-c3ccc(C(F)(F)F)cc3)c2C1 11818837 CQNNZQANSLMICL-UHFFFAOYSA-N 391.353 2.914 0 50 GFAA COC(=O)CCC(=O)N1CC[C@H](C2CCN(Cc3cccc(F)c3F)CC2)C1 11842846 DUTHVTPPVTWGAS-INIZCTEOSA-N 394.462 2.979 0 50 GFAA Cc1cc(C(=O)NCc2nnc3n2CCN(C[C@H]2CC=CCC2)CC3)c(C)o1 11872294 JDWWPDAYZSRRFU-KRWDZBQOSA-N 383.496 2.632 0 50 GFAA COCc1cc(CN2CCC(CCC(=O)N3CCOCC3)CC2)ccc1OC 12706551 MNJRTMXPXIBEDM-UHFFFAOYSA-N 390.524 2.693 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@H](NCC(F)(F)F)CC2 14531010 AYYPCZVTHGMUHN-CQSZACIVSA-N 380.414 2.702 0 50 GFAA Cn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NC1CCCCCC1)C2 14745678 LKQWHSSSAQCANJ-INIZCTEOSA-N 376.570 2.779 0 50 GFAA COc1ccc(CCNC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC 19850512 BTQIIDDZVHYXGR-UHFFFAOYSA-N 384.476 2.509 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)/C=C/c4ccc(C)o4)nnc23)n1 169776356 JQHWICJRGMWOLY-CMDGGOBGSA-N 378.392 2.573 0 50 GFAA O=C(c1ccco1)N1CC[C@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169778047 AHXHYZRYRCEQHG-AWEZNQCLSA-N 376.376 2.675 0 50 GFAA COc1ccc(CN2C(=O)C[C@H]3[C@@H]2CCN3C(=O)CCc2c(C)noc2C)cc1 1857692126 PSMZUKTWVSKEQV-PMACEKPBSA-N 397.475 2.635 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@H]12 1857697498 WQGABVMVRCDFPY-XLPNERPQSA-N 380.448 2.545 0 50 GFAA O=C(CC(c1ccccc1)c1ccccc1)N1CC[C@@]23OCCN2C(=O)C[C@@H]13 1857728129 OUBMFWAQYCQDGW-OFNKIYASSA-N 376.456 2.768 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ncccc3Cl)C[C@]23CC[C@H]1O3)c1ccncc1 1857738318 BVBHTXXFQVKZSB-DKYLXPRQSA-N 384.867 2.544 0 50 GFAA CCOc1ccc(-c2nccn2[C@H]2C[C@H]3CO[C@@H](CCO)CN3C2)cc1Cl 1857741441 SPVPVCGERXZRTF-ULQDDVLXSA-N 391.899 2.999 0 50 GFAA COc1ccc(CN2CC[C@H]3[C@H](CCC(=O)N3CCc3cnc[nH]3)C2)c(F)c1 216956024 RERWOSHCJHAQDU-UZLBHIALSA-N 386.471 2.613 0 50 GFAA O=C(Nc1ccc(Cc2nnn[nH]2)cc1)c1cc(N2CCCC2=O)ccc1Cl 129960153 BBOJZKHAONCCSQ-UHFFFAOYSA-N 396.838 2.823 0 50 GFAA O=C(C1CC1)N1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2Cl)CC1 155719128 FJSLZLDAYAZBLH-UHFFFAOYSA-N 391.320 2.768 0 50 GFAA Cc1ccccc1[C@H]1CN(S(=O)(=O)c2cn(C)nc2C2CC2)[C@H](C)CO1 1875393197 JAXQZXMZSHVWCV-RHSMWYFYSA-N 375.494 2.757 0 50 GFAA Cn1c(N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)nc2cc(Br)ccc21 1875404530 LNWFRUDKNXFZQC-SGIREYDYSA-N 390.285 2.784 0 50 GFAA CN1CCN(Cc2cccc(CNC(=O)N3CCC[C@@H]3c3ccc[nH]3)c2)CC1 1318529550 QGIWEQGXOXIYBF-OAQYLSRUSA-N 381.524 2.809 0 50 GFAA CC1=C(C(=O)OCCOc2ccccc2)[C@@H](c2ccc3c(c2)OCO3)NC(=O)N1 4066367 HIDYYVSVSAZQJR-LJQANCHMSA-N 396.399 2.665 0 50 GFAA COc1cc2c(cc1C)CN(c1nnc(-c3cc(C)[nH]c4ncnc3-4)n1C)CC2 2325768089 FBIXRJHKNHRXFQ-UHFFFAOYSA-N 389.463 2.893 0 50 GFAA O=C1O[C@@H](C(=O)N2C[C@@H](CO)c3ccccc32)Cc2cc(C(F)(F)F)ccc21 2325784846 NTTJORSLOZDBCH-YVEFUNNKSA-N 391.345 2.910 0 50 GFAA Cn1ncc(C2CC2)c1C(=O)N1CC2(CCN(C(=O)[C@@]3(C)C[C@H]4CC[C@H]3C4)C2)C1 2325793996 NQNFWRNPDOBRSI-YHEJKZAPSA-N 396.535 2.798 0 50 GFAA CN1CCC(N(C)c2ccc(NC(=O)Cc3ccc4nonc4c3)cc2)CC1 2325806853 KZQDWRMSLOHZFX-UHFFFAOYSA-N 379.464 2.934 0 50 GFAA COc1cccc([C@@H]2CNCCN2C(=O)NCc2nc3cc(C)ccc3n2C)c1 891889284 TYMDJCRERCBGRG-FQEVSTJZSA-N 393.491 2.746 0 50 GFAA Cc1cc(N2CC[C@H]3[C@@H]2CCN3Cc2cnn(-c3ccccc3F)c2)ncn1 2356146277 ZDPVIBNRNYKTNE-PMACEKPBSA-N 378.455 2.963 0 50 GFAA COc1cccc(NC(=O)c2cnc(NS(=O)(=O)c3ccccc3)nc2)c1 6267836 UPIMKKWYWHGCDR-UHFFFAOYSA-N 384.417 2.538 0 50 GFAA COc1ccccc1CCN(C)C(=O)NC1CCN(Cc2ccncc2)CC1 171588098 XWCYAKKGQQHJEV-UHFFFAOYSA-N 382.508 2.939 0 50 GFAA COc1ccc(C(=O)N2CCCN(CCc3nc4ccccc4n3C)CC2)cc1 225433197 HFZCQTYYTDAQMQ-UHFFFAOYSA-N 392.503 2.973 0 50 GFAA Cc1ccc([C@@H]2C=C(c3ccccc3)N=C3N=C(N4C(=O)CCC4=O)NN32)cc1 100434507 WBUQEPJWSLOSEB-SFHVURJKSA-N 385.427 2.772 0 50 GFAA COc1cccc(OC[C@@H](O)CN2CCN(c3cccc(Cl)c3)CC2)c1 20109770 WOKHVZIZCODFAG-SFHVURJKSA-N 376.884 2.911 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1 247947825 PIAKUFKWYZRDCW-DAYGRLMNSA-N 379.526 2.671 0 50 GFAA Cn1ncc(Cl)c1C(=O)NCc1cccnc1N1CCc2ccccc2C1 67654279 DQDYFBHEEIPMAQ-UHFFFAOYSA-N 381.867 2.961 0 50 GFAA CCOC(=O)c1nn(Cc2ccc(OC)cc2)cc1I 113678921 YNEVUNLNNQEWHG-UHFFFAOYSA-N 386.189 2.721 0 50 GFAA Cc1cc(CNC[C@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)cnc1C 67851289 HTFCQHLSSTYYGT-OAQYLSRUSA-N 389.446 2.620 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N(C)C[C@H]4COCCO4)cc3o2)cc1 12585250 FPDJRBQNGVKYDE-SFHVURJKSA-N 396.443 2.915 0 50 GFAA COC(=O)c1ccc(NC(=O)c2c(O)c3cccc4c3n(c2=O)[C@H](C)C4)cc1 170624663 QUAGWHBFFZETHE-LLVKDONJSA-N 378.384 2.863 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@@H](C)c3ccccc3)cc2)c(=O)[nH]n1 33026732 IPBUFHBUKMFYBJ-HNNXBMFYSA-N 383.473 2.709 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCC[C@@H](N2CCN(c3ccccc3F)CC2)C1 72172940 HGSOBNFYRMQWCC-QGZVFWFLSA-N 399.514 2.928 0 50 GFAA COc1ccccc1C1=NO[C@@H](C(=O)Nc2cc(OC)c(OC)c(OC)c2)C1 6738309 ATGGDUJQISWANB-GOSISDBHSA-N 386.404 2.853 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)ccn1 363247875 WSUNFTUGPAFGOK-SFHVURJKSA-N 395.507 2.817 0 50 GFAA OCCN(CCO)c1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)cn1 39543741 PSAXEHOIIWKNAN-UHFFFAOYSA-N 394.353 2.608 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@@H]1c1nc(COCC(F)(F)F)no1 377424149 YYFPCASFFUOKGB-GFCCVEGCSA-N 391.371 2.674 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)Nc2cccnc2N2CCOCC2)o1 157959185 ALHSEZMGYDSCCQ-QGZVFWFLSA-N 386.452 2.679 0 50 GFAA CC(C)(C)n1nccc1NC(=O)C(=O)N1CCC[C@@H](c2ncc3n2CCCC3)C1 374436468 ULBPXXRUFMSSNT-OAHLLOKOSA-N 398.511 2.516 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)NCc1ccc(N3CCO[C@H](C)C3)nc1)CCO2 286790878 XXDKTBBJYDVATP-QGZVFWFLSA-N 396.491 2.719 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)CCc1nnc(CCCc2ccccc2)o1 15073755 ALKBETPIWWJFBT-UHFFFAOYSA-N 381.480 2.960 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)[C@H]2CCC[C@@H](O)C2)CC1 223291417 CFUCLIHEHRYLLY-FUHWJXTLSA-N 380.916 2.723 0 50 GFAA O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1nn(Cc2ccccc2Cl)cc1Cl 226567711 XMIXAOQJFLRXRZ-TUVASFSCSA-N 392.242 2.905 0 50 GFAA O=C(c1cccc(N2CCCNC2=O)c1)N1CCC[C@@](O)(C(F)(F)F)CC1 287937950 RIDNZQKGGFUZEG-KRWDZBQOSA-N 385.386 2.526 0 50 GFAA Cc1c(-c2cc(CN3CC[C@@](CO)(Cc4ccc(F)cc4)C3)on2)cnn1C 288788483 KWKBKGZPWQJHEX-OAQYLSRUSA-N 384.455 2.950 0 50 GFAA COc1ccc(C(=O)N2CC(Oc3ccccc3Cl)C2)c(OCCN)c1 426606753 OERPREPDPKCTJP-UHFFFAOYSA-N 376.840 2.590 0 50 GFAA Cc1cc(NC(=O)Cn2ccc(-c3scnc3C)n2)n(-c2ccccn2)n1 48080888 KFXCTJGATOVSPL-UHFFFAOYSA-N 379.449 2.843 0 50 GFAA Cc1cccc(C[C@H](C)NC(=O)N2CCC(c3nnc4ccccn34)CC2)n1 426707439 OECCTXYAYKOSBM-INIZCTEOSA-N 378.480 2.953 0 50 GFAA Cc1cc(=O)c(C2=Nc3c(C(N)=O)cnn3[C@H](c3cccc(Cl)c3)C2)c(O)o1 198833039 AJJMWUZHONHYTM-AWEZNQCLSA-N 398.806 2.717 0 50 GFAA C[C@H]1C[C@H](NC(=O)Nc2cn(C)nc2C2CC2)c2ccsc2S1(=O)=O 292085436 QBJQISPSOKIDHT-CABZTGNLSA-N 380.495 2.788 0 50 GFAA CC(C)(C)C(=O)COC(=O)c1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 239403100 RMQCCKLLPIYWAU-LBTBCDHLSA-N 383.444 2.994 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NCc1nc(Cc3cccs3)no1)C2 95519116 QHWLDQOAKXHTQP-ZDUSSCGKSA-N 385.445 2.598 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cc(C)nc3c1c(C)nn3C)C2 91894990 KIWVLMZUEYAPHI-CQSZACIVSA-N 380.448 2.575 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4oc(C)nc4C)CC3)CC2=O)c1 95503776 YZTUWLZCEATZJP-UHFFFAOYSA-N 397.475 2.955 0 50 GFAA C[C@H](O)C(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95502993 MSBSSYYKTOQTNB-ZDUSSCGKSA-N 394.899 2.763 0 50 GFAA CN1Cc2ccccc2C[C@H]1CNC(=O)N1CC(OCc2ccccc2F)C1 426387843 KTJFIINZQUCSMV-IBGZPJMESA-N 383.467 2.793 0 50 GFAA Cc1cc(N2CCCN(C(=O)Nc3ccc4c(c3)oc(=O)n4C)CC2)ccn1 96132900 XWHRZVZJEQMZQB-UHFFFAOYSA-N 381.436 2.579 0 50 GFAA Cc1nonc1OCCNC(=O)Nc1ccc(OC[C@H]2CCCCO2)cc1 96161503 KJHWZJAEWDDLHW-MRXNPFEDSA-N 376.413 2.526 0 50 GFAA Cc1nc(N(C)C)nc(N2CCC[C@H](c3nccn3CCCN(C)C)C2)c1C 95500648 FFNYCUBDGZJXRC-SFHVURJKSA-N 385.560 2.692 0 50 GFAA O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NCCc1nc2c(s1)CCC2 252485516 GXMYKLIBFRGYNE-KRWDZBQOSA-N 385.533 2.582 0 50 GFAA COC(=O)[C@@H]1CC[C@@H]2[C@]34CC[C@@]5(O)CC(=O)CC[C@@]5([C@@H](OC)O3)[C@@H]4CC[C@@]21C 253596735 VLMLLACKDSNIAO-HLEMFBTASA-N 392.492 2.608 0 50 GFAA CC(C)N1CCNC(=O)[C@H]1CC(=O)NCc1sc2ccccc2c1Cl 670451869 WRKBLQMGLZEPCF-CYBMUJFWSA-N 379.913 2.770 0 50 GFAA Cc1ccc2nc(SCCC(=O)N[C@H]3CCS(=O)(=O)C3)cc(C)c2c1 670470284 RHSQCEQJZRMQCF-AWEZNQCLSA-N 378.519 2.637 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](CC(=O)O)c1ccc(C(C)C)cc1 275371084 YSIBTXWTNMGHEA-INIZCTEOSA-N 379.482 2.655 0 50 GFAA C[C@H]1C[C@@H]1c1ccc(CNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)o1 170641634 LMDMHIBCJIJPFA-ONGXEEELSA-N 396.852 2.866 0 50 GFAA COc1cc(CN2CC[C@@](C(N)=O)(c3ccccc3)C2)ccc1OC(F)F 411969759 QWPLUWOAMRTRAZ-FQEVSTJZSA-N 376.403 2.926 0 50 GFAA CCOc1ccc2c(c1)[C@H](NCc1c(C)nn(C)c1N1CCOCC1)CCO2 187545484 KURCEZBLTXZONE-LJQANCHMSA-N 386.496 2.577 0 50 GFAA Cc1ccccc1-n1ncc(C(=O)N2CCCNC(=O)[C@H]2C)c1C(F)(F)F 189242286 ULZQJXQFZUVRPE-GFCCVEGCSA-N 380.370 2.550 0 50 GFAA C[C@@H](O)CSc1nnc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1 193048479 CWKUPEUZKCSTGR-CYBMUJFWSA-N 394.456 2.968 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)Nc3nc(-c4cnn(C)c4)cs3)CC2=O)cc1F 741608922 YFOHTCBMMCMLQA-GFCCVEGCSA-N 399.451 2.983 0 50 GFAA CCCC[C@H]1CN(C(=O)CCc2c(C)nc3ncnn3c2C)C[C@@H](C2CC2)O1 1616074860 WYOBOMVIKHVDQH-HKUYNNGSSA-N 385.512 2.870 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)N1CCN(Cc2ccco2)CC1 1506395376 GXPHZFVGKGJMLE-UHFFFAOYSA-N 393.490 2.811 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCc3sc(N4CCOCC4)nc3C2)s1 1772807885 VEOUJIYAFLQPFL-CYBMUJFWSA-N 377.535 2.771 0 50 GFAA c1cc(SCc2nnc(N3CCC(N4CCSCC4)CC3)o2)ccn1 1772705936 NDMIHKGZIWPYBG-UHFFFAOYSA-N 377.539 2.775 0 50 GFAA CCCN1C[C@H]2CN(C(=O)c3ccc(=O)n(C)c3)C[C@@]2(CCc2ccccc2)C1 1772809903 GVBCYIMGUWNXSQ-XUZZJYLKSA-N 393.531 2.802 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)CCn3cccn3)C2)c1 11880027 OFZOEFDGDYUPAO-GOSISDBHSA-N 398.507 2.617 0 50 GFAA CC(C)Cn1c(CN2CCCCCC2)cnc1S(=O)(=O)C[C@H]1CCCO1 12316126 CJVWULRMRXHKCU-GOSISDBHSA-N 383.558 2.868 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCC(OCc2ccccn2)CC1 12320661 NDCHVVYDBWXTRM-UHFFFAOYSA-N 391.475 2.737 0 50 GFAA COC(=O)CCCC(=O)N1CCC(CCC(=O)NCc2ccc(F)cc2)CC1 14969180 VUOBEXPHGHECSL-UHFFFAOYSA-N 392.471 2.804 0 50 GFAA COc1ccc(C(=O)NCCc2nnc(SCC(C)C)n2C)cc1OC 14986603 SZAYNMKWEDCSMQ-UHFFFAOYSA-N 378.498 2.553 0 50 GFAA CCc1ccc(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)s1 16603197 VWGFHRSXFJWNPL-UHFFFAOYSA-N 380.491 2.584 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)CCc1csc(=N)[nH]1)CC2 1857698296 KIOJJCCXGUQGFF-UHFFFAOYSA-N 381.505 2.516 0 50 GFAA CC(C)=CCN1CCC[C@@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NCCO)C1 1857729594 QSORPLZLXSMAMF-HSZRJFAPSA-N 393.535 2.611 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccsc4)[C@H]4CC[C@]3(C2)O4)nc1 1857736404 SKTHJAXVABPMOP-QEUVDIPISA-N 383.517 2.861 0 50 GFAA Cc1ccccc1-n1ncc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c1C 110954254 FXXOUKHZZJCPDC-LJQANCHMSA-N 382.508 2.816 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1c2ccccc2C[C@H]1O 245540125 IBZGSTYRPJNNLQ-UDTVLSCZSA-N 381.398 2.940 0 50 GFAA O=C(NCCn1cnc2ccccc21)[C@H](c1ccccc1)N1CCCCC1=O 263958673 IZLVXUASWRIVEC-NRFANRHFSA-N 376.460 2.906 0 50 GFAA COc1ccc(C(=O)NC[C@H]2CCOc3ccccc32)cc1N1CCNC1=O 266071440 FESLGKWAHJJBDF-OAHLLOKOSA-N 381.432 2.521 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(=O)n(C)c3)n2C[C@@H]2CCOC2)[C@@H]2CCCC[C@@H]12 910152603 GITXUZZJYBDXBS-KCITZHQASA-N 397.523 2.695 0 50 GFAA O=C(NC[C@@H]1C[C@@H]2OCC[C@H]2O1)c1cc(-c2ccc(Br)cc2)[nH]n1 1875308830 ZZTMNCCTUPPLAO-MAZHCROVSA-N 392.253 2.515 0 50 GFAA O=C(c1cccc(O)n1)N1CCC2(CC1)C[C@H](O)c1nn(C3CCCC3)cc1O2 1875394827 YFDLLPZKVXAZHA-INIZCTEOSA-N 398.463 2.590 0 50 GFAA C[C@H](c1ccc(F)cc1)N1C[C@H](C(=O)N[C@@H]2CCc3cc(CN)ccc32)CC1=O 1875301153 BQEIAZPFELDXED-CFCCAZDESA-N 395.478 2.998 0 50 GFAA Cc1c(NC(=O)[C@@H]2CN(C)C(=O)c3ccccc32)c(=O)n(C2CCCCC2)n1C 880517701 OQUVRJNOBYKBIY-GOSISDBHSA-N 396.491 2.808 0 50 GFAA O=C([C@@H]1OC[C@@H]2COCC[C@H]21)N(Cc1ccc2c(c1)OCCO2)C1CCCC1 885703029 IBQJLQQIYJHJPV-YRISNDGFSA-N 387.476 2.781 0 50 GFAA CN(C[C@H]1CC12CCN(c1ccc3nnc(-c4ccccn4)n3n1)CC2)C1CC1 2325764525 XYYVZISLCMYPLR-MRXNPFEDSA-N 389.507 2.887 0 50 GFAA CC(C)n1nc(-c2ccco2)cc1NC(=O)c1cnc(N2CCNCC2)s1 2325808374 VIACPTQHSOKRAS-UHFFFAOYSA-N 386.481 2.842 0 50 GFAA CC[C@](C)(O)c1cn(-c2cccc(CNC(=O)c3ccc4c[nH]nc4c3)c2)nn1 2325869325 JITZQQHFZCIHPL-NRFANRHFSA-N 390.447 2.691 0 50 GFAA C/C=C/C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)/C(C)=C/C 2325872488 AACJKVRIFYUMMG-RLHNEURQSA-N 391.512 2.624 0 50 GFAA C=CC(=O)N(C)CC(=O)N1Cc2cc(Br)ccc2OC2(CCC2)C1 1455913973 QTSBKBMUAAKRON-UHFFFAOYSA-N 393.281 2.737 0 50 GFAA COc1ccc(CCNc2nc(N3CCCC3)nc(N3CCCC3)n2)cc1OC 1131440 ZHSVEQOKAOLUDB-UHFFFAOYSA-N 398.511 2.744 0 50 GFAA O=C(Nc1ccccc1Cl)c1cc(S(=O)(=O)N2CCOCC2)cs1 1139104 FZVHIRBYQMBARI-UHFFFAOYSA-N 386.882 2.675 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1 1144046 JYWVDXNWRIVAMF-UHFFFAOYSA-N 396.896 2.722 0 50 GFAA Cc1ccc(-c2c(C)sc3ncn(CC(=O)N4CCOCC4)c(=O)c23)cc1 1942736 MECAJXJVTZQYDY-UHFFFAOYSA-N 383.473 2.601 0 50 GFAA Cc1nnc(CNC(=O)c2ccc(-c3ccc(CN(C)C)cc3CO)cc2)o1 2356148560 FTYHFSVCQRIFRW-UHFFFAOYSA-N 380.448 2.529 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)cc1=O 2356167489 QGEKJEZMXXKEPQ-QHCPKHFHSA-N 393.487 2.666 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cs1 6681522 PYGRDXMCXKPHFR-UHFFFAOYSA-N 378.519 2.751 0 50 GFAA COc1ccc(Nc2nc(N)nc(CN3CCN(c4ccccc4)CC3)n2)cc1 6886995 CJTSZIGVYJTBRA-UHFFFAOYSA-N 391.479 2.528 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)CSc1nc2c(c(=O)[nH]1)CCCC2 8844244 YVVCFJYIWORMBA-UHFFFAOYSA-N 387.461 2.556 0 50 GFAA COc1cccc([C@H]2CCN2C(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)c1 55370744 LMFFBVIOKROMFM-LJQANCHMSA-N 388.489 2.743 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)NC[C@@H](c2cccnc2)N2CCCC2)cc1 55387327 YOMJFZYCAFJZPB-FQEVSTJZSA-N 396.491 2.762 0 50 GFAA COc1ccccc1N1CCN(c2nc(-c3ccc(F)cc3)cc(=O)[nH]2)CC1 9061218 SQSHWQLHNWUZBV-UHFFFAOYSA-N 380.423 2.911 0 50 GFAA COc1ccc(OC)c(CN(C)Cc2nnc(SC)n2C[C@H]2CCCO2)c1 55575378 XSKUAMHOOCYHBB-MRXNPFEDSA-N 392.525 2.828 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(-n2cncn2)c1 115368391 HQLPVJNMDWASMS-LJQANCHMSA-N 375.476 2.562 0 50 GFAA CC1(C)[C@@H](C(N)=O)C(=N)NC(=O)[C@@H]1c1nc(-c2ccc(Cl)cc2)cs1 22478421 SXZYKFGMBRQJHI-VXGBXAGGSA-N 376.869 2.782 0 50 GFAA CCc1ccc(N(CC(=O)Nc2ccc(OC)cc2OC)S(C)(=O)=O)cc1 1132144 VQJKQOWYHNHBPC-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA CCCc1cc2c(=O)n(NC(=O)c3c(Cl)cnn3CC)c(C)nc2s1 2781934 DTTSQGDBCDIBLC-UHFFFAOYSA-N 379.873 2.973 0 50 GFAA CC[C@@H](C)N(CCC(=O)O)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 328590591 CHRQJYHEIMLAPZ-QGZVFWFLSA-N 375.513 2.932 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2ccc(-c3nnn(C)n3)cc2)[C@@H](C)C1 77536613 CJVRAGUXVVBAQY-INIZCTEOSA-N 376.464 2.536 0 50 GFAA CCS(=O)(=O)N1CCc2c(cccc2NCc2ncnn2-c2ccccc2)C1 368127871 XTYFKDMWCYGNQA-UHFFFAOYSA-N 397.504 2.587 0 50 GFAA CC(C)C(=O)NCC(=O)N1CCCN(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71736039 UQOFPIYSTBKEON-LJQANCHMSA-N 377.504 2.657 0 50 GFAA CN1CCN(C(=O)Nc2ccc3c(c2)CCCO3)C[C@H]1c1nc(C2CC2)no1 284686403 SESLYGGVFQAJIH-INIZCTEOSA-N 383.452 2.793 0 50 GFAA Cn1cc(N2CCC[C@@H](NC(=O)NCCc3nc(C(C)(C)C)cs3)C2)cn1 176478723 FHPDLIRSVPXPGW-CQSZACIVSA-N 390.557 2.685 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccccc2)C1)Nc1ccc2c(c1)S(=O)(=O)CC2 178355546 VMNIIMUKWXRGFX-HNNXBMFYSA-N 385.489 2.664 0 50 GFAA Cc1nn(CCNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)c(C)c1Cl 20607520 UAQHOLPPQCSRCA-UHFFFAOYSA-N 389.809 2.674 0 50 GFAA O=C(O)[C@H]1[C@@H](C(=O)N2CCN(Cc3ccccc3Cl)CC2)[C@H]2C=C[C@H]1CC2 225785302 FNLIBPLMOWCQBZ-STEAMIEHSA-N 388.895 2.897 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)c1 95390417 DMFJNMGWELDHAU-KRWDZBQOSA-N 378.480 2.697 0 50 GFAA O=C(NCCc1cn2ccsc2n1)Nc1ccccc1CN1CCOCC1 96130565 NURUVKLURIFJTB-UHFFFAOYSA-N 385.493 2.592 0 50 GFAA NC(=O)C1CCN(c2ncccc2CNC(=O)c2cccc3c2CCCC3)CC1 294665576 SFKQXEJQJGZDMF-UHFFFAOYSA-N 392.503 2.592 0 50 GFAA O=C(O)COc1ccc(S(=O)(=O)Nc2ccc([C@@H]3CCOC3)cc2)cc1F 295261475 YDFUULRXBBQOKA-CYBMUJFWSA-N 395.408 2.594 0 50 GFAA O=c1c2ccccc2ncn1C[C@H]1CC[C@H](C(=O)NCc2ccncc2)CC1 245325293 FHMCHJDKTWAQOW-IYARVYRRSA-N 376.460 2.914 0 50 GFAA CCc1n[nH]c(=O)c(CNC(=O)c2cnc(OCC3CC3)c(Cl)c2)c1CC 183586708 SHCMIWIQJWRUQV-UHFFFAOYSA-N 390.871 2.662 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)[C@@H]1COc2ccccc2O1 298970196 KSBAKBLAAZGCMW-FQEVSTJZSA-N 388.414 2.885 0 50 GFAA O=C(O)CCN(C(=O)COc1cc(Cl)ccc1Cl)C1CCOCC1 299741965 AMUFGKFEBCYRHN-UHFFFAOYSA-N 376.236 2.855 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)NCc1nc2ccccc2[nH]1 1940194649 BLZNMORLOUQGLY-UHFFFAOYSA-N 388.427 2.771 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)NCc1ccc2c(c1)OCO2 1940197243 CAPIAKHLQNQKOX-UHFFFAOYSA-N 392.411 2.623 0 50 GFAA O=C1CCC[C@@H]2[C@H]3C[C@H](CN(C(=O)C4(c5ccccc5)CCOCC4)C3)CN12 828261221 VRCSQTYFJAMMOX-WSTZPKSXSA-N 382.504 2.594 0 50 GFAA biogenic O=C(CCc1nc(-c2ccco2)no1)N1CCc2nc[nH]c2[C@@H]1c1ccncc1 827972465 IOJBETMXOZMWMF-IBGZPJMESA-N 390.403 2.555 0 50 GFAA CC[C@@H](Sc1nc2ccccc2o1)C(=O)NCCn1c(C)cc(C)nc1=O 822555074 ICSOZMDTWBAHTJ-MRXNPFEDSA-N 386.477 2.688 0 50 GFAA CCO[C@H]1COC[C@@H]1NC(=O)c1ccccc1-c1nc(-c2ccccc2)no1 952988057 AISDKZFWPKIITI-ROUUACIJSA-N 379.416 2.937 0 50 GFAA Cn1ncc(NC[C@@H](O)c2ccc(C(C)(C)C)cc2)c(Br)c1=O 169987958 AFPIRXYRUZLCJD-CQSZACIVSA-N 380.286 2.986 0 50 GFAA Cc1cccc(NC(=O)CC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 1506426423 GUDTWXDSRWCLQR-OAQYLSRUSA-N 395.503 2.731 0 50 GFAA COc1ccc(-n2c(CNC(=O)[C@H]3CCOC(C)(C)C3)nnc2SC)cc1 12131296 LNESILFLQPBKGH-ZDUSSCGKSA-N 390.509 2.819 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CCN(Cc1ccc(NC(C)=O)cc1)C2 14743387 NJSUNHWVTOCNKU-UHFFFAOYSA-N 395.507 2.656 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@@H](CNC(=O)c2ccccc2Cl)C1 15076807 XEOYQFGAEAVAFT-AWEZNQCLSA-N 380.872 2.652 0 50 GFAA Cc1ccn(CC(=O)NCC2(N(C)Cc3ccccc3)Cc3ccccc3C2)n1 19789924 PPXDXTZLGBLLOQ-UHFFFAOYSA-N 388.515 2.977 0 50 GFAA CCCCCN1[C@H]2CC[C@@H]1CNC(=O)c1ccc(C)c(c1)OCCNC(=O)C2 1857707986 DERBFLWMULJACT-RBUKOAKNSA-N 387.524 2.647 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c1C 1857715904 NNCUKOHHLNVCFJ-CEXWTWQISA-N 381.476 2.778 0 50 GFAA O=C([C@@H]1CSCN1C(=O)c1cnc(OCC2CC2)c(Cl)c1)N1CCCC1 329618504 DYSJVLSTFJSUNC-HNNXBMFYSA-N 395.912 2.661 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N(C)C3CCN(c4cnccn4)CC3)c2c1 366079027 SPEFCTYMEVLSCM-UHFFFAOYSA-N 379.464 2.636 0 50 GFAA O=C(NCC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccc(-c2ccccc2)cc1 155564404 KFZUNWZLMJPQKQ-IBGZPJMESA-N 389.459 2.955 0 50 GFAA Cc1nc2ccc(NC(=O)[C@H]3CCCN3S(=O)(=O)c3cccs3)cc2o1 155999822 ABAQRKGYVJLXLR-CQSZACIVSA-N 391.474 2.990 0 50 GFAA COc1cccc(CC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 1704312863 AJCYVRSYGSAFGW-JOCHJYFZSA-N 380.492 2.600 0 50 GFAA C[C@H](c1ccccc1)[C@@H](O)CNC(=O)C(=O)c1ccc(Br)s1 856288388 GFHLFUKHCZPSEF-PWSUYJOCSA-N 382.279 2.974 0 50 GFAA CCN=c1[nH]cnc2cc(C(=O)N[C@@H]3CCO[C@H](c4ccncc4)C3)ccc12 1875267896 HCSKIWBBLPSXFZ-APWZRJJASA-N 377.448 2.529 0 50 GFAA COc1ccc(N2C(=O)C[C@H](n3c(CCCCO)nc4ccccc43)C2=O)cc1 13152827 AFJCCTXJVFVHQQ-IBGZPJMESA-N 393.443 2.865 0 50 GFAA CN(C)Cc1cnn2c1CN(C(=O)c1ccnc(-c3ccc(Cl)cc3)n1)CC2 2325759875 IUSUGMHLBSDSRY-UHFFFAOYSA-N 396.882 2.711 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccc(F)cc2)nc1 2325785657 HOQAUOMEPGRQMX-NIKGAXFTSA-N 396.422 2.779 0 50 GFAA O=C(O)C[C@H](NC(=O)c1nc(C(F)(F)F)n2ccccc12)C1CC(F)(F)C1 2325788468 IJUNGNUZJBSAQW-VIFPVBQESA-N 391.296 2.972 0 50 GFAA Cc1nc(C(C)(C)C)sc1C(=O)NCc1ccccc1CNC(=O)[C@H](C)O 2325873521 KDIGTGSCAJIUIC-ZDUSSCGKSA-N 389.521 2.676 0 50 GFAA COc1cccc(-c2nc(C(=O)N3CCCC[C@@H]3CN3CCOCC3)c(C)[nH]2)c1 133276878 KXKAVHGQPDVJAW-GOSISDBHSA-N 398.507 2.721 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1C(=O)Nc1ccccc1)Nc1cccc(Cl)c1 1118941 OSTMZEXSXFOHTE-INIZCTEOSA-N 386.839 2.701 0 50 GFAA O=C(Cc1ccc(C(F)(F)F)cc1)N1CC[C@](O)(c2ccccc2)[C@@H](O)C1 2356143075 UGTSGNYTQZUPGJ-HKUYNNGSSA-N 379.378 2.729 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c(OC)c1 2356143708 SYCIPNUYJJLYNP-JOCHJYFZSA-N 396.491 2.680 0 50 GFAA O=C1CCCCCN1CC(=O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356162575 FRMRKMWLMQDXIH-QHCPKHFHSA-N 397.519 2.573 0 50 GFAA O=C(Nc1cccc(Cl)c1)c1cc(S(=O)(=O)N2CCOCC2)cs1 4841074 OOIQKFSTCXVYGJ-UHFFFAOYSA-N 386.882 2.675 0 50 GFAA CC(=O)NCCc1nc2cc(NC(=O)COc3ccc(C)cc3)ccc2n1C 4906241 RARFJLYDNPBVLK-UHFFFAOYSA-N 380.448 2.578 0 50 GFAA CC[C@H](CO)N(Cc1ccsc1)C(=O)c1ccc(Cn2nnnc2C)cc1 55368842 GWFNYWFKHCFWIX-GOSISDBHSA-N 385.493 2.505 0 50 GFAA C[C@H](O)[C@@](C)(CNC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1)Cc1ccccc1 225403430 YVQCGMVZYSTTEC-HYFFOGBASA-N 393.491 2.647 0 50 GFAA CC1(C)O[C@@H]2O[C@H](COC(=O)c3ccccc3Cl)[C@@H]3OC(C)(C)O[C@@H]3[C@@H]2O1 22107275 LBWVFYWBICENNB-MDLJMBGESA-N 398.839 2.893 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)NC[C@@H](c3cccs3)N3CCOCC3)oc2c1 28291693 XBSRAPPOHUCLDE-INIZCTEOSA-N 398.484 2.966 0 50 GFAA COc1cc(CN2CCN(CC(C)(C)C)[C@H](CCO)C2)cc(OC)c1OC 104403074 DGCWCTPRUOZQJM-QGZVFWFLSA-N 380.529 2.627 0 50 GFAA CCN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)c3ncccc3C)CC2)[C@H]1O 20867330 SKTUZYIJKXLGNJ-RTWAWAEBSA-N 379.504 2.931 0 50 GFAA CN1CCC(N(C)C(=O)c2coc(COc3cccc4cccnc34)n2)CC1 67849866 SPFGCLMBEHTUEY-UHFFFAOYSA-N 380.448 2.968 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@@]1(O)CNCc1cc2ccccc2[nH]1 67433435 WSAGCBKBBBMURM-HSZRJFAPSA-N 377.488 2.854 0 50 GFAA CN1[C@@H](c2ccccc2Cl)[C@@H](C(=O)NCc2cccnc2)C[C@@]1(C)C(=O)O 67883846 ZHGALYWDCFAZCW-KNBMTAEXSA-N 387.867 2.888 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H](O)c2cccc(C)c2)C1 119226984 HURYVJHBZFYOCF-XLIONFOSSA-N 383.492 2.863 0 50 GFAA CCc1ccc([C@@H](COC)NC(=O)Nc2ccc(N3CCOCC3)nc2C)o1 119364473 YLPHJVQDPRYKEY-QGZVFWFLSA-N 388.468 2.891 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4nc(C)cc4C)ncn3)CC2)cc1 65364577 LJACDXQTOAFIEG-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)N1CCCN(Cc2cccs2)CC1 1506397581 PEAADXCYYHIBMC-IBGZPJMESA-N 397.544 2.799 0 50 GFAA CCCCn1c(CN(Cc2nccn2C)C(C)C)cnc1S(=O)(=O)CC 12433867 MTAXXAMHXPQYLC-UHFFFAOYSA-N 381.546 2.621 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C(=O)CCc2ccc(C)o2)CC1 328632271 LHIFOSFSUMOSRW-IBGZPJMESA-N 384.480 2.740 0 50 GFAA CCN(C(=O)NCc1ccc(COC2CCOCC2)cc1)[C@H](C)CN(C)C 252497268 QCSGVAVOJMNAFU-QGZVFWFLSA-N 377.529 2.864 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@@H](c3nncn3C)C2)nn1-c1ccccc1F 173078676 DYSRNGIJUFTSTD-CQSZACIVSA-N 397.458 2.507 0 50 GFAA O=C(O)[C@H]1CN(C(=O)Cc2c[nH]c3ncccc23)C[C@@H]1c1ccc(F)cc1F 368311752 DJAGWPHVGOZPDA-CVEARBPZSA-N 385.370 2.710 0 50 GFAA O=C(Cn1ncc2ccccc21)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 368745526 GBKXQBWVAWIOCG-LBPRGKRZSA-N 377.370 2.630 0 50 GFAA CCOC1CC2(CCN(C(=O)C[C@H]3CCCN(C(=O)NCC(C)C)C3)C2)C1 375858739 VSQBNFRCNIPONN-MPQSDHOMSA-N 379.545 2.872 0 50 GFAA Cc1nn(CC(=O)Nc2cnn(C(C)C)n2)c(C)c1-c1ccc2c(c1)OCO2 48234116 QPLJGCPCDCBZFA-UHFFFAOYSA-N 382.424 2.707 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCN(C)C)C3)C2)cc1F 82125842 QFEAQSHVBRWYBA-NRFANRHFSA-N 375.488 2.541 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@@H](CN)C3)cc2)c(C)c1Br 178579056 IWRSLYXYMLOOPQ-ZDUSSCGKSA-N 377.286 2.672 0 50 GFAA CN1CCN(c2ccccc2CN2CCC[C@H]2c2ccc(C(N)=O)s2)CC1 20448690 NBVPISBNWALXAW-SFHVURJKSA-N 384.549 2.936 0 50 GFAA O=C(NC1CCN(Cc2cccnc2)CC1)N1CC[C@@H](Oc2ccccc2)C1 426511646 JHUYZCXWXZZADI-OAQYLSRUSA-N 380.492 2.909 0 50 GFAA CCc1c(C(=O)N2CC[C@H](CNC)C2)cnn1-c1ccc(Br)cc1 178998471 YHQVJBXHGYEWTI-CYBMUJFWSA-N 391.313 2.879 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CCNC(=O)[C@@H]3Cc3ccccc3)oc2c1 97532611 VGHWXFHRGKCUAK-SFHVURJKSA-N 378.428 2.933 0 50 GFAA CCOc1ccc(N([C@H](C)C(=O)N[C@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 239425650 UXVVONRGSKLJCN-LLDVTBCESA-N 380.510 2.545 0 50 GFAA O=C(CCN1C[C@H]2CC[C@@H]1CN(c1ncccn1)C2)NCc1ccc(Cl)cc1 91486314 DTTQBOZCNXEOPR-IEBWSBKVSA-N 399.926 2.737 0 50 GFAA Cc1ccc(C(=O)N2CCC(CCn3cccn3)CC2)cc1N1CCNC1=O 92045611 VTCZCQUNGBOHLA-UHFFFAOYSA-N 381.480 2.664 0 50 GFAA CN(C)[C@H](C(=O)NC1CCN(Cc2cccc(O)c2)CC1)c1cccc(F)c1 95383470 PWZXAKNQNZNSOL-NRFANRHFSA-N 385.483 2.915 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cc(-c3ccccc3O)n[nH]1)C2 95522678 AKYKCGDFFNIHPM-CYBMUJFWSA-N 379.416 2.772 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)c2cc(F)ccc2C)CN1CCC=C(C)C 96139242 XHJGSOUHXNQNNV-HKUYNNGSSA-N 375.488 2.799 0 50 GFAA CC(C)CCn1cc([C@@H](C(=O)O)N2CCC(N3CCSCC3)CC2)cn1 95381113 OJOIZSOGCOYNRZ-SFHVURJKSA-N 380.558 2.568 0 50 GFAA COc1ccc(C[C@@H](C)C(=O)N2CCC(Nc3cccnn3)CC2)cc1OC 181953360 IYGMZNPSBMGMOS-OAHLLOKOSA-N 384.480 2.776 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1c2ccccc2C[C@H]1O 182348719 IBZGSTYRPJNNLQ-FGDXXIHYSA-N 381.398 2.940 0 50 GFAA O[C@@H](COc1ccccc1F)CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 298685338 AWLHCNUZEWBXSA-IAGOWNOFSA-N 388.487 2.763 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CCCN(C(=O)c3ccccn3)C2)CC1 61969211 BVTJSFRMMZQBEC-GOSISDBHSA-N 380.492 2.517 0 50 GFAA Cc1cc(N2CCN(Cc3ccc([C@H]4CCCCO4)o3)CC2)n2ncnc2n1 825138963 VMLHWJMLUAKUNJ-QGZVFWFLSA-N 382.468 2.590 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2cccs2)C1)c1ccccc1N1CCOCC1 828182390 UTHOENRYOCAJGK-QGZVFWFLSA-N 385.533 2.979 0 50 GFAA CCC(=O)N1CCC(C(=O)N2CCC(COc3ccc(OC)cc3)CC2)CC1 952982124 JVWAZMQGPDPMNS-UHFFFAOYSA-N 388.508 2.961 0 50 GFAA CCC(=O)Nc1ccc(OC)cc1NC(=O)Cc1ccc(S(C)(=O)=O)cc1 952872668 BFVJNIQTVPCUCF-UHFFFAOYSA-N 390.461 2.628 0 50 GFAA CCN1C[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)c(C)c2Cl)CC1=O 952973168 ROKSOUCVCHDUAB-LLVKDONJSA-N 379.309 2.791 0 50 GFAA O=C(Nc1cc(N2CCNC2=O)ccc1F)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F 410782006 FOPDINMJXBJYCJ-SYQHCUMBSA-N 387.333 2.650 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2cn(-c3ccc(Br)cc3)cn2)C1 271894548 GSJHVALXSSVWCI-INIZCTEOSA-N 378.226 2.572 0 50 GFAA CCn1cc(CN2CCCN(C(=O)Nc3ccc(F)c(OC)c3)CC2)cn1 187067066 HYISQGVBCLDQDI-UHFFFAOYSA-N 375.448 2.791 0 50 GFAA C[C@@H]1CN(C2CCOCC2)CCN1C(=O)Nc1cnc(-c2ccccc2)nc1 278402310 UJKRMULDEZXOSW-MRXNPFEDSA-N 381.480 2.861 0 50 GFAA COc1ccnc(NC2CCN(C(=O)NCC3(c4ccccc4)CC3)CC2)n1 189738894 QSNRBJCJIXCETE-UHFFFAOYSA-N 381.480 2.803 0 50 GFAA CC(C)NC(=O)c1ccc(NC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1 195140689 GXKGNNIFWQDPDO-LJQANCHMSA-N 394.475 2.920 0 50 GFAA COC(=O)c1ccc(CNC(=O)CCc2cscn2)c(Br)c1 785627692 GPXVDPFCTXRJAH-UHFFFAOYSA-N 383.267 2.941 0 50 GFAA Cc1c(CN2CCC[C@@H](CNC(=O)Cc3cn(C)c4ccccc34)C2)cnn1C 1506416127 HWFONPXQOUNLNK-SFHVURJKSA-N 393.535 2.791 0 50 GFAA Cc1ccc(NC(=O)CN2CC[C@H](O)[C@](CO)(Cc3ccccc3)C2)cc1C 1529145874 OMHHCDWPJWXQSA-JTHBVZDNSA-N 382.504 2.530 0 50 GFAA Cc1ccc2cccc(OCCNc3ccc(C(=O)N4CCOCC4)cn3)c2n1 1704325248 GSSNBWCIWLRKQB-UHFFFAOYSA-N 392.459 2.902 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)Cc2ccc(F)c(F)c2)CC1)C1CC1 12702429 NOIFNNAVIUFFBY-UHFFFAOYSA-N 388.418 2.916 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)[C@H]1CCCN(CCCn2cccn2)C1 12836924 LLYAJYOMNAKFFI-SFHVURJKSA-N 378.480 2.810 0 50 GFAA CN1CCC2(CC1)C(=O)N(CCCc1cccnc1)C(=O)N2Cc1ccccc1 14539839 SBJBKLVCUSSYRR-UHFFFAOYSA-N 392.503 2.943 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cccnc4)ccn3n2)c(C)c1 169775698 NSAIFDACEBPHFI-UHFFFAOYSA-N 387.443 2.605 0 50 GFAA CCOC(=O)CNC(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857730048 XJVGXCQVHGSSSE-GFCCVEGCSA-N 379.844 2.767 0 50 GFAA O=C(CCc1cccnc1)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857734451 JWECOPDBAJSOAX-HSALFYBXSA-N 385.895 2.998 0 50 GFAA CCc1cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccoc4C)[C@H]4CC[C@]3(C2)O4)on1 1857736158 YAJROBVMDXNCGH-QEUVDIPISA-N 385.464 2.548 0 50 GFAA CCc1cnc(C)nc1N1C[C@@H]2[C@H](CNC(=O)c3ccccc3)[C@H]3CC[C@]2(C1)O3 1857736353 QAZKLFPDKWQJJU-DZCCDHAISA-N 392.503 2.761 0 50 GFAA COc1ccc(Oc2ccc(C(=O)N3CC[C@@]45OCCN4C(=O)C[C@@H]35)cc2)cc1 1857739773 RLSUIQBVGSLKEC-KNQAVFIVSA-N 394.427 2.661 0 50 GFAA CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(N)=O)cn2)C1 773191192 WMOHHPLXOOMKOJ-HNNXBMFYSA-N 377.448 2.570 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)[C@@H]1Cc3ccccc31)CC2 262867491 WBRMXNVMUZLFMT-MSOLQXFVSA-N 381.428 2.944 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3cccc4nccnc34)C1)CC2 1704300983 DPDPFSQNBLTMKV-JOCHJYFZSA-N 388.475 2.606 0 50 GFAA COc1ccc(-c2cnc(NC(=O)C3CCN(c4ccncn4)CC3)n2C)cc1 1875259039 QWTVBSLPHVKBGX-UHFFFAOYSA-N 392.463 2.741 0 50 GFAA CC1(C)Cc2ccc(C(=O)NC[C@@H]3CCc4nnc(C(F)F)n4C3)c(O)c2O1 1875300444 CJQQZHWZTATRLW-JTQLQIEISA-N 392.406 2.627 0 50 GFAA O=C(NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)NC[C@H]1CC(F)(F)CO1 1875301748 SHKFOZXLALOQSR-GXTWGEPZSA-N 396.356 2.580 0 50 GFAA O=C(N[C@H](CCc1c[nH]nc1C(F)(F)F)C(=O)O)C1CC2(C1)CC21CCC1 1875320999 QCKHYEGVMVTOLP-VMBJYNEYSA-N 385.386 2.901 0 50 GFAA C=CC(=O)N(Cc1cc(Cl)c2c(c1)OCCCO2)[C@H]1CCCCNC1=O 1875383794 FCMQFHLIQRWTPO-HNNXBMFYSA-N 378.856 2.685 0 50 GFAA CO[C@@H](CNCc1ccc2c(c1)N(C(=O)OCc1ccccc1)CC2)C(=O)O 1777148800 NNPNAHYIKWTQQV-IBGZPJMESA-N 384.432 2.575 0 50 GFAA Cc1ccc(C(=O)N2CC3(COc4ccccc4C3)C2)cc1N1CCNC1=O 2100537285 LNJGEXPYDTXNFH-UHFFFAOYSA-N 377.444 2.602 0 50 GFAA NCCc1nnc2n1-c1ccc(Br)cc1C(c1ccccc1)=NC2 27322762 ARAYVTCXPOFLEW-UHFFFAOYSA-N 382.265 2.882 0 50 GFAA NCC1(c2ccccc2)CCN(C(=O)Nc2cnn(-c3ccccc3)n2)CC1 904401597 RMLHPMIYCITHCV-UHFFFAOYSA-N 376.464 2.792 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(C(=O)OC)cc2)nnc1-c1ccncc1 907582 ZTECIBUJOZYYJT-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA O=C(Cc1ccc(F)cc1)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 917530 VRQZMTHTKACLJR-UHFFFAOYSA-N 386.408 2.598 0 50 GFAA Cc1cc(C)nc(SCC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)n1 1064927 OTFASMKXSOBTAA-UHFFFAOYSA-N 383.477 2.622 0 50 GFAA CCN(CC)C(=O)c1sc(NC(=O)c2cccnc2)c(C(=O)OC)c1C 1140211 JCVYDCOUFAAQSM-UHFFFAOYSA-N 375.450 2.972 0 50 GFAA COc1ccc(CN2CCN(c3ncnc4c3CCC4)C[C@H]2CCO)c(C)c1C 106942613 PZXQHQXDNMEKAK-LJQANCHMSA-N 396.535 2.664 0 50 GFAA O=C(C(=O)N1CC[C@H]1c1ccc(Cl)cc1)N1CCN(c2ccccc2)CC1 462189166 MWDPEIVDEDMLSL-IBGZPJMESA-N 383.879 2.962 0 50 GFAA COc1ccc(CNCCc2ccncc2)cc1OC[C@@H](O)CN1CCCCC1 20540772 YNNXWRNMAOYCEH-NRFANRHFSA-N 399.535 2.648 0 50 GFAA O=C(CCc1ccccc1)NCCN1CCN(C(=O)CCc2ccccc2)CC1 20458646 DTLYBKCFQYMWQB-UHFFFAOYSA-N 393.531 2.512 0 50 GFAA COc1ccc([C@H]2CCCN2C(=O)Cn2cnc(C3CCC3)cc2=O)c(OC)c1 134378522 MMUPIRRXUJHAMT-LJQANCHMSA-N 397.475 2.892 0 50 GFAA CN(C[C@@H]1CCCN1C)C(=O)c1coc(COc2cccc3cccnc23)n1 67983505 FKFQTCLHINOFQH-INIZCTEOSA-N 380.448 2.968 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c(C)c1 67604583 OZCFAYWTCMHINB-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA C[C@H](c1ccon1)N(C)Cc1cnc(S(C)(=O)=O)n1Cc1ccccc1F 20600915 JBCXVWLSNQVCRQ-CYBMUJFWSA-N 392.456 2.655 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1ccn(Cc2cccc3ccccc23)n1 2804589 OQNGHMLFIVEDEC-UHFFFAOYSA-N 381.461 2.927 0 50 GFAA CC(C)Oc1ccc(C(=O)N[C@@H]2CC(=O)N(C3Cc4ccccc4C3)C2)cc1 72172459 UCDJZDLLLNVSAR-LJQANCHMSA-N 378.472 2.972 0 50 GFAA O=C(CCC1CCN(c2cnccn2)CC1)N[C@@H]1CCN(Cc2ccccc2)C1 76949846 OXIUOCQPLILJHV-OAQYLSRUSA-N 393.535 2.864 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)N[C@@H]3CCO[C@H](C4CC4)C3)CC2)cc1 128983207 MJDBBESFAUKUEE-CTNGQTDRSA-N 387.524 2.870 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71765574 HMENXBWBCFVHCZ-LJQANCHMSA-N 382.508 2.667 0 50 GFAA O=C(N1C[C@@H]2CCS(=O)(=O)[C@@H]2C1)C1(Cc2cccc(F)c2)CCCCC1 377128526 LVCOOEIPMSRKGE-FUHWJXTLSA-N 379.497 2.964 0 50 GFAA Cc1c(C(=O)N2CCC(n3ncc(C(=O)O)c3C)CC2)oc2c1C(=O)CCC2 263142070 IGSXBVJFOYKUQP-UHFFFAOYSA-N 385.420 2.787 0 50 GFAA CCS(=O)(=O)c1ccccc1N1CCC[C@H](CNC(=O)c2ccco2)C1 374539473 WYMGQCXOBKBROX-OAHLLOKOSA-N 376.478 2.720 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2CC(=O)NC(C)C 77504866 XUHWZIMCWQGXSF-ICSRJNTNSA-N 393.487 2.676 0 50 GFAA CC[C@H](O)CCNC(=O)c1c(F)ccc(S(=O)(=O)C2CCCC2)c1F 241170984 KDGYPQRUWJDVSS-NSHDSACASA-N 375.437 2.572 0 50 GFAA CN(CC1(CO)CCOCC1)C(=O)NCc1ccccc1OC(F)(F)F 426612620 IIMOAYVDFIXHOD-UHFFFAOYSA-N 376.375 2.516 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCN3CCCC3)csc2C1 426662446 QGUUKFNZBLZSOY-UHFFFAOYSA-N 388.537 2.737 0 50 GFAA O=C(O)[C@H](c1ccc(NC(=O)N2CCOCC2)cc1)N1CCCCCCC1 95361906 DZPRWEOOONJLEG-SFHVURJKSA-N 375.469 2.943 0 50 GFAA CCCc1nc(CN(C)C(=O)Nc2cc(Cl)ccc2-n2cncn2)no1 96162155 SFNZPQPLBWVBET-UHFFFAOYSA-N 375.820 2.920 0 50 GFAA Cc1c(CC(=O)N2CC[C@@H](N)C2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 95507827 QTNMRRSXDYAMML-QGZVFWFLSA-N 383.467 2.605 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1CCC2(CC1)c1[nH]cnc1CCN2C 91444508 NFEHBEKLZFMQQF-UHFFFAOYSA-N 377.492 2.748 0 50 GFAA CC(=O)c1ccc(N2CCN([C@H](C(=O)O)c3cccc4c3OCC4)CC2)cc1 95374887 NGHPUMOMNHCRJI-FQEVSTJZSA-N 380.444 2.772 0 50 GFAA COc1ccc(-c2ccccc2NC(=O)NC[C@@H]2CN(C(C)=O)CCO2)cc1 95516482 WNVHEBPQELKVIW-GOSISDBHSA-N 383.448 2.731 0 50 GFAA CCc1cc(N2CCC(N[C@@H](C)Cc3cccc(C)n3)CC2)nc(N(C)C)n1 95527711 ISTAGTAHLBQAGI-KRWDZBQOSA-N 382.556 2.998 0 50 GFAA Cc1cccc(N2CCN([C@H](C(=O)O)c3ccc(-n4cccn4)cc3)CC2)n1 95390638 MKGPZRIJPGQWIT-FQEVSTJZSA-N 377.448 2.524 0 50 GFAA O=C(CCC(=O)N1CCC[C@@H](COc2ccccc2F)C1)Nc1nncs1 828084886 VOYNKGNEVRPLKV-CYBMUJFWSA-N 392.456 2.714 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC3CCC(S(C)(=O)=O)CC3)[nH]n2)cc1C 187317922 VSMYLDKSECPZNF-UHFFFAOYSA-N 375.494 2.779 0 50 GFAA CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=S)NCC1CCN(C)CC1 760505223 XUPJTTWHYKMBES-QGZVFWFLSA-N 398.617 2.924 0 50 GFAA COc1ccc(CN2CCC[C@@H](OCc3ccccn3)C2)cc1Cn1cncn1 1506396591 CQDKDAAZQLIZJR-OAQYLSRUSA-N 393.491 2.911 0 50 GFAA Cc1nnc(CCNS(=O)(=O)c2ccc(-c3c(C)noc3C)s2)s1 1506401015 HRYKDSCEWNYBCD-UHFFFAOYSA-N 384.508 2.701 0 50 GFAA CCOc1cc(CN2C[C@@H](O)[C@H](Cc3cnccn3)C2)cc(Cl)c1OCC 1529187537 UUWXWYJYLHXIKW-CRAIPNDOSA-N 391.899 2.963 0 50 GFAA CN(C)c1cc(N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)nc(N)n1 1704328398 NSNYIKGBKRMYBS-UHFFFAOYSA-N 378.480 2.675 0 50 GFAA Cc1cc(C(=O)N2CCCN(Cc3cnn(-c4cccc(F)c4)c3)CC2)no1 1775979827 NHUQRJGBVGHFQV-UHFFFAOYSA-N 383.427 2.656 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCC[C@H](C(=O)Nc2ccccc2)C1 13580587 NHGFUQAMOLYJAB-AWEZNQCLSA-N 392.452 2.874 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)NC(C)C)C3)C2=O)c1OC 14968724 VRLGLWWXLSOJST-NRFANRHFSA-N 389.496 2.636 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4ccccc4OC)nnc3c2)n1 169781038 ZWZPLYZCYRNUSV-UHFFFAOYSA-N 392.419 2.670 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3cccc(C)c3)CC(=O)N2[C@H]1c1ccccc1 1857740990 XAHPNTGAKMJYAS-ONTIZHBOSA-N 378.472 2.942 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2c3ccccc3NC(=O)[C@H]2C)cc1OC 225437444 XXDHJXIKKKAVCW-GFCCVEGCSA-N 376.434 2.548 0 50 GFAA O=C(CCc1cscn1)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1 262715049 GMYOHEYOEHBTJL-INIZCTEOSA-N 387.461 2.794 0 50 GFAA O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccc2cc[nH]c2n1 498531067 YZJOCFBYKOKSTI-ZDUSSCGKSA-N 379.338 2.751 0 50 GFAA CCN(C(=O)c1ccc(C(F)(F)F)c(O)n1)[C@H]1CCN(CC(F)(F)F)C1 912489133 YTKSVQDFIMMOOD-VIFPVBQESA-N 385.308 2.905 0 50 GFAA CCOc1ccc(S(=O)(=O)NC(=O)c2c(C3CC3)cnn2C)c2ccccc12 850865824 UULRNDKHNPECME-UHFFFAOYSA-N 399.472 2.968 0 50 GFAA Cc1ccc([C@H](CN2CCOCC2)NC(=O)Cc2sc(S)nc2C)cc1 858085382 IZYVVNULKCPCLM-INIZCTEOSA-N 391.562 2.781 0 50 GFAA O=C([C@@H](c1cccc(F)c1)N1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1 862803273 KOISSFMVYLPCNP-GGAORHGYSA-N 398.478 2.709 0 50 GFAA CN(C)Cc1nc2ccc(NC(=O)c3ccc4c(c3)N(C)C(=O)CC4)cc2[nH]1 1875297297 JRFPPRHMKNKKDT-UHFFFAOYSA-N 377.448 2.786 0 50 GFAA CC1(c2ccccc2)CCC(NC(=O)N2CCc3c(O)nc(O)nc3C2)CC1 1875303691 ISYHJFANKGELFF-UHFFFAOYSA-N 382.464 2.856 0 50 GFAA C=CC(=O)NC[C@@H](NC(=O)c1ccc2c(c1)CNC2=O)c1ccc2ccccc2c1 1875386096 IUVDPWYRWZBBBD-OAQYLSRUSA-N 399.450 2.857 0 50 GFAA COC(=O)c1cccc(-c2nc(CN[C@@H]3CNC(=O)CC34CCC4)cs2)c1 2325778689 KFDLIRFHFHBNMR-MRXNPFEDSA-N 385.489 2.745 0 50 GFAA Cn1c(COc2ccccc2)nnc1SCc1nc2ccccc2c(=O)[nH]1 1062151 OSDSTMQZZUMLOX-UHFFFAOYSA-N 379.445 2.923 0 50 GFAA COc1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccn2)cc1OC 8685065 BEWXCXQDLTWMRK-KRWDZBQOSA-N 384.461 2.530 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3ccc(CSC)o3)C2)CC1 55042697 CAVLMUARXWRKDJ-HNNXBMFYSA-N 395.525 2.521 0 50 GFAA COC(=O)c1ccnc(NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)c1 114443188 XLBDUWOUIRXGHV-UHFFFAOYSA-N 380.379 2.934 0 50 GFAA CCOc1cccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4)CC3)C2=O)c1 100560624 GANBTVQGIBLVOI-HXUWFJFHSA-N 379.460 2.539 0 50 GFAA COC(=O)[C@@H]1C[C@H](C(=O)NCc2ccccc2F)[C@H](c2ccccc2F)N1C 55133174 SQMCZDNHQUSTRJ-SNRMKQJTSA-N 388.414 2.816 0 50 GFAA CC(C)N1C(=O)CN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1(C)C 464375112 IQSOASMSRNMZMR-SFHVURJKSA-N 389.515 2.896 0 50 GFAA O=C(c1nc2ccccn2c1CN1CCN(C2CCCC2)CC1)N1CCCC1 20450053 IRGQQYJIWKCUGG-UHFFFAOYSA-N 381.524 2.631 0 50 GFAA CCc1nccn1CC(=O)N1CCC(O)(c2ccc3nc(C)ccc3c2)CC1 67739935 JUKBQYHKUMAWNR-UHFFFAOYSA-N 378.476 2.812 0 50 GFAA CC[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C12CC3CC(CC(C3)C1)C2 13960061 ULXREXXJWKQMRF-LMFLDHGRSA-N 382.570 2.769 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)NC1CCN(Cc2ccccc2)CC1 363179179 GTUMTDVAIJLTTQ-UHFFFAOYSA-N 375.472 2.782 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2cc3c(n(C)c2=O)CCCC3)[C@H](C)C1 77515920 PIAWPEBFNYFOLT-QGZVFWFLSA-N 379.504 2.923 0 50 GFAA C[C@H](NC(=O)N1CCCN(c2cccnn2)CC1)c1ccc(-n2cccn2)cc1 173653090 IVMASJLHFIDQMB-KRWDZBQOSA-N 391.479 2.645 0 50 GFAA COc1ccccc1CC(=O)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1OC 72425339 REWFHMGKTTULRF-YADHBBJMSA-N 380.488 2.745 0 50 GFAA Cn1cc(CCC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c2ccccc21 225428783 GIEMGKBMGYURSO-AEFFLSMTSA-N 375.472 2.919 0 50 GFAA biogenic COCCN1CCC(CN(Cc2ccncc2)C(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 95501869 ZXIBCKJAHMTAFP-BHIFYINESA-N 383.536 2.981 0 50 GFAA O=C(COc1ccccc1)N1CCN(C(=O)Nc2ccc3c(c2)CCC3)CC1 96130702 YFDOIVXOVPAYLH-UHFFFAOYSA-N 379.460 2.930 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1C[C@H]2COc3ccccc3C[C@@]2(CO)C1 95383941 ZHTLHLGOAUTRQB-KKSFZXQISA-N 387.863 2.791 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(C(=O)c1cc(-n3cccn3)ccc1Cl)C2 95371795 BNDQMZAJDXDRNL-NVXWUHKLSA-N 388.899 2.709 0 50 GFAA Cc1nonc1OCCNC(=O)c1cc(-c2ccncc2)nc2ccccc12 95374866 QUGBFEAMLQFVTN-UHFFFAOYSA-N 375.388 2.797 0 50 GFAA CCn1ccc2ccc(CN3CC[C@H](N4CCN(C)CC4)[C@H](CCCO)C3)cc21 91998081 SLJLMJQGRSRTSP-PKTZIBPZSA-N 398.595 2.872 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cc(Cl)ccc2OC)[C@H]2C[C@@H](O)C2)cn1 244678760 IJOQGDOYBNHIRU-UVBSCNOISA-N 376.840 2.994 0 50 GFAA CN(C)CCN1C[C@H](C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CC1=O 181518073 HIYSVMDIOWFOGS-LJQANCHMSA-N 393.487 2.637 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCCC[C@@H]2c2ncon2)c1 182100548 LUYUUIRYXGWLMA-CQSZACIVSA-N 383.857 2.884 0 50 GFAA COC(=O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 299035230 TUVCFAYOSZKLJN-NHYWBVRUSA-N 399.274 2.620 0 50 GFAA Cc1cccc(C)c1OC[C@@H](C)NC(=O)N1CCC[C@@H](CS(C)(=O)=O)C1 299153822 QXJHATPUAVURBD-IAGOWNOFSA-N 382.526 2.537 0 50 GFAA O=C1C[C@@H](C(=O)NCc2nc(-c3ccccc3Cl)no2)C2(CCCC2)O1 828244561 OYJQVQYOKHEYQU-LBPRGKRZSA-N 375.812 2.882 0 50 GFAA CN(C)[C@H](C(=O)N1CCN(c2nc3ccccc3o2)CC1)c1ccccc1F 826626336 ZZVGSBBPJVABOE-IBGZPJMESA-N 382.439 2.918 0 50 GFAA CCc1ccc(C(=O)N[C@H]2CCOC[C@@H]2Oc2ccc(C(=O)O)cc2)s1 1565507723 QNFACHJKWIMWRU-HOTGVXAUSA-N 375.446 2.975 0 50 GFAA CNc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(OC)cc2)C3)ccn1 1565527153 RWYKEJGXDXFPLB-MJGOQNOKSA-N 380.492 2.869 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCC[C@]3(C2)C(=O)Nc2ccccc23)n[nH]1 952986863 GQADJSJEIDJCCD-OAQYLSRUSA-N 375.432 2.541 0 50 GFAA Cc1nn(C)c(C)c1CN(C1CC1)S(=O)(=O)c1c(Cl)nc2sccn12 952977058 AIWKIBBJJFNUIS-UHFFFAOYSA-N 399.929 2.753 0 50 GFAA O=C(Cn1nc(-c2ccco2)ccc1=O)NCCn1ccc2cc(Cl)ccc21 951723465 ODOMTSVGPPRDDR-UHFFFAOYSA-N 396.834 2.928 0 50 GFAA O=C(OCCn1nc2ccccn2c1=O)C1(c2cccc(C(F)(F)F)c2)CC1 170620687 PUVNQHSTRWZYPQ-UHFFFAOYSA-N 391.349 2.790 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@H](C)Nc2cc(C(F)(F)F)nc3ncnn23)cc1 185842008 ATMASOHSDIFVMW-NSHDSACASA-N 399.398 2.726 0 50 GFAA CCc1c(C(=O)N[C@@H]2COc3ccccc3C2=O)cnn1-c1ccccc1OC 187720555 KHRITQRXGXLSAT-MRXNPFEDSA-N 391.427 2.817 0 50 GFAA CC(C)c1cc(C(F)(F)F)nc(N2CCN(CCc3nccn3C)CC2)n1 1506407426 NYGUOPAQPNZRJB-UHFFFAOYSA-N 382.434 2.717 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)NCCOCc2ccccc2)[C@H]1c1ccccc1 1529161164 AACQFZHSQNMSIA-YADHBBJMSA-N 396.487 2.697 0 50 GFAA CN(C)Cc1ccc([C@@H]2CCCN2c2ncc(F)c(N3CCOCC3)n2)cc1 1529098889 OGBKKMZNRGBPOQ-IBGZPJMESA-N 385.487 2.855 0 50 GFAA O=C(NCCc1cn2ccsc2n1)c1cn(Cc2ccccc2Cl)nn1 12297408 UPNDDWLFDPAYAD-UHFFFAOYSA-N 386.868 2.662 0 50 GFAA CCCNC(=O)c1cc(S(=O)(=O)Nc2cccc(C(C)=O)c2)ccc1OC 16661367 UJHBDYFWBGGUGY-UHFFFAOYSA-N 390.461 2.838 0 50 GFAA CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1ccc3c(c1)OCO3)C2 1857685408 VSRPVQCBVTWDCT-JIPZTSHUSA-N 397.475 2.915 0 50 GFAA COc1cc(-c2nc(CNC(=O)CN3Cc4ccccc4C3)c(C)o2)ccc1O 1857690521 LTJZTXRJMLRLHX-UHFFFAOYSA-N 393.443 2.996 0 50 GFAA CCCc1nnc(N2C[C@H](C(=O)NCCc3cccc(Cl)c3)CC2=O)s1 1857701753 VJFKNEQGTMFYBY-CYBMUJFWSA-N 392.912 2.856 0 50 GFAA COc1ccc(Cc2nc(-c3cnc(C)cc3C)n(C[C@H](C)O)n2)cc1OC 1857710948 CNUWRFTXLGCYQG-HNNXBMFYSA-N 382.464 2.946 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1F 1857727433 QWWVNGSJCKIRES-KNKQGSTJSA-N 396.418 2.749 0 50 GFAA Cc1nc(CN2C[C@@H]3[C@H](CNC(=O)c4occc4C)[C@H]4CC[C@]3(C2)O4)cs1 1857733564 OYLOFZSCBSMBCG-TVKQPGBESA-N 387.505 2.762 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCO[C@@H](CO)[C@@H]1c1ccccc1 1875242381 PLCHECPPWFAVAX-PMACEKPBSA-N 390.443 2.795 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2cc(C)c(C)c(S(N)(=O)=O)c2)C[C@H](C2CC2)O1 1875244662 YKLYTADVKSWGJK-QZTJIDSGSA-N 394.537 2.761 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3ccc4nccnc4c3)C[C@@H]2C(=O)O)c1 222072862 LJZVMMDOJMECJU-SJORKVTESA-N 377.400 2.579 0 50 GFAA CO[C@@H](CN1CCN(c2ccnc(N(C)C)n2)CC1)c1ccc(Cl)cc1 225770810 UIKCVGCDPCZBEE-KRWDZBQOSA-N 375.904 2.706 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328627932 NEMIAMITJFZPTJ-LJQANCHMSA-N 377.448 2.772 0 50 GFAA CC1(C)CN(C(=O)C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c2cccc(Cl)c21 246813343 IYADDGLDGDJHFV-IUIKQTSFSA-N 376.884 2.894 0 50 GFAA CC(C)C[C@H](NS(C)(=O)=O)c1nc(Cc2nc(C(F)(F)F)cs2)no1 1875270733 INKJSWYHHUJHCY-QMMMGPOBSA-N 398.432 2.772 0 50 GFAA CN(C[C@@H]1CCCN(C(=O)c2cnc3cc[nH]c3c2)C1)C(=O)CC[C@@H]1CCOC1 1875338639 FKOFLHLJZYCYJB-SJORKVTESA-N 398.507 2.690 0 50 GFAA C=CC(=O)NCCC(=O)N1CCOc2c(Cl)cc(Br)cc2C1 889865454 OGSZZOGWMPZAON-UHFFFAOYSA-N 387.661 2.516 0 50 GFAA COC(=O)C1=CN(C[C@H]2CCCO2)C=C(C(=O)OC)C1c1ccc(C)s1 729586 XTKOBRUTCSFRCO-CYBMUJFWSA-N 377.462 2.749 0 50 GFAA Cc1oc(-c2ccccc2Cl)cc1C(=O)N1C[C@H]2COC[C@@H](C1)C(=O)N2C 2100545411 UDFXPWIESQDXAR-KGLIPLIRSA-N 388.851 2.838 0 50 GFAA NS(=O)(=O)c1cc(CNC(=O)c2cc(-c3ccc4ccccc4c3)on2)co1 1857800408 AKPKZXPIEBAZDP-UHFFFAOYSA-N 397.412 2.665 0 50 GFAA COCCN(CCNC(=O)c1ccoc1C)Cc1noc2c1CC(C)(C)CC2 2325794240 VNXSOWBMRHCAAF-UHFFFAOYSA-N 389.496 2.969 0 50 GFAA CO[C@]1(C(F)(F)F)C[C@H](CN2CCCC[C@@H]2c2n[nH]cc2C(=O)N(C)C)C1 2325797342 DITMSGLBIYWPSF-MRRJBJDNSA-N 388.434 2.996 0 50 GFAA CC(C)(CN1CCN(c2ccccc2)CC1)NC(=O)c1cc[nH]c2nccc1-2 2325857412 AQFZYTVYQIKIBW-UHFFFAOYSA-N 377.492 2.845 0 50 GFAA O=C(CSc1nnnn1-c1cccc(Cl)c1)Nc1ccc2c(c1)OCO2 1004218 SFAIVQPUSQKZHM-UHFFFAOYSA-N 389.824 2.775 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 1156584 REYTXORDSGWJJO-UHFFFAOYSA-N 390.480 2.885 0 50 GFAA CN(C)[C@H]1C[C@H]2C[C@@H](N(C)C(=O)CCc3nc(-c4ccncc4)no3)C[C@H]2C1 2356149077 IZOLMMPXOLYILF-USTZCAOPSA-N 383.496 2.641 0 50 GFAA COc1cc(-c2o[nH]c(=NCCCNc3cccnc3)c2C(=O)O)ccc1F 2356160136 FGLLKTRAAHGWQF-UHFFFAOYSA-N 386.383 2.919 0 50 GFAA Cc1ccc(N(CC(=O)NC[C@H](C)c2ccccc2)S(=O)(=O)N(C)C)cc1 8602053 BFLKCESNGXEGHN-KRWDZBQOSA-N 389.521 2.528 0 50 GFAA O=C(NC1CCCCC1)[C@H](Cc1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 100637006 NQFNXZYBAQVKDT-XYYCENQHSA-N 392.499 2.854 0 50 GFAA Cc1ccc(-c2nn3c(CN4CCN(c5ccccc5)CC4)nnc3s2)cn1 67629913 HBIRUDLCFVPVRC-UHFFFAOYSA-N 391.504 2.878 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)Nc2ccc(C(=O)NC(C)C)cc2)CC1=O 108325244 RINYYOPLJYZEAM-INIZCTEOSA-N 395.459 2.825 0 50 GFAA CC[C@@H]1CN(C(=O)c2coc(COc3ccc4sc(C)nc4c3)n2)CCN1 67867336 CGGMKKINTCVQMC-CYBMUJFWSA-N 386.477 2.996 0 50 GFAA COc1cccc(Cn2ncc3c4sc([S@](C)=O)cc4n(C)c3c2=O)c1 36382858 MORBXZMIXGYQDB-AREMUKBSSA-N 387.486 2.744 0 50 GFAA in-vitro OCC[C@@H]1CN(Cc2ccc3nonc3c2)CCN1Cc1ccc(F)c(F)c1 23375528 KAXLXYYBTMJHSM-MRXNPFEDSA-N 388.418 2.570 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCOC(C)(C)C2)nc1 67641139 NSNURVXTXKQPLY-UHFFFAOYSA-N 385.512 2.837 0 50 GFAA CC(C)S(=O)(=O)CCNC(=O)c1csc2nc(-c3ccc(F)cc3)cn12 67712734 OXFLBCUGCLKPKW-UHFFFAOYSA-N 395.481 2.755 0 50 GFAA CC(C)n1nccc1NC(=O)Cn1cc(-c2ccc(N3CCOCC3)cc2)cn1 23369398 VVSVBRVHDWSNJF-UHFFFAOYSA-N 394.479 2.803 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)c(C)c1 67602000 XGUCUGRPLDUOEA-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CN([C@H]1CCN(c2ccccc2)C1=O)S(=O)(=O)c1cccc2cnccc12 172029911 LTKQZBUQVQRAEO-SFHVURJKSA-N 381.457 2.661 0 50 GFAA CCc1c(C(=O)N2CC[C@@]3(CCCN(CCOC)C3=O)C2)[nH]c2ccccc12 72158069 KLCMTSGDFQBONL-QFIPXVFZSA-N 383.492 2.831 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@H](c1ccccc1F)CC(=O)N2 33271388 LCIGSYBDGWIIME-ZDUSSCGKSA-N 377.383 2.540 0 50 GFAA CCc1csc([C@H]2CCCN(C(=O)c3nnn(C4CCNCC4)c3C)C2)n1 237114367 JRZNTAYLNSXLJP-AWEZNQCLSA-N 388.541 2.550 0 50 GFAA O=C(Cn1nnc(-c2ccccc2)n1)NOCc1ccc(C(F)(F)F)cc1 153178281 WAICTWOKYDUTSK-UHFFFAOYSA-N 377.326 2.607 0 50 GFAA CC(=O)N[C@H](CC(=O)NC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1 363362372 HCSBZNDHEKDASO-FYYLOGMGSA-N 393.531 2.935 0 50 GFAA CCN(CC)C(=O)c1cccc(NC(=O)CN2CCC[C@H](N3CCCC3)C2)c1 363690532 IPSXAHJKSSGJKR-FQEVSTJZSA-N 386.540 2.667 0 50 GFAA COc1cccc(OC)c1CC(=O)N1CCN(C(=O)CCC2CCCC2)CC1 155544767 AFLHSGGMPBERRB-UHFFFAOYSA-N 388.508 2.888 0 50 GFAA CN(CCCN1c2ccccc2CCc2ccccc21)C(=O)[C@H]1CNCCO1 72157812 UVPAFBKVFKJABH-JOCHJYFZSA-N 379.504 2.760 0 50 GFAA COCc1ccc(S(=O)(=O)N[C@H](CCC(=O)O)Cc2ccccc2)cc1 262379900 GTDBRHFVOSIUCK-QGZVFWFLSA-N 377.462 2.587 0 50 GFAA Cc1scc(C(=O)N[C@@H]2COCC[C@@H]2OCC(=O)O)c1-c1ccccc1 220220368 KVKGNVIRHIQJFM-CVEARBPZSA-N 375.446 2.712 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCC(Cn2cc(C(C)(C)N)nn2)CC1 48395525 ZVDJSNSUJAOGPU-UHFFFAOYSA-N 375.904 2.986 0 50 GFAA CN1C(=O)N[C@@H]2CN(C(=O)c3csc(-c4ccccc4Cl)n3)CC[C@@H]21 286387901 QMDZYNCTTXHPJT-OCCSQVGLSA-N 376.869 2.702 0 50 GFAA COc1cccc(N2C[C@@H](Cc3ccccc3)N(C(=O)c3cc[nH]n3)CC2=O)c1 82127289 AQDZQQQNSBHRLH-GOSISDBHSA-N 390.443 2.519 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Nc3ccc(Cl)nc3)C2)CCC1=O 82096318 CWEZCTQNQDOOBE-GOSISDBHSA-N 380.876 2.618 0 50 GFAA O=C(CCN1CCCCC1=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 220471154 JGEFCDDGZFQECZ-QRFVXNFXSA-N 381.476 2.566 0 50 GFAA CCNC(=O)CCN1CC[C@@]2(CCCN(Cc3cc(OC)ccc3F)C2)C1 426488520 ZTACAQDORXEJKO-NRFANRHFSA-N 377.504 2.648 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)N1CC[C@@H](Oc2ccccc2)C1 426395954 MSXJAZKUEPNSIV-GOSISDBHSA-N 377.444 2.857 0 50 GFAA O=C([C@H](O)c1ccc(Cl)cc1)N1CCC2(CC1)Nc1ccccc1NC2=O 82092653 ZPSNSDOMEYWRDE-QGZVFWFLSA-N 385.851 2.799 0 50 GFAA CCSc1nc(CC(=O)N2CCCn3nc([C@H](O)CC)cc3C2)cs1 221412079 NCWIHEUGCJGBBD-OAHLLOKOSA-N 380.539 2.870 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cccc(Cn3nc(C)cc3C)c2)on1 95354677 UKRAIPVUSRVVNL-CTNGQTDRSA-N 394.475 2.832 0 50 GFAA c1ccc2sc(N3CCC(N4CCN(c5cnccn5)CC4)CC3)nc2c1 95506629 JBOPOYKQNGGDQW-UHFFFAOYSA-N 380.521 2.877 0 50 GFAA C[C@@]1(Cc2ccc3c(c2)OCO3)CCCN(C(=O)c2cn3cccnc3n2)C1 91434682 DPPCJBZYMVWGIT-NRFANRHFSA-N 378.432 2.943 0 50 GFAA CN(CC(=O)N(C)C)C[C@@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1 95530409 GZAOJJSVSHCKFQ-KRWDZBQOSA-N 385.474 2.980 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(C3Cc4ccccc4C3)CC2)n1C 96132587 CXHKDPIOTXFAPN-UHFFFAOYSA-N 376.508 2.715 0 50 GFAA CC1(C)CC(CC(=O)N2CCN(Cc3ccccc3)C[C@@H](O)C2)CC(C)(C)N1 95517730 PSTLMFPFYDLVHN-HXUWFJFHSA-N 387.568 2.639 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95375364 SHZWEMDHKCCOSD-DOTOQJQBSA-N 382.460 2.508 0 50 GFAA COc1nnc(CN2CCC[C@H](c3nccn3Cc3cscn3)C2)s1 95366417 CZAINNOOEOGAME-LBPRGKRZSA-N 376.511 2.628 0 50 GFAA CSc1nc(N)cc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)n1 91770224 TYOWOWVQGDLBTC-HNNXBMFYSA-N 381.509 2.805 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCN(c2ncccc2C)CC1 95385907 DXICOGWTCJVURY-KRWDZBQOSA-N 375.856 3.000 0 50 GFAA COC(=O)COCCOCCNC(=O)OCC1c2ccccc2-c2ccccc21 97756901 DBSAFNJUEHWIDB-UHFFFAOYSA-N 399.443 2.731 0 50 GFAA Cc1nc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)nn1-c1cccc(Cl)c1 261490578 KPBVLMPPAUWFON-UHFFFAOYSA-N 390.852 2.885 0 50 GFAA Cc1ccn(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 71440370 MFMSBRRZDFNCIA-LJQANCHMSA-N 386.471 2.616 0 50 GFAA CN1CCN([C@H]2CCN(C(=O)Nc3ccccc3Oc3cccnc3)C2)CC1 299781264 DIQZKEHQKAZVTC-KRWDZBQOSA-N 381.480 2.728 0 50 GFAA Cc1cnc(C)c(-c2cccc(C(=O)NCCS(=O)(=O)CC(C)C)c2)n1 299778865 RDOHJHUDTASQLC-UHFFFAOYSA-N 375.494 2.561 0 50 GFAA O=C(NCCCn1cc(Cl)cn1)N1CCC(OCc2ccccn2)CC1 584895997 VWJIABVSBJFUIC-UHFFFAOYSA-N 377.876 2.712 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2cc(C)nc(C)n2)cc1 1565528314 RXUKKCIMWLSKIP-MOPGFXCFSA-N 380.492 2.839 0 50 GFAA Cc1cc(N2CCN(C(=O)c3cc[nH]c3C)CC2)nc(-c2ccccc2O)n1 952987052 ORXOXJQDUGRMIF-UHFFFAOYSA-N 377.448 2.757 0 50 GFAA CC(=O)N1CCC(CC(=O)N2CCCCCC2)(N2Cc3ccccc3C2=O)CC1 888105518 HRHJURVMVLBKPQ-UHFFFAOYSA-N 397.519 2.816 0 50 GFAA Cn1ccnc1CCN1CCC[C@@H](CNC(=O)c2cc3ccccc3cn2)C1 952981066 YWJSEQNPGLZTOY-KRWDZBQOSA-N 377.492 2.653 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2Br)CC1 186663884 SPYIOZMYIUVXFG-GFCCVEGCSA-N 387.249 2.599 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)Nc3nc(C)cc(C4CC4)n3)cc2C[C@@H]1C 191807240 BFVMLLMWPBZPBC-LBPRGKRZSA-N 386.477 2.761 0 50 GFAA O=C1C[C@@H](c2ccccc2)N(C(=O)Nc2cccc(C(=O)NC3CC3)c2)CCN1 195447565 JJAUVGXPGDJIJX-IBGZPJMESA-N 392.459 2.674 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NC[C@@H](CO)Cc2ccco2)s1 1506417175 LHFCZRQMWPPXJD-ZDUSSCGKSA-N 396.490 2.742 0 50 GFAA CC(C)c1cc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)nc(N)n1 1506415649 AGXHOJVDBRKTDA-UHFFFAOYSA-N 381.480 2.738 0 50 GFAA C[C@H](CN(C)c1noc(-c2ccc(Cl)cc2)c1C(=O)O)N1CCOCC1 1704310813 UCDOQMBIZKPJQA-GFCCVEGCSA-N 379.844 2.850 0 50 GFAA CC(C)[C@@H](NC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccco1)C(=O)O 5092759 IEWONSUFAFFPGT-HFQYIWAZSA-N 390.823 2.929 0 50 GFAA CCc1ccc(CN2C[C@@H]3CN(Cc4ccc(C(=O)O)o4)C[C@@]3(CO)C2)s1 1772805741 RLVXDZZBQRXJNK-XOBRGWDASA-N 390.505 2.528 0 50 GFAA Cn1ccnc1CN1C[C@H]2CN(Cc3cnc[nH]3)C[C@]2(CCc2ccccc2)C1 1772808389 OWJAYHSFQZSHIU-NFBKMPQASA-N 390.535 2.710 0 50 GFAA CCOC(=O)N1CCN(C(=O)[C@@H]2CC23CCN(C[C@@H]2CC=CCC2)CC3)CC1 11998265 QUSONGRXVQCWQT-MOPGFXCFSA-N 389.540 2.746 0 50 GFAA CC(C)C[C@@H](O)C1CCN(C(=O)c2cn(Cc3c(F)cccc3F)nn2)CC1 12057781 KQYDMHVOTGFSTI-LJQANCHMSA-N 392.450 2.864 0 50 GFAA O=C(c1ccc(-c2ccccc2)c(F)c1)[C@@H]1CCCN(C(=O)Cn2cnnn2)C1 12442250 UDZBXWYGBASIJS-QGZVFWFLSA-N 393.422 2.601 0 50 GFAA CN(C)CCCN(C)[C@@H]1CCCN(C(=O)CCc2nc(-c3ccccc3)no2)C1 19112604 ABSZHPWOLIPJNV-LJQANCHMSA-N 399.539 2.544 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCC(Oc2cccnc2)CC1 19566972 UBBLWKGDRKKVBX-UHFFFAOYSA-N 376.478 2.939 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)o1 19608554 HUEDPAHFEGIGDE-INIZCTEOSA-N 380.435 2.773 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@H](C)n2cnc3ccccc3c2=O)nc1C 206244510 FEXIQNYJJQSVKY-NSHDSACASA-N 386.433 2.538 0 50 GFAA COC(=O)C[C@@H](c1ccc(F)c(F)c1F)c1c(O)n2ccccc2nc1=O 205968295 BJCAWBHSHZSICA-JTQLQIEISA-N 378.306 2.512 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N4CCc5n[nH]cc5C4)C3)nc2c1 1857668365 ASIIVSFLJLYSLD-AWEZNQCLSA-N 395.463 2.751 0 50 GFAA CC1(C)CN(C(=O)C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c2cccc(Cl)c21 121861943 IYADDGLDGDJHFV-XZJROXQQSA-N 376.884 2.894 0 50 GFAA CN(Cc1ccccc1S(=O)(=O)N1CCOCC1)C1CCC(F)(F)CC1 952846128 FSPRQVYVDZNWNF-UHFFFAOYSA-N 388.480 2.717 0 50 GFAA C[C@@H](C(=O)NS(=O)(=O)[C@@H]1CCc2ccccc21)n1ccc(C(F)(F)F)n1 1875285471 ODZRFVIPOPSQQJ-GXFFZTMASA-N 387.383 2.596 0 50 GFAA O=C(NC[C@@H]1CCCN(C[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)C1)c1ccccc1 1875264928 OZUJIHSLKULLRU-AYVLOHNJSA-N 392.543 2.637 0 50 GFAA CCC/C(C)=C/C(=O)NC1(CNC(=O)COc2cccc(F)c2)CCOCC1 1875344215 HHVCYHJPAMXRHO-FOWTUZBSSA-N 392.471 2.733 0 50 GFAA C[C@@H]1COC[C@@](CO)(CNc2nccc3ncccc23)N1Cc1ccccc1 1875325994 JWIVFKVNLOQATE-VGSWGCGISA-N 378.476 2.694 0 50 GFAA CC(C)N(C(=O)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1)c1ccccn1 1875378965 JLMZUFXTLVARQT-UHFFFAOYSA-N 396.447 2.603 0 50 GFAA Cc1ccc(-c2csc(NC(=O)[C@H](C)CS(C)(=O)=O)c2C(N)=O)cc1C 1875355056 YLIYRCPNGRWOED-GFCCVEGCSA-N 394.518 2.750 0 50 GFAA Cc1nc2ccccn2c1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 1875300955 XNRBANPPOOZMHX-INIZCTEOSA-N 381.411 2.818 0 50 GFAA N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC[C@H](O)c1ccccc1C(F)(F)F 884108329 XSSSLMDEEKRGEM-AEFFLSMTSA-N 391.393 2.906 0 50 GFAA Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)C3(C(C)(F)F)CC3)cc2)n1 888100886 QKABFEANFNECRY-UHFFFAOYSA-N 396.419 2.960 0 50 GFAA CCCCC(=O)N1CCCCC[C@H](NC(=O)[C@@]2(CC(C)C)CCNC2=O)C1 1775991134 HOBMZPFQQVUQCR-LAUBAEHRSA-N 379.545 2.616 0 50 GFAA COc1ccccc1N1CCN(S(=O)(=O)c2cc(Cl)ccc2OC)CC1 1025600 VDGKOVUAJDZMCI-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA Cc1ccc(-c2cccnc2)cc1NC(=O)N1CC[C@@H](n2cc(CN)nn2)C1 2325859995 TVSLYUMAQFRQPE-GOSISDBHSA-N 377.452 2.586 0 50 GFAA CN(C(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1cccc(CC(=O)O)c1 2325869390 LLWAIGBYPXDXSQ-UHFFFAOYSA-N 387.823 2.773 0 50 GFAA CCN(Cc1cn(CC)nc1C)C(=O)Cn1nc(C(F)(F)F)c2c1CCC2 20607733 WXLYNCGZNHBLMP-UHFFFAOYSA-N 383.418 2.964 0 50 GFAA COc1ccc(-n2c(SCC(N)=O)nc3sc(C)c(C)c3c2=O)cc1 793619 QBMCFSGFKQKRTD-UHFFFAOYSA-N 375.475 2.650 0 50 GFAA COc1ccc(C(=O)NC(=S)Nc2ccc(Br)cn2)cc1OC 881479 IRYSSHQCRTUVGJ-UHFFFAOYSA-N 396.266 2.988 0 50 GFAA CC(C)CNS(=O)(=O)c1ccc(CCC(=O)NCCc2ccccc2)cc1 1110857 PDQVJIJZAYVMTM-UHFFFAOYSA-N 388.533 2.912 0 50 GFAA CCOC(=O)N1CCN(c2ncnc3c2cnn3-c2ccc(C)cc2C)CC1 2367387 SEPSWKJAARQRNU-UHFFFAOYSA-N 380.452 2.711 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2CC(=O)NCCc2ccc(Cl)cc2)C1=O 2356166082 NVCYSTCUSZTKIS-NRFANRHFSA-N 391.943 2.864 0 50 GFAA CCN(CC)CCNC(=O)C[S@@](=O)Cc1nc(-c2ccc(C)cc2)oc1C 4035723 FZEMBKBXIUMMGG-HHHXNRCGSA-N 391.537 2.665 0 50 GFAA C[C@@H]1CN(C(=O)CCNC(=O)c2ccc3ccccc3c2)CC2(CCOCC2)O1 225736840 KMKGZUMTKAJADS-QGZVFWFLSA-N 396.487 2.756 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCN(C)C(C)(C)C3)C2=O)cc1 67724961 JHLTWURCAFZKSG-HSZRJFAPSA-N 387.568 2.690 0 50 GFAA COc1ccc(-n2cccn2)c([C@@H]2CC(=O)NCc3nc4sccn4c32)c1 65406787 DCRYRUJLJFMVHA-AWEZNQCLSA-N 379.445 2.742 0 50 GFAA Nc1ccc(-c2ccc(C(=O)NCC[C@H]3COc4ccccc4O3)cn2)cn1 67689036 WIWDXHGGBHXJJH-INIZCTEOSA-N 376.416 2.686 0 50 GFAA CCN1CCC[C@H](NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)C1 252511133 ZUUWUZFLNCJSGQ-KRWDZBQOSA-N 394.541 2.513 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nn2cnnc2)cc1OC 1109374 CBGPUORQOBDXMI-UHFFFAOYSA-N 390.403 2.532 0 50 GFAA CNC(=O)c1cccc(S(=O)(=O)N[C@@H]2CCCN(C3CCCCCC3)C2)c1 72143666 DBFKWXUFQSKVOW-QGZVFWFLSA-N 393.553 2.512 0 50 GFAA O=C(NC[C@@H](c1ccc(F)cc1)N1CCCC1)c1cn(-c2ccccc2)nn1 72168445 FMXZTOBFJVPSHX-FQEVSTJZSA-N 379.439 2.973 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N3CCC(n4ccnc4)CC3)cc2)C[C@H](C)O1 363155172 HNXRGDBDOZPVBP-ROUUACIJSA-N 382.508 2.970 0 50 GFAA CCC(=O)N1CCC[C@@H](C(=O)Nc2ccc(OCC(=O)O)c3ccccc23)C1 486045428 AFYRUJDNYBMBKO-CQSZACIVSA-N 384.432 2.890 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)NCCCc2nc3ccccc3s2)cc1 30364605 NRNYNNWBXQWUCV-UHFFFAOYSA-N 389.502 2.567 0 50 GFAA Cc1cc(CNc2cncc(C(=O)N3CCOCC3)n2)c2[nH]c(C)c(C)c2c1 71419441 RVZIRZJDXHRIRY-UHFFFAOYSA-N 379.464 2.968 0 50 GFAA Cc1ccc(NC(=O)NC(=O)[C@H](C)N2C[C@@H](N)[C@H](c3ccccc3)C2)c(C)c1 261871845 XMGQYVCHEQPBBV-YTQUADARSA-N 380.492 2.767 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NC[C@](C)(O)c1cnn(C)c1 157565669 KUTLBLQSWUIKRR-SFHVURJKSA-N 392.818 2.814 0 50 GFAA CCOc1ccc2cc(C(=O)N(C)[C@@H]3CCN(C4CCN(C)CC4)C3)[nH]c2c1 377638209 YTFSYWUXXRSCRD-GOSISDBHSA-N 384.524 2.807 0 50 GFAA Cc1ccc(Oc2cccc(C(=O)N3CCN(c4ccc(C)nn4)CC3)c2)nn1 72442078 YKNFXYBNZDMWMV-UHFFFAOYSA-N 390.447 2.638 0 50 GFAA COc1cc(OC)cc([C@H]2CCN(C(=O)Cn3c(=O)oc4ccccc43)C2)c1 175407423 JHEUPCNLWMMGTD-AWEZNQCLSA-N 382.416 2.628 0 50 GFAA CC[S@](=O)[C@H]1CCCC[C@H]1NC(=O)Cc1cc(Cl)c2c(c1)OCCO2 242338995 ZEBUMEBPGKBSLE-YHSMVDSJSA-N 385.913 2.850 0 50 GFAA C[C@H](C(=O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1)C1CC1 178390043 MLGDMKCRDBRONJ-AWEZNQCLSA-N 386.883 2.581 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)NCc3cnc4c(c3)CCC4)c2n1 426545062 MDAYLAUPNAQOPY-UHFFFAOYSA-N 375.354 2.870 0 50 GFAA O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)N1CCC(c2ccn[nH]2)CC1 190733404 MAOUJDKXWTUBHQ-HXUWFJFHSA-N 397.523 2.590 0 50 GFAA CCN1CCC[C@H](c2nc3cc(S(=O)(=O)N4CCCC4)ccc3n2C)C1 82161074 KCRQTJTYVBOVQZ-HNNXBMFYSA-N 376.526 2.557 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CC[C@H](CN)C4)csc3C2)nc1 426503201 AKEAEVODBIHPFJ-MRXNPFEDSA-N 384.549 2.685 0 50 GFAA CCc1nc(C)c(CNC(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)s1 97698893 HKZSFSXCXAYNLF-UHFFFAOYSA-N 387.465 2.734 0 50 GFAA Cc1cc(C(=O)N2CC[C@H](N(C)C)[C@H](CCC(=O)O)C2)c2ccc(F)cc2n1 91997808 VHDQTMODCUSCNG-KUHUBIRLSA-N 387.455 2.939 0 50 GFAA CCCCc1nc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)c[nH]1 91381104 OIIBDBDUMDYGLG-UHFFFAOYSA-N 384.528 2.771 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CSc3nccn3C)[nH]c2C1 95385568 MAUIFSQHEIACES-LBPRGKRZSA-N 383.477 2.514 0 50 GFAA O=C(CCN1CCC(C(=O)NCc2ccccn2)CC1)Nc1ccccc1F 244882445 XRSSTSYEEMUVFU-UHFFFAOYSA-N 384.455 2.578 0 50 GFAA CC(C)n1nnc(-c2ccc(C(=O)Nc3ccc4ncnc(O)c4c3)cc2)n1 253623639 CQYJAXGZKVUKCC-UHFFFAOYSA-N 375.392 2.822 0 50 GFAA CC(=O)c1cccc(O[C@@H](C)C(=O)NC2CCN(Cc3ccncc3)CC2)c1 299341675 MLEUYRVFRYNIFG-KRWDZBQOSA-N 381.476 2.832 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1-c1ccc(C(=O)N2CCC[C@H](C(N)=O)C2)cc1 534671763 FPDBVNFKBLJWEK-ZDUSSCGKSA-N 380.370 2.741 0 50 GFAA O=C([C@@H](Cc1ccccc1)NCC1=Cc2ccccc2OC1)N1CCOCC1 185162708 VFKNHAKNQBFEMS-OAQYLSRUSA-N 378.472 2.522 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC[C@H](CN3CCCC3=O)C2)c(C)c1 299795241 LOYKXGHVFSBWQS-MRXNPFEDSA-N 386.496 2.611 0 50 GFAA O=C1C[C@@H](C(=O)NC[C@H]2Cc3cccc(-c4cncnc4)c3O2)c2ccccc21 299759956 REAUDBHKDYAPCM-OXQOHEQNSA-N 385.423 2.934 0 50 GFAA O=C(c1ccc(-c2cc(O)ncn2)cc1)N1CCC(CCn2cccn2)CC1 584893309 JGLPSNOSHUYHOC-UHFFFAOYSA-N 377.448 2.988 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3ccc(F)cc3C)C2)cc1=O 952965072 BOHXYIZKQNYMIE-INIZCTEOSA-N 399.466 2.598 0 50 GFAA Cc1ccc(OCc2nc(CS(=O)(=O)CC[C@@H]3CCOC3=O)cs2)cc1 267892241 XHKHADDBGPIZEM-AWEZNQCLSA-N 395.502 2.899 0 50 GFAA CC1=C(c2ccccc2)[C@@H]1C(=O)NCC1CCN(C(=O)c2ccc(CO)o2)CC1 952862676 PJKIVFQQZTXBBD-OAQYLSRUSA-N 394.471 2.844 0 50 GFAA CN(C)C[C@]1(CO)CCCN(S(=O)(=O)c2ccc(-c3ccccc3)cc2)C1 952986229 YXUVYWDAWCSXPD-OAQYLSRUSA-N 388.533 2.678 0 50 GFAA COCC1CCN(S(=O)(=O)N(C)CCCOc2cccc(Cl)c2)CC1 952968783 NWBUVASKCINKNW-UHFFFAOYSA-N 390.933 2.644 0 50 GFAA CCOc1ccccc1[C@](N)(C(=O)NCCN1CCC[C@@H](C)C1)C(F)(F)F 221896800 DDXAFYPESUOTGV-KDOFPFPSSA-N 387.446 2.650 0 50 GFAA CC1CCN(C(=O)c2ccc(NC(=O)N3CCC[C@]4(CNC(=O)C4)C3)cc2)CC1 170643969 GXUYCAFLNXYTHX-QFIPXVFZSA-N 398.507 2.693 0 50 GFAA CC(C)(C)n1cc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)nn1 191472528 PFVUZMVHOXLJSC-OAHLLOKOSA-N 381.402 2.725 0 50 GFAA Cc1ccn(C)c(=O)c1NC(=O)Cn1c(-c2ccc(F)cc2)c(C)sc1=O 758567945 PPRFOJDAXDJUJN-UHFFFAOYSA-N 387.436 2.670 0 50 GFAA O=C(NC[C@H](c1cccnc1)N1CCCCC1)c1nnc(O)c2ccccc12 1506407692 KYBOASCSMYIFBX-GOSISDBHSA-N 377.448 2.687 0 50 GFAA Cc1nnc(CN2CCC[C@@H](CNC(=O)Cc3c[nH]c4ccccc34)C2)s1 1506398110 VWYLPZZFPGGNNG-HNNXBMFYSA-N 383.521 2.899 0 50 GFAA CN(CCOc1cccc(Cl)c1)CC(=O)Nc1nnc([C@H]2CCCO2)s1 1529158629 HKCPEGNZHZHLFH-CQSZACIVSA-N 396.900 2.992 0 50 GFAA CCCn1cc(C(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)c(C)n1 1615941121 POVQHWHLOVDOJT-UTKZUKDTSA-N 378.476 2.825 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N2CCC3(C=C(C)CCO3)CC2)CC1=O 1704345523 ZHMWDSRJABMZNJ-LJQANCHMSA-N 398.503 2.772 0 50 GFAA CC(C)c1cc(C(=O)N2C[C@H]3CCC[C@](O)(c4ccccc4)[C@H]3C2)nc(N)n1 1704338932 AKVVHDMBAMZYIL-ZWWNWMABSA-N 380.492 2.942 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704297755 DOZDEQDEWRTHDC-UHFFFAOYSA-N 377.448 2.553 0 50 GFAA Cc1cc(CN(C)C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)no1 1704307434 ZDWNVRAADDUXJT-UHFFFAOYSA-N 382.420 2.747 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccc(-c2cc(Cl)nc(N)n2)cc1)C(=O)O 114220289 KOGJTURHFMAARC-CYBMUJFWSA-N 392.843 2.900 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)c3ccc4c(c3)C(=O)N(C)C4=O)C2)cc1 12308198 QSZQFPNVGZYXLZ-INIZCTEOSA-N 393.443 2.638 0 50 GFAA Cc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)CCN2CCCC2=O)C1 12581728 BCHAFLMNZAWOJI-FQEVSTJZSA-N 385.552 2.720 0 50 GFAA CN(Cc1ccco1)C(=O)c1nn(C)c2c1C[C@H](NCc1ccccc1)CC2 14741568 DCLHEIADKKUVQF-QGZVFWFLSA-N 378.476 2.932 0 50 GFAA CSc1nnc(CN(C)Cc2ccc(NC(C)=O)cc2)n1C[C@H]1CCCO1 14975914 JMALLEDYSVOZGH-QGZVFWFLSA-N 389.525 2.769 0 50 GFAA CCOCCCNC(=O)c1cn(C2CCCC2)cc(C(=O)N[C@H](C)CC)c1=O 15001375 ZJUJPESLVJZXSO-OAHLLOKOSA-N 391.512 2.648 0 50 GFAA Cc1n[nH]c([C@@H](C)NC(=O)C2(N(C)Cc3ccccc3)Cc3ccccc3C2)n1 15062184 ZHAZIDGFOHBNMF-MRXNPFEDSA-N 389.503 2.960 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc(-c2cc[nH]n2)o1 1857675470 ZADJWSKCGZODNX-WBHUJUFNSA-N 393.465 2.555 0 50 GFAA COc1cc(-c2nccn2-c2ccc(N3CCN(C(C)=O)CC3)cc2)ccn1 1857684705 ZJBJMCWQMOJIDB-UHFFFAOYSA-N 377.448 2.611 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N(C)[C@H](C)Cc4cnccn4)CC3)nc2n1 1857721995 BNEVJGVSFMOJHL-OAHLLOKOSA-N 394.479 2.627 0 50 GFAA COc1cccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1C 1857728917 FPIJVVWNXMNSAY-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)C2(c3ccc(OC)cc3)CCCC2)CC[C@@H]1O 1857738948 GBCMVJWRDZELNM-FPOVZHCZSA-N 375.509 2.879 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(S(=O)(=O)Cc3ccc(F)cc3)C1)CC2 1704315896 QIHAJBOFMAFIGD-IBGZPJMESA-N 375.469 2.734 0 50 GFAA O=[S@](c1ccc(N2CCC[C@]3(CCS(=O)(=O)C3)C2)cc1)C(F)(F)F 865856712 KJDCECNHQZRUCZ-LFVRLGFBSA-N 381.441 2.719 0 50 GFAA COc1ccc([C@@H]2C[C@H](C)N(S(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1 1875260153 VECIRGWFAYAGPU-XJKSGUPXSA-N 375.446 2.960 0 50 GFAA CCCn1cc(CNC(=O)[C@@H](N)Cc2cccc(Oc3ccccc3)c2)nn1 1875315472 WHQCTSFUZXPRJB-FQEVSTJZSA-N 379.464 2.667 0 50 GFAA Cn1cc(C(=O)N2CC(=O)Nc3ccc(Cl)cc3[C@H]2c2ccccc2F)nn1 1875340016 IGOYJSQRPBFNLV-GOSISDBHSA-N 399.813 2.792 0 50 GFAA C[C@@H](C(=O)N[C@H](C)c1ccc2ccccc2c1)N1CCc2c(O)nc(O)nc2C1 1875308071 RPFSDZSUXHAAKU-KGLIPLIRSA-N 392.459 2.665 0 50 GFAA CCOCCn1cc(C(=O)N2CCCCC[C@@H](NC(=O)C[C@@H](C)CC)C2)cn1 1775990477 BFBVKKLSUCKOBZ-PKOBYXMFSA-N 392.544 2.857 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100540493 JRVNCGXKGFRKDR-QHCPKHFHSA-N 392.503 2.738 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(c2ncc3c(ncn3C)n2)CC1 2100556567 FNFFMLRFSQMFRV-UHFFFAOYSA-N 386.887 2.526 0 50 GFAA O=C(NCCc1ccccc1)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2100556805 IDBIUIMFOQQFEA-QHCPKHFHSA-N 392.503 2.991 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)C1 2325888762 XHBANKKIRWFFNO-OAHLLOKOSA-N 399.491 2.821 0 50 GFAA CCOc1ccccc1NC(=O)CN(c1ccccc1OCC)S(C)(=O)=O 647771 IVMHRKVHJYLNRK-UHFFFAOYSA-N 392.477 2.889 0 50 GFAA COc1ccc(-c2noc(-c3ccccc3C(=O)N3CCOCC3)n2)cc1OC 2209435 JPGDFOCNMGZRDW-UHFFFAOYSA-N 395.415 2.893 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2csc(Cc3ccccc3)n2)CC[C@@H]1O 2356140941 SEZVDLQNWARBBY-OXJNMPFZSA-N 388.489 2.812 0 50 GFAA CCCCCC(=O)N[C@H](NC(=S)N1CCOCC1)C(Cl)(Cl)Cl 8680628 KNTDLMGIWNBELZ-LLVKDONJSA-N 390.764 2.586 0 50 GFAA COc1ccc(C)cc1N1C[C@H](C(=O)Nc2cccc(NC(C)=O)c2)CC1=O 9342126 RBEFZZJFGNNZPC-OAHLLOKOSA-N 381.432 2.954 0 50 GFAA Cc1ccc(OC[C@H]2CCCN(C(=O)c3ccc(-n4cnnc4)nc3)C2)cc1 55073929 TVDJJTOQBQQSKE-KRWDZBQOSA-N 377.448 2.902 0 50 GFAA COc1cc(CN2CCN(Cc3ccccc3F)C[C@@H]2CCO)cc(OC)c1 23361204 GRRCVVLVZUOKFX-IBGZPJMESA-N 388.483 2.912 0 50 GFAA CNC(=O)C[C@H](C)N(C)C(=O)c1csc2nc(-c3ccccc3OC)cn12 67472779 INJDDTWCHHNUKF-LBPRGKRZSA-N 386.477 2.668 0 50 GFAA COCc1cccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1 25335383 QGMGWBZEPMUNMN-OAHLLOKOSA-N 394.518 2.934 0 50 GFAA OCCOc1ccc(CN2CCN(CC3CCCCC3)[C@H](CCO)C2)cc1 22852994 WAYQOFFVIPWJNQ-OAQYLSRUSA-N 376.541 2.507 0 50 GFAA Cc1cnc(C)c(N2CCC(n3nccc3NC(=O)c3cccnc3)CC2)n1 67756888 UOVLSDSRPSHJHF-UHFFFAOYSA-N 377.452 2.779 0 50 GFAA COc1cc(CN2CCOCC2)ccc1OC[C@H](O)CN1CCCCCCC1 23340465 HFWLSWVAEVWQPE-HXUWFJFHSA-N 392.540 2.533 0 50 GFAA CN(C)c1cnc(-c2noc([C@H]3CCC(=O)N(C)[C@H]3c3ccccc3)n2)cn1 350541858 BKOOHMOXZIBIFM-KSSFIOAISA-N 378.436 2.670 0 50 GFAA Cc1cc(C)c(S(=O)(=O)NCc2ccccc2CN2CCOCC2)c(C)c1 24193317 RBODFLHDDWCICR-UHFFFAOYSA-N 388.533 2.923 0 50 GFAA O=C(Nc1ccc(Sc2ccncc2)cc1)C(=O)N[C@H]1CCc2[nH]ncc2C1 119529463 VFABRZRLAAGMHN-HNNXBMFYSA-N 393.472 2.568 0 50 GFAA Cc1csc(CN2CCN(C)C3(CCN(C(=O)CC(C)(C)C)CC3)C2)n1 67884614 FQPFDVZUZNOWDQ-UHFFFAOYSA-N 378.586 2.996 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)NCCc2ccc3c(c2)OCCO3)[C@@H]1c1ccccc1 171985702 IKDPWPQBEGQURO-GCJKJVERSA-N 394.471 2.726 0 50 GFAA CCN1CCC[C@@H](CN(C)C(=O)CC[C@H]2CC[C@@H](C)O2)[C@@H]1c1cnn(C)c1 328632138 RQCIMJXSOIDBNZ-SHJAMOMRSA-N 376.545 2.999 0 50 GFAA CCOC(=O)[C@H](CNC(=O)CCc1nc(C)no1)C1C2CC3CC(C2)CC1C3 253430401 YUYIWUFLSOAFKS-XQYHGENGSA-N 389.496 2.678 0 50 GFAA CC(C)c1c(C(=O)N[C@H](CN)C2CC2)cnn1-c1ccc(C(F)(F)F)cn1 236875417 GYTGYNGZNAAHLA-CQSZACIVSA-N 381.402 2.877 0 50 GFAA CS(=O)(=O)c1ccccc1C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 363630599 WMSNRMQXNRQKSE-CQSZACIVSA-N 392.908 3.000 0 50 GFAA CC(C)c1ccc(C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)nc1 368667470 RWFLXYGMJGGKMB-IAGOWNOFSA-N 379.460 2.854 0 50 GFAA CCOc1cc2c(cc1NC(=O)N1CCC(n3cnnc3O)CC1)O[C@@H](C)C2 375256938 BSQQULWPXAXOAT-LBPRGKRZSA-N 387.440 2.575 0 50 GFAA O=S(=O)(CCC1Cc2ccccc2C1)N1CCC[C@@](O)(C(F)(F)F)CC1 377835677 VUBDAQULPUNFBM-KRWDZBQOSA-N 391.455 2.901 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(-c2ncccn2)c1 174892944 ZMHCOTRXJCVWQD-QGZVFWFLSA-N 391.479 2.791 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@H](CC(=O)N(C)C(C1CC1)C1CC1)CO2 71747606 LLUZJXLRYWUPDH-QGZVFWFLSA-N 385.508 2.623 0 50 GFAA O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCC([C@@H](O)Cc2ccccc2)CC1 77485731 PSZGEAOAVZSCJN-FQEVSTJZSA-N 376.460 2.928 0 50 GFAA CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)Nc2cc3n(n2)CCCC3)cc1 287001281 MXCNWXSWADBWFQ-UHFFFAOYSA-N 389.481 2.646 0 50 GFAA O=C(NCc1noc2c1CCCC2)N[C@@H]1CCCN(c2ccccc2F)C1=O 287537202 CEPBOPMJFWOVRT-OAHLLOKOSA-N 386.427 2.687 0 50 GFAA O=C(c1cc2ncccn2n1)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)O)C1 426419999 MDUVGZPSJXXEFD-HOIFWPIMSA-N 390.443 2.840 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)N1CCC[C@H](Cn2ccnc2)C1 426502830 CPQBIZMQASBXCD-GOSISDBHSA-N 381.480 2.632 0 50 GFAA O=C(CCn1cnc2ccccc21)NC[C@H]1CN(Cc2ccccc2)CCCO1 192229631 JDYXIHHZNFUUPK-FQEVSTJZSA-N 392.503 2.834 0 50 GFAA O=C(c1cc(-c2ccc(Cl)cc2)[nH]n1)N1CCCO[C@@H](Cn2cccn2)C1 426399384 JMWSLJUTMXJMOI-MRXNPFEDSA-N 385.855 2.858 0 50 GFAA CC(C)NC(=O)CN1CCN(C(=O)NC2c3ccccc3-c3ccccc32)CC1 426711524 XGCDJPYRDIHTPJ-UHFFFAOYSA-N 392.503 2.608 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)N1CCCC[C@H]1CCN1CCOCC1 96151992 WTMIPYCPRNTJHZ-IBGZPJMESA-N 383.496 2.981 0 50 GFAA CCc1cc(N2CCC3(CC2)CC(=O)N(Cc2c(C)noc2C)C3)nc(C)n1 91830617 SRZAJGOUIHKTQS-UHFFFAOYSA-N 383.496 2.971 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(c2nccnc2N2CCCC2)C1 95512610 HSYQQMUAWVBRSF-SFHVURJKSA-N 383.544 2.609 0 50 GFAA Cc1c(CC(=O)N2CCN[C@H](C)C2)c2c(n1Cc1ccccc1)CCCC2=O 95503017 LJNCRBKFPICELB-MRXNPFEDSA-N 379.504 2.727 0 50 GFAA Cc1nsc(C)c1C(=O)N1CCOC[C@H]1c1ncnn1Cc1ccccc1 294654545 LBNSKACYPONHLT-INIZCTEOSA-N 383.477 2.613 0 50 GFAA CN1CCC(NC(=O)[C@@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)CC1 91974392 RLJGRPIQVXNPCU-OAHLLOKOSA-N 397.441 2.654 0 50 GFAA O=C(c1ccncc1)N1CCC(c2nnc(CN3CCCC3)n2C2CC2)CC1 96165397 DKDYYUOUCUIZBL-UHFFFAOYSA-N 380.496 2.624 0 50 GFAA CC(=O)c1cccc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)c1 91625696 ZDHHQYYGVLAMQF-FQEVSTJZSA-N 398.503 2.913 0 50 GFAA CN1C(=O)N=C2[C@@H]1[C@@H](c1ccc3c(c1)OCO3)CC(=O)N2c1ccc(F)cc1 253471125 MDBDCOKNMZIGQV-KDOFPFPSSA-N 381.363 2.907 0 50 GFAA Cc1cccc(-c2noc([C@@H](C)NC(=O)N3CCC(c4nc[nH]n4)CC3)n2)c1 534587749 OXPRXWMDEYJEON-CYBMUJFWSA-N 381.440 2.813 0 50 GFAA Cc1cc(S(=O)(=O)NCCCCCN2CCOCC2)c(Cl)cc1F 670469340 ZZSFYHIQLDQNAN-UHFFFAOYSA-N 378.897 2.568 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCCc3c(O)cccc32)cc(C)c1C 190262391 MHHUWSMQCQAQAQ-KRWDZBQOSA-N 388.489 2.725 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N1CCCN(Cc2cccs2)CC1 1506403059 QHRPATRUUHZLLP-UHFFFAOYSA-N 385.533 2.677 0 50 GFAA Cc1noc([C@@H]2CCCN2S(=O)(=O)c2ccc(-c3onc(C)c3C)o2)n1 1506419800 JWIUGQCAWVSUPE-LBPRGKRZSA-N 378.410 2.769 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2ccc(-c3cc[nH]n3)o2)cc1OC 1529153354 ARZOONYCTVRPRO-NHCUHLMSSA-N 399.447 2.621 0 50 GFAA Cn1ccn2ncc(C(=O)N3CCC4(CC3)OCCc3c4[nH]c4ccccc34)c12 1704297980 BFFWEIRPDJPOAP-UHFFFAOYSA-N 389.459 2.858 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)cc1 11668036 LWICITLKLWSOSI-UHFFFAOYSA-N 381.480 2.775 0 50 GFAA O=C(CCC1CCN(C(=O)c2ccc3cccc(F)c3n2)CC1)N1CCOCC1 11717178 IKCGLXPVYFTQMX-UHFFFAOYSA-N 399.466 2.865 0 50 GFAA CC(C)=CCC[C@H](C)CN1CCc2nnc(CNC(=O)c3ccncc3)n2CC1 11872522 UFPGFICHHDUOHV-SFHVURJKSA-N 396.539 2.844 0 50 GFAA O=C(c1nc2sccn2c1CN1CCC[C@H](O)C1)N1CCCCCCC1 11936771 NYWGMJOADUFRRD-HNNXBMFYSA-N 376.526 2.759 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccoc4)C3)C2=O)c1OC 12613079 UBHRMJMJHSISLT-QFIPXVFZSA-N 398.459 2.952 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)[C@@H]1CCCN(CCCn2cccn2)C1 12836922 LLYAJYOMNAKFFI-GOSISDBHSA-N 378.480 2.810 0 50 GFAA CN1C(=O)N(CCCc2ccncc2)C(=O)C12CCN(Cc1ccoc1)CC2 14536961 WAWDOSPTQSSIPK-UHFFFAOYSA-N 382.464 2.536 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)CSC)C2)c(OC)c1 14954903 ODKQBWYIQVKREE-OAHLLOKOSA-N 394.537 2.702 0 50 GFAA Cc1ccccc1N1C[C@H](C(=O)N2CCN(c3ccccc3F)CC2)CC1=O 16576789 AIKUWYNHAALADF-QGZVFWFLSA-N 381.451 2.836 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4ccc(F)c(Cl)c4)CC3)nn2)n1 169777295 MABMLKCTGWWGNC-UHFFFAOYSA-N 390.806 2.906 0 50 GFAA Cn1c([C@H]2CCCN2C(=O)Cc2n[nH]c(=O)c3ccccc23)nc2ccccc21 206234814 QWHUOVAJZTXOQT-LJQANCHMSA-N 387.443 2.716 0 50 GFAA CCc1nccn1CCC(=O)N1CCC2(CC1)C[C@H](O)C[C@H](C(C)(C)C)O2 1857711295 RPYHPDMCCQFMOG-IAGOWNOFSA-N 377.529 2.783 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NC[C@H]1COc2ccccc2O1 1857709738 OMJDLUDLGURAJJ-LBPRGKRZSA-N 382.445 2.732 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCc3cc(Cl)no3)C1)CC2 1857713682 COCFLBHFXPNDHJ-GOSISDBHSA-N 376.844 2.571 0 50 GFAA Cc1ccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c(O)n1 1857716695 PEHJEMHTTNMCPH-XYJFISCASA-N 387.867 2.693 0 50 GFAA O=C(NCCN1CCCC1)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857726929 FRYDFUHAMZEXOQ-UHFFFAOYSA-N 376.888 2.910 0 50 GFAA CCOc1cc(-c2nccn2CCc2cnn(C)c2)ccc1OCCN(C)C 1875248003 TVFUACOHZIQKOC-UHFFFAOYSA-N 383.496 2.865 0 50 GFAA COc1ccc(S(=O)(=O)N2C[C@H](c3ccsc3)[C@@H](CO)C2)c(C)c1F 249422938 DVFCDUNCYMRWGB-ZIAGYGMSSA-N 385.482 2.601 0 50 GFAA Cc1ccc([C@H](C)[C@@H](O)C(=O)N[C@H](C(=O)N2CCCC2)c2ccccc2)cc1 1875254755 IGIYYKDXBKYOQX-DZFGPLHGSA-N 380.488 2.939 0 50 GFAA CNC(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)c1c(C)oc3ccc(OC)cc13)C2 1875394542 MHHOJSTUWXCETK-KHIZAZIESA-N 395.415 2.726 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cnc(-c2ccccc2)o1 1875402731 LPFKIZBFCSBVTA-DAXOMENPSA-N 386.839 2.761 0 50 GFAA CN1CCc2[nH]c3ccc(C(=O)NCc4nnc5c(Cl)cccn45)cc3c2C1 2325760661 FONVWIKQOZINNZ-UHFFFAOYSA-N 394.866 2.782 0 50 GFAA Cc1cscc1C(=O)N=[S@](C)(=O)c1cnn2c1CN(C(=O)C(C)C)CC2 2325784972 XATDDWPUWJNVIA-AREMUKBSSA-N 394.522 2.548 0 50 GFAA CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 1074658 ZHFJTBDJYFVVNM-GOSISDBHSA-N 387.505 2.702 0 50 GFAA COc1ccc(C(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)cc1 1156689 NZZPMXHWQIBELL-UHFFFAOYSA-N 382.416 2.915 0 50 GFAA CC[C@@H]1SC2=NC(C)=C(C(=O)OC)[C@H](c3ccc(OC)c(OC)c3)N2C1=O 2251775 FOSGWPWSCKRQPY-HOCLYGCPSA-N 390.461 2.916 0 50 GFAA CC(C)(CSc1nnnn1-c1ccccc1)NS(=O)(=O)c1ccccc1 2708595 BITHGMIXMIJJNJ-UHFFFAOYSA-N 389.506 2.512 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 2806929 DGIGUTGSEGPOJH-SECBINFHSA-N 384.807 2.969 0 50 GFAA O=C(COc1ccccc1)c1cn(CC(=O)N2CCOCC2)c2ccccc12 2866454 HKIGYDHBNMQMAM-UHFFFAOYSA-N 378.428 2.762 0 50 GFAA Cc1nc2ccnn2c(N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1C 2356157531 JYCGKKPMNITEHN-OAQYLSRUSA-N 377.448 2.600 0 50 GFAA CCc1ccccc1N1C[C@H](C(=O)N2CCN(c3ccccc3)CC2)CC1=O 7609220 OJTZJDMQERFRMD-LJQANCHMSA-N 377.488 2.951 0 50 GFAA CCCS(=O)(=O)Nc1cccc(C(=O)N2CCCC3(CCOCC3)C2)c1 225418497 NSXYDIMTRTZNTD-UHFFFAOYSA-N 380.510 2.871 0 50 GFAA CC[C@@H](C(=O)Nc1cccc(NS(C)(=O)=O)c1)N(C)Cc1ccccc1 225799575 RSMKTDQTOGFYNZ-SFHVURJKSA-N 375.494 2.907 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3cccc(Cl)c3)CC2)cc(-n2cccn2)n1 65363079 JRINJJNXIMRJDD-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA O=C(NCc1cccnc1Oc1ccccc1)c1cnc2sccn2c1=O 67688859 QCCNZRHCGYYKIP-UHFFFAOYSA-N 378.413 2.873 0 50 GFAA C[C@@H](C(N)=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 67850239 PDMXHOFGGMBVDL-LBPRGKRZSA-N 390.875 2.691 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](N(C)Cc1c[nH]nc1-c1ccccc1)C2 67880987 UAADCOHBWUQPSF-INIZCTEOSA-N 379.464 2.981 0 50 GFAA Cc1csc(NC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)n1 280981114 DACHZGKTTBVKME-SWLSCSKDSA-N 390.513 2.695 0 50 GFAA COc1ccc(CCNS(=O)(=O)C[C@@]23CC[C@@H](CC2=O)C3(C)C)cc1OC 894897 HYTNQNTURSDSAB-YWZLYKJASA-N 395.521 2.561 0 50 GFAA CCn1cc(C(=O)NC(=S)Nc2sc3c(c2C(=O)OC)CCCC3)cn1 2776433 VNALSMQDMHLXJU-UHFFFAOYSA-N 392.506 2.757 0 50 GFAA Cn1ncc(Br)c1C(=O)Nc1sc2c(c1C(N)=O)CCCCC2 2778935 HMCZRQADRZSVJZ-UHFFFAOYSA-N 397.298 2.864 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)c3ccc(CN4CCOCC4)cc3)n2)cc1 72436862 VOHLINDQDGXRBO-UHFFFAOYSA-N 392.459 2.807 0 50 GFAA COCc1c(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)sc2cccc(F)c12 360025456 YRYTYDAOWLUITL-GFCCVEGCSA-N 391.468 2.817 0 50 GFAA CS(=O)(=O)c1cnc(COc2ccc(Cl)cc2)nc1[C@H]1CCCNC1 71440111 UFMKQVOCJAXJDF-LBPRGKRZSA-N 381.885 2.580 0 50 GFAA O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@@H](N2CCCC2)C1 363099257 FOUUFXLIMINOEW-DAQLFPLESA-N 399.579 2.891 0 50 GFAA Cc1cc(C)n(-c2ccccc2CN2CCn3nc(CCC(=O)O)cc3C2)n1 72157847 CXLMROPEPFTEBL-UHFFFAOYSA-N 379.464 2.719 0 50 GFAA COc1ccc(Cn2cc(NC(=O)[C@H]3CCCN3Cc3ccccn3)cn2)cc1 367512547 DNPZPXDQCVIVBD-OAQYLSRUSA-N 391.475 2.938 0 50 GFAA O=C(c1ncoc1C1CC1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 72163452 LUHDYESRFQTXSG-DFQSSKMNSA-N 379.460 2.960 0 50 GFAA Cc1ncsc1CCC(=O)N1CCOC[C@@H]1CC(=O)Nc1cccc(F)c1 72470489 IZADEYCPAUIFQR-INIZCTEOSA-N 391.468 2.779 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)c1ccccc1COC1CCOCC1 378168756 MUNIPXHBQPZSMZ-UHFFFAOYSA-N 392.459 2.893 0 50 GFAA Cc1cccc(N2C[C@@H](Nc3nccc(-c4cc(C(=O)O)ccn4)n3)CC2=O)c1 72412155 JTVJJUCOFXULAM-HNNXBMFYSA-N 389.415 2.763 0 50 GFAA Cc1ccc(N2CC[C@H](NS(=O)(=O)c3cccc4cnccc34)C2=O)cc1 173392530 KOUSXJBMLBZNJS-SFHVURJKSA-N 381.457 2.627 0 50 GFAA CCOC(=O)N1[C@H](C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)CC[C@H]1c1ccc(C)o1 242339233 ZGCILIIUXPJJDC-OWSLCNJRSA-N 389.496 2.945 0 50 GFAA COc1ccc([C@H](NC(=O)c2cccc(-n3cccn3)c2)C2CC(O)C2)cn1 223556792 QKRUYDROAPBNJB-NLPFYKDJSA-N 378.432 2.518 0 50 GFAA O=C([C@H](O)c1ccc(C(F)(F)F)cc1)N1CCN(c2ccccc2)C(=O)C1 82156393 PIVPBKVWCWTHDB-QGZVFWFLSA-N 378.350 2.614 0 50 GFAA O=C(c1ccsc1)N1CCCN(C(=O)c2ccccc2N2CCOCC2)CC1 195484241 LTPBECRPRRFRGA-UHFFFAOYSA-N 399.516 2.573 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95525667 MNOAAIHIXYPWOG-LJQANCHMSA-N 376.460 2.981 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)OCc1ccccc1Cl 239432996 XBUIVWSKYHUACM-AQPSJQEXSA-N 385.847 2.826 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)N(Cc1ccncc1)C[C@@H]1CCCO1 95497488 TUUXFDPRAXFRNF-IBGZPJMESA-N 378.436 2.875 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)c1 92020147 PWQSRQOPTCAENO-HXUWFJFHSA-N 384.520 2.948 0 50 GFAA CCc1cc(N2CCC(NC[C@H](O)c3cccc(F)c3)CC2)nc(N(C)C)n1 95527772 MNNZJQBRXPNLFP-IBGZPJMESA-N 387.503 2.536 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CC[C@H](Cc2ccc(CO)cc2)C1 91876840 RNAQZFOKKVYNQP-HXUWFJFHSA-N 390.483 2.893 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(C(=O)CCc3n[nH]c(C)c3C)CC2)cc1 97819599 KAKXTEGLQWUYLF-UHFFFAOYSA-N 382.508 2.823 0 50 GFAA Cc1cc(NC(=O)NC[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)n(C)n1 96162890 OUJSXQCPOZQLHD-KRWDZBQOSA-N 385.468 2.899 0 50 GFAA Nc1cc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95356781 VCFCRYKQCPAOQW-CWFSZBLJSA-N 384.430 2.644 0 50 GFAA Cn1cnc(-c2ccc(C(=O)NC[C@H]3CCN(CCc4ccccc4)C3)cc2)n1 183649830 ZIXLGNOIIUOJEM-LJQANCHMSA-N 389.503 2.777 0 50 GFAA CC(C)C(=O)Nc1ccc(C(=O)CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 263586253 RSJUOIJTEDHLSK-FUHWJXTLSA-N 393.487 2.745 0 50 GFAA biogenic COc1ccc(CN2CCC(n3cc(C(=O)N4CCCC4)nn3)CC2)cc1C 299792089 FKECIEWLQMPNEV-UHFFFAOYSA-N 383.496 2.668 0 50 GFAA COc1cccc(SCC(=O)NCC2(N3CCN(C)CC3)CCCCC2)c1 824787783 LIIPYHDIJBMWLO-UHFFFAOYSA-N 391.581 2.854 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(Oc3ccc(F)cc3)CC2)CN1Cc1ccncc1 826588608 HRUNGOWPNZZXBJ-KRWDZBQOSA-N 397.450 2.639 0 50 GFAA COc1cc2c(cc1CN(Cc1ccncc1)C[C@@H]1CCC(=O)N1)OCCCO2 952868010 WCAVKNWJDFEUMS-SFHVURJKSA-N 397.475 2.532 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCn3cccc3[C@@H]2c2cccnc2)c1C 952873204 XCMSPXSMACVGMK-NRFANRHFSA-N 377.448 2.531 0 50 GFAA CCCCCS(=O)(=O)CC(=O)Nc1cc2ccc(Br)cn2n1 170614342 HVBPBDUQEKOUTE-UHFFFAOYSA-N 388.287 2.640 0 50 GFAA Cc1c(NC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)nnn1Cc1ccccc1F 192377186 CJUPCEIYYGZCRW-OAHLLOKOSA-N 397.385 2.978 0 50 GFAA Cc1nn(C)c(C)c1[C@H](C)N(C)S(=O)(=O)c1ccc2oc(=O)ccc2c1 1506418641 DVDIGVDFVNMOIB-ZDUSSCGKSA-N 375.450 2.525 0 50 GFAA Cc1cccc(CN(Cc2cnc3c(C(=O)O)cnn3c2)C[C@@H]2CCCO2)c1 1506399465 GJYDUVVAJGVJNB-SFHVURJKSA-N 380.448 2.917 0 50 GFAA CCCCn1nc(C)cc1NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O 1529119396 GRLUMDCZDNMCNE-OAHLLOKOSA-N 378.498 2.785 0 50 GFAA O=C(N[C@H]1COC[C@H]1Cc1ccncc1)c1ccc(-c2noc(C3CC3)n2)cc1 1615964409 GPJOQRBTDGDBPJ-MOPGFXCFSA-N 390.443 2.997 0 50 GFAA Cc1ccccc1-c1noc(CCC(=O)N[C@H]2COC[C@H]2Cc2ccncc2)n1 1704279494 SUIXDHGHZRUNMI-MJGOQNOKSA-N 392.459 2.747 0 50 GFAA O=C([C@@H]1CCc2sc(-c3ccncc3)nc2C1)N1CCC(n2cnnc2)CC1 1772816056 FRXOEYHQONNMGW-OAHLLOKOSA-N 394.504 2.765 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N(C)[C@H]1CCS(=O)(=O)C1 5724377 OKEQFUMTESNXDI-JTQLQIEISA-N 386.832 2.702 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN([C@H](C)COC)CC2)c(Cl)c1 12028060 JRLCXYZNRKTLQU-CQSZACIVSA-N 384.904 2.594 0 50 GFAA CN(C[C@@H](O)COc1cccc(CNCC2(C)COC2)c1)C1CCCCC1 12208947 DYYPRVYUOVCNRJ-HXUWFJFHSA-N 376.541 2.817 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)cc1 12756849 FRBYHVTXZFDCOA-UHFFFAOYSA-N 380.448 2.912 0 50 GFAA Cc1ccc(C(=O)N2CCCC[C@@H]2CCn2cc(C(=O)NC3CC3)nn2)cc1 14997346 QQTRMIYIOVNAKN-GOSISDBHSA-N 381.480 2.564 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc4nonc4c3)C[C@@H]2CCO)cc1C 19225294 RMEGKWZPDHWEEL-IBGZPJMESA-N 396.491 2.609 0 50 GFAA CSCC[C@@H](NC(=O)c1cc(-c2cccnc2)n[nH]1)c1nnc2ccccn12 206256362 YHCQNFZAXWZCEF-CQSZACIVSA-N 393.476 2.739 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc(C(F)(F)F)nc1 206257158 GSIHGFYHTUHSOR-CYBMUJFWSA-N 392.337 2.570 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(CC(C)(C)CN1CCOCC1)CC2 1857668260 WYTUEGJRRZWFDT-UHFFFAOYSA-N 382.552 2.846 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3ccc(OC)c(OC)c3OC)CC2)O1 1857697678 ICUWIIYATHUHHD-CABCVRRESA-N 393.480 2.637 0 50 GFAA Cc1noc2nc3c(c(C(=O)N4CCc5[nH]nc(C6CC6)c5CC4)c12)CCC3 1857706609 WMMABBFMBWDEOT-UHFFFAOYSA-N 377.448 2.861 0 50 GFAA CC[C@@]1(C(=O)NCCc2ccnn2C)C[C@@H]2CC[C@H]1N2C(=O)c1cccs1 1857709554 FKYZZAULFQAJSS-XAUMDUMWSA-N 386.521 2.614 0 50 GFAA Cc1ccc([C@@H](NC(=O)c2cn3c(n2)CCNCC3)c2cccnc2)cc1C 1857718696 ORJZZEHHXPIRII-OAQYLSRUSA-N 375.476 2.560 0 50 GFAA CC(C)Oc1ccc(NC(=O)c2cncc(Br)c2)cc1C(N)=O 253429473 HFZMQUHSYZUHML-UHFFFAOYSA-N 378.226 2.983 0 50 GFAA CC(=O)N1CCC(CNC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1 264313061 MGUFXEGTBMRDAB-NRFANRHFSA-N 386.540 2.599 0 50 GFAA COC(=O)c1nc2cc(NC(=O)[C@H]3CCN(c4ccccc4F)C3)ccc2[nH]1 1875311411 YHJNPHHWCQUVKV-LBPRGKRZSA-N 382.395 2.954 0 50 GFAA Cc1nc(N2CCNCC2)sc1C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 2325768406 SEFHRNDQAVNSAF-AWEZNQCLSA-N 396.520 2.538 0 50 GFAA COc1cccc2c(C(=O)N3CCC4(CC3)C[C@H]4NC(=O)C3=CCCC3)cnn12 2325794102 QHJJCZQYDYZDAF-GOSISDBHSA-N 394.475 2.564 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(C)cc2C)S(C)(=O)=O)cc1OC 786407 QKTKXFGKLNAFNT-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1CCN(C(=O)c2ccc(F)cc2)CC1 893099 DGXZKICLSVWNNJ-UHFFFAOYSA-N 376.815 2.843 0 50 GFAA CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cc(OC)ccc1Br 997853 FGNOISQTHYASFS-CYBMUJFWSA-N 385.283 2.814 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@H]2CC(=O)N(c3nccs3)C2)CC1 2356134253 GLTMROMPDPAOSW-HNNXBMFYSA-N 385.489 2.660 0 50 GFAA CSc1ccccc1NC(=O)CN(c1ccc2c(c1)OCO2)S(C)(=O)=O 2873694 KZSIFHVYCUMNTB-UHFFFAOYSA-N 394.474 2.542 0 50 GFAA COc1ccc(-c2onc(N3CCC(C(=O)N4CCCC4)CC3)c2C(=O)O)cc1 2356143588 OGIZKQMTRSXKHH-UHFFFAOYSA-N 399.447 2.887 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)Cn2c(C)cc(=O)c3ccccc32)C1=O 2356148137 IXEOGEIAFBOEOK-HSZRJFAPSA-N 395.503 2.704 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)c2c(C)n(C)c3ccc(OC)cc23)C[C@@H]1O 2356157348 GRHBZRYBWFTBQZ-UWJYYQICSA-N 388.464 2.573 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2cc(C)nc3c2c(C)nn3C)C1=O 2356167407 YOBSWNHQVMZDKS-OAQYLSRUSA-N 383.496 2.592 0 50 GFAA O=C(NCc1ccc2c(c1)CCO2)c1cc2c(s1)C1(CCNCC1)OCC2 2356169055 JZVHVVLSZAIRLW-UHFFFAOYSA-N 384.501 2.764 0 50 GFAA COc1ccc(Cl)cc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)cc1 4810755 UNIZTTJWHNHZGI-SNVBAGLBSA-N 386.832 2.793 0 50 GFAA CC1(C)[C@]2(C(=O)Nc3c4c(nc5c6c(nn35)CCC6)CCC4)CC[C@@]1(C)OC2=O 55099442 CPAKHFIOUXVXSY-YADHBBJMSA-N 394.475 2.767 0 50 GFAA O=C1Nc2cc(F)ccc2[C@@H]1CC(=O)N1CCc2nc[nH]c2[C@H]1c1ccncc1 102334575 KQVRREZSIMJBBS-MGPUTAFESA-N 391.406 2.544 0 50 GFAA CC(=O)Nc1cccc([C@H](C)NC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)c1 229691021 MPSYTASYTIIHBS-KSVNGYGVSA-N 375.513 2.956 0 50 GFAA Cc1c([C@H]2CC(=O)Nc3cc4c(cc32)OCO4)c(=O)n(-c2ccccc2)n1C 65435375 XYZBMJVUAVYLSV-HNNXBMFYSA-N 377.400 2.687 0 50 GFAA COCCN(C[C@H]1CCCN2CCCC[C@H]12)C(=O)c1cc(CC(C)C)[nH]n1 409414171 OFLAYJUMVBZROV-YLJYHZDGSA-N 376.545 2.961 0 50 GFAA O=S(=O)(Nc1ncn(Cc2ccccc2)n1)c1ccc(Br)s1 2803784 KMCKNEIIZDVTQN-UHFFFAOYSA-N 399.295 2.951 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2c[nH]nc2C(C)(C)C)CC1 328636180 NXFVTLMYJMKBDO-IBGZPJMESA-N 384.528 2.900 0 50 GFAA O=C1NCCN1c1ccc(F)c(NS(=O)(=O)c2ccc(F)cc2Cl)c1 253429590 DDCQBGGUHBJLBU-UHFFFAOYSA-N 387.795 2.949 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCc2ncc[nH]2)(Cc2ccccc2)c2ccccc21 71614510 MGEVIHBQJBEQKB-QHCPKHFHSA-N 388.471 2.616 0 50 GFAA Cc1cccn2cc(COc3ccc(CN(C)[C@@H]4CCS(=O)(=O)C4)cc3)nc12 157635908 HVJALELSZGDRKY-LJQANCHMSA-N 399.516 2.841 0 50 GFAA COCc1nn2c(ncc3c(=O)n([C@H](C)C(=O)O)ccc32)c1-c1ccc(F)cc1 40397138 ALHOVPJGLQAKND-LLVKDONJSA-N 396.378 2.642 0 50 GFAA CN(C)C(=O)C1(CNC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CCCC1 177365143 TUIQZFJHENWXGL-UHFFFAOYSA-N 382.464 2.992 0 50 GFAA Cc1ccn(-c2ccccc2NC(=O)NCc2ccnc(N3CCOCC3)c2)n1 177695504 NVHVVQFDRHEFLR-UHFFFAOYSA-N 392.463 2.734 0 50 GFAA NC(=O)c1cccnc1-c1ccc(C(=O)N2CCCC3(CCOCC3)C2)cc1 426547543 DWEJCYHEQHEWLL-UHFFFAOYSA-N 379.460 2.880 0 50 GFAA CCN(CC)CCCN[C@@H](CC(=O)c1ccc(Br)cc1)C(=O)O 20432486 MIIVPDZZUGXBEQ-HNNXBMFYSA-N 385.302 2.797 0 50 GFAA Cc1cc(CN(C)C(=O)c2cnc(C34CC5CC(CC(C5)C3)C4)[nH]c2=O)on1 91656738 QKGMQALDJSKENN-UHFFFAOYSA-N 382.464 2.806 0 50 GFAA Cn1c(=O)c(C(=O)N2CCC[C@@H](c3cccc(C(=O)O)c3)C2)nc2ccccc21 95365380 KARHQVOOOJXIDO-MRXNPFEDSA-N 391.427 2.652 0 50 GFAA CSCC(=O)N1CCC2(CCN(Cc3cccc(F)c3)CC2)[C@@H](CO)C1 97660673 JJRXJLSVJDOGIR-QGZVFWFLSA-N 380.529 2.612 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2ccc(CN3CCC(C)CC3)o2)on1 96162331 KAVFYTBMOAEXMJ-APWZRJJASA-N 387.480 2.795 0 50 GFAA Cc1ncsc1C(=O)N1CCC2(CC1)CC(=O)N(Cc1c(C)noc1C)C2 91943136 QHKDRDZGDIITEF-UHFFFAOYSA-N 388.493 2.711 0 50 GFAA Cc1cccc(C(=O)N2CCN(c3nccn4nc5c(c34)CCCC5)CC2)c1 263617403 NQEOSMULIWOTPE-UHFFFAOYSA-N 375.476 2.879 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2CC[C@@H]3OCc4cnnn4[C@@H]3C2)c1 1076054855 IHKYJAUJVBYHLY-CTNGQTDRSA-N 390.443 2.940 0 50 GFAA CCN(CCN1CCCCCC1)C(=O)NC[C@H]1CC(=O)N(c2ccccc2)C1 584899058 NLOYLXBPJGGXIG-LJQANCHMSA-N 386.540 2.947 0 50 GFAA O=C(NC[C@@H]1CCN(Cc2ccccc2F)C1)N1CCC(Cn2ccnc2)CC1 584902994 UPXNWHIDTZWDJS-IBGZPJMESA-N 399.514 2.966 0 50 GFAA Cc1c(C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)cnn1-c1ccccn1 952967498 JVUWQRSQOHTXIE-UHFFFAOYSA-N 375.432 2.649 0 50 GFAA COc1ccccc1NC(=O)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 36708267 NXTDHQBIXSOLIC-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CCc1ncc(C(=O)N2CCc3ccc(NC(=O)c4ccccn4)cc3C2)cn1 95498122 PGGRLTZWIYWRSI-UHFFFAOYSA-N 387.443 2.885 0 50 GFAA C[C@H](O)CSc1nnc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1 193048466 CWKUPEUZKCSTGR-ZDUSSCGKSA-N 394.456 2.968 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1 194746807 DPUSEHMNZVVRCL-LJQANCHMSA-N 399.535 2.835 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N[C@H]1COC[C@@H]1Cc1ccncc1 1615963513 NDMHUWHUXFPTAR-HKUYNNGSSA-N 376.460 2.683 0 50 GFAA Nc1ncc(/C=C/C(=O)N2CCC(CCC(=O)Nc3ccccc3)CC2)cn1 1506400727 OQWYIOJXVYQWJJ-VQHVLOKHSA-N 379.464 2.730 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N[C@H](C)C(C)(C)O 1704327434 FHTPVKSUCYRYID-LLVKDONJSA-N 381.860 2.943 0 50 GFAA O=C(CN1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1)NCC1CCCCC1 1704301438 ZOSOUUTULNTJFS-KNQAVFIVSA-N 381.520 2.767 0 50 GFAA CC[C@@H](C)C(=O)Nc1cccc(C(=O)N(CCN(C)C)Cc2cnc(C)[nH]2)c1 1704311097 YAQJTGJTOQVZGZ-OAHLLOKOSA-N 385.512 2.907 0 50 GFAA CN(C)c1nc(Oc2ccc(OCc3ccccc3)nn2)nc(N2CCCC2)n1 5016902 YQQVGLYKEWBFKK-UHFFFAOYSA-N 393.451 2.699 0 50 GFAA O=C(Nc1ccccc1F)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1 12003524 MUMZODDPMJSRFH-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA CCOc1ccc(NC(=O)c2cccc(N3C(=O)[C@H](C)CS3(=O)=O)c2)cc1 12003958 PSJQERKZMKERJD-CYBMUJFWSA-N 388.445 2.650 0 50 GFAA Cc1nnc(CNC(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)o1 12054225 QPEAKIFLKSZRAZ-UHFFFAOYSA-N 382.298 2.894 0 50 GFAA O=C(NCc1cnn(-c2ccccc2)n1)[C@@H]1CC(Cc2cccc(Cl)c2)=NO1 12455523 JSSPMXWYJAVVET-IBGZPJMESA-N 395.850 2.925 0 50 GFAA CC(C)CN1C[C@H](OCc2cccc(F)c2)CN(C(=O)c2ccoc2)CC1=O 14533141 WWABTXLVRAHIEU-IBGZPJMESA-N 388.439 2.945 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3C)cc2CN(C)C[C@@H](O)CO)cc1F 14961641 UCRHJBXKMUFLGP-GOSISDBHSA-N 399.466 2.780 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@]3(CCCN(Cc4ccccc4F)C3)C2)c(=O)[nH]1 14965399 DGCHIQBPSQZNPF-JOCHJYFZSA-N 383.467 2.951 0 50 GFAA O=C(NCCCN1CCOCC1)c1cc2cc(Cl)cc(Cl)c2oc1=O 19292488 FCFRWVPVEAPTLS-UHFFFAOYSA-N 385.247 2.552 0 50 GFAA CN(C)C(=O)c1ccc([C@@H]2CCCN2C(=O)Cn2nc3ccccc3n2)s1 19835818 HASSTRZVNGQJFN-HNNXBMFYSA-N 383.477 2.558 0 50 GFAA O=C(CN1C(=O)C(c2ccccc2)=NC12CCCCCC2)NC[C@H]1CCCO1 169765619 NULDDIVENXLEMM-GOSISDBHSA-N 383.492 2.664 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(-c4noc(-c5cccnc5)n4)c3CO2)cc1 169769026 VUMBQEGLEJKKSB-INIZCTEOSA-N 376.376 2.670 0 50 GFAA O=C(CCC(F)(F)F)N1CCC[C@]2(C1)CN(c1nccs1)CC[C@H]2O 1857690945 WCWHBNCJZKCJFT-DOMZBBRYSA-N 377.432 2.665 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1cccc2c1NCCC2 1857738278 ZTSOIBNKYRFPHD-SVFBPWRDSA-N 377.488 2.989 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N(CCC(=O)O)C[C@@H]1CCCO1 237662167 VYKCSEMREUBBPK-ZDUSSCGKSA-N 378.450 2.736 0 50 GFAA COc1ccc2cc(CNC(=O)c3cn(C)nc3-c3cnn(C)c3)ccc2c1 363992421 AKYOILQTACTJNT-UHFFFAOYSA-N 375.432 2.912 0 50 GFAA CCN(Cc1cc(Cl)cc(Cl)c1OCCN1CCOCC1)C[C@@H](C)O 1875268733 ULUUKLABKVCEJJ-CQSZACIVSA-N 391.339 2.907 0 50 GFAA O=C(N[C@@H](CNC(=O)C1SCCCS1)C1CCCC1)c1ccncc1F 1875347416 OMBSVRGGINJBSO-HNNXBMFYSA-N 397.541 2.822 0 50 GFAA O=C(NC[C@H](O)c1ccc(O)cc1)[C@@H]1[C@@H]2Cc3c(Br)cccc3[C@H]21 1875322968 QAJVJXMNHTZGRO-BZZMCLGOSA-N 388.261 2.890 0 50 GFAA Cn1cc(CNC(=O)N2CC[C@@H](C3CC3)[C@H]2c2nc(O)n[nH]2)c2ccccc21 1875402221 CIRKKDUYYSQKRY-RDJZCZTQSA-N 380.452 2.685 0 50 GFAA CCOC(=O)C1=C(CP(=O)(OCC)OCC)NC(=O)N[C@H]1c1ccco1 1776004199 MREPVSPUQDXHGT-AWEZNQCLSA-N 386.341 2.717 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSc1nnnn1-c1ccc(C)cc1C 1113388 YRPXOLGFWXYTOU-UHFFFAOYSA-N 397.460 2.797 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4144303 AGBRNNFXUULIMS-CKEIUWERSA-N 382.313 2.930 0 50 GFAA Cn1c(=O)n(C)c2cc(N3CCCCC3)c(N[C@H]3[C@H]4OC[C@H]5C[C@@H]3C[C@@H]54)cc21 2325763217 QAGIBPXJFPAMMH-UGGHSASASA-N 382.508 2.703 0 50 GFAA COc1ccccc1CC(=O)N1CCCN(c2cc(C(F)(F)F)ncn2)CC1 2325780564 VJVGBVRDOVYFBU-UHFFFAOYSA-N 394.397 2.785 0 50 GFAA C[C@H](CC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2ncn(C)c12)c1ccco1 2325793462 VOLJQQWZSVQZQZ-PMPSAXMXSA-N 392.459 2.785 0 50 GFAA Cn1c(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)nc2ccccc2c1=O 126709624 OBSYZFKTHJKIOL-MRXNPFEDSA-N 392.507 2.631 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)c2cc(Cn3c(C)nc4ccccc43)on2)C1 11937079 APNJZDMOWDRONV-MRXNPFEDSA-N 381.480 2.937 0 50 GFAA O=C(c1ccco1)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 1049149 IYQSZHOANMXVLR-UHFFFAOYSA-N 389.260 2.733 0 50 GFAA COC[C@@H](NC(=O)c1ccc(-c2cc(OC)c(C)[nH]c2=N)cc1)c1ccccn1 2356150128 MZOZYJBOYNVZMJ-LJQANCHMSA-N 392.459 2.991 0 50 GFAA CCC[C@H]1[C@H]2C[C@H](CN(CC(=O)Nc3ccc(C(N)=O)cc3)C2)[C@@H]2CCCCN12 2356159636 KQLNCSVYMXYENJ-YHELAOLJSA-N 398.551 2.699 0 50 GFAA O=C(NCc1ccncc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 6271460 BKCLITLHIWSXSA-UHFFFAOYSA-N 393.896 2.840 0 50 GFAA C[C@@H](C(=O)N1CCC[C@@H](c2nncn2C)C1)N1CCC(Cc2ccccc2)CC1 110627562 ZBAUGVKVBCALNK-GHTZIAJQSA-N 395.551 2.864 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1Cc1ccc(I)cc1)[C@H]1C=C[C@H]2CC1 100411358 OEDCLHKPZZFZSE-JURCDPSOSA-N 393.224 2.988 0 50 GFAA CC(C)[C@@H](N)C(=O)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67741688 FBXMBCHXASIPSG-QGZVFWFLSA-N 375.856 2.812 0 50 GFAA O=S(=O)(N(c1ccccc1Cl)S(=O)(=O)C(F)(F)F)C(F)(F)F 67800035 TZEWDHLZCRUOOP-UHFFFAOYSA-N 391.698 2.846 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3csc(C(C)=O)c3)C2)CC1 20209484 DYRFTDKXQKFLSB-KRWDZBQOSA-N 379.526 2.689 0 50 GFAA CCc1nccn1[C@@H]1CCCN(CC(=O)Nc2nnc(C(C)(C)C)s2)C1 137202254 PXUFWEKVAXFMDB-CYBMUJFWSA-N 376.530 2.870 0 50 GFAA COc1cccc(CC2(CO)CCN(C(=O)c3cnn4ccccc34)CC2)c1 67955029 PLOWYSYNGHAGMU-UHFFFAOYSA-N 379.460 2.800 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN([C@H](C(=N)O)c2ccccc2)CC1 328632911 LOYKXKXXMKEUQS-PMACEKPBSA-N 381.480 2.956 0 50 GFAA CCNC(=O)C[C@@H]1CCCCN1C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 253423133 ODKFIINBTSSEHM-KRWDZBQOSA-N 398.507 2.966 0 50 GFAA O=S(=O)(C[C@@H]1CCCC1(F)F)N1CCCC[C@@H]1c1nnc2n1CCCC2 333479980 XSOZVXUXWDWIRG-UONOGXRCSA-N 388.484 2.907 0 50 GFAA CN[C@H](C)CNC(=O)c1ccc(C)c(S(=O)(=O)Nc2cccc(Cl)c2)c1 261794288 RCXOZBJAQSNFJB-CYBMUJFWSA-N 395.912 2.787 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3[C@@H](C)CC[C@H]3C)[C@H]4C2=O)cc1C 77519704 GRFRXBMIOQVCBE-BWPAGOFOSA-N 394.515 2.985 0 50 GFAA O=S(=O)(N[C@@H]1CCOC[C@H]1OCC1CC1)c1ccccc1C(F)(F)F 223126180 MFXXCNWDTZICSS-ZIAGYGMSSA-N 379.400 2.568 0 50 GFAA CC(=O)N(Cc1ccccc1)c1nc(C)c(C(=O)NCCc2c[nH]cn2)s1 44893721 SUNXCJDNEHNWMU-UHFFFAOYSA-N 383.477 2.700 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(-c3ccc(CC(=O)N(C)C)cc3)cc2)CCN1 426538089 LNPZIYLUQCTPHE-NRFANRHFSA-N 379.504 2.808 0 50 GFAA CN(C[C@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O 95528819 RPZCZTHTAMQLMG-OAHLLOKOSA-N 378.460 2.851 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1cccc(I)c1 239347188 MHPWIUHQCRHJIL-PKCACUDHSA-N 391.208 2.849 0 50 GFAA CNc1nc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)ncc1F 95388247 XZWRDCHQPBGOTC-UHFFFAOYSA-N 398.486 2.504 0 50 GFAA O=C1c2ccccc2N2C(=O)CC[C@@]2(C(=O)NCC2CC2)N1Cc1ccccc1 183494896 AUISLISBRDILDC-HSZRJFAPSA-N 389.455 2.692 0 50 GFAA Cc1sc(NC(=O)[C@@H]2C[C@H](O)CN2)nc1-c1ccc(Br)cc1 299749830 LUYSZFIBHIOCGD-RYUDHWBXSA-N 382.283 2.542 0 50 GFAA Cn1nnc2cc(C(=O)N3CCC[C@@H](c4[nH]ncc4-c4ccccc4)C3)cnc21 67725847 ALGSUKMQPMKWTC-OAHLLOKOSA-N 387.447 2.773 0 50 GFAA COC1CCN(S(=O)(=O)NCC[C@H](c2ccccc2)c2ccco2)CC1 670444592 ZUWXFFUVGICWOC-GOSISDBHSA-N 378.494 2.747 0 50 GFAA O=C(O)c1cccc(NS(=O)(=O)c2cc(Br)cc3c2OCC3)c1 170594906 MVTNMSKCNHRFKU-UHFFFAOYSA-N 398.234 2.883 0 50 GFAA COc1ccc2cc(NC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)ccc2n1 170620602 DJWCGRJYRXZVDS-HZPDHXFCSA-N 381.432 2.747 0 50 GFAA O=C(N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(Br)cn1 171199769 XYCPLPKLGHUYMU-KRWDZBQOSA-N 390.281 2.647 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2csc3ccccc23)[C@@H]1c1cnn(C)c1 275260192 HTWKHOIGACMPFY-YCRPNKLZSA-N 398.532 2.961 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)N1CCN(C2CCCC2)CC1 186726790 BFKHVBCNKGEORK-UHFFFAOYSA-N 376.467 2.531 0 50 GFAA NC(=O)[C@@H]1CC[C@H](C(=O)N(Cc2ccccc2Br)C2CCCC2)O1 193587068 AQURQLSFCXFMCF-JKSUJKDBSA-N 395.297 2.753 0 50 GFAA Cc1ccc(C)c(OCCc2nnc(NC(=O)[C@@H](C)Cn3cncn3)s2)c1 1506427512 WLVGZQIHJSDOSG-AWEZNQCLSA-N 386.481 2.643 0 50 GFAA C[C@@H](Cn1cncn1)NC(=O)c1cc(COc2ccc3c(c2)CCCC3)on1 11662429 ZEGRFAZICJZMBZ-AWEZNQCLSA-N 381.436 2.542 0 50 GFAA COc1ccc(OCc2cc(C(=O)N[C@H](C)c3ccncn3)n[nH]2)c(Cl)c1 12434349 CJPSYRROLRZENW-LLVKDONJSA-N 387.827 2.932 0 50 GFAA NC(=O)C1(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(-c3cccc(F)c3)cc2)CC1 12594401 IRUUQONYCDNCRS-SFHVURJKSA-N 395.434 2.688 0 50 GFAA COc1cccc(CC[C@H]2CCCN(C(=O)Cc3cnc4ncnn4c3)C2)c1 12761417 SAHITDCYVSGOQO-QGZVFWFLSA-N 379.464 2.547 0 50 GFAA CN(C[C@@H](O)COc1cccc(CN2CCC(CO)CC2)c1)C1CCCCC1 14977442 UJHHFBXVMNQOMH-JOCHJYFZSA-N 390.568 2.895 0 50 GFAA COc1ccc(-n2nnc(C(=O)Nc3ccc(Br)cc3)c2N)cc1 16661483 PAOWJIXAICHGFF-UHFFFAOYSA-N 388.225 2.873 0 50 GFAA Cc1ccc(F)cc1CN1CCC2(CC1)CN(Cc1ncc[nH]1)C[C@H]2C(=O)O 1857696031 IVDATRNKXJLRMP-SFHVURJKSA-N 386.471 2.656 0 50 GFAA Cc1nc(CN2CCOC3(CCN(c4nccs4)CC3)CC2=O)cs1 1857698631 BAADRIZNNNGGSG-UHFFFAOYSA-N 378.523 2.696 0 50 GFAA Cc1cc(Cl)cc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2cnn(C)c2)c1 1857714853 OUVPZCVDRSYVEQ-ROUUACIJSA-N 376.888 2.526 0 50 GFAA O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)N=c1[nH]oc2ncccc12 1875241831 JCVJOWQDPIGGFE-UHFFFAOYSA-N 397.394 2.660 0 50 GFAA COC[C@@]1(C(=O)O)CCN(C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1 262880146 CCPFLEKYZRERFC-QGZVFWFLSA-N 384.354 2.760 0 50 GFAA C[C@H](CC(=O)N[C@H](CO)[C@@H](O)c1cccnc1)c1ccc(Br)cc1 913565485 KKZBOJTZVAOCEM-NJAPINKUSA-N 393.281 2.548 0 50 GFAA CCOc1cc(Cn2ccnc2C(F)(F)F)nc2nc(C(F)(F)F)nn12 919939594 ICLTZKKHFXJEEB-UHFFFAOYSA-N 380.252 2.805 0 50 GFAA O=C(N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21)C1(n2cc(Br)cn2)CC1 826574779 DXHOWKAIZXEULM-RBSFLKMASA-N 376.229 2.728 0 50 GFAA Cc1cc(NC(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)n(CCO)n1 1875391438 OLQOBVJJSUKEJJ-UHFFFAOYSA-N 396.329 2.897 0 50 GFAA O=S(=O)(c1ccc(F)c2cnccc12)N1CCOC[C@H]1CC1CCOCC1 1875404279 CGSSWPBHYOEMLW-OAHLLOKOSA-N 394.468 2.580 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccnc(Oc2ccccc2)c1 1875402143 COHWCIZCESZFQC-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA CCn1cnc2c(N3CC[C@@]4(NC(=O)[C@@H]5C[C@H]5C5CC5)CCC[C@H]34)ncnc21 1775990174 DLJUUFOODXRCGZ-YJXLLHPSSA-N 380.496 2.510 0 50 GFAA CCCOc1ccc([C@H](CC(=O)O)NS(=O)(=O)c2ccc(OC)cc2)cc1 4593252 JEPWZBLHBHKGDY-SFHVURJKSA-N 393.461 2.978 0 50 GFAA COc1ccc(O[C@@H]2C(=O)N(C[C@@H]3CCCO3)[C@H]2c2ccc3c(c2)OCO3)cc1 4686285 XDGXKYVFNMZNRW-YYWHXJBOSA-N 397.427 2.934 0 50 GFAA C[C@@H](C(=O)Nc1nnc(-c2cnccn2)o1)N1C(=O)c2cccc3cccc1c23 2100482574 JMRWCTUYEORJAM-NSHDSACASA-N 386.371 2.667 0 50 GFAA O=C(NCc1ccnc(CNC(=O)C2CC2)c1)c1c[nH]nc1-c1cccc(F)c1 2100536881 CWRGEOXHUIPNFK-UHFFFAOYSA-N 393.422 2.567 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1ccnnc1)C(=O)N1CC[C@@H]1Cc1ccccc1 2325763839 ILQCZLAWQOFPIG-MOPGFXCFSA-N 396.491 2.756 0 50 GFAA Cc1ncccc1CCNC(=O)N1CCO[C@@H](c2cn3c(C)cccc3n2)C1 2325764753 VYKGXEYXBFHVLG-LJQANCHMSA-N 379.464 2.672 0 50 GFAA C[C@H]1CCn2ncc(C(=O)N[C@@H](C(=O)O)c3ccc(F)c(Cl)c3F)c2C1 2325805633 YEBVNSBAQIOCSG-VXJOIVPMSA-N 383.782 2.953 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2F)cc1Cl 1071835 MBYIAZDXIYSOTR-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)c2cc3c(s2)C2(CCNCC2)OCC3)n1 2356134760 AYQGZBFEHYDPEV-AWEZNQCLSA-N 388.537 2.531 0 50 GFAA O=C(COc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NC[C@@H]1CCCO1 2826925 UWLPVZPBSZVZAB-NSHDSACASA-N 377.824 2.609 0 50 GFAA Nc1cncc(-c2ccc(C(=O)NCc3nncn3C3CCCCC3)cc2)n1 2356150977 LIGHKUZALNJRMK-UHFFFAOYSA-N 377.452 2.753 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)nn1C 2356163706 OFDOLACXAMCJCE-JOCHJYFZSA-N 380.492 2.568 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O 4313852 URUALYLRUUVFCA-UHFFFAOYSA-N 390.461 2.576 0 50 GFAA COc1ccc(C(=O)NCC2CCN(C(=O)c3ccc(OC)cc3)CC2)cc1 6127745 JANHMLHMHSKHIT-UHFFFAOYSA-N 382.460 2.986 0 50 GFAA CCc1ccccc1NC(=O)c1ccccc1NC(=O)[C@@H](N)Cc1c[nH]cn1 55182590 CBLNDGQMVATQRO-KRWDZBQOSA-N 377.448 2.733 0 50 GFAA CCCc1ncc(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccc(F)cc2)cn1 55253154 DYSKHIVAJRKFCA-RBUKOAKNSA-N 384.455 2.816 0 50 GFAA O=C(C[C@@H]1CCOc2ccccc21)N1CCN(C(=O)c2ccccc2O)CC1 117970804 JJRPLUZPJDZEQZ-INIZCTEOSA-N 380.444 2.633 0 50 GFAA CCn1cc(NC(=O)c2ccc(CN3CCC[C@@H]3c3nc(C)no3)cc2)nn1 65371187 UVMJLIZYBOTURV-MRXNPFEDSA-N 381.440 2.579 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc(C)ccc3F)CC2)C1 67805581 BODZDEFMGVLMEF-SFHVURJKSA-N 391.531 2.573 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3ccncc3)C2)cc1OC 12299186 UKORIUVCNZIVHH-LJQANCHMSA-N 383.492 2.878 0 50 GFAA CCOC(=O)C1=NO[C@@H](CNC(=O)c2c(-c3ccccc3Cl)noc2C)C1 1401568 XZYXUWGCCNEUHX-LLVKDONJSA-N 391.811 2.741 0 50 GFAA CC[C@H]1CN(C(=O)c2cnc3ccnn3c2C)CCC(=O)N1Cc1ccccc1 71745793 ZUDYMPXAOREUOI-SFHVURJKSA-N 391.475 2.691 0 50 GFAA Cc1cccc(-c2cnc(C)nc2[C@H]2CCCN(C(=O)[C@@H]3CCC(=O)N3)C2)c1 11872839 SBWOVHJFSZLWBO-HKUYNNGSSA-N 378.476 2.745 0 50 GFAA Cc1cccnc1CN(C)C[C@@]1(O)CCCN(Cc2cccc(F)c2F)C1=O 12373722 YUXRVPMFVVDTAI-NRFANRHFSA-N 389.446 2.654 0 50 GFAA C[C@H](Cc1ccc(O)cc1)N(C)C(=O)Cn1cnc2c(oc3ccccc32)c1=O 155059280 YRGLLODSXJWBOP-CQSZACIVSA-N 391.427 2.938 0 50 GFAA COc1ccccc1C[C@H](CNC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)O 237271308 PSEKEIVKYCGRRH-WOJBJXKFSA-N 396.487 2.719 0 50 GFAA CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)N2CCC[C@@H](OC)CC2)c1 376282892 SCQSENRCERKUBV-CRAIPNDOSA-N 397.541 2.937 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)c1 72463457 ITHSHNWKGIUCRK-JOCHJYFZSA-N 387.568 2.685 0 50 GFAA CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@](O)(C(F)(F)F)CC1 287954883 SMMDKHLYWATORC-MRXNPFEDSA-N 393.427 2.572 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)Nc1ccc(C(=O)OC)cc1C 96138628 PCTJUWHRMRYNKS-UHFFFAOYSA-N 377.470 2.615 0 50 GFAA CN(CC(=O)N1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1)c1ccccc1 91365174 WRGJYGXWMQILJK-FQEVSTJZSA-N 399.535 2.533 0 50 GFAA CC(C)OC(=O)[C@@H]1[C@H]2C=C[C@@]3(CN(c4ccccc4Br)C(=O)[C@H]13)O2 239306228 GOUMLHLYFWBNID-BSXFFOKHSA-N 392.249 2.687 0 50 GFAA CCCCN(Cc1ccccn1)C(=O)Nc1cc(S(N)(=O)=O)ccc1C 96150262 ZNLKHACSRLMQEX-UHFFFAOYSA-N 376.482 2.872 0 50 GFAA Cc1nc(C)c(CC(=O)N2CCC(c3nc4c(C)cccc4[nH]3)CC2)c(=O)[nH]1 95385236 MKZLFULBVQVKQI-UHFFFAOYSA-N 379.464 2.520 0 50 GFAA CCN(CC)C[C@H](O)COc1cc(CN2CCC3(CCO3)CC2)ccc1OC 95509340 SQHILFGZBDHTPQ-IBGZPJMESA-N 392.540 2.532 0 50 GFAA CCOC(=O)/C=C1\C[C@@H]2[C@H]3[C@H]4[C@H]5[C@@H]2C/C(=C\C(=O)OCC)[C@H]5[C@@H]2[C@@H]5O[C@@H]5[C@@H]([C@H]13)[C@H]42 257347054 PQZHGKNYSHTADS-UIXQLNTFSA-N 396.483 2.757 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)NC[C@@H]3CCCN4CCCC[C@H]34)CC(=O)N2C)cc1 253400193 DRUXYJWJUPVKGV-LLMJNHHCSA-N 399.535 2.595 0 50 GFAA biogenic CC(C)C[C@@H](C(=O)N[C@H](CO)Cc1ccccc1)N1Cc2ccccc2C1=O 253397468 BLNSUYWFPRNLJY-FPOVZHCZSA-N 380.488 2.777 0 50 GFAA biogenic COc1ccccc1NC[C@@H](NC(=O)c1ccccc1S(=O)(=O)O)C(C)C 725325713 YKQRYZPDVJBAET-MRXNPFEDSA-N 392.477 2.808 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N[C@@H]1CCCN(Cc2cccs2)C1 823724784 KIGLCQUEQBBWTJ-QGZVFWFLSA-N 379.551 2.679 0 50 GFAA O=C(CC1CCN(Cc2ccccc2)CC1)NCCCN1CCCC[C@H]1CO 670457200 ASUXIUYDECJQAZ-QFIPXVFZSA-N 387.568 2.642 0 50 GFAA CCNC(=O)[C@H]1CC[C@@](C)(C(=O)Nc2ccc(NC(=O)COC)cc2)C1(C)C 952873225 JATCWTVGMKTEKQ-IERDGZPVSA-N 389.496 2.789 0 50 GFAA COc1ccc([C@H]2CN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]2N(C)C)cc1 1565528470 YSHSOBKGWZIVJB-MOPGFXCFSA-N 382.460 2.523 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc2c(=O)n(C)cnc2c1 952860085 DFBMTCXSXQXZAG-UHFFFAOYSA-N 390.443 2.730 0 50 GFAA CCOc1cc(NC2CCN(C(=O)C[C@@](C)(O)c3ccccc3)CC2)ncn1 186209635 SPCVIPVPPLVUDL-OAQYLSRUSA-N 384.480 2.576 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)c(F)c1 279190273 WHZXGKUJHNJXSR-AWEZNQCLSA-N 399.488 2.645 0 50 GFAA Cc1nn(C)c(Oc2cccnc2)c1NS(=O)(=O)c1ccc(N(C)C)cc1 170617504 HMCSBWNPAURYPZ-UHFFFAOYSA-N 387.465 2.783 0 50 GFAA C[C@@](O)(C(=O)Nc1ccc(-c2nn[nH]n2)cc1)c1cccc(C(F)(F)F)c1 754847187 HUUJQBVBYWYVMM-INIZCTEOSA-N 377.326 2.732 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC[C@H]2CCCCN2)ccc1F 1704313170 HKHURBSRZJTSFV-CQSZACIVSA-N 390.459 2.817 0 50 GFAA O=C(c1ccc2ncsc2c1)N1CCCN(CCn2cc(Cl)cn2)CC1 1704278271 JOKZMHBDTSVHDY-UHFFFAOYSA-N 389.912 2.994 0 50 GFAA Cc1c(C(=O)N(C)CCc2ccccn2)sc2ncnc(N[C@H]3CCOC3)c12 12080295 DMJKABIXYUSZSC-HNNXBMFYSA-N 397.504 2.910 0 50 GFAA C[C@H](CCn1cccn1)NC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12093604 CXIUARVBHJTHLL-CYBMUJFWSA-N 392.385 2.750 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(c3cc(C)nc(N)n3)C2)c1 12201309 QBGUHTSOTPWOBR-INIZCTEOSA-N 383.496 2.689 0 50 GFAA Cn1ccnc1C(=O)N1CC[C@H]2[C@@H]1CC(=O)N2Cc1ccc2sccc2c1 1857683471 HBSVWXPAFSHMRG-HOTGVXAUSA-N 380.473 2.650 0 50 GFAA COc1cc(CN2[C@H]3CC[C@@H]2[C@@H]2CN(C(=O)c4cc(C)on4)C[C@@H]23)cc(OC)c1 1857709708 MUYDVYAUYBLATA-GHSBBIOCSA-N 397.475 2.735 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)Cc3cccs3)[C@H]3CC[C@]2(C1)O3 1875248270 HBECDHGNRLMXHN-XKGFGPFHSA-N 383.517 2.794 0 50 GFAA COc1cc(OC)c(OC)cc1CNc1ccc(C(=O)NCCO)c(Cl)c1 225430576 ZCTOGGRHUHSXPP-UHFFFAOYSA-N 394.855 2.700 0 50 GFAA Cc1cc([C@@H]2CCCN(C(=O)CCn3cnc4sc(C)c(C)c4c3=O)C2)n[nH]1 328748084 QGKQAMRGOOTUOC-OAHLLOKOSA-N 399.520 2.903 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c(F)c1 241470696 NXFBWZRFIIXXCS-CYBMUJFWSA-N 382.432 2.778 0 50 GFAA CC(C)CNC(=O)c1cn([C@@H]2CCCN(C(=O)/C=C/c3cccs3)C2)nn1 14987128 OQHZWQXZEVQMFG-MVGZEHJDSA-N 387.509 2.602 0 50 GFAA O=C1CN(C(=O)c2ccc(CNc3ccnc4c(F)cccc34)cc2)CCN1 252508325 XKHUUHDYPIDSEY-UHFFFAOYSA-N 378.407 2.558 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc(-n2cnnc2)cc1 263663025 JEXPPAGYQUQLEP-UHFFFAOYSA-N 397.429 2.940 0 50 GFAA C[C@@H]1CN(C(=O)NCc2cccc(NC(=O)NCc3ccncc3)c2)CCCO1 263870339 JZFYJTAWKZKWIK-MRXNPFEDSA-N 397.479 2.724 0 50 GFAA CN(C(=O)c1ccnc(C(F)(F)F)c1)[C@@H]1CCN(Cc2ccccc2)C1=O 808768144 ZWWYAFSLMDVGSR-OAHLLOKOSA-N 377.366 2.974 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)c1ccnc(C)n1)NC(=O)OC(C)(C)C 918164356 SUFDDNMTTSSSOL-MRXNPFEDSA-N 386.452 2.789 0 50 GFAA CCc1cccc(Cc2cnc(NC(=O)c3nnn([C@@H]4CCNC4)c3C)s2)c1 823531355 BUQSCDBKIIZMRU-MRXNPFEDSA-N 396.520 2.983 0 50 GFAA CC(C)Nc1cccc(CNC(=O)N2CCC3(CCC3)S(=O)(=O)CC2)c1 952852494 BUPLVFCHTCLRHK-UHFFFAOYSA-N 379.526 2.760 0 50 GFAA Cn1c(-c2cc(-c3ccc4c(c3)OCCO4)on2)nnc1N1CC[C@](C)(F)C1 1875280608 ABIQQTKNRMYMAX-IBGZPJMESA-N 385.399 2.847 0 50 GFAA COc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1ccc2cnnn2c1 1875293455 RBOYMTVJRWAFLK-UHFFFAOYSA-N 381.436 2.605 0 50 GFAA Cc1ncnc2c1C[C@@H](C(=O)N1CCC[C@H](CN(C)Cc3cccnc3)C1)CC2 1875290671 WMKDDTKNWPFEHD-UXHICEINSA-N 393.535 2.656 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)N1C[C@H]2[C@@H](O)C[C@H]2C1 1875268046 COLYPVMBKVZAFP-GLQYFDAESA-N 384.436 2.588 0 50 GFAA CN(C[C@H]1CCCO1)C(=O)c1ccccc1Cn1cc([C@@H](O)C(C)(C)C)nn1 1875316439 RAPXSBRHRWPURS-VQIMIIECSA-N 386.496 2.657 0 50 GFAA Cc1cccc2nc(CNC(=O)N3CCC[C@]34CCC[S@](=N)(=O)C4)cn12 1875393147 HTRXSKYWTJSEIV-DWXRJYCRSA-N 375.498 2.527 0 50 GFAA NCC[C@@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCO1 1875319090 PXDVWXMOBXHHDS-OAHLLOKOSA-N 399.438 2.948 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)Cc1ccc2c(c1)CCCO2 1875401738 QKGKNNSNAURJLD-XLIONFOSSA-N 396.491 2.871 0 50 GFAA O=C(Nc1ccc(N2CCc3sccc3C2)nc1)[C@H]1CCc2nncn2CC1 878115154 XVWKAIWHJJUEMD-AWEZNQCLSA-N 394.504 2.889 0 50 GFAA CN1CCc2[nH]nc(C(=O)NCc3cc4cc(Br)ccc4[nH]3)c2C1 2325811304 NJETTWDIIFXHTF-UHFFFAOYSA-N 388.269 2.571 0 50 GFAA Cc1ncc(CN(C)C(=O)[C@@H]2CO[C@H](CNC(=O)CC3(C)CCCC3)C2)s1 2332238015 VHFONDSNHQQUAO-HOTGVXAUSA-N 393.553 2.902 0 50 GFAA CC(=O)NC(=O)c1ccccc1OCC(=O)c1ccc(Br)cc1 860996 GAMQORKBKAMIBT-UHFFFAOYSA-N 376.206 2.987 0 50 GFAA CC(=O)Nc1ccc(C(=O)NCC(=O)OCc2c(F)cccc2Cl)cc1 1116093 RPJUZQWBCPKXBK-UHFFFAOYSA-N 378.787 2.911 0 50 GFAA CCc1ccc(N(CC(=O)NCCCOC)S(=O)(=O)c2ccccc2)cc1 2817397 RLZWQLSUIFBVOC-UHFFFAOYSA-N 390.505 2.597 0 50 GFAA C[C@@H](c1ccon1)N(C)Cc1cnc(S(C)(=O)=O)n1Cc1ccccc1F 20600916 JBCXVWLSNQVCRQ-ZDUSSCGKSA-N 392.456 2.655 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)C[C@@H]1N 418930138 AZPGTSHFZARFLM-MDASCCDHSA-N 385.895 2.546 0 50 GFAA CCOc1ccccc1-n1ccc2c(cnc3nc(C(F)(F)F)nn32)c1=O 22609038 NPVRJOCAGUEWKZ-UHFFFAOYSA-N 375.310 2.846 0 50 GFAA O=C(N[C@@H]1CCCOC1)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 171613192 MSQLFSKNTWRZOM-QGZVFWFLSA-N 386.521 2.816 0 50 GFAA CC(C)C(=O)NCCc1nnc2n1CCN(Cc1ccc(C(C)C)cc1)CC2 20599730 ZASIMFBHHWGDEN-UHFFFAOYSA-N 383.540 2.775 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1csc(CC(=O)OC(C)C)n1 252470066 XUPGOTOJGGVQEP-IMJJTQAJSA-N 380.510 2.943 0 50 GFAA C[C@](O)(CCCO)CNC(=O)c1csc2nc(-c3ccccc3Cl)cn12 67689008 QIVHCKMHXGAKNP-SFHVURJKSA-N 393.896 2.970 0 50 GFAA COC(=O)C[C@@H]1C(=O)NCCN1Cc1nc(-c2ccc3ccccc3c2)oc1C 39421109 RBLORVLMIYXLDI-LJQANCHMSA-N 393.443 2.667 0 50 GFAA Cc1nn(C)c(-c2nc3c4c(C)c(C(=O)N(C)C)sc4ncn3n2)c1Cl 2790356 FOBMLYPMZXLXIV-UHFFFAOYSA-N 389.872 2.712 0 50 GFAA Cc1nccn1CCN(C)C(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 72151803 UBDDBGPEGCAYCE-UHFFFAOYSA-N 392.385 2.622 0 50 GFAA O=C(c1c(F)cccc1F)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 72437842 ZLKWDJTVBLXFTK-UHFFFAOYSA-N 387.434 2.708 0 50 GFAA Cc1nc(CCC(=O)N2CCC(c3[nH]ncc3-c3cccc(F)c3)CC2)n[nH]1 71315384 PTFXSCNZVYPSJQ-UHFFFAOYSA-N 382.443 2.981 0 50 GFAA Cc1nn(C)c2sc(C(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)cc12 155040609 GIZNLXOUPUWXMT-MRXNPFEDSA-N 396.516 2.907 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 72433995 SVFSYNPZIHNYJS-UHFFFAOYSA-N 392.438 2.646 0 50 GFAA CC(C)C(=O)Nc1ccc(CNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cc1 172711980 NRDZZWIZMHVEAP-OAQYLSRUSA-N 395.503 2.798 0 50 GFAA O=C(N[C@@H](C(=O)O)[C@H]1CCCOC1)c1ccc(COc2ccc(F)cc2)o1 262697266 ABYSFXPMDMJYBR-YVEFUNNKSA-N 377.368 2.607 0 50 GFAA O=C(c1ccc2[nH]c(CO)nc2c1)N1CCN(Cc2ccc(Cl)cc2)CC1 77537947 NBXJJDQPEOBLAF-UHFFFAOYSA-N 384.867 2.667 0 50 GFAA COc1cccc(C2(NS(=O)(=O)c3cnc(C)s3)CCOCC2)c1F 447838633 CIHYUSBJZNPEQT-UHFFFAOYSA-N 386.470 2.583 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 238092497 PKHISXPPSRZIQN-IINYFYTJSA-N 385.247 2.531 0 50 GFAA COc1ccc(-c2ccc(C)c(NC(=O)N[C@H]3CCc4ncnn4C3)c2)cn1 284079869 SAWXKPXPKMIALD-INIZCTEOSA-N 378.436 2.794 0 50 GFAA COC(=O)c1c(NC(=S)N2CCC[C@H](C)C2)sc(C(=O)N(C)C)c1C 17078366 MLUMJAKCEYREEZ-JTQLQIEISA-N 383.539 2.974 0 50 GFAA CC(C)(C)Oc1cccc(CCC(=O)N[C@@H]2CCCN(c3ncccn3)C2)n1 176974403 RZYPPLDQDPOGIR-QGZVFWFLSA-N 383.496 2.767 0 50 GFAA CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)Nc1c(-c4cnn(C)c4)nc4ccccn14)C[C@@H]3C2 288979442 DMHIXAMXFNWOGQ-RSADAIHESA-N 392.463 2.622 0 50 GFAA CCCCN1CCN(C(=O)c2cccc(-c3cc(OC)nc(OC)n3)c2)CC1 426720018 SRUTWHNSJYJIKB-UHFFFAOYSA-N 384.480 2.719 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)N1CCN(C/C=C/c2ccccc2)CC1 426514620 HTQAMBJETJZCJB-JXMROGBWSA-N 381.524 3.000 0 50 GFAA CCCSCC(=O)N1CCC[C@@]2(CCC(=O)N(Cc3cnc(C)cn3)C2)C1 91933239 DGDKVHCQNIQRER-HXUWFJFHSA-N 390.553 2.659 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCCn3ccnc3)csc2C1 426503255 JMMAXEKAFLJWJC-UHFFFAOYSA-N 399.520 2.928 0 50 GFAA Cc1cc(Oc2ccc(NC(=O)CNC(=O)Cc3cccc(F)c3)cc2)n[nH]1 162525367 JEZOFCGNUPOGHI-UHFFFAOYSA-N 382.395 2.947 0 50 GFAA COC(=O)c1ccc(NC(=O)N2CCC(c3nc(C)n[nH]3)CC2)c(Cl)c1 96138128 VCHGTJXDKVAPDZ-UHFFFAOYSA-N 377.832 2.965 0 50 GFAA CC(C)c1cc(C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)no1 179328559 BQBRXHPGVGOMBV-UHFFFAOYSA-N 378.454 2.620 0 50 GFAA O=C(Cc1ccc2ccccc2c1)N1CC[C@H](N2CCOCC2)[C@H](CCCO)C1 91830187 MHFJUFVYVVBZTL-PKTZIBPZSA-N 396.531 2.704 0 50 GFAA COc1ccc(C)cc1NC(=O)N1CCC2(CC[C@@H](CNC(C)=O)O2)CC1 96162842 KQTLGULCXPRIHI-INIZCTEOSA-N 375.469 2.685 0 50 GFAA C[C@@H](CCNC(=O)N(Cc1ccc2[nH]ccc2c1)C1CC1)N1CCN(C)CC1 534661200 ZGFIKDVCBASRSV-KRWDZBQOSA-N 383.540 2.868 0 50 GFAA O=C(Cc1ccc(NC(=O)[C@H]2CCCN(c3ccccn3)C2)cc1)NC1CC1 827848681 IHQZSFOGKZKUQZ-KRWDZBQOSA-N 378.476 2.758 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1)N1CCC(CNC(=O)COc2ccccc2)CC1 952983011 NIMKISCSVYRJKG-SFHVURJKSA-N 395.503 2.921 0 50 GFAA Nc1cc(OC(=O)c2cccc(F)c2)nn1S(=O)(=O)c1cccc(Cl)c1 170615635 WRLMZOZQIUQMQU-UHFFFAOYSA-N 395.799 2.714 0 50 GFAA C[C@@H](C(=O)NCc1nc2cccnc2[nH]1)N1CCC(Cc2ccccc2)CC1 194230417 ZLZJTMCPNGOOMO-INIZCTEOSA-N 377.492 2.917 0 50 GFAA CN1C(=O)COc2ccc(NC(=O)NC[C@H](O)c3cc(F)cc(Cl)c3)cc21 785838615 OUYHGWWFQZUIRZ-HNNXBMFYSA-N 393.802 2.689 0 50 GFAA O=C(CCN1CCCCCC1=O)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 1506427448 MOCGIQSHRHVGJL-UHFFFAOYSA-N 385.468 2.600 0 50 GFAA O=C(CCc1ccccc1)[C@H]1CCCN(C(=O)Cn2[nH]c3ccccc3c2=O)C1 1506401072 HQOBNCGPGFBIHX-SFHVURJKSA-N 391.471 2.770 0 50 GFAA COc1cc(Cl)cc(CN2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)c1OC 1529179768 DOSDVVXCXCBIFB-APWZRJJASA-N 382.888 2.728 0 50 GFAA O=C(CCC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)NC1CCCC1 1704357853 YSENWMRSELWONR-DYESRHJHSA-N 395.503 2.748 0 50 GFAA CN(CCCn1cccn1)C(=O)c1c(N2CCOCC2)noc1-c1ccccc1 1704341356 ZQTUBYQRWFVWBT-UHFFFAOYSA-N 395.463 2.537 0 50 GFAA O=C(CC1CC1)N1CCCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 1772815657 RGLHBDDWZZVMBN-QFIPXVFZSA-N 385.552 2.612 0 50 GFAA COc1ccc(CN2CC[C@@H](N3CCCCCC3)[C@H](O)C2)c(OC)c1OC 11818103 DBFCIUHQPFKTBY-QZTJIDSGSA-N 378.513 2.524 0 50 GFAA O=C1CCCN1CC(=O)N(Cc1cccnc1)CC1CCN(C2CCCC2)CC1 11937836 MLKCLETXPSZFGT-UHFFFAOYSA-N 398.551 2.687 0 50 GFAA O=C(c1csc2nc(-c3ccccc3)cn12)N1CCN(c2ncccn2)CC1 12441639 ONSXVBMDJFXGQP-UHFFFAOYSA-N 390.472 2.815 0 50 GFAA COCCn1c(=O)c(CNC[C@H]2COc3ccccc3O2)cc2cc(C)ccc21 15070970 URMOQSPXTXWNGF-IBGZPJMESA-N 394.471 2.886 0 50 GFAA Cc1c(O)nc(SCC(=O)Nc2nccs2)n(-c2ccccc2F)c1=O 16361247 SQDDRNDAHIDMDT-UHFFFAOYSA-N 392.437 2.573 0 50 GFAA COc1ccc(C(=O)N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)cc1F 169772303 NCMPJJQKAHRZOC-UHFFFAOYSA-N 398.360 2.914 0 50 GFAA O=C1CC2(CCN(C(=O)Cc3ccc(-c4ccccc4)cc3)CC2)OCCN1 1857689027 BUHCPWFLOQLYIE-UHFFFAOYSA-N 378.472 2.794 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)CCc1cccnc1)C2)c1cncc(Cl)c1 1857699026 FGQORINFHKQEDV-IGOJGBNBSA-N 398.894 2.730 0 50 GFAA Oc1nc(C2CC2)nc2c1CC[C@]21CCCN(c2cc(-n3cccn3)ncn2)C1 1857701783 WAGXAKGYNYQBTH-NRFANRHFSA-N 389.463 2.520 0 50 GFAA CCOCCN1C(=O)C[C@H]2[C@@H]1CCN2C(=O)Cc1csc(-c2ccccc2)n1 1857703074 IDKXOPXJPQXHNR-ROUUACIJSA-N 399.516 2.591 0 50 GFAA Cc1cccc(OCCN2C[C@@H]3[C@H](CNC(=O)C4CC4)[C@H]4CC[C@]3(C2)O4)c1C 1857711461 AYCGUGGUPYZCJI-KLJZETAQSA-N 384.520 2.688 0 50 GFAA CCCO[C@@H]1CC[C@H](c2nc(-c3c[nH]c4ccccc34)nn2CCO)C[C@H]1N 1857716990 KPEGGYUTAMCYPO-POZUXBRTSA-N 383.496 2.809 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3nncs3)C[C@]23CC[C@H]1O3)C1CCCCCC1 1857718895 YOPLDRZPAFAABY-WFXMFSGNSA-N 376.526 2.609 0 50 GFAA CC(C)=CCN1CCC[C@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NCCO)C1 1857729595 QSORPLZLXSMAMF-QHCPKHFHSA-N 393.535 2.611 0 50 GFAA O=C(Cc1ccccc1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857735387 BNTWKXCDZGXIEG-UPVQGACJSA-N 394.515 2.655 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c(F)c1 1875241126 OMUDHTCFRWNVDN-KNKQGSTJSA-N 396.418 2.749 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC2CC2)C[C@H]1NC(=O)Cc1ccc(OC)cc1 1875244672 YUMRRTVMUGRFQX-PWIZWCRZSA-N 388.508 2.596 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3ccc(=O)n(-c4ccccc4)n3)c2)n1C 378222959 XMHPPLDBXWEDRU-UHFFFAOYSA-N 386.415 2.589 0 50 GFAA CN1CCC(=O)Nc2cc(C(=O)OCc3nc4ccc(Cl)nc4[nH]3)ccc21 802215957 PJCYOJKMEFTDGS-UHFFFAOYSA-N 385.811 2.747 0 50 GFAA O=S(=O)(CC1CCOCC1)N1CCC[C@H](Cn2cnc3ccccc32)C1 919356679 NVBKQZZFOBKYHK-QGZVFWFLSA-N 377.510 2.505 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)c3ccc([S@@](C)(=N)=O)cc3)cn2)C[C@@H](C)O1 1875292227 AQMOVRHZEHQMIG-ZRBXUZRCSA-N 388.493 2.983 0 50 GFAA O=C(Nc1cccc(N2C(=O)CC3(CCCC3)C2=O)c1)c1ccn2nncc2c1 1875294182 COPXUTNKKNYDBM-UHFFFAOYSA-N 389.415 2.805 0 50 GFAA O=C(O)c1ccoc1CC1CCN(C(=O)[C@H]2C[C@H]3C[C@@H](O)C[C@H](C3)C2)CC1 2325808345 SAUSBCKPXNNTAH-WNKDZCFJSA-N 375.465 2.946 0 50 GFAA COc1ccc(NC(=S)NC(=O)c2ccc(OC)c(OC)c2)cc1OC 881617 LTUDWNQWUKLWEZ-UHFFFAOYSA-N 376.434 2.848 0 50 GFAA CCN(CC(=O)Nc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(Cl)cc1 1063010 GKJWKBSELZIKHZ-UHFFFAOYSA-N 396.852 2.718 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Nc2cc(C)ccc2OC)C1=O 2356163378 ZMARLJCHNRZMMX-HXUWFJFHSA-N 375.469 2.639 0 50 GFAA COc1ccccc1/C=C(/C(=O)NC[C@@H](CO)[C@@H]1CCOC1)c1ccccc1 225488614 URBRQVCTHMKOTI-ZXRHXNHJSA-N 381.472 2.997 0 50 GFAA CCc1nnnn1-c1ccccc1NC(=O)c1cccc(N2CCCC2=O)c1 136641366 UAIVZUBVJPNDAX-UHFFFAOYSA-N 376.420 2.604 0 50 GFAA O=C([C@@H]1Cc2ccccc2N1)N1CCn2nc(-c3nc4ccccc4[nH]3)cc2C1 67541039 NYTURSLGUQETKX-FQEVSTJZSA-N 384.443 2.805 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(NC3CCN(C)CC3)nc2)cc1 67850085 YVHKTLMUFTZGAN-UHFFFAOYSA-N 382.508 2.959 0 50 GFAA Cc1cnn(CCc2nnc(S)n2-c2cnn(Cc3ccccc3C)c2)c1 8511047 WQOZZLLGXZMNIN-UHFFFAOYSA-N 379.493 2.857 0 50 GFAA Cn1nc(-c2ccccc2)c2c1NC(=O)C[C@@H]2c1cccnc1N1CCOCC1 65386680 UACAPFVMFCEDLY-QGZVFWFLSA-N 389.459 2.793 0 50 GFAA C[C@@H](NC(=O)c1cc(CN2CCC(O)CC2)on1)c1cn(C)c2ccccc12 67741086 LGERYTHRRDGUSG-CQSZACIVSA-N 382.464 2.614 0 50 GFAA COc1ccc(CC(=O)O[C@@H](C(=O)Nc2cc(C)on2)c2ccccc2)cc1 328592347 UDBJOHBIMUFAFJ-HXUWFJFHSA-N 380.400 3.457 0 50 GFAA C[C@H]1CN(C(=O)c2nc3sccn3c2CN(C)Cc2ccoc2)C[C@@H](C)O1 71745182 JQWYGWMGECNGJF-OKILXGFUSA-N 388.493 2.870 0 50 GFAA CCN(Cc1ccccn1)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1 151442552 OTCRVKQITJAWID-LJQANCHMSA-N 398.507 2.905 0 50 GFAA CCc1cc(=O)oc2cc(O[C@@H](C)C(=O)N3CCCn4cncc4C3)ccc12 72132924 ZMFJSGXTGPYJAK-AWEZNQCLSA-N 381.432 2.752 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](C(=O)O)C[C@@H](C(=O)Nc3ccc(F)cc3)C2)c1 72131779 PCRHDECZUPRMIP-CVEARBPZSA-N 384.407 2.936 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc([C@H](C)OC)cc2)c1 71771465 VQVYWMRPCHQABQ-ZDUSSCGKSA-N 393.461 2.684 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)c4cc(C)[nH]n4)C3)C2)c1 76915974 UQVNHJLHIONAGE-NRFANRHFSA-N 386.471 2.994 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCC[C@@H]3CN)cc2)c(C)c1Br 237658768 HHDRUDUEDAKSQG-OAHLLOKOSA-N 377.286 2.815 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@H]1CCCN(Cc2nc3ccccc3[nH]2)C1 426727060 ZIFZVOIAFQIOQA-INIZCTEOSA-N 379.512 2.667 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)NC1CCN(c2cnccn2)CC1 426635608 WGHIOMNFDAYISR-UHFFFAOYSA-N 378.480 2.564 0 50 GFAA CCCC[C@@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)c1cncnc1C 82155772 AQVQINZRLJWMLT-MRXNPFEDSA-N 382.464 2.841 0 50 GFAA CCCc1nc(C)cc(-c2cccc(C(=O)NCCS(=O)(=O)CC)c2)n1 426632904 QQLBWEIYOQWPCA-UHFFFAOYSA-N 375.494 2.569 0 50 GFAA Cc1cccc(C)c1OC[C@@H](C)NC(=O)N1CCC(N2CCOCC2)CC1 426420036 URRCPJPJPMMNDP-GOSISDBHSA-N 375.513 2.577 0 50 GFAA NCCOc1ccc(Cl)cc1C(=O)N1CCCC[C@@H]1CCn1cccn1 426431371 RPBPXHHAMAHXBY-MRXNPFEDSA-N 376.888 2.959 0 50 GFAA CN(Cc1cccnc1)C(=O)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91807353 WKADCKHXNPYZNC-UHFFFAOYSA-N 378.476 2.905 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3ccc(=O)n(C)c3)CC2)C1 95367202 FXGKSQNYTVNTIT-HXUWFJFHSA-N 379.504 2.727 0 50 GFAA Cc1cccc(OC2CCN(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)c1 95521989 CNTICJVZGWIKBB-UHFFFAOYSA-N 389.477 2.718 0 50 GFAA COc1cc(OC)cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccn2)C3)c1 95374933 JUANCUCEGROSJD-QFBILLFUSA-N 381.476 2.835 0 50 GFAA COc1ccc(CN2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)c(OC)c1 91809003 FDVHKGZGOPHOEE-VQIMIIECSA-N 381.476 2.835 0 50 GFAA Cc1cc(C)n(CC2(CNC(=O)c3ccc(C)c(N4CCNC4=O)c3)CC2)n1 96180911 TYXSIEFQCFRWNQ-UHFFFAOYSA-N 381.480 2.548 0 50 GFAA C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)c1 299422261 USNWMHLMDRXRED-XPGWFJOJSA-N 391.471 2.812 0 50 GFAA O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NC[C@H]1CN(C(=O)Nc2ccccc2)[C@H]2CCN1C2 299754289 GBCMXZIMMPEIIH-XJEPWFOTSA-N 396.535 2.920 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)Nc1ncc(-c2ccc(F)cc2)[nH]1 1940195115 DVFYUJJIOQJJOU-UHFFFAOYSA-N 377.379 2.955 0 50 GFAA Cc1ccc2[nH]c(C(=O)O)c(CN3CCN(c4nc(C)cnc4C)CC3)c2c1 67787629 GHDMDYIJZBWQMX-UHFFFAOYSA-N 379.464 2.904 0 50 GFAA CN(C(=O)Nc1ccccc1Oc1cccnc1)C1CCS(=O)(=O)CC1 299783579 VTKAXLFPGLBYBO-UHFFFAOYSA-N 375.450 2.915 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@H](C(=O)N1CCCC1)C2)c1ccsc1 299793491 IVTWJEISQPXNIR-LLVKDONJSA-N 375.475 2.824 0 50 GFAA Cc1cc(CC(=O)NC[C@H]2CCCN(Cc3ccc(-c4cc[nH]n4)o3)C2)on1 827861470 HDNNUZAFOIWYSV-OAHLLOKOSA-N 383.452 2.537 0 50 GFAA CN(C)C[C@@]1(CO)CCCN(C(=O)NCC2(c3ccc(F)cc3)CCCC2)C1 584893918 CEVFZPWERCBFDN-NRFANRHFSA-N 391.531 2.983 0 50 GFAA CC[C@H](c1cccnc1)N(C)C(=O)NCc1csc(N2CCOCC2)n1 584893009 URIHAKOHAFRZIU-MRXNPFEDSA-N 375.498 2.667 0 50 GFAA NC(=O)c1csc(S(=O)(=O)NCC[C@@H](c2ccccc2)c2ccco2)c1 670465128 AZDDIWDUHYAWJX-HNNXBMFYSA-N 390.486 2.941 0 50 GFAA Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1ccc2nc(C(C)(C)CO)[nH]c2c1 1346410230 XFEBJOUOMBXFFW-GOSISDBHSA-N 381.480 2.852 0 50 GFAA CCCc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccc2)C3)n(C)n1 1565527648 WRVQQNTVZUIELZ-APWZRJJASA-N 380.492 2.749 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)c(OC)c1 1565526040 FDVHKGZGOPHOEE-LPHOPBHVSA-N 381.476 2.835 0 50 GFAA CC(C)[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1 276532827 RBHMAZWUMZYAFU-RTBURBONSA-N 381.524 2.606 0 50 GFAA CCn1cc([C@H]2CN(C(=O)c3cnc(OCC4CC4)c(Cl)c3)CCO2)cn1 191738625 DWEACGAJPBUEAC-QGZVFWFLSA-N 390.871 2.954 0 50 GFAA C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)c1nc2cccnc2s1 193958572 WVHCIUKIQRGIIO-HNNXBMFYSA-N 381.505 2.632 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)NCc2noc(C)n2)cc1 1704302929 FDSFERZFEWYGHC-UHFFFAOYSA-N 383.408 2.572 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697487 NTNRIBMQRNNFJC-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697932 RBUSJHDOENZOQK-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA COCCN(C(=O)CCc1nnc(CCc2ccccc2OC)o1)C(C)C 11932962 NBKQOJJYUGBJOA-UHFFFAOYSA-N 375.469 2.679 0 50 GFAA O=C(COc1ccccc1)N[C@H]1CCCC[C@H]1NC(=O)COc1ccccc1 12376762 YBRVMPVDCHTAQX-BGYRXZFFSA-N 382.460 2.688 0 50 GFAA O=C(Cc1ccc(Cl)c2cccnc12)N[C@H]1C[C@H](Cn2ccnc2)C[C@@H]1O 1857531042 NSQUJEMTVRCHGH-KKXDTOCCSA-N 384.867 2.583 0 50 GFAA CC1(C(=O)N2CCC3(CC2)CN(Cc2cccnc2)C[C@H]3C(=O)O)CCCC1 1857685505 LKSUAISCSYCIMI-SFHVURJKSA-N 385.508 2.787 0 50 GFAA O=C1NCC(=O)N2C[C@H](n3ccnc3-c3sc4ccccc4c3Cl)C[C@@H]12 1857697072 IYOGHMDZEZXUMY-PWSUYJOCSA-N 386.864 2.690 0 50 GFAA CCc1nccn1CCCNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857698739 GMWMZXZASUCGJN-INIZCTEOSA-N 396.495 2.795 0 50 GFAA CCC[C@@H](C)c1cc(NS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)n[nH]1 410385059 VGWRKFNNLSQCDT-LLVKDONJSA-N 381.454 2.909 0 50 GFAA CC(=O)Nc1ccc(F)c(C(=O)N2CCC(CN3CCCCC3=O)CC2)c1 125112349 JFEJEXYGHUYKIQ-UHFFFAOYSA-N 375.444 2.649 0 50 GFAA CCOc1cccc(N2CCN(C(=O)c3cc(O)c4ccccc4n3)CC2)n1 264419556 LPNFHPUPFDIEPZ-UHFFFAOYSA-N 378.432 2.697 0 50 GFAA C[C@@H](O)C(=O)N[C@]12CC[C@H](C[C@H]1n1cc(-c3ccc(C(F)(F)F)cc3)nn1)C2 1875338014 LWRYQKOPPXDOFK-JHCVGGGNSA-N 394.397 2.945 0 50 GFAA Cc1nc(CN2CCC(C(=O)N3CCCC3(C)C)([S@](C)=O)CC2)cs1 886088477 HIWQHYMCMLZSTJ-VWLOTQADSA-N 383.583 2.566 0 50 GFAA Brc1ccc(N2CCN(CCc3cnccn3)CC2)nc1C1CC1 2325764586 UZQZQAUGTPPTIV-UHFFFAOYSA-N 388.313 2.876 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccc(F)cc2)o1 2325785767 MPTVEKCMULOZKP-GDIGMMSISA-N 399.422 2.764 0 50 GFAA N[C@H]1CCc2c(C(=O)Nc3ccc(-n4nccc4C(F)(F)F)cc3)n[nH]c2C1 2325856262 HXRJHXFPEDBITG-JTQLQIEISA-N 390.369 2.683 0 50 GFAA NC1(CC(=O)Nc2cccc3c(O)ncnc23)CCN(Cc2ccccc2)CC1 2325858328 IQHZKSPZFPCHGH-UHFFFAOYSA-N 391.475 2.658 0 50 GFAA O=C(c1cc2c(s1)CCCCCC2)N1CCN(C(=O)[C@@H]2CCCO2)CC1 1055710 BROLUEXOYHNVIU-INIZCTEOSA-N 376.522 2.871 0 50 GFAA COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)ncn1 1226777 IJEKDBHPAUBZRN-UHFFFAOYSA-N 384.417 2.538 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cc4cccnc4[nH]3)C1)CC2 2356159893 URTFLQHWSYNQSE-NRFANRHFSA-N 376.464 2.539 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)cc1 110597739 NLHHZCUKJIZYCB-HOTGVXAUSA-N 398.406 2.773 0 50 GFAA Cc1cccc2c1[C@H](NC(=O)c1cc(COc3ccccc3F)[nH]n1)C(=O)N2 102162755 FSEKJRUXVDHQCQ-SFHVURJKSA-N 380.379 2.859 0 50 GFAA O=C(Cn1ccnc1)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67562662 OWQMKJGGOFSHQI-UHFFFAOYSA-N 384.823 2.725 0 50 GFAA CC(C)c1cccc(NC(=O)NCc2ccc(S(=O)(=O)CCO)cc2)c1 252490146 KKFTYISPARCLAQ-UHFFFAOYSA-N 376.478 2.898 0 50 GFAA Cc1c(/C=C/C(=O)O)c(=O)n(Cc2ccccc2)c(=O)n1Cc1ccccc1 759407 UIGKFKSARWUEBJ-OUKQBFOZSA-N 376.412 2.513 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2CCc3c(nc(-c4ccncc4)[nH]c3=O)C2)c1 71405710 XNQNHOKEBMEHFT-UHFFFAOYSA-N 380.835 2.992 0 50 GFAA C[C@@H](C(=O)N1CCCc2c(Cl)ccc(Br)c21)S(C)(=O)=O 332707133 XHCMKUHYIJOKEE-QMMMGPOBSA-N 380.691 2.815 0 50 GFAA O=C(C1CCN(c2cnccn2)CC1)N1CC[C@@H](COCc2ccccc2)C1 172813044 YRGOYVFPYBBRIV-LJQANCHMSA-N 380.492 2.758 0 50 GFAA CCCCN1C(=O)CC[C@@H](C(=O)N2CCCNCC2)[C@@H]1c1ccccc1OC 236772969 DLXWGVRQVUXGBE-NQIIRXRSSA-N 387.524 2.597 0 50 GFAA CCCN(C(=O)c1nnn(C2CCNCC2)c1C)[C@H]1C[C@@H](OCC)C1(C)C 236752518 QXFYXUPEBFPCLM-DLBZAZTESA-N 377.533 2.567 0 50 GFAA Cn1cc(N2CCC[C@@H](NC(=O)NCCc3csc(C(C)(C)C)n3)C2)cn1 133143276 SRCSBHFJQFEIEN-CQSZACIVSA-N 390.557 2.685 0 50 GFAA Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)Nc1cnn([C@@H]2CCOC2)c1C 451100133 QGGKIHAAEHHICS-GFCCVEGCSA-N 399.856 2.614 0 50 GFAA COc1cc(-c2nccn2-c2cccc(-n3cnnn3)c2)cc(OC)c1OC 71552256 OJAJRPYMNURLND-UHFFFAOYSA-N 378.392 2.541 0 50 GFAA Cc1nnc(CNC(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)o1 72122602 VIEMKLWJIWPDAG-UHFFFAOYSA-N 390.487 2.706 0 50 GFAA Cc1ccc2[nH]c(=O)cc(C(=O)N[C@H]3CC(=O)N(CC4CCCCC4)C3)c2c1 72131823 DNDKHPRCBWNKBV-INIZCTEOSA-N 381.476 2.748 0 50 GFAA CNc1nc(C)cc(NCc2cc3c(nc2OC)CN(C2CCCC2)C3=O)n1 71755239 CXWZZTDLBNJYMA-UHFFFAOYSA-N 382.468 2.741 0 50 GFAA CO[C@@H]1COC[C@H]1n1cc(C(=O)N(C)C2c3ccccc3-c3ccccc32)nn1 289317354 WTZZUWWQYFTZDF-WOJBJXKFSA-N 390.443 2.706 0 50 GFAA CNC(=O)CCN(C)C(=O)NC[C@H](c1ccc(Cl)cc1)N1CCCCC1 426544260 BVPPCTGJYWXSLW-QGZVFWFLSA-N 380.920 2.645 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)nn1 179538779 LSWLHJKRPPSGJG-INIZCTEOSA-N 394.454 2.629 0 50 GFAA COc1ccc(CN(C[C@H]2CCCO2)C(=O)Nc2cccn3cnnc23)cc1 96133807 XAYYEDISFPZIST-QGZVFWFLSA-N 381.436 2.951 0 50 GFAA CCS(=O)(=O)c1ccc(CNC(=O)[C@@H]2CCN(C3CCCCC3)C2)cc1 181366697 AYHDIHGGFXCWRN-QGZVFWFLSA-N 378.538 2.751 0 50 GFAA O=C(NCc1ccco1)c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1 239165254 NTXAEMXTNHARBB-IPJCAIGPSA-N 388.423 2.767 0 50 GFAA CCS(=O)(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2 91915491 BYRXPAPYIDERAK-GOSISDBHSA-N 376.522 2.597 0 50 GFAA COCCn1c(NC(=O)c2ccc(C(=O)NC3CC3)cc2)nc2ccccc21 184067884 WZTUUONBEPZISS-UHFFFAOYSA-N 378.432 2.827 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)CCCc1cccs1 266334302 KWIAGFSWLAHERR-AWEZNQCLSA-N 381.523 2.882 0 50 GFAA COCCOc1ccccc1NC(=O)N1CCC[C@@H](C(=O)N2CCCC2)C1 299769920 KGEFOVPSKXZIGN-MRXNPFEDSA-N 375.469 2.578 0 50 GFAA O=C1CN(Cc2cnn(-c3cccc(F)c3)c2)CCN1CCc1ccccc1 826621192 AGRDXHHHHFXHMW-UHFFFAOYSA-N 378.451 2.898 0 50 GFAA O=C(NCc1noc(C2CC2)n1)c1ccccc1S(=O)(=O)Cc1ccccc1 828182609 JLLZIDREGNUVRN-UHFFFAOYSA-N 397.456 2.851 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)[C@H]1C[C@@H]1c1ccccc1)CC2 1565505564 NJQDBHOKQOOYQD-RTWAWAEBSA-N 397.563 2.973 0 50 GFAA Cc1nccn1C[C@@H]1CCCN1S(=O)(=O)c1cccc2c1OC(C)(C)C2 192638534 UNXTXTUYURZCCG-INIZCTEOSA-N 375.494 2.758 0 50 GFAA CC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 193520545 HKVHNNRZKDVOSD-GUDVDZBRSA-N 390.842 2.666 0 50 GFAA COc1ccc(CN(C)[C@@H]2C[C@@H]3C[C@H](N(C)C)C[C@@H]3C2)cc1OCC(=O)O 1529181594 RUGJSUIRMRPTPP-USTZCAOPSA-N 376.497 2.709 0 50 GFAA O=C(c1ccc(Cn2ccnc2)o1)N1C[C@@H]2CNC[C@]2(CCc2ccccc2)C1 1772703151 GXNFPHPAVGWDRO-WMZHIEFXSA-N 390.487 2.819 0 50 GFAA COC(=O)c1cccc(CN2CCN(C(=O)c3ccc(C)s3)CCC2=O)c1 12037825 VMMQMTKDTKNRMI-UHFFFAOYSA-N 386.473 2.718 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)c2coc(Cn3cnc4ccccc43)n2)n1 12448341 LQESSMBWSUGIBN-CQSZACIVSA-N 378.436 2.704 0 50 GFAA COc1ccccc1CCNC(=O)[C@@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12707440 QOLAYUYSONMAAF-GOSISDBHSA-N 384.451 2.932 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(Cc4cnc(C)nc4)C3)C2=O)c1 12836577 RNQDXFLZXCEVRT-JOCHJYFZSA-N 380.492 2.808 0 50 GFAA O=C1CCN(C(=O)c2cnn(-c3ccccc3)c2)CCN1Cc1cccc(F)c1 15002663 UHSKCPAPXKMUGJ-UHFFFAOYSA-N 392.434 2.886 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2ccccn2)cc1C(=O)N1CCCC1 16649308 NXINTYZODJPNGU-UHFFFAOYSA-N 391.518 2.518 0 50 GFAA O=C(NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12)c1ccccc1F 169776308 VOSUIUQZVCJLGV-UHFFFAOYSA-N 378.367 2.726 0 50 GFAA Cc1cccc(OCC(=O)N2CCN(c3cc(C(F)(F)F)ncn3)CC2)c1 169779299 XYJGUCSMUJUOCN-UHFFFAOYSA-N 380.370 2.531 0 50 GFAA CCn1nc(-c2nc(Cc3ccccc3OC)nn2-c2ccnn2C)cc1C 1857674912 CTKCCLVCEBGDEN-UHFFFAOYSA-N 377.452 2.792 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCC[C@@]3(CCc4c(O)nc(N(C)C)nc43)C2)c1 1857696749 AZSDCGBPKXBEFE-HSZRJFAPSA-N 394.519 2.914 0 50 GFAA Cc1ccc(C)c(OCC(=O)N2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c1C 1857734807 SHCHMIKXUVPHKN-SVMVAKDDSA-N 386.492 2.575 0 50 GFAA CNC(=O)c1ccc(CN2C[C@@H]3CC[C@H]2CN(Cc2ccc(OC)cc2)C3)o1 247872509 DZPUQLIWFIVCIM-MSOLQXFVSA-N 383.492 2.744 0 50 GFAA CN(Cc1cccnc1)Cc1cccc(-c2nc(C3CCNCC3)cc(=O)[nH]2)c1 23380206 MGIONHAQQYLXIK-UHFFFAOYSA-N 389.503 2.931 0 50 GFAA O=C1c2ccccc2CCN1CCNC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1 886093711 DFDAPBNWCILWCR-FQEVSTJZSA-N 397.519 2.676 0 50 GFAA C[C@@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccnn1CC1CC1)[C@@H]1COc2ccccc21 888101624 KDDIXWHTSWVRLC-GCQDIAHQSA-N 396.491 2.987 0 50 GFAA O=C(c1ccccc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1cnc(O)c(Cl)c1 1073305976 LPAQSYCBNQNSSL-CJNGLKHVSA-N 385.851 2.817 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CC[C@@](CO)(C(=O)O)C1 2325803216 YHNJEQLABUXJMF-MIZPHKNDSA-N 395.455 2.665 0 50 GFAA COC(=O)c1cccc(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1 715335 NLBYKYJKKDVASV-KRWDZBQOSA-N 380.400 2.733 0 50 GFAA Cc1cc(N(CC(=O)NC2CCCC2)S(C)(=O)=O)ccc1Br 1057670 VNNHFVFISJOBRX-UHFFFAOYSA-N 389.315 2.582 0 50 GFAA CCOc1ccccc1CNC(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1ccccc1C 2356137672 VBGPKDCYUDOENY-RTWAWAEBSA-N 382.460 2.608 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)Cc3cn(C)nc3C)C2=O)cc1 2356143769 WHXOBNDGLLLYEL-JOCHJYFZSA-N 380.492 2.768 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@H](C)CC3 4310744 IZCPPOVZLXYGBM-IUODEOHRSA-N 387.455 2.568 0 50 GFAA COC(=O)CSc1nnc(CNC(=O)OC(C)(C)C)n1-c1ccccc1 4858124 BWTVGNSUWOIVPZ-UHFFFAOYSA-N 378.454 2.557 0 50 GFAA COC(=O)c1cccc(Nc2nn3c(=O)c4cc5c(cc4nc3s2)OCO5)c1 8591920 MIXNLPOWXZNRCK-UHFFFAOYSA-N 396.384 2.563 0 50 GFAA COc1ccc([C@H](NC(=O)Nc2ccc(OC)c(OC)c2)C(=O)O)c(OC)c1 225486867 RYKYNTYYLVZTMP-KRWDZBQOSA-N 390.392 2.668 0 50 GFAA C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)c2ccccc2-n2cccn2)CC1 133560800 WSOYMCSHNXRLJZ-RTBURBONSA-N 381.524 2.503 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)C[C@@H]1N 418930136 AZPGTSHFZARFLM-CCKFTAQKSA-N 385.895 2.546 0 50 GFAA O=C(O)c1cnc2c(c1)n(Cc1ccccn1)c(=O)n2Cc1ccc(F)cc1 55199134 PEPCZPSSLGKAFN-UHFFFAOYSA-N 378.363 2.527 0 50 GFAA CCc1cn[nH]c1C1CCN(C(=O)c2sc3ncn(C)c(=O)c3c2C)CC1 67947955 DAXWBHHHRAGNSJ-UHFFFAOYSA-N 385.493 2.609 0 50 GFAA Cc1nn(-c2ccccc2F)c(C)c1[C@H]1COCCN1CC(=O)N(C)C1CC1 329372690 JNUXHKUAQXVSCX-LJQANCHMSA-N 386.471 2.622 0 50 GFAA COc1ccc(CN2CCN(c3nc(C)cnc3C)C[C@H]2CCO)c(C)c1C 72431118 RLYWLZUVZGZXPJ-HXUWFJFHSA-N 384.524 2.792 0 50 GFAA Cc1ccccc1CCNC(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71662551 PKOGAOWOSKWZTB-NRFANRHFSA-N 397.563 2.767 0 50 GFAA Cc1c(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)nnn1C1CCNCC1 237745711 UROCKNUJJXMJIC-UHFFFAOYSA-N 379.468 2.907 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@@H](c3ccsc3)C2)n(-c2ccccc2)n1 237981112 BGVOBCQKTDFZQI-QGZVFWFLSA-N 383.429 2.846 0 50 GFAA CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@@H](C)C(=O)Nc1nc(C)c(C)s1 157837752 BLHWYFLZPWJZJI-LBPRGKRZSA-N 385.493 2.846 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)[C@H](Oc2ccc(F)c(F)c2)c2ccccc2)CCO1 262465263 XIHGBRYFZUBVNF-DNVCBOLYSA-N 391.370 2.787 0 50 GFAA CN1Cc2ccccc2[C@H](NC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 378277622 OIRBASNJFUJJCH-WIYYLYMNSA-N 395.478 2.981 0 50 GFAA CCc1cnc(CCNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)s1 173807425 WELAXEQDZFWYCI-UHFFFAOYSA-N 379.507 2.501 0 50 GFAA C[C@H]1CCc2c(sc(NC(=O)COCC(=O)O)c2C(=O)NC2CCCC2)C1 17080623 MHEFNRBBYXDBKZ-NSHDSACASA-N 394.493 2.585 0 50 GFAA Cn1cc(NC(=O)Cn2ccc3cc(-c4ccc5c(c4)OCO5)ccc32)nn1 48234130 KAPVPOPPKOAQEI-UHFFFAOYSA-N 375.388 2.804 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC(c2nccn2Cc2ccccn2)CC1 95528144 DXCFRPMWHNIJOY-UHFFFAOYSA-N 386.459 2.994 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95530533 WPENIBZOANSMLW-GXTWGEPZSA-N 377.416 2.685 0 50 GFAA O=C(CN1CCN(Cc2cccc(F)c2)CC1)Nc1ccc2nsnc2c1 22752324 WGBZCQBZDJAIBB-UHFFFAOYSA-N 385.468 2.587 0 50 GFAA Cc1nc(-c2cc3c(s2)CCN(C(=O)[C@@H]2CCN(C)C(=O)C2)C3)cs1 180269247 XRSMJMLBXXIRTA-GFCCVEGCSA-N 375.519 2.933 0 50 GFAA CC(C)CCN1CCC2(CC1)CCN(C(=O)Cc1cncs1)C[C@@H]2CO 97394051 VVDWUIWEGJROJX-QGZVFWFLSA-N 379.570 2.655 0 50 GFAA CNc1cc(C)nc(N2CCC[C@@]3(CCC(=O)N(Cc4ccccn4)C3)C2)n1 91655907 SSYMDBFFCOUYME-OAQYLSRUSA-N 380.496 2.631 0 50 GFAA CSc1ccc2c(C)cc(N3CCC4(CC3)NC(=O)C[C@@H]4C(=O)O)nc2c1 95386225 GEFFBKUXDDYAOZ-OAHLLOKOSA-N 385.489 2.825 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N(C)C[C@@H]3CCCC[C@H]3O)CC2)oc1C 182850448 OIDDBNFOPXESRK-RBUKOAKNSA-N 392.544 2.696 0 50 GFAA CC[C@H](NS(=O)(=O)c1cc2c3c(c1)CC(=O)N3CCC2)c1nc(C)cs1 183628605 CMVCDAZLLJZKAC-HNNXBMFYSA-N 391.518 2.716 0 50 GFAA CCOc1cc(NC2CCN(C(=O)c3cc(-c4ccncc4)on3)CC2)ncn1 183980075 JMONDAPWPMQOCG-UHFFFAOYSA-N 394.435 2.642 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)NCC2(Cn3ccnc3C)CC2)CC1 534634300 XRLPQWWEYISHAJ-UHFFFAOYSA-N 382.512 2.597 0 50 GFAA COc1cccc(-c2cc3c(=O)n(C[C@@H](O)c4cccc(OC)c4)ccn3n2)c1 263619154 XFTDEBPFQFHUOO-OAQYLSRUSA-N 391.427 2.914 0 50 GFAA O=C(c1nnn2c1CO[C@H](c1ccc(F)cc1)C2)N1CCc2ccccc2C1 263618499 UCNXXCYVBDKJIJ-IBGZPJMESA-N 378.407 2.887 0 50 GFAA O=C(Cc1ccccn1)N1CCCN(C(=O)Cc2ccc(F)cc2Cl)CC1 374459888 BYASETDSRPYYNE-UHFFFAOYSA-N 389.858 2.720 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccn1)C2 1565506869 RECHYVDAUDFRCS-GJZGRUSLSA-N 387.915 2.768 0 50 GFAA Cc1cccc(N2CCN(CC(=O)Nc3cccc(C(=O)N(C)C)c3C)CC2)c1 952971476 HBTFGUIBQXPCIW-UHFFFAOYSA-N 394.519 2.766 0 50 GFAA Cc1cccc(N2CCN(CC(=O)N(Cc3c(C)nn(C)c3C)C3CC3)CC2)c1 1506426930 VYHPDKKGHTZZDK-UHFFFAOYSA-N 395.551 2.659 0 50 GFAA C[C@H](C(=O)N1CCCN(Cc2cccs2)CC1)n1cnc2ccccc2c1=O 1506415179 MKKVQQPUEYWLQO-MRXNPFEDSA-N 396.516 2.754 0 50 GFAA Cc1ccc(C)c([C@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)c1 1506422211 OZEXOWZMOHNJTF-HXUWFJFHSA-N 381.476 2.853 0 50 GFAA C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1cc(=O)n(-c2ccccc2)[nH]1 1529174793 XZIJJTDIVKWWSU-CQSZACIVSA-N 379.416 2.770 0 50 GFAA CN(C)CCc1nnc(NC(=O)c2ccc(-c3noc(C4CC4)n3)cc2)s1 1529191028 SBQTXLBYSTYJFL-UHFFFAOYSA-N 384.465 2.822 0 50 GFAA CC(C)(Oc1cccc2ccccc12)C(=O)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772712083 HFCHVFQBWNEYIC-ZHRRBRCNSA-N 383.444 2.947 0 50 GFAA CN1CCC(N2C[C@H]3CN(Cc4cc[nH]n4)C[C@@]3(CCc3ccccc3)C2)CC1 1772817609 GLHMFZCYLCIZCH-QPPBQGQZSA-N 393.579 2.871 0 50 GFAA Cc1noc(CNC(=O)Cc2c(-c3ccccc3)oc3c(=O)cc(C)oc23)n1 1772491257 DXNWDEDZJUKOTE-UHFFFAOYSA-N 379.372 2.912 0 50 GFAA Cc1cccc(Nc2ccc(N3CCN(C(=O)Cc4ccccc4)CC3)nn2)n1 11697211 UCXMSXRHOPFRRF-UHFFFAOYSA-N 388.475 2.815 0 50 GFAA COCCN1C(=O)N(CCc2ccccc2)C2(CCN(CC(C)C)CC2)C1=O 14754731 NLXSOMRGGODNBL-UHFFFAOYSA-N 387.524 2.630 0 50 GFAA CN(Cc1ccon1)C(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 14959064 AXMKAPFNIRMXLC-UHFFFAOYSA-N 383.448 2.727 0 50 GFAA Cc1ccn(-c2ccc(NCCNC(=O)c3cccc(C(F)(F)F)c3)nn2)n1 19924078 COHFZZRZLPIOIX-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(Cc3cc[nH]n3)CC1)OCC2)N1CCCC1 1857684832 GIUSADNIOFNVRZ-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA O=C(CCOc1ccccc1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857709507 BQFYZSQVCSSRDD-VIZSFHNOSA-N 392.455 2.757 0 50 GFAA Cc1c(C(=O)N(CCC(=O)O)C[C@H]2CCCO2)cnn1-c1ccccc1Cl 237731396 BWDCGLRUEMSMBO-CQSZACIVSA-N 391.855 2.930 0 50 GFAA COC(=O)/C=C/c1ccc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)o1 821416175 XFKPCJPCMUDJAI-PXUDHTSWSA-N 384.388 2.836 0 50 GFAA O=C(Nc1ccc2nc(Cc3ccc(F)cc3)[nH]c2c1)[C@@H]1CCS(=O)(=O)C1 864097002 HLZUMKADEBGMQQ-CYBMUJFWSA-N 387.436 2.666 0 50 GFAA C[C@H](NC(=O)N1CCC2(C1)Oc1ccccc1O2)c1ccc2c(c1)NC(=O)CO2 888102476 RVHVJVKNKSDBFZ-ZDUSSCGKSA-N 395.415 2.662 0 50 GFAA O=C(NCc1cccc(F)c1)N1CCCS(=O)(=O)C[C@@H]1c1ccccc1 891770022 FNIUTRRQQPEGER-GOSISDBHSA-N 376.453 2.897 0 50 GFAA CC(C)CN(CCc1ccccc1)C(=O)Cn1nc(O)c2ccccc2c1=O 2325728776 WGTCXHAJSAPMPQ-UHFFFAOYSA-N 379.460 2.829 0 50 GFAA Cc1cccnc1Oc1ccc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc1 2325785553 DLQJOOWSETXRRH-PWIZWCRZSA-N 392.459 2.948 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1cccc(F)c1 815607 KANUCCGZDGNASN-INIZCTEOSA-N 378.425 2.535 0 50 GFAA CCC[C@@]1(CO)CN(Cc2ccccc2OCCN2CCCCC2)CC[C@H]1O 2356138639 NWOUWRLSUJALLO-PKTZIBPZSA-N 390.568 2.897 0 50 GFAA Cc1ccc(N(CC(=O)NCCSc2ccccc2)S(C)(=O)=O)cc1 2982797 QYQMMLUICHWAPI-UHFFFAOYSA-N 378.519 2.670 0 50 GFAA COc1ccc(-c2cc(=NC(=O)CCc3cc(Cl)no3)[nH][nH]2)c(OC)c1 2356164371 QLYRELLHHMDEPQ-UHFFFAOYSA-N 376.800 2.729 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1S(C)(=O)=O 134197034 AUVWQUYXEFCIAK-SFHVURJKSA-N 378.538 2.743 0 50 GFAA Cc1nc(CN(C)Cc2c(C(=O)N3CCOCC3)nc3c(C)cccn23)cs1 20450406 HMNMTWOKCRXYFK-UHFFFAOYSA-N 399.520 2.512 0 50 GFAA CN(C)C(=O)CNc1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)cn1 67740545 MGPVPZOAVAQOTH-SFHVURJKSA-N 380.492 2.992 0 50 GFAA CC(C)c1cc(N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)ncn1 71755388 BBXZBDCRIJZVRY-GOSISDBHSA-N 385.556 2.903 0 50 GFAA O=C1CC[C@]2(C(=O)N3CC[C@@H](Oc4ccccn4)C3)Sc3ccccc3N12 330013761 AGKVPVWQJXUMKC-JLTOFOAXSA-N 381.457 2.690 0 50 GFAA C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)Nc2cccc(C(N)=O)n2)CC1 127464883 NXYRTGRRBCQBGF-ZDUSSCGKSA-N 387.871 2.745 0 50 GFAA CCc1ccc(N2CCN(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)CC2)cc1 363300628 WXRQBFUOCIRPER-FQEVSTJZSA-N 383.496 2.979 0 50 GFAA Cn1c(-c2ccc(CN3CCc4nc[nH]c4[C@H]3C(=O)O)o2)nc2ccccc21 72458306 UHTCBAGHIKXXCE-SFHVURJKSA-N 377.404 2.740 0 50 GFAA NC(=O)c1ccnc(N2CCC[C@]3(CCC(=O)N(Cc4ccccc4)C3)C2)c1 72408605 XTMAURASCCITHH-QFIPXVFZSA-N 378.476 2.590 0 50 GFAA COc1ccc2c(c1)CN(C(=O)c1nc(O)nc(O)c1N)[C@@H](C1CCCCC1)C2 368548760 KSJGYQNBLUUZTJ-MRXNPFEDSA-N 398.463 2.626 0 50 GFAA O=C1Nc2ccccc2C[C@H]1CCC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 238025982 XGYOKSGNVWCOIR-VQIMIIECSA-N 378.428 2.616 0 50 GFAA COc1ccc(NC(=O)Cc2noc([C@@H]3Cc4ccccc4N3C(C)=O)n2)cc1 373195478 JIUOHSPBPFFBPS-SFHVURJKSA-N 392.415 2.910 0 50 GFAA O=C(c1cnc2ccccn2c1=O)N1CCC[C@@H](COc2ccc(F)cc2)C1 77377392 HOIQQOULDUBDHW-OAHLLOKOSA-N 381.407 2.765 0 50 GFAA COc1ccc(C2(C(=O)N3CCN(Cc4cccc(C)c4)C(=O)C3)CC2)cc1 77357628 DHIYZAPWEHHCDA-UHFFFAOYSA-N 378.472 2.906 0 50 GFAA CCc1nc(CN2CCC[C@@H](NC(=O)[C@@H](C)Cc3ccc(OC)cc3)C2)no1 378275173 UNKHPZDEFZEQTN-DOTOQJQBSA-N 386.496 2.600 0 50 GFAA CC(=O)N1CCc2ccc(S(=O)(=O)N3c4ccccc4C[C@@H]3C)cc2CC1 283774386 BMWIKSPLEQRHCW-HNNXBMFYSA-N 384.501 2.774 0 50 GFAA Cc1cc(C(=O)N(C)CC23CC4CC(CC(C4)C2)C3)nc2nc(O)[nH]c(=O)c12 173893384 XLLFGUAGXXJGEF-UHFFFAOYSA-N 382.464 2.621 0 50 GFAA COCCn1ccc2c(cnc3c(-c4ccc(F)cc4)c(COC)nn32)c1=O 40397070 KXCYXTZMFVNKCZ-UHFFFAOYSA-N 382.395 2.643 0 50 GFAA O=C1NC(=O)c2cc(S(=O)(=O)N3CC4(CCCC4)c4ccccc43)ccc21 176521125 HHVQHQMUAPEBAW-UHFFFAOYSA-N 382.441 2.591 0 50 GFAA CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)C2CCN(CC(F)F)CC2)CC1 288023912 XTBXTUNFWGHYGX-LJQANCHMSA-N 394.510 2.872 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)o1 82097467 NJAFDYREKJUCBW-NRFANRHFSA-N 382.464 2.731 0 50 GFAA COc1ccccc1C(=O)NCC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 290667300 OIJTUGDLLFNYLR-MRXNPFEDSA-N 398.463 2.829 0 50 GFAA Cc1nc(O)cc(CNC(=O)c2ccc(-c3ccc(OC(C)C)nn3)cc2)n1 426388347 CBSKMPOMSCFHGR-UHFFFAOYSA-N 379.420 2.665 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cc(F)c(F)c(F)c3)n2)cc1 49549669 GNWCPVJFIXTCQI-UHFFFAOYSA-N 389.333 2.975 0 50 GFAA CCn1nc(C)c([C@@H](C)NC(=O)N(C)Cc2nc(-c3cccnc3)no2)c1C 426534131 XFJPTYPHZQNGIU-GFCCVEGCSA-N 383.456 2.867 0 50 GFAA O=C(Cc1cccs1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 225331442 PUQLWUVORFOKDC-UHFFFAOYSA-N 381.505 2.561 0 50 GFAA O=C(NCCOc1ccccc1)N1CCCN(C2Cc3ccccc3C2)CC1 426485487 DIGLXEMPGPCIMF-UHFFFAOYSA-N 379.504 2.950 0 50 GFAA CCSCCC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91871821 PGBFHARWLKIOOB-UHFFFAOYSA-N 375.538 2.956 0 50 GFAA Cc1cnc(-c2ccc(C(=O)N[C@@H](C)Cc3cnccn3)cc2)nc1N(C)C 426690784 YIAORMNETZIXKS-HNNXBMFYSA-N 376.464 2.669 0 50 GFAA CNc1nc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)cs1 95367832 USFQXHTUNHQFQC-WMLDXEAASA-N 382.533 2.889 0 50 GFAA O=C1NCCc2c1sc1ccc(C(=O)N3CCC(c4ncon4)CC3)cc21 426529327 OGMWRQPBSFCWHU-UHFFFAOYSA-N 382.445 2.590 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCN(Cc2ccncc2)CC1 95352487 IFEIJURTHVXJGM-GOSISDBHSA-N 375.856 2.687 0 50 GFAA CC[C@@H](C)NC(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 95512167 DZHJQBIRILZWLQ-GFCCVEGCSA-N 388.917 2.671 0 50 GFAA CC(=O)[C@@H]1[C@@H]2C(=O)N(C(C)(C)C)C(=O)[C@H]2[C@H]2C=Cc3ccc4cccnc4c3N12 245310322 IDRVIQXMNRIGPG-SFNKJDCFSA-N 389.455 2.808 0 50 GFAA C[C@H]1CCN(C(=O)NCCOc2ccc(Cl)c(Cl)c2)CCS1(=O)=O 298211363 USSOOAMHWBCNGL-NSHDSACASA-N 395.308 2.591 0 50 GFAA Cc1nccc(N2CCN([C@H](C)C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)n1 183798847 UDHTUVXKXBDNKI-CYBMUJFWSA-N 393.413 2.953 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)cc1 252537094 KHENEYZEEQJVHN-YQQAZPJKSA-N 391.493 2.528 0 50 GFAA CC[C@H](NC(=O)N1CCC(C(=O)NCc2ccccn2)CC1)c1cccnc1 534583399 RTINNQSDISHZCL-IBGZPJMESA-N 381.480 2.666 0 50 GFAA Cc1cccc(CN2CCOC3(CCN(C(=O)Cc4cccs4)CC3)C2)n1 827921337 OOEILWDNRIBXCJ-UHFFFAOYSA-N 385.533 2.888 0 50 GFAA Cc1ccc(C(=O)NC(C)C)cc1NC(=O)c1nn(C)c(=O)c2ccccc12 821810221 SSDXMCVMNGEYBJ-UHFFFAOYSA-N 378.432 2.632 0 50 GFAA CN1C(=O)C[C@@H](C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)c2ccccc21 952975443 NMYADSXGNRXEMV-GOSISDBHSA-N 377.444 2.597 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](CC(=O)O)c1ccc(C(C)C)cc1 275372086 YSIBTXWTNMGHEA-MRXNPFEDSA-N 379.482 2.655 0 50 GFAA Cc1nn(-c2ccccc2)cc1C(=O)N[C@@](C)(COc1ccccc1)C(=O)O 170044603 FHYMXHKUIOAMHM-NRFANRHFSA-N 379.416 2.833 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)c3oc4ccccc4c3CN(C)C)C2)n(C)n1 278471747 UNCKZBUZRZKNMS-MRXNPFEDSA-N 395.507 2.935 0 50 GFAA CC(C)Cc1ccc(S(=O)(=O)N2CCC([C@H](O)c3ncc[nH]3)CC2)cc1 170619751 RWMNMNBVTHQGFG-SFHVURJKSA-N 377.510 2.743 0 50 GFAA CNS(=O)(=O)c1ccc(CNC(=O)N(C)CC2(c3ccccc3)CC2)s1 187271114 KNMNXDRAYLBCKY-UHFFFAOYSA-N 393.534 2.529 0 50 GFAA O=C(O)C1CCC(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)CC1 194442455 RYXLULNVCANATG-NWHVRFAMSA-N 382.819 2.592 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N1CCCN(C(=O)c3ccco3)CC1)n2C 1506410827 UPPPYQHDGTYMNP-UHFFFAOYSA-N 381.432 2.768 0 50 GFAA COc1ccc(CN2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)c(Cl)c1OC 1529153539 FEULMLHDRPVPMR-BEFAXECRSA-N 382.888 2.728 0 50 GFAA Cc1ncn(CCNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)c1C 1772813448 AWCJVWBCLHMSGG-INIZCTEOSA-N 381.505 2.940 0 50 GFAA CCOc1ccccc1NC(=O)N1CCCN(C(=O)c2cc(C)n(C)n2)CC1 1775984090 HMNZTAFXOLIJPW-UHFFFAOYSA-N 385.468 2.507 0 50 GFAA O=C(O)c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 5049642 NUMNLSPIGAJFCF-UHFFFAOYSA-N 388.445 2.812 0 50 GFAA COC[C@H](C)NC(=O)c1sc2ncnc(NCCN3CCCCC3)c2c1C 11783240 KPCJTZLAGYCRKN-ZDUSSCGKSA-N 391.541 2.662 0 50 GFAA C[C@H]1CCCCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 11934625 MCVQNPSFXFLYLG-HNNXBMFYSA-N 380.510 2.504 0 50 GFAA CC(C)N1CCC(N2CCC[C@H](C(=O)NCc3cnc4ccccn34)C2)CC1 12206934 QLIGSTKVJZSKMJ-SFHVURJKSA-N 383.540 2.535 0 50 GFAA COc1ccc(CNCc2cc(C)no2)cc1OC[C@@H](O)CN1CCCCC1 12386019 PMBPVSPXAJSQML-SFHVURJKSA-N 389.496 2.507 0 50 GFAA O=C(NCc1ccccn1)c1ccc(OC2CCN(C[C@H]3CCOC3)CC2)cc1 12435932 YZQOGPYEPVJGER-GOSISDBHSA-N 395.503 2.891 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NC1CCCCC1)C2 14532914 PHAXLGAFNSORFD-INIZCTEOSA-N 376.570 2.872 0 50 GFAA CN1CCCN(C(=O)c2nc3sccn3c2CN2CCCCCC2)CC1 15077455 AEAVSAIAYIWODQ-UHFFFAOYSA-N 375.542 2.550 0 50 GFAA CCCCc1nnc(NC(=O)CSCc2cc(=O)n3ccsc3n2)s1 15942450 SIAVHOMXNVICAC-UHFFFAOYSA-N 395.535 2.822 0 50 GFAA O=C(OCc1ccccc1)N1CC[C@H](c2nc(-c3ccnc4ccnn34)no2)C1 813348950 PLIMVOYCLMFANE-HNNXBMFYSA-N 390.403 2.905 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)[C@H]1CC(=O)OC13CCCC3)CC2 1857667673 LVSZADIBPKFMPF-GOSISDBHSA-N 393.487 2.890 0 50 GFAA CN1CCn2nc(-c3nc(C4CCCC4)nn3Cc3ccccc3)cc2C1=O 1857672486 FGIYDXAEPUBVBZ-UHFFFAOYSA-N 376.464 2.933 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c(C)s1 1857681619 AYYCHMNEKXIHBZ-OKZBNKHCSA-N 392.546 2.858 0 50 GFAA Cc1ncccc1CN1CC[C@@H](O)[C@]2(CCCN(C(=O)CCC(F)(F)F)C2)C1 1857691335 GVFWHSNFKBSERA-IEBWSBKVSA-N 399.457 2.908 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857708394 RFRMHQKEVATYGC-LJQANCHMSA-N 381.542 2.889 0 50 GFAA Cc1ncccc1C(=O)N1C[C@@H]2OC(=O)N(CCc3cccc(Cl)c3)[C@@H]2C1 211646918 JBVYDPYEIQOJAG-MSOLQXFVSA-N 385.851 2.931 0 50 GFAA N[C@H]1CCN(C(=O)CSc2cn(Cc3ccccc3)c3ccccc23)C[C@@H]1O 216742277 DGYAUUMXNPOHKY-ICSRJNTNSA-N 395.528 2.702 0 50 GFAA Cc1cccc(CN2CC[C@H](N3CCN(c4ccccc4F)CC3)[C@@H](O)C2)c1 247853172 BKGAKOYAZSXPKV-GOTSBHOMSA-N 383.511 2.892 0 50 GFAA Cc1cc(N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)nc(N2CCCC2)n1 1704311383 HFQJZDIHTVEGPD-QFIPXVFZSA-N 393.539 2.726 0 50 GFAA N[C@@H]1CCO[C@H](C(=O)N2C[C@H](c3ccccc3)O[C@H](c3ccc(F)cc3)C2)C1 1875276954 PWQSXBADQCMPAK-MHTWAQMVSA-N 384.451 2.973 0 50 GFAA Cc1cc2oc(=O)cc(CN3C[C@@H]4C[C@H](C3)Cn3c4cccc3=O)c2cc1O 23127133 ROVPUTKHWZSOSC-ZBFHGGJFSA-N 378.428 2.588 0 50 GFAA COc1ccc(OC)c(NC(=O)C2=C(C)NC(=S)N[C@@H]2c2ccc(O)cc2)c1 909921 RXBVWTVLVGVMMP-GOSISDBHSA-N 399.472 2.841 0 50 GFAA C[C@@H]1C[C@]2(C[C@@](C)(C(=O)CSc3nc4ccccc4s3)OC2=O)C(=O)O1 1124983 UBMQUKPOVZTBAS-APEXYLGGSA-N 391.470 2.985 0 50 GFAA aggregator O=C(O)c1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cs2)cc1 4953510 HGWNGJRDZXRRMP-UHFFFAOYSA-N 394.474 2.873 0 50 GFAA CC[C@H]1CCCN(C(C)(C)CNC(=O)Cc2csc(N3CCCC3=O)n2)C1 110974886 SAQVANGKDCHKOD-HNNXBMFYSA-N 392.569 2.829 0 50 GFAA CC(C)c1ccc([C@@H](N)CNC(=O)c2cc(N3CCNC3=O)ccc2F)cc1 225468337 GVCYNPSKYIJISA-IBGZPJMESA-N 384.455 2.909 0 50 GFAA COc1ccc(CCN2C[C@H](NCc3cccn3-c3cccnc3)CC2=O)cc1 12448191 UJJSTXLHPYZQBC-LJQANCHMSA-N 390.487 2.814 0 50 GFAA Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)Cn3cnc(N)c4ncnc3-4)C[C@@H]1O2 101149009 GACPZBUVEBGCNP-RBOXIYTFSA-N 393.447 2.903 0 50 GFAA CCc1ccccc1NC(=O)c1ccccc1NC(=O)CCc1n[nH]c(N)n1 65382430 QVEYIGRBSCCILC-UHFFFAOYSA-N 378.436 2.773 0 50 GFAA Cc1cccc(N2CCC(N3CCN([C@H]4CN5CCC4CC5)CC3)CC2)c1C 65381152 JIZCJTOSGCCLLB-DEOSSOPVSA-N 382.596 2.984 0 50 GFAA CCCn1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)c1C 20775164 SCIULDHHTKFWQU-IBGZPJMESA-N 392.494 2.949 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CCc4ncccc4C3)nc2)on1 67724464 MSWCPSSITZMFHV-UHFFFAOYSA-N 377.448 2.910 0 50 GFAA CCS(=O)(=O)c1cccc(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c1 119390957 DLJXCZGBMUIBNZ-OAHLLOKOSA-N 390.480 2.876 0 50 GFAA Cc1nc([C@H](C)NC(=O)c2cc(COc3ccc4ncccc4c3)on2)n[nH]1 67726450 FPRROFNGBNCMMA-NSHDSACASA-N 378.392 2.719 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)COc3ccccc3O)CC2)OC1=O 77379683 RFTJBCUKPFSNQM-HNNXBMFYSA-N 376.453 2.773 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2cc(O)nc3c(Br)cccc23)C1 328596450 QPMGMKZZWFCZDK-GHMZBOCLSA-N 378.270 2.902 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2N[C@@H](C)Cn2cc(Br)cn2)cn1 328654183 XHMMFDCIJGPSBI-VBNZEHGJSA-N 382.306 2.760 0 50 GFAA CSCC(=O)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1OCc1cccnc1 72120952 ASOKKWBIQKQHAJ-RTWAWAEBSA-N 397.544 2.822 0 50 GFAA OCC[C@H]1CN(c2nc3ccccc3cc2CO)CCN1Cc1ccccc1 72453786 QSFORWDNUPNQGB-NRFANRHFSA-N 377.488 2.800 0 50 GFAA CC(C)(C)n1ncc(C(=O)N2CCC[C@H](c3ccnc(N)n3)C2)c1C(F)(F)F 331482579 ADNZFLMIPZGJFV-NSHDSACASA-N 396.417 3.049 0 50 GFAA CCc1nnsc1C(=O)Nc1ncnc2c1c(C)c(C)n2C[C@@H]1CCCO1 153531276 MBXBTBSDUKUMNX-LBPRGKRZSA-N 386.481 2.893 0 50 GFAA CO[C@@H]1CC[C@@H]2OCCN(C(=O)CCc3nc(-c4cccs4)no3)[C@@H]2C1 127351922 FUYOKUITOMSSFF-MCIONIFRSA-N 377.466 2.526 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)cc1OC(F)F 156480863 KOJFEMKDKCVRNS-AWEZNQCLSA-N 393.390 2.908 0 50 GFAA O=C(NC1CCOCC1)[C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 71771314 VHFKCNTXALTGBQ-FQEVSTJZSA-N 385.552 2.658 0 50 GFAA O=C(NC[C@H]1CNCC[C@H]1c1ccc(F)cc1)N1CCC2(CCNCC2)CC1 333478053 BRVQQDBNLJHVBU-QUCCMNQESA-N 388.531 2.694 0 50 GFAA Cn1c(C(=O)N(CC(=O)O)C2CCOCC2)cc2cc(C(F)(F)F)ccc21 237708946 RNPMCMHOYCHYSR-UHFFFAOYSA-N 384.354 2.903 0 50 GFAA CN(C)c1nc(-c2ccccn2)nc2c1CCN(C(=O)c1cccc(O)c1)C2 71708183 WGYAIDIBESWLBJ-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA Cc1ccc(CNc2ncc(S(C)(=O)=O)c([C@H]3CCCNC3)n2)c(F)c1F 72481410 QPYAWTRWEFCOQU-ZDUSSCGKSA-N 396.463 2.546 0 50 GFAA CN(C)C(=O)N[C@H]1CCCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)C1 456897313 BZDBSJINMGEHPA-HNNXBMFYSA-N 383.414 2.999 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Br)cc2N)CC1 217832940 BHSQLKLVJYCXMK-UHFFFAOYSA-N 384.274 2.724 0 50 GFAA C[C@@H](NC(=O)c1occ2c1CCOC2)c1cc(F)ccc1N1CCN(C)CC1 375715717 DNXZETBYVMQTOQ-CQSZACIVSA-N 387.455 2.734 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)cc1 174879432 PAPDVQNCOYOAEN-PMACEKPBSA-N 387.501 2.960 0 50 GFAA Cc1ccc(N2CC[C@@H](CNC(=O)C3CCN(C4CCOCC4)CC3)C2)cc1 426379598 BPWVKCUTUNKZIG-IBGZPJMESA-N 385.552 2.829 0 50 GFAA COC(C)(C)CS(=O)(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 289631128 YPUNJIJBMKNWFP-AWEZNQCLSA-N 397.472 2.810 0 50 GFAA Cc1c(O)ccc2c(CN3CCN(CCc4ccccn4)CC3)cc(=O)oc12 20721096 RQJKRFKNHHVOME-UHFFFAOYSA-N 379.460 2.562 0 50 GFAA biogenic CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2c3ccccc3OC[C@]2(C(=O)O)C1 96152623 ARDFZFVGJTZMMY-QVKFZJNVSA-N 383.448 2.729 0 50 GFAA CNC(=O)c1cc(NC(=O)NCCN2CCCc3ccccc32)ccc1OC 95508865 MLXZUJVHDKQJIE-UHFFFAOYSA-N 382.464 2.629 0 50 GFAA O=C(NCc1noc(Cc2ccccc2)n1)[C@@H](c1cccnc1)N1CCCC1 95363021 VSFQRHQJCORBCB-HXUWFJFHSA-N 377.448 2.509 0 50 GFAA Cc1nc(C)c(CC(=O)N[C@H](C)c2cnn(-c3ccccc3C)c2C)c(=O)[nH]1 92077834 UDAQPWIMXYKHSS-CQSZACIVSA-N 379.464 2.609 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)c3ccc(-c4cc[nH]n4)cc3)CC2=O)cc1 92061979 GYYWHARDHFTVRF-MRXNPFEDSA-N 376.416 2.621 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3ccc4c(c3)OCO4)C2)[nH]1 95508718 WOZRJIIMBCYXFM-AWEZNQCLSA-N 383.448 2.588 0 50 GFAA O=S1(=O)CCN(C2CCN(Cc3ccc(Cl)c4cccnc34)CC2)CC1 181741915 ZETSVSURTFWDRB-UHFFFAOYSA-N 393.940 2.583 0 50 GFAA COc1ccc2[nH]cc([C@@H](C(=O)O)N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 263585330 HMCCVEHKZOPNBK-LKBUQDJMSA-N 393.443 2.583 0 50 GFAA biogenic O=C(C1CCN(c2ncccn2)CC1)N(Cc1ccsc1)C[C@@H]1CCCO1 55036589 JYQKEFMPCGXYID-SFHVURJKSA-N 386.521 2.962 0 50 GFAA Cc1cc(N2CCN(Cc3ccc(Sc4nncn4C)o3)CC2)cc(C)n1 825145553 WNTAKGSTIPJYBB-UHFFFAOYSA-N 384.509 2.893 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)Cc2ccc3c(c2)OCO3)C1)c1cccs1 827928409 SHNRXOULSBFHSC-HNNXBMFYSA-N 386.473 2.688 0 50 GFAA Cc1noc(C)c1CO[C@H]1COCC[C@@H]1NC(=O)c1cc2sccc2[nH]1 1565517097 VSWYCXKXHWLTMO-BBRMVZONSA-N 375.450 2.938 0 50 GFAA CN(C)c1ccc(CC(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccn2)C3)cc1 1565516621 RMBLVKKBTODHDD-KNQAVFIVSA-N 378.520 2.813 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N[C@H]1CCCN(c2ncccn2)C1 952970238 UDQZERRATURLPB-AWEZNQCLSA-N 387.871 2.877 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)N[C@H](C)c2ccccc2)cc1 952980879 AZJNCKZMKMJHOH-MRXNPFEDSA-N 375.494 2.724 0 50 GFAA C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCCC2)CCN1CC(C)(C)O 186602465 FWCOZIWCJCFWAW-GOSISDBHSA-N 388.556 2.664 0 50 GFAA Cc1ccc2oc(N3CCN(C(=O)c4ccn(CC(F)F)n4)CC3)nc2c1 194105880 WSEVDDHPZOZDNN-UHFFFAOYSA-N 375.379 2.560 0 50 GFAA CN(C)c1ccnc(C(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 195135715 BOCCJYMNDKGXTD-UHFFFAOYSA-N 379.386 2.524 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2 195441558 OCMIJURCAQGRCN-OAHLLOKOSA-N 390.509 2.847 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1529099534 APJIHFUCEJWRAX-QZTJIDSGSA-N 381.432 2.705 0 50 GFAA CC(C)c1cc(CN2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)n[nH]1 11820251 RBANNNMMICDJQE-OAHLLOKOSA-N 386.500 2.542 0 50 GFAA CC(=O)c1ccccc1-c1ccc2c(c1)C[C@H](CNC(=O)CCC(=O)N(C)C)O2 12184160 FJDMNGZCBYMKFO-GOSISDBHSA-N 394.471 2.844 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@@H]1CCCN(C2Cc3ccccc3C2)C1 12203694 IKBYQXCUZGJCIY-LJQANCHMSA-N 378.472 2.706 0 50 GFAA C[C@@H]1Oc2ccc(S(=O)(=O)NC3C4CC5CC(C4)CC3C5)cc2NC1=O 12417079 MHIGFSYZFNYYRN-SYSDIAMWSA-N 376.478 2.509 0 50 GFAA CSc1ccccc1C(=O)[C@H]1CCCN(C(=O)CSc2nncn2C)C1 12430446 LZGXKCZPTZDYFE-ZDUSSCGKSA-N 390.534 2.751 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@@H](CNC(=O)c3cccnc3)C2)c(C)s1 12714222 GDZXSFKCRDAFFN-HNNXBMFYSA-N 393.534 2.591 0 50 GFAA CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3ccncc3)CC2)cc1 13331517 MYBRDRUYKCOEOD-INIZCTEOSA-N 387.505 2.742 0 50 GFAA Cc1ccc(C[C@]2(CCC(=O)NC[C@@H](C)Oc3cccnc3)CCC(=O)N2)cc1 15066687 HXBQBYLWBAZZPD-JPYJTQIMSA-N 395.503 2.945 0 50 GFAA COc1ccc(CNCCCOC(C)C)cc1OC[C@H](O)CN(C)C(C)C 15074127 SHZVYJLUCJZHIV-LJQANCHMSA-N 382.545 2.680 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3nccs3)CC2)c1 16606965 WBUXSJQFXYXFSH-UHFFFAOYSA-N 379.507 2.799 0 50 GFAA CCN1CCN(Cc2nc3cc(NC(=O)c4ccccc4)ccc3n2C)CC1 19830648 VJULEYJXNRKMEJ-UHFFFAOYSA-N 377.492 2.963 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@]4(CCc5c(O)nc(C)nc54)C3)c(F)n2c1 1857670982 KMAXIVUZWQTFHK-NRFANRHFSA-N 395.438 2.706 0 50 GFAA COc1ccc([C@H]2[C@H](CO)OCCN2C(=O)c2cccc3cc[nH]c23)cc1OC 1857717347 LNNGIHIFNWLBET-FPOVZHCZSA-N 396.443 2.760 0 50 GFAA CCCNC(=O)N1C[C@@H]2[C@H](CNC(=O)C3(C)CCCCC3)[C@H]3CC[C@]2(C1)O3 1857722888 RUBACHQSCDUOFD-BIZBXSGISA-N 377.529 2.672 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1cnc(C2CC2)nc1 1857731523 UGYJTLXLVBROFH-CEXWTWQISA-N 398.894 2.952 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC(C)C)C[C@H]1NC(=O)c1ccn2nccc2c1 1857736381 RGXQFGQVGPOAOP-KFKAGJAMSA-N 386.496 2.553 0 50 GFAA CC1(C)C[C@](CCN2CCn3nc(C(=O)O)cc3C2=O)(c2ccccc2)CCO1 1875244736 RSFUWWMBQQYWBS-JOCHJYFZSA-N 397.475 2.954 0 50 GFAA O=C1O[C@H]2CN(Cc3cccn3-c3nccs3)C[C@H]2N1CCc1ccccn1 206147071 YZSALOVLBDOYIA-MSOLQXFVSA-N 395.488 2.577 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 109621827 GKUFIPPTHYHOSM-ZDUSSCGKSA-N 396.281 2.821 0 50 GFAA Cc1cc(NC(=O)CN2CCN(c3ccncc3Cl)CC2)n(C(C)(C)C)n1 133414019 UHGNBDJABGITPN-UHFFFAOYSA-N 390.919 2.756 0 50 GFAA C[C@@H](NC(=O)Cn1cc(-c2cccc(CO)n2)nn1)c1ccc2c(c1)CCCC2 1875270061 GLDQBDGIFRHVSQ-OAHLLOKOSA-N 391.475 2.589 0 50 GFAA C[C@@H](CNC(=O)C(=O)N(C)Cc1ccccn1)c1cccc(C(F)(F)F)c1 1875258432 KRIYOTVWQDTUNS-ZDUSSCGKSA-N 379.382 2.979 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C[C@H]2C)n1 1875309969 WQMIQOSWHUTXGF-ZIAGYGMSSA-N 397.454 2.804 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2CCCN(C(=O)C3(C)CC3)C2)c2c(C)n[nH]c2n1 1875332383 ZRVZMVUSENUECQ-HNNXBMFYSA-N 383.496 2.685 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2cccc3c2N(C(=O)OC(C)(C)C)CC3)cn1 1875385478 UGGXBPBSRCZDFE-BXKMTCNYSA-N 384.480 2.981 0 50 GFAA Cc1nnc2ccc(N3[C@H]4CC[C@H]3CC(NC(=O)c3ccccc3F)C4)nn12 888103234 ACPWIGRJMMHNAD-GJZGRUSLSA-N 380.427 2.502 0 50 GFAA CCc1nn2c(ncc3c(=O)n(-c4nc[nH]n4)ccc32)c1-c1ccc(F)cc1 19821387 OPMPROJWKHVELP-UHFFFAOYSA-N 375.367 2.520 0 50 GFAA C[C@@H](CC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2ncn(C)c12)c1ccco1 2325793461 VOLJQQWZSVQZQZ-JYJNAYRXSA-N 392.459 2.785 0 50 GFAA CC(C)c1ccccc1N1CCN(C(=O)[C@H](N)Cc2n[nH]c3ccccc23)CC1 2325856411 OPCWMFGORSQWBD-LJQANCHMSA-N 391.519 2.905 0 50 GFAA O=C(C[C@@H](c1ccc(F)c(F)c1)C1CC1)N[C@@H](C(=O)O)C1CC(C(=O)O)C1 2325877460 RMKHKPPULQDQSS-CAEPASBNSA-N 381.375 2.529 0 50 GFAA O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc1cccc(C(F)(F)F)c1 661001 LMJZPGVIMDFURH-UHFFFAOYSA-N 398.362 2.879 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)c1 817149 CVKVECJXDMBKJS-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(C(=O)Nc3ccccn3)cc1)C2=O 2826550 PKFVCXOWAAVQHS-UHFFFAOYSA-N 387.351 2.833 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)C3(c4ccc(Cl)cc4)CCC3)CC2)[C@H]1O 2356143369 FEYGMMMQUYLTJE-PKOBYXMFSA-N 393.911 2.655 0 50 GFAA COc1ccc(OC)c(C2N(C(=O)C(F)(F)F)C=CN2C(=O)C(F)(F)F)c1 3212198 LGJKERMWPDKMJA-UHFFFAOYSA-N 398.259 2.969 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCC(c2ccncn2)CC1 2356154709 HAVSFFFQNKUTOA-UHFFFAOYSA-N 398.532 2.709 0 50 GFAA NC(=O)C1CCN(CC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 4838555 YWIZCOROSJHBFC-UHFFFAOYSA-N 397.319 2.860 0 50 GFAA CN(CCNC(=O)NCCN(C)Cc1cccc(F)c1)Cc1cccc(F)c1 225618314 HSWUHJWXQCVQLE-UHFFFAOYSA-N 390.478 2.828 0 50 GFAA Cn1c(=O)n(C/C=C/c2ccccc2)c(=O)c2c1nc1oc(C(C)(C)C)cn12 9789813 VRVJDZVRWSYLAE-DHZHZOJOSA-N 378.432 2.952 0 50 GFAA O=S(=O)(c1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@H]23)cc1)N1CCOCC1 247340414 AJDYMPQWJUBBCZ-SDZDHKAXSA-N 390.549 2.622 0 50 GFAA Cc1nc(C)c(CC(=O)N2CCC[C@@H](c3[nH]ncc3-c3ccccc3)C2)c(=O)[nH]1 67817634 GTNQRJOIIYHWOJ-QGZVFWFLSA-N 391.475 2.726 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)Nc1ccc(F)c(Cl)c1 65362135 GYSVQBAZWJXKRP-UHFFFAOYSA-N 375.795 2.688 0 50 GFAA CCn1ncnc1CN1CCOc2c(cc(-c3cccc(OC)n3)cc2OC)C1 67541522 KCKVGEBIEDYXIJ-UHFFFAOYSA-N 395.463 2.772 0 50 GFAA COc1cc(C(=O)N[C@@H](c2ccccc2C)C(C)C)sc1S(N)(=O)=O 151428303 ZMKVHLJOUZERKI-OAHLLOKOSA-N 382.507 2.840 0 50 GFAA C[C@H](O)C1CCN(c2cc(N3CCC([C@@H](C)O)CC3)nc3cnccc23)CC1 328590375 FDENFUXPAXJACV-JKSUJKDBSA-N 384.524 2.824 0 50 GFAA Cc1ccc(CC(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2csc(C)n2)cn1 328603098 DSJWJPGQOTXHAL-WMZOPIPTSA-N 376.501 2.768 0 50 GFAA COc1cc(CC(=O)NCc2n[nH]c3c2CCCCC3)c(C(C)=O)cc1OC 219326790 IKQPZXCVCWTPGB-UHFFFAOYSA-N 385.464 2.757 0 50 GFAA Cn1ncc(NC(=O)N2CCC([C@@H]3OCCC[C@@H]3N)CC2)c1-c1ccccc1 333270261 FZYXULWEQFNJBP-PXNSSMCTSA-N 383.496 2.837 0 50 GFAA Cc1ccn(-c2ccccc2NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)n1 373228423 IDEWGJLIFSQSFZ-QGZVFWFLSA-N 383.496 2.898 0 50 GFAA Cc1cccc2[nH]c([C@H]3CCCN(C(=O)c4cnc5ccccn5c4=O)C3)nc12 77388696 FKTYNJWCTMDZHT-HNNXBMFYSA-N 387.443 2.899 0 50 GFAA CN(C)CCN1C[C@@]2(CCCN(C(=O)CCc3ccccc3F)C2)CCC1=O 82099004 OXTSEVSNODTKPS-QFIPXVFZSA-N 389.515 2.551 0 50 GFAA O=C(Nc1cnn(Cc2cccc3ccccc23)c1)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)O 239164975 NGEGGVYNURDQQT-WTGUMLROSA-N 389.411 2.677 0 50 GFAA Cc1oncc1S(=O)(=O)N1CCC[C@@](C)(Cc2ccc3c(c2)OCO3)C1 91656978 WPSVVKHTNCYLJN-SFHVURJKSA-N 378.450 2.745 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)Nc2cccc(-c3nncn3C)c2)nn1 179315083 HSUZCAJWMSIWAE-UHFFFAOYSA-N 377.383 2.763 0 50 GFAA O=C(CN1CCN(Cc2ccc(F)cc2)CC1)Nc1ccc2nsnc2c1 22752126 KUGJCWIZFOTYTN-UHFFFAOYSA-N 385.468 2.587 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 95360916 SDIPHIPJJZEBEU-IEBWSBKVSA-N 380.492 2.635 0 50 GFAA COc1ccccc1C[C@@H](CNC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)O 237221030 PSEKEIVKYCGRRH-PMACEKPBSA-N 396.487 2.719 0 50 GFAA Cc1ccc([C@H](C(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)N(C)C)cc1 95357753 UMTURIRLSJWCRA-HXUWFJFHSA-N 386.927 2.991 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4cc(C)no4)CC3)CC2=O)c1 95516970 DVDPFHDYBQLVSS-UHFFFAOYSA-N 383.448 2.647 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3cccnc3OC)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95355227 HNXVGNKBHHGHNK-PWRODBHTSA-N 393.487 2.801 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)CCc3cccc(F)c3)C2)CCC1=O 91848970 RSHBTSJWBBWLJY-OAQYLSRUSA-N 376.472 2.636 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)c2cc3ccccc3n2C)C1 95376139 MSVVGDNKOQZCLW-SFHVURJKSA-N 379.508 2.956 0 50 GFAA C[C@H](CO)NC(=O)c1cnn(-c2ccc(OC(F)(F)F)cc2)c1-n1cccc1 230211129 REGLJYWOAKOYEZ-GFCCVEGCSA-N 394.353 2.672 0 50 GFAA COc1cc(CN(C)CC2CCC2)ccc1OC[C@H](O)CN1CCSCC1 95524004 QAGSANRXWFWTIF-LJQANCHMSA-N 394.581 2.716 0 50 GFAA COc1cccc(N2CCN(CCC(=O)NCc3cccs3)[C@H](C)C2=O)c1 244899758 ZPOXWTLYXPCJMA-OAHLLOKOSA-N 387.505 2.500 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N(C)C[C@H]3CCCC[C@H]3O)CC2)oc1C 182850472 OIDDBNFOPXESRK-RTBURBONSA-N 392.544 2.696 0 50 GFAA O=c1c(=Cc2ccco2)sc2n1[C@@H](c1ccccc1)C(c1ccccc1)=NN=2 252680085 VQLHHFPYONZRRL-FQEVSTJZSA-N 385.448 2.959 0 50 GFAA COc1cccc2c1CCN(C(=O)NCc1ccccc1N1CCOCC1)C2 183724681 DWENGLQFOYABCX-UHFFFAOYSA-N 381.476 2.800 0 50 GFAA CC(=O)N1CCCN(C(=O)Nc2ccc(OC[C@H]3CCCCO3)cc2)CC1 299766258 MKMWPVQVCJYWGZ-LJQANCHMSA-N 375.469 2.721 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)N1CCN(c2cnccn2)CC1 299773986 HFSGMKLUVMFRNZ-UHFFFAOYSA-N 377.452 2.540 0 50 GFAA O=C(Nc1c(-c2ccccc2)cnc2ncnn12)[C@@H]1CC(=O)N(C2CCCC2)C1 1851809736 RERUQNZJUUXBSC-OAHLLOKOSA-N 390.447 2.521 0 50 GFAA O=C(NCc1csc(-c2cccs2)n1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 827696780 XXNRJKRLUZAOKJ-CYBMUJFWSA-N 398.513 2.932 0 50 GFAA O=C(CCn1cnc2ccccc21)NC[C@@H]1CCCN(c2noc(C3CC3)n2)C1 952983647 UNEGVNJMNQPRQQ-HNNXBMFYSA-N 394.479 2.720 0 50 GFAA CCc1nc(C)cc(N2CCC3(CC2)CN(C(=O)Cc2ccccc2)CCO3)n1 952978085 JWNGTHIBHNRNDE-UHFFFAOYSA-N 394.519 2.788 0 50 GFAA Cc1c(C(=O)N(C)Cc2cc(-c3ccccn3)no2)sc2[nH]cnc(=O)c12 1506403729 YVFIEVHPLVFVQY-UHFFFAOYSA-N 381.417 2.615 0 50 GFAA CN(CC1CCN(CCO)CC1)c1noc(-c2ccc(Cl)cc2)c1C(=O)O 1704324900 AFSXOHVXOXMFGU-UHFFFAOYSA-N 393.871 2.834 0 50 GFAA COc1c(C)cc(S(=O)(=O)N[C@H]2COC[C@H]2Cc2ccncc2)c(C)c1C 1704299605 RSVXXKYCSFEOLF-MSOLQXFVSA-N 390.505 2.551 0 50 GFAA O=C(c1cncc(N2CCN(c3nsc4ccccc34)CC2)n1)N1CCCC1 1704300264 WTNJJWYWWUFSMX-UHFFFAOYSA-N 394.504 2.649 0 50 GFAA CCOc1ccc(S(=O)(=O)NNC(=S)NCc2ccc(Cl)cc2)cc1 5061084 YMMMIQUJRFHFLN-UHFFFAOYSA-N 399.925 2.596 0 50 GFAA COc1cc([C@H]2NC(=O)N(C)C(C)=C2C(=O)OC(C)C)cc(OC)c1OC 5426834 PAWLKZGGQKAVFZ-MRXNPFEDSA-N 378.425 2.634 0 50 GFAA CCOC(=O)c1ccc(CNC(=O)c2cn(CCCc3ccccc3)nn2)o1 12057311 NBEKHUDRSBDRQE-UHFFFAOYSA-N 382.420 2.611 0 50 GFAA O=C(c1coc(COc2ccc(F)cc2Cl)n1)N1CCN2CCC[C@H]2C1 12594361 XREUYGJKRYHPKR-ZDUSSCGKSA-N 379.819 2.966 0 50 GFAA O=C(NCCCOc1cccnc1)[C@H]1CCC(=O)N(CCCc2ccccc2)C1 15063923 GWKIKXJSQMKGRQ-FQEVSTJZSA-N 395.503 2.838 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)N2CCCN2[C@@H]3c2ccc(Cl)cc2)cc1 19169329 FQAIRYRCTPLSPA-OTWHNJEPSA-N 397.862 2.884 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N1CCc2ccccc21)CCCCC3 169778359 KDEWOMFGGUMNGO-UHFFFAOYSA-N 376.460 2.822 0 50 GFAA CC(C)(C)N1C[C@H](C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)CC1=O 1857670163 XPYCMTQIEJYTSZ-MRXNPFEDSA-N 380.492 2.651 0 50 GFAA COc1ccc([C@H](O)C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)cc1 1857697276 NCOYFTPLEGOACJ-QFIPXVFZSA-N 391.471 2.757 0 50 GFAA COCCC(=O)N1CCC[C@]2(C1)CN(C1CC3(CCCCC3)C1)CC[C@H]2O 1857704518 VQQQREYEERIXBD-DENIHFKCSA-N 378.557 2.811 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)c2n[nH]cc2Cl)CC1 1857707500 VFMDZEWKUNDLSA-UHFFFAOYSA-N 381.841 2.527 0 50 GFAA Cc1ncsc1CN1C[C@@H]2[C@H](CNC(=O)c3ccccc3)[C@H]3CC[C@]2(C1)O3 1857724140 NJQMBNPLEBPPGB-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA COc1ccc(CN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1O 1857739884 XFMYDNCGDCWZPV-WEYGHZABSA-N 380.444 2.675 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857740224 DYJNGEASHXLTRY-OPYAIIAOSA-N 398.846 2.960 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)NC[C@@H](CO)CC1CCCC1 225622482 XBUZBVZKFHENKQ-QFBILLFUSA-N 378.488 2.885 0 50 GFAA Cc1ccc(C)c(OC2CCN(C(=O)c3cn(C4CCNCC4)nn3)CC2)c1 237854454 UHHGWDZDEACANU-UHFFFAOYSA-N 383.496 2.503 0 50 GFAA CCc1ccc(CNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1 252523103 BWQYQVYYQUVCOS-MRXNPFEDSA-N 378.519 2.780 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1C(=O)O 372021375 IWBTVTILVRRKAN-OAHLLOKOSA-N 390.823 2.951 0 50 GFAA C[C@H](OC(=O)c1ccccc1OCc1cn2ccccc2n1)[C@@H]1CCNC(=O)C1 1263661237 CNTGOJXBCIZSTO-JKSUJKDBSA-N 393.443 2.985 0 50 GFAA C[C@H](C(=O)NCC[S@](=O)c1ccccc1F)n1ccc(C(F)(F)F)n1 1875269371 GMWNJWFFSWWGBM-JUTIIYIPSA-N 377.363 2.526 0 50 GFAA Cc1cc(Cl)cc(C(=O)N2CC3(CN(C)C[C@@H]3c3ccnc(N(C)C)n3)C2)c1 1875395445 CJTUKOOQVSIQHY-QGZVFWFLSA-N 399.926 2.676 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCC2(CC1)C[C@H](N)c1ccccc1O2)c1ccccc1 1875301342 GGLBUSCSHDPYDH-FPOVZHCZSA-N 393.487 2.708 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)c1nnn([C@@H]2CCNC2)c1C 888102059 WPVCVIOKQSGQAK-ZHALLVOQSA-N 383.496 2.549 0 50 GFAA O=C(NCC1(NC(=O)[C@H]2C[C@H]2F)CC1)c1cccc(Cl)c1Br 2325829797 SMQHCWMXZLYUMA-GXSJLCMTSA-N 389.652 2.839 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cc(Br)c3c(c2)OCO3)CC1 2325887873 NILSFAZHILKWQV-UHFFFAOYSA-N 381.226 2.541 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@@H]1c1ccc(OC)c(OC)c1 975665 KGFMWASPPDZZQT-MRXNPFEDSA-N 376.434 2.527 0 50 GFAA Cc1cc(C)c(C)c(C(=O)COC(=O)CN2C(=O)c3ccccc3C2=O)c1C 991333 MNGAWVIMAGAQGR-UHFFFAOYSA-N 379.412 2.942 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c1 1462342 CLCJGHADLYGSAM-UHFFFAOYSA-N 382.460 2.872 0 50 GFAA COc1ccc([C@@H]2CC(=O)c3cnc(NC[C@@H]4CCCO4)nc3C2)cc1OC 2111726 RKRQPQBKWSMWIS-GJZGRUSLSA-N 383.448 2.997 0 50 GFAA biogenic COc1ccc(NS(=O)(=O)c2cc3c4c(c2)CC(=O)N4CCC3)cc1Cl 4570167 ZQKQQKFNOZOHFY-UHFFFAOYSA-N 392.864 2.985 0 50 GFAA COc1ccc(-c2nc(C[S@@](=O)CC(=O)NCc3cccnc3)c(C)o2)cc1 4924670 VRKCHOIJRFZQSF-NDEPHWFRSA-N 399.472 2.619 0 50 GFAA aggregator Cc1noc(C2CC2)c1NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)C1CCCCC1 225806536 DEFAGBDGLGHPCC-MRXNPFEDSA-N 385.468 2.830 0 50 GFAA CCCN(CC1CC1)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1 55099958 NAJCLLSSCRPLMQ-GOSISDBHSA-N 395.906 2.818 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 100635672 MBDWPUWOQANSFQ-NXKWAJLKSA-N 376.840 2.708 0 50 GFAA COc1ccccc1/C=C/CN1CCN(Cc2cccc(C)n2)[C@@H](CCO)C1 20540804 PXJSRAKHUPZAQP-OUZREKFBSA-N 381.520 2.981 0 50 GFAA CCc1cn[nH]c1[C@H]1CCCN(C(=O)c2cc(-c3c(C)nn(C)c3C)nn2C)C1 67692177 CCRLRYJCVHITGD-INIZCTEOSA-N 395.511 2.743 0 50 GFAA CC1=NN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)[C@](O)(C(F)(F)F)C1 7260632 PUSPVHLNSLYEGQ-CYBMUJFWSA-N 376.722 2.651 0 50 GFAA CNC(=O)[C@@H](C)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67871786 HOWABEFHAPSJQG-GFCCVEGCSA-N 383.473 2.998 0 50 GFAA O=C(c1ccccc1)N1CCC(Nc2cc(C(F)(F)F)nc3ncnn23)CC1 172150520 XANKTPPTTNSUDN-UHFFFAOYSA-N 390.369 2.860 0 50 GFAA CC(C)CCN1C(=O)CC[C@H]2CN(C(=O)CCn3cc(Cl)cn3)CC[C@H]21 72429172 HUVYFGLHRBLRDF-DOTOQJQBSA-N 380.920 2.812 0 50 GFAA Cn1nc(C(F)F)c2cc(C(=O)N3CCC[C@@H]3[C@@H]3COCC[C@@]3(C)O)sc21 329006529 NASRURNWGKMYRD-VNBZBWLYSA-N 399.463 2.965 0 50 GFAA CC(C)[C@@H]1CN(CC(=O)N(C)C(C)C)CCC(=O)N1Cc1ccc(F)cc1 71761272 OZFSHULMGCRLRY-IBGZPJMESA-N 377.504 2.751 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)c2ccnc(-n3ccnc3)c2)C1 154268181 MZDYMPCNJKNQOV-MRXNPFEDSA-N 377.448 2.532 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N2CCC[C@H](C[C@H]3CCOC3)C2)ccc1C 373140176 MDWVHQCPRANTJL-IAGOWNOFSA-N 380.510 2.781 0 50 GFAA O=C(N[C@H]1CCc2nnnn2CC1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 333675209 DGQFALCKYJYWCP-MAUKXSAKSA-N 379.468 2.796 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N(C)C(C)C)c2=O)cc1 77538465 NOCMZWABPIKFOE-UHFFFAOYSA-N 380.448 2.576 0 50 GFAA O=C(NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)[C@@H]1CCCc2cccnc21 375865690 CIJFMLQMEOJOMF-MRXNPFEDSA-N 386.883 2.904 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CC[C@@H]4[C@H](CCC(=O)N4C4CC4)C3)cc2)o1 129709970 SAKOBCFYXBWQKF-SJLPKXTDSA-N 380.448 2.661 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(c2nccnc2N2CCCC2)CC1 82148340 GMFQPQFVNLIJIX-UHFFFAOYSA-N 398.463 2.588 0 50 GFAA COc1cccc(C(=O)N2CCN(c3cc(N4CCCCC4)nc(C)n3)CC2)c1 82230422 FVRQUZHXWOXGAC-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA CCOc1cc([C@@H]2C(C(=O)OC)=C(C)Nc3ncnn32)ccc1OC(F)F 20607936 FHRIITKKIYWVCE-CQSZACIVSA-N 380.351 2.740 0 50 GFAA CCCCN1CCn2nc(CNC(=O)[C@H]3CCOc4ccccc4C3)cc2C1 426622907 HPFDIWUHAPYXPJ-SFHVURJKSA-N 382.508 2.756 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cncn1-c1ccc(F)cc1 179396727 WOCGZMJNRKMLFV-IBGZPJMESA-N 392.434 2.932 0 50 GFAA COc1coc(C(=O)N2C[C@H]3CC[C@@H]2CN(CCCc2ccccc2)C3)cc1=O 91876510 XAAKVTHQNCWGEE-RBUKOAKNSA-N 396.487 2.818 0 50 GFAA CCOC(=O)C1CCN(CC2=CC(C)(C)N3C(=O)C(=O)c4c(C)ccc2c43)CC1 334161190 WEZQHOIHIQALQE-UHFFFAOYSA-N 396.487 2.975 0 50 GFAA Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(CCN2CCCC2=O)CC1 91951802 ZFNWLGSWLCIEII-UHFFFAOYSA-N 380.492 2.952 0 50 GFAA O=C(CN1CCc2ccccc21)N[C@H]1CN(C(=O)C2CCCC2)C[C@@H]1C1CC1 95390094 GJHIYOPNCLREFT-UXHICEINSA-N 381.520 2.593 0 50 GFAA CN(Cc1ncc(Cl)n1C)C(=O)NCc1ccc(-n2ccnc2)c(F)c1 180779594 DBSGRNZJUHWFJZ-UHFFFAOYSA-N 376.823 2.740 0 50 GFAA Cn1ccnc1[C@H](O)C1CCN(c2nncc(-c3ccc(Cl)cc3)n2)CC1 23398944 DBCCQLQQYUMPTK-QGZVFWFLSA-N 384.871 2.876 0 50 GFAA O=C(c1ccc(-n2ccnc2)cc1)N1C[C@H]2COc3ccccc3C[C@@]2(CO)C1 95376346 VKAAVZFSKMGQFJ-CVDCTZTESA-N 389.455 2.558 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CN1CCc2n[nH]cc2C1)C1CCCCC1 95496745 ATQJSYOXFOBGRV-OAQYLSRUSA-N 398.551 2.972 0 50 GFAA COC(=O)c1cc(NC(=O)N2CCC[C@H](N3CCCC3=O)C2)ccc1Cl 96130940 FUNFPDGYIAMNNC-ZDUSSCGKSA-N 379.844 2.745 0 50 GFAA COc1cccc2c1CCN(C(=O)C[C@@H]1CN(Cc3ccccc3)CCO1)C2 182748363 MDWBFKVFGHPLDS-HXUWFJFHSA-N 380.488 2.871 0 50 GFAA COc1ccccc1OCC(=O)N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252539909 ORGUJYWQTYAODR-HYFFOGBASA-N 383.444 2.637 0 50 GFAA CO[C@@H]1[C@@H](Sc2ccccc2)OC[C@@H](OC)[C@H]1O[C@H]1OCCC[C@H]1OC 257357708 PMVNXXXRJLDLRS-WVXCVLBUSA-N 384.494 2.702 0 50 GFAA CSCc1nc(CNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)cs1 534656708 MMCLZMJCVKPKEO-UHFFFAOYSA-N 378.479 2.683 0 50 GFAA Cc1ccc(NC(=O)CN(C)C)c(NC(=O)c2ccc(N3CCCC3=O)cc2)c1 823676231 YOUFROFAYHGUGH-UHFFFAOYSA-N 394.475 2.874 0 50 GFAA CCC(=O)N1CCC(C(=O)N2CCN(C3C4CC5CC(C4)CC3C5)CC2)CC1 822529702 PPNDKWRSMAWSRN-UHFFFAOYSA-N 387.568 2.604 0 50 GFAA Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)NCCNC(=O)c1cccnc1 584891703 TVGYGOLRCPVWQE-QGZVFWFLSA-N 382.464 2.721 0 50 GFAA Cc1cccc(C)c1OCCNC(=O)N1CCN(Cc2ccc(F)cc2)C(=O)C1 584894953 PKCGAHXFLPDQEC-UHFFFAOYSA-N 399.466 2.875 0 50 GFAA CCOc1ccc(-c2csc3ncn(CCc4ncnn4C)c(=O)c23)cc1 584891562 JDPKXRBYMHTLLX-UHFFFAOYSA-N 381.461 2.895 0 50 GFAA O=C(NC[C@H]1CCCN(C2CCCC2)C1)N(CCO)Cc1ccc(F)cc1 584897336 XBVKRAXVPOQZKF-GOSISDBHSA-N 377.504 2.984 0 50 GFAA Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)N1CCC[C@@H](Cc2nccn2C)C1 1340542093 VJQVFPCDUAPJGF-KRWDZBQOSA-N 394.523 2.651 0 50 GFAA Cc1oc2ccc(OCc3ccccc3)cc2c1C(=O)N1C[C@H](O)C[C@H]1C(=O)O 952986818 FXCRDMISGPEZQU-QAPCUYQASA-N 395.411 2.980 0 50 GFAA O=C(CCc1ccccc1F)NCC1CCN(C(=O)[C@H](O)c2ccccc2)CC1 952968430 MUPKXNIQGLHSBF-JOCHJYFZSA-N 398.478 2.847 0 50 GFAA CC(=O)c1ccc(C(=O)N[C@H]2CCOC[C@@H]2OCc2c(C)noc2C)s1 1565511237 PSJJUCSHLWJOQP-GJZGRUSLSA-N 378.450 2.660 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NCC[S@@](=O)c1ccccc1 170623604 WJBVRLURHFINMN-QAZDYGKNSA-N 386.517 2.755 0 50 GFAA O=C(CCN1CCCS1(=O)=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 170974574 KIRWLGJUPKIKMI-SFHVURJKSA-N 375.494 2.647 0 50 GFAA CCc1ccc(C(=O)NCCCN(CCOC)C(=O)c2ccc(CC)o2)o1 170598432 FSMMSAMFCVNTIZ-UHFFFAOYSA-N 376.453 2.906 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)C1CC(F)(F)C1 788420762 WMAFSDUYEBPNBQ-SECBINFHSA-N 397.827 2.604 0 50 GFAA CC(=O)c1cccc(N(CC(=O)Nc2ccccc2Cl)S(C)(=O)=O)c1 5027821 PYKVWGOEJMIJOO-UHFFFAOYSA-N 380.853 2.947 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1c(F)cccc1F 12475716 SYPGMVUOZXQQHW-SFHVURJKSA-N 384.390 2.544 0 50 GFAA CC[C@@H](COC)NC(=O)[C@@H]1CCCN(c2nc(C)c3ccc(OC)cc3n2)C1 14879451 JOSMUJFDSMSULG-CVEARBPZSA-N 386.496 2.704 0 50 GFAA COc1cccc(-c2nn(-c3ccccc3)cc2CN2CCC[C@H]2C(N)=O)c1 15065185 XZKBXPHUPRROHU-FQEVSTJZSA-N 376.460 2.998 0 50 GFAA CCOC(CCNC(=O)c1nnn(Cc2ccccc2)c1-n1cccc1)OCC 206641399 PDFIVQGNJUZHNL-UHFFFAOYSA-N 397.479 2.636 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4conc4-c4ccccc4)[C@@H]2CC(=O)N13 1857708745 LRARLNNKGQMRAC-FVJLSDCUSA-N 381.432 2.540 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N(C)[C@@H](C)Cc4cnccn4)CC3)nc2n1 1857721994 BNEVJGVSFMOJHL-HNNXBMFYSA-N 394.479 2.627 0 50 GFAA NCc1cccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)c1 1857738517 LJAXJCKHXGOJFW-VXKWHMMOSA-N 379.504 2.823 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1C[C@H]2c3ccccc3OC[C@@]2(C(=O)O)C1 248148659 ARDFZFVGJTZMMY-BTYIYWSLSA-N 383.448 2.729 0 50 GFAA O=[S@@](c1ccc(N2CCC[C@]3(CCS(=O)(=O)C3)C2)cc1)C(F)(F)F 865856713 KJDCECNHQZRUCZ-PSLXWICFSA-N 381.441 2.719 0 50 GFAA Cc1cc([C@H](O)CN(C)C(=O)c2csc(N3CCCCC3)n2)ccc1O 1875296417 WHBUNJJLJOKHAY-QGZVFWFLSA-N 375.494 2.953 0 50 GFAA O=C(c1ccccc1)N1CC[C@@H](Cn2c(Cc3ccc(F)cc3)noc2=O)C1 1875315851 KBKXDZYQZNGSET-MRXNPFEDSA-N 381.407 2.729 0 50 GFAA Cc1ccc(CN2CCO[C@@H](CNc3ncnc4nc(N(C)C)sc34)C2)cc1 1875341404 RGPWZTHCDCVHQB-INIZCTEOSA-N 398.536 2.774 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnoc1C1CC1 1875403154 PTHHWPGVFBJFCB-GDIGMMSISA-N 392.459 2.985 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)NCc2cccnc2)c(Cl)cc1Cl 1083587 DECOOVJTINWPAX-UHFFFAOYSA-N 388.276 2.569 0 50 GFAA O=S(=O)(c1ccc(I)cc1)n1cnc2ccccc21 887301 RCBFLWDFXWIMKQ-UHFFFAOYSA-N 384.198 2.878 0 50 GFAA COc1cc(C(=O)N(Cc2ccccn2)C2CCNCC2)cc2c1O[C@H](C)C2 2325774743 PGIYNDDMJIQKIJ-OAHLLOKOSA-N 381.476 2.808 0 50 GFAA CCOC(=O)c1ccc2c(c1)C[C@@H](NC(=O)Cc1ccc3oc(O)nc3c1)C2 2325851076 ONURCDIAKXXBDO-INIZCTEOSA-N 380.400 2.536 0 50 GFAA CC[C@H]1c2ccccc2CN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 932246910 HJKUPJPDGWSDKH-INIZCTEOSA-N 385.445 2.911 0 50 GFAA CC(=O)Nc1ccc(OC[C@@H](O)Cn2nc(C)c(Br)c2C)cc1 816537 GILZWWFRXVLQSL-AWEZNQCLSA-N 382.258 2.661 0 50 GFAA Cc1ccc(-n2c3c(cc(C(=O)NC[C@@H]4CCCO4)c2=O)C(=O)CCC3)cc1 1108833 OUTGLQHFEDLVBL-INIZCTEOSA-N 380.444 2.574 0 50 GFAA COc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1OC 2936260 MWSOLQAJVUBKFO-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA O=C(c1cnn2cccnc12)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356152338 ZPNYLLUIFSAIAA-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA COc1cccc(-n2nnc3c(=O)n(Cc4c(F)cccc4Cl)cnc32)c1 4035227 YEUPWRNRJVWQPX-UHFFFAOYSA-N 385.786 2.827 0 50 GFAA CCc1nnc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cs2)s1 6680453 JZKNPFYLGPGHGI-UHFFFAOYSA-N 386.524 2.589 0 50 GFAA COCCOc1ccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)cc1 8723060 LBIIRRCAFWTNNZ-SFHVURJKSA-N 398.459 2.873 0 50 GFAA CCc1nc(C[C@H]2CN(c3cc(C)nc(-c4ccccc4O)n3)CCO2)no1 102792436 NWRMLJFPYDJJBT-AWEZNQCLSA-N 381.436 2.551 0 50 GFAA COc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@@H]2CCO)cc1C 23373948 GLWAUNYLBRVONT-NRFANRHFSA-N 386.540 2.850 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(C)cc3C)CC2)C1 67803030 OXKGTDKENXZWSX-NRFANRHFSA-N 387.568 2.742 0 50 GFAA CC(C)[C@H]1CC[C@H](C)CCN1C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 117527442 WXOYWOSCJYRYJY-SUMWQHHRSA-N 398.500 2.841 0 50 GFAA CNC(=O)C[C@@H](C)N(C)C(=O)c1csc2nc(-c3ccccc3OC)cn12 67472780 INJDDTWCHHNUKF-GFCCVEGCSA-N 386.477 2.668 0 50 GFAA CC(C)C[C@@H]1CCN(Cc2cn(C3CCN(C4CCOCC4)CC3)nn2)C1 63848259 TUJPELBHGJHRAA-SFHVURJKSA-N 375.561 2.962 0 50 GFAA CC(C)c1ncc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)cn1 71589514 FGZIWYQVWGRZFK-GOSISDBHSA-N 385.556 2.555 0 50 GFAA Cc1cnn(C(=O)c2cnn3c(C(F)(F)F)cc(-c4cn(C)nc4C)nc23)c1 2780768 QMMMSXNTSXJSAM-UHFFFAOYSA-N 389.341 2.650 0 50 GFAA CCc1nc(CN2CCN(Cc3nc(N)c4c(C)c(C)oc4n3)CC2)cs1 153494519 QZALYNYBFKIKOP-UHFFFAOYSA-N 386.525 2.759 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 363233677 MKJRSHNMQVIHIX-JXFKEZNVSA-N 386.471 2.996 0 50 GFAA Cc1nn(C)c2sc(C(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)cc12 155040710 GIZNLXOUPUWXMT-INIZCTEOSA-N 396.516 2.907 0 50 GFAA CC(C)(C)NC(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72161498 BOJNGFRSSLNOCV-HXUWFJFHSA-N 379.504 2.959 0 50 GFAA CC1(C(=O)N2CCc3ccc(S(=O)(=O)NCc4cccs4)cc3C2)CC1 77470606 SVVSIKYJHPDRLI-UHFFFAOYSA-N 390.530 2.911 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)Nc2ccc(-c3nncs3)cc2)C[C@H]1C(F)(F)F 263078200 QVGKBBNALMCKAY-GHMZBOCLSA-N 386.355 2.932 0 50 GFAA CSCC[C@H](C(=O)NCc1ccc(C)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 242317012 YWOSFPCQZXHUHS-KZNAEPCWSA-N 388.533 2.908 0 50 GFAA O=C(NCCN1CCN(c2ncccn2)CC1)Nc1ccc(Cl)c(Cl)c1 47323486 ITFDQLBBYVJCGG-UHFFFAOYSA-N 395.294 2.727 0 50 GFAA COc1ccc(-c2cncc(C(=O)N[C@@H]3CC(=O)N(CC(F)(F)F)C3)c2)cc1 131532448 AOYWLYLGPAOKQZ-OAHLLOKOSA-N 393.365 2.650 0 50 GFAA O[C@@H](COCc1ccccc1Cl)Cn1cnc2c(N3CCCC3)ncnc21 176943108 FEPKRQQZXUDNHY-OAHLLOKOSA-N 387.871 2.658 0 50 GFAA CCS(=O)(=O)c1ccc(-c2ccc(C(=O)N[C@@H]3CCN(C)C3)cc2)s1 426431430 VRQRJWVCKWKITK-OAHLLOKOSA-N 378.519 2.643 0 50 GFAA Cc1ccc(N2C[C@H](C)N(C(=O)c3cc4nc(C)cc(C)n4n3)CC2=O)cc1 82148298 OZTHNOYZMRXONS-INIZCTEOSA-N 377.448 2.532 0 50 GFAA Cc1nc(-n2cccc2)sc1C(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 225416477 MJYPFCWYKJDWDS-CABCVRRESA-N 380.473 2.663 0 50 GFAA biogenic Cn1cccc1-c1cc(C(=O)N2CCN(c3nc4ccccc4o3)CC2)[nH]n1 91603214 DQBMQCWPEWOTFF-UHFFFAOYSA-N 376.420 2.519 0 50 GFAA O=C1CC[C@]2(CCCN(Cc3ccc4c(c3)OCO4)C2)CN1CCc1c[nH]cn1 91435223 FQFPKBKIJNEJPN-QFIPXVFZSA-N 396.491 2.586 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)CCc2ncc(-c3ccccc3Cl)o2)CCO1 238195737 HQYWCSSVYSQOCK-GFCCVEGCSA-N 378.812 2.630 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC2(CCC(=O)N(C3CCCC3)C2)CC1 92004561 CKCIRULSRWLEGW-UHFFFAOYSA-N 376.526 2.821 0 50 GFAA O=C(NCCC1CCN(C2CCCC2)CC1)NC[C@@H](O)c1cccc(O)c1 426502838 DRKDWRAGWUZUHM-HXUWFJFHSA-N 375.513 2.770 0 50 GFAA O=C(CN1CC[C@H](c2ccccc2)C1)N1CCCN(Cc2ccncc2)CC1 230571625 LOIROICQVUWFOM-QFIPXVFZSA-N 378.520 2.605 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)CCn3c(=O)[nH]c4ccccc43)C2)cc1 95361504 AWCYLTVTMFLMDU-QGZVFWFLSA-N 393.443 2.824 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccc(F)cc2)cc1C 245328257 UREZEQAUZAHWSP-SLFFLAALSA-N 379.435 2.978 0 50 GFAA Cc1csc(NC(=O)[C@@H](C)N2CCc3sc(C(=O)N(C)C)cc3C2)n1 244882519 XTIXEXAUHZNUDA-LLVKDONJSA-N 378.523 2.600 0 50 GFAA Cc1cc2c(NC(=O)NC[C@@H]3CCCN(c4ncccn4)C3)cccc2nn1 299803122 XKWIIHMBXQSWOO-HNNXBMFYSA-N 377.452 2.766 0 50 GFAA CN1CCO[C@H](CNC(=O)c2cccc(-c3ccc4c(O)nccc4c3)c2)C1 584893345 XMNBINZIXBFMHU-LJQANCHMSA-N 377.444 2.668 0 50 GFAA CC(C)(C)c1cc(CN2CCOC3(CCN(Cc4cccnc4N)CC3)C2)[nH]n1 827591835 PIEPCDFKBVTXQH-UHFFFAOYSA-N 398.555 2.551 0 50 GFAA O=C(CCn1cnc2ccccc21)NC12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 952980903 MSXVBCOVMCZOJE-RGMRCXJASA-N 390.491 2.882 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 268944434 MBEYIXSPAJKZCP-KSZLIROESA-N 379.412 2.599 0 50 GFAA O=C(/C=C/c1cc(CO)cs1)NC1CCN(C(=O)NC2CCCCC2)CC1 952991414 RJNXIOJFAPUPHM-VOTSOKGWSA-N 391.537 2.877 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC1CCN(CC(F)(F)F)CC1 171186448 DUHGNXNRAHIERH-UHFFFAOYSA-N 399.392 2.837 0 50 GFAA O=C(Cc1nc2ccccc2o1)N1CCCN(C(=O)c2cc(C3CC3)no2)CC1 1529167504 MILXITLBWAIUMD-UHFFFAOYSA-N 394.431 2.610 0 50 GFAA Cn1nc(C(=O)N2CCCN(C3CSCCSC3)CC2)c2ccccc21 1775981357 LIESCDRPBMHYMG-UHFFFAOYSA-N 390.578 2.570 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)N2CCC(CCc3ccccc3)CC2)nn1 11816451 VPKNOVLAMVBCRM-UHFFFAOYSA-N 397.523 2.632 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCN1CCOC1=O 11838453 IAJQDNVSVMCQCC-QGZVFWFLSA-N 382.416 2.506 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)N4CC[C@@H](N(C)C)C4)no3)ccc2s1 11873415 WRUXLMQTRJSOSC-CYBMUJFWSA-N 386.477 2.948 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(Cc4cnc(OC)nc4)C3)C2=O)c1 12090832 ATWJGDRKLAHZOM-JOCHJYFZSA-N 396.491 2.509 0 50 GFAA CCCn1cc(CN2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)c(C)n1 12717823 BJBORDDBAKKFGW-HXUWFJFHSA-N 376.545 2.889 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)[C@H]2CCCO2)CC1 14973470 DGVDAFOICMSFMD-GOSISDBHSA-N 382.464 2.786 0 50 GFAA COCC(=O)N1CC[C@H]2[C@H](CCCN2C(=O)/C=C/c2ccccc2Cl)C1 15005611 DXDVVZJHNOKGDS-FDRAFAAVSA-N 376.884 2.839 0 50 GFAA O=C(NCC1(N2CCOCC2)CCCCCC1)[C@@H]1CCN(c2ccccc2)C1=O 19223964 VUEILZDRGLBRFQ-FQEVSTJZSA-N 399.535 2.581 0 50 GFAA COc1ccc(CN2C(=O)N[C@H](CC(=O)Nc3ccc4cc[nH]c4c3)C2=O)cc1 206239410 VCHKHBCXSNPSKM-GOSISDBHSA-N 392.415 2.626 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857680809 UZKGMYUWYWSALK-SXLOBPIMSA-N 375.465 2.973 0 50 GFAA COc1cc2c(cc1-c1nccn1[C@@H](Cc1ccccc1)C(N)=O)OCCO2 1857695862 BOLLYYBEOBJVKU-INIZCTEOSA-N 379.416 2.599 0 50 GFAA Oc1nc(N2CCOCC2)nc2c1CC[C@@]21CCCN(Cc2ccccc2F)C1 1857708648 FQKMFGQOEHZOFW-JOCHJYFZSA-N 398.482 2.638 0 50 GFAA Cc1nccnc1-c1cc(=O)nc(-c2cccc(CN(C)Cc3cc[nH]n3)c2)[nH]1 23580701 HVCMVOMRMDBIKL-UHFFFAOYSA-N 387.447 2.557 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)[C@@H]4CCCCCC[C@@H]4N)CC3)n2)cn1 952894598 OFFCIDNCZQQCND-MOPGFXCFSA-N 396.539 2.881 0 50 GFAA CN(C)CCn1nnc2c1C[C@@H](c1nc(-c3cc4ccccc4o3)no1)CC2 952894584 ODUDRSVQLIBNJX-AWEZNQCLSA-N 378.436 2.908 0 50 GFAA Cc1cs/c(=N/c2ccc(OC(F)F)cc2)n1CCCNS(C)(=O)=O 1875257938 XRVCVQXITHJYQC-XDJHFCHBSA-N 391.465 2.631 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1c(F)cccc1OC)C[C@H](C)O[C@@H]2C 1875315876 LCZOFZKHFATIDZ-QWHCGFSZSA-N 391.443 2.629 0 50 GFAA NCc1cccc(CNC(=O)[C@@H]2CCO[C@@H]2c2cnn(-c3ccccc3F)c2)c1 2325787563 HNVVKLJGMUXRPN-WIYYLYMNSA-N 394.450 2.864 0 50 GFAA O=C(NC[C@H]1Cc2ccccc2CN1)c1c[nH]c2ncc(Br)cc12 2325854271 VTVKEXVBVQNJLX-CQSZACIVSA-N 385.265 2.770 0 50 GFAA CC[C@H](O)c1cn(-c2cccc(CNC(=O)c3c[nH]c4ncccc34)c2)nn1 2325869289 HBJSCXPYBYELTK-SFHVURJKSA-N 376.420 2.517 0 50 GFAA Cc1cccc(C(=O)N[C@@H]2CC3(CN(C(=O)C4CC(C)C4)C3)n3ccnc32)c1C 2332237722 JEHHMXMVHFDAOS-ITXXBFQVSA-N 392.503 2.958 0 50 GFAA COC(=O)[C@H]1CCN(C(=O)c2cn(-c3cccc(C)c3)nn2)c2ccccc21 130655872 XRIYQZKQUMDACI-KRWDZBQOSA-N 376.416 2.883 0 50 GFAA Cc1ccc(-n2nnnc2SCC(=O)Nc2ccc3c(c2)OCCO3)cc1C 1353543 JMHBVGRRBOPQDK-UHFFFAOYSA-N 397.460 2.781 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1cccc(OC)c1 2827648 QGSSYNWKXIHVLH-KRWDZBQOSA-N 390.461 2.535 0 50 GFAA Cc1cccc(N2C(=O)c3cccc4c(N)c(S(=O)(=O)O)cc(c34)C2=O)c1 3045306 MEFWMAYRBIYTMX-UHFFFAOYSA-N 382.397 2.778 0 50 GFAA CCCn1nc(N(Cc2nc(-c3ccccc3)no2)S(C)(=O)=O)cc1C 2356156424 BBIVEDJRJXUNBF-UHFFFAOYSA-N 375.454 2.618 0 50 GFAA COc1ccc([C@H]2N[C@@H](C(=O)O)Cc3c2[nH]c2ccccc32)c(OC)c1OC 4012429 NEEYWOPERFZLCV-NVXWUHKLSA-N 382.416 2.882 0 50 GFAA biogenic COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)Nc1ccc(C)cc1C 4840550 IXBGCGLPMNCPSY-UHFFFAOYSA-N 376.478 2.880 0 50 GFAA CCOC(=O)[C@H](C(=O)CCCCSc1nc(N)nc2[nH]cnc12)C(C)C 6564646 LGCMPOVOCBYOQF-LBPRGKRZSA-N 379.486 2.602 0 50 GFAA COC(=O)[C@H]1[C@@H]2C(=O)N(C(c3ccccc3)c3ccccc3)C[C@@]23C=C[C@H]1O3 100886082 AJYDXIPSQULZLA-ZQAYVECASA-N 375.424 2.731 0 50 GFAA CCN(Cc1cnc(S(=O)(=O)CC)n1Cc1ccccc1)C[C@H]1CCCO1 55118788 HSJDXIUKCBNNAH-LJQANCHMSA-N 391.537 2.726 0 50 GFAA Cc1cc(C(=O)NCc2cccnc2-n2ccnc2)c2cnn(C(C)C)c2n1 29912336 OBALITVKAOMDCY-UHFFFAOYSA-N 375.436 2.831 0 50 GFAA C/C(=C\c1ccco1)CN1CCc2nnc(CNC(=O)c3ccccc3)n2CC1 67840569 PIBQGSHQFVCKOT-SAPNQHFASA-N 391.475 2.763 0 50 GFAA CS(=O)(=O)Nc1ccc2c(c1)NC(=O)C[C@@H]2c1ccc2cccc(O)c2n1 65369989 PSAHTYCLCNXQPU-AWEZNQCLSA-N 383.429 2.786 0 50 GFAA O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)N1CC[C@@H](N2CCCC2)C1 151995179 ZWRIHNYOVYMBOQ-GOSISDBHSA-N 384.455 2.738 0 50 GFAA COc1ccc(NC(=O)[C@@H]2Cc3ccccc3CN2)cc1N1CCCCC1=O 153803126 KIQNQRMRPRSTBJ-SFHVURJKSA-N 379.460 2.865 0 50 GFAA CSc1ncccc1C(=O)N[C@@H]1CCOC[C@H]1OCc1c(C)noc1C 218925651 BTDGBMVMOXNIPC-HZPDHXFCSA-N 377.466 2.512 0 50 GFAA Cc1nnnn1-c1cc(NC(=O)N2CCCC[C@H]2c2ccnn2C)ccc1F 370725288 QSJVELZNRYCYLM-INIZCTEOSA-N 384.419 2.602 0 50 GFAA CCn1ccnc1CN(C(=O)c1n[nH]c2ccccc12)[C@@H]1CC12CCNCC2 262094920 HRXXTICNHSDPRP-QGZVFWFLSA-N 378.480 2.564 0 50 GFAA C[C@@H](N)[C@@H]1CCCCN1C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 237375930 GHIYTVJEELLYOQ-BMIGLBTASA-N 378.270 2.633 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N2C[C@@H](C3CC3)[C@@H]2C2CC2)s1 333969016 UGNAMSDTFMFGSK-JZXOWHBKSA-N 394.562 2.857 0 50 GFAA O=C(Cc1cc(F)ccc1F)Nc1ccc(-n2ncc3c(=O)[nH]cnc32)cc1 173462682 WBKCGTRMYBUZMK-UHFFFAOYSA-N 381.342 2.568 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c1C 242324406 ZBBFEEGWMPCPSF-YWPYICTPSA-N 378.469 2.906 0 50 GFAA C[C@@H]1CN(Cc2ccccc2NC(=O)N2CCOCC(F)(F)C2)C[C@@H](C)O1 289573893 HEWMUHYZZMJNKK-HUUCEWRRSA-N 383.439 2.795 0 50 GFAA O=C(c1cn(CCN2CCCCC2)nn1)N1CCCC[C@H]1CCc1ccccn1 20453774 AZAIRCJVHUDLMJ-FQEVSTJZSA-N 396.539 2.787 0 50 GFAA COc1nccnc1-c1ccc(C(=O)N2CCN(Cc3ccco3)CC2)cc1 426517786 FTGBXTTZMJOYDD-UHFFFAOYSA-N 378.432 2.703 0 50 GFAA O=C(NC1(CN2CCOCC2)CCCC1)c1cccc(-c2ncccc2O)c1 426701559 FZHLOCFQBVVGIH-UHFFFAOYSA-N 381.476 2.829 0 50 GFAA COc1cc(C(=O)N2CCOCC2)ccc1OC1CCN(C2CCCC2)CC1 95521082 FHTCQXSURSRXBK-UHFFFAOYSA-N 388.508 2.953 0 50 GFAA Cc1ccc(-c2ccc(CCC(=O)N3CC[C@@]4(CN(C)C(=O)CO4)C3)o2)cc1 426489844 BCTJFEMMYHHZQA-JOCHJYFZSA-N 382.460 2.647 0 50 GFAA O=C(O)[C@@H]1c2nc[nH]c2CCN1C(=O)c1ccc(CN2CCCCCC2)cc1 96141839 GAJQHNKLJGETRB-IBGZPJMESA-N 382.464 2.610 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CC(O)(c2ccccc2)C1 292299836 HSLNIYBONQEYHO-UHFFFAOYSA-N 393.487 2.726 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)[C@@H](O)c2cccc(Cl)c2)CC1 95507722 BVERKGZOSRPQOE-KRWDZBQOSA-N 377.872 2.623 0 50 GFAA CN(C)C[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(-c2nnn(C)n2)c1 97675301 FZJVUJAEFHJCCU-GOSISDBHSA-N 379.468 2.644 0 50 GFAA CNc1nnc(CC(=O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)s1 183979136 ZRXQTPHMMVJOAL-LLVKDONJSA-N 377.539 2.864 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)c(F)c1 257372042 LPCAHEBDDVVJSR-HXUWFJFHSA-N 393.547 2.576 0 50 GFAA CCN(CCn1cccn1)C(=O)c1cccc(-c2cc(C(=O)OC)n(C)c2)c1 534631120 WAEUMPUOBWUYGK-UHFFFAOYSA-N 380.448 2.838 0 50 GFAA COCCn1cnnc1CCNC(=O)c1cccc(-c2nc(C)c(C)s2)c1 299796990 ROYZNKKWOQYWCN-UHFFFAOYSA-N 385.493 2.637 0 50 GFAA Cc1cc(C)cc(-c2nn3c([C@@H]4CCCN(S(C)(=O)=O)C4)nnc3s2)c1 825131930 CLGPVZFTOOAXIV-CYBMUJFWSA-N 391.522 2.609 0 50 GFAA Cc1cc2[nH]cc(C(=O)N[C@H](c3cccnc3)c3ccc(C)c(C)c3)c(=O)n2n1 670455910 UAKVGURDSUNYER-FQEVSTJZSA-N 387.443 2.862 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)CCc2c[nH]c3ccccc23)C1)C1CCOCC1 952990163 GUSLNOHSXJCKQA-KRWDZBQOSA-N 397.519 2.882 0 50 GFAA Cc1cc([C@@](C)(O)CNC(=O)c2cc(Br)cnc2N(C)C)c(C)o1 170004106 RZDKVRDKOFOPCR-KRWDZBQOSA-N 396.285 2.757 0 50 GFAA Cc1ccc(-c2cnc(CNC(=O)Cn3c(=O)n(C)c4ccccc43)o2)cc1 170643621 XBJDCLLJCDEETI-UHFFFAOYSA-N 376.416 2.620 0 50 GFAA Cc1ccc([C@H]2CCN(C(=O)NCc3ccc(S(N)(=O)=O)s3)C2)c(C)c1 280041668 SEXQGUJFTQTTHQ-AWEZNQCLSA-N 393.534 2.711 0 50 GFAA CCN1CCC(N(CCc2ccccn2)C(=O)Cc2ccc3c(c2)OCO3)CC1 1506427265 LMIXTQNMRLYQQK-UHFFFAOYSA-N 395.503 2.908 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@H](Cn2ccnc2)c2ccccc2)CC1 1506423835 XDTJUNPDGYMZAO-OAQYLSRUSA-N 375.476 2.914 0 50 GFAA CN(C)C(=O)CSc1nnc(NC(=O)c2ccc(-c3cnco3)cc2)s1 1529090377 HTBMPWMSMUFXBM-UHFFFAOYSA-N 389.462 2.626 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CC[C@@]4(C(=O)O)CCCN(C)[C@@H]4C3)oc2c1 1704305417 QBCKWTYXUUMJTD-UTKZUKDTSA-N 386.448 2.761 0 50 GFAA Cc1cc(OCc2cc(C(=O)NC[C@@H]3COCCO3)no2)cc(C)c1Cl 11841048 VTEBDMXYNMOQFK-OAHLLOKOSA-N 380.828 2.669 0 50 GFAA c1cc(CN2CCOc3ccc(CN4CCOCC4)cc3C2)c2nccnc2c1 11973228 BKPOTQHRZXOWOO-UHFFFAOYSA-N 390.487 2.857 0 50 GFAA C[C@H](CCn1cccn1)NCc1c(C(=O)N2CCCCC2)nc2sccn12 12303031 XFXZWTPLKFOGPE-OAHLLOKOSA-N 386.525 2.787 0 50 GFAA C[C@H]1Oc2ccc(S(=O)(=O)NC3C4CC5CC(C4)CC3C5)cc2NC1=O 12417076 MHIGFSYZFNYYRN-STDAWHRDSA-N 376.478 2.509 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N[C@@H]1CCCN(Cc2ccccc2F)C1 14974727 DMKMUSDTOOFBMR-MRXNPFEDSA-N 383.423 2.514 0 50 GFAA Cc1cccn2c(CN3CCOCC3)c(C(=O)N(C)CCc3ccccc3)nc12 19218364 IIMPQMDQMJDQKR-UHFFFAOYSA-N 392.503 2.790 0 50 GFAA Cc1ccc(-c2ccc3nnc(CNC(=O)CSc4ccncc4)n3n2)cc1 169778415 CJODZFWGHOYNIG-UHFFFAOYSA-N 390.472 2.903 0 50 GFAA COc1cc(CN2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cc2c1OCO2 1857673008 LOHYLVUXWAUXSL-QFIPXVFZSA-N 396.443 2.673 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCCn3cccn3)C1)CC2 1857698319 LKYXDQHUNIYNDI-QFIPXVFZSA-N 397.523 2.963 0 50 GFAA Cc1ccc2nccc(C(=O)N3CC[C@@]45OC[C@@H](C(C)C)N4C(=O)C[C@@H]35)c2c1 1857720428 UEWHLHHCKBKVRI-JQVVWYNYSA-N 379.460 2.741 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)[C@H]1CC[C@H](c2ccccc2)N1 1857734304 HXYKKZFXRTXJDL-LHGONGGSSA-N 391.515 2.810 0 50 GFAA C[C@@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)N1CCOCC1 111452893 VYTSRTPNBXBQNA-HNNXBMFYSA-N 388.487 2.917 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCC(=O)N(C3CC3)[C@H]2c2ccnn2C)ccc1F 366367183 XGHZFVNDUUZKRR-OXQOHEQNSA-N 384.455 2.626 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCN[C@@H](C)C3)cc2Br)on1 155011011 UBGXHUVYTAKIKO-LBPRGKRZSA-N 394.269 2.758 0 50 GFAA CCn1ccnc1CN(Cc1ncc(CN(C)C)s1)[C@@H]1CC12CCNCC2 952886871 CUQRTBIRDQEKOE-QGZVFWFLSA-N 388.585 2.565 0 50 GFAA O=C(O)c1cnc([C@@H]2CCCN2C[C@@H](O)COCc2ccc(Cl)cc2)nc1 1875282899 XLJUGIGBLISNQW-SJORKVTESA-N 391.855 2.543 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@@H]([C@@H](C)c2ccccc2)C1 1875297491 STZVMAFOOGBMIV-BLLLJJGKSA-N 376.478 2.810 0 50 GFAA COc1ccccc1[C@@H]1[C@H](O)CCN1c1nccn2ncc(Br)c12 1875392307 OHRWOHWZKKHZIY-UKRRQHHQSA-N 389.253 2.813 0 50 GFAA COC(=O)/C=C/C(=O)N1CCC2(CC1)C[C@@H]2c1nnc(-c2cccc(F)c2)o1 1875379205 PGODXPATDXGMHP-LLYBFZRZSA-N 385.395 2.701 0 50 GFAA C[C@@H]1CO[C@@H](C(=O)NC2(C3CCN(c4ccc(C(F)(F)F)nn4)CC3)CC2)C1 1775991173 JDGPVDLFSARXSO-GXTWGEPZSA-N 398.429 2.786 0 50 GFAA CC(=O)N1CCN(C(=O)NC[C@]23C[C@H]2COC32CCC2)CC12CCCCC2 898686193 XPQFRNPDFLEOOE-FXAWDEMLSA-N 375.513 2.522 0 50 GFAA NC1(C(=O)N2CCN([C@@H](COc3ccccc3)c3ccccc3)CC2)CCC1 2100555358 SFWRTVZRANTUGQ-NRFANRHFSA-N 379.504 2.832 0 50 GFAA CC1(C)O[C@]2(CCCN(C(=O)[C@]3(c4ccccc4)C[C@@H]3C(F)(F)F)C2)NC1=O 2325784335 VHTVHDWVLWDNEA-JVPBZIDWSA-N 396.409 2.750 0 50 GFAA Cc1cc(S(=O)(=O)N2Cc3c(Br)cccc3C[C@H]2C)c[nH]c1=N 2325862355 QYZKNFIXJABGKE-LLVKDONJSA-N 396.310 2.701 0 50 GFAA Cc1ccc(CC(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1 795322 VYFJBZVFZRPYBM-UHFFFAOYSA-N 382.445 2.767 0 50 GFAA C[C@H](C(=O)N1CCN(c2ccccc2Cl)CC1)N1C(=O)c2ccccc2C1=O 1029023 LWDOSUNYENFPLM-CQSZACIVSA-N 397.862 2.673 0 50 GFAA COc1cc(OC)c(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1Cl 2883556 NUXCYVXIAHTUEJ-UHFFFAOYSA-N 388.807 2.982 0 50 GFAA COc1ccc(C(=O)[C@@H](C)OC(=O)c2ccc(NC(=O)CCC(=O)O)cc2)cc1 8473690 BWYMGXYAXXHOGE-CYBMUJFWSA-N 399.399 2.927 0 50 GFAA CC(C)c1cc(CNC(=O)N2CCN(c3ncnc4sccc34)CC2)on1 114605896 ZSOBTMDLYMYXMK-UHFFFAOYSA-N 386.481 2.835 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCO[C@@H](c3cccc(O)c3)C2)[C@@H]1c1ccccc1 247253407 YMJNARBXMPBTHD-VWPQPMDRSA-N 394.471 2.902 0 50 GFAA CCCN1CCN(C(=O)c2cnn(-c3nccc(-c4cccs4)n3)c2C)CC1 64058187 HIAARMXHNIYYEB-UHFFFAOYSA-N 396.520 2.867 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@@H]1CCOC1)CC2 12074268 NQYUNCCSJLMOEO-QGZVFWFLSA-N 382.435 2.928 0 50 GFAA C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)Nc2ccc(C(N)=O)cc2)CC1 171722717 NXYCPEYKFBMZBJ-CYBMUJFWSA-N 388.418 2.974 0 50 GFAA COc1ccccc1N1CC[C@@H](Nc2ncnc3ccc(S(C)(=O)=O)cc23)C1 252497953 QRWHWPRBOHXNSF-CQSZACIVSA-N 398.488 2.733 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4cc(Cl)cc(Cl)c4)ccc3n2n1 71385161 XMLDFIAAAPMPKD-UHFFFAOYSA-N 379.232 2.852 0 50 GFAA O=C(NCCNc1cc(N2CCCC2)ncn1)c1cccc(C(F)(F)F)c1 72119096 BSFPGMVZAGMAFJ-UHFFFAOYSA-N 379.386 2.938 0 50 GFAA Cn1cnnc1-c1ccc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1 172781887 CNOLNTRTUGGDOO-UHFFFAOYSA-N 389.459 2.973 0 50 GFAA COc1ccc2c(c1)OCC[C@@H]2NC(=O)NC1CCN(Cc2ccccn2)CC1 363288036 FPVJIHYKNQOUNN-FQEVSTJZSA-N 396.491 2.878 0 50 GFAA CC[C@@]1(O)CCN(C(=O)c2cccnc2SCCc2ccccc2)C[C@H]1O 72420517 GFOYXNDIXXHKMQ-WIYYLYMNSA-N 386.517 2.764 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1CCOC[C@H]1c1nnc(-c2ccccc2)o1 286153303 UUMSOBQICMELAH-KRWDZBQOSA-N 381.436 2.609 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(C(=O)[C@H]1CCc3ccccc3C1)CC2 95520636 YUBVNGPCRUNYBF-IBGZPJMESA-N 378.520 2.911 0 50 GFAA CC(C)[C@@H](C)NC(=O)N1CCC2(CCC(=O)N(CCCn3ccnc3)C2)CC1 91829348 CUFYMQSTXGXJMA-GOSISDBHSA-N 389.544 2.732 0 50 GFAA Cc1ccc2nc(C(=O)N3CCc4nnc(Cc5ccccc5)n4CC3)cn2c1 91690988 CGNGSBWCMNKPNC-UHFFFAOYSA-N 386.459 2.524 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)Cn1ccnc1)CC2 95527937 ISMCJUVINMWSPT-UHFFFAOYSA-N 392.434 2.788 0 50 GFAA CCc1noc(-c2ccccc2NC(=O)N2CCC[C@]3(CN(C)C(=O)O3)C2)n1 96164786 MPBJGZNQEZADMX-IBGZPJMESA-N 385.424 2.748 0 50 GFAA Cc1ccccc1COC1CN(C(=O)c2cnc(-c3cccnc3)nc2O)C1 96165213 UHRUNUYJVPNISL-UHFFFAOYSA-N 376.416 2.594 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)NCCc1nc(O)cc(=O)[nH]1)c1ccccc1 95517405 CHJPHGUXIXHLLS-SFHVURJKSA-N 377.444 2.665 0 50 GFAA O=C(Cc1ccccc1Cl)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 180290197 MUVDUQHHVXGYRH-INIZCTEOSA-N 384.929 2.736 0 50 GFAA CN(CC1(CO)CCC1)C(=O)[C@@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91829300 VLMLBZVKRDHZDY-MRXNPFEDSA-N 378.900 2.700 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccc(OC(F)F)cc2)[C@H]2C[C@@H](O)C2)cn1 244691784 JJIXGSYUQLIWBN-JKIFEVAISA-N 378.375 2.934 0 50 GFAA Cc1nc(-c2ccc(CNC(=O)[C@H](C)n3c(=O)oc4ccccc43)cc2)no1 244763920 OXXVWTZQSBJQOI-LBPRGKRZSA-N 378.388 2.830 0 50 GFAA COc1ccc([C@H]2[C@@H](C(=O)NC[C@@H]3CCCN4CCCC[C@H]34)CC(=O)N2C)cc1 253400189 DRUXYJWJUPVKGV-KMQSCTNJSA-N 399.535 2.595 0 50 GFAA biogenic Cc1nnnn1-c1cccc(NC(=O)CCSc2ccc3c(c2)OCCO3)c1 606173893 PQBBMRONKUKCOL-UHFFFAOYSA-N 397.460 2.863 0 50 GFAA Cc1c(NC(=O)CC(C)C)cccc1NC(=O)NCC1(CO)CCOCC1 299764621 BRSCOFQCSYRDKE-UHFFFAOYSA-N 377.485 2.890 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)CCc2ccc(F)cc2F)cc1 827820875 KREUHVUYUDPCOG-UHFFFAOYSA-N 396.459 2.691 0 50 GFAA O=C(NC1CCN(Cc2ccco2)CC1)N(Cc1cocn1)Cc1cocn1 584888042 BLZYKVUINGRUMH-UHFFFAOYSA-N 385.424 2.632 0 50 GFAA Cc1ncc(CN2CCC3(CC2)CN(c2cnc4ccccc4n2)CCO3)[nH]1 825106321 MIHKWJJQKYJILL-UHFFFAOYSA-N 378.480 2.533 0 50 GFAA C[C@@H]1CN(C2CCN(C(=O)c3ccc(OCc4ccccc4)nc3)CC2)CCO1 171258699 XXMAJYCKJNIWEL-GOSISDBHSA-N 395.503 2.986 0 50 GFAA COCc1cccc(CC(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c1 188983985 BWORGKODAAZDHH-UHFFFAOYSA-N 384.451 2.889 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(-c4noc(C5CC5)n4)cc3)C[C@@H]2O)on1 1704352225 AAHGEURZANYCRJ-AEFFLSMTSA-N 394.431 2.586 0 50 GFAA CS(=O)(=O)c1ccc(CN2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)cc1 1704302833 DKEZNMDWUWOBFZ-XMSQKQJNSA-N 396.512 2.674 0 50 GFAA COc1ccc(F)c(F)c1CN1CC[C@H](O)[C@@](Cc2ccccc2)(C(=O)O)C1 1704352206 RUEZKHJZBWOFTA-RXVVDRJESA-N 391.414 2.854 0 50 GFAA Cc1cccc(CN2C[C@@H]3CN(CCOc4ccc(F)cc4)C[C@]3(CO)C2)c1 1772807462 NVAATZAAWPJKFW-NZQKXSOJSA-N 384.495 2.939 0 50 GFAA COCCCn1c(C(=O)Nc2cccnc2)cc2c(=O)n3cccc(C)c3nc21 5246559 UUWZFYTWERAZPO-UHFFFAOYSA-N 391.431 2.641 0 50 GFAA COc1cccc(CCNC(=O)[C@H]2CCC(=O)N(Cc3cccc(OC)c3)C2)c1 11873553 YNLNLJHXGGACPG-IBGZPJMESA-N 396.487 2.801 0 50 GFAA CCN(CC)C(=O)c1cnn(-c2nccc(-c3ccc4c(c3)OCO4)n2)c1C 12150123 JDUFKPBJLYGHCB-UHFFFAOYSA-N 379.420 2.848 0 50 GFAA CN(C(=O)CCN1CCCCCC1=O)[C@@H]1CCCN(CCc2ccccc2)C1 12195801 GGIOMUQNJGQCEO-OAQYLSRUSA-N 385.552 2.945 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)[nH]n1 12433744 MQIBSKCNCGJXNX-UHFFFAOYSA-N 384.484 2.631 0 50 GFAA CN(C[C@@H](O)COc1cccc(CN2CCC(O)CC2)c1)C1CCCCC1 12578831 YHXCQZJDCUBFJR-OAQYLSRUSA-N 376.541 2.648 0 50 GFAA Cn1nc(C(=O)N2CCC[C@H](C(=O)c3cccc(C(F)(F)F)c3)C2)ccc1=O 12835800 CJOAJRXGIPQEQK-ZDUSSCGKSA-N 393.365 2.534 0 50 GFAA Cc1noc(C)c1CC(=O)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 14949836 GFHWVBQLRHFLHU-SFHVURJKSA-N 377.444 2.904 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@@H](C2CCN(CCc3ccccc3)CC2)C1 19300727 ZLCZRSICPYBNKT-JOCHJYFZSA-N 379.504 2.737 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4cc(C)no4)[C@H]4CC[C@]3(C2)O4)c1 1857717903 DXUODLIIYMZRKN-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC[C@@H]4c4nc(C)no4)CC3)nc2n1 1857731427 IAZSUPJVJXIBGO-OAHLLOKOSA-N 396.451 2.803 0 50 GFAA O=C(CNc1cccnc1)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857740745 XUJGGFDYOQJVPZ-WOJBJXKFSA-N 381.476 2.767 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(c4cc(F)ccc4F)CC3)n[nH]c21 1875394096 VGWPYUYILNYBHT-NEPJUHHUSA-N 376.407 2.673 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NC3CC(c4ccccc4)C3)C2)c1C 1875397976 VUXGWXNJUDVIAQ-IOJLRTSASA-N 393.535 2.910 0 50 GFAA O=C(NCCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1-n1cncn1 1875316125 WJMCGYUSRYEPKF-UHFFFAOYSA-N 394.822 2.943 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1cnc2c(n1)CCCC2 1875401884 VAYAKGROQMGEQU-KDOFPFPSSA-N 396.495 2.847 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CC(c4cnc5ccccc5n4)C3)nn(C)c21 1875403947 MJUDEZSBDPQXSC-OLZOCXBDSA-N 377.448 2.625 0 50 GFAA Cc1ccc(C2(C(=O)N[C@@H]3C[C@H](Cn4ccnc4)C[C@H]3O)CCOCC2)cc1C 1875402247 DBSKQPHWJJGNCD-CEWLAPEOSA-N 397.519 2.504 0 50 GFAA Cc1ccn2nc(C(=O)Nc3cc(CN4CCSCC4)ccc3C)nc2n1 2325703707 YAIXRSAALXJETM-UHFFFAOYSA-N 382.493 2.542 0 50 GFAA O=C(N[C@@H]1CCCc2sccc21)c1nc(N2CCOCC2)ncc1Cl 2325738051 LDRAATORVUWSFF-CYBMUJFWSA-N 378.885 2.836 0 50 GFAA COC(=O)c1cc(CSc2nnc(O)n2C[C@H]2CCCO2)c(Cl)s1 2325772347 DUAIBPCAJGQUAI-SECBINFHSA-N 389.886 2.957 0 50 GFAA C[C@H]1C[C@@H](CS(=O)(=O)N2CCC(CCCn3ccnc3)CC2)C[C@@H](C)O1 2325804194 ZMDFYJXHHJAPGD-DZFIZOCASA-N 383.558 2.909 0 50 GFAA CC(C)n1cnnc1Cc1nc(-c2cccc(N)n2)nn1Cc1ccccc1F 2325841010 AABVUKAPKJMPHP-UHFFFAOYSA-N 392.442 2.873 0 50 GFAA CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H](N)C(=O)O)cc1 2325851521 BFLARXNIHCOOOX-FQEVSTJZSA-N 394.475 2.828 0 50 GFAA Oc1ccc(Nc2nc(Nc3ccc(O)cc3)nc(N3CCOCC3)n2)cc1 756251 HZHFVKUAGLVYKG-UHFFFAOYSA-N 380.408 2.607 0 50 GFAA Cc1cccnc1CN1CCN(Cc2cn(CCC(N)=O)c3ccccc23)CC1 55060762 VNYRBNUQQUDJSU-UHFFFAOYSA-N 391.519 2.538 0 50 GFAA Cc1ccn(CCC(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)n1 55037013 HOJVLPVWXQGNDN-NRFANRHFSA-N 395.551 2.703 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)c2ccc4c(c2)OCO4)C3)no1 20448728 SUVMFUXYWPRHLW-UHFFFAOYSA-N 378.388 2.676 0 50 GFAA O=C1NCCN(Cc2cccc(C(F)(F)F)c2)[C@H]1CC(=O)N1CCCCCC1 55269680 ZRJRZULMKNRWIB-KRWDZBQOSA-N 397.441 2.799 0 50 GFAA O=C(c1ccc(CO)o1)N1CCCn2nc(-c3nc4ccccc4[nH]3)cc2C1 67787759 WDWLPBVZLKVXKT-UHFFFAOYSA-N 377.404 2.558 0 50 GFAA O=C(NC1CCN(Cc2cccnc2)CC1)c1ccc(OCC(F)(F)F)nc1 172244311 PPFFIWKKGDFATE-UHFFFAOYSA-N 394.397 2.812 0 50 GFAA COCCc1noc(-c2ccc(N3CCCN(c4ccncc4C)CC3)nc2)n1 72419690 XTVFXZMZXSGQQG-UHFFFAOYSA-N 394.479 2.741 0 50 GFAA CC(=O)c1cc(CN2CCC(N3CCC(C(=O)NC4CC4)CC3)CC2)cs1 15078387 WIVZLRWFEROZAD-UHFFFAOYSA-N 389.565 2.906 0 50 GFAA O=C(CN1CCN(c2ccccc2F)CC1)NCCc1ccc(Cl)cc1 13323416 WABPWTFMYAEXIJ-UHFFFAOYSA-N 375.875 2.960 0 50 GFAA CC[C@H](O)c1cc2n(n1)CCCN(Cc1cnn(-c3ccccc3OC)c1)C2 220222151 LXGYAIDFOYJNHG-FQEVSTJZSA-N 381.480 2.927 0 50 GFAA CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)c1ccc(-c2cnc(O)nc2)cc1 426528079 SNZZVLAZYWRVQG-NRFANRHFSA-N 388.471 2.978 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCC(O)(C(=O)O)CC3)sc2C)cc1 263522472 HWQZUDIPLBDYPF-UHFFFAOYSA-N 375.446 2.784 0 50 GFAA Cc1nn(C)c(C)c1-c1ccnc(NCCc2nc(-c3ccccn3)no2)n1 48175545 RAUUADDEABSBEE-UHFFFAOYSA-N 376.424 2.594 0 50 GFAA CN(C)c1ccc(C(=O)N2CCn3nc([C@H](O)c4ccccc4)cc3C2)cc1 222519587 YOBJJZLUYQSRHO-OAQYLSRUSA-N 376.460 2.687 0 50 GFAA CC[C@H](NS(=O)(=O)c1cccc(C(=O)N(CC)CC)c1)c1nc(C)c[nH]1 95352337 MUQSBIKXXVJTBH-INIZCTEOSA-N 378.498 2.630 0 50 GFAA CC(=O)c1cc(CN2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)n(C)c1 91452283 UPABUUAZKWNMAN-HXUWFJFHSA-N 387.524 2.611 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)C2CCCCCC2)CN1Cc1cccs1 91604658 DADQHCBJBXQSPP-WMZOPIPTSA-N 377.554 2.914 0 50 GFAA COc1cc(CN2CC(c3cccnc3)C2)ccc1OC[C@H](O)CN1CCCC1 95516898 WUZSZEWWWNBSGW-OAQYLSRUSA-N 397.519 2.525 0 50 GFAA Cc1nc(C2CCN(C(=O)c3ccc4nc(C)c(C)nc4c3)CC2)cc(=O)[nH]1 95361012 XHHASYIFWFXWSC-UHFFFAOYSA-N 377.448 2.658 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91391409 FYLDGFMIHGBPNV-JTQLQIEISA-N 382.247 2.576 0 50 GFAA COCCCn1c(C)cc(C)c(C(=O)N[C@H](C)c2nc3ccccc3n2C)c1=O 252490465 KUEQGELYVVDWKW-MRXNPFEDSA-N 396.491 2.879 0 50 GFAA CCOc1ccccc1CCCNC(=O)N1CCN(C(=O)c2ccco2)CC1 534580400 YATGDSDBPKWAFU-UHFFFAOYSA-N 385.464 2.779 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@H](NCc2ccc(F)cc2F)CNC3=O)c1 263616840 KUZZDKHPLGCQOZ-IBGZPJMESA-N 384.386 2.869 0 50 GFAA COc1cccc(-c2cc(-c3c(C)nn(C)c3C)nc(N3CC[C@H](N)C3)n2)c1 824789997 YEWURMAMKIMOMS-INIZCTEOSA-N 378.480 2.707 0 50 GFAA COc1ccc([C@@H](C)NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCC4)cc1 169778285 OMMYRJOEWFADNJ-OAHLLOKOSA-N 394.475 2.729 0 50 GFAA Oc1cccc(CN[C@H]2C3CN4CCN(C3)CC2(c2ccccc2)C4)c1Cl 952974215 INKZDYCVJVRKDW-LPBNZCGVSA-N 383.923 2.703 0 50 GFAA CCCNC(=O)c1ccc(C)c(NC(=O)c2ccc(-c3nnn(C)n3)cc2)c1 952984993 DLAREJZZHZSQEO-UHFFFAOYSA-N 378.436 2.578 0 50 GFAA COc1ccc(C(=O)N2CCCC2)cc1NC(=O)N[C@H]1c2ccccc2C[C@H]1O 274755666 IUUOXTYBBBDIJA-QUCCMNQESA-N 395.459 2.711 0 50 GFAA CN(C)c1nccc([C@H]2CN(C(=O)Nc3ccc(-c4cc[nH]n4)cc3)CCO2)n1 275413385 CSOGNJXEFXTLOH-GOSISDBHSA-N 393.451 2.538 0 50 GFAA Cc1cc(Oc2ccc(C(=O)NCCN3CCNCC3)cn2)ccc1C(C)C 170676523 XOJOXUCZESSFAZ-UHFFFAOYSA-N 382.508 2.941 0 50 GFAA CCOC(=O)[C@@](C)(CNC(=O)c1cnn(-c2ccccc2)n1)c1ccccc1 170605692 URVQJCOPQILAPE-NRFANRHFSA-N 378.432 2.518 0 50 GFAA O=C1CCCN1CCCC(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704335030 JNJRCWVMQKOMGP-UHFFFAOYSA-N 395.503 2.961 0 50 GFAA CN(C)C[C@@]12CN(C(=O)C3C(C)(C)C3(C)C)C[C@H]1CN(c1ccncc1F)C2 1772812105 APTYSKZDULRFPI-IVZQSRNASA-N 388.531 2.729 0 50 GFAA Cc1cccc(-c2noc(CCCC(=O)N3CCCN(C(=O)C4CC4)CC3)n2)c1 1772705458 LCJDMSAOPGWZEP-UHFFFAOYSA-N 396.491 2.839 0 50 GFAA CC(C)N1CC[C@@H](C(=O)N2CCCN(C(=O)c3c(F)cccc3Cl)CC2)C1 1772703185 HARIFBSQEMLMJM-OAHLLOKOSA-N 395.906 2.884 0 50 GFAA O=C1CC[C@H](C(=O)N(CCO)Cc2ccccc2)CN1CCc1cccc(F)c1 11879213 XLJYYYWUCLSELI-FQEVSTJZSA-N 398.478 2.628 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N(Cc2c(C)nn(C)c2C)C2CC2)nn1 12314649 QSQRLJXABRJLQF-UHFFFAOYSA-N 378.480 2.790 0 50 GFAA O=C(NCc1ccccn1)c1cccc(OC2CCN(Cc3ncc[nH]3)CC2)c1 12317706 QOANBGBLUBLSKY-UHFFFAOYSA-N 391.475 2.778 0 50 GFAA COC(=O)CCCC[C@@H]1SC[C@H](NC(=O)c2ccccc2)[C@@H]1OC(C)=O 12379845 PVEAODUKPHUVRQ-BQFCYCMXSA-N 379.478 2.566 0 50 GFAA biogenic O=C(Cc1c(F)cccc1Cl)NCc1cccnc1N1CCC[C@@H](O)C1 12835566 NPSNSEDRRDGZJX-CQSZACIVSA-N 377.847 2.694 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1)NC1CCC1 12836474 CSFZWLHWDUEVHL-OAQYLSRUSA-N 393.487 2.838 0 50 GFAA c1ccc(CCc2nnc3n2CCN(Cc2ccc4c(c2)OCO4)CC3)cc1 19340590 CRWOUKCXLHLVHK-UHFFFAOYSA-N 376.460 2.850 0 50 GFAA CCOC(=O)c1c(-c2ccco2)csc1NC(=O)CN1CCN(CC)CC1 19910697 ARLQMURCLHRZIN-UHFFFAOYSA-N 391.493 2.761 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCN(c2cc(-c3cccs3)n[nH]2)CC1 169753213 QSAUJXSGEXRWDY-UHFFFAOYSA-N 382.445 2.829 0 50 GFAA CN1CCN(CCCOc2ccccc2-c2nccn2CCC(C)(C)O)CC1 1857667962 ZVXJGOJQWZJBNZ-UHFFFAOYSA-N 386.540 2.727 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3[C@H]4CC[C@@H]3[C@@](CO)(Cc3ccccc3)C4)cc2n1 1857673175 KPSXWLPNNZXAJT-NOXFTYBFSA-N 390.487 2.944 0 50 GFAA Cc1nc(CCNC(=O)c2cc3c(s2)CCOC32CCNCC2)sc1C 1857683822 ZNFZNWPQYCACIW-UHFFFAOYSA-N 391.562 2.945 0 50 GFAA CN[C@@H](CC(C)C)C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857731710 XYQSCEJLVBLXDI-CADBVGFASA-N 379.932 2.605 0 50 GFAA O=C(c1c[nH]nc1[C@@H]1CCOC1)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 330320492 FDYKBWCSLQTNNI-HZPDHXFCSA-N 392.463 2.719 0 50 GFAA COc1ccc(/C=C/CN2CCC(n3cc(C(=O)NC(C)C)nn3)CC2)cc1 14955459 GGOALMCDQBDSBG-SNAWJCMRSA-N 383.496 2.775 0 50 GFAA CCCNC(=O)c1cccc(NC(=O)[C@H]2CN(Cc3ccccc3)CCO2)c1 265878657 SPJCRCQSXNSWBU-HXUWFJFHSA-N 381.476 2.666 0 50 GFAA N[C@@H]1CCO[C@H](C(=O)N2C[C@H](c3ccc(F)cc3)O[C@H](c3ccccc3)C2)C1 1875276953 PWQSXBADQCMPAK-IVAOSVALSA-N 384.451 2.973 0 50 GFAA O=C(Nc1cc(Cl)ccc1OC[C@H]1CCOC1)NC12CC(C(=O)O)(C1)C2 1875279335 SDTFMYNGDAGQAW-NVWNAPEYSA-N 380.828 2.884 0 50 GFAA Cc1ccc(-c2csc(NC(=O)[C@@H](C)CS(C)(=O)=O)c2C(N)=O)cc1C 1875355057 YLIYRCPNGRWOED-LBPRGKRZSA-N 394.518 2.750 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)c2nn(C)c3c2C[C@@H](C)O[C@H]3C)cc1 1875404095 UQXIBNAXZQJNRD-KGLIPLIRSA-N 379.464 2.866 0 50 GFAA CC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)Nc1ccc(NC(C)=O)cc1 2841214 UXUMNVCNJJPMJF-GOSISDBHSA-N 389.477 2.649 0 50 GFAA O=C(N=c1ccn(Cc2ccncc2)[nH]1)c1cnc2c(cnn2C2CCCC2)c1 2325703932 WRAXOSNNJPVPEP-UHFFFAOYSA-N 387.447 2.860 0 50 GFAA O=C(Cc1ccc(Br)cc1)N1CCN(C(=O)c2ccco2)CC1 659416 DEBFVLHSXSKZHZ-UHFFFAOYSA-N 377.238 2.569 0 50 GFAA Cc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N2CCC[C@@H]2C(=O)O)cc1 2830212 BJRKXELMVXGPIO-GDLUXTLDSA-N 378.428 2.842 0 50 GFAA CCCCN1CCOC[C@H]1C(=O)NCc1cc2c(cc1OCC)C[C@@H](C)O2 225385004 UQGNSAJSJZETIZ-QAPCUYQASA-N 376.497 2.526 0 50 GFAA COc1ccc(OC)c(CN(c2cc(N3CCC[C@@H](CO)C3)ncn2)C2CC2)c1 246322015 AOMGWHKYVBJOJE-MRXNPFEDSA-N 398.507 2.872 0 50 GFAA O=C(NCCO)c1ccc([C@@H]2CCCN2C(=O)Cc2ccc(F)cc2)s1 20999888 SBUPMOGOSVXKCE-HNNXBMFYSA-N 376.453 2.516 0 50 GFAA O=C1N[C@H](c2ccc(O)cc2)[C@H](C(=O)c2ccc(F)cc2)[C@@](O)(C(F)(F)F)N1 100736590 MPEPRMHZBVKOIL-CKEIUWERSA-N 398.312 2.635 0 50 GFAA CCOc1ccccc1CN(CC)C(=O)[C@@H]1CC(=O)N(Cc2cccnc2)C1 55342816 OVINQBOZRHGGNL-LJQANCHMSA-N 381.476 2.878 0 50 GFAA CCc1noc(CN2CCOc3c(O)cc(-c4nc(C)cnc4C)cc3C2)n1 67755784 YYFNYKUBPXYRGX-UHFFFAOYSA-N 381.436 2.806 0 50 GFAA CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC 33830337 DAXYUDFNWXHGBE-NRAMRBJXSA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro CCc1nccc(-c2c(-c3ccccc3)ncn2CCSc2nnnn2C)n1 65508149 AIFJFGCOKDBUNY-UHFFFAOYSA-N 392.492 2.885 0 50 GFAA Cc1cc(C(=O)NCCNC(=S)Nc2ccc(Cl)cc2Cl)nn1C 2741104 SJHIRHQADAYUND-UHFFFAOYSA-N 386.308 2.752 0 50 GFAA O=C([C@H]1CC12CCCC2)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc2C1 77393999 GZBQJVDAHIKGDC-LJQANCHMSA-N 388.533 2.936 0 50 GFAA C[C@@]1(C(=O)N2CCC(Cn3ccnn3)CC2)CC(c2ccccc2Cl)=NO1 253408144 XMMYPSKMHIMMHZ-IBGZPJMESA-N 387.871 2.753 0 50 GFAA CCCc1cc(CN(C)C(=O)[C@H]2CCCN(C3CCN(C(C)C)CC3)C2)n[nH]1 71761081 ZUPSHFFVLQZLTI-SFHVURJKSA-N 389.588 2.905 0 50 GFAA Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)c1cnc(Oc2ccccc2)cn1 125656600 MVJOQODXARVXOL-FQEVSTJZSA-N 388.427 2.891 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 156410182 FFVBXCDQDGMHFB-MLGOLLRUSA-N 379.482 2.510 0 50 GFAA Cc1c(C(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)nnn1C1CCNCC1 236779609 PWPWXZDSRZALOP-KRWDZBQOSA-N 381.484 2.514 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)O)N(C(=O)c2sc3nc(C(F)(F)F)ccc3c2C)C1 262923097 IXQLINYTLZKGEC-SCZZXKLOSA-N 388.367 2.938 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@H]1CN[C@H]1CCc2cc(F)c(F)c(F)c21 449322255 OPWZFLBCMQXKBL-YUTCNCBUSA-N 376.444 2.789 0 50 GFAA Cc1sc(NC(=O)COCC(=O)O)c(C(N)=O)c1-c1ccc(C(C)C)cc1 17079631 ZIPCDVJICOONPK-UHFFFAOYSA-N 390.461 2.986 0 50 GFAA CCn1nc(CO)c2c1CCN(C(=O)CSCc1ccccc1Cl)C2 220299303 FUQBOCNGHWPRKP-UHFFFAOYSA-N 379.913 2.867 0 50 GFAA CCn1cc(C(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)c(C)n1 95528740 PRLZYBMDZOTMDO-HNNXBMFYSA-N 384.509 2.933 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)c1 91620843 ZLMKEPKKRKIHMA-KRWDZBQOSA-N 386.492 2.724 0 50 GFAA COCCNc1nc2cc(C(=O)NC[C@@H]3COc4ccccc4C3)ccc2n1C 91270059 XBVRIBSFCZWIJJ-OAHLLOKOSA-N 394.475 2.613 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C[C@H]3CCCO3)CC2)c1 95520127 HPCQMNKQZXVAMK-LJQANCHMSA-N 388.508 2.953 0 50 GFAA COc1ccc(CN(C)C(=O)c2cnc(-c3ccc(C)cc3)[nH]c2=O)cc1O 91325907 BCOUYDCVSNYVIM-UHFFFAOYSA-N 379.416 2.732 0 50 GFAA CS(=O)(=O)c1cc(C(=O)NC2CCN(CCc3ccccc3)CC2)cs1 179691565 HOHJIECRWGTJNW-UHFFFAOYSA-N 392.546 2.589 0 50 GFAA O=C(NCc1ccccc1F)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 243892599 AJPHDSHKGPGAOH-WKILWMFISA-N 383.423 2.875 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCN3CCC[C@H]3C2)nc1 244691542 JERLKUUAYPJEBK-IBGZPJMESA-N 396.539 2.506 0 50 GFAA O=C(Cc1ccc(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)cc1)NC1CC1 827848682 IHQZSFOGKZKUQZ-QGZVFWFLSA-N 378.476 2.758 0 50 GFAA Cn1cccc1C(=O)C(=O)N1C[C@@H]2CC[C@H]1CN(CCCc1ccccc1)C2 1565527590 ZEWDHJQLLGXZLQ-UXHICEINSA-N 379.504 2.763 0 50 GFAA COc1ccc(CNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)cc1C(=O)O 408526013 UWLJGPFKNHQJNM-JTQLQIEISA-N 386.429 2.756 0 50 GFAA CN(C)c1nccc([C@@H]2CN(C(=O)Nc3ccccc3N3CCCC3)CCO2)n1 275330827 RDLFWOVMAXHYMD-IBGZPJMESA-N 396.495 2.748 0 50 GFAA COc1cc(NC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)nn1C 170599490 RCDJNGDETHKMRR-ZDUSSCGKSA-N 397.262 2.979 0 50 GFAA Cc1cc(CCC(=O)N(CC(=O)O)C[C@@H]2CCCO2)ccc1Br 170592059 UISGMKWCTKRWHA-AWEZNQCLSA-N 384.270 2.782 0 50 GFAA O=C(c1cccnc1)N1CCC(NCCc2nccc(-c3ccccc3)n2)CC1 1506413672 KZVPSHBAOYHUNN-UHFFFAOYSA-N 387.487 2.976 0 50 GFAA CC(=O)NCC(=O)N1C[C@H]2CN(C3CCCCC3)C[C@]2(CCc2ccccc2)C1 1772819891 WQVSWQVUCJJHDD-ZJSXRUAMSA-N 397.563 2.848 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@@](Cc2ccccc2)(C(=O)OCC)C1 11753652 LTVHAZWWXDSLLP-QFIPXVFZSA-N 399.491 2.974 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3ccc(Cl)cc3)c2)C1=O 12003879 CWXGKLGQFOZXEE-LLVKDONJSA-N 378.837 2.905 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@H](CNC(=O)[C@@H]2CCCN(C)C2)C3)n1 12040308 AKYRJSNWLNNYOH-MSOLQXFVSA-N 380.492 2.522 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 17334206 JQLLWVYPUZAWQX-UHFFFAOYSA-N 378.519 2.807 0 50 GFAA Cc1nc(N2CCC[C@H](O)C2)c2c(n1)C1(CC2)CCN(Cc2cccnc2)CC1 1857702857 RBBJTCTTWVJKDS-IBGZPJMESA-N 393.535 2.621 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)c(O)n1 1857717324 KLERSDZEBZFZRE-PMACEKPBSA-N 381.476 2.774 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)/C=C/c3ccccc3)C1)CC2 1857729239 BAFZIJPBQPOOSM-CZQLGGELSA-N 378.476 2.768 0 50 GFAA O=C(c1cccc(O)c1)N1C[C@@H]2OC(=O)N(CCCc3ccc(F)cc3)[C@@H]2C1 211361980 WVSVOCSMCNVVRE-MOPGFXCFSA-N 384.407 2.809 0 50 GFAA CSc1nc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2[nH]cnc2C)C3)cs1 248002594 CJPLBYSLGPHOFO-OLZOCXBDSA-N 377.539 2.633 0 50 GFAA CN1CCN(CCOc2ccccc2NC(=O)c2cn(C)nc2C(C)(C)C)CC1 952847513 WQGWUXHQGPIGNE-UHFFFAOYSA-N 399.539 2.596 0 50 GFAA CC(C)C[C@@H](NS(C)(=O)=O)c1nc(Cc2nc(C(F)(F)F)cs2)no1 1875270732 INKJSWYHHUJHCY-MRVPVSSYSA-N 398.432 2.772 0 50 GFAA CCn1c(C(=O)NC[C@@H]2C[C@H](OC)CN2c2cc(C)ncn2)cc2ccccc21 1875393141 HORVIRFLVZMENX-ROUUACIJSA-N 393.491 2.783 0 50 GFAA CCOC(=O)c1nn(Cc2ccccn2)c2c1CN(Cc1ccc(O)cc1)CC2 14532037 LTZJIRGADVWGAZ-UHFFFAOYSA-N 392.459 2.767 0 50 GFAA Cc1c(CN)c(=NC(=O)[C@@H](C)Sc2ccnc3cc(Cl)ccc23)[nH]n1C 2325795152 KBFXBYIKZQDFGE-LLVKDONJSA-N 389.912 2.930 0 50 GFAA COc1ccc(NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)c(OC)c1 655166 QZUSZDKCOQRZBY-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cnn2c(C(F)(F)F)cc(-c3ccco3)nc12 1517166 REEHXWOUYZLEPT-SNVBAGLBSA-N 380.326 2.917 0 50 GFAA O=C(c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2)N1CCOCC1 2697213 MBSVWRNTIGCZIP-UHFFFAOYSA-N 391.427 2.783 0 50 GFAA COc1c(C)cccc1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356154972 RJXVVBCGGSBTKE-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA COc1ccc(N2CCN(c3noc(-c4ccccc4)c3C(=O)O)CC2)cn1 2356155882 MQMZYODJONFEIH-UHFFFAOYSA-N 380.404 2.770 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccccc2NC(=O)c2ccccc2F)CC1 4815806 ZYGWYDOQZYJXMZ-UHFFFAOYSA-N 399.422 2.992 0 50 GFAA CCOc1cc(-c2noc(CCCC(=O)NC)n2)cc(Br)c1OC 4838832 NHENHKBQSIOQNH-UHFFFAOYSA-N 398.257 2.975 0 50 GFAA COc1cccc(CNCCSc2nnnn2C)c1OCc1ccccc1 4998048 VIQIHFAWPDAXJP-UHFFFAOYSA-N 385.493 2.680 0 50 GFAA CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)c1cc(=O)nc2sccn12 55227325 KJWIHIOIUSKKLM-UHFFFAOYSA-N 381.461 2.646 0 50 GFAA COC(=O)c1cccc(NC(=O)CN2CC[C@@H](n3c(C)nc4c3CCCC4)C2)c1 225430821 RMJMDKNYIRBSRG-GOSISDBHSA-N 396.491 2.742 0 50 GFAA CC[C@H](NCc1ccccc1OCCCN1CCN(C)CC1)c1ccnn1C 55369677 VUBAJLFBQJROGR-FQEVSTJZSA-N 385.556 2.677 0 50 GFAA CCN1CCN(C(=O)c2cnn(-c3nccc(-c4ccco4)n3)c2C2CC2)CC1 55283067 MLIGEVJGOJXGPT-UHFFFAOYSA-N 392.463 2.577 0 50 GFAA Cc1ccc(OC[C@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c(C)c1 20806363 GBONNEDZOONZNC-HXUWFJFHSA-N 398.503 2.590 0 50 GFAA C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C[C@H]1COc2ccccc2O1 248006248 OPBSCUMSGVPVTO-CVEARBPZSA-N 395.459 2.522 0 50 GFAA O=C(CNc1cccc(Cl)c1)N[C@H]1CCCN(c2ncnc3[nH]ccc23)C1 116450177 SPSNKQVUYDXOGY-HNNXBMFYSA-N 384.871 2.808 0 50 GFAA COC(=O)CCNC(=O)CCc1nnc(Cc2ccc(-c3ccccc3)cc2)o1 20599195 MYUJNFAMHJWAOW-UHFFFAOYSA-N 393.443 2.939 0 50 GFAA C[C@@](CO)(CNC(=O)CCCc1ccc2c(c1)CC(=O)N2)Cc1ccccc1 252496959 PWNNXMYRDMNOQE-QHCPKHFHSA-N 380.488 2.861 0 50 GFAA Cc1ccccc1[C@H]1[C@@H](C(=O)N(C)Cc2cccnc2)C[C@@](C)(C(=O)O)N1C 67803526 AUZOIZYRJJTNBV-IPJJNNNSSA-N 381.476 2.885 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(Cc3ccc(Br)s3)C2=O)nn1 328614320 VPLKTQDYHSZGCA-NSHDSACASA-N 398.286 2.551 0 50 GFAA O=C(CCOC[C@@H]1CCCO1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1 153091763 ONXRLYRXNBGDQJ-UXHICEINSA-N 398.507 2.854 0 50 GFAA O=C(CCC(=O)c1ccc(F)cc1)NC1CCN(C(=O)N2CCCC2)CC1 219110319 BSZBIKQSNZZZGQ-UHFFFAOYSA-N 375.444 2.585 0 50 GFAA O=C(c1cc(C(=O)N2CCNC[C@H]2c2cccc(Cl)c2)c[nH]1)N1CCCC1 261994665 MZDAVJZTYLODAF-SFHVURJKSA-N 386.883 2.691 0 50 GFAA COc1cc([C@H](C)N[C@@H]2CCCN(c3cccnc3)C2=O)cc(OC)c1OC 240540890 GPYSUEWPJNFKMS-WMLDXEAASA-N 385.464 2.954 0 50 GFAA Cc1cc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)ccc1-n1cncn1 173303546 DPKUEDUJBQCUEC-UHFFFAOYSA-N 395.507 2.877 0 50 GFAA CC[C@@H](CO)N1CCN([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 174132484 RWXHQIPMJGODST-LEWJYISDSA-N 385.483 2.894 0 50 GFAA C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)O[C@H]2CCCCC2=O)c1 242048072 VSMCVMYHPHOCNC-KSSFIOAISA-N 379.478 2.918 0 50 GFAA COC(=O)CCCC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71764950 KFFDHNPXUJLBDA-GOSISDBHSA-N 392.471 2.755 0 50 GFAA COc1cccc(-c2cc(NC(=O)[C@H]3COCCO3)n(-c3ccccc3)n2)c1 192506673 MLPHIOMCVFDSLL-LJQANCHMSA-N 379.416 2.902 0 50 GFAA CCS(=O)(=O)NC1CCN(C(=O)c2occc2-c2ccc(F)cc2)CC1 179124750 SFSKPXZCJNCHQP-UHFFFAOYSA-N 380.441 2.630 0 50 GFAA CCc1cnc(C)nc1N1CCC(c2nnc(Cn3cccn3)n2CC)CC1 96152482 QAAKVXHVOQLPQZ-UHFFFAOYSA-N 380.500 2.588 0 50 GFAA O=C(O)C[C@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1cccs1 238030070 SQDMSXZWHCWHDY-NSHDSACASA-N 380.857 2.738 0 50 GFAA O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCc2[nH]c(-c3ccccc3)nc2C1 95506115 CARPXOYCEGMWAJ-INIZCTEOSA-N 378.476 2.753 0 50 GFAA COc1cc(C(=O)NCCc2scnc2C)ccc1OC1CCN(C)CC1 95512020 QONZGLGENQLMST-UHFFFAOYSA-N 389.521 2.906 0 50 GFAA CNc1nc(C)cc(N[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)n1 92046413 WFSKGLNRCLHJSV-OAHLLOKOSA-N 383.500 2.579 0 50 GFAA COc1cc2c(cc1NC(=O)N1CCC[C@@H]1c1cc(C)on1)n(C)c(=O)n2C 96133165 ZRGOMNFUKBUKHV-CQSZACIVSA-N 385.424 2.551 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N1Cc2cnc(C(C)(C)C)nc2C1 97635011 MGCFEZWDLDTBRY-CQSZACIVSA-N 380.448 2.751 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC[C@@H](C(=O)N3CCOCC3)C2)CC1 91594448 ODICJQYCWSVWIN-OAQYLSRUSA-N 385.552 2.530 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CC[C@H](CN)C3)cc2Br)no1 299739457 OPWSRWSATKYCKX-GFCCVEGCSA-N 394.269 2.745 0 50 GFAA C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc(-c2ncn[nH]2)cc1 184239794 MNIKEJNTCJKYRX-ZDUSSCGKSA-N 384.461 2.708 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)N(C)CCC2CCOCC2)[C@H]1c1ccccc1 1940197633 DTBSFAFTYYMTMK-RTWAWAEBSA-N 388.508 2.639 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cnc(-c3ccccn3)nc2)C1)c1ccccn1 828184267 UEUVJGVZQOHIIG-KRWDZBQOSA-N 388.475 2.576 0 50 GFAA COc1cccc(-n2cc(CNC(=O)c3cnc(-c4ccccn4)nc3)cn2)c1 670435448 LIPKPOJYYQPHSD-UHFFFAOYSA-N 386.415 2.663 0 50 GFAA O=C(NC[C@H]1CCCN(S(=O)(=O)c2cccnc2)C1)c1sccc1Cl 952983716 VETSFLHZJYVDKI-GFCCVEGCSA-N 399.925 2.627 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@H]1CCOC[C@@H]1OCc1ccccc1 1565515381 NRJPHFRKVWNBIT-FPOVZHCZSA-N 379.460 2.917 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 170620888 FSXSADROSLCJJA-HHTDUIENSA-N 384.464 2.722 0 50 GFAA CCCC(=O)N1CCC[C@@H](C(=O)NC2(c3ccc(F)cc3)CCOCC2)C1 170950545 VLMGORXKEDOKNX-MRXNPFEDSA-N 376.472 2.986 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cc(O)nc(O)n2)C1)c1ccc2ccccc2c1 1506420197 YBKUYRAYTCVREW-HNNXBMFYSA-N 392.459 2.683 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cccc(O)c2Cl)cc1OC 1529100033 NCQHZSZDUWGBNA-UYAOXDASSA-N 393.867 2.997 0 50 GFAA CC(=O)N1C[C@@H]2CN(CCn3cc(Cl)cn3)C[C@@]2(CCc2ccccc2)C1 1772705381 HHYSOZAVDCTKGX-FPOVZHCZSA-N 386.927 2.950 0 50 GFAA CCOC(=O)N1CCN(c2ncc3c(n2)C[C@H](c2ccccc2F)CC3=O)CC1 5274275 CDARTEVXBKYJBZ-AWEZNQCLSA-N 398.438 2.807 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cccc(C(C)=O)c3)n2)cc1 5388949 LIJKRSONEDNPNC-UHFFFAOYSA-N 377.400 2.760 0 50 GFAA Cc1cccc(CC(=O)N2CC[C@]3(CCCN(Cc4cccnc4)C3=O)C2)c1 11843750 GWYBZJPURBHJEG-HSZRJFAPSA-N 377.488 2.974 0 50 GFAA Cc1oc(-c2ccc(F)cc2)nc1CN1CCC[C@@H](C(=O)N2CCOCC2)C1 12075325 MJSWGIUSMCULJR-QGZVFWFLSA-N 387.455 2.860 0 50 GFAA COc1ccc(OC)c([C@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccn2)c1 13522078 CSMCSKVSFBICLE-QGZVFWFLSA-N 384.461 2.530 0 50 GFAA CCNC(=O)c1cn([C@H](C)CC)cc(C(=O)NCc2ccc(F)cc2F)c1=O 14882900 VDNNTGZRCRTPRM-GFCCVEGCSA-N 391.418 2.777 0 50 GFAA CC(=O)N1CCC(C(=O)NCc2cccnc2N(C)Cc2ccccc2)CC1 19110848 HTYRXUKSNABOAN-UHFFFAOYSA-N 380.492 2.593 0 50 GFAA CN1CCN(C(=S)NC(=O)CCCOc2ccc(Cl)cc2Cl)CC1 19860645 DLUKYKCVPJKUTA-UHFFFAOYSA-N 390.336 2.801 0 50 GFAA CN1CCn2nc(C(=O)N[C@@H]3CC4(CCCC4)Oc4ccccc43)cc2C1=O 1857671892 VQTZYSSSJZPNES-MRXNPFEDSA-N 380.448 2.535 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)CCc3ccc4c(c3)OCO4)C[C@H]12 1857698413 QJCABPSPZOIGQH-MEOSDYHSSA-N 385.460 2.808 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)CCC(F)(F)F)cn1 1857729000 JBXPSJJMKBCOBF-RDJZCZTQSA-N 388.434 2.517 0 50 GFAA O=C([C@@H]1CCc2ncnn2C1)N1CCC(c2cc(Cc3ccccc3)[nH]n2)CC1 1857735556 RRIDZNGXQYJNSE-GOSISDBHSA-N 390.491 2.561 0 50 GFAA c1ccc(COc2cccc(CN3CCN4[C@@H](C5CC5)COC[C@H]4C3)c2)nc1 1875249416 RFMWQZQLTZBWNQ-FYYLOGMGSA-N 379.504 2.956 0 50 GFAA CCOc1ccc(S(=O)(=O)N[C@H]2CCN(C(=O)CC)C2)c2ccccc12 133213292 NUBRZCRMSWBBSV-AWEZNQCLSA-N 376.478 2.528 0 50 GFAA Cc1nc(Cn2cc(C(=O)N3CCC4(CC3)C3CC5CC(C3)CC4C5)nn2)no1 365368506 WWNPGGWBHWRMRU-UHFFFAOYSA-N 396.495 2.696 0 50 GFAA Cc1ccc(CN2CCO[C@H](CNc3ncnc4nc(N(C)C)sc34)C2)cc1 1875341405 RGPWZTHCDCVHQB-MRXNPFEDSA-N 398.536 2.774 0 50 GFAA CS[C@H](C)CC(=O)N1CC[C@]2(NC(=O)Cc3ccn(C(C)C)n3)CCC[C@H]12 1775991339 KYGMBCHJDWITNY-OXFYSEKESA-N 392.569 2.788 0 50 GFAA O=C1N[C@H](CC(=O)N2CCN(c3ccnc4ccccc34)CC2)c2ccccc21 897721969 PTKHYLQYPYGTME-HXUWFJFHSA-N 386.455 2.758 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CC[C@@](O)(c3cccc(C(F)(F)F)c3)C2)C1 2325889523 VBWZUBVQCOBWNJ-KUHUBIRLSA-N 396.409 2.550 0 50 GFAA COC(=O)COc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1Cl 810044 MKIVZJWNSVMOLB-UHFFFAOYSA-N 395.864 2.639 0 50 GFAA COc1ccc(NC(=O)CS[C@@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 1123199 HTCJIOQIQIHXCN-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1 1148565 PDFYPGMNZMDYPH-UHFFFAOYSA-N 395.868 2.703 0 50 GFAA COc1cccc2c1C1(CCN(Cc3noc([C@@H]4CCCO4)n3)CC1)OCC2 2356145661 HGWUPKQAECORLC-KRWDZBQOSA-N 385.464 2.994 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2ccc(OC)c(Cl)c2)C1=O 2356149895 YBNOEIMJGGCQHP-LJQANCHMSA-N 380.872 2.592 0 50 GFAA COc1ccc(N2C(=O)N(c3cccc(Cl)c3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4199469 PONLFMUXXVZTLB-SJORKVTESA-N 392.864 2.961 0 50 GFAA CCc1ccc(NC(=N)Nc2nc(CSc3ncccn3)cc(=O)[nH]2)cc1 9111456 ONSKSSKMZFBGNV-UHFFFAOYSA-N 381.465 2.873 0 50 GFAA C[C@@H](C(=O)Nc1ccccn1)n1c(=O)n(CC2CC2)c2ccc(C(=O)O)cc21 55575767 SIPDXWDYSGPKDB-LBPRGKRZSA-N 380.404 2.506 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)n1 67613119 OUWMJBXILOKZFT-UHFFFAOYSA-N 387.434 2.626 0 50 GFAA CSc1ccccc1NC(=O)CCC(=O)N1CCCN(C(=O)C2CC2)CC1 65488166 SXAULHCBAOIHPT-UHFFFAOYSA-N 389.521 2.598 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)CCc2ccc(C)cc2)CN1Cc1cccc(O)c1 11783906 WUUWPDKDVOPDES-CTNGQTDRSA-N 396.487 2.566 0 50 GFAA Cc1cc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)nc(N2CCCC2)n1 65365100 GBRUSVMQLITTJL-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1CCC(=O)N(Cc2ccccn2)C1 39420683 LHEBULKRBLTWAH-KRWDZBQOSA-N 390.487 2.969 0 50 GFAA CN1CCN(Cc2cccnc2)CC12CCN(C(=O)CCc1ccccc1)CC2 67769723 VAOWXGPLMRMCOG-UHFFFAOYSA-N 392.547 2.823 0 50 GFAA CCc1cccc(NC(=O)CNC(=O)NC[C@@H](CO)Cc2ccc(C)cc2)c1 252487235 HTIKVCUZYIPOIC-IBGZPJMESA-N 383.492 2.646 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cn(CC)nc2C)C[C@H]1CCO 39531534 MSRKDXAWDHBVRA-OAQYLSRUSA-N 386.540 2.679 0 50 GFAA C[C@@H]1CCC[C@@H]2CCCN(C(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)[C@@H]12 229639008 KNCPRYOJDOYNGA-BXWZSMHLSA-N 395.503 2.807 0 50 GFAA CCc1ncsc1C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1 328623177 IZOSNBYVIOVTIZ-WMLDXEAASA-N 375.542 2.984 0 50 GFAA O=C(c1cccc(C(F)(F)F)c1)N1CCc2c(ncnc2N2CCOCC2)C1 77342204 MNYAUECLJUTROU-UHFFFAOYSA-N 392.381 2.531 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cccc3cccnc23)c1 72127487 MQXITYMFCNYITJ-UHFFFAOYSA-N 386.429 2.525 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(Cc3ccoc3)CC2)C1 71730323 NXVAORJKCLSEJE-FQEVSTJZSA-N 382.508 2.667 0 50 GFAA O=C(NCC[S@](=O)Cc1ccccc1)NC[C@H](O)c1ccccc1Cl 127147983 OSBDLIQTKBCSCC-SSOJOUAXSA-N 380.897 2.622 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@@H]2[C@@H](CCC(=O)N2CCC2=CCCCC2)C1 72473426 CWYULABIYSWHRC-PKOBYXMFSA-N 386.496 2.651 0 50 GFAA CCc1nn(C)c(Cl)c1C(=O)NC[C@@H]1OCCN(CC)[C@H]1c1ccccc1 284777529 DWYHUWNGOKCDDU-WMZOPIPTSA-N 390.915 2.828 0 50 GFAA O=C(Cn1nc(-c2cccs2)ccc1=O)N1CCO[C@@H](c2ccccc2)C1 49549260 GZCCXZQRTNTNDH-QGZVFWFLSA-N 381.457 2.572 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CCN2CCC[C@@H]2CO)c2ccccc2)cc1 174867891 AGZXDBVEMYBRGB-CTNGQTDRSA-N 388.533 2.861 0 50 GFAA COc1cc(CN[C@@H]2CC(=O)N(C3CC3)C2)ccc1OCc1c(C)noc1C 174935156 YGWLHJCCDDWIPV-MRXNPFEDSA-N 385.464 2.732 0 50 GFAA CCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cc(Cn2cc(C)cn2)on1 132485752 UAUYDZQVOPDVOR-MRXNPFEDSA-N 382.420 2.530 0 50 GFAA Cn1nc(C(=O)N2CCC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)ccc1=O 177472566 MEZJJNQAJJKING-GFCCVEGCSA-N 382.247 2.771 0 50 GFAA Cc1cc(O)nc(CCNC(=O)N2CCC[C@H]2c2nc3cccc(C)c3[nH]2)n1 426507852 JUSNQERCQFFQHX-HNNXBMFYSA-N 380.452 2.765 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2ccc(-n3nc(C)c(Br)c3C)cc2)C1 179015903 VKQWVTRSMTUWKH-AWEZNQCLSA-N 391.313 2.933 0 50 GFAA O=C(NC[C@@H]1CC(=O)N(c2ccccc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1 426628713 DZXRCYBNALTUPH-AWEZNQCLSA-N 378.407 2.999 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91906748 MPTGEFQPHFSOBP-UHFFFAOYSA-N 380.492 2.806 0 50 GFAA CC(C)CN(CC(N)=O)C(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1 292909354 XHZVRMUHEGNUSH-UHFFFAOYSA-N 392.887 2.668 0 50 GFAA OC[C@H]1CN(Cc2sc3ccccc3c2Cl)C[C@H]1CN1CCOCC1 92107754 QSHGBZRSSOMLLO-HUUCEWRRSA-N 380.941 2.927 0 50 GFAA CN(C)C[C@H]1C[C@H](CO)CN(C(=O)c2ccc(N3CCCC3)c(Cl)c2)C1 91390745 OYALZMLQJYFBBF-CVEARBPZSA-N 379.932 2.572 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 92080504 NTIIGTXOIYDSMV-UHFFFAOYSA-N 395.507 2.651 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)c2cccc(-c3ncc[nH]3)c2)C1 95500023 YTKMRJJYSDJNHZ-SFHVURJKSA-N 379.464 2.939 0 50 GFAA C[C@@H]1CCc2ncc(F)cc2[C@H]2CCCN2c2ccn3ncc(c3n2)C(=O)N1 145815230 OEBIHOVSAMBXIB-SJKOYZFVSA-N 380.427 2.669 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)NCCC(=O)Nc2nccs2)cc1 97436950 ZNTPDYGQCGWJJY-GFCCVEGCSA-N 387.465 2.809 0 50 GFAA CC(C)O[C@H]1CN(C(=O)Nc2cccc(NC(=O)C3CCCC3)c2)C[C@@H]1O 95528079 GKQYCPVQGAWPPW-ROUUACIJSA-N 375.469 2.817 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)Nc2cc(N3CCOCC3)ccc2Cl)[nH]n1 97572367 FNMLAVLFDHQRLR-LBPRGKRZSA-N 377.876 2.961 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N(C)C[C@H]3CCCC[C@H]3O)CC2)cc1 182659951 ARMSKQVLFYZTLC-UYAOXDASSA-N 387.524 2.792 0 50 GFAA Cn1nc(C(F)(F)F)c2c(NC(=O)c3ccc(CN4CCCC4)o3)[nH]nc21 1940195199 OERTUQJGWDNXJM-UHFFFAOYSA-N 382.346 2.756 0 50 GFAA Cc1cnn(CC(=O)NCC2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 827863977 LCMNAULULPMGLW-UHFFFAOYSA-N 381.402 2.638 0 50 GFAA CC(C)N1CCC(NC(=O)[C@@H](C)SCC(=O)Nc2ccc(F)cc2)CC1 170120586 XZRRTMSHZRQGLG-CQSZACIVSA-N 381.517 2.875 0 50 GFAA CN(CC(=O)N1CCN(c2cncc3ccccc23)CC1)C(=O)c1cccs1 190397422 XDCTWMJMDUSJII-UHFFFAOYSA-N 394.500 2.717 0 50 GFAA Cn1ccnc1CN1CCC(CCC(=O)Nc2ccc3c(c2)OCCO3)CC1 11664470 LYAUMSAZQCBNIP-UHFFFAOYSA-N 384.480 2.822 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)[C@@H]2CCCCO2)CC1 11754036 ZKYPCOMDGYSFOR-NRFANRHFSA-N 394.519 2.902 0 50 GFAA COc1ccc(CC2=NO[C@H](C(=O)NCC[C@H]3COc4ccccc4O3)C2)cc1 11998510 LGRPCQFRFNZSII-RXVVDRJESA-N 396.443 2.729 0 50 GFAA O=C(NC(=S)Nc1ccc(C(=O)N2CCOCC2)cc1)C1CCCCC1 12405993 SESUQLSEZZWZLQ-UHFFFAOYSA-N 375.494 2.552 0 50 GFAA CSc1ccccc1C(=O)[C@@H]1CCCN(C(=O)CSc2nncn2C)C1 12430445 LZGXKCZPTZDYFE-CYBMUJFWSA-N 390.534 2.751 0 50 GFAA CC(C)OCC(=O)N1CCC[C@@H]1c1ccc(C(=O)N2CCCOCC2)s1 19113480 XMWHFBYZKMHYKY-OAHLLOKOSA-N 380.510 2.699 0 50 GFAA CC[C@@]1(C(=O)O)C[C@@H]2CC[C@H]1N2C(=O)CCCc1nc(-c2cccnc2)no1 1857670088 POOFBGXQUREUKE-BXTJHSDWSA-N 384.436 2.699 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccccc3NCc3cccs3)CC2)OCCN1 1857694672 UFKSFRRJEKCRDV-UHFFFAOYSA-N 399.516 2.872 0 50 GFAA O=C(NCc1cc(-c2ccccc2Cl)on1)[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857718873 XNFAGMLPLIWAKM-JCURWCKSSA-N 375.856 2.768 0 50 GFAA O=C(CCn1cc(Cl)cn1)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 247791536 OJJKYHKNPNVQIW-CJNGLKHVSA-N 379.917 2.506 0 50 GFAA O[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1NCc1ccc(OCc2cccnc2)cc1 1875399573 DBQXIGRHOAEANO-KSEOMHKRSA-N 378.476 2.786 0 50 GFAA CC(=O)N1CC(C(=O)N2CC3(CCN(CC4CC(C)(C)C4)CC3)C[C@H]2C)C1 1875331282 CFTINFVHKKTFNE-MRXNPFEDSA-N 375.557 2.604 0 50 GFAA Cc1ccc(C)c(-n2c(=O)c(NC(=O)N=c3[nH][nH]c4c3CCCC4)c(C)n2C)c1 1875301705 QPVCDWMZRWVEHT-UHFFFAOYSA-N 394.479 2.769 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2cnco2)cc1 1875401570 LLOFDTYFOQRVFV-NVXWUHKLSA-N 379.420 2.789 0 50 GFAA N[C@H]1CCc2cc(C(=O)N3CCC(F)(F)[C@H](C(F)(F)F)C3)ccc2NC1=O 2325774965 LOCBDMKQNCEPCE-WCQYABFASA-N 391.340 2.558 0 50 GFAA NC[C@H](CC(=O)N=c1cc2n([nH]1)CCCC2)c1ccc(Br)s1 2325795708 UQIBMWHIUCVBTD-JTQLQIEISA-N 383.315 2.536 0 50 GFAA O=C(N[C@H]1COc2ccccc2[C@@H]1O)N[C@@H]1C[C@H]1c1ccccc1OC(F)F 2325814927 BNGRTOFZIXMKER-KRXQYRFLSA-N 390.386 2.938 0 50 GFAA Cc1cc(S(=O)(=O)N2Cc3c(Br)cccc3C[C@@H]2C)c[nH]c1=N 2325862356 QYZKNFIXJABGKE-NSHDSACASA-N 396.310 2.701 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)c1ccc(I)cc1 626843 OOANVWCUSDXJGA-UHFFFAOYSA-N 390.180 2.884 0 50 GFAA COc1ccc(-c2cc(=O)oc3cc(OCC(=O)N4CCOCC4)ccc23)cc1 793099 LBFHNOBSVDXIDN-UHFFFAOYSA-N 395.411 2.706 0 50 GFAA biogenic COC(=O)CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(OC)c(OC)c1 2874511 MQRMOEAXFDQLKN-UHFFFAOYSA-N 399.852 2.726 0 50 GFAA CCn1c(SCC(=O)Nc2nnc(C)s2)nnc1-c1ccccc1F 4519835 NOZMSZPRCPUSGP-UHFFFAOYSA-N 378.458 2.995 0 50 GFAA CO[C@]1(C)CCCN(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)C1 417481690 OZBBTAGUQLIIHM-GOSISDBHSA-N 383.514 2.796 0 50 GFAA O=C1C[C@H](N2CCN(Cc3ccccc3)CC2)C(=O)N1c1ccc(Cl)cc1 100308854 FERSUGIDTMEMBO-IBGZPJMESA-N 383.879 2.790 0 50 GFAA CC(C)C(=O)N1CCC(NC(=O)c2coc(COc3cccc(F)c3)n2)CC1 67821267 JLTCVHMZCSIMJD-UHFFFAOYSA-N 389.427 2.770 0 50 GFAA CC(C)N1CCO[C@@H](CN2CCN(C(=O)Nc3cc(Cl)ccc3F)CC2)C1 117437920 CLAKWCLLFXFNJL-INIZCTEOSA-N 398.910 2.738 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4cccc(F)c4)CC3)ncn2)n1 65361826 SHFAHHZDRAHARB-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA COc1cc(CNC(=O)COCC(F)(F)F)ccc1OCC(F)(F)F 122611945 UQNQEACMGWZDDD-UHFFFAOYSA-N 375.265 2.831 0 50 GFAA O=C(c1cnn2c(C(F)F)cc(-c3ccc(F)cc3)nc12)N1CCOCC1 2778770 LJSCYSJNHOXDGW-UHFFFAOYSA-N 376.338 2.945 0 50 GFAA COC(=O)c1sc(NC(=O)[C@H](C)n2ncc(Br)c2C)nc1C 2802370 CNDFSKJLPBGSDE-QMMMGPOBSA-N 387.259 2.705 0 50 GFAA O=C(C[C@@H]1CCCN1C(=O)CN1C(=O)c2ccccc2C1=O)c1cccs1 122709371 PFESCZDMIIQJQD-ZDUSSCGKSA-N 382.441 2.608 0 50 GFAA COc1ccccc1[C@H]1CCN(C(=O)c2ccccc2OCC(=O)N(C)C)C1 153153950 NMHYZUKVHWATNB-INIZCTEOSA-N 382.460 2.792 0 50 GFAA O=C(O)CCN(Cc1cccc(F)c1F)C(=O)Cc1ccc2c(c1)OCCO2 486003071 HULDQEBDMXRFBC-UHFFFAOYSA-N 391.370 2.782 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CCc2c(nc(-c3ccccc3)[nH]c2=O)C1 72171689 QWWAKMCWJYEZRP-UHFFFAOYSA-N 375.428 2.660 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1CCC[C@@H](c2ccn[nH]2)C1 77300207 ZJXSYVNCZZMBAF-CQSZACIVSA-N 384.465 2.743 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)n1 237216370 GJVURGJHOSUDDE-IBGZPJMESA-N 391.427 2.841 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)CN1CCc3cccc(F)c3C1)CC2 158114467 YXIDGWLMIWUPLX-UHFFFAOYSA-N 384.451 2.786 0 50 GFAA CC(C)n1nccc1[C@@H]1OCCC[C@H]1c1nc(CC(=O)NCc2ccco2)no1 377465224 WXVZDQORLLUOGO-DNVCBOLYSA-N 399.451 2.934 0 50 GFAA C[C@@]1(C(=O)N2CCN(C3c4ccccc4-c4ccccc43)CC2)CCC(=O)NC1 282571218 BTENNRCYJSJTCO-XMMPIXPASA-N 389.499 2.817 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1CC[C@@H](C)[C@H](n2ccnc2)C1)c1ccc2c(c1)OCCO2 245559326 BNDDBLWYCSSWKF-VUHPKUFZSA-N 398.507 2.803 0 50 GFAA O=C(c1ccc(COc2ccc(F)cc2)o1)N1CCN(C[C@H]2CCOC2)CC1 178113220 NIJVVGBUTCBTCR-MRXNPFEDSA-N 388.439 2.792 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccc(-n2cnnn2)cc1)c1nc2ccccc2n1C 223216075 XQCJEVNDXCTFKG-GOSISDBHSA-N 375.436 2.676 0 50 GFAA CCn1ncc2c(C(=O)N[C@@H]3CCCC[C@@H]3C(N)=O)cc(-c3ccccc3)nc21 177705795 CJXAOZXXPBTMBU-MAUKXSAKSA-N 391.475 2.892 0 50 GFAA CC(C)SCC(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 95512184 SHNVBVFFZKKDPL-UHFFFAOYSA-N 390.553 2.554 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4cccnc4)C3)CC2)o1 95358216 QWSMVKAIEHLIPF-UHFFFAOYSA-N 397.475 2.771 0 50 GFAA O=C1CCC2(CCN(CCn3cc(Cl)cn3)CC2)CN1Cc1ccccn1 91304459 UCMREDGKMNLBJL-UHFFFAOYSA-N 387.915 2.836 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](NC(=O)C2CCCCC2)CN1Cc1ccsc1 96131034 HDPMBAKLLBPXCK-MSOLQXFVSA-N 377.554 2.912 0 50 GFAA C[C@]1(c2ccccc2)CCCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)C1 92062346 KJEDYNAMDRKRBM-FQEVSTJZSA-N 386.473 2.760 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(NC(=O)[C@@H]3C[C@H]3C)c2)c1 298467539 YOXFJKBQUWGPIT-KZULUSFZSA-N 376.420 2.818 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)NCC(=O)N1CCCC1 299776892 MUOVQIXUPXIQBK-UHFFFAOYSA-N 375.860 2.637 0 50 GFAA CS(=O)(=O)N1CCC[C@H](c2nnc3sc(-c4cccc(Cl)c4)nn23)C1 825591165 UFLUVGVSLPISQT-NSHDSACASA-N 397.913 2.645 0 50 GFAA Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)NCCN=c1cc[nH]cc1C)O2 825253757 XXCUWZKSMLUHAO-JOCHJYFZSA-N 383.492 2.755 0 50 GFAA Cc1cc2c(cc1CN1CCN(c3nnc(C(F)(F)F)s3)CC1)OCO2 825151074 HEUONEMFXBIKDR-UHFFFAOYSA-N 386.399 2.916 0 50 GFAA CN(Cc1noc(C2CC2)n1)C(=O)N[C@@H]1CCCN(Cc2ccccc2F)C1 584886933 WNUMDPSBZNERNW-MRXNPFEDSA-N 387.459 2.892 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C2CCN(C(=O)c3ccccn3)CC2)C1 952860167 GZVQWPAZXFBFMV-KRWDZBQOSA-N 378.476 2.676 0 50 GFAA Nc1nc(N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cc(-n2cccn2)n1 302512545 XNAJCACXOKWTLW-GFCCVEGCSA-N 389.385 2.954 0 50 GFAA CC1(C)CC[C@@H](CNC(=O)[C@@H]2CC(=O)N(c3ccccc3Br)C2)O1 170601112 AYLPSYWXTNUJLI-OLZOCXBDSA-N 395.297 2.876 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)N1CCOCC2(CCOCC2)C1 189685962 OYZHCZLPXNZCSV-UHFFFAOYSA-N 391.418 2.728 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCc2csc(-c3ccccc3)n2)C1 1506396742 FWYXHKTZHIRINV-CQSZACIVSA-N 381.523 2.503 0 50 GFAA Fc1cnc(N[C@H]2CCCN(Cc3cccs3)C2)nc1N1CCOCC1 1529138845 ISJOPHARCFBVGW-AWEZNQCLSA-N 377.489 2.590 0 50 GFAA NC(=O)c1ccc(NC(=O)CN2CCCC[C@@H]2CCc2cccc(O)c2)cc1 1529112239 HDRBPRPOCSWBNZ-LJQANCHMSA-N 381.476 2.917 0 50 GFAA Cc1[nH]nc(CCC(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1C 1704325444 MWZMENXITPNGBN-DYESRHJHSA-N 378.476 2.569 0 50 GFAA OC[C@@]12CN(Cc3cc[nH]n3)C[C@H]1CN(Cc1ccc(-c3ccccc3F)o1)C2 1772701673 ORTVFXOJZYLEJM-AOMKIAJQSA-N 396.466 2.735 0 50 GFAA COc1cccc(CN2C[C@@H]3CN(C(=O)CN)C[C@]3(CCc3ccccc3)C2)c1 1772806585 BQYONTHBXZJGPV-QPPBQGQZSA-N 393.531 2.547 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)c1ccccc1C(F)(F)F 19924274 TXQMBNBBEVHENS-UHFFFAOYSA-N 376.342 2.523 0 50 GFAA O=C(COc1ccccc1)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772346 XLCOWIGFFPCMLD-UHFFFAOYSA-N 380.370 2.659 0 50 GFAA CC[C@H](C(=O)NCc1nnc2c(-c3nc(C)no3)cccn12)c1ccccc1 169775977 YHPKDAMEBSYKQK-HNNXBMFYSA-N 376.420 2.898 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857700279 QHLXDHVBGDOQTE-UHFFFAOYSA-N 391.475 2.749 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(c3ccc(Cl)c(C)n3)C[C@]23CC[C@H]1O3 1857737470 NPDIPMQANVLMPY-YRWGSWDYSA-N 381.929 2.506 0 50 GFAA NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)c2cc(Cl)cc(F)c2N)c1 241213425 KORCZCLSUOPCDE-MRXNPFEDSA-N 390.846 2.763 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)c2cccc(NS(=O)(=O)C3CC3)c2)no1 1875280520 RMPLMROTHRETQE-QGZVFWFLSA-N 375.450 2.864 0 50 GFAA C[C@H]1CN(C(=O)c2cccc3nc[nH]c23)CC[C@@H]1NC(=O)c1ncc(F)cc1F 1875338976 RWJYOVLIONYAMR-NHYWBVRUSA-N 399.401 2.517 0 50 GFAA COCCn1c([C@H]2C[C@H]2C)nnc1N1CCN(c2ncc(C)c(C(C)C)n2)CC1 2325769231 ZJBNVMYPKLFKTA-WBVHZDCISA-N 399.543 2.596 0 50 GFAA Cn1nncc1-c1ccc(C(=O)N2CCC(c3ccccc3CN)CC2)cc1 2325789466 RPGBZLPFCUFVLN-UHFFFAOYSA-N 375.476 2.961 0 50 GFAA CCC[C@@H](OC)C(=O)NC1(C)CCN(C(=O)CC[C@@H]2CC(C)(C)CO2)CC1 2325793684 DHUKGPOINKRWCP-IAGOWNOFSA-N 382.545 2.894 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC2CC2)CC[C@H]1NS(=O)(=O)c1cccc(C)c1 2356146588 MNXCOIVKWUDKCV-KFKAGJAMSA-N 394.537 2.516 0 50 GFAA CCC[C@@]1(CO)CN(Cc2ccc(-c3ccc4c(c3)C(=O)OC4)o2)CC[C@@H]1O 2356158329 YFUVAAPOQUMRPG-UNMCSNQZSA-N 385.460 2.962 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O 4701862 CYGKZWGEWRROBQ-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(N(C)C[C@@H]4COCCO4)CC3)cc2)n1 23541232 YMZNFWHXOFAYOR-JOCHJYFZSA-N 384.524 2.805 0 50 GFAA O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N1CCOC2(CCCCCC2)C1 120233965 SDUJBDBITOHVPU-CALCHBBNSA-N 376.497 2.504 0 50 GFAA Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)CCNC(=O)CC(C)C 151260295 KJNAPOAVXYJIEU-UHFFFAOYSA-N 387.402 2.778 0 50 GFAA Cc1ccc(CCNC[C@@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)o1 67540400 WHEXGHKSJRPRBC-FQEVSTJZSA-N 378.419 2.552 0 50 GFAA CCN1CCC[C@@H](CN(C)Cc2ccc(C(=O)NC)cc2)[C@@H]1c1cnn(C)c1 328637741 OTRULGPFCAQHSN-PZJWPPBQSA-N 383.540 2.685 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@H]1CCCN(C(=O)c2cc3c(cc2O)CCCC3)C1 328603969 HXNVDSGVGKVWOH-INIZCTEOSA-N 396.491 2.716 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2cccc3c2O[C@H](C)C(=O)N3)CC1 363344429 CXLASUKNHDPMMQ-CQSZACIVSA-N 395.459 2.813 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCCCCN)CCC(=O)N1Cc1ccc(F)cc1 72121857 ANLJPKKVDRFLNQ-LJQANCHMSA-N 377.504 2.930 0 50 GFAA COc1ccc(CN2CC[C@@H](NC(=O)Cc3c[nH]c4c(C)cccc34)C2=O)cc1 172849523 KWYZKBSUNBNGIG-HXUWFJFHSA-N 391.471 2.945 0 50 GFAA CN1CCN(CCOc2ccccc2CN2CC(Oc3ccccc3)C2)CC1 215982309 ZBNJYCPECLRYPA-UHFFFAOYSA-N 381.520 2.576 0 50 GFAA COc1cccc(CN2CCO[C@@H](C(F)(F)F)C2)c1OCCn1ccnc1 71751454 LXQDBNCPPPGTCX-MRXNPFEDSA-N 385.386 2.734 0 50 GFAA O=C(Nc1ccc(SC(F)F)nc1)C(=O)N1CCO[C@@]2(C[C@H]3CC[C@H]2C3)C1 370169521 ACDZZTWLPPFDAP-PZROIBLQSA-N 397.447 2.752 0 50 GFAA CC[C@@H](O)C(=O)Nc1nn(-c2ccc(F)cc2)c2cccc(N3CCOCC3)c12 77520950 FGHHDJASLYFNFD-GOSISDBHSA-N 398.438 2.711 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@@H](Nc3ccc(OC)cc3)C2)c(=O)n1C 72144438 COBMDDQISYXCAS-QGZVFWFLSA-N 383.492 2.981 0 50 GFAA Cc1oc(C(=O)NCC2(c3ccccc3)CCC2)cc1S(=O)(=O)N(C)C 176521868 FGLKUNYUSOQOGS-UHFFFAOYSA-N 376.478 2.690 0 50 GFAA CCOc1ccccc1CN1CCN(C(=O)c2cnc(C3CC3)nc2N)[C@@H](C)C1 288040468 DSFLGKOPAUTCOD-HNNXBMFYSA-N 395.507 2.681 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N(C)Cc1nnc(-c2ccccc2)o1 426547565 FNMWTPUPFCYDKY-OAHLLOKOSA-N 392.415 2.830 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cc(=O)[nH]c3cc(F)ccc13)C2 95525345 DOEADMGTFHJPFV-LBPRGKRZSA-N 382.391 2.657 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)c(C)n1 95374466 HNGILMUOCKWMDM-PWRODBHTSA-N 380.467 2.935 0 50 GFAA Cc1nc(CNC(=O)N2CCC[C@@H](c3nc(-c4cccnc4)no3)C2)cs1 426413070 YDTNQHYLKLPCEA-CQSZACIVSA-N 384.465 2.986 0 50 GFAA Cc1cccc(=O)n1CCc1nc(CC2CC2)nn1-c1ccccc1C(=O)O 96149437 ASZRNDVDMYKHLF-UHFFFAOYSA-N 378.432 2.631 0 50 GFAA CCn1nnc(-c2cccc(NC(=O)NCCCNc3ccc(C)cn3)c2)n1 96132662 MZRDYYXEAXFFJJ-UHFFFAOYSA-N 380.456 2.687 0 50 GFAA CSCC[C@H](O)C(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1 294983004 NYXYBFPDKHAGJB-KRWDZBQOSA-N 395.502 2.935 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@H]1C[C@H](c2cc(O)ncn2)C1 253535258 JGFMRUMQZUCXNV-WKILWMFISA-N 377.448 2.590 0 50 GFAA COC(=O)c1c(NC(=O)[C@@H]2CCCO2)c2cc(N)cnc2n1Cc1ccccc1 299798497 QCSZEIZZZWLFCV-INIZCTEOSA-N 394.431 2.571 0 50 GFAA O=C(NCCSc1cnn[nH]1)Nc1ccc(OC[C@H]2CCCCO2)cc1 299762894 WIXFUUUXZRLIEF-OAHLLOKOSA-N 377.470 2.666 0 50 GFAA Cn1c(=O)n(C)c2cc(NC(=O)N3CCCC[C@@H]3CCn3ccnc3)ccc21 299799940 XSRXFBQLYFBDJJ-MRXNPFEDSA-N 382.468 2.550 0 50 GFAA Cc1cccc(F)c1C(=O)NCC1CCN(Cc2cnn3cccnc23)CC1 828133643 HEFAOYGMGKCGRH-UHFFFAOYSA-N 381.455 2.819 0 50 GFAA COc1cccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)c1C 1565514015 ZEZPPGSCVYYCCK-AEFFLSMTSA-N 379.460 2.775 0 50 GFAA Cc1cc([C@](C)(O)CNC(=O)c2cc(Br)cnc2N(C)C)c(C)o1 170004102 RZDKVRDKOFOPCR-QGZVFWFLSA-N 396.285 2.757 0 50 GFAA NC(=O)c1cccc2c1CCCN2C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 170996963 PEQNQMRPIILCHK-QGZVFWFLSA-N 391.471 2.617 0 50 GFAA O[C@H](CC1CCCC1)CN1CCN(Cc2nc(-c3cccs3)no2)CC1 190370922 GUMJZHGNMMQCPY-MRXNPFEDSA-N 376.526 2.857 0 50 GFAA O=C([C@H]1CCOC1)N1CCCN(CC2=Cc3cc(Cl)ccc3OC2)CC1 1529119346 UZNKOVJNLGNIFI-INIZCTEOSA-N 376.884 2.687 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2C[C@H]3CCC[C@](O)(c4ccccc4)[C@H]3C2)c1 1704335563 BKIRROIWGBDFHK-AGHHOFFYSA-N 399.512 2.850 0 50 GFAA O=C(c1cccnc1N1CCC[C@H](c2nnc3ccccn23)C1)N1CCCC1 1704298787 NVLQFAHHQIDFOY-INIZCTEOSA-N 376.464 2.744 0 50 GFAA CN(Cc1ccccc1)C(=O)CCC1CCN(C(=O)c2cc[n+]([O-])cc2)CC1 11932964 MIMNLKGUPUKSPE-UHFFFAOYSA-N 381.476 2.611 0 50 GFAA CCOC(=O)C1CCN(C(=O)c2coc(COc3cccc(F)c3)n2)CC1 12057616 ZCUDFOXTPVNDOI-UHFFFAOYSA-N 376.384 2.808 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)C1 12594040 VHSPHHBISFMVBT-HSZRJFAPSA-N 391.559 2.861 0 50 GFAA Cc1cc(N)n(CC(=O)N[C@@H]2CCCN(Cc3ccc(CC(C)C)cc3)C2)n1 15065166 QUVXVEAQIAJSGU-HXUWFJFHSA-N 383.540 2.753 0 50 GFAA COc1cc(CN2CCC[C@H](CCC(=O)N3CCN(C)CC3)C2)ccc1F 15074784 XQHIILYAFGYIGV-QGZVFWFLSA-N 377.504 2.601 0 50 GFAA O=C(Cn1ccn2nc3c(c2c1=O)CCCCC3)NCc1ccc(Cl)cc1 169769463 IIMAXWBDGCVPPX-UHFFFAOYSA-N 384.867 2.735 0 50 GFAA CN1CCn2nc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2C1=O 1857670336 IMDBGCUWBPEQIH-AWEZNQCLSA-N 381.461 2.556 0 50 GFAA Cc1ccc(C)c(-c2n[nH]cc2CN2CCCN(C(=O)c3ccnn3C)CC2)c1 1857697899 AQGQXINFRXWJAE-UHFFFAOYSA-N 392.507 2.775 0 50 GFAA C[C@H]1CN(C[C@H](O)C2CCN(c3nc4ccccc4s3)CC2)C[C@@H](C)O1 1857708712 JBLGHSHZNLJKDI-DAYGRLMNSA-N 375.538 2.983 0 50 GFAA COc1ccc(C)cc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857728274 USXAKZAOFKOWLF-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA COc1cc(OC)c2nc(N3C[C@H](O)[C@H](Cc4cc(C)[nH]n4)C3)cc(C)c2c1 1875246115 YZMUQROLBYIBSW-KDOFPFPSSA-N 382.464 2.632 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2nc(C)cc(N3CCCCC3)n2)CC1 17012612 LHRTXOFDVJUVPD-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA O=C1NC[C@@H]2[C@H]1CCCN2C(=O)c1cn(-c2ccccc2)nc1-c1cccs1 366843702 GEDMRGGEURWJGU-NVXWUHKLSA-N 392.484 2.951 0 50 GFAA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)[C@H]1CCCN(Cc2ccccc2)C1 263823963 RBVNNIJMWKZORB-MSOLQXFVSA-N 383.458 2.899 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)COc3cccc(F)c3)C1)CC2 1704302595 AVSRYXQCBDQVSO-OAQYLSRUSA-N 384.455 2.567 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N2CCC[C@H]2c2nc(C(=O)O)cs2)c1 910116485 ZATKUDVILXGXOC-HNNXBMFYSA-N 387.461 2.958 0 50 GFAA Cc1nc(CN)sc1C(=O)N1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 1875301708 QUEHGKJCXMWWTH-QWHCGFSZSA-N 385.411 2.877 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)N2[C@@H](C)CC[C@H]2C)CC[C@@H]1NC(=O)c1cc[nH]n1 2100483353 NKTVGPVGXRAZLZ-IWSXDTNSSA-N 376.501 2.503 0 50 GFAA COC(=O)c1nc(-c2ccc(C)cc2)oc1S(=O)(=O)N1CCC(C)CC1 1857798991 ISUMQQYWNHRDGM-UHFFFAOYSA-N 378.450 2.857 0 50 GFAA O=C(NCc1nc([C@H]2CC(=O)N(Cc3ccccc3)C2)no1)NC1CCCCC1 274091798 UKCDYLGCDGLESV-INIZCTEOSA-N 397.479 2.718 0 50 GFAA C[C@@H]1CC2(CN1)CC(C(=O)N=c1ccn(Cc3cccc4cccnc34)[nH]1)C2 2325788826 JOCAGXVGNWZVES-MFPRGYPFSA-N 375.476 2.618 0 50 GFAA Cn1cc(N2C[C@@H](Nc3ccnc4cc(Br)ccc34)CC2=O)cn1 2325857309 WWJRCRCKPZRZGY-LBPRGKRZSA-N 386.253 2.948 0 50 GFAA O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1 840867 YSPCUNUKFKKKEW-UHFFFAOYSA-N 380.491 2.662 0 50 GFAA COc1cc(-c2ccc(C(=O)N3CCC(n4cnnc4)CC3)cc2)c(=N)[nH]c1C 2356138235 JETVDULDIATJGP-UHFFFAOYSA-N 392.463 2.547 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CC(c2ccccn2)C1 2356153083 QKHAARIPYNNMTP-UHFFFAOYSA-N 375.428 2.599 0 50 GFAA COc1ccc(CCNC(=O)C(=O)NCc2ccc(C(C)C)cc2)cc1OC 3005709 VAKDCLHBTCOOBU-UHFFFAOYSA-N 384.476 2.802 0 50 GFAA O=C(N1CCO[C@@H](c2nn[nH]n2)C1)C1(c2ccc(Cl)c(Cl)c2)CCCC1 2356160208 INRZNYQZRCHVJW-CQSZACIVSA-N 396.278 2.918 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@H]1c1cccc(Cl)c1 4108445 QRUWDFCYKJYGTR-MKSNKDDYSA-N 382.840 2.506 0 50 GFAA O=C([C@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(c2ccc(F)cc2)CC1 4731987 SKECCASNAMENPB-HNNXBMFYSA-N 385.414 2.667 0 50 GFAA COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)COc2ccc(C)cc2)c1 6700979 AYOHEJLRHFBCLB-UHFFFAOYSA-N 397.475 2.551 0 50 GFAA CC[C@H](C)NC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613226 RXHBHVDHWKQFJG-LBPRGKRZSA-N 390.908 2.936 0 50 GFAA Cc1cccc(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1C 100618908 YFQKHRGODYOBGO-IBGZPJMESA-N 379.460 2.884 0 50 GFAA C[C@@H](C(=O)NCc1ccc(F)cc1)N1CCC(CN2CCCCC2=O)CC1 118851953 SFGLMQODRKUGHF-INIZCTEOSA-N 375.488 2.555 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)NC(=O)C[C@H]2c1ccc(O)cc1Cl 65372110 PQPIXLCZANNVGE-NSHDSACASA-N 396.852 2.900 0 50 GFAA CN(C)[C@@H](CNC(=O)N1CCN(c2nc3ccccc3o2)CC1)c1ccco1 172514430 LQCZHFXCFNCROL-INIZCTEOSA-N 383.452 2.555 0 50 GFAA C[C@H]1c2cccn2CCN1C(=O)/C=C/C=C/C(=O)N1CCn2cccc2[C@H]1C 281176754 NLDLPYVWGSRQKZ-JAOADGGPSA-N 378.476 2.909 0 50 GFAA CS(=O)(=O)c1cnc(COc2cccc(Cl)c2)nc1[C@@H]1CCCNC1 71770892 RXXZUHDQECAEML-GFCCVEGCSA-N 381.885 2.580 0 50 GFAA COCCc1noc(-c2ccc(N3CCC(O)(c4ccc(F)cc4)CC3)nc2)n1 72410955 ZOTSRBNXOHQKHC-UHFFFAOYSA-N 398.438 2.948 0 50 GFAA COc1cccc([C@H]2C[C@@H](O)CN2C(=O)NCc2ccc3c(c2)OCCCO3)c1 282117261 GBODIUOQNHDLKX-IEBWSBKVSA-N 398.459 2.874 0 50 GFAA CCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1ccc(OC2CCCC2)cc1 157086444 ZSMUPTCGJRJPKW-KRWDZBQOSA-N 390.509 2.975 0 50 GFAA O=C(N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1cn(C2CCNCC2)nn1 238131668 VQSXYOBZVUJBEZ-QGZVFWFLSA-N 381.480 2.769 0 50 GFAA COc1ccccc1[C@H]1CCN(CC(=O)Nc2cccc(C(=O)N(C)C)c2)C1 158100336 BIUQOVGHKLSHQV-KRWDZBQOSA-N 381.476 2.825 0 50 GFAA COCCn1nc(C(=O)N2CCC3(CC2)C2CC4CC(C2)CC3C4)ccc1=O 376072018 UWIZZPJNGCLSDP-UHFFFAOYSA-N 385.508 2.568 0 50 GFAA CN(C)CCN(C)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71745789 RUKUPFXMAJFXJX-HSZRJFAPSA-N 379.504 2.554 0 50 GFAA COc1ccc(NC(=O)N[C@@H]2COc3c(C)cccc3C2)c(S(C)(=O)=O)c1 455955298 WKKTVCDKJAGJEZ-AWEZNQCLSA-N 390.461 2.532 0 50 GFAA CCc1nc(NC(=O)NC[C@H]2CCCN2c2cc(NC)ncn2)sc1C 174354053 QISQNWCEDKKQQV-GFCCVEGCSA-N 375.502 2.636 0 50 GFAA O=C(c1nn(-c2ccc(Cl)cc2)cc1O)N1CCN(Cc2cccnc2)CC1 176998738 SLJPEIIVZCREJZ-UHFFFAOYSA-N 397.866 2.584 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1ccccn1)C1(N2CCCCC2)CCCCC1 220394131 VJRQLLISRZBSNJ-RTBURBONSA-N 387.524 2.923 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@H](c3ccccc3F)N(C)C)CC2)cs1 95355845 HJUWEDUHYOLLDQ-SFHVURJKSA-N 376.501 2.538 0 50 GFAA c1cnc(N2CCC(N3CCN([C@@H]4CCc5ccccc5C4)CC3)CC2)nc1 95519284 JZQHXKMCTUOGES-JOCHJYFZSA-N 377.536 2.621 0 50 GFAA Cc1ccc2cccc(OCCNC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)c2n1 91656906 SBNVXLXJNNGHQX-QGZVFWFLSA-N 381.476 2.829 0 50 GFAA O=C(Nc1ccccc1F)c1cccc(S(=O)(=O)N[C@@H]2CCCOC2)c1 95390815 TVEPAOYYIVQVQH-CQSZACIVSA-N 378.425 2.535 0 50 GFAA Cc1cnn(CCCN2CCC[C@]3(CCC(=O)N(Cc4ccccn4)C3)C2)c1 92062385 QZTSADCIRADIPA-QFIPXVFZSA-N 381.524 2.881 0 50 GFAA Cc1cc(NC(=O)N2CCNC(=O)[C@@H]2Cc2ccccc2)n(C2CCCC2)n1 96166872 DRAXXVRTZMJSNV-SFHVURJKSA-N 381.480 2.882 0 50 GFAA CCCCn1nc(C2CCOCC2)nc1CCc1c(C)nc2ncnn2c1C 96141085 UKHAWFWBDJPDQN-UHFFFAOYSA-N 383.500 2.812 0 50 GFAA COc1cc(-c2ccccc2)ccc1CN[C@@H]1CCN(c2cnn(C)c2)C1=O 183060821 CCRFIUNIDRNWGG-HXUWFJFHSA-N 376.460 2.991 0 50 GFAA CCC[C@@H](NC(=O)c1cc(C(=O)O)co1)C(=O)N1CCc2sccc2C1 183780510 KJAPIQIAYZVRGE-CYBMUJFWSA-N 376.434 2.523 0 50 GFAA CCn1c(CCNC(=O)N2CCN(c3cccnc3)CC2)nc2ccccc21 534629936 IVPFACDEWSVUDH-UHFFFAOYSA-N 378.480 2.526 0 50 GFAA CN(C)c1ccc(CC(=O)N2C[C@@H]3CC[C@H]2CN(Cc2cccnc2)C3)cc1 1565512292 DMQZNJGZTMFJHD-IRLDBZIGSA-N 378.520 2.813 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@H](CNC(=O)Cc3c[nH]c4ccccc34)C2)o1 952978709 BWUZYJYVHQKPAG-MRXNPFEDSA-N 394.475 2.984 0 50 GFAA COc1ccc([C@H]2CCCN2C(=O)c2cc3c(O)ncnc3cn2)cc1OC 275093718 CUDQZYDNVCSYSD-MRXNPFEDSA-N 380.404 2.725 0 50 GFAA O=C(CCCn1cncn1)N1CC[C@@]2(CCCN(CCc3ccccc3)C2)C1 12023276 WMVIYFIJEOCHOG-JOCHJYFZSA-N 381.524 2.616 0 50 GFAA O=C(NCc1scnc1-c1ccccc1)c1cn(CCN2CCCCC2)nn1 12072849 LAOZBMQYOZHEBX-UHFFFAOYSA-N 396.520 2.818 0 50 GFAA COCCC(=O)N1CCC(C(=O)Nc2ccc(-n3nc(C)cc3C)cc2)CC1 12112323 AEUCRSQGWOHCIK-UHFFFAOYSA-N 384.480 2.703 0 50 GFAA CO[C@H](C(=O)NC[C@H]1Cc2cccc(-c3cncnc3)c2O1)c1ccccc1 12122853 GAIMSRDWOMKUTL-NQIIRXRSSA-N 375.428 2.951 0 50 GFAA Cc1ccc(C(=O)N2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)cc1C 12202342 TXXDABPKUKNLMP-GOSISDBHSA-N 396.491 2.952 0 50 GFAA CCCCn1c(CN2CCC[C@H](O)C2)cnc1S(=O)(=O)CCCC(C)C 12316363 WYUZLJYRFOOHLE-SFHVURJKSA-N 385.574 2.850 0 50 GFAA CC1(C)C(C(=O)N[C@H]2CCCc3nc(N4CCC(CO)CC4)ncc32)C1(C)C 12577489 AOHBFKTXACVAJT-INIZCTEOSA-N 386.540 2.861 0 50 GFAA CCS(=O)(=O)N1CC[C@]2(CCCN(Cc3ccc(C(C)C)cc3)C2=O)C1 15076236 MZGGTZPFUYVAAL-HXUWFJFHSA-N 378.538 2.974 0 50 GFAA OCc1cc(N2CCC3(CC2)c2ccccc2[C@@H](N2CCCC2)[C@@H]3O)ccn1 19800230 MYLIAAJETWPJRI-YADHBBJMSA-N 379.504 2.624 0 50 GFAA COC(=O)C1=C(C)[C@@](C(C)=O)(C(=O)OC)NC(C)=C1c1ccccc1Cl 19817929 UBCFCNIXAJZKPF-LJQANCHMSA-N 377.824 2.665 0 50 GFAA CCOCCn1nc(CC)nc1C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857679339 UUSLLMYSLHBNRI-HNNXBMFYSA-N 384.484 2.872 0 50 GFAA O=C1CCc2c1cccc2C(=O)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1857720688 FMSJCKPUEUHHIU-DYESRHJHSA-N 376.456 2.713 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1C[C@H](O)[C@H](Cc2ccncc2)C1 1857732744 DYDBVEASBPQDDV-AEFFLSMTSA-N 380.423 2.595 0 50 GFAA Cc1ccc(O)cc1C(=O)N1CCO[C@@H](CN2CCCCC2)[C@@H]1c1cnn(C)c1 1857735708 HOJKBCKEGZCHAF-SFTDATJTSA-N 398.507 2.502 0 50 GFAA O=S1(=O)CCC(S(=O)(=O)N2CCC[C@H]2c2cccc3ccccc23)CC1 263648947 CPKKLJOSFPIXKC-IBGZPJMESA-N 393.530 2.884 0 50 GFAA O=C(N[C@H]1C[C@@H]2CCCCN2C1=O)c1cc2ccc(C(F)(F)F)cc2nc1O 822302735 RQGHKQKEKKRFKY-WFASDCNBSA-N 393.365 2.842 0 50 GFAA O=C(N[C@@H]1C[C@H]1C1CCN(C(=O)/C=C/c2cn[nH]c2)CC1)OCc1ccccc1 1875270930 LROLTMHQYKFZDF-RLWBPELLSA-N 394.475 2.976 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3C[C@@H](C(=O)OC)[C@H](C(C)C)C3)ccc21 1875371923 QFYYXMSYMZDROB-ZWKOTPCHSA-N 384.476 2.669 0 50 GFAA CCn1nc2c(c1C(=O)N(C)Cc1ccc(C(=O)NC)cc1)C[C@H](C)O[C@@H]2C 1875314098 HCMMMYCPKFUPKA-UONOGXRCSA-N 384.480 2.557 0 50 GFAA O=C(NCCOc1ccccc1Cl)C(=O)NCCOc1ccccc1Cl 2096137 XPWWKHOKRAERSX-UHFFFAOYSA-N 397.258 2.684 0 50 GFAA CC(C)(C)OC(=O)NCC12CC(N=c3ccc4nnc(C(C)(C)C)n4[nH]3)(C1)C2 2325760544 KQQYLEHIJJDXBC-UHFFFAOYSA-N 386.500 2.703 0 50 GFAA O=C1NC2(CC(c3ccccc3Cl)C2)C(=O)N1c1cnccc1-n1ccnn1 2325869484 POOYHRSAXYAKFM-UHFFFAOYSA-N 394.822 2.688 0 50 GFAA CCOC(=O)c1cc[n+](Cc2nc3ccccc3c(=O)n2-c2ccccc2)cc1 1193849 QGFXWHMYEXRRNC-UHFFFAOYSA-N 386.431 2.898 0 50 GFAA COc1nccnc1NS(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1 1508675 DXJURIOLSSIKLI-UHFFFAOYSA-N 390.446 2.600 0 50 GFAA COC(=O)Cc1c(C)c2ccc(OCC(=O)OCc3ccccc3)cc2oc1=O 2093997 GHGZUNKIKQBNCJ-UHFFFAOYSA-N 396.395 2.939 0 50 GFAA biogenic CCSCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cc(OC)ccc1OC 2784129 ZNMOFZUBBULFLY-QGZVFWFLSA-N 394.493 2.970 0 50 GFAA CCOc1cc(/C=C2/C(=O)N(C)C(=S)N2C)cc(Br)c1OC 2818647 JYLHSNZJNMKFPI-XFFZJAGNSA-N 385.283 2.886 0 50 GFAA CCc1noc2ncc(S(=O)(=O)NC[C@H](N)c3ccc(C(C)C)cc3)cc12 225425651 KDEPJORLDJSXPX-KRWDZBQOSA-N 388.493 2.887 0 50 GFAA Cc1ccc(CNC[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)s1 55342397 IAKMVJWVDOBNCG-LJQANCHMSA-N 380.460 2.978 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2CCC(O)(c3ccc(C)cn3)CC2)cc1 67515282 FBQPOSPGXTUJLT-UHFFFAOYSA-N 382.460 2.872 0 50 GFAA C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)O[C@H]3CCCN(C)C3)c2)C1 248087497 BOOCVYNAIUOAHD-NUJGCVRESA-N 394.537 2.604 0 50 GFAA CN1CCN(C(=O)CCN2C(=O)S/C(=C/c3ccc(Cl)cc3)C2=O)CC1 22146946 LTSQSTMEVNPZQL-NTCAYCPXSA-N 393.896 2.540 0 50 GFAA COCCN1CC[C@@H](N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)CCC1=O 20911656 AUHWOJGCQSCVAQ-YYCBCANDSA-N 389.584 2.600 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CCC(n2cc(CCO)nn2)CC1 20919414 FRMOGAVYYMLRHS-UHFFFAOYSA-N 376.460 2.957 0 50 GFAA CN(Cc1nccn1C)C(=O)c1cc(COc2cccc3cccnc23)on1 12434180 ZAIOYUQMQGYZCL-UHFFFAOYSA-N 377.404 2.808 0 50 GFAA O=C(N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cnc(-c2ccccc2)nc1 252490979 LGXKBSOHLGBJHN-LJQANCHMSA-N 390.418 2.814 0 50 GFAA COc1cc(N2CC[C@H](c3ccc(F)cc3)[C@@H](NC(=O)C(F)(F)F)C2)ncn1 252515610 MEHPVTAOIRMZBY-KGLIPLIRSA-N 398.360 2.665 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)c2nnn(-c3ccc(OC)cc3)c2C)o1 172499526 MESPYKUDMQBQFT-SFHVURJKSA-N 396.447 2.953 0 50 GFAA CS(=O)(=O)c1nc2ccccc2n1C[C@@H]1CCN(C(=O)c2ccccc2)C1 282248650 RBBDLSPZJAQVKT-OAHLLOKOSA-N 383.473 2.602 0 50 GFAA CC[C@@H]1CN(C)c2ccccc2CN1S(=O)(=O)c1cnc2c(c1)c(C)nn2C 157211646 XXRLOCCBIUJZHX-MRXNPFEDSA-N 399.520 2.696 0 50 GFAA Cc1cc(N2CC[C@H](N3CC4(CCOCC4)[C@H]3c3ccccc3)C2=O)n(C)n1 333194983 VZEJDYVZXQEATD-AZUAARDMSA-N 380.492 2.688 0 50 GFAA COc1ccc2c(c1)N(S(=O)(=O)c1cnc(-c3ccccc3)nc1)CCC2=O 375679728 OCZPPEQZSNUYLH-UHFFFAOYSA-N 395.440 2.934 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 240894792 IPXNEONMNQDNNP-MRXNPFEDSA-N 376.416 2.814 0 50 GFAA CNC[C@@H]1CCCN(C(=O)c2cnn(-c3cccc(Br)c3)c2)C1 237264706 XZEZNQDPXNQUGA-ZDUSSCGKSA-N 377.286 2.706 0 50 GFAA O=C(Cc1ccccc1)NCCC(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1 174846957 IUCSJHXEQGSJSE-LEWJYISDSA-N 380.488 2.850 0 50 GFAA Cc1cc(C)cc(NC(=O)C[C@H]2COCCN2C(=O)Cc2c(C)noc2C)c1 72479133 BFGZWJYBLUJHOG-SFHVURJKSA-N 385.464 2.707 0 50 GFAA COCc1cc(N2CC[C@]3(CCCN(Cc4ccccc4F)C3=O)C2)ncn1 426604249 GXRHUUDBIQTOHA-OAQYLSRUSA-N 384.455 2.781 0 50 GFAA Cc1cccc(C2(C(=O)O)CCN(S(=O)(=O)CCC3CCOCC3)CC2)c1 292369843 GJHYUBIYWMYYEA-UHFFFAOYSA-N 395.521 2.560 0 50 GFAA CCCC[C@@H](C(=O)Nc1nc(-c2ccc[nH]2)cs1)N1CCCS1(=O)=O 179476759 JVCBPBUKFPOOGG-AWEZNQCLSA-N 382.511 2.671 0 50 GFAA O=C(CCc1cc2n(n1)CCCN(C(=O)CCc1ccsc1)C2)NC1CC1 91593157 QIOZYDNKESRCNC-UHFFFAOYSA-N 386.521 2.521 0 50 GFAA O=C1NCCN(C(=O)c2cc(-c3ccccc3F)n[nH]2)[C@@H]1c1ccc(F)cc1 97532876 VDZBVNOJODQTEX-GOSISDBHSA-N 382.370 2.668 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)[C@@H]2CCCN(Cc3ccco3)C2)CC1 95352501 XBGBZSHRVNQEFO-LJQANCHMSA-N 382.508 2.934 0 50 GFAA Cc1cccc(N2C[C@@H](C(=O)N3CCC(c4ccncn4)CC3)CC2=O)c1C 298360990 OZCBWTHQXHMOLC-SFHVURJKSA-N 378.476 2.853 0 50 GFAA Cc1nc(CC(C)C)cc(C(=O)N[C@H]2CCOC[C@@H]2OCc2cscn2)n1 1565507057 RZBWXHGWIRFRMO-WMZOPIPTSA-N 390.509 2.544 0 50 GFAA Cc1ccc(-c2nnc(NC(=O)[C@H]3CC(=O)N(Cc4cccnc4)C3)s2)cc1 1529139279 OGXXMKUUTSZGQQ-INIZCTEOSA-N 393.472 2.896 0 50 GFAA CN(C)Cc1nc(C(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)cs1 1704356967 MZOKFEZWQLUSLU-QAPCUYQASA-N 396.516 2.740 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@H]2CN(C(=O)C3CCC3)C[C@@]2(CO)C1 1772818600 VFMBLGHBHKQMBL-QRWLVFNGSA-N 391.899 2.733 0 50 GFAA CCCOc1ccccc1-c1nnc(N2CCN(C)C3(CCN(C)CC3)C2)o1 1772711458 UMMBIHPLCXPUHC-UHFFFAOYSA-N 385.512 2.742 0 50 GFAA Cc1ccn(CCC(=O)NC[C@H]2Cc3cc(-c4cnccn4)cc(Cl)c3O2)n1 11995794 FVAUTZPRSPCHDD-MRXNPFEDSA-N 397.866 2.812 0 50 GFAA CCc1ccc([C@@H]2c3[nH]c4ccccc4c3CCN2C(=O)CNC(N)=O)cc1 12072603 MIUYMBPPFSZEQM-OAQYLSRUSA-N 376.460 2.873 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(Cc2ccc3nonc3c2)CC1 12196976 VFJODCBPFQWQRP-IBGZPJMESA-N 399.539 2.816 0 50 GFAA O=C(c1cnc(O)cn1)N1CC[C@@H](C2CCN(CCc3ccccc3)CC2)C1 12385727 BAEPFLLBDPLDRW-LJQANCHMSA-N 380.492 2.599 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc(NC(=O)CCC3CCCC3)cc2)CC1 16580557 YUWUCLPUEOLPLR-UHFFFAOYSA-N 379.526 2.532 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4cc(F)ccc4F)nnc3c2)n1 169776200 FTEJBBRZVDRMHW-UHFFFAOYSA-N 398.373 2.940 0 50 GFAA Cc1ccc(C2(C(=O)N[C@H]3C[C@@H](Cn4ccnc4)C[C@@H]3O)CCOCC2)cc1C 1857527512 DBSKQPHWJJGNCD-GIVPXCGWSA-N 397.519 2.504 0 50 GFAA Cc1nc[nH]c1CN1CCC2(CC1)OCCc1cc(C(=O)NC3CC3)sc12 1857682519 LYSBKCVYCWCVJY-UHFFFAOYSA-N 386.521 2.736 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NC3(c4ccccc4Cl)CC3)CC2=O)s1 1857722825 PBBJZDWHPUTSOP-NSHDSACASA-N 390.896 2.912 0 50 GFAA CC(C)=CCCN1C[C@@H]2[C@H](CNC(=O)CCc3ccncc3)[C@H]3CC[C@]2(C1)O3 1857730914 CIJDCSZODLPYGT-ZZLPTCMGSA-N 383.536 2.966 0 50 GFAA O=C(NCc1cnc2c(c1)CN(C(=O)c1ccc[nH]1)CC2)c1ccc(F)cc1F 1875246058 HHPYAACZOZOWIL-UHFFFAOYSA-N 396.397 2.816 0 50 GFAA C[C@H](NC(=O)CN1CCN([C@@H]2CCCN(C)C2)CC1)c1cccc2ccccc12 112638172 KXQZFKUNNGCZMB-PZJWPPBQSA-N 394.563 2.729 0 50 GFAA Cc1ccc(OCC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc1 1704304097 KOYNJWMVKSURDQ-QFIPXVFZSA-N 380.492 2.736 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1cc(Cl)ccc1C(=O)[C@H]1CCOC1)C1CC1 952832854 AUYVRNAJZBKVOY-LRDDRELGSA-N 387.885 2.726 0 50 GFAA C[C@H](Cn1ccc2ccccc21)C(=O)N1CCC(C(=O)N=c2cc[nH]cc2)CC1 1875255232 GTWJWVXCXCOLAV-QGZVFWFLSA-N 390.487 2.972 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@]2(Cc3ccc(Cl)cc3)CCCOC2)CC1 1875267965 CQDXTKSZVUJHII-NRFANRHFSA-N 390.911 2.973 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCCN3C(=O)c3ccc(F)c(C)c3)C2)ncn1 1875280553 WISNMIXDPXFGRO-YLJYHZDGSA-N 396.466 2.999 0 50 GFAA Cc1ccc(-c2csc(=O)n2CC(=O)N2C[C@@H]3CCCC[C@@]3(CN)C2)cc1 1875287430 KHSATXRXUFYUNY-LAUBAEHRSA-N 385.533 2.863 0 50 GFAA C[C@H]1CN(c2ccc(F)cn2)CCN1C(=O)c1cc(F)c2nc(O)ccc2c1 1875313765 TWIUTICPCDIQEB-LBPRGKRZSA-N 384.386 2.965 0 50 GFAA CC[C@H](O)[C@H](C)C(=O)N[C@@H](CNC(=O)[C@@H](C)c1ccco1)C1CCCCC1 1875344654 OIEDRSZWDYQWMF-LAQRGFTBSA-N 378.513 2.971 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)[C@@H](C)c1ccc(F)c(F)c1)CCO2 1875395548 DJKCQZRKZPYURX-VVSZKKGMSA-N 386.464 2.558 0 50 GFAA CN=[S@@]1(=O)CCC[C@@]2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1 1875396181 YCKMASXQLVUKIT-ODCWNRFASA-N 375.416 2.967 0 50 GFAA CC(C)c1ccc(C2(O)CN(C(=O)c3csc(N=S(C)(C)=O)n3)C2)cc1 1875311251 RQWIPBASDRFJIA-UHFFFAOYSA-N 393.534 2.969 0 50 GFAA COc1ccc2c(c1)OC[C@@H](N=c1nc(-c3ccc(OC)c(OC)c3)[nH]o1)C2 2325718211 SQHNDCRNJDIMPF-AWEZNQCLSA-N 383.404 2.600 0 50 GFAA O=C1CC[C@]2(CCN(C(=O)c3[nH]c(Cl)c(Cl)c3Br)C2)N1 2325805455 JSIPRQJZEJGAGH-GFCCVEGCSA-N 381.057 2.579 0 50 GFAA CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1cc2c(c(OC)c1)O[C@@H](C)C2 910541075 BEWDTQUMKQKQRF-LBPRGKRZSA-N 386.448 2.582 0 50 GFAA CCCC(=O)NC(=S)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1 676691 WGOVATYLPIJBPT-UHFFFAOYSA-N 383.539 2.911 0 50 GFAA COc1cc(/C=C(\NC(C)=O)C(=O)N[C@H](C)c2ccccc2)ccc1OC(C)=O 2814276 LICFDJBDRRSZSK-VCRXTVNUSA-N 396.443 2.975 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)[C@H]3CCn4nccc4C3)CC1)OCC2 2356149021 FPZCVISOZVMCQY-KRWDZBQOSA-N 381.476 2.545 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3c2nnc(-c3ccccc3)s2)no1 2356169058 TYRHHKGKWXFVPQ-HOTGVXAUSA-N 381.461 2.995 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NC3CCCC3)C2)cc1 6702070 MVKNMKDIMYOJTG-HNNXBMFYSA-N 380.510 2.545 0 50 GFAA Cc1csc(CN(C)C[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)n1 55133325 QPLYGDGBXORNHP-LJQANCHMSA-N 395.475 2.715 0 50 GFAA O=C(O)c1nn(CC2CC2)c2c1CN(C(=O)c1ccc(Cl)cc1O)CC2 67804225 XVQONNJORRNQAR-UHFFFAOYSA-N 375.812 2.549 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(NCc3ccco3)nc2)CC1 67896481 MIXAHTNXIKTSQY-UHFFFAOYSA-N 382.464 2.761 0 50 GFAA CNC(=O)[C@H]1CC[C@](C)(c2nc(-c3c(C)ncc4c3CCNC4)no2)C1(C)C 20363674 XUNQPOGONCYBPK-QVKFZJNVSA-N 383.496 2.526 0 50 GFAA Cc1oc(-c2cccc3ccccc23)nc1CN1CCN(CCC(N)=O)CC1 20908770 YSDCQUGMFXNAKL-UHFFFAOYSA-N 378.476 2.796 0 50 GFAA CCc1sc(-c2nnc(SCC(N)=O)n2CC)cc1Br 2779006 APVJSBXQTOIFJC-UHFFFAOYSA-N 375.317 2.929 0 50 GFAA Cc1nn(C)c2nc(-c3ccccn3)nc(NCc3cn4c(n3)SCC4)c12 72469199 DHXCJXWWDDVNCE-UHFFFAOYSA-N 378.465 2.648 0 50 GFAA COc1ccc(CN2CCN([C@@H](C)c3nc(C)no3)CC2)c(OC(F)F)c1 121264648 MCNYLURSVMZTBN-LBPRGKRZSA-N 382.411 2.867 0 50 GFAA CCOC(=O)c1ccc(S(=O)(=O)NCc2nccn2-c2ccccc2)cc1 253430326 XVVPMTRMZIHQLK-UHFFFAOYSA-N 385.445 2.528 0 50 GFAA O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC(O)(C(=O)O)CC1 71763281 KQFJCKMKFRYXIU-UHFFFAOYSA-N 376.412 2.954 0 50 GFAA COCCOC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 77298208 GCBZZMWXWHYMSX-UHFFFAOYSA-N 380.872 2.938 0 50 GFAA Cc1noc([C@H]2C[C@H](O)CN2S(=O)(=O)c2csc3ccc(Cl)cc23)n1 328634838 UHWFFWKCNMIZDJ-CMPLNLGQSA-N 399.881 2.743 0 50 GFAA COc1ccc([C@H]2CCN(C(=O)NCc3ccc(-n4ccnc4)nc3)C2)cc1 363370993 VVZBJMRCCYIDTR-SFHVURJKSA-N 377.448 2.975 0 50 GFAA O=C(O)C1(n2cnc3ccccc32)CCN(c2nccnc2N2CCCC2)CC1 72407495 BRIXOOMVHBGZEF-UHFFFAOYSA-N 392.463 2.507 0 50 GFAA Cc1nc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)sc1C 71614466 RLKGGBMYFICRAE-INIZCTEOSA-N 376.570 2.715 0 50 GFAA NC(=O)NCC(=O)N1CCC[C@@H](C(=O)c2ccc(-c3ccccc3)c(F)c2)C1 72129235 XWGRSOMLZSYPTP-MRXNPFEDSA-N 383.423 2.582 0 50 GFAA CC(C)(CCCO)CNC(=O)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 372529867 GEHCFPPEDYLASI-KRWDZBQOSA-N 390.528 2.643 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(c3nccs3)CC2)C1 71735885 QTLGBRBGBZYBPK-QGZVFWFLSA-N 385.537 2.535 0 50 GFAA CN1CCN(c2ccc(C(=O)NCCCc3nc4ccccc4o3)cc2)CC1 220673605 DJCYWSVWPKHZGO-UHFFFAOYSA-N 378.476 2.942 0 50 GFAA CCCC[C@H]1CN(c2cccc(-c3ccccc3)c2)C(=O)CN1C(=O)C(N)=O 82157379 QIIWSFYOSSMQEA-IBGZPJMESA-N 379.460 2.573 0 50 GFAA CN1CCOC[C@H](CNC(=O)c2cccc(-c3cnc4ccccc4n3)c2)C1 426376382 NWMOBBSJTKEKNQ-MRXNPFEDSA-N 376.460 2.605 0 50 GFAA COc1ccnc(N2CCN(C(=O)c3c(C)[nH]c4ccc(Cl)cc34)CC2)n1 179198119 BOPXPHXKSKVYKA-UHFFFAOYSA-N 385.855 2.891 0 50 GFAA Cc1cc(=O)oc2cc(O[C@@H](C)C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)ccc12 238899386 GCWSGQPKIODBTC-KKUMJFAQSA-N 387.432 2.876 0 50 GFAA biogenic Cc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(CCCc2ccccc2)C3)c(=O)[nH]1 95379857 ZDCHGGUWSJJIKR-VQTJNVASSA-N 379.504 2.853 0 50 GFAA CCN1CCC[C@](C)(C(=O)N2CCC(c3nccn3CCCN(C)C)CC2)C1 95377379 FZLUSMXBGULTIF-QFIPXVFZSA-N 389.588 2.663 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C2Cc3ccccc3C2)CC1 96131532 AXVVLAYOOVQIHD-UHFFFAOYSA-N 376.508 2.890 0 50 GFAA COc1ccc(F)cc1-c1ccc(C(=O)NCCN2CCC[C@@H](CO)C2)cc1 426563066 HCTFMUFNZOMYOL-MRXNPFEDSA-N 386.467 2.935 0 50 GFAA CNc1snc(C)c1C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 181422273 CMMQJSLBXAOIBG-LBPRGKRZSA-N 382.848 2.821 0 50 GFAA Cc1ccccc1-n1cc(CN(C)C(=O)CN2CC3(CCCC3)CC2=O)cn1 95508730 UMSNZTFCCSFKEO-UHFFFAOYSA-N 380.492 2.932 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)c2cc(=O)c3ccccc3o2)C1 95496849 HPXPRPRJXUOJER-OAHLLOKOSA-N 381.432 2.656 0 50 GFAA CN1C(=O)N[C@@]2(CCN(C(=O)NCc3ccc(C4CCCCC4)cc3)C2)C1=O 297937435 JVJZAZYBDXDXOB-OAQYLSRUSA-N 384.480 2.570 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)[C@H](C)Oc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)O 253488172 YSRBTLZFGKPIHV-SIMVJXQJSA-N 375.421 2.793 0 50 GFAA CCn1ncc(CNC(=O)N2CCN([C@@H]3CCc4ccccc4C3)CC2)c1C 534651195 UBJLKIDPIMFQIO-OAQYLSRUSA-N 381.524 2.596 0 50 GFAA Cc1cc(C(=O)N[C@@H]2C[C@H](C(=O)NC(C)C)C[C@H]2O)c2ccc(C)c(C)c2n1 1940195647 UZGIRBBGSOQEKP-KFKAGJAMSA-N 383.492 2.554 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@H](C)Nc2ncnc3nn(C)cc23)cc1 162971614 MJKDRCSZYPHVSP-ZDUSSCGKSA-N 388.497 2.567 0 50 GFAA O=C(NCCNC(=O)c1ccc(F)cc1)NC[C@H]1CCN(C2CCCCC2)C1 584900113 SBQZVAINSOHPSM-MRXNPFEDSA-N 390.503 2.509 0 50 GFAA O=C(Nc1nccs1)c1cccc(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c1 827691980 DWVDQHLNFXGIOB-UOVKNHIHSA-N 383.429 2.857 0 50 GFAA Cc1cccc(OC2CN(C(=O)NC3CCN(C(=O)C4CCCC4)CC3)C2)c1 584895521 FIGOXXNGXMBSCH-UHFFFAOYSA-N 385.508 2.949 0 50 GFAA C[C@H]1CCc2c(sc3nc(CCC(=O)NO[C@@H]4CCCCO4)[nH]c(=O)c23)C1 170608051 YADUMATZJGCGGN-MEDUHNTESA-N 391.493 2.616 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)NC[C@@H]4CCCS4(=O)=O)CC3)oc12 189402807 UTRNRZWSOSWERX-HNNXBMFYSA-N 391.493 2.602 0 50 GFAA CCN(Cc1ccc2c(c1)OCCO2)C(=O)Cn1ccc(=O)c2ccccc21 194121387 UNOHUSLYXUUBIM-UHFFFAOYSA-N 378.428 2.821 0 50 GFAA Cc1ccc2nc(C(=O)N3CCN4[C@H](COC[C@H]4c4ccccc4)C3)c(F)n2c1 1616080318 OLIZZFMNRIUKCK-ROUUACIJSA-N 394.450 2.680 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCC([C@H](O)c3cccs3)CC2)c1 1506426563 PQVYQHVNMIVNMR-KRWDZBQOSA-N 379.503 2.737 0 50 GFAA C[C@@H](CN(C)c1noc(-c2ccc(Cl)cc2)c1C(=O)O)N1CCOCC1 1704310814 UCDOQMBIZKPJQA-LBPRGKRZSA-N 379.844 2.850 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N1CCC[C@H](N)C1 1704304465 RVIWBDNHFCEPKN-AWEZNQCLSA-N 378.860 2.617 0 50 GFAA COc1ccccc1CNC(=O)Cn1nc(-c2ccc(Cl)cc2)ccc1=O 5388550 IABGOYKWUVNNIW-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA CCN(CC)CCN(CC)C(=O)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 11874011 UBSQWIMCUFLHKB-LJQANCHMSA-N 391.531 2.797 0 50 GFAA Cc1ccc(-c2ccc3nnc(CNC(=O)COc4ccc(F)cc4)n3n2)cc1 169781146 XUKJGGMGLAZILK-UHFFFAOYSA-N 391.406 2.934 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)O)C3(CCN(Cc4[nH]cnc4C)CC3)C2)cc1 1857690509 LNHUKVZSNHOUDA-IBGZPJMESA-N 382.508 2.825 0 50 GFAA O=C(c1cnc2c(c1)CCCC2)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857707781 JRLSCLPUWKFWJC-QHCPKHFHSA-N 391.471 2.850 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1ccncc1F 1857721503 RWFCEYNTIBRBKS-RVKKMQEKSA-N 375.831 2.818 0 50 GFAA O=S(=O)(NC[C@H]1CCCNC1)c1c(Cl)cc(F)cc1Br 237706655 PJWJSIZKLICXAF-QMMMGPOBSA-N 385.686 2.520 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)cc1 408513208 RYRDFQSNXJQOJO-GOSISDBHSA-N 387.457 2.522 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)Cc3ccn(C)c3)C2)cc1OC 12711254 CDSIUHJWGIXNSQ-HXUWFJFHSA-N 399.535 2.750 0 50 GFAA CCn1nc(C)c(CN2C[C@@H]3OC(=O)N(CCc4ccc(OC)cc4)[C@@H]3C2)c1C 247930790 SCFKNNMVHVQIGQ-RTWAWAEBSA-N 398.507 2.776 0 50 GFAA CCCOc1cc(OC)ccc1C(=O)Nc1ccc(N2CCN(C)CC2)nc1 252500185 SOLPPDFLQANSBE-UHFFFAOYSA-N 384.480 2.883 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cnc4ccccc4n3)C1)CC2 1704350056 OEGDGXWMLDQCIW-QFIPXVFZSA-N 388.475 2.606 0 50 GFAA CC(=O)N[C@H](CC(=O)N1C[C@]2(C)CN(C)C[C@@]2(C)C1)c1ccc(Cl)cc1 823754868 IBCTXPKRIKCZNH-HOJAQTOUSA-N 377.916 2.708 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@@](CO)(C(C)C)C2)(c2ccccc2)CC1 848144347 RELREZIODQYGEY-HSZRJFAPSA-N 398.547 2.990 0 50 GFAA COc1cccc(C(F)(F)CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)n1 952853102 IBLJZNQGTSGOLG-IAOVAPTHSA-N 377.366 2.959 0 50 GFAA Cc1ccccc1CN1CCC(N2C(=O)N[C@@H]3CN(C(=O)C(C)C)CC[C@H]32)CC1 888103301 CEPNZIFLNXJHTA-NHCUHLMSSA-N 398.551 2.610 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C(=O)c3ccccc3C2=O)sc(C)c1C 943813 HWSRMOHVACUOEN-UHFFFAOYSA-N 386.429 2.776 0 50 GFAA O=C(c1cc(=O)c2c(O)cccc2o1)N(CCc1ccccc1)[C@H]1CCOC1 2325870271 QCLNTLRQZRBEFD-INIZCTEOSA-N 379.412 2.972 0 50 GFAA COc1ccc(-c2noc(CCCN3C(=O)c4ccccc4C3=O)n2)cc1OC 1116808 XVJWIIUQFAFLLT-UHFFFAOYSA-N 393.399 2.983 0 50 GFAA O=C(Cn1cccn1)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2356154860 NCKHSZHXSIDLFT-QFIPXVFZSA-N 390.487 2.848 0 50 GFAA O=C(CN1C(=O)c2cccc3cccc(c23)C1=O)N1CCN(c2ccccc2)CC1 4116531 WOQPEWGHKGVUIE-UHFFFAOYSA-N 399.450 2.785 0 50 GFAA CCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)c1cc(C)ccc1OC 4857852 LRBIQTWBCHQKTN-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA CSc1nsc(SCC(=O)Nc2sc3c(c2C(N)=O)CCC3)n1 6467662 BHJCSPLGYQVFLS-UHFFFAOYSA-N 386.549 2.640 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nncn2Cc2ccccc2)c1 225476325 AGCPECIFTDZBKY-UHFFFAOYSA-N 390.852 2.983 0 50 GFAA CCN(Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1)C[C@@H]1CCCO1 55042407 LZNHSPHWHRCRHG-SFHVURJKSA-N 383.558 2.868 0 50 GFAA O=C(NS(=O)(=O)N1CCCCC1)c1ccc(Br)c(Cl)c1F 225692640 MEKWUMQKKZLTCD-UHFFFAOYSA-N 399.669 2.702 0 50 GFAA OCC[C@H]1CN(Cc2cccc3c2OCO3)CCN1Cc1ccc(F)c(F)c1 20601625 KNPUVGSOOKMXBW-KRWDZBQOSA-N 390.430 2.762 0 50 GFAA CN1CCC[C@@]2(CCCN(C(=O)c3ccc(CSc4nnc[nH]4)o3)C2)C1 55325499 XYBLHSPLTQFALX-GOSISDBHSA-N 375.498 2.638 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)c2cc(CN3CCc4ccccc4C3)on2)C1 67695114 ICHPXAIXIACACH-IBGZPJMESA-N 382.508 2.789 0 50 GFAA COC1CCN(c2ccc(C(=O)NCC[C@H]3COc4ccccc4O3)cn2)CC1 20994042 DXWWBDZAXOLZRR-SFHVURJKSA-N 397.475 2.657 0 50 GFAA O=c1[nH]c(NC2CCCCC2)nc(=O)c2c1ncn2CCCc1ccccc1 20600222 UVCRWQQEAWWBPA-UHFFFAOYSA-N 379.464 2.857 0 50 GFAA CC1CCN(c2ccc(=O)n(CC(=O)Nc3nc4ccccc4s3)n2)CC1 61721190 JKBQZZQFCCKRCS-UHFFFAOYSA-N 383.477 2.728 0 50 GFAA COc1ccc2[nH]c(=O)c(CN3CCc4[nH]cnc4[C@H]3c3ccncc3)cc2c1 67834120 XGGYRAKAYAXCPY-OAQYLSRUSA-N 387.443 2.803 0 50 GFAA Cc1nn(C)c2sc(C(=O)N[C@H](C)CN3CCN(c4ccccc4)CC3)cc12 119672038 VJMVFBLXIMATQN-OAHLLOKOSA-N 397.548 2.884 0 50 GFAA Cn1c(=O)oc2cc3c(cc21)NC(=O)C[C@H]3c1cc(F)ccc1-n1cccn1 65501606 DPAHCBRHRRRSDN-GFCCVEGCSA-N 378.363 2.930 0 50 GFAA Cc1nnc(NC(=O)c2ccc(Cn3cnc4ccccc4c3=O)cc2)s1 36357451 ABXPOUNKPYCGEL-UHFFFAOYSA-N 377.429 2.857 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)Cc2cc(F)ccc2-n2cccn2)N1 216389809 MFCUFPOCUALDDF-IBGZPJMESA-N 379.439 2.687 0 50 GFAA COc1cccc(OCC(=O)N2CCN(Cc3ccc(C)c(C)c3)C(=O)C2)c1 77536287 DNTRNBSZWHMFDL-UHFFFAOYSA-N 382.460 2.562 0 50 GFAA O=c1n(Cc2cc(F)cc(F)c2)nc(C2CCNCC2)n1Cc1ccccc1 71763905 XNAKBVQGNHUPFW-UHFFFAOYSA-N 384.430 2.887 0 50 GFAA O=C(O)[C@H]1CC2(CCN(C(=O)C3CC3)CC2)CN1Cc1ccc(O)c(Cl)c1 72412004 LMECMQZKBYSOMP-MRXNPFEDSA-N 392.883 2.723 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CCN1 262940072 UJWTYHHVRNCVIF-AYOQOUSVSA-N 389.499 2.867 0 50 GFAA O=C(O)[C@H]1C[C@@H](C(=O)NC2CC2)CN(C(=O)c2ccccc2-c2ccccc2)C1 72145562 SSOZHMGLPIDVNZ-SJORKVTESA-N 392.455 2.795 0 50 GFAA COc1cc(F)c(C(=O)N2CCC[C@H](Cn3nc(C)nc3C)C2)cc1OC 130876190 WTDZZYQXFCDJIN-AWEZNQCLSA-N 376.432 2.604 0 50 GFAA CC[C@@H]1CCN(C(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)C1 131048898 MCUGFHSTTYSOMU-GFCCVEGCSA-N 396.417 2.618 0 50 GFAA CCCOc1cccc(CCNC(=O)N2CCN(C(=O)c3ccco3)CC2)c1 136800759 YXMVRCSDQOXQRR-UHFFFAOYSA-N 385.464 2.779 0 50 GFAA O=C(NCc1cc(C2CC2)n[nH]1)N1CCN([C@@H]2CCc3ccccc3C2)CC1 426423094 QPKLGZVQULNRQV-HXUWFJFHSA-N 379.508 2.672 0 50 GFAA CNC(=O)[C@H](NC(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccccc1 426402017 SGWPHHUYVHJGRW-OAQYLSRUSA-N 394.519 2.685 0 50 GFAA CC(C)(C)c1cc(CNC(=O)N2CCC[C@]3(C2)C(=O)Nc2ccccc23)[nH]n1 426491566 RBWBRGILMSBWFA-OAQYLSRUSA-N 381.480 2.903 0 50 GFAA O=C(c1ccc(Cl)c(F)c1)N1C[C@H]2CN(CC3CCC3)C[C@@]2(C(=O)O)C1 96130819 HBASSXMIHNWMLY-AUUYWEPGSA-N 380.847 2.738 0 50 GFAA O=C([C@@H]1CCCN(Cc2ccco2)C1)N1CCCN(Cc2ccccn2)CC1 95353490 BXDMUCDDOWTDKJ-LJQANCHMSA-N 382.508 2.621 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)Nc1cc(F)ccc1C)CCN2C 91896766 MSAQWGCLEQJLQT-HXUWFJFHSA-N 376.476 2.685 0 50 GFAA COCCn1cncc1CN1C[C@](C)(Cc2ccc3c(c2)OCO3)CCC1=O 91942965 GHFKJZGKOPEHJT-NRFANRHFSA-N 385.464 2.630 0 50 GFAA CC(C)C[C@@H]1CN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)CCO1 92096767 IDMKVXMTABABQN-OAHLLOKOSA-N 388.420 2.869 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccccc2F)C1)S(=O)(=O)N1CCCCC1 95518667 CAUUQLAFWLHNRR-SFHVURJKSA-N 397.560 2.743 0 50 GFAA Cc1n[nH]c(SCCNC2CCN(c3nc(C)nc4sccc34)CC2)n1 95524457 MILYMWKCWRPTPV-UHFFFAOYSA-N 389.554 2.777 0 50 GFAA Cc1ccc(C(=O)NCc2cc3n(n2)CCCN(C(=O)C2CCC2)C3)c(F)c1 92028744 FOJMUTZMIPTPGC-UHFFFAOYSA-N 384.455 2.793 0 50 GFAA C[C@@H](O)c1cccc(-c2ccc(C(=O)N3CCC4(CC3)CNC(=O)O4)cc2)n1 534672390 DRBXRHAKKYIIMD-CQSZACIVSA-N 381.432 2.517 0 50 GFAA Cc1ccccc1[C@]1(O)CCN(C(=O)c2cccc(-c3nc(C)n(C)n3)c2)C1 299782938 NRFWPAVFSOVTOL-QFIPXVFZSA-N 376.460 2.833 0 50 GFAA CCc1nccn1CCCNC(=O)C12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 823557530 SUSYVEXBKRMAGT-AGXSTUJCSA-N 382.512 2.539 0 50 GFAA CNC(=O)c1ccc(CNC(=O)N2CCC[C@H]2c2nc3cccc(C)c3[nH]2)o1 584884189 PSKNMGYPOFMSGN-HNNXBMFYSA-N 381.436 2.871 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)C2CC2)CN1Cc1ccc(CC(C)C)s1 91745642 VBVUOTDHJANJBH-YJBOKZPZSA-N 377.554 2.552 0 50 GFAA COCCN(CCOc1ccccc1F)CCC(=O)NCc1cccs1 1506397768 CNQBFWYRMNMTOI-UHFFFAOYSA-N 380.485 2.921 0 50 GFAA Cc1ccc(C(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc1N1CCNC1=O 1506396385 HWEMXQOLVPWRFE-IBGZPJMESA-N 394.475 2.741 0 50 GFAA CC[C@]1(O)CCN(C(=O)c2cccnc2SCCc2ccccc2)C[C@@H]1O 212030432 GFOYXNDIXXHKMQ-RXVVDRJESA-N 386.517 2.764 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3ccc(O)nc3)CC1)OCC2 1704315313 ROAMAHSJAHWHHC-UHFFFAOYSA-N 384.432 2.509 0 50 GFAA CN1CCC[C@@]2(C(=O)NCC3=CCCCC3)CCN(C(=O)c3cccn3C)C[C@H]12 1775981787 WMPBHGRXROTYQV-NZQKXSOJSA-N 398.551 2.568 0 50 GFAA CCCC1=C(C(=O)OCC)[C@@H](c2ccc(OC)c(OC)c2OC)NC(=O)N1 5019037 CXLZICTWUGZLHI-OAHLLOKOSA-N 378.425 2.684 0 50 GFAA O=C(NCc1ccncc1)c1ccc(OC2CCN(C[C@H]3CCOC3)CC2)cc1 11937714 KOCLEEJVSHTNRB-LJQANCHMSA-N 395.503 2.891 0 50 GFAA Cc1ccccc1[C@]1(CC(=O)N(C)C(C)C)CC(=O)N(Cc2cccnc2)C1=O 12213337 YTLRNPQJXXGRKM-QHCPKHFHSA-N 393.487 2.844 0 50 GFAA CCc1nnc(NC(=O)[C@@H](C)Sc2nnc(-c3ccncc3)n2CC)s1 13956247 BPBXRUWEWNWFEC-SNVBAGLBSA-N 389.510 2.893 0 50 GFAA COC(=O)[C@@H]1CCCN1C(=O)c1coc(COc2ccc(F)cc2Cl)n1 15064646 VQGLIQMEZWARJP-ZDUSSCGKSA-N 382.775 2.824 0 50 GFAA CCn1c(CN2CCOCC2)nc2cc(NC(=O)COc3ccccc3)ccc21 16650071 FYQDQQFPKWAGLI-UHFFFAOYSA-N 394.475 2.906 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C(=O)c3sccc3C)CC2)CC1 19226580 DPNYNULZJSTTTG-UHFFFAOYSA-N 377.554 2.853 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)Cc3c(C)nn(-c4ccccc4)c3C)CCN12 1857735564 RVVVFULAPFFUOW-LEWJYISDSA-N 396.535 2.743 0 50 GFAA O=C(O)[C@@H]1CCCN(S(=O)(=O)c2cc(Cl)ccc2Br)C1 262640039 OMJUWDLSNGGQMH-MRVPVSSYSA-N 382.663 2.588 0 50 GFAA C[C@H](OC(=O)c1ccccc1OCc1cn2ccccc2n1)[C@H]1CCNC(=O)C1 1263661235 CNTGOJXBCIZSTO-HOTGVXAUSA-N 393.443 2.985 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccncc2)CN(C(=O)N[C@H]2CCCCNC2)C1 952895723 WWAHAGGDXNYRAM-KRWDZBQOSA-N 382.512 2.503 0 50 GFAA O=C(CCOCC(F)F)N1CC[C@@](c2nc(C3CC3)no2)(C(F)(F)F)C1 952895647 VCIZQLPHXLSBGO-CQSZACIVSA-N 383.317 2.651 0 50 GFAA CC(C)Oc1ccc(Cl)c(C(=O)Nc2ccc3c(c2)C(=O)NCCO3)n1 1875296126 GKYZBCZVZCNUPU-UHFFFAOYSA-N 375.812 2.897 0 50 GFAA O=C(c1cccc2ncnc(O)c12)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2 1875280470 MKSGEGQOGVNWEO-HOTGVXAUSA-N 375.428 2.990 0 50 GFAA CSCCCC(=O)N[C@H](C(=O)NCc1cccc2c1OCCCO2)C(C)C 1875310687 YRDVLZVSEGENLP-SFHVURJKSA-N 394.537 2.748 0 50 GFAA Cc1cc(F)ccc1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397222 QQJQLUAABYKQLI-GOSISDBHSA-N 385.487 2.611 0 50 GFAA COc1coc(C(=O)N2C[C@@H]3CC[C@H]2CN(CCCc2ccccc2)C3)cc1=O 1073305983 XAAKVTHQNCWGEE-MOPGFXCFSA-N 396.487 2.818 0 50 GFAA CCN(Cc1noc(C2CC2)n1)C(=O)c1ccc2nnc(-c3cccn3C)n2c1 2100555284 PEQOUYHZGZNJBE-UHFFFAOYSA-N 391.435 2.658 0 50 GFAA C=CC(=O)N(CC)CC(=O)N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F 907921780 QJZWGWNTQVJQDT-CYBMUJFWSA-N 378.778 2.543 0 50 GFAA CCn1nnnc1-c1ccc(OC)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1 623950 AAZRLEOBBFSJGJ-UHFFFAOYSA-N 393.856 2.823 0 50 GFAA Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3F)cc2)n1 898248 JIDDEKAGGBQWCI-UHFFFAOYSA-N 386.408 2.977 0 50 GFAA O=S(=O)(C1CC1)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2356163776 QLAUBHJDFWMROL-NRFANRHFSA-N 386.517 2.917 0 50 GFAA COc1ccc(N2C(=S)N(c3ccc(F)cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4168085 AKHWBOCJQGZDQH-DLBZAZTESA-N 392.477 2.611 0 50 GFAA COC(=O)c1c(N2C(=O)[C@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)sc2c1CCCCCC2 101709539 JDLSIIZPYMLWOH-MPTQWLOMSA-N 389.473 2.861 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc4nonc4c3)C[C@H]2CCO)cc1 104311051 HPQWKYDJWRPEIG-LJQANCHMSA-N 396.491 2.690 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCO2)cccc1C(=O)NCc1cn2cccc(C)c2n1 23620010 NSXIQRAQLBAXMP-LJQANCHMSA-N 392.459 2.999 0 50 GFAA O=C(CCCOc1ccc(Cl)cc1Cl)NCCCN1CCOCC1 20149294 HXGOXHIXSJUXNE-UHFFFAOYSA-N 375.296 2.991 0 50 GFAA CC[C@H](CO)N(Cc1ccc(CN(C)S(C)(=O)=O)o1)Cc1ccccc1C 63844612 YDCIYWFOGKXOEU-GOSISDBHSA-N 394.537 2.753 0 50 GFAA CN1C(=O)COc2cc3c(cc21)[C@@H](c1coc2ccccc2c1=O)CC(=O)N3 65406055 JKBAYAFDHHOMND-LBPRGKRZSA-N 376.368 2.622 0 50 GFAA CN(C)c1nc(-c2cccc(-c3ccn(C[C@H]4COCCO4)n3)c2)ncc1F 20109503 ABVZXNOVSVFJLD-INIZCTEOSA-N 383.427 2.628 0 50 GFAA CC(C)(C)n1cnc(C(=O)N2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)n1 329733630 JUFVSNYXYLAZQN-CQSZACIVSA-N 388.472 2.678 0 50 GFAA CCN1CC2(CCN(Cc3cnc(-c4ccc(OC)cc4)nc3)CC2)OC1=O 72420492 CVRIORAVXOOHMY-UHFFFAOYSA-N 382.464 2.959 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)Cc2nccs2)n1Cc1ccccc1 11935795 WTJNDONXTSTQKB-UHFFFAOYSA-N 390.534 2.814 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)c2cc(Cn3c(C)nc4ccccc43)on2)C1 11937080 APNJZDMOWDRONV-INIZCTEOSA-N 381.480 2.937 0 50 GFAA Cc1cc(CNC(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)n[nH]1 71736234 DUZYOZJOJHCFSL-QHCPKHFHSA-N 388.471 2.882 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)N1CCO[C@]2(CNCCOC2)C1 72156292 NAQSKPFQLNPODK-OAQYLSRUSA-N 383.448 2.702 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)[C@H]1CCCN(Cc2cccc(F)c2)C1 150750968 LIDJUSKEMDSTKE-INIZCTEOSA-N 380.427 2.652 0 50 GFAA CN(Cc1ccccc1Cl)c1ncc(S(C)(=O)=O)c([C@@H]2CCCNC2)n1 71388617 PCDJAMMWEXCJPT-CYBMUJFWSA-N 394.928 2.637 0 50 GFAA CCc1noc2ncc(C(=O)N[C@@H]3CCN(c4ccc(Cl)cc4)C3=O)cc12 154584343 OWZOKCLZIIGDTN-MRXNPFEDSA-N 384.823 2.974 0 50 GFAA CCc1ccc([C@H]2COCCN2CCOc2cccc(S(C)(=O)=O)c2)o1 155177056 DBHHTCVLOABTJQ-GOSISDBHSA-N 379.478 2.698 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)Nc3ccc4c(c3)NC(=O)CS4)cn21 333928930 XWKDRRTYXKQVJK-SNVBAGLBSA-N 378.479 2.625 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@H](C)Oc4cc(F)ccc43)ccc21 172897472 IUBLCVDGPFVNMS-LBPRGKRZSA-N 390.436 2.711 0 50 GFAA COc1cccc(NC(=O)N2CCN(c3ccnc(N4CCCCC4)n3)CC2)c1 72119345 ICKYHDJFALLBPS-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CCN(CC)C(=O)c1ccc(-n2ccnc2-c2cc3n(n2)CCNC3)c(C)c1 72426178 XJBRZDJATPWSFA-UHFFFAOYSA-N 378.480 2.629 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cncc(C)c1)C(=O)N(C1CCCC1)C2 71416288 FYADVEYYFWBYBZ-UHFFFAOYSA-N 380.448 2.622 0 50 GFAA Cc1ccccc1CN(C(=O)C[C@@H]1C(=O)NCCN1Cc1ccoc1)C(C)C 72167333 ILFHQYSWKFLDBL-HXUWFJFHSA-N 383.492 2.716 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C1=O 177095894 PVFGLRVOPDLALT-GFCCVEGCSA-N 383.429 2.947 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N[C@H](C)c2nncn2C2CCCC2)c1 426535641 GKSVPJQLHFJNOE-CQSZACIVSA-N 384.484 2.955 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccccc3OC)n2)c(F)c1 49551102 BNBIUTZKURAQIJ-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA CCCC(=O)N1CCCC[C@H]1C(=O)N1CC[C@](CO)(Cc2ccc(F)cc2)C1 290640124 MTMVPHGUVPVDPA-UGKGYDQZSA-N 390.499 2.760 0 50 GFAA COc1cc(C(=O)NCC(=O)N2CCC[C@H](C3CC3)C2)ccc1OC(F)F 290791666 DQYDPYKIEDCQLV-AWEZNQCLSA-N 382.407 2.675 0 50 GFAA CC[C@]1(CNC(=O)c2cnc3scc(C)n3c2=O)OCCc2ccccc21 291178988 BQRQHGKQWSDDFB-HXUWFJFHSA-N 383.473 2.672 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)c3nc4ccccc4[nH]c3=O)C2)c1 95368275 JOCVHGSPKOMGMN-OAHLLOKOSA-N 377.400 2.641 0 50 GFAA O=C1CCC2(CCN(c3cc(C4CC4)ncn3)CC2)CN1CCCn1ccnc1 91645756 DRINKZOVFDHSHC-UHFFFAOYSA-N 394.523 2.850 0 50 GFAA CCn1ncc2cc(C(=O)NCc3cccc(N4CCOCC4)c3)c(C)nc21 294101197 DMOBXCNBDVWFGP-UHFFFAOYSA-N 379.464 2.526 0 50 GFAA Cn1cnnc1SCCN1C[C@](C)(Cc2ccc3c(c2)OCO3)CCC1=O 91724613 OAKUKSAGXQRVFN-IBGZPJMESA-N 388.493 2.507 0 50 GFAA O=S(=O)(C1CC1)N1CCC(N[C@H]2CCCOc3cc4c(cc32)CCC4)CC1 181275093 IMMGCOALZSQLRA-FQEVSTJZSA-N 390.549 2.935 0 50 GFAA Cc1cccc(C(=O)N[C@H]2CC[C@@H](n3cc(C(=O)N4CCCC4)nn3)CC2)c1 244764114 PBPJPDHJVWZBTF-HDICACEKSA-N 381.480 2.736 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)Nc1cccc2nsnc12 252539265 NYASUPLWVGMWJM-CQSZACIVSA-N 381.417 2.810 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2ccsc2)[C@H](CCO)C1 39485464 HIZIQDPSOFEZIV-MRXNPFEDSA-N 376.551 2.835 0 50 GFAA COc1cc(F)c([C@H]2CC(=O)Nc3cc(N4CCNC4=O)ccc32)cc1OC 65497373 BTWGUSUJPMCDAY-ZDUSSCGKSA-N 385.395 2.847 0 50 GFAA O=C(CCn1cnnc1)NCC1CCN(Cc2cc3ccccc3s2)CC1 827822371 KEILUXLHAWQDSU-UHFFFAOYSA-N 383.521 2.911 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)Nc2ccccc2CN2CCCC2)cc1 828157808 WTDRMVQXJLNMSZ-UHFFFAOYSA-N 376.464 2.878 0 50 GFAA O=C(c1cnccn1)N1CCC(NCCCc2nc3ccc(Cl)cc3[nH]2)CC1 825573916 YYUYPNQENHRMSJ-UHFFFAOYSA-N 398.898 2.833 0 50 GFAA Cn1c(NC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)nc2cccnc21 274460496 JVFYNWFYCAPDSK-NRFANRHFSA-N 377.448 2.849 0 50 GFAA COc1ccc(Cl)cc1CN(C)c1cc(N2CCC[C@@H](CO)C2)ncn1 301260740 SCRXLUBKYUWGGQ-CQSZACIVSA-N 376.888 2.984 0 50 GFAA O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCN2CCC[C@H]2C1 187542982 UMSAGAQHKHCVJO-PCKAHOCUSA-N 378.904 2.915 0 50 GFAA C[C@H](C(=O)NCCSCCOc1cccc(Br)c1)[C@@H](C)N 192048387 RMKGWJGTDUWMHD-NWDGAFQWSA-N 375.332 2.661 0 50 GFAA CCCC[C@H](N)C(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704340746 SXAKUFKHSDZOAZ-KRWDZBQOSA-N 376.497 2.612 0 50 GFAA COc1cccc(CN2C[C@H]3CN(C(=O)CN)C[C@@]3(CCc3ccccc3)C2)c1 1772806590 BQYONTHBXZJGPV-XUZZJYLKSA-N 393.531 2.547 0 50 GFAA Cc1ccc(NC(=O)c2ccc(Cl)c(N3C(=O)CCS3(=O)=O)c2)cc1 12003474 SXYGRGSIRMAITF-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA O=C(N[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1cccc2nccnc12 12052392 HDJLHNVGFKGIHB-CQSZACIVSA-N 380.835 2.814 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)[C@H]3CCCN3C(=O)C3(C(N)=O)CC3)c2)c1 12200173 NGLNJHWJWSUBPU-LJQANCHMSA-N 391.471 2.857 0 50 GFAA CCOCCOc1ccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1 12404408 DIAOLASPDZFHGJ-UHFFFAOYSA-N 398.459 2.827 0 50 GFAA COc1ccc(OC)c([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccn2)c1 13522074 CSMCSKVSFBICLE-KRWDZBQOSA-N 384.461 2.530 0 50 GFAA CCOC(=O)N1CCC(N2C(=O)CC[C@H]2CCNCc2ccc(F)cc2)CC1 14986525 SMZNZZUZBFLYMW-SFHVURJKSA-N 391.487 2.917 0 50 GFAA O=C(Cc1cccc(F)c1)N1CCC(n2cc(-c3nc(C4CC4)no3)nn2)CC1 169777423 MFJMQFFKWILGBB-UHFFFAOYSA-N 396.426 2.751 0 50 GFAA CCCc1nc(C(=O)N[C@@H]2CCC[C@H](NC(=O)c3ncccc3O)C2)cs1 1857677407 AIQSMVUHRMGLQA-OLZOCXBDSA-N 388.493 2.667 0 50 GFAA CCn1cc(CNC(=O)C[C@H]2CCCN(c3nc4ncccc4o3)C2)c(C)n1 1857733091 UXAYLHJFAUEPST-OAHLLOKOSA-N 382.468 2.671 0 50 GFAA CN(Cc1ccc(C(=O)N(C)C)[nH]1)C[C@H]1CCc2nc(C(F)(F)F)cn2C1 328656022 YZNYIZGQBYLKAN-GFCCVEGCSA-N 383.418 2.626 0 50 GFAA CC(=O)N[C@H]1C[C@@H](Cc2ccccc2)O[C@@H](Cn2c(=O)oc3ccccc32)C1 253495146 ZZNXARABHCRGIW-IPMKNSEASA-N 380.444 2.890 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(=O)n(C)c3)n2C[C@@H]2CCOC2)[C@H]2CCCC[C@H]12 910152602 GITXUZZJYBDXBS-JFRXWTBNSA-N 397.523 2.695 0 50 GFAA Cc1noc2ncc(C(=O)N3CCN(c4ccc(C(=O)O)cc4)C[C@@H]3C)cc12 911317272 JIFYTUCVQZBPNA-LBPRGKRZSA-N 380.404 2.580 0 50 GFAA COc1ccc(Nc2cc(NC[C@@H](CO)c3cccnc3)ncn2)c(OC)c1 952845938 ORTOCTLKNUJRFT-HNNXBMFYSA-N 381.436 2.820 0 50 GFAA COc1ccc(NC(=O)COC(=O)c2cnn(-c3nccs3)c2)cc1Cl 1875259234 JXJUCZWWKFLBOU-UHFFFAOYSA-N 392.824 2.786 0 50 GFAA COC[C@H](NS(=O)(=O)c1cncc(C(F)(F)F)c1)c1ccc(F)cc1 1875317263 SUXFOXHYXSPJPY-AWEZNQCLSA-N 378.347 2.906 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@H]2CCS(=O)(=O)c3ccc(F)cc32)cc1 1875371022 MEPNKWSFNPSZHF-INIZCTEOSA-N 388.420 2.599 0 50 GFAA O=C(NCC12CC(C(=O)O)(C1)[C@H](c1ccccc1)O2)[C@H]1CC2(CCCC2)CO1 1875404686 QRPILPWZDMMPJG-TUJYPLEISA-N 385.460 2.827 0 50 GFAA CC[C@H](c1ccccc1)c1nnc(N2CCO[C@H](C)C2)n1CCCNC(C)=O 1764009232 KHFQCWCLCIZYEJ-VQIMIIECSA-N 385.512 2.571 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC4(CC3)C[C@H](N)CO4)ncnc21 2100545273 MKBJSVGMBUBDOP-INIZCTEOSA-N 386.544 2.912 0 50 GFAA O=C(O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@@H]2CCCn3cnnc32)CC1 2325778009 XEJOTMHESXCMBJ-MSOLQXFVSA-N 382.464 2.653 0 50 GFAA C[C@@H]1CN(C(=O)c2cc3c(cnn3C)nc2C(F)(F)F)CCN(C2CCC2)C1 2325780139 JQJVCXJQHKYWGG-LBPRGKRZSA-N 395.429 2.934 0 50 GFAA Cc1nc2c([nH]1)CN(C(=O)c1cnn(-c3ccc(Br)cc3)c1)CC2 2325857403 AMJXILRUBNLKBG-UHFFFAOYSA-N 386.253 2.865 0 50 GFAA Cc1nccn1Cc1cccc(CN=c2[nH]c3ncnc-3c(C(F)(F)F)[nH]2)c1 2325859757 JLXCGQKPJXAPII-UHFFFAOYSA-N 387.369 2.911 0 50 GFAA COc1ccc(-c2nnc(NC(=O)Cn3cnc4ccccc4c3=O)s2)cc1 136325200 IDKVTIMXGKWWAB-UHFFFAOYSA-N 393.428 2.562 0 50 GFAA CCOc1ccc(NS(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)cc1 674231 XGMBPVWRFOHEDW-UHFFFAOYSA-N 392.433 2.689 0 50 GFAA COc1ccccc1CNC(=O)[C@H]1CC[C@@H](OC)[C@H](Nc2cc(C)ncn2)C1 2356144205 MYJVFAZJMCOXSG-KVSKMBFKSA-N 384.480 2.706 0 50 GFAA COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC3(CC2)OCCc2cc(OC)ccc23)C1 2356153805 VNGJKNDRZPQDFO-DLBZAZTESA-N 387.476 2.675 0 50 GFAA COc1cccc(N2C(=O)N(c3ccccc3Cl)[C@H]3CS(=O)(=O)C[C@H]32)c1 4172209 QDGMBDNHDQYNFO-SJORKVTESA-N 392.864 2.961 0 50 GFAA Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)/C=C/c3ccco3)cc2)n1 4877431 FJKNONBWOSUGIC-RMKNXTFCSA-N 384.417 2.831 0 50 GFAA COc1cccc(OCC(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)c1 111155225 DDKVJOVVXCFGCQ-UHFFFAOYSA-N 387.480 2.707 0 50 GFAA CCC[C@@H](C)c1cc(NS(=O)(=O)c2ccc(OC)cc2CC(=O)OC)n[nH]1 414375765 SFVAJZNHWMWNES-GFCCVEGCSA-N 395.481 2.838 0 50 GFAA CCc1ccc([C@H]2CC(=O)Nc3c2c(C)nn3-c2ccc3nnc(C)n3n2)cc1 21726253 YWAJWIPYZMPFOD-MRXNPFEDSA-N 387.447 2.963 0 50 GFAA Cn1c(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc2c(=O)n3ccccc3nc21 464460450 KXIHFMZZEKNLKU-CYBMUJFWSA-N 398.422 2.907 0 50 GFAA CCN(CCn1cccn1)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 20599597 CJIONUNCNVBBHW-UHFFFAOYSA-N 393.557 2.586 0 50 GFAA CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(CN2CCCC[C@H]2C)cc1 249687251 RHCOJJPJUSANIK-PBHICJAKSA-N 378.542 2.790 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C[C@@]2(c3ccc(F)cc3)CCOC2)CC1 23251329 ZIZVLJMOYHHLFK-QHCPKHFHSA-N 397.494 2.907 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCc3ccc(F)cc3)C2=O)c1 67966267 XJPINULSODBSLO-OAQYLSRUSA-N 390.430 2.617 0 50 GFAA Cn1c(-c2cc3n(n2)CCCN(C(=O)c2ncccc2O)C3)nc2ccccc21 65506372 PCNRQDKQIGIBPD-UHFFFAOYSA-N 388.431 2.584 0 50 GFAA O=C1Cc2cc(S(=O)(=O)Nc3ccc(Cl)cc3-n3cccn3)ccc2N1 252487080 HSCXDBGWLOTXOK-UHFFFAOYSA-N 388.836 2.821 0 50 GFAA O=C1CC[C@H](NCc2ccc(-n3cncn3)cc2)CCN1Cc1ccccc1 67695279 JEJCMUSCDNZOGO-FQEVSTJZSA-N 375.476 2.938 0 50 GFAA CN(CCC(N)=O)C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 477842117 BDNAPCCOTUGGRF-UHFFFAOYSA-N 391.475 2.615 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)Cn3nc(C)c(C)c3C)CC2)OC1=O 77439757 FUNGRVVLAYFHSB-CQSZACIVSA-N 376.501 2.810 0 50 GFAA O=C(C[C@H]1CCCN1C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1 124153813 RYYPHLUEWXDKJY-MRXNPFEDSA-N 376.412 2.547 0 50 GFAA CCN(C)C(=O)c1cn2cc(-c3ccc(OC)cc3F)n(CC3CC3)c(=O)c2n1 72432409 NJRBLWFJHDDIKH-UHFFFAOYSA-N 398.438 2.813 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCC([C@@H](O)Cc2ccccc2)CC1 77299777 YIPMIBOLOJJIBO-NRFANRHFSA-N 376.460 2.723 0 50 GFAA C[C@H](C1CCN(c2nc(C(C)(C)C)nc3c2cnn3C)CC1)N1CCOCC1 72131793 GRQSQPKRHAGYHJ-OAHLLOKOSA-N 386.544 2.598 0 50 GFAA CCN1C[C@H](CCN2CCOCC2)[C@](c2ccccc2)(c2cccnc2)C1=O 71769364 DHPMSMRUUUKJSL-GMAHTHKFSA-N 379.504 2.568 0 50 GFAA Cn1ncc(N2CCO[C@H](CCNc3ccc4cccc(Cl)c4n3)C2)cc1=O 77303004 QMIDSYAIOBLMOJ-MRXNPFEDSA-N 399.882 2.689 0 50 GFAA Cc1ccccc1OCC(=O)N1CCOC[C@H]1CC(=O)Nc1ccccc1F 72468104 PZOQXNMSDWROPT-MRXNPFEDSA-N 386.423 2.769 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)C1 290747346 OOWNFWWVLNYCHL-UXHICEINSA-N 386.540 2.599 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)c2cnoc2-c2ccccc2)cc1 426571614 OCPMTHXYEJDLHD-UHFFFAOYSA-N 399.472 2.748 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)n1 426465447 LJUGPZAJCXOXPV-GFCCVEGCSA-N 382.390 2.659 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(O)(c2ccccn2)CC1 426518964 LQLXQELOHYIGJC-HXUWFJFHSA-N 394.519 2.739 0 50 GFAA COC(=O)N1CCCc2cc(NC(=O)NCCSc3nccn3C)ccc21 95522245 TYWRBCGVXLWAIQ-UHFFFAOYSA-N 389.481 2.853 0 50 GFAA COc1cccc([C@]2(C)CCN(CCCn3c(=O)[nH]c4ccccc4c3=O)C2)c1 96027709 DVOUFMDBMYOISV-HSZRJFAPSA-N 393.487 2.752 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3nc4ccccc4n3CC)C2)CC1 22853458 VAAFKTPINUFENW-SFHVURJKSA-N 399.539 2.795 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCC[C@@]3(CCC(=O)N(CCC(C)C)C3)C2)CC1 95508256 ZPJVIDMBFMTLJR-QFIPXVFZSA-N 391.556 2.522 0 50 GFAA C[C@H]1OCCN(C(=O)Nc2cccc(-n3ccnn3)c2)[C@@H]1c1nc(C2CC2)no1 297320552 CHBJTCCEDUNIHA-WBMJQRKESA-N 395.423 2.522 0 50 GFAA COCCN1Cc2cc(C(=O)NC[C@H](C)c3ccccc3)ccc2OCC1=O 263615674 DOXUBVYBSMLKDF-INIZCTEOSA-N 382.460 2.588 0 50 GFAA COc1ccc(CN(C[C@@H]2CCCO2)C(=O)CCN2CCCCCC2=O)cc1 824668745 LGOKLHZGUSVEFK-FQEVSTJZSA-N 388.508 2.996 0 50 GFAA CCc1cc(CN2CCC(CNC(=O)Cn3cc4ccccc4n3)CC2)on1 823565497 GOUQDDQATTWRGB-UHFFFAOYSA-N 381.480 2.615 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)NCCNC(=O)c1ccccc1Cl 952969140 BJVBBULSPFKSBU-LJQANCHMSA-N 385.895 2.633 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)NC[C@H](O)CN1CCCCCC1 952975790 XHUACJPLBVQNPO-HNNXBMFYSA-N 381.904 2.655 0 50 GFAA COc1cccc(N2CCC(N(Cc3ccncc3)C[C@@H]3CCC(=O)N3)CC2)c1 952873220 XGZGXRORBNVTEW-IBGZPJMESA-N 394.519 2.840 0 50 GFAA O=C1C[C@]2(CCN(C(=O)c3ccc(-c4ccc5c(c4)OCCO5)s3)C2)CN1 278985112 QHABYBUQQZRAAY-HXUWFJFHSA-N 384.457 2.539 0 50 GFAA CN(CCNS(C)(=O)=O)C(=O)c1cc2c(s1)-c1ccccc1C(C)(C)C2 170626459 RRUUONPFQBAAPR-UHFFFAOYSA-N 392.546 2.870 0 50 GFAA Cc1ccc(-n2nnc(C(=O)N3CCOC[C@@H]3c3nc(C)cs3)c2C)cc1 188583034 UONYWGBQIJEEDQ-MRXNPFEDSA-N 383.477 2.863 0 50 GFAA C[C@@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)CCS(=O)(=O)C1 191873470 IVMKGLBQJATFQK-LLVKDONJSA-N 384.910 2.970 0 50 GFAA Cc1csc2c(N3CCCN(S(=O)(=O)c4ccccc4)CC3)ncnc12 192525194 SVYFKYOPLDEEOM-UHFFFAOYSA-N 388.518 2.901 0 50 GFAA O=C(N[C@H]1CCCOCC1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 192970836 OOXSBZHQCNDKGW-LBPRGKRZSA-N 397.353 2.888 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)n1 1506399219 BZQUELHAAFHHRR-HNNXBMFYSA-N 391.541 2.941 0 50 GFAA Cc1ncsc1C(=O)N1CCCN(Cc2cnc(-c3ccccn3)nc2)CC1 1529167066 FFRULXLQOXJGEF-UHFFFAOYSA-N 394.504 2.652 0 50 GFAA O=C(Nc1ccc(-c2cccc(F)c2F)cn1)c1cn(C[C@@H]2CCCNC2)nn1 1529192168 PXYGNOZUZJWPLN-CYBMUJFWSA-N 398.417 2.870 0 50 GFAA COc1cccc(C(=O)N2CCC[C@]3(CO)CCN(Cc4ccoc4)C[C@@H]23)c1 1704324661 CGHRBGJRMWIHLU-IFMALSPDSA-N 384.476 2.777 0 50 GFAA C[C@H](C(=O)N1CCN(C)C2(CCOCC2)C1)N1C(=O)c2cccc3cccc1c23 1775980139 SMCJFSCCKMZWNS-MRXNPFEDSA-N 393.487 2.512 0 50 GFAA COc1cc(CNC(=O)c2cn(Cc3cccc(Cl)c3)nn2)cc(OC)c1 12439038 NNHXAKDVIMFSGE-UHFFFAOYSA-N 386.839 2.927 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12836606 QJXZZCDSDAOTFK-SFHVURJKSA-N 387.499 2.555 0 50 GFAA COc1cc(OC)c(CN2CCN(c3ncccn3)CC2)cc1Br 19536089 RHKGKPVWERWNCF-UHFFFAOYSA-N 393.285 2.579 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCC3CCOCC3)sc12 1857681914 DRESGHWOJKZJMZ-UHFFFAOYSA-N 378.538 2.788 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4cc(F)ccc4-n4cccn4)[C@@H]2CC(=O)N13 1857736185 ZBZVRIKEDJTJKY-ZVDOUQERSA-N 384.455 2.569 0 50 GFAA CCSCCCNC(=O)CCc1nc(C2(NC(C)=O)CCCCCC2)no1 225708779 HKQNSDVDVFVEMN-UHFFFAOYSA-N 396.557 2.947 0 50 GFAA CC(C)c1ccc(-n2cnnc2SCC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)cc1 249628239 UNRBRRQYWANZOD-OVWALXMSSA-N 398.532 2.711 0 50 GFAA O=C(Nc1ccc(F)cc1)NC1CCN(Cc2nnc3n2CCCCC3)CC1 264215729 NUUWFFIVMADLHW-UHFFFAOYSA-N 386.475 2.930 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@@H]21 910239211 FMOPREHMNBKVJJ-LVQVYYBASA-N 385.382 2.711 0 50 GFAA Brc1cnn([C@@H]2CCCC[C@@H]2NCc2n[nH]c3c2COCC3)c1 1875281832 ZOJVDJPFATZSMY-GOEBONIOSA-N 380.290 2.715 0 50 GFAA COC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC(c2ncnc3ccccc23)C1 1875313446 QRJHMOGYVDICSI-IBGZPJMESA-N 390.443 2.523 0 50 GFAA COc1cc(C)cnc1C(=O)N[C@@H]1CC[C@@H](CNC(=O)c2coc(C3CC3)n2)C1 1875333626 FAGURRYVMPXENA-UKRRQHHQSA-N 398.463 2.593 0 50 GFAA Cc1cc(NC(=O)c2c[nH]cc2-c2cnn(C)c2)ccc1N1CCN(C)CC1 2325744580 MYOCTKOFAJPOPB-UHFFFAOYSA-N 378.480 2.728 0 50 GFAA COc1cc(CCNC(=O)N=c2cc(Br)n(C)[nH]2)ccc1Cl 2325751060 KWGUZWTXXRYYSZ-UHFFFAOYSA-N 387.665 2.631 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N[C@@H]3C[C@H](Cn4ccnc4)C[C@H]3O)nc2)c1 2325786178 MQPNJJSHGXZIHN-ZLGUVYLKSA-N 392.459 2.948 0 50 GFAA CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3ccccc3c(=O)n1C)C2 2325802899 CZZKZJYRTIYPHU-UHFFFAOYSA-N 375.472 2.799 0 50 GFAA COc1ccccc1C(=O)C[C@@]1(O)C(=O)Nc2ccc(Br)cc21 684550 JXIUVXZVYBQZAB-KRWDZBQOSA-N 376.206 2.870 0 50 GFAA COc1ccc(N2C(=O)N(c3cccc(Cl)c3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 1153079 PONLFMUXXVZTLB-DLBZAZTESA-N 392.864 2.961 0 50 GFAA COc1ccc(C)cc1N(CC(=O)NC1CC1)S(=O)(=O)c1ccc(C)cc1 1174652 BGJGYPXTPOMKKB-UHFFFAOYSA-N 388.489 2.786 0 50 GFAA COC(=O)C1=C(C)N(C(C)C)C(=O)[C@@]1(NC(=O)C1CCCCC1)C(F)(F)F 2871970 IEUWPCFLIBYUFF-QGZVFWFLSA-N 390.402 2.682 0 50 GFAA Cc1nc([C@H](C)NC(=O)c2coc(COc3cccc4cnccc34)n2)n[nH]1 67804182 HEYXPEAJWHXEBF-NSHDSACASA-N 378.392 2.719 0 50 GFAA O[C@@H]1CN(Cc2cccn2-c2ccccn2)CC[C@H]1c1ccc2c(c1)OCO2 65371412 JEKXOJJKFNYWED-RBUKOAKNSA-N 377.444 2.951 0 50 GFAA COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)N[C@H]2CCNC2)c1 127021611 KSLJLCSAUKQCRM-HNNXBMFYSA-N 392.459 2.648 0 50 GFAA COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2cc3c(O)ncnc3cn2)c1 364479324 YZNRREKDXYVTOX-KRWDZBQOSA-N 380.404 2.725 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)N2CCO[C@@H](c3ccccc3)C2)cn1 127699066 OKJITHRWOTXDMV-LJQANCHMSA-N 377.448 2.859 0 50 GFAA CCSC[C@H](N)C(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 72411999 DSBPPTMLUNJWMD-AWEZNQCLSA-N 376.444 2.596 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CC(N4CCCC[C@H]4C)C3)cc2n1 216385129 QJQZAXOGHWJKNU-GFCCVEGCSA-N 381.402 2.755 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)CN2CCC[C@H]2Cc2ccc(OC)cc2)C1 241774211 RNXYBNNVFFFFMD-MOPGFXCFSA-N 388.508 2.504 0 50 GFAA O=C(NCC(=O)N1CCC(c2nc3cc(F)ccc3s2)CC1)c1cccnc1 242389228 ZVIMMOXKRLJDCS-UHFFFAOYSA-N 398.463 2.966 0 50 GFAA C[C@H]1CCC[C@@H](C)CN1C(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12 176614632 IRUQYTGFTPWFHL-OLZOCXBDSA-N 381.436 2.739 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N(C)C[C@H]2Cc3ccccc3CN2C)c1C 222540162 JVOCSFWVWIINOS-HXUWFJFHSA-N 382.508 2.608 0 50 GFAA CCNC(=O)c1ccc(N2CCC(Oc3ccccc3C)(C(=O)O)CC2)nc1 82098059 GHPPRCMQWOVRNC-UHFFFAOYSA-N 383.448 2.642 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)c2ccsc2)CN1Cc1sccc1C 96149863 VTKNPUOLLUNSJD-GJZGRUSLSA-N 377.535 2.627 0 50 GFAA O=C(c1cc(-c2ccsc2)n[nH]1)N1C[C@@H]2c3ccccc3OC[C@]2(CO)C1 95512662 RTUMYAUCQULQNE-FOIQADDNSA-N 381.457 2.749 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@H]2CCNC2)c1 95521662 MUMODIBIDJGFBJ-INIZCTEOSA-N 387.524 2.573 0 50 GFAA CN1C(=O)C[C@H](C(=O)NCc2ccc(C(=O)O)cc2)[C@H]1c1cccc(Cl)c1 237062650 NKZJLTSTHRJWTI-FUHWJXTLSA-N 386.835 2.874 0 50 GFAA CC[C@@H](OC)C(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 91636656 VTTRJBZJXGPGFW-QGZVFWFLSA-N 380.435 2.731 0 50 GFAA Cc1cccc(CN2CCN(CC(=O)Nc3ccc4nsnc4c3)CC2)c1 22752118 KRLLLNPUEJVZGX-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA CCn1ncc(C(=O)N2CCC(c3nccn3Cc3cscn3)CC2)c1C 95499079 LSBOIEYTNNWTJC-UHFFFAOYSA-N 384.509 2.933 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC[C@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n1 95504183 USLUYWQXDJMJAA-CQSZACIVSA-N 390.434 2.945 0 50 GFAA Cc1cccc(C)c1OC1CN(C(=O)c2cnc(-c3ccccc3)[nH]c2=O)C1 92037447 FEEMYHHQXVCXLQ-UHFFFAOYSA-N 375.428 2.957 0 50 GFAA CN(Cc1nnc[nH]1)C(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1 298543174 YTWRFMVHXKQHSX-GFCCVEGCSA-N 383.283 2.922 0 50 GFAA C[C@H](C(=O)NCCCc1csc(N)n1)N1C(=O)c2cccc3cccc1c23 827654529 PITXHXXGCGJNPM-GFCCVEGCSA-N 380.473 2.976 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3ccccc3-n3cncn3)C[C@@H]2N(C)C)cc1 1565511461 AYAWGHBERMFPHV-CTNGQTDRSA-N 375.476 2.746 0 50 GFAA Cc1cc(-c2ccc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cc2)nc(N(C)C)n1 1565515125 KOFYUGHJCFMSQI-MOPGFXCFSA-N 379.508 2.827 0 50 GFAA CCc1c(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cnn1Cc1ccccc1 193547686 UZXBNCYJBSHXHL-GOSISDBHSA-N 390.491 2.683 0 50 GFAA O=C1C[C@H](C(=O)N2C[C@@H](O)C[C@H]2c2ccc(F)cc2)CN1c1ccc(F)cc1 770185807 FHZTYZYUJCROEE-JVPBZIDWSA-N 386.398 2.652 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(C(=O)c2cccc(-n3cnnc3)n2)C1 1506408491 YMGNTKXNSSCOJE-KRWDZBQOSA-N 377.448 2.902 0 50 GFAA CN(Cc1cccc2cnccc12)C(=O)[C@@H]1CC(=O)N(c2cccc(O)c2)C1 1506399478 GMTMNFIMIQWPFP-QGZVFWFLSA-N 375.428 2.952 0 50 GFAA O=C([C@@H]1CCOC1)N1CCCN(CC2=Cc3cc(Cl)ccc3OC2)CC1 1529119348 UZNKOVJNLGNIFI-MRXNPFEDSA-N 376.884 2.687 0 50 GFAA CCNC(=O)c1ccc(N2CCC3(CC2)OCCc2cccc(OC)c23)nc1 1704325150 JRECJNNXHKWMOP-UHFFFAOYSA-N 381.476 2.908 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H]2CCCCO2)ccc1F 1704313385 PCEAXFPSAMFYPF-ZDUSSCGKSA-N 377.416 2.854 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N1CCC[C@]2(CCc3c[nH]nc32)C1 1775984075 HDTUJUSHTCLIDJ-FQEVSTJZSA-N 387.867 2.883 0 50 GFAA O=C(CSc1nc2c(c(=O)[nH]1)CCC2)Nc1ccc(Br)cc1 5054695 QEAFCEUWKHDRNH-UHFFFAOYSA-N 380.267 2.752 0 50 GFAA Cc1ccc(CNC(=O)CC[C@@H]2CCCN(S(=O)(=O)CC(F)(F)F)C2)o1 11816386 QYLMYTFXUHKVHO-ZDUSSCGKSA-N 396.431 2.589 0 50 GFAA Cc1c(CC(=O)NCCn2cccn2)c2c(n1Cc1ccccc1)CCCC2=O 12207400 ZPRSWUGBRFXGEJ-UHFFFAOYSA-N 390.487 2.919 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(Cc3ccco3)CC2)C1 12449390 UAMKDVQJDVRKDC-GOSISDBHSA-N 382.508 2.667 0 50 GFAA CCN1CCC(N2CC(=O)N(Cc3ccccc3)C[C@H](OCC3CC3)C2)CC1 14536783 KEQNJQMHFXYEGN-JOCHJYFZSA-N 385.552 2.610 0 50 GFAA COc1cccc(C[C@]2(CCC(=O)N[C@@H](C)Cc3cccnc3)CCC(=O)N2)c1 14885861 HPAUDVKXUTZQFE-SBUREZEXSA-N 395.503 2.809 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3nonc3C)no2)c(Cl)c1 15069426 DBYDNGGZDJTUHO-UHFFFAOYSA-N 392.799 2.879 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)N(C)Cc2nc(C)c[nH]2)[C@H](c2ccccc2C)N1C 15078730 FVSNUSJORHERCD-JLMWRMLUSA-N 398.507 2.610 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2cc(COC)n[nH]2)CC[C@@H]1NC1CCCC1 1857693236 NVBXHQGNHLDKNK-YSSFQJQWSA-N 392.544 2.668 0 50 GFAA O=C(CN1CCN(Cc2nnc(-c3ccccc3)s2)CC1)NC1CCCCC1 155547156 YVEKYIOERMUOCM-UHFFFAOYSA-N 399.564 2.772 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H]1COCCN1C(=O)C(=O)C(C)(C)C 952887468 PPTJWXBQHJEHBQ-GFCCVEGCSA-N 375.391 2.577 0 50 GFAA O=c1nc(NS(=O)(=O)c2sccc2C2CC2)ccn1CC(F)(F)F 1875279959 MOHVQECXSAAGMJ-UHFFFAOYSA-N 379.385 2.545 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](C)c3ccc(F)cc3)C2)c1C 1875396833 FFCPYOJOGFDYIJ-MAUKXSAKSA-N 385.487 2.864 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2cc(Br)c3cn[nH]c3c2)C1 1875380732 XWMJSCFORBFVCY-SNVBAGLBSA-N 377.242 2.689 0 50 GFAA Cn1nc(CNC(=O)c2ccc(N3CCC4(CC(F)C4)C3)nc2)cc1C1CC1 1875361162 SKMLSSBSENQVCC-UHFFFAOYSA-N 383.471 2.951 0 50 GFAA CCc1nc([C@H]2CN(C(=O)C3(c4ccccc4C)CCC3)Cc3c[nH]nc32)n[nH]1 1875393758 RROLSFFMFQKTLU-INIZCTEOSA-N 390.491 2.995 0 50 GFAA Cc1cccc(N2CC[C@H](N(C)S(=O)(=O)c3cccc4cnccc34)C2=O)c1 1775997684 PEFNNWDPKDDINR-IBGZPJMESA-N 395.484 2.969 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccccc2F)nc1 2325785677 INRFCAHETDZUIS-ZTFGCOKTSA-N 396.422 2.779 0 50 GFAA CO[C@H]1C[C@@H](CCO)N(C(=O)c2cccc(OCc3cn4ccccc4n3)c2)C1 2325816667 RQWIVQALLWNWEG-QUCCMNQESA-N 395.459 2.525 0 50 GFAA O=C(C(=O)N1CCC12C1CC3CC(C1)CC2C3)N1CCN(c2ccccc2)CC1 2325828603 MGVPUVUAYNSUQM-UHFFFAOYSA-N 393.531 2.762 0 50 GFAA CNc1cccc(C(=O)NC/C=C/CNC(=O)c2cc3c(s2)CCCC3)n1 2325850806 IIIYWCGAXPTRAM-SNAWJCMRSA-N 384.505 2.780 0 50 GFAA Cc1cc(N2CCN(CCc3cccs3)CC2)nc(=O)n1-c1ccccc1 2325858861 DESGDPPLSVKOFW-UHFFFAOYSA-N 380.517 2.967 0 50 GFAA O=C(O)c1cccc(NCN2C(=O)c3ccc(Br)cc3C2=O)c1 639224 AATDDQRHRXCYGD-UHFFFAOYSA-N 375.178 2.813 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1OC 1219720 WUCHPCGUYBDFMG-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA Cn1nnnc1SCC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 2383584 AJLYYGPRIJWVLY-UHFFFAOYSA-N 385.293 2.979 0 50 GFAA Cc1nnc2n1[C@@H](CC(C)C)CN(C(=O)c1ccccc1N1CCOCC1)C2 2356142953 ONGQKWFCZUAFCN-KRWDZBQOSA-N 383.496 2.666 0 50 GFAA O=c1c(CN2CCN(Cc3ccsc3)[C@@H](CCO)C2)coc2ccccc12 20537978 CLEZOBVMMJEJDM-SFHVURJKSA-N 384.501 2.923 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)Nc2ccc(N(C)C(C)=O)nc2)CC1 417649672 LUPORFAQYOOCEF-UHFFFAOYSA-N 397.479 2.817 0 50 GFAA Cc1c(C(=O)N2CCO[C@@H](CN)C2)c(-c2ccccc2)nn1-c1ccccc1 20209610 PVUZUGGKHQCDNH-IBGZPJMESA-N 376.460 2.647 0 50 GFAA Cc1ccc(-c2noc(COC(=O)[C@H](C)N3C(=O)[C@@H]4CCCC[C@H]4C3=O)n2)cc1 248066187 FXNBATNSPSMXCB-NUEKZKHPSA-N 397.431 2.652 0 50 GFAA CC1CCN(C2=NC(=O)[C@H](CC(=O)Nc3cc(Cl)ccc3Cl)N2)CC1 20466888 DKUCAQBYVGZREZ-AWEZNQCLSA-N 383.279 2.908 0 50 GFAA O=C(CCC(=O)N1CCc2[nH]c3ccc(F)cc3c2C1)NCc1cccnc1 20744814 PUMCDOFFLHKLTL-UHFFFAOYSA-N 380.423 2.683 0 50 GFAA CN1CCN(C(=O)COc2c(Cl)cc(Cl)cc2Br)CC1 20220099 JOVUWVDGYSGLON-UHFFFAOYSA-N 382.085 2.909 0 50 GFAA O=C1C[C@@H](c2cc3ccccc3[nH]c2=O)c2sc(N3CCCC3)nc2CN1 67909697 NLVQLZCRHPPQQB-ZDUSSCGKSA-N 380.473 2.737 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3ccncc3)C2)cc1OC 12299187 UKORIUVCNZIVHH-IBGZPJMESA-N 383.492 2.878 0 50 GFAA O=C(CCC1CCN(Cc2ccc3nsnc3c2)CC1)NC[C@H]1CCCO1 20363408 BVSKVKWBPZOLDV-QGZVFWFLSA-N 388.537 2.979 0 50 GFAA CC1=C(C(=O)NCc2cnc3c(c2)CCC3)[C@H](c2cccc(C)c2)NC(=O)N1 67867773 RBZAHQBGIWNGED-FQEVSTJZSA-N 376.460 2.823 0 50 GFAA Cn1c(=O)[nH]c2cc(C(=O)N3CCN(c4ccc(F)cc4Cl)CC3)ccc21 120717225 ZEVAIMYLOSIXQK-UHFFFAOYSA-N 388.830 2.622 0 50 GFAA C[C@@H](Cn1cncn1)C(=O)N1CCC(c2[nH]ncc2-c2cccc(F)c2)CC1 67872826 LLCZVQXXRFRRFR-AWEZNQCLSA-N 382.443 2.850 0 50 GFAA CCOC(=O)N[C@H](C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)C(C)C 252523291 CGRIRXFRWAPVDJ-LQWHRVPQSA-N 394.487 2.786 0 50 GFAA COc1nc2c(cc1CNC(=O)c1scnc1C)C(=O)N(C1CCCC1)C2 71754338 ZJDVUSIEYXWVSY-UHFFFAOYSA-N 386.477 2.684 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)CCc2ccc(C)cc2)CN1Cc1ccccc1O 12161427 LSPQWSVDTBVKNT-PMACEKPBSA-N 396.487 2.566 0 50 GFAA CC[C@H](CNC(=O)N1CCn2cnnc2C1)Cc1cccc(Br)c1 153821979 CQSNNKQHGIEPPZ-ZDUSSCGKSA-N 392.301 2.835 0 50 GFAA Cn1cc(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)c(C(C)(C)C)n1 127537249 SAAXZNODVLUOKA-FQEVSTJZSA-N 398.551 2.893 0 50 GFAA O[C@H](CNC1CCCCC1)COc1ccc(I)cc1 238120801 CFYLTJQNEATIPR-CQSZACIVSA-N 375.250 2.953 0 50 GFAA C[C@H](CN(C(=O)c1ccc(S(=O)(=O)c2ccccc2)s1)C1CC1)C(=O)O 262209098 PLUITPWJYAJQGL-GFCCVEGCSA-N 393.486 2.906 0 50 GFAA CCc1nc2cc(CNC(=O)N3CCC[C@H]4C(=O)N(C)C[C@H]43)ccc2n1C1CC1 375680243 ZYTSWECHCLIXBY-VQIMIIECSA-N 395.507 2.696 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2cc(=O)n(-c3ccccc3)[nH]2)[C@H](C)C1 77425258 GBXKBTLRVZVTSA-QGZVFWFLSA-N 376.460 2.825 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCCN(c2ncccn2)CC1 82146617 TWFXNJRXVOAIIP-UHFFFAOYSA-N 379.489 2.876 0 50 GFAA CNc1cc(C(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)ccn1 95520210 QPLHGKRZCPFQSQ-UHFFFAOYSA-N 376.464 2.783 0 50 GFAA Nc1ccsc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91664690 JYCQPWLFVJLQSJ-UHFFFAOYSA-N 398.532 2.813 0 50 GFAA CCNC(=O)c1ccnc(N2CC[C@]3(CCCN(C4CCCCC4)C3=O)C2)c1 95371569 XBTCHGSJLJQLHP-JOCHJYFZSA-N 384.524 2.983 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nccn3Cc3cscn3)CC2)nc(C)n1 95502518 GPJUKXNRKUSSJH-UHFFFAOYSA-N 382.493 2.815 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)CN1C[C@H](c2ccccc2)CC1=O)C1CC1 95517839 GHUALEMPOHTPBF-GOSISDBHSA-N 380.492 2.544 0 50 GFAA Cn1c(CO)nnc1[C@H]1C[C@@H](NC(=O)c2ccc(-c3ccccc3Cl)o2)C1 244742188 ODHWWUPISIRSDO-TXEJJXNPSA-N 386.839 2.897 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@@H]3CC[C@@H]1[C@H]32 248042628 OQPJCJPJPNWQBN-CITUDLJWSA-N 379.504 2.873 0 50 GFAA CCCCN1CCn2nc(CNC(=O)CCN3CCCCCCC3)cc2C1 299793375 ISPBPDBTMLSDSB-UHFFFAOYSA-N 375.561 2.771 0 50 GFAA CCN1CCN(C(=O)Nc2cc(C(=O)N(CC)CC)ccc2Cl)CC1=O 299795892 MZJOPMSKCBDCRE-UHFFFAOYSA-N 380.876 2.518 0 50 GFAA CCCOc1ccccc1CCNC(=O)N1CCC(N2CCOCC2)CC1 584892135 VIOYCLDXARCCOA-UHFFFAOYSA-N 375.513 2.524 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2c(C)nn(C)c2C)cc1 1565511661 NKKCQLOGNQJEHT-MOPGFXCFSA-N 382.508 2.782 0 50 GFAA COc1ccc([C@@H](CC(=O)O)NC(=O)[C@@H]2CCOc3ccccc32)cc1OC 268936043 HSVYPFNDLSKBNE-HZPDHXFCSA-N 385.416 2.902 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)CC3CC(C)(C)NC(C)(C)C3)CC2=O)cc1 952979064 QTAHHWCGDIDYRQ-MRXNPFEDSA-N 387.524 2.864 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)[C@H]1CCCN(Cc2ccco2)C1 952975300 XHJWMJIMOQJLAY-FQEVSTJZSA-N 395.503 2.930 0 50 GFAA O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@@H](c2noc(C3CC3)n2)C1 270089793 TVAZNFWBZMCSRI-CVEARBPZSA-N 382.468 2.510 0 50 GFAA O=C(CN1CCN(c2ncccn2)CC1)N1CCCC[C@@H]1CCc1cccs1 952990679 SCTYZZIXPBCQAU-GOSISDBHSA-N 399.564 2.674 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OC4CCCC4)c(F)c3)C(=O)[C@H]2C1 278264721 YCARLYMICNIYPI-BLLLJJGKSA-N 390.411 2.867 0 50 GFAA O=C(NCc1ccccc1N1CCCCC1)[C@@H]1CC12CCS(=O)(=O)CC2 187220672 YCFXQNCLHCZRFF-KRWDZBQOSA-N 376.522 2.508 0 50 GFAA Cc1cccn2c(CNCCOc3cccnc3)c(C(=O)N3CCCCC3)nc12 11663156 LMRPDRCXIJMGAX-UHFFFAOYSA-N 393.491 2.832 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)c2cn(CCCc3ccccc3)nn2)C1 11753490 CIGUJPWCRQTKCP-LJQANCHMSA-N 397.523 2.632 0 50 GFAA COC(=O)CCNC(=O)Cc1c2c(n(CC(C)C)c1C)CC(C)(C)CC2=O 12055998 SZJZRFZRVRELIA-UHFFFAOYSA-N 376.497 2.829 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]1(O)CNC1Cc2ccccc2C1 14977887 KBKQNAHDAHDOLN-QFIPXVFZSA-N 386.442 2.575 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NC(=O)C3=NN(C)C(=O)CC3)C2)cc1 15064085 LBDNNEGSTWBOTA-IBGZPJMESA-N 384.524 2.574 0 50 GFAA CCNC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3c(C)noc3C)n2)C1 19782057 YXPVLIGWPMACMJ-UHFFFAOYSA-N 382.424 2.799 0 50 GFAA COc1ccccc1CN1C(=O)N[C@H](CC(=O)Nc2cccc3[nH]ccc23)C1=O 206237063 YTGCNWLGBRMVEX-QGZVFWFLSA-N 392.415 2.626 0 50 GFAA Cc1ccc(CNC(=O)N2CCC[C@@]3(CCc4c(O)nc(N(C)C)nc43)C2)cc1 1857708825 PHYUFNIAHMLKED-JOCHJYFZSA-N 395.507 2.746 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c(C)c1 1857728286 VOPMEVBPTUUSAI-MZKRTTBSSA-N 392.455 2.918 0 50 GFAA Cc1cc(C[C@@H]2CN(c3nc(-c4ccccc4)ccc3C(=O)O)C[C@H]2O)n[nH]1 1857735423 DJIOORFVKOAYHA-DNVCBOLYSA-N 378.432 2.518 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCc3nc(C)nn3C2)nc(-c2ccc(Cl)cc2)n1 122445713 KEZJFIKOGQAAER-OAHLLOKOSA-N 382.855 2.750 0 50 GFAA Cc1cccc(C(=O)N2CCC(n3cc(C(=O)NC4CCCC4)nn3)CC2)c1 11816206 RLKUTNCELQBUGM-UHFFFAOYSA-N 381.480 2.736 0 50 GFAA Cc1ccc(-n2nc(C(=O)N3CCC(C(N)=O)CC3)nc2-c2ccccc2)cc1 13568883 JVBKSLMPNYQOOO-UHFFFAOYSA-N 389.459 2.580 0 50 GFAA O=C(O)[C@H](CNC(=O)[C@@H]1CCc2nc[nH]c2C1)Cc1cccc2ccccc12 909269397 ZSUKNEMCKNFVCW-SJORKVTESA-N 377.444 2.728 0 50 GFAA CCc1ccc([C@H]2CCCCCN2C(=O)Cn2c(=O)c(=O)[nH]c3ccccc32)o1 1875259889 KAHVXZGAOIGRMO-GOSISDBHSA-N 395.459 2.989 0 50 GFAA Cc1ncc(C(F)(F)F)cc1C(=O)N=[S@]1(=O)CCC[C@@]2(CCCN2)C1 1875393383 MAEFTDUCWAJMET-MQNRADLISA-N 375.416 2.933 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)cc1 1875314850 WIRORZZRYVERAO-KGLIPLIRSA-N 379.464 2.866 0 50 GFAA Cn1cncc1[C@@H]1CN(Cc2cccc(Cl)c2F)C[C@H]1CNC(=O)C1CC1 1775962755 COGKCRWXFSTYIQ-HZPDHXFCSA-N 390.890 2.954 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1Br 4451109 XGEGNHGCIINXJS-CYBMUJFWSA-N 382.254 2.906 0 50 GFAA COc1ccc2[nH]cc(CCN[C@H]3CC(=O)N(c4ccccc4F)C3=O)c2c1 4744811 CXNNSPURFODXSU-SFHVURJKSA-N 381.407 2.780 0 50 GFAA NC(=O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCCCC2)C2(CC2)C1 2325790182 WMUWYFSLLVLRMN-INIZCTEOSA-N 398.507 2.965 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCN(C)C3(CCOCC3)C2)cc1 2356141901 VHXLBBDXMIAYIO-UHFFFAOYSA-N 381.476 2.694 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@@]12CCCN2Cc1cccc2ccnn12 2356167068 HJJOYAPCXLFCTO-XJABCFGWSA-N 382.508 2.595 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3ccccn3)n2CC)s1 6728833 OQYFOONMIGXOTL-UHFFFAOYSA-N 375.483 2.505 0 50 GFAA COC(=O)c1cccc(NC(=O)CN2CC[C@H](n3c(C)nc4c3CCCC4)C2)c1 225430778 RMJMDKNYIRBSRG-SFHVURJKSA-N 396.491 2.742 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1cccc(C(F)(F)F)c1 55562740 PDRZFPYJKMFNSF-UHFFFAOYSA-N 381.354 2.695 0 50 GFAA COc1ccc(C)cc1[C@H](C(=O)O)N1CCC(N2C[C@H](C)O[C@H](C)C2)CC1 63833561 GSCKMKMGBYZPKT-GQIGUUNPSA-N 376.497 2.703 0 50 GFAA Cc1nn(Cn2cc(NC(=O)c3ccc4c(c3)OCCO4)cn2)c(C)c1Cl 2793889 LTGAQZNJVQFUGG-UHFFFAOYSA-N 387.827 2.879 0 50 GFAA O=S(=O)(c1ccc2c(c1)CCCO2)N1CC[C@@H](c2ccccc2)[C@@H](CO)C1 329040658 DKKPVRMHDYIIID-QUCCMNQESA-N 387.501 2.798 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NCc2cccc(Cl)c2)CN1C1Cc2ccccc2C1 32578197 NZONJNBMTQIWRM-FPOVZHCZSA-N 383.923 2.786 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(C(=O)N3C[C@H](C)O[C@H](CC)C3)o2)C[C@H](C)O1 124424181 IYDWRCRGYLXHTF-YHUYYLMFSA-N 378.469 2.559 0 50 GFAA O=C(CCOCC(F)(F)F)N1CCC(c2nc(-c3ccccn3)no2)CC1 360192020 FBQWCHPQDMCPPX-UHFFFAOYSA-N 384.358 2.807 0 50 GFAA CC(C)[C@@](C)(CN)NC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 236597678 GYPVVMVRDRTVHR-LJQANCHMSA-N 393.484 2.730 0 50 GFAA COc1ccc2cc([C@H]3CN(C(=O)CCc4n[nH]c(C)n4)CCO3)ccc2c1 71715378 GOMMQLVGWFOVBJ-LJQANCHMSA-N 380.448 2.808 0 50 GFAA Cc1cc(N2CCN(C(=O)Cc3ccccc3)CC2)nc(N2CCCCC2)n1 72437028 FZFUGKWUDAFEKN-UHFFFAOYSA-N 379.508 2.667 0 50 GFAA CCn1c(N)nc2cc(C(=O)NCCCN3CCCc4ccccc43)cnc21 77484960 XKQOUUZMNVBAIO-UHFFFAOYSA-N 378.480 2.606 0 50 GFAA COCc1nc([C@H]2COCCN2C(=O)c2csc(-c3ccccc3)n2)no1 378596610 JLFSSQSCNHJARN-CQSZACIVSA-N 386.433 2.553 0 50 GFAA CCOc1cc(Br)c(CC(=O)N2CC[C@@H](CN)C2)cc1OCC 178524386 NGPYDTTWZMHFDJ-LBPRGKRZSA-N 385.302 2.596 0 50 GFAA COC[C@H]1CCCN(C(=O)c2ccc(-c3ccc(OCC(N)=O)cc3)cc2)C1 426465530 XSDLPLKHSLDLRU-INIZCTEOSA-N 382.460 2.716 0 50 GFAA Cc1cc(=N/C(O)=C2/N=NC3=C2CCCCC3)n([C@H]2CCS(=O)(=O)C2)[nH]1 334159380 NCFOPCPPQGSQNZ-OLBPAWMMSA-N 377.470 2.796 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(-c3nc(C(C)(C)C)no3)[nH]c2C1 95502621 SJPFJDXVAHLBAI-NSHDSACASA-N 381.436 2.836 0 50 GFAA CC(C)c1ccc(N2C[C@H](C(=O)NCc3cnn4cccnc34)CC2=O)cc1 91663699 UCGATYOGZDOITE-MRXNPFEDSA-N 377.448 2.522 0 50 GFAA Cc1cc(N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)nc(N)n1 91964476 FFEWBQFYQOKUEJ-UHFFFAOYSA-N 379.508 2.819 0 50 GFAA COCC[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NC2CCC2)c1 95355985 NVYMARALGFFYRT-KRWDZBQOSA-N 380.510 2.549 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@@H]1CCCN(CCCn2cnnn2)C1 95508703 KAMPFEZJOBNDDK-QGZVFWFLSA-N 380.452 2.674 0 50 GFAA CC(C)c1noc([C@@H]2CCCN(C(=O)Cn3ccc4ccccc4c3=O)C2)n1 95512245 RLBMZDLRVVVCAP-MRXNPFEDSA-N 380.448 2.914 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(Cc1cc3c(cc1Cl)OCO3)C2 95355897 AHGSJWTWSFJREP-UHFFFAOYSA-N 377.828 2.688 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)NCc1ccccc1-n1ccnc1)CC(=O)N2 91974049 AEQJPDJWBTUKFS-KRWDZBQOSA-N 376.416 2.623 0 50 GFAA Cc1cc(N2CCC(NCCc3cn[nH]c3)CC2)nc(-c2ccccc2O)n1 96161211 NRQSYFNYEIEOFH-UHFFFAOYSA-N 378.480 2.682 0 50 GFAA CCc1nnc(CN(C)C(=O)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)o1 91563210 KBQDEQIWSKVVFQ-AWEZNQCLSA-N 390.871 2.683 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(Cc2ccc(OCC(N)=O)c(Cl)c2)C1 243901519 BCCAXZCOXCBVHN-OAHLLOKOSA-N 376.888 2.800 0 50 GFAA COc1ccc(N2CCN(Cc3cc(-c4cccnc4)no3)[C@@H](C)C2=O)cc1 243901730 BDJFXOCAIMCXKM-HNNXBMFYSA-N 378.432 2.983 0 50 GFAA CCCN1C[C@@H](NC(=O)c2cccc(-c3ccc4[nH]nc(N)c4c3)c2)CC1=O 534646470 GSGPQKWHIYMHBS-INIZCTEOSA-N 377.448 2.553 0 50 GFAA CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)NCCn3cccn3)CC2)cc1 299761636 XBORRXOTECRDIG-UHFFFAOYSA-N 382.508 2.849 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNC(=O)c2ccc3c(c2)ncn3CCO)C1 828776993 PBJVFVFSBVRSSN-LJQANCHMSA-N 392.503 2.556 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565530739 WPENIBZOANSMLW-OCCSQVGLSA-N 377.416 2.685 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(F)cc2)C3)cc1=O 1565507231 GZDWYDMXMVYPCU-XLIONFOSSA-N 383.467 2.744 0 50 GFAA C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@@H](CCC(=O)O)c2ccccc2)C1=O 268889916 IXSNPVPWPQDZIH-RDJZCZTQSA-N 396.443 2.913 0 50 GFAA CC(NC(=O)CN1C(=O)NC2(CCCC2)C1=O)(c1ccccc1)c1ccccc1 171492941 QKCUKRJDNAVDPV-UHFFFAOYSA-N 391.471 2.931 0 50 GFAA CCCCO[C@@H]1C[C@@H](NC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)C1(C)C 170652255 XDQKDQDJIDTESQ-QZTJIDSGSA-N 386.496 2.920 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(C(C)=O)cc3)n2)cc1 5388880 NASZLAKEFXPGGE-UHFFFAOYSA-N 377.400 2.760 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cccc(OCCO)c2)C1)c1ccc(F)cc1 12592771 YCKNYKIZUQJVON-GOSISDBHSA-N 386.467 2.839 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1 13545229 XGPRTNUAFMBVAG-MRXNPFEDSA-N 388.489 2.526 0 50 GFAA Cc1cccc(CNC(=O)C2(N3C[C@H](C)O[C@H](C)C3)Cc3ccccc3C2)n1 15065663 UKSPNWABAAAZNQ-HDICACEKSA-N 379.504 2.653 0 50 GFAA COc1ccc(CNS(=O)(=O)c2cc(Br)ccc2OC)cc1 16092758 IGWLUJBNSRCVEF-UHFFFAOYSA-N 386.267 2.945 0 50 GFAA O=C(c1ccc(N2CCCC[C@H]2CO)nc1)N1CCC(CCn2cccn2)CC1 19839796 WTZXHQIMMGJPOI-FQEVSTJZSA-N 397.523 2.572 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(-c4nc(-c5ccncc5)no4)c3CO2)cc1 169758341 JQFZMAUFNQYFMM-INIZCTEOSA-N 376.376 2.670 0 50 GFAA O=C(CN1C(=O)C(c2ccccc2)=NC12CCCCCC2)NC[C@@H]1CCCO1 169765617 NULDDIVENXLEMM-SFHVURJKSA-N 383.492 2.664 0 50 GFAA Cc1ccc(CC(=O)NCc2nnc3c(-c4nc(C5CC5)no4)cccn23)cc1 169776122 NFARDNHKFWTBBE-UHFFFAOYSA-N 388.431 2.824 0 50 GFAA CCOc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)[C@@H]3NC(=O)[C@@H]1CCOC1)CCC2 1857670144 WCVBQPPMCRUUFC-AWWSKVOZSA-N 398.547 2.937 0 50 GFAA O=C(N[C@@H]1CN(C2CCSCC2)CC[C@@H]1O)c1cc2ccccc2s1 1857695424 JBHACOIZJDJUAP-CVEARBPZSA-N 376.547 2.962 0 50 GFAA Cc1ccccc1-c1ccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](CCO)CN3C2)cc1 1857716025 STJVJHBPMLFFPL-ACRUOGEOSA-N 380.488 2.616 0 50 GFAA O=C(CC1CCCC1)NC[C@H]1[C@H]2CN(Cc3cnsc3)C[C@]23CC[C@H]1O3 1857721601 XNKRHOFXMWZZOV-JRBPQWBISA-N 375.538 2.819 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(c3nc(-c4ccccc4)no3)C[C@]23CC[C@H]1O3 1857724222 QGDYCQLBZMJMNX-BIZBXSGISA-N 382.464 2.637 0 50 GFAA CC(C)(C)n1cc(C(=O)N2CCO[C@H](C(=O)O)C2)c(-c2ccccc2Cl)n1 236775823 YWNWQNFCASVDNP-HNNXBMFYSA-N 391.855 2.884 0 50 GFAA Cc1sc(-c2cccnc2)nc1NC(=O)c1ccc(=O)n(-c2cnn(C)c2)c1 1875254243 HCBXZTZALCVSSD-UHFFFAOYSA-N 392.444 2.650 0 50 GFAA C[C@@H](C(=O)N1CCC[C@H]1c1cn(C)c2ccccc12)n1cnc2c(N)ncnc21 1875312929 KMPRBNFMNNUDNV-GUYCJALGSA-N 389.463 2.825 0 50 GFAA O=C(O)c1csc([C@H]2CCCN2C(=O)c2ccc(CN3CCCC3=O)cc2)n1 888091459 IYHDIYWUBFDSNG-MRXNPFEDSA-N 399.472 2.941 0 50 GFAA O=C(NCc1cccc(Cn2ccnc2)c1)NC[C@@H]1Cc2ccccc2CO1 888099959 KJEMWUDZGYCWOP-NRFANRHFSA-N 376.460 2.872 0 50 GFAA Cc1ccc(C(=O)N2Cc3cnn(C4CCN(C(=O)[C@@H]5C[C@H]5C)CC4)c3C2)o1 1775989420 NUHCNQJVYZRMGX-CXAGYDPISA-N 382.464 2.760 0 50 GFAA Cc1cc(-c2ccccc2)nc(NC(=O)C2CCN(C(=O)[C@@H]3CCCO3)CC2)n1 2100542977 KRHCEEMNFSMVGC-IBGZPJMESA-N 394.475 2.808 0 50 GFAA CN1CCC2(CC1)CN(C(=O)c1ccc(-n3ccnn3)cc1)Cc1ccccc12 2325856271 IKTCXAUMKGIAHI-UHFFFAOYSA-N 387.487 2.887 0 50 GFAA Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)c(O)c1Cl 2325872598 GBRWEBMVRIQICI-OKILXGFUSA-N 385.851 2.757 0 50 GFAA COC(=O)c1cc(NC(=O)c2cc3ccccc3oc2=O)cc(C(=O)OC)c1 1202421 BYVGLKCZGSHDMS-UHFFFAOYSA-N 381.340 2.619 0 50 GFAA CC(C)NC(=O)c1ccccc1NC(=O)CCS(=O)(=O)Cc1ccccc1 2875650 WKQUBFRLIHJPFY-UHFFFAOYSA-N 388.489 2.768 0 50 GFAA CC(=O)Nc1ccc(NC(=O)c2cc3c(=O)n4cccc(C)c4nc3n2C)cc1 2917441 WWOGQKODRKWJBO-UHFFFAOYSA-N 389.415 2.705 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1=O 2356150317 WUNXKIFSNIUSLW-JOCHJYFZSA-N 383.492 2.731 0 50 GFAA COc1ccc(N2C[C@@H](NC(=O)C(=O)c3c(C)[nH]c4ccccc34)CC2=O)cc1 4497216 QIFQYFPQGFSNPO-AWEZNQCLSA-N 391.427 2.589 0 50 GFAA CCOC(=O)C1CCN(C(=O)C2CCN(Cc3ccc(F)cc3)CC2)CC1 4725552 MXNKKLZJXGRTSN-UHFFFAOYSA-N 376.472 2.839 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCCn1nc(C)cc1C 225536055 HDIBLFSBJJBMFP-GOSISDBHSA-N 385.464 2.747 0 50 GFAA CN(C[C@]1(c2ccccc2)CC1(C)C)C(=O)c1cc(CN2CCOCC2)on1 67446857 DXTTWLYCANTOIX-QFIPXVFZSA-N 383.492 2.947 0 50 GFAA CC(C)N1CC[C@H](C(=O)N2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)C1 67856834 BAVLIQZJEXNGRV-HNNXBMFYSA-N 383.448 2.685 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20149560 VBTINEYMQZBFCA-LJQANCHMSA-N 382.460 2.917 0 50 GFAA COc1cccc(Cl)c1CNC(=O)CCN1CCN(c2ccccn2)CC1 252492125 MDKJFVZHNYGNJW-UHFFFAOYSA-N 388.899 2.572 0 50 GFAA Cc1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)cc(C)c1O 39543781 HIXDFCZDSGJZHW-JOCHJYFZSA-N 389.584 2.750 0 50 GFAA O=C(c1ccc2cc[nH]c2c1)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328643400 YWHZRFUSTHGZBT-LJQANCHMSA-N 377.448 2.772 0 50 GFAA CCN1CCC[C@@H](CN(C)C[C@H](O)COc2ccccc2)[C@@H]1c1cnn(C)c1 328630909 JVVAJLVUNUMDHP-RCZSKKKRSA-N 386.540 2.565 0 50 GFAA Cn1ncc2c(N3CCN(c4ccccc4)C(=O)C3)nc(C3CCCC3)nc21 72434398 NZDWBXUWMXCBSB-UHFFFAOYSA-N 376.464 2.874 0 50 GFAA CCN(C)C(=O)C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 39442838 QUEDRBIEATUGHJ-FQEVSTJZSA-N 381.476 2.648 0 50 GFAA CNC(=O)c1nn(Cc2cc(F)cc(Br)c2)c(=O)c2ccccc12 484732180 WCZNQADSSVDYLO-UHFFFAOYSA-N 390.212 2.706 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCO2)c1)N1CCN(c2nc3ccccc3o2)CC1 363323035 PNZVSDNJDBRSQL-MRXNPFEDSA-N 396.451 2.557 0 50 GFAA COc1cc(F)c(NC(=O)N2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)cc1F 363951423 WXRIKLWNLQUCJS-BLLLJJGKSA-N 380.395 2.827 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC(n2ccnc2-c2ccc(CO)o2)CC1 77538820 HRFGKNXQSKKWOV-UHFFFAOYSA-N 387.461 2.661 0 50 GFAA CS(=O)(=O)c1csc(C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 158159324 VMWCAIPHNLGWDE-UHFFFAOYSA-N 377.487 2.887 0 50 GFAA CCO[C@@H](C)c1nc(CN(C)C(=O)c2cc(N3CCOCC3)ccn2)cs1 131335658 YKVZRSSMJYLSLT-AWEZNQCLSA-N 390.509 2.744 0 50 GFAA C[C@@H](NC(=O)c1coc(S(=O)(=O)N(C)C)c1)c1ccc2c(c1)CCCC2 159713962 VVPAJZYRLXVGIJ-CYBMUJFWSA-N 376.478 2.900 0 50 GFAA O=C(O)CCC(=O)Nc1sc2c(c1C(=O)NCc1ccco1)CCCC2 17076957 HASWTHLRVOFVJZ-UHFFFAOYSA-N 376.434 2.953 0 50 GFAA CCc1cc(N2CCC(NC(=O)C[C@@H]3OCCc4ccccc43)CC2)ncn1 177174631 LRVKBJLQEXXZRS-FQEVSTJZSA-N 380.492 2.828 0 50 GFAA CN(Cc1ccc2nonc2c1)C(=O)NCCN1CC[C@H](c2ccccc2)C1 426546316 ZAQIXWKOMJEVBV-SFHVURJKSA-N 379.464 2.854 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3c[nH]nc3-c3ccc(F)cc3)C2)n[nH]1 426369407 UNJROKUVBNWKAE-AWEZNQCLSA-N 383.431 2.732 0 50 GFAA CSc1nc(C(=O)N2CCCn3nc([C@@H](O)C4CCC4)cc3C2)cs1 220520985 HPWNJQPBNMGKGU-HNNXBMFYSA-N 378.523 2.941 0 50 GFAA CN1CC[C@@H](NC(=O)NC2CCN(Cc3ccncc3)CC2)[C@@H]1c1ccccc1 179113296 YJFPBKJERAXYDO-YADHBBJMSA-N 393.535 2.791 0 50 GFAA C[C@H](O)C(=O)N1CCC(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)CC1 95511883 VRASCSXGUBBDCQ-AWEZNQCLSA-N 392.459 2.788 0 50 GFAA Cc1ccccc1CN1CCC(CN(CC(=O)N(C)C)C[C@@H]2CCCO2)CC1 95505972 BYYDOKFRKVMICN-QFIPXVFZSA-N 387.568 2.776 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC[C@@H](c3cccc(C(=O)O)c3)C2)c1C 95361199 XCYJEZGFIDAYPV-GOSISDBHSA-N 383.448 2.807 0 50 GFAA COc1cccc(-c2cc(C(=O)N3CCN(c4ccncc4C)CC3)n[nH]2)c1 91587246 IYYWAVNDOKQMFQ-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA O=C1Nc2ccccc2S[C@@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 299748709 HXQQINASEQHVOX-NVXWUHKLSA-N 382.441 2.528 0 50 GFAA Cc1nn(C)cc1CC(=O)Nc1cscc1S(=O)(=O)c1ccccc1 1940196323 BZOTVMGAIKNUCN-UHFFFAOYSA-N 375.475 2.804 0 50 GFAA CCn1nc(C)c([C@H](C)NS(=O)(=O)c2cc(Cl)sc2C(=O)O)c1C 670441491 ZWYKGVULVODLMP-QMMMGPOBSA-N 391.902 2.972 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)[C@@H]1CC(=O)Nc3ccc(F)cc31)OCCO2 952989544 RSKGIBFPNULCBW-CQSZACIVSA-N 384.363 2.864 0 50 GFAA COCCN(CCOc1ccccc1F)S(=O)(=O)c1ccc(F)cc1F 952991280 WNBPFUPFZSTQTN-UHFFFAOYSA-N 389.395 2.820 0 50 GFAA Cc1cc(N2CCN(Cc3nc(C)c(C)n3C)CC2)nc(-c2ccccc2O)n1 952977460 IGHILLPENPIXIK-UHFFFAOYSA-N 392.507 2.830 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@H]1CC12CCOCC2)c1ccc(Br)cc1 170066337 ZFCBUZYFESATAV-KGLIPLIRSA-N 382.254 2.898 0 50 GFAA O=C(Nc1ccc(-n2ccnn2)cc1)N1CCC[C@H](Oc2ncccc2F)C1 278812271 HLNVWDLANXKXEW-INIZCTEOSA-N 382.399 2.877 0 50 GFAA Cc1cc(CNC(=O)CSCc2cc(=O)n3ccsc3n2)cc(C)c1O 170637610 UMVDKFLKKUEHPW-UHFFFAOYSA-N 389.502 2.628 0 50 GFAA CCN1C[C@@H](CN(C)Cc2nc(-c3ccc(OC)cc3OC)oc2C)CC1=O 12472986 LKLGCUJCDPUYIL-OAHLLOKOSA-N 387.480 2.967 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)Nc2nc(C)c(C)s2)cc1 13548652 XYWFZXYUTOTJCP-OAHLLOKOSA-N 379.507 2.860 0 50 GFAA O=C(Nc1ccccc1)O[C@@H]1CS(=O)(=O)C[C@@H]1OC(=O)Nc1ccccc1 16675865 ZBFBPBSFROGYCR-IYBDPMFKSA-N 390.417 2.649 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCN(c3ccc(F)cn3)[C@@H](C)C2)cn1 1857670671 XCFWQYYMPMZFPM-HNNXBMFYSA-N 395.438 2.766 0 50 GFAA CC(C)n1cc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3ncc(F)cc3F)C2)cn1 1857703686 WJBOCKQOLRDQDG-HUUCEWRRSA-N 391.422 2.608 0 50 GFAA COc1ccc(Cc2nc(-c3cnc(C)cc3C)n(C[C@@H](C)O)n2)cc1OC 1857710949 CNUWRFTXLGCYQG-OAHLLOKOSA-N 382.464 2.946 0 50 GFAA COCCN1CC2(CCN(C(=O)c3cccc(C(C)C)c3)CC2)OCCC1=O 1857715502 VBIUJTDMDQDRRD-UHFFFAOYSA-N 388.508 2.680 0 50 GFAA CC(C)c1cccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)C4CC4)C[C@]34CC[C@H]2O4)c1 1857736159 YBWPECUAXXOVAX-DZCCDHAISA-N 382.504 2.956 0 50 GFAA CCOc1cc(C)c(CN2C[C@H]3[C@H](N(C)C)CS(=O)(=O)[C@H]3C2)cc1C(C)C 1857740965 VPOGIPPQPQWDHU-ZVDOUQERSA-N 394.581 2.676 0 50 GFAA Cc1cc(CC(=O)N2CCC[C@@]3(CCc4c(N5CCCC5)nc(C)nc43)C2)on1 1875251292 WIFDZXRLAZFAJC-JOCHJYFZSA-N 395.507 2.731 0 50 GFAA CN(Cc1cc(Br)cs1)C(=O)CN1[C@H]2CC[C@H]1CC(O)=NC2 330018752 UBGHIFBEQYQEIQ-RYUDHWBXSA-N 386.315 2.662 0 50 GFAA C[C@@H](NC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1ccc(F)c(F)c1 265801596 SWUHROUNZLSHFK-MRVPVSSYSA-N 375.301 2.862 0 50 GFAA CCN(CC(=O)N1CCC(C(=O)NCCC(C)C)CC1)[C@@H]1CCOC(C)(C)C1 810043242 RBGKYQJLMGZDKZ-LJQANCHMSA-N 395.588 2.667 0 50 GFAA CC(=O)N1CCC[C@@H](CNC(=O)N[C@@H](Cc2ccccc2)Cc2cccnc2)C1 1875288944 MECMNZBJYDYRCL-VXKWHMMOSA-N 394.519 2.793 0 50 GFAA COC(=O)[C@@H]1CC=C[C@@H](NC(=O)c2cc(Cl)nn2-c2ncccc2Cl)C1 1875295862 SRTIFFXVUZUZBL-GHMZBOCLSA-N 395.246 2.812 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2ccc(N3CCOC[C@H]3C)c(Cl)c2)C1 1875371316 WWJRNYHYTOLMBX-CABCVRRESA-N 391.899 2.928 0 50 GFAA CN(c1ccccc1)c1ccc(CN[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cn1 1875399365 APUPFHLGSGIDPH-CEWLAPEOSA-N 377.492 2.975 0 50 GFAA COCc1ccc(C(=O)N[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875403438 XFQVKSKLKAZTNA-KFKAGJAMSA-N 395.459 2.859 0 50 GFAA CCc1sc([C@@H](C)NC(=O)N2CCC(N3CCCS3(=O)=O)CC2)cc1C 886093427 MMNDIPHIDCNFSV-CQSZACIVSA-N 399.582 2.889 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H](CN(Cc3scnc3C)C(=O)C(C)C)C2)n[nH]1 1775990240 WHIRTLGUJPCGAM-OAHLLOKOSA-N 389.525 2.630 0 50 GFAA O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)NC1(C2CC2)CCOCC1 1321929440 HXEJIVVUVAIQKZ-FQEVSTJZSA-N 387.524 2.536 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3oc(-c4ccc(Cl)cc4)nc3c2)C(=O)N1 1857798142 RGLDXHWIMBFLBT-CYBMUJFWSA-N 383.791 2.683 0 50 GFAA Cc1ccc([C@]23C[C@H]2CN(CC(=O)Nc2ccc(C(=O)N(C)C)cc2)C3)cc1 2325778522 BULBUXNVNZMXEP-WMZHIEFXSA-N 377.488 2.909 0 50 GFAA Cc1nc(NCCC(=O)N2CCN(c3ccccn3)CC2)c2c(C)csc2n1 123051937 JVJHQFJDDYRLAU-UHFFFAOYSA-N 396.520 2.854 0 50 GFAA O=C(Cn1cnc2scc(-c3ccc(Cl)cc3)c2c1=O)N1CCOCC1 791302 DAKHJKBAEDRATR-UHFFFAOYSA-N 389.864 2.637 0 50 GFAA CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccc(Br)cc1 797741 LEHUOOJZJRJAQE-UHFFFAOYSA-N 389.315 2.664 0 50 GFAA COc1cc(Br)c(S(=O)(=O)NCc2ccccc2)cc1OC 944419 GKUHHFPGUOKJCE-UHFFFAOYSA-N 386.267 2.945 0 50 GFAA O=C(Cc1ccccc1)N1CCC(C(=O)N2CCN(c3ccccc3)CC2)CC1 1163278 PJJMPFJFMZTDGU-UHFFFAOYSA-N 391.515 2.817 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc(-n3nc(C)cc3C)cc2)CC[C@H]1O 2356147153 KHLSOHDGTWQLHV-WIYYLYMNSA-N 385.464 2.567 0 50 GFAA Cc1ccccc1C(=O)N1CCC(C(=O)N(C)[C@H]2C[C@H]3C[C@@H](O)C[C@H]3C2)CC1 2356163195 ROMLXNMDIYYQRU-FGYAAKKASA-N 384.520 2.855 0 50 GFAA Cc1nc(N2CCOCC2)c2c(C(=O)NCCc3ccccc3)c(C)oc2n1 8596998 IHXWXVXXHQWXAO-UHFFFAOYSA-N 380.448 2.649 0 50 GFAA O=C(CCc1ccccc1)N1CCC(C(=O)N2CCC[C@@H]2c2ccn[nH]2)CC1 225701865 GXONEWMRFYTQCZ-HXUWFJFHSA-N 380.492 2.945 0 50 GFAA O=C(O)Cc1ccc(Nc2nccc(Nc3ccc(O)c(C(=O)O)c3)n2)cc1 170621820 QHKDSLZGYPEIJY-UHFFFAOYSA-N 380.360 2.995 0 50 GFAA O=C(NCCSc1c[nH]nn1)c1ccc([C@H]2CCCN2CC2CC2)s1 23379947 BRWKWZRLAUZQSD-CYBMUJFWSA-N 377.539 2.935 0 50 GFAA CC(=O)N1CCc2c(nc(-c3cccnc3)nc2NCCCC(C)(C)CO)C1 71714503 BBIFEXANXIKTBY-UHFFFAOYSA-N 383.496 2.654 0 50 GFAA O=C(NCC[C@H]1C(=O)Nc2ccccc21)c1cccc(OCC(F)(F)F)n1 172361924 FFEJLXDTJKTWCJ-GFCCVEGCSA-N 379.338 2.879 0 50 GFAA O[C@@H](c1cccs1)C1CCN(c2nc3nonc3nc2N2CCCC2)CC1 12709794 LNKFMARBUFYUQZ-CQSZACIVSA-N 386.481 2.625 0 50 GFAA O=C(NC[C@H]1CCCS1(=O)=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 124477332 ODUBJPLDKHHERO-QAPCUYQASA-N 375.494 2.982 0 50 GFAA C[C@H](CCn1cncn1)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 253432807 OKNBGUBRJWMBCG-SNVBAGLBSA-N 380.330 2.556 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccccc2Cl)CN1C1Cc2ccccc2C1 32582176 QPJFOBYTWJEOGI-NQIIRXRSSA-N 383.923 2.786 0 50 GFAA Cc1c(C(=O)N2CCC(N3CCC[C@H]3C(N)=O)CC2)sc2cccc(F)c12 364040593 YPAKIDFVLYUGQB-HNNXBMFYSA-N 389.496 2.903 0 50 GFAA Cc1ccc(OCC(=O)N2CCc3ccccc32)c(I)n1 126648225 CNYDCZAOUOATPF-UHFFFAOYSA-N 394.212 2.963 0 50 GFAA CC(C)c1ccc(C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)nc1 368667467 RWFLXYGMJGGKMB-DLBZAZTESA-N 379.460 2.854 0 50 GFAA O=C(CCn1cnc2ccccc21)N1CCC2(CC1)c1ccccc1C[C@@H]2O 72146392 LLGRMPIHYDFAOO-NRFANRHFSA-N 375.472 2.904 0 50 GFAA O=C(Nc1ccc(-n2ncc3c(O)ncnc32)cc1)[C@@H](O)c1ccc(Cl)cc1 813410649 VEURVMLHIRFJMC-INIZCTEOSA-N 395.806 2.847 0 50 GFAA O=S(=O)(NC[C@H]1CN(C2CC2)CCO1)c1cc2cc(Cl)ccc2s1 176930012 JDGYHFHUCREDLA-AWEZNQCLSA-N 386.926 2.696 0 50 GFAA NC(=O)C[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)C1 245428329 IUMXZWNRUYDOMJ-GJZGRUSLSA-N 378.904 2.606 0 50 GFAA CC(C)N1C(=O)[C@]2(Cc3c(Cl)cccc3N3CCCC[C@H]32)C(=O)NC1=S 229915151 SCUJNEBFSBCZLW-KXBFYZLASA-N 391.924 2.893 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)N2CCC3(CC2)C(=O)Nc2ccccc23)n1 426382782 OJAQPWYGMIBOKH-HNNXBMFYSA-N 381.480 2.584 0 50 GFAA O[C@H](CN1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)C(F)(F)F 20219000 ZAUYCHGXFFHZGO-SNVBAGLBSA-N 377.716 2.799 0 50 GFAA CC(C)(C)COC(=O)N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1 91656085 HZMORQUFYQXQJA-UHFFFAOYSA-N 376.501 2.840 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N([C@H]4CCN(C)C4)C3)CC2)cc1C 95517823 XEDNAJQISDWHLY-IBGZPJMESA-N 399.535 2.553 0 50 GFAA Cc1cc(C)cc(CN2CCC[C@@H](c3nnc(CN4CCOCC4)n3C)C2)c1 426383175 WFCHQHYGCSCNRT-HXUWFJFHSA-N 383.540 2.644 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2nc(C(C)C)no2)CC3)cn1 91965490 NCWKRDJMJOFLQZ-UHFFFAOYSA-N 398.511 2.696 0 50 GFAA O=C(NC[C@@H]1CCCN(c2ncccn2)C1)Nc1ccc(-n2ccnc2)cc1 95505320 RREVEDUBWHSGDY-INIZCTEOSA-N 377.452 2.700 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95378121 HHYAPSHEGNSAGS-HNAYVOBHSA-N 387.487 2.662 0 50 GFAA O=C(CN1CCCCCC1)N1CCC(c2nccn2Cc2cscn2)CC1 95505345 WMXNYHAYEYUGSL-UHFFFAOYSA-N 387.553 2.970 0 50 GFAA CN(C(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)C1CC1 183539908 NZNFSYABPQAOTR-QHCPKHFHSA-N 389.455 2.787 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCCc4ccc(C)cc4)c3CO2)cc1 263616312 IAVYGVFXWAQDFV-HXUWFJFHSA-N 392.459 2.839 0 50 GFAA O=C(N1CC[C@@H](Nc2ncccn2)[C@H](O)C1)C1(c2ccc(Cl)cc2)CCC1 299758956 LYWLKBGMLORWDI-IAGOWNOFSA-N 386.883 2.626 0 50 GFAA O=C1CCC[C@H]2[C@H]3C[C@H](CN(C(=O)C4(c5ccccc5)CCOCC4)C3)CN12 828261220 VRCSQTYFJAMMOX-HBFSDRIKSA-N 382.504 2.594 0 50 GFAA biogenic CC(C)(C)OC(=O)NCCc1cc(O)c(O)cc1I 142719296 TUWDQSFYHRHXPC-UHFFFAOYSA-N 379.194 2.770 0 50 GFAA COC(=O)[C@@](C)(c1ccccn1)N(C)Cc1nc([C@@H](C)OCC(C)C)no1 222119780 DEZAGULIXNNPEJ-AUUYWEPGSA-N 376.457 2.718 0 50 GFAA C[C@@H]1C[C@H](O)CN1c1cnn(CCOc2ccc(Cl)cc2)c(=O)c1Cl 170088625 QPLRDDVAKQRSJZ-YPMHNXCESA-N 384.263 2.589 0 50 GFAA Cn1c(SCc2ccc([Si](C)(C)C)cc2)nnc1[C@H]1CCS(=O)(=O)C1 170613009 ZXRBUBWKUKLUTB-AWEZNQCLSA-N 395.626 2.555 0 50 GFAA O=C(Nc1cc(-c2ccc(Br)cc2)nn1CCO)c1cccnc1 171142640 AWVXNHALSHVARM-UHFFFAOYSA-N 387.237 2.952 0 50 GFAA O=C(Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)NOCc1ccccc1 767926007 HGFRTNHALOIKCS-UHFFFAOYSA-N 377.326 2.607 0 50 GFAA Cc1ccc(CNS(=O)(=O)Cc2cc(C(C)(C)C)on2)c(N2CCCC2)n1 790263351 XLUJNYBQDVFMMP-UHFFFAOYSA-N 392.525 2.895 0 50 GFAA C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)CN1CC(O)(c2ccc(F)cc2)C1 792876895 ZYYUVRIZSNPFKA-CYBMUJFWSA-N 378.394 2.827 0 50 GFAA c1ccc(-c2nc3ncccn3c2CN2CCN3[C@H](COC[C@H]3C3CC3)C2)cc1 1615963577 JGLGCULUAXUTRD-FPOVZHCZSA-N 389.503 2.691 0 50 GFAA O=C(CN1CCC2(CC1)OCCO2)Nc1ccc(Br)cc1Cl 6729543 IOMPJYXSSDJLED-UHFFFAOYSA-N 389.677 2.880 0 50 GFAA Cc1cccc(CN2C[C@@H]3CN(C/C=C/c4ccc(F)cc4)C[C@]3(CO)C2)n1 1772815911 COVCMUDJCZLBFC-GLKGQDOESA-N 381.495 2.969 0 50 GFAA CN1CCC[C@@H](c2nc(-c3cn(C)c4ccccc34)n(-c3ccnn3C)n2)C1 1772804457 AMDHNVJRQQGRAN-OAHLLOKOSA-N 375.480 2.969 0 50 GFAA COc1cccc(CN2C[C@@H]3CN(C(=O)CN)C[C@@]3(CCc3ccccc3)C2)c1 1772806592 BQYONTHBXZJGPV-ZJSXRUAMSA-N 393.531 2.547 0 50 GFAA Cc1cc2nc(CNC(=O)[C@@H]3CCCN(C4CCN(C)CC4)C3)[nH]c2cc1C 11814149 YCFGAXXCJIMLQF-QGZVFWFLSA-N 383.540 2.602 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccccc2F)C1)C(=O)CN1CCCCC1=O 12076276 FNXFJSBVFLTFFM-GOSISDBHSA-N 389.515 2.551 0 50 GFAA COc1cccc(OCc2nc(C(=O)NCc3cn4ccccc4n3)co2)c1 12307150 FDISVCZKWRFZIX-UHFFFAOYSA-N 378.388 2.840 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C4CCOCC4)C3)C2=O)c1 12432859 BORWMLURWLKAGM-OAQYLSRUSA-N 376.472 2.828 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@@H](C(=O)c2cccc(OC(C)C)c2)C1 12588609 DRJQRCKECFOWGM-MRXNPFEDSA-N 376.453 2.641 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)NCCN2CC[C@H](c3ccccc3)C2)nn1 14953764 OAQSQIORBCRHMZ-NRFANRHFSA-N 389.503 2.854 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCCc2cccc(F)c2)c1=O 14990550 QYEAGCHCSOZULJ-UHFFFAOYSA-N 399.466 2.825 0 50 GFAA c1ccc(CN2CN(CCN3CCOCC3)Cn3c2nc2ccccc23)cc1 19938240 MYTVKXCUNCBDAU-UHFFFAOYSA-N 377.492 2.606 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)C1(Cc3ccccc3F)CC1)CCO2 1857528881 ONGWATSYBJVFAG-UHFFFAOYSA-N 394.512 2.638 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)c1cnoc1-c1ccccc1 1857666901 PGMZTQRKUWDGLJ-YRWFTTLQSA-N 391.475 2.716 0 50 GFAA O=C(c1cccc(OCCc2ccccc2)c1)N1C[C@@H]2CCOC[C@]2(CO)C1 1857669807 VSWLKLQJPKTKID-NZQKXSOJSA-N 381.472 2.779 0 50 GFAA O=C(Cc1ccccc1)N1CCC[C@@]2(CN(CCC(F)(F)F)CC[C@H]2O)C1 1857702731 BAOOTUHWHIKRAG-IEBWSBKVSA-N 384.442 2.857 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN3CCOCC3)[C@@H]2c2cccnc2)cc1C 1857717975 ITYDPRHRCGOFCE-VXKWHMMOSA-N 395.503 2.613 0 50 GFAA O=C(CNc1cccnc1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857721215 FLUCMGQFZSGBQP-UNMCSNQZSA-N 380.492 2.558 0 50 GFAA C[C@H]1CC[C@@H](C)N1C(=O)[C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857738274 ZRAHSRFGGOMKDQ-IJEWVQPXSA-N 384.505 2.881 0 50 GFAA CNC[C@H]1CCCN(C(=O)c2cc(O)nc3ccc(Br)cc23)C1 237059434 GEYDXEAHZFLPAW-LLVKDONJSA-N 378.270 2.775 0 50 GFAA CC(C)(C)OC(=O)NC1(C(=O)O)CCN(C(=O)OCc2ccccc2)CC1 12648497 BGRHKAAVXJAPGP-UHFFFAOYSA-N 378.425 2.767 0 50 GFAA in-vitro C[C@@]1(F)CCCCN(C(=O)N[C@@H](C(=O)N2CCOCC2)c2ccccc2)C1 1875265856 PSGOHWAZLQFIBU-YLJYHZDGSA-N 377.460 2.510 0 50 GFAA CN(C(=O)Cc1ccc(F)c(F)c1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)C1 1875316673 GCVNPRBRAJJNHK-GVLSGGHMSA-N 388.458 2.859 0 50 GFAA CC(=O)Nc1cccnc1C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2C(=O)C1C(C)(C)C1(C)C 1775992198 QKNRHJDKBUSXBP-NUEKZKHPSA-N 398.507 2.584 0 50 GFAA O=C1CCN(C[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)C(=O)N1Cc1ccc2c(=O)cc[nH]c2c1 2325779778 BRECGDKMCRVKSZ-NXJYUQPGSA-N 391.471 2.975 0 50 GFAA CC(C)(C)[C@H](C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12)N1CCCC1=O 2325813188 UOVDRIIQPUROBM-SFHVURJKSA-N 383.492 2.536 0 50 GFAA CC(C)c1ccc(C(=O)N(C)C2CC(NC(=O)[C@H](O)c3ccc(F)cc3)C2)o1 2325829201 BVHKRRQXXAIBPN-LADRWXRNSA-N 388.439 2.995 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCc3sc(Br)cc3C2)C1 2325888417 QZLBBOCJLIYYIG-LLVKDONJSA-N 383.311 2.820 0 50 GFAA CC[C@H](C)[C@H](C(=O)N1CCN(c2ccc3nncn3n2)CC1)c1ccccc1 136401442 XILJZJZQFIBARW-JXFKEZNVSA-N 378.480 2.603 0 50 GFAA Cc1c(C(=O)OC(C)C)sc2ncn(CC(=O)NCc3ccccc3)c(=O)c12 814809 LMVJFLGSZQPRRD-UHFFFAOYSA-N 399.472 2.648 0 50 GFAA O=C(c1ccc(Cl)cc1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 899927 WCGPEANFIZDVCN-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA Nc1nc(SCCCC(=O)NCCCO)nc2sc3c(c12)CCCC3 1830514 IDYOGSVFDZGUQD-UHFFFAOYSA-N 380.539 2.523 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3S(=O)(=O)N3CCCCC3)C2=O)cc1 2356138228 JBFIUHBRLBQIRA-HXUWFJFHSA-N 391.537 2.687 0 50 GFAA Cc1cc(Br)c2c(c1)[C@@](O)([C@@H]1C(=O)Nc3ccccc31)C(=O)N2C 2868749 IOKGCPVYEXWMOL-KBXCAEBGSA-N 387.233 2.657 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccccc2OC(F)(F)F)CC[C@@H]1O 2356147194 MJONEZVBDXVJMK-XJKSGUPXSA-N 375.343 2.663 0 50 GFAA Oc1nc(-c2cccnc2)nc2c1CCC21CCN(CCCn2cccn2)CC1 2356165264 AIBJPKSIFOLKJE-UHFFFAOYSA-N 390.491 2.811 0 50 GFAA CS(=O)(=O)c1ccc(N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)nc1 2356166628 GHVDBFBSNMHBJO-BEFAXECRSA-N 383.473 2.703 0 50 GFAA CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc2c(cc1Br)OCO2 4599445 VSHNGTSABVWOTR-CQSZACIVSA-N 397.225 2.759 0 50 GFAA CCC[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)OC 4764349 RWJCTEYKWWBVCL-XIRDDKMYSA-N 378.469 2.785 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2ccc(N3CCCN(CC(C)C)CC3)nc2)C1 106730128 PJLSGLUYWZDDHY-LJQANCHMSA-N 388.556 2.748 0 50 GFAA Cc1nc(C(C)C)ncc1C(=O)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65397544 UOSIQAHQGZDCMC-DOTOQJQBSA-N 383.448 2.628 0 50 GFAA CCOC(=O)c1ccc(C)c(NC(=O)c2ccc(NS(C)(=O)=O)cc2)c1 10112320 PTGWNKYHFQEJOA-UHFFFAOYSA-N 376.434 2.796 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3ccc(-n4cccn4)cc3)C2)CC1 23358015 MYUVTGXKMYNOJW-OAQYLSRUSA-N 397.523 2.611 0 50 GFAA Cc1nc(-c2cccc(NC(=O)C3CCN(C(=O)c4ccccn4)CC3)c2)n[nH]1 172846092 HWSFGJWRFBUYGL-UHFFFAOYSA-N 390.447 2.666 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1 125981099 MDOSCAZUKAOLJJ-HXUWFJFHSA-N 393.487 2.700 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2cccc3c2OCO3)CC1 328655642 YPFWJYQDUFXQQY-IBGZPJMESA-N 382.464 2.609 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(OC)cc3F)[C@H](CCO)C2)cc1 39362596 XJGKCRZHAZPHOJ-LJQANCHMSA-N 388.483 2.912 0 50 GFAA O=C(NCc1csc(N2CCCC2)n1)[C@@H]1CCC(=O)N(C2CCCC2)C1 215351262 ROGZYSWODOSDGM-CQSZACIVSA-N 376.526 2.541 0 50 GFAA O=C(c1cccnc1)N1C[C@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72156894 SUCUKFMCKNCUJP-DUXKGJEZSA-N 377.444 2.513 0 50 GFAA C[C@H]1[C@H](NC(=O)c2ccc(NC(N)=O)cc2)[C@H](C)CCN1C(=O)OC(C)(C)C 253418141 GYQYLMMDOQOUOD-DVOMOZLQSA-N 390.484 2.941 0 50 GFAA COc1ccc(CNCCc2cccnc2)cc1OC[C@@H](O)CN1CCCCC1 12429766 WQEAWNLEYRYFRD-NRFANRHFSA-N 399.535 2.648 0 50 GFAA Cc1nnsc1C(=O)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 15066652 WKYAJQUSHATZPD-LJQANCHMSA-N 388.468 2.641 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)N1CC[C@H](Cc2cnn(C)c2)C1 363756706 CBWGXJIMESRVGM-OAHLLOKOSA-N 394.483 2.751 0 50 GFAA CC(C)[C@H]1CN(C(=O)CN2CCCCC2=O)CCCN1Cc1ccc(F)cc1 72152921 AWXLUPJQXPFFMI-HXUWFJFHSA-N 389.515 2.897 0 50 GFAA CS(=O)(=O)c1cccc(OCCN2CCO[C@@]3(CCc4ccccc43)C2)c1 158980785 LSWGDOYTOVRMNV-NRFANRHFSA-N 387.501 2.643 0 50 GFAA CN(C)c1noc([C@@H]2CCCN(Cc3noc(-c4ccc(F)cc4F)n3)C2)n1 374534946 FVWILYDLESZVDU-LLVKDONJSA-N 390.394 2.843 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(N2CCNC2=O)ccc1Cl 262424819 QXLMQWGUWWIXKB-UVBJJODRSA-N 391.855 2.728 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1ccccn1)c1c[nH]nc1-c1ccccc1F 219594021 GUJMYJOJAKVSFY-IAGOWNOFSA-N 382.395 2.577 0 50 GFAA C[C@H]1CCc2n[nH]c(C(=O)N3CCC4(CC3)C(=O)N(C)c3ccccc34)c2C1 72145004 CLJVAPMPCBODPX-AWEZNQCLSA-N 378.476 2.685 0 50 GFAA Cc1ccc(OC2CN(C(=O)C[C@H]3CN(Cc4ccccc4)CCO3)C2)cc1 219383829 NGFNZXUSXMHWCL-NRFANRHFSA-N 380.488 2.876 0 50 GFAA COc1ccc2[nH]c(CCN(C)C(=O)CCN3Cc4ccccc4C3)nc2c1 222485026 IRUWOQGQPWEYOV-UHFFFAOYSA-N 378.476 2.978 0 50 GFAA O=C(NCCNc1cc(N2CCCC2)ncn1)c1ccccc1C(F)(F)F 82230523 PJCZFJFXDHDRNV-UHFFFAOYSA-N 379.386 2.938 0 50 GFAA CCn1cc(CN(Cc2ccccc2)S(=O)(=O)c2cn(CC)nc2C)cn1 20603870 WECXDXFIEXEZMQ-UHFFFAOYSA-N 387.509 2.819 0 50 GFAA CCN1C(=O)COc2cc(NC(=O)N3CCC[C@@H](c4ccncn4)C3)ccc21 96165553 CLDUFNGYOKGCEZ-CQSZACIVSA-N 381.436 2.633 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)NCCc1nc(N)cc(=O)[nH]1)c1ccccc1 95519236 APNQONZDHOTUHJ-SFHVURJKSA-N 376.460 2.541 0 50 GFAA COC(=O)c1cncc(N2CCC3(CC2)C[C@@H](c2ccccc2)CN(C)C3)n1 96138300 OCSJUWYEYRKOTC-GOSISDBHSA-N 380.492 2.969 0 50 GFAA COc1ccc(C2(C(=O)NCCSc3nc[nH]n3)CCCC2)cc1OC 426582733 DBDFJVURNNFIIZ-UHFFFAOYSA-N 376.482 2.542 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC(CCC(=O)NC[C@@H]4CCCO4)CC3)ccc21 95506327 DSCIZGIMEDCDKN-SFHVURJKSA-N 398.507 2.501 0 50 GFAA CN(CCC1CCN(c2ccncc2)CC1)[C@H]1CCN(CC(F)(F)F)C1=O 179397386 VRHNRMFXNYADEN-KRWDZBQOSA-N 384.446 2.783 0 50 GFAA O=C(c1ccccc1)[C@@H]1[C@@H]2C(=O)N(c3ccccc3F)C(=O)[C@H]2[C@H]2CCCN12 230080626 WRRUROFEEKQBIT-HCXYKTFWSA-N 378.403 2.661 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 95520198 YWEFIXRXEUQUAE-MRXNPFEDSA-N 380.496 2.731 0 50 GFAA CC[C@@H](CO)NC(=O)Cc1c2c(n(Cc3ccc(F)cc3)c1C)CCCC2=O 95528704 ASJJMHZFKKNQAH-KRWDZBQOSA-N 386.467 2.933 0 50 GFAA COCc1nc(N(C)Cc2cc(-c3ccncc3)no2)cc([C@H]2C[C@@H](N)C2)n1 244718862 LSIGHEBUPQEXKS-GASCZTMLSA-N 380.452 2.514 0 50 GFAA CC(C)(C)[C@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C[C@H]1O 298844679 IFDHTCWZFQDKJK-DLBZAZTESA-N 381.480 2.750 0 50 GFAA O=C(O)[C@@H]1COCCN1C(=O)c1cc2ccccc2n1Cc1ccccc1F 299750004 MJBYBJMVUBVVMT-IBGZPJMESA-N 382.391 2.754 0 50 GFAA CCn1ncnc1[C@@H](C)NC(=O)N(C)CC1CCN(Cc2ccccc2)CC1 534644816 KOLWRHSTKHTGGZ-QGZVFWFLSA-N 384.528 2.913 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(Oc3ccc(F)cc3)CC2)CN1Cc1ccncc1 826588609 HRUNGOWPNZZXBJ-QGZVFWFLSA-N 397.450 2.639 0 50 GFAA CCN1CCN(CC(=O)Nc2cc(C)ccc2NC(=O)c2ccccc2)CC1 952992163 XXXVLWUOXXGMRZ-UHFFFAOYSA-N 380.492 2.823 0 50 GFAA COC(=O)c1ccc(NC(=O)NC[C@H](O)c2ccc(F)cc2)c(N(C)C)c1 170612047 WHNHNOTZQYEZKQ-KRWDZBQOSA-N 375.400 2.533 0 50 GFAA O=C(Cn1nnc(-c2ccc(Br)o2)n1)N1CCC[C@@H]2CCCC[C@H]21 408158835 OOGAGYJAJGFXCB-NWDGAFQWSA-N 394.273 2.877 0 50 GFAA O=C1CCc2cc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)ccc2N1 192218385 JZWYWZLINOODNZ-FQEVSTJZSA-N 393.487 2.592 0 50 GFAA Cc1cnc([C@@H](NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)C2CC2)s1 195305814 FJUUFFBQJLQMJZ-HNNXBMFYSA-N 379.507 2.583 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)N[C@H]1CC(=O)N(Cc2ccccc2)C1 1506401630 FLGAGLBMWNKXCE-KRWDZBQOSA-N 399.878 2.894 0 50 GFAA CN(C)C(=O)c1cncc(N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)n1 1704303854 CJGAKENXBZUTTG-UHFFFAOYSA-N 391.475 2.728 0 50 GFAA CCNC(=O)N1C[C@H]2CN(Cc3cccnc3N)C[C@@]2(CCc2ccccc2)C1 1772815607 PUJVFTUMQBIYRV-OFNKIYASSA-N 393.535 2.760 0 50 GFAA CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)c1cc(COc2ccc(F)c(F)c2)on1 11874308 NHDMOHPALHSBOC-LBPRGKRZSA-N 393.390 2.661 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)[C@@H]1CCC(=O)N(Cc2ccccn2)C1 11938131 VLOCQQJFHVGBOX-QGZVFWFLSA-N 390.443 2.792 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NCc1cccnc1N(C)Cc1ccccc1 12052858 PTHRQNGGPREQKO-UHFFFAOYSA-N 386.477 2.801 0 50 GFAA Cc1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)CCN2CCCC2=O)cc1C 12443040 YGTHGHLICVIMQI-IBGZPJMESA-N 380.492 2.995 0 50 GFAA CCOC(=O)[C@]1(CCc2ccccc2)CCCN(C(=O)CCN2CCCO2)C1 12586487 PPXAZKGXOMQKIR-QFIPXVFZSA-N 388.508 2.819 0 50 GFAA COc1cc(C[C@]2(CCC(=O)NCCc3ccncc3)CCC(=O)N2)ccc1F 14982685 ORCVLQLCLDMQBX-QFIPXVFZSA-N 399.466 2.560 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cc4c(nc3O)CCCC4)C1)CC2 1857701034 LBWVQWKNNIYNPU-JOCHJYFZSA-N 394.475 2.590 0 50 GFAA COc1c(C)cnc(CN2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1C 1857706866 UGDRAAKLGZMDMS-QFIPXVFZSA-N 381.476 2.956 0 50 GFAA Cc1cnccc1N1C[C@@H]2[C@H](CNC(=O)c3ccccc3F)[C@H]3CC[C@]2(C1)O3 1857715606 ZLHOFVNZRGLOPT-VTAPXXACSA-N 381.451 2.943 0 50 GFAA O=C(Cc1ccc(F)cc1)NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3 1875246356 NKDVBCNKJRMMNA-JZJXAQOMSA-N 381.451 2.563 0 50 GFAA Cc1c(C(=O)N(CCC(=O)O)C[C@@H]2CCCO2)cnn1-c1cccc(Cl)c1 237730791 ABSOSVORBVMJAU-INIZCTEOSA-N 391.855 2.930 0 50 GFAA COCCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)C1(c3ccccc3)CCCCC1)C2 247836957 JMASONCKDIFZHO-QUCCMNQESA-N 384.520 2.984 0 50 GFAA O=C(O)c1cnc(C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCCC2)cn1 263257865 IVFZHJYDSVUAGC-UHFFFAOYSA-N 388.811 2.707 0 50 GFAA N[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1)Cc1ccccc1 1875263859 WIWMSPQIMJQPIK-VXKWHMMOSA-N 393.531 2.687 0 50 GFAA COc1ccc(N2C(=O)C[C@H](SCC(=O)Nc3cccc(F)c3)C2=O)cc1 100033730 DSOYNAQGINVWNH-INIZCTEOSA-N 388.420 2.838 0 50 GFAA COCCN1C=C(C(=O)OC)C(c2ccccc2C(F)(F)F)C(C(=O)OC)=C1 2762155 CULAJLZTHFJYDC-UHFFFAOYSA-N 399.365 2.865 0 50 GFAA COc1c(F)cc(Cc2nc(-c3cccc(F)c3C)no2)cc1S(N)(=O)=O 2325869665 XMQZPHYOSRTZFA-UHFFFAOYSA-N 395.387 2.570 0 50 GFAA CCNC(=O)C[C@@H]1C(=O)N(c2ccc(C)cc2)C(=O)N1Cc1ccc(F)cc1 1127932 OSRSYOPFXTXZBT-GOSISDBHSA-N 383.423 2.998 0 50 GFAA Cc1ccc(O)c(NC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)c1 1177056 ZTMRYNMHZYBLSE-CQSZACIVSA-N 380.400 2.728 0 50 GFAA CCC(=O)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1=O 1210818 IHAUSTNZNZWKLF-LJQANCHMSA-N 380.444 2.808 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]3(CCc4c[nH]c(=N)nc43)C2)nc2ccccc12 2356153440 HHYRQWXTZGYXNB-JOCHJYFZSA-N 389.459 2.566 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CCC[C@@]34CCCN(C)C4=O)oc2c1OC 2356166128 VSBUUJRDYPNJIK-OAQYLSRUSA-N 386.448 2.985 0 50 GFAA CCC[C@@H]1CCc2c(sc(NC(=O)C3CCN(C(C)=O)CC3)c2C(N)=O)C1 6725813 FXNYZYYGJQZLKQ-CYBMUJFWSA-N 391.537 2.949 0 50 GFAA O=c1n(Cc2nc3ccccc3n2CCCCO)c2cnccc2n1C1CC1 28820871 KSHJXDWYTZJUEI-UHFFFAOYSA-N 377.448 2.703 0 50 GFAA in-vitro CCCN(CC1CC1)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(Cl)c(F)c1 55099960 NAJCLLSSCRPLMQ-SFHVURJKSA-N 395.906 2.818 0 50 GFAA Cc1c(C(=O)N(C)Cc2nc3ccc(F)cc3[nH]2)sc2ncn(C)c(=O)c12 55283534 JTSSMPUVUPZCAC-UHFFFAOYSA-N 385.424 2.591 0 50 GFAA CCCn1nnc(-c2cc(I)c(OC)c(OCC)c2)n1 10338042 FFTXTCNSGKHYFZ-UHFFFAOYSA-N 388.209 2.762 0 50 GFAA Cc1c(Cl)cccc1NC(=O)N1CCN(c2ccc(-n3cccn3)nn2)CC1 67612565 PMLZTWCPFVSHMR-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 127975343 RFKBIPPVGYKERZ-UHFFFAOYSA-N 378.215 2.795 0 50 GFAA Cc1cc(C)c(CNC[C@]2(O)CCCN(CCCc3ccccc3)C2=O)cn1 67947909 JJPTVPWGQUNSQI-HSZRJFAPSA-N 381.520 2.774 0 50 GFAA Cc1cc(C[C@H](C)Nc2ccc(C(=O)NCc3noc(C(C)C)n3)cn2)[nH]n1 67817298 QAKZCJLWHAXGSE-LBPRGKRZSA-N 383.456 2.593 0 50 GFAA Cc1ccc2nc(N3CCC[C@@H](O)C3)c(CN(C)CCc3cn[nH]c3)cc2c1 72433605 ZVFXNYLISFFJJZ-HXUWFJFHSA-N 379.508 2.902 0 50 GFAA COc1cc2c(cc1OC)CCN(C(=O)Nc1ccc(C(N)=O)c(F)c1)CC2 363123609 GFFSIJHHGWXICM-UHFFFAOYSA-N 387.411 2.575 0 50 GFAA C[C@H]1[C@@H](NC(=O)c2ccc(NC(N)=O)cc2)[C@H](C)CCN1C(=O)OC(C)(C)C 253418146 GYQYLMMDOQOUOD-WWGRRREGSA-N 390.484 2.941 0 50 GFAA O=S(=O)(N1CCCCCC1)N1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 155264192 BFEBWZWIPOBUFE-CVEARBPZSA-N 392.443 2.934 0 50 GFAA O=[S@@](Cc1cccc(-n2cccn2)c1)Cc1nc(O)cc(C(F)(F)F)n1 371869476 HSPZMLTXJRZAGY-SANMLTNESA-N 382.367 2.836 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(Cc3ccco3)CC2)C1 71763672 RBYZYDRFIYAZRV-IBGZPJMESA-N 382.508 2.667 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCN(C(=O)Nc2cc(C(N)=O)ccc2F)C1 454531581 YDUKMYFOJBBIOO-HNNXBMFYSA-N 384.455 2.910 0 50 GFAA CN1C(=O)[C@](CC(=O)NC2CCOCC2)(Cc2ccccc2)c2ccccc21 71552010 WRZXFZIQQGYAMT-QHCPKHFHSA-N 378.472 2.829 0 50 GFAA C[C@@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC[C@@H](c2ccnc(N)n2)C1 241383349 MUPOAQNQOQBHTP-MRESUBBGSA-N 383.540 2.712 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)N3CC[C@@H](c4ccccc4C(=O)O)C3)c2n1 72146297 CTZYOSMQLJWIIA-OAHLLOKOSA-N 378.432 2.982 0 50 GFAA CCCN(Cc1ccc(Cl)cc1)C(=O)C[C@@H]1C(=O)NCCN1CC(C)C 72153744 ZUEZPTHCMIQESS-GOSISDBHSA-N 379.932 2.925 0 50 GFAA Cc1nc2c(c(C)c1CCC(=O)N1CC[C@@H](Nc3ccccc3)C1)c(=O)[nH]n2C 174696939 UDGJUUWHKQZGAE-QGZVFWFLSA-N 393.491 2.524 0 50 GFAA O=C(c1csc(-c2cnccn2)n1)N1CCN(c2cc(F)ccc2F)CC1 175415267 RHJYNERLZOGLJF-UHFFFAOYSA-N 387.415 2.841 0 50 GFAA COc1ccnc(N2CCN(C(=O)N[C@@H](C)c3ccc4[nH]ccc4c3)CC2)n1 426488086 APCVTTPXRVNKQJ-AWEZNQCLSA-N 380.452 2.559 0 50 GFAA CN(C)C(=O)COc1ccccc1CN1CCC[C@@H](c2nnc3ccccn23)C1 179779663 NYHSVSAZHPWZCG-GOSISDBHSA-N 393.491 2.576 0 50 GFAA Cc1nccn1CCC(=O)N1CCC(c2nccn2Cc2cscn2)CC1 95520620 NDLVPNFDNAOJAW-UHFFFAOYSA-N 384.509 2.689 0 50 GFAA Cn1c(=O)c(C(=O)N2CCC[C@H](c3cccc(C(=O)O)c3)C2)nc2ccccc21 95365379 KARHQVOOOJXIDO-INIZCTEOSA-N 391.427 2.652 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1cnn2c1CCCC2 183043046 QXGPTMRQIVOPNP-OAHLLOKOSA-N 376.819 2.547 0 50 GFAA COc1ccc(-c2ccc(C(=O)N[C@H]3C[C@@H](c4cc(O)nc(N)n4)C3)o2)cc1 253535724 NZKJMYADNQPBLX-BETUJISGSA-N 380.404 2.709 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)c1 299338356 FTDAEVZVCXJBFP-ONERCXAPSA-N 385.869 2.601 0 50 GFAA COCCCn1cnnc1[C@H](C)NC(=O)Nc1ccc(-n2ccnc2C)cc1 299783634 WDSPIVFRYZQFAW-AWEZNQCLSA-N 383.456 2.691 0 50 GFAA NC(=O)c1noc(CNC(=O)N(CCC2=CCCCC2)Cc2ccccc2)n1 584893564 UXFZMJDVZVSARJ-UHFFFAOYSA-N 383.452 2.771 0 50 GFAA CN(Cc1csc(-c2ccccc2)n1)C(=O)N[C@]1(C)CCS(=O)(=O)C1 584902053 ZGURJWKAFOZEDI-QGZVFWFLSA-N 379.507 2.529 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1C[C@@H]2CC[C@H]1CN(Cc1ccc(F)cc1)C2 1565530847 CAUWTNMUASYOPJ-IRLDBZIGSA-N 382.479 2.984 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CNC[C@@H](C(=O)N(C)Cc3ncccc3C)C2)cc1 1565527876 KVLKTXOPOPGMPY-MSOLQXFVSA-N 380.492 2.521 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(S(=O)(=O)c2cc(C(N)=O)cs2)C1 952990327 XHYMDOICKPTLIG-AWEZNQCLSA-N 394.518 2.635 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CCc2nc[nH]c2[C@H]1c1cccnc1 952972678 HLNXCTXLRRGFOZ-OAQYLSRUSA-N 376.416 2.640 0 50 GFAA O=C(NS(=O)(=O)c1ccc2c(c1)CCC2)c1csc([C@H]2CCCO2)n1 165279954 DUQLKTNOPQWYJA-OAHLLOKOSA-N 378.475 2.602 0 50 GFAA COc1ccccc1-c1nc(C2CCN(C(=O)NCCN(C)C3CC3)CC2)no1 276832960 HNPYPBBZADEZIF-UHFFFAOYSA-N 399.495 2.728 0 50 GFAA CCc1ccccc1CC(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 188578566 DKFPZEQNPPRKAQ-LJQANCHMSA-N 378.538 2.645 0 50 GFAA CC[C@H](c1ccc(OC)cc1)N(C)S(=O)(=O)c1ccc(C(=O)NC)cc1 1505795098 FPEIDKBBYSRKKT-GOSISDBHSA-N 376.478 2.827 0 50 GFAA O=C(c1cccnc1)N1CCC(N[C@@H](CCn2cncn2)c2ccccc2)CC1 1506408354 XRPYGXQNTDNPBL-NRFANRHFSA-N 390.491 2.699 0 50 GFAA O=C(c1cc(O)nc2cc(F)ccc12)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529100012 MCVDBMIFLHCDCA-UYAOXDASSA-N 382.391 2.654 0 50 GFAA O=C(CC1=CCCC1)N1C[C@@H]2CN(Cc3c(F)cccc3F)C[C@]2(CO)C1 1772819765 SIQBZHHYRRNFSI-HRAATJIYSA-N 376.447 2.718 0 50 GFAA CCOC(=O)c1[nH]ncc1CN1CCC[C@@H](C(=O)c2ccc(OC)cc2C)C1 11663824 MIJKGAMPNGSFDQ-OAHLLOKOSA-N 385.464 2.998 0 50 GFAA O=C(CCC1CCN(C(=O)CCc2cnccn2)CC1)NCc1ccc(F)cc1 11767525 WJLNUESWQCXCKX-UHFFFAOYSA-N 398.482 2.884 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCSC)C3)C2=O)c1 12713588 AGALZDIFLVNUNU-FQEVSTJZSA-N 376.522 2.789 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(Cc1ccccc1)CC2 14752462 VPPRNLHOIWWEMZ-UHFFFAOYSA-N 378.476 2.901 0 50 GFAA CSc1ccccc1C(=O)N1CCC[C@H](CCC(=O)N2CCN(C)CC2)C1 14949898 LCJZAZMVTTWRNG-QGZVFWFLSA-N 389.565 2.815 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)Cc2ccc(Cl)cc2Cl)CC1 16579402 AGRCWWNUIYDPHI-UHFFFAOYSA-N 381.281 2.597 0 50 GFAA CCn1nccc1-c1nc(-c2nnn3c2CO[C@H](c2ccc(C)cc2)C3)no1 169781402 ZVIMEEVKVMZPFJ-INIZCTEOSA-N 377.408 2.791 0 50 GFAA COc1ccccc1C(=O)NCc1nnc2c(-c3nc(C(C)C)no3)cccn12 169776098 SYDIOSNQCXNJDR-UHFFFAOYSA-N 392.419 2.841 0 50 GFAA Cc1sc2ncnc(N3C[C@@H](O)[C@]4(C3)[C@H](c3ccccc3)[C@H]4CO)c2c1C 1857714658 GGOTZRQTOZVRGF-BZSOYRFXSA-N 381.501 2.881 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)NCc3ccc4cc[nH]c4c3)CC2=O)s1 1857734168 MGCAYRIZKPCAGI-AWEZNQCLSA-N 383.477 2.812 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3cnc4ccccc4n3)C1)CC2 1704350053 OEGDGXWMLDQCIW-JOCHJYFZSA-N 388.475 2.606 0 50 GFAA COC(=O)[C@H]1CC[C@H]2C(=O)N(c3ccc4cc(OC)c(OC)cc4c3)C(=O)N2C1 864565929 OPIZESBZVRJASQ-BBRMVZONSA-N 398.415 2.577 0 50 GFAA O=C(Cc1ccc(C(F)(F)F)nc1)Nc1cccc(N2CCCS2(=O)=O)c1 1875268503 MPMCLVUEOHLJHI-UHFFFAOYSA-N 399.394 2.822 0 50 GFAA CC(C)CO[C@H](C)c1noc(Cn2c(Cc3ccc(F)cc3)noc2=O)n1 1875316149 XNOOOSDCXAIFIN-GFCCVEGCSA-N 376.388 2.731 0 50 GFAA CS(=O)(=O)[C@H]1CC[C@@H](NC(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320342 PQJPZHIIKAAFBW-NEPJUHHUSA-N 376.400 2.673 0 50 GFAA O=C(O)[C@H]1CC[C@H]1C(=O)NC[C@H](O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1875303896 RFHFZUBIHYABRK-WOPDTQHZSA-N 399.287 2.985 0 50 GFAA Cc1[nH]c2ccccc2c1C1CCN(C(=O)[C@H](N)Cc2ccnc(O)c2)CC1 1875319500 FQGSBMRSQKGAIK-GOSISDBHSA-N 378.476 2.853 0 50 GFAA COC(=O)C1=CN(C2CC2)C=C(C(=O)OC)C1c1cc2c(cc1Cl)OCO2 717269 GGNYSTGKLBSWLH-UHFFFAOYSA-N 391.807 2.744 0 50 GFAA CCN1C(=O)N[C@H](c2ccc(Br)cc2)C(C(=O)OCCOC)=C1C 2757339 WCAKNJFIYPSXOD-OAHLLOKOSA-N 397.269 2.999 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](Nc3ccc(N(C)C)cc3)C2=O)cc1 4317751 QLFYKASLGYRDGE-SFHVURJKSA-N 381.432 2.673 0 50 GFAA Clc1cc(Br)cc2ccc(=NCc3cnn4c3CNCC4)[nH]c12 2325857098 PBVWOMKWIDGFNW-UHFFFAOYSA-N 392.688 2.984 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NC[C@H]3CCCO3)cc2)cc1 639865 IRUYXYLTCBAGIR-GOSISDBHSA-N 388.489 2.729 0 50 GFAA COc1ccc(COC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(O)c(OC)c2)cc1 716224 ITNSGLCHRFJDOV-IBGZPJMESA-N 398.415 2.781 0 50 GFAA O=C(NCc1ccccc1)NC(=O)c1ccccc1I 1188026 UODWJHAVPSIENF-UHFFFAOYSA-N 380.185 2.931 0 50 GFAA CCCc1cc(=O)n(-c2ccc(C(=O)N(C)[C@H]3C[C@H]4C[C@@H](O)C[C@H]4C3)cc2)[nH]1 2356146187 VYTLITNDOGHDDP-NFQUHZNNSA-N 383.492 2.740 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)Cn2c(C)cc(=O)c3ccccc32)C1=O 2356148138 IXEOGEIAFBOEOK-QHCPKHFHSA-N 395.503 2.704 0 50 GFAA Cc1ccc([C@@H]2[C@H](C(=O)OC(C)C)C(=O)C[C@@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 4142374 JKLWHFRPHNOWMT-NXWNEQKCSA-N 390.476 2.938 0 50 GFAA COc1ccc(CN(C(=O)c2ccccc2F)[C@H]2CCS(=O)(=O)C2)cc1 4182975 ARWQIUKZZYTWGF-HNNXBMFYSA-N 377.437 2.664 0 50 GFAA O=C1COc2ccc(CC(=O)N(Cc3ccsc3)C[C@@H]3CCCO3)cc2N1 55211117 VHCVFKRMDVQOAU-INIZCTEOSA-N 386.473 2.829 0 50 GFAA O=C1C[C@H](N2CCN(c3ccc(F)cc3)CC2)C(=O)N1c1ccc(Cl)cc1 100308894 IEPRAQQDOXGHSW-SFHVURJKSA-N 387.842 2.933 0 50 GFAA Cc1cc(N2CCN(C(=O)Nc3cccc(F)c3)CC2)nc(N2CCCC2)n1 64800118 GEVVVKUIUPTHEI-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(-c4ccc(O)c(OC)c4)[nH]c3C2)c1 65397919 OAEAKGZALNSIDB-CQSZACIVSA-N 379.416 2.869 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(Cc4noc(C(C)C)n4)[nH]c3C2)c1 67515286 GGRXNCGBJHKMBU-CYBMUJFWSA-N 381.436 2.585 0 50 GFAA COc1ccc(C(=O)NCc2ccc(-c3nnn[nH]3)cc2)c(OCC(C)C)c1 252507386 WJPRTNUZZWBDLV-UHFFFAOYSA-N 381.436 2.840 0 50 GFAA COc1cc([C@@H]2c3cc4c(cc3C[C@@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1O 3870962 RFDMNXDDRXVJTM-DPMMWBKBSA-N 384.384 2.615 0 50 GFAA biogenic O=C(NCc1n[nH]c2c1CCCCC2)c1cn(Cc2ccccc2Cl)nn1 72164196 IMPQYMYPKAKVSS-UHFFFAOYSA-N 384.871 2.902 0 50 GFAA CN(C)c1ccc(-c2cncc(C(=O)N[C@H]3CC(=O)N(C(C)(C)C)C3)c2)cc1 151525048 UXCZIUVKVSALQL-SFHVURJKSA-N 380.492 2.944 0 50 GFAA COC(=O)c1cc(NC(=O)c2ccc(-n3cncn3)c(F)c2)c(F)cc1F 153779768 FAHSYPCDQWNDBS-UHFFFAOYSA-N 376.294 2.724 0 50 GFAA C[C@@H](c1ccc(C(=O)N2CCC(N3CCC(O)CC3)CC2)o1)N1CCCCC1 72148761 WPCQWXVTLFEMSU-KRWDZBQOSA-N 389.540 2.888 0 50 GFAA C[C@@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1nc2ccccc2n1C 154179823 KLVWWRPPLOMNLA-OAHLLOKOSA-N 392.507 2.521 0 50 GFAA O=S(=O)(c1ccccc1CNc1ccc2ncccc2c1)N1CCOCC1 159125241 DKLXFTRCLDEVHT-UHFFFAOYSA-N 383.473 2.868 0 50 GFAA O=C(c1ccc(F)cc1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71776319 QHJUCRNUHNPOIY-SFHVURJKSA-N 387.499 2.765 0 50 GFAA CC(C)c1nc(C(=O)N2CCSC[C@H]2CC(=O)O)nn1-c1cccc(F)c1 262212185 UGCYXJWUDIMCKF-CQSZACIVSA-N 392.456 2.562 0 50 GFAA O=C(c1ccc(Cl)c(F)c1)N1CC[C@@H]2[C@@H](CCC(=O)N2CCCCO)C1 72447455 UEIGEWQVURHOLA-WMLDXEAASA-N 382.863 2.705 0 50 GFAA Cn1cccc1[C@@H]1CCCCN1C(=O)CNC(=O)c1cnc2ccccc2c1O 174398515 NQXRQHVISWSEDD-IBGZPJMESA-N 392.459 2.763 0 50 GFAA C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N(C)C[C@@H]2CCCCO2)c1 133980375 XOAFJOUHTHDRBM-WMZOPIPTSA-N 394.537 2.891 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)NCc2cc(Cl)cc(Cl)c2)CCC(=O)N1 222461281 XMIPSHLHALPVSL-KRWDZBQOSA-N 387.263 2.903 0 50 GFAA CCCC[C@@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)C1CCN(C)CC1 82166641 QSKKKWNDDAXUNA-GOSISDBHSA-N 387.524 2.771 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)Nc1nnc(C2CC2)s1 44901075 WDAJBFKDSUKQIJ-UHFFFAOYSA-N 387.852 2.931 0 50 GFAA CN(CC1(CO)CCC1)C(=O)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91829303 VLMLBZVKRDHZDY-INIZCTEOSA-N 378.900 2.700 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N2CC[C@@H](N)C2)c1 95519270 STTBUBXANRTVMM-MRXNPFEDSA-N 387.524 2.654 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC(CCC(=O)NC[C@H]4CCCO4)CC3)ccc21 95506328 DSCIZGIMEDCDKN-GOSISDBHSA-N 398.507 2.501 0 50 GFAA Cc1cc(C(F)(F)F)n(-c2nc(C(=O)N3CCc4[nH]cnc4C3)cs2)n1 95360497 RKKOUWHIHTWTFT-UHFFFAOYSA-N 382.371 2.578 0 50 GFAA Cc1cc(N2CCC(NCC3(c4ccccc4)CCOCC3)CC2)nc(N)n1 95371181 NLWYAZREEKLIFN-UHFFFAOYSA-N 381.524 2.674 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCc2[nH]c(-c3cccc(C(=O)O)c3)nc2C1 244633404 GCJGUODORPTOEQ-UHFFFAOYSA-N 379.420 2.649 0 50 GFAA CCS(=O)(=O)c1cccc(S(=O)(=O)Nc2ccc(C(F)(F)F)cn2)c1 182749963 IZOJNLGCTNCDND-UHFFFAOYSA-N 394.396 2.695 0 50 GFAA Cc1nc(CN(C)Cc2csc(-c3ccc(S(C)(=O)=O)cc3)n2)no1 183725752 YJVITZKXXIHWLW-UHFFFAOYSA-N 378.479 2.537 0 50 GFAA Cc1nc(CNC(=O)C[C@H]2C(O)=NCCN2Cc2cccs2)sc1C 39532889 PKTPFDCZPCQMCL-AWEZNQCLSA-N 378.523 2.669 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCC(N(C)CCN(C)C)CC1 822535027 SNCXWGPFUYTURV-UHFFFAOYSA-N 394.947 2.787 0 50 GFAA COc1ccc2[nH]c(CN3CCN(c4ccc5nccn5n4)CC3)c(C)c2c1 824757906 VXOYGFQHYNMXSR-UHFFFAOYSA-N 376.464 2.850 0 50 GFAA COc1cc(-c2nn3c([C@@H]4CCCN(C)C4)nnc3s2)cc(OC)c1OC 824585959 WXFWIZUTLNZXFN-LLVKDONJSA-N 389.481 2.688 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2cn(CC(F)(F)F)nc2C)C1 268622267 BSQLSBSWQLHGMN-CYBMUJFWSA-N 382.386 2.771 0 50 GFAA O=C(Cc1cccs1)NC[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 952867262 LFSBNCQEJVTMPL-OAHLLOKOSA-N 394.500 2.902 0 50 GFAA C[C@H](CCc1ccccc1)NC(=O)COC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 221960452 SNRRSISAICTNDZ-NVFUDODSSA-N 385.504 2.998 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)O 268929046 IHQBBFSQJQPLTC-LJQANCHMSA-N 384.432 2.998 0 50 GFAA CCc1ccc(N2C[C@@H](c3nc(Cc4cccc(C(N)=O)c4)no3)CC2=O)cc1 274008831 VXDXFLHIHQAQMS-KRWDZBQOSA-N 390.443 2.842 0 50 GFAA O=C(CCC(=O)N[C@H]1COC[C@@H]1Cc1ccncc1)Nc1ccc2c(c1)CCC2 1615956242 UPKLNVJVJGWWBO-FPOVZHCZSA-N 393.487 2.663 0 50 GFAA O=C(c1ccccc1-c1nn[nH]n1)N1CCC2(CC1)OCCc1ccsc12 1704345268 VNMCTAKJMPIWLD-UHFFFAOYSA-N 381.461 2.632 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H](C)n3cc(C)cn3)CC1)OCC2 1704300481 XQNFRKMMZUVKSV-INIZCTEOSA-N 399.491 2.860 0 50 GFAA CCCOc1ccccc1-c1nnc(NCC2(CN3CCN(C)CC3)CC2)o1 1772710211 PEYYZGDJSAMRSA-UHFFFAOYSA-N 385.512 2.965 0 50 GFAA Cn1cc(CN2CC(=O)N(C3CCCCC3)C[C@@H](OCc3ccccc3)C2)cn1 14732382 OFQLOKCYNBUICD-QFIPXVFZSA-N 396.535 2.982 0 50 GFAA O=C1c2cccc(N3CCN(C4CCCC4)CC3)c2C(=O)N1C[C@H]1CCCO1 15000925 OTERZWCLUZOQHT-QGZVFWFLSA-N 383.492 2.526 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)C1(CCN(c3ncc(F)cn3)CC1)OCC2 1857682212 GTQOFPOMTCYVMZ-UHFFFAOYSA-N 390.484 2.884 0 50 GFAA O=C(O)c1cc2c(s1)C1(CCN(C(=O)c3cc(C4CC4)[nH]n3)CC1)OCC2 1857689560 HEQYGEAPXMXPPM-UHFFFAOYSA-N 387.461 2.751 0 50 GFAA COc1ccccc1Cc1nc([C@H]2CCn3nccc3C2)n(-c2ccnn2C)n1 1857697552 CREXNNRYPKTWNT-INIZCTEOSA-N 389.463 2.527 0 50 GFAA C[C@@H]1CN2C[C@H](NS(=O)(=O)c3cccc4cccc(Cl)c34)C[C@H]2CO1 1857730821 YPTYASPKMBGVDH-YUELXQCFSA-N 380.897 2.633 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCC2CC2)C[C@H]1NC(=O)c1c(C)noc1C 1875250606 QGIJVNZMZXENDL-GVDBMIGSSA-N 377.485 2.511 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@H]1/C(=C/OC)C(=O)OC 254704036 DAXYUDFNWXHGBE-GMEDPQTISA-N 384.476 2.700 0 50 GFAA biogenic CCc1nc(C(=O)N2c3ccccc3C[C@H]2C(N)=O)nn1-c1ccccc1Cl 155206846 ORTKDAFOPFCCOF-INIZCTEOSA-N 395.850 2.540 0 50 GFAA Cc1nc2c(NCc3cccc(S(C)(=O)=O)c3)nccn2c1Br 498051077 LBULOYRAFWHTHY-UHFFFAOYSA-N 395.282 2.816 0 50 GFAA COC(=O)C1=NO[C@@]2(CCCN(C(=O)N[C@@H](C3CCCC3)C(F)(F)F)C2)C1 1875296460 YGJNGHIGGOVQSQ-BBRMVZONSA-N 391.390 2.601 0 50 GFAA CC(C)Cc1ccc(CCC(=O)N2C[C@H]3C[C@H]2[C@H]3c2ocnc2C(N)=O)cc1 1875394645 QKGHTWLGYSEVKI-AOIWGVFYSA-N 381.476 2.919 0 50 GFAA Cc1nccn1-c1cc(C(=O)N=[S@](C)(=O)[C@H]2CCOC2)c2ccccc2n1 1875392317 QQBDUTRQAVXBPA-PGGUUEOZSA-N 384.461 2.756 0 50 GFAA CCc1cccc(S(=O)(=O)NC(=O)[C@@H]2[C@H]3CC[C@@]2(c2cncs2)C3)c1 1875404431 IQSXLGRVKWRLLT-OWQGQXMQSA-N 376.503 2.878 0 50 GFAA O=C(NC1(C2CCN(c3cncc(Cl)n3)CC2)CC1)c1cccn2nccc12 1775990023 BVPIDVRWXKXGGX-UHFFFAOYSA-N 396.882 2.957 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)N2CCc3ccccc3C2)CC[C@H]1Nc1cc(C)ncn1 2100555547 WELQJIXXXXFGTH-DFQSSKMNSA-N 380.492 2.966 0 50 GFAA COc1ccc(CC(=O)N[C@H]2C[C@H](C)N(C(=O)c3cc4cnccc4[nH]3)C2)cc1 2325806548 RQUIWISIESPYST-YOEHRIQHSA-N 392.459 2.533 0 50 GFAA O=C(N=c1cc(-c2cccc3c2OCC3)[nH][nH]1)[C@@H]1CCN(Cc2ccccc2)C1 2325859603 CVZGWSRCDGBBEO-GOSISDBHSA-N 388.471 2.894 0 50 GFAA Cc1ccc(Cl)cc1N(CC(=O)Nc1ccccc1C(=O)O)S(C)(=O)=O 2170339 XYORHVIRBPKHHV-UHFFFAOYSA-N 396.852 2.751 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@H]3CC(C)=C(C)C[C@@H]3C(=O)O)CC2)c1 6727039 NMRKHYOCKIUMBD-PMACEKPBSA-N 386.492 2.787 0 50 GFAA COC(=O)c1c(NC(=O)C2CCN(C(C)=O)CC2)sc2c1CC[C@H](C)C2 6730908 CJIYNJDKRYQJQX-NSHDSACASA-N 378.494 2.857 0 50 GFAA CCCCOC[C@H](O)CN(C)C[C@H](O)COc1ccccc1C(F)(F)F 225718392 RDTMYQSWXRHQEB-CABCVRRESA-N 379.419 2.555 0 50 GFAA Cc1cccc(-n2nnc(C(=O)Nc3ccc(N4CCOCC4)cc3)c2C)c1 9970591 PRTAQCGKZDYVSD-UHFFFAOYSA-N 377.448 2.973 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)NCCc3nc4c(s3)CCC4)CC2=O)cc1 55071266 KZYYEASFCZICPL-MRXNPFEDSA-N 383.517 2.648 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCC(n2cc(-c3ccccn3)nn2)CC1 55309272 URMYDJGTKFMDNY-UHFFFAOYSA-N 392.419 2.938 0 50 GFAA CCNC(=S)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O 100578262 NKCBHPCLDNKURB-GOSISDBHSA-N 399.491 2.897 0 50 GFAA Cc1nc(CCN(C)C(=O)c2cc(-c3cnn(C)c3)nc3cc(F)ccc23)no1 63870635 VWTJLTIGIIAVPS-UHFFFAOYSA-N 394.410 2.781 0 50 GFAA Cc1cc(NC(=O)C(=O)N2CCC[C@H](c3[nH]ncc3-c3ccccc3)C2)no1 67741862 VJYJVUZKXPLCJA-HNNXBMFYSA-N 379.420 2.718 0 50 GFAA Cc1n[nH]c2ncc(NC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cc12 126186568 DDDFVUBZKCXLHG-UHFFFAOYSA-N 399.476 2.693 0 50 GFAA CC(C)C(=O)Nc1ccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cc1 172711974 NRDZZWIZMHVEAP-NRFANRHFSA-N 395.503 2.798 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2N[C@H](C)Cn2cc(Br)cn2)cn1 328632289 LIFVECVNDNPFHW-XFJVYGCCSA-N 395.305 2.700 0 50 GFAA COc1cc(CC2CN(C(=O)NC[C@H]3CCN(CC(C)C)C3)C2)cc(OC)c1 363969794 LEVGPRNHOOGLDC-QGZVFWFLSA-N 389.540 2.866 0 50 GFAA O=C(Cc1ccc2c(c1)CCC2)NCc1ccccc1CN1CCC(O)CC1 176042671 FCFVQPVCZZAFKA-UHFFFAOYSA-N 378.516 2.991 0 50 GFAA O=C(Cn1cc(-c2ccccc2)nn1)NC1(c2ccc(F)cc2)CCOCC1 178153178 WNUIEMCHEYNKGQ-UHFFFAOYSA-N 380.423 2.906 0 50 GFAA Cc1ccc(-c2cccc(C(=O)NCC3(CN4CCN(C)CC4)CC3)c2)cn1 426387062 ITUMZLICJBGWLL-UHFFFAOYSA-N 378.520 2.814 0 50 GFAA CCOC(=O)N1CCC[C@H](CCC(=O)N2CCN(Cc3ccccc3)CC2)C1 95516984 LQMIUPYICVNSQY-HXUWFJFHSA-N 387.524 2.980 0 50 GFAA CC(C)Sc1ccccc1N1CCN(CCCCN2C(=O)CNC2=O)CC1 96027649 PGKRFXMVKLMWLX-UHFFFAOYSA-N 390.553 2.641 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(CCN(C)C)C3)CC2)c(F)c1 91974410 RSTINPYMIHNNEC-UHFFFAOYSA-N 375.488 2.541 0 50 GFAA CCc1nc(C)ccc1OCC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)C1CCC1)C2 95363822 OEAGBRPZUBPASP-FUHWJXTLSA-N 385.508 2.581 0 50 GFAA O=C1COc2cc(NC(=O)N3CCC[C@H](OCc4cccnc4)C3)ccc2N1 97743496 ZTHMMCIANDSWRK-INIZCTEOSA-N 382.420 2.626 0 50 GFAA CC(=O)c1cc(CC(=O)N2C[C@H]3CC[C@@H]2CN(C2CCOCC2)C3)cs1 95392729 MUJQJWHPFXCCBF-MAUKXSAKSA-N 376.522 2.595 0 50 GFAA CCc1ccccc1NC(=O)N1CC[C@H](N2CCOCC2)[C@H](CCC(=O)O)C1 91690393 KQFNCYSMWUJSSO-MJGOQNOKSA-N 389.496 2.668 0 50 GFAA CCN(c1cc(C)nc(Nc2c(F)cccc2F)n1)[C@@H]1CCS(=O)(=O)C1 243463154 NIHOWQVNZVWNAO-GFCCVEGCSA-N 382.436 2.820 0 50 GFAA CCc1cccc(NC(=O)[C@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)n1 1940198216 VJEIGVBTXOUHRN-ZDUSSCGKSA-N 399.447 2.661 0 50 GFAA Cc1occc1C(=O)Nc1nc2c(s1)C(=O)C[C@@H](C(=O)N(C)C(C)C)C2 299763969 ZOKPOXOTOZWDOV-NSHDSACASA-N 375.450 2.909 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NC2Cc3ccccc3C2)CN1Cc1ccccc1Cl 299777141 JLCOCYZUCBLOEE-CTNGQTDRSA-N 383.923 2.786 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)[C@@H]1C[C@H]1c1ccccc1 828111555 ZHIOHQAMBLFABA-VQTJNVASSA-N 380.444 2.666 0 50 GFAA O=C(COCc1ccccc1)NC[C@@H]1CCCN(C(=O)Cc2cccc(F)c2)C1 828022164 APNCUYPJXKZHSN-FQEVSTJZSA-N 398.478 2.940 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)NCc1nc2ccc(F)cc2[nH]1 670469068 DWCCHZLUAAFWTH-UHFFFAOYSA-N 385.424 2.675 0 50 GFAA O=S(=O)(NCCCN1CCC[C@@H](CO)C1)c1ccc(-c2ccccc2)cc1 670470266 YLFQEZDZZHNXEU-GOSISDBHSA-N 388.533 2.726 0 50 GFAA CC(C)n1ncc2c1[C@@H](NC(=O)Cc1cccc(NS(C)(=O)=O)c1)CCC2 1338005556 RBILUHWYUBKDKI-KRWDZBQOSA-N 390.509 2.572 0 50 GFAA CCN1CC[C@@H](CN(CC)Cc2cccn2S(=O)(=O)c2ccccc2)C1 952984026 ZAWFEOXHOXTOCF-GOSISDBHSA-N 375.538 2.889 0 50 GFAA Cc1ccc([C@H](CNC(=O)Cc2c(C)nc(O)nc2O)N2CCC(C)CC2)cc1 952967513 LWDGUAFSVRUXPW-IBGZPJMESA-N 398.507 2.637 0 50 GFAA CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 271596646 TVNLRDCOZNVTLO-VKJFTORMSA-N 375.448 2.615 0 50 GFAA Cc1nnc(S)n1CCNC(=O)[C@@H]1C[C@H]1c1ccccc1Br 170644559 SKPPOGJKLLWESJ-NWDGAFQWSA-N 381.299 2.558 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)NCc2csc(-c3cccs3)n2)C1 1506400593 BCABGZJABIMBCB-GFCCVEGCSA-N 387.552 2.564 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)CCn2c(O)nc3ccccc32)C1 1506422161 PBZJAUOLLMLGJC-HNNXBMFYSA-N 378.432 2.649 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)Cc3ccccc3C(F)(F)F)C[C@@H]12 1704300562 XQXMEBCPPLAGSK-QAPCUYQASA-N 384.398 2.645 0 50 GFAA Cc1c(C(=O)N(C)C)sc2ncnc(NC[C@H]3COc4ccccc4O3)c12 12031550 NNVWKPNWYYWNBA-LBPRGKRZSA-N 384.461 2.953 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)c1cn(CCc2ccccc2)nn1)C(C)C 12594948 ITEMWQBZEFLJIR-UHFFFAOYSA-N 380.496 2.922 0 50 GFAA O=C(C1CCN(S(=O)(=O)CCCc2ccccc2)CC1)N1CCCCC1 16625278 WURSLYXBUNJUAG-UHFFFAOYSA-N 378.538 2.674 0 50 GFAA Cc1ccc(C2(C(=O)N[C@H]3C[C@H](Cn4ccnc4)C[C@@H]3O)CCOCC2)cc1C 1857527513 DBSKQPHWJJGNCD-JBACZVJFSA-N 397.519 2.504 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCNC(=O)[C@@H]1c1cccc(F)c1 1857671290 SIKRQEVSCGTPSL-SFHVURJKSA-N 396.397 2.977 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCCc3ccccn3)sc12 1857691654 UUHLDIDRCHJRDX-UHFFFAOYSA-N 385.533 2.999 0 50 GFAA CCN=c1ncc(CN2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)c[nH]1 1857697644 GFVLDWUENYHINF-WOJBJXKFSA-N 382.508 2.578 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)N(CCO)Cc1ccccc1 1857717213 NNDZNJMLQGLWLS-SFHVURJKSA-N 394.475 2.850 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@H](Cc1ccccc1)C(=O)O 236830827 SZJPSLQMJNLSKZ-WOJBJXKFSA-N 378.428 2.763 0 50 GFAA CSc1cccc(CN2CC[C@H](N3CCN(c4ccccn4)CC3)[C@@H](O)C2)c1 247806884 ACNZSTZGHWXROY-SFTDATJTSA-N 398.576 2.561 0 50 GFAA Cc1c(C(=O)NC2CCC(C(=O)O)CC2)nnn1-c1ccc(F)c(Cl)c1 261993444 CYKSXFAEAHHZIC-UHFFFAOYSA-N 380.807 2.741 0 50 GFAA O=C1CCCN1CC[C@H]1CN(C(=O)COCc2cccnc2)c2ccccc21 805188928 KSWWDGSDCUQZIN-SFHVURJKSA-N 379.460 2.741 0 50 GFAA Ic1cc(-c2noc([C@@H]3CCc4nn[nH]c4C3)n2)cs1 952892577 DXIJVXDOSXEWHO-ZCFIWIBFSA-N 399.217 2.793 0 50 GFAA C[C@H](c1ccc(F)cc1)N1C[C@@H](C(=O)N[C@H]2CCc3cc(CN)ccc32)CC1=O 1875301154 BQEIAZPFELDXED-IBZMOEQTSA-N 395.478 2.998 0 50 GFAA Cc1c(N2C(=O)[C@@H](c3cccc(O)c3)N(C)C2=O)nnn1Cc1ccccc1F 1875337292 WCTBGBAWJCFZEJ-QGZVFWFLSA-N 395.394 2.619 0 50 GFAA COCCn1c([C@@H]2C[C@H]2C)nnc1N1CCN(c2ncc(C)c(C(C)C)n2)CC1 2325769229 ZJBNVMYPKLFKTA-NVXWUHKLSA-N 399.543 2.596 0 50 GFAA Cc1cc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H]4NC(=O)[C@@H](C(C)C)N(C)C)cn2c1 2325793671 CWOKUFYNXFNKJJ-MXEMCNAFSA-N 396.535 2.696 0 50 GFAA CN1CC2(CCN(S(=O)(=O)Cc3cc(Cl)sc3Cl)CC2)OC1=O 2325817893 BGAZLUJJIHJPNU-UHFFFAOYSA-N 399.321 2.801 0 50 GFAA O=C(/C=c1/nc(O)/c(=C/c2ccsc2Br)s1)c1ccco1 2325854518 HVLYECZQYBWXKM-IODUZNRKSA-N 382.260 2.758 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)N(C)C[C@@H]2CCCC[C@H]2O)C1 245973610 OIDNBQZLAYUGRP-ZIFCJYIRSA-N 375.513 2.714 0 50 GFAA Cc1cccc(C)c1-n1nnnc1SCC(=O)Nc1ccc2c(c1)OCO2 1115115 RAZZLSWTBMIONK-UHFFFAOYSA-N 383.433 2.739 0 50 GFAA O=C([C@@H]1CCCNC1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1[C@H]2Cc1ccccc1 2356153027 NVPLMTAAFBHSAS-VROINQGHSA-N 381.564 2.930 0 50 GFAA Cc1cccc(CN2CCN(Cc3cccn3-c3ccccn3)C[C@H]2CCO)n1 104469949 NXCBDXYTEBXFTQ-OAQYLSRUSA-N 391.519 2.645 0 50 GFAA CCc1nc2n(n1)C[C@H](NC(=O)c1csc(Cc3ccc(F)cc3)n1)CC2 114867930 QLHFTGFJSOAICJ-CQSZACIVSA-N 385.468 2.772 0 50 GFAA C[C@@H]1CCc2ccccc2N1C(=O)CN1CCN(Cc2cccc(O)c2)CC1 471184399 BVCFHTRWPMVWER-GOSISDBHSA-N 379.504 2.878 0 50 GFAA Cn1cc(CN2CCC[C@H]2c2ccc(C(=O)NCCc3c[nH]cn3)s2)cn1 20168616 WSMZAOMPCRAUFD-INIZCTEOSA-N 384.509 2.514 0 50 GFAA C[C@H]1CCc2ccccc2[C@@H]1NC(=O)C1CCN(c2ccc3nncn3n2)CC1 122616726 LXGWDBNSPARLJP-YCRPNKLZSA-N 390.491 2.781 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)cc1 171988724 QJRABYGRKCJWPK-FPOVZHCZSA-N 393.487 2.614 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)CCn3ccc(C)n3)CC2)OC1=O 77285072 UWCONHLLCXFCHD-UHFFFAOYSA-N 376.501 2.975 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 363984035 QHVBJAJANWOKLY-UHFFFAOYSA-N 379.420 2.547 0 50 GFAA O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CCC[C@@](O)(CO)CC1 72171261 UCUCPQZRWWTANY-QFIPXVFZSA-N 377.444 2.646 0 50 GFAA COc1ccc(Cn2ncc(C)c2NC(=O)c2cc(N(C)C)ccn2)cc1OC 130710240 BYJJOALQQMITOR-UHFFFAOYSA-N 395.463 2.970 0 50 GFAA CNC(=O)CC1CCN(C(=O)c2c[nH]nc2-c2cccc(OC(F)F)c2)CC1 173810833 KTVGQMYDZHCQHH-UHFFFAOYSA-N 392.406 2.666 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCN(c3ccccc3C)C(=O)C2)cn1 82138936 GRHVQEXQQQIITN-UHFFFAOYSA-N 390.443 2.678 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)NCc2cc3cc(Cl)ccc3[nH]2)CCC(=O)N1 222890949 MSUGZYBIMPRKJY-IBGZPJMESA-N 391.855 2.731 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@@H]2CCCN(CCc3ccc(OC)cc3)C2)cn1 95505216 WAFGUTOCABZSMK-SFHVURJKSA-N 397.523 2.554 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCc1nc(Cc3ccccc3)no1)C2 95383389 OUDLWALWKLYDGK-INIZCTEOSA-N 379.416 2.537 0 50 GFAA CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)N1Cc2cnn(-c3ccccc3)c2C1 296704328 VBTQIGAAOFWXKN-VQIMIIECSA-N 381.480 2.591 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC[C@@H](CN3CCCC3=O)C2)c(C)c1 299795227 LOYKXGHVFSBWQS-INIZCTEOSA-N 386.496 2.611 0 50 GFAA CCCc1nc(C)cc(N2CCC[C@@H](CNC(=O)c3c(C)ncnc3C)C2)n1 823015237 SJXLLGIUJKCZNH-KRWDZBQOSA-N 382.512 2.791 0 50 GFAA O=C(Cc1cccs1)NC[C@H]1CCCN(CCn2c(=O)oc3ccccc32)C1 827855711 XUSVANTWYBUUNK-MRXNPFEDSA-N 399.516 2.727 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCC[C@H]1c1ccccc1I 859383918 PQSOQHMVUGUDEO-AWEZNQCLSA-N 398.244 2.599 0 50 GFAA C[C@@H]1C(=O)N(Cc2ccccc2)CCN1C(=O)CCn1cnc2ccccc21 952981924 DVCCYDVEOKSQLP-QGZVFWFLSA-N 376.460 2.686 0 50 GFAA CCc1nnc([C@H]2CN(S(=O)(=O)c3cc(Cl)sc3Cl)CCO2)o1 275368491 WTSNCTDAGUHJSE-SSDOTTSWSA-N 398.293 2.763 0 50 GFAA C[C@H]1C(=O)NCCN1C(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1 170795519 LBJJHHOCMRURRF-LBPRGKRZSA-N 384.823 2.746 0 50 GFAA Cc1ccccc1[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 191672689 FBTIXEKZLGRDMA-ZWKOTPCHSA-N 398.484 2.878 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(C(=O)c3ccc(CN4CCC(C)CC4)o3)CCN21 1616075361 CAWHCRMOGJCMJC-MOPGFXCFSA-N 389.540 2.837 0 50 GFAA CCC(=O)N1CCC(C(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)CC1 1704277913 PGECEGTUDUYUDO-NQIIRXRSSA-N 395.503 2.557 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@H]2CC[C@H](O)CC2)ccc1F 1704325610 QQJPBAGRFVAYFI-JOCQHMNTSA-N 377.416 2.589 0 50 GFAA O=C1CO[C@@]2(CCN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)C2)CN1 1772807980 DKIXVDAYQWJNOM-IBGZPJMESA-N 376.884 2.659 0 50 GFAA COC(=O)CCCC(=O)N(C)CC1CCN(CCc2ccccc2OC)CC1 12112022 KWBRABUTAAUGIA-UHFFFAOYSA-N 390.524 2.751 0 50 GFAA Cc1c(C(=O)N2CCOCC2)sc2ncnc(NCCc3ccccn3)c12 12132430 XKVPSOHPQOPWPH-UHFFFAOYSA-N 383.477 2.522 0 50 GFAA O=C(CNC(=O)N1CCc2c([nH]c3ccccc23)C1)Nc1ccc2c(c1)OCO2 12296559 XGGNOZWMSTURCK-UHFFFAOYSA-N 392.415 2.603 0 50 GFAA biogenic NC(=O)C1CCN(C(=O)c2cccc(OC3CCN(C4CCCC4)CC3)c2)CC1 12314617 CGLIQZDOUJDCRK-UHFFFAOYSA-N 399.535 2.810 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN2Cc2cnc(C)n2C)cc1 12433650 AOWUPSCGJUTLGL-HXUWFJFHSA-N 378.480 2.826 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12712633 QDBKCDZUOFJTGA-GOSISDBHSA-N 386.464 2.518 0 50 GFAA COc1ccc(CN2CCc3nnc([C@H](CC(C)C)NC(C)=O)n3CC2)cc1C 14967903 MYXSAGZPHSXMMF-IBGZPJMESA-N 399.539 2.877 0 50 GFAA COc1ccc([C@H](C)NC(=O)CN2C(=O)C(c3ccccc3)=NC2(C)C)cc1 169765561 LAXYZHWBORZLTM-HNNXBMFYSA-N 379.460 2.940 0 50 GFAA O=C(CN1C(=O)C(c2ccccc2)=NC12CCCC2)Nc1ccc2c(c1)OCO2 169765582 JEGIPKKCVWOMSE-UHFFFAOYSA-N 391.427 2.956 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)N[C@H](C)c3cnn(C)c3)sc12 1857681651 BGVASMFAQZBUOQ-CQSZACIVSA-N 388.537 2.856 0 50 GFAA CCOc1cc(CN2CC[C@H](O)[C@@]3(CCCNC3=O)C2)cc(Cl)c1OCC 1857703169 MCRDEERLMXSQOU-FXAWDEMLSA-N 396.915 2.600 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCC[C@@H](CNC(=O)c3ccc4nc[nH]c4c3)C2)no1 1857704054 BNFHWAOFWWCDMK-HIFRSBDPSA-N 381.436 2.578 0 50 GFAA CC1(C(=O)N2C[C@@H](C(=O)O)C3(CCN(Cc4ccncc4)CC3)C2)CCCC1 1857704760 FEVTVKSJTWBICR-SFHVURJKSA-N 385.508 2.787 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cccc3[nH]ccc23)N1Cc1cnc2ccccn12 1857706780 QRLWBVXRQNSIJR-PMACEKPBSA-N 399.454 2.831 0 50 GFAA CN(Cc1ncon1)C(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857731124 AFSYSTKVQLVOOY-NSHDSACASA-N 375.816 2.739 0 50 GFAA C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccnc(N3CCCCC3)c2)C1=O 126755010 FXNZUXFXBQNVFD-INIZCTEOSA-N 394.475 2.502 0 50 GFAA CC(C)c1cc(C(=O)N2C[C@H]3CC[C@@H](C2)N(Cc2ccccc2)C3)nc(N)n1 248204648 ZEHFCGXXLARORL-ROUUACIJSA-N 379.508 2.919 0 50 GFAA O=C(CCc1cscn1)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1 262715050 GMYOHEYOEHBTJL-MRXNPFEDSA-N 387.461 2.794 0 50 GFAA CN(C)c1ccc(C(=O)N[C@H]2C[C@H](S(=O)(=O)c3ccccc3)C2)c(F)c1 871400442 YTZWMUVXSRYSPY-SAZUREKKSA-N 376.453 2.626 0 50 GFAA CC(=O)Nc1cnc(C)c(C(=O)NCc2cccc(C(=O)N3CCCCC3)c2)c1 1875274053 CXFVCXDQUWJIFV-UHFFFAOYSA-N 394.475 2.905 0 50 GFAA CC1(C)NC(=O)O[C@@]12CCN(c1ncc(C(=O)NC3CCCC3)cc1Cl)C2 1875397138 NJODHHUWEZCKRV-LJQANCHMSA-N 392.887 2.875 0 50 GFAA CCC[C@@H](C)N(C)C(=O)[C@H](Cc1cn(-c2cncc(C(=O)O)c2)nn1)C1CC1 1875326154 CJZPOMFOKPIZGN-FZKQIMNGSA-N 385.468 2.576 0 50 GFAA O=C(O)c1ccc(C(=O)NCc2ccccc2-n2cc(-c3nccs3)nn2)o1 1875326806 NFHMKFSQVWRODH-UHFFFAOYSA-N 395.400 2.612 0 50 GFAA CCOc1ccccc1[C@H](C)N[C@@H]1CCN(c2nc(C(N)=O)nc(C)c2C)C1 1875397751 MHURYILIWZMOMP-JKSUJKDBSA-N 383.496 2.521 0 50 GFAA Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)C1 888095916 FIBXZAOTTICNBT-ARFHVFGLSA-N 379.526 2.623 0 50 GFAA CCCN1C(=O)[C@@]2(CCN(C(=O)Cc3cn4ccsc4n3)C2)c2ccccc21 2100540547 LHNULYLVMMPELV-OAQYLSRUSA-N 394.500 2.865 0 50 GFAA COc1ccc(-c2coc3cc(OCC(=O)N4CCOCC4)ccc3c2=O)cc1 2325726195 ANFWJWPINMNGII-UHFFFAOYSA-N 395.411 2.706 0 50 GFAA C[C@H]1Cc2ccc(F)cc2CN1C(=O)NCc1cccc(-n2cc(CN)nn2)c1 2325761980 WOHUHGJDIDBOJH-AWEZNQCLSA-N 394.454 2.522 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC1CC1 1167286 QWABMMNUHMYYIT-UHFFFAOYSA-N 378.881 2.810 0 50 GFAA Cc1ccc(O)c(NC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)c1 1177057 ZTMRYNMHZYBLSE-AWEZNQCLSA-N 380.400 2.728 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3ccccc3F)n2C)s1 4519831 WXEHYVHTBNQXNI-UHFFFAOYSA-N 378.458 2.766 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(S(=O)(=O)Nc2ccccc2F)c1 6402319 HQUNLCNJSWAVMS-AWEZNQCLSA-N 378.425 2.535 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)n1 6702904 OJWARJNACBHRSL-OAHLLOKOSA-N 379.869 2.835 0 50 GFAA O=C(c1ccc([C@H]2CCCN2Cc2cc[nH]c(=O)c2)s1)N1CCCOCC1 23543326 ZJWWSHOGXFTSQY-MRXNPFEDSA-N 387.505 2.636 0 50 GFAA CCc1noc([C@@H](C)N2CCN(C(=O)c3ccccc3OCC3CC3)CC2)n1 112036223 KXXBBGHUMXCFLL-OAHLLOKOSA-N 384.480 2.940 0 50 GFAA CCc1c(C(=O)NC[C@H]2CN(C3CC3)CCO2)cnn1-c1cccc(Cl)c1 114858387 NRYUWZZYNIYADQ-KRWDZBQOSA-N 388.899 2.681 0 50 GFAA C[C@H](C(=O)O)n1nc(Br)c(Br)c1Br 59949822 RXLYXRLZUBANRU-UWTATZPHSA-N 376.830 2.816 0 50 GFAA O=C1CCCCN1CCC(=O)N1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1 65528105 AHONZVBTIAYPOO-LEWJYISDSA-N 380.488 2.919 0 50 GFAA O=C1N[C@@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cccnc1 67934686 PGQUVSUKFWOBHA-QHCPKHFHSA-N 392.503 2.895 0 50 GFAA O=C(CCN1C(=O)CC2(CCCC2)C1=O)NCCn1ccc2ccc(F)cc21 170625267 LMRDVGLPZNCJNU-UHFFFAOYSA-N 385.439 2.606 0 50 GFAA O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)Nc1ccccc1F 2860610 JLGVRAGHFTWFSR-UHFFFAOYSA-N 376.331 2.762 0 50 GFAA COc1cc2c(c(OC)c1OC)CC[C@H](NC(C)=O)c1cc(=O)c(OC)ccc1-2 212687804 XXTCGVALMPUCBB-KRWDZBQOSA-N 399.443 2.872 0 50 GFAA CCc1ccc2nc(C)cc(C(=O)N3CCc4nc(C)[nH]c(=O)c4CC3)c2c1 77375023 DNLABJQJQWOQOL-UHFFFAOYSA-N 376.460 2.738 0 50 GFAA COc1cccc(CNC(=O)CN2CCC(C(=O)c3ccc(O)cc3)CC2)c1 363096223 JSWBKCQBOSCZIX-UHFFFAOYSA-N 382.460 2.612 0 50 GFAA C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)NC1CCC2(CC1)NC(=O)NC2=O 376888447 PWHRRCZSGIUDSW-FVLMKAMBSA-N 384.480 2.520 0 50 GFAA Cc1cc([C@H](NC(=O)C(=O)Nc2cnc3c(c2)COCC3)C2CC2)ccc1F 368461983 MUIFZWCMLBGRDB-LJQANCHMSA-N 383.423 2.808 0 50 GFAA O=C(c1cnc2ccccn12)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 72150596 GMOZFKXADLEFJC-VLCRHTCISA-N 388.471 2.742 0 50 GFAA Cn1cc([C@H]2CN([C@H]3CCN(c4ccc(F)cc4)C3=O)CC23CCOCC3)cn1 334058965 XLYMNZDQRWTTFD-UXHICEINSA-N 398.482 2.561 0 50 GFAA O=C(c1ccc(Oc2cccc(Cl)c2)cc1)N1CCO[C@@H](c2nn[nH]n2)C1 370860347 JPIPERPGSYBZKP-MRXNPFEDSA-N 385.811 2.859 0 50 GFAA O=C(O)[C@@H](NC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1)c1ccccc1 238003976 BAVVXCOFWGUXKC-XLIONFOSSA-N 398.434 2.549 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NCC[C@H]1CCCNC1)c1ccccc1 238152538 IGCFUOWWCOPLJM-CTNGQTDRSA-N 379.504 2.534 0 50 GFAA COc1cc(Cn2nc([C@@H]3CCCNC3)n(-c3ccccc3)c2=O)cc(OC)c1 71738671 FNVYAZXSTDDSOE-QGZVFWFLSA-N 394.475 2.567 0 50 GFAA C[C@@H](N1CCN(C(=O)NCc2ccccc2-n2ccnc2)CC1)C(F)(F)F 175980041 HAJJLTUTLNPBNU-CQSZACIVSA-N 381.402 2.650 0 50 GFAA CN1CCCN(C(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71524431 YWVAPTMIJDVLIY-DEOSSOPVSA-N 391.515 2.698 0 50 GFAA CNC(=O)c1nn(CC2CCCCC2)c2c1C[C@H](N1CCSCC1)CC2 82039559 VGHVHEYBUVHVSB-MRXNPFEDSA-N 376.570 2.729 0 50 GFAA O=C(c1cnc(NC[C@@H]2CCCS(=O)(=O)C2)c(Cl)c1)N1CCCCC1 288468950 KKHNXYSSCRLHFM-ZDUSSCGKSA-N 385.917 2.598 0 50 GFAA COCCN(Cc1cnn(C)c1)C(=O)c1ccc(-c2nc(C)cnc2C)cc1 426402113 WMNJIDMROJGFLC-UHFFFAOYSA-N 379.464 2.783 0 50 GFAA Cc1ccc(N2C[C@H](C)N(C(=O)c3cc(C)n4nc(C)cc4n3)CC2=O)cc1 82116273 BHMKRAWDPMVPBE-INIZCTEOSA-N 377.448 2.532 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c(=O)n1C 95377064 XAQMXHYTPKSLOD-UHFFFAOYSA-N 380.275 2.963 0 50 GFAA COC(=O)[C@H](CCC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21 95093051 GVVDKFNHFXLOQY-SFHVURJKSA-N 383.400 2.932 0 50 GFAA CNC(=O)c1ccc(CN2C[C@H]3CC[C@@H]2CN(Cc2ccc(OC)cc2)C3)o1 95392918 DZPUQLIWFIVCIM-ZWKOTPCHSA-N 383.492 2.744 0 50 GFAA Cc1nc(CN2CCC[C@@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n(C)n1 95522818 AEXXVKXHSSKVEH-HNNXBMFYSA-N 391.466 2.710 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCO[C@@H]4CCC[C@@H]43)cc2)c(C)c1CCC(=O)O 299746647 YVXKKGSKINHTRP-VQTJNVASSA-N 397.475 2.900 0 50 GFAA Cc1nn(C)c(C)c1[C@H](C)NC(=O)c1cccc(-c2cncc(C(=O)O)n2)c1 534661115 BZJLCZIJELVPGZ-NSHDSACASA-N 379.420 2.683 0 50 GFAA CCOc1ccc(-c2ccc(C(=O)N[C@@H](c3ncnn3C)C(C)C)cc2)nn1 534659675 IPVHZCRBJQLYKF-GOSISDBHSA-N 380.452 2.798 0 50 GFAA O=C(C[C@H]1CCc2ccccc21)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 828003447 AQWDDAPMUKQTBG-CZHDOKMCSA-N 377.492 2.957 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Br)N1C[C@H](CO)[C@@H](CCO)C1 1347591281 STOFSUOYZWFDED-VHSXEESVSA-N 396.203 2.531 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 167475697 YBQCXLPEXAEQOG-MRXNPFEDSA-N 376.416 2.814 0 50 GFAA COCC(=O)N1CCc2cc(NC(=O)C[C@@H]3OCCc4ccccc43)ccc21 186323258 FNQXUZVYDHVRMD-FQEVSTJZSA-N 380.444 2.865 0 50 GFAA Cc1ccc2c(CC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc(=O)oc2c1 170593521 GSCPIHNNESMCIS-UHFFFAOYSA-N 386.448 2.723 0 50 GFAA C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC2(CC1)Nc1ccccc1NC2=O 1506418100 PBWKTSRTOXASNQ-MRXNPFEDSA-N 390.487 2.863 0 50 GFAA Cc1ccc2c(c1)C[C@H](C(=O)N1CCCN(C(=O)c3ccc(F)cc3)CC1)N2 1529191846 GFXHACAZRSBDAW-HXUWFJFHSA-N 381.451 2.845 0 50 GFAA CN(Cc1ccco1)C(=O)c1nn(C)c2c1C[C@H](NCCc1ccccc1)CC2 14537665 UCCRBETWGCIHBI-GOSISDBHSA-N 392.503 2.975 0 50 GFAA Cc1c(C(=O)N[C@@H](C)Cc2ccccn2)cnn1-c1nccc(-c2cccnc2)n1 14991342 KNQUVVUEFWBSGA-HNNXBMFYSA-N 399.458 2.789 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2cccc3cccc(O)c23)N(c2cc(C)ncn2)C1 1857528101 ONRGOWBSYJKHJP-IRXDYDNUSA-N 392.459 2.668 0 50 GFAA Cc1cccc(CN2C[C@@H](C(=O)O)C3(CCN(C(=O)C4CCCC4)CC3)C2)n1 1857687317 PXNHHFIHMDIHOA-IBGZPJMESA-N 385.508 2.705 0 50 GFAA O=C(c1ccc2c(c1)CCO2)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857729705 ILXAXFQXAABRGN-VIZSFHNOSA-N 390.439 2.536 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(Cc2cccc(O)c2Cl)C[C@@H]1O 1875246406 FROTUQHUVNDUHK-FXAWDEMLSA-N 375.852 2.926 0 50 GFAA O=C1C[C@@H](NC23CC4CC(CC(C4)C2)C3)C(=O)N1Cc1ccc2c(c1)OCO2 4539416 MGPNNRVETJVOFD-GOWZHPGHSA-N 382.460 2.601 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)[C@@H]4CCCCCC[C@H]4N)CC3)n2)cn1 952894604 OFFCIDNCZQQCND-RTBURBONSA-N 396.539 2.881 0 50 GFAA CN1CCC2(CC1)CCN(C(=O)Nc1cccc(-c3nnnn3C3CC3)c1)C2 1875282795 SJXZRKLQKMMWEK-UHFFFAOYSA-N 381.484 2.625 0 50 GFAA Cc1cc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc(N2CCCCC2)c1 1875274814 GGXPNGSXWGKNGQ-UHFFFAOYSA-N 378.432 2.767 0 50 GFAA Cc1ccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(F)c1 1875397712 LDUGQSBXMSEDAO-QGZVFWFLSA-N 385.487 2.611 0 50 GFAA Cn1nc(C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)c(=O)c2ccccc21 2325699519 LCZLZODOSPFWLS-QHCPKHFHSA-N 390.487 2.576 0 50 GFAA O=C(NCc1cc2c(cc1OC(F)F)OCO2)NC[C@@]12CCC[C@@H](C1)OC2 2325776138 QTGQHAKCPHBENR-KPZWWZAWSA-N 384.379 2.775 0 50 GFAA CN1C[C@H]2[C@@H](C1)[C@@H]2CN(Cc1ccc(F)c(Cl)c1)C(=O)c1cn(C)cn1 101270900 KYLOBHXXQOZRKK-FICVDOATSA-N 376.863 2.663 0 50 GFAA investigational OCCN(CCO)C[C@H](O)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc21 626542 IUYHQXQULKHTOS-HNNXBMFYSA-N 397.302 2.749 0 50 GFAA COC(=O)CCC(=O)Nc1cccc2c(NC(=O)CCC(=O)OC)cccc12 752044 FGPUYYRHXNRCTF-UHFFFAOYSA-N 386.404 2.623 0 50 GFAA CCc1ccccc1NC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 796324 RBQSVXOQCVENRQ-UHFFFAOYSA-N 388.489 2.831 0 50 GFAA COc1ccc(N2C(=O)C[C@H](NC3CCN(Cc4ccccc4)CC3)C2=O)cc1 852436 URNKVWVDUBLFNJ-NRFANRHFSA-N 393.487 2.581 0 50 GFAA O=C(CCc1nc2ccc(F)cc2[nH]1)N1CCC[C@]12CCCN(C1CC1)C2=O 2356137215 SKVUVKRMYGWHNU-NRFANRHFSA-N 384.455 2.781 0 50 GFAA Cc1cccn2cc(C(=O)N3CCC[C@@]4(CCc5cnc(N(C)C)nc54)C3)nc12 2356147143 JWSQRBRMRDZWKL-JOCHJYFZSA-N 390.491 2.619 0 50 GFAA O=C(NCc1ncccc1Cl)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356147416 VFTGXQFQGUKXOY-CGSMKXTHSA-N 396.878 2.683 0 50 GFAA O=C(c1cccc2ncnn12)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 2356154523 YVNMXMBZRPWGPF-IEBWSBKVSA-N 392.459 2.617 0 50 GFAA CCOc1ccccc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(OC)c(C)c1 4867368 VDTWGIGJJFEFCI-CQSZACIVSA-N 392.477 2.708 0 50 GFAA COc1cc2c(cc1OC)CN(c1ccc3nnc(C(F)(F)F)n3n1)CC2 20721017 ZMRUWRCKZRYCAE-UHFFFAOYSA-N 379.342 2.723 0 50 GFAA CNC(=O)c1cccc(CNC(=O)CCC(=O)Nc2ccccc2SC)c1 65384885 JOEWNWOOINONDE-UHFFFAOYSA-N 385.489 2.803 0 50 GFAA CC(CO)(CO)Nc1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)cn1 67803339 GHORFURNHGWZKB-SFHVURJKSA-N 383.492 2.647 0 50 GFAA O=C(Cc1csc(-c2ccccn2)n1)NCc1ccnc(O[C@H]2CCOC2)c1 118946690 YPMKGNNEFSJXNF-INIZCTEOSA-N 396.472 2.627 0 50 GFAA Cc1nc(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc(-n2cccn2)n1 67601788 SFFISHBXGFXEJU-UHFFFAOYSA-N 396.882 2.515 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N2CC[C@H]3[C@H](CCCN3Cc3ccccc3)C2)C1 152838672 RMMLCACMIFSMMB-HKBOAZHASA-N 398.551 2.693 0 50 GFAA COc1ccc(F)cc1CN1CCC(N2CCC[C@@H](C(=O)NC3CC3)C2)CC1 71763722 AWARPSYWEMNHOD-MRXNPFEDSA-N 389.515 2.789 0 50 GFAA CCN(CC)C(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)cc1 363520187 OMZWPNSNXJFFDR-VQTJNVASSA-N 386.540 2.937 0 50 GFAA NC(=O)c1ccc(-c2nc(CN3CC[C@@H](Oc4cccnc4)C3)cs2)cc1 154696752 GOYPAPUPNQTUDR-GOSISDBHSA-N 380.473 2.957 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21 172527368 QBMQADFALMLDJQ-OAHLLOKOSA-N 388.470 2.899 0 50 GFAA C[C@@]1(C(=O)Nc2nncn2-c2cccnc2)CCCN(C(=O)c2ccccc2)C1 377163180 QBWLZWDDAVDZBG-OAQYLSRUSA-N 390.447 2.543 0 50 GFAA COCCCN1C[C@@]2(CCCN(C(=O)c3cccc4nccnc34)C2)CCC1=O 77454308 KETCLYHAMXZOHV-JOCHJYFZSA-N 396.491 2.511 0 50 GFAA O=C(CCc1nc(-c2nc[nH]n2)no1)N1CCC[C@H](c2ccc(F)cc2)CC1 378491481 GWAHCZPADMNFAB-ZDUSSCGKSA-N 384.415 2.723 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2F)CN1Cc1ccc(F)c(F)c1 14987119 PUPJETVHOFPJOQ-UGSOOPFHSA-N 392.377 2.650 0 50 GFAA COc1ccc(C(=O)NC[C@H](O)CN2CCc3ccccc3C2)c(OC(C)C)c1 242147499 WSHMLZVZDHWDNO-IBGZPJMESA-N 398.503 2.631 0 50 GFAA C[C@]1(C(=O)O)CCN(CC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)C1 263560684 BPQMSSLFJFIKOP-SFHVURJKSA-N 377.441 2.608 0 50 GFAA CCCc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)[nH]n1 91468845 WVJYJVNIYDFDDS-UHFFFAOYSA-N 395.507 2.802 0 50 GFAA CCCc1nnsc1C(=O)N1CC[C@@]2(CCCN(C3CCCC3)C2=O)C1 95378072 JRIPRTGUQNIUGZ-IBGZPJMESA-N 376.526 2.888 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)COc2ccc(F)cc2F)n1 91745289 AFQFLRCPZCUEBJ-UHFFFAOYSA-N 375.297 2.820 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)nc(C)n1 95527945 FSDQITZRKDQOFO-GOSISDBHSA-N 376.464 2.753 0 50 GFAA CC(=O)C(=O)N1CCC(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)CC1 95521636 XXAVYDRBVOWUGG-UHFFFAOYSA-N 390.443 2.996 0 50 GFAA Cc1ccc2[nH]c(CNC(=O)CC[C@H]3NC(=O)c4ccccc4N=C3O)nc2c1 252540552 PLTBWCHJFORMGH-MRXNPFEDSA-N 391.431 2.668 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(C[C@H](O)c4ccc5c(c4)OCO5)ccn3n2)cc1 263616659 JYKZZVHDHXVIMI-IBGZPJMESA-N 389.411 2.934 0 50 GFAA CCN(C(=O)c1cccc(-c2nc(C)ccc2OC)c1)[C@H]1CCS(=O)(=O)C1 299756029 BPCRBZLVEWEJQM-KRWDZBQOSA-N 388.489 2.715 0 50 GFAA Cc1cnn(Cc2ccc(Cl)cc2)c1NC(=O)N[C@@H]1CCC(=O)N(C)C1 299793280 IHQGJQLBPIAKEV-OAHLLOKOSA-N 375.860 2.636 0 50 GFAA CC1(C)[C@H](C(N)=O)C(=N)NC(=O)[C@H]1c1nc(-c2ccc(Cl)cc2)cs1 828296182 SXZYKFGMBRQJHI-RYUDHWBXSA-N 376.869 2.782 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2)c1ccc(C(F)(F)F)nc1 828163308 ZUQHDVCTANVPPH-GKUGFIGPSA-N 392.385 2.565 0 50 GFAA CCc1nc(C)sc1CNC(=O)N1CCN(Cc2cccc(C)c2)C(=O)C1 584902333 CSGLMYFJNZCXCX-UHFFFAOYSA-N 386.521 2.876 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)[C@H](Cc1cnc[nH]1)n1cccc1 952971788 FYLDXZNCXNYPIK-IBGZPJMESA-N 376.420 2.704 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3cccc(-n4cnnc4)c3)C[C@@H]2N(C)C)cc1 1565531035 GEHQJPKKTLAMHO-RTWAWAEBSA-N 375.476 2.746 0 50 GFAA O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)N1CCCN(c2nccs2)CC1 222149384 JIGFBTUUJJUIJZ-JZFKGDSASA-N 375.538 2.903 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@@H]1C[C@@H]1C(=O)O)CC2 268880526 DEFHSJCLNQXTIX-QWQRMKEZSA-N 387.457 2.960 0 50 GFAA Cc1oc(CN(C)C(=O)c2ncoc2-c2ccc3c(c2)OCCO3)cc1C(=O)O 268932917 LNBHLTFPJGNJAZ-UHFFFAOYSA-N 398.371 2.985 0 50 GFAA CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NC[C@@H]1CCCNC1 170676588 RGZDAGWJKJUUMP-GCJKJVERSA-N 381.520 2.639 0 50 GFAA CCN(C(=O)c1cc(N2CCNC(=O)C2)ccn1)[C@@H](C)c1cc2ccccc2o1 190278348 CUIDTJNRHHCYHX-HNNXBMFYSA-N 392.459 2.987 0 50 GFAA CCOC1CC(CNC2CCN(C3CCCCC3)CC2)(N2CCOCC2)C1 193403622 IBQXPWPRHALEDN-UHFFFAOYSA-N 379.589 2.643 0 50 GFAA O=C(N[C@H]1COC[C@H]1Cc1ccnc2ccccc12)c1n[nH]c2c1CCCC2 1704339208 FLWDMYKCSCAMON-QRWLVFNGSA-N 376.460 2.824 0 50 GFAA Cn1cccc1C(=O)C(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704298344 HEGTXZNCGLWEHU-UHFFFAOYSA-N 377.444 2.780 0 50 GFAA C/C=C/Cn1c(=O)c2c(nc3n(-c4ccccc4Cl)c(C)cn23)n(C)c1=O 12343360 WPVFZJXNRBDJNM-SNAWJCMRSA-N 383.839 2.677 0 50 GFAA COCCNC(=O)CCC1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 12386303 SKUCCMAOQINQIC-UHFFFAOYSA-N 376.541 2.984 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1cn(Cc2ccccc2F)nn1 12572990 TWHYMCDTXKDZMH-IBGZPJMESA-N 393.466 2.860 0 50 GFAA CC(=O)c1sc(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1C 16606777 BLBUZCGRXSPXQD-UHFFFAOYSA-N 393.490 2.691 0 50 GFAA Cc1cc(=O)c(O)c(C(C)(C)CC(=O)NCCc2nc3ccc(F)cc3[nH]2)o1 1857526904 LWMYZMPQHRBJMK-UHFFFAOYSA-N 387.411 2.696 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCCc3ccncc3Br)n[nH]c21 1857531164 AQIZRLHPADXLHM-ZJUUUORDSA-N 379.258 2.562 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCC[C@]2(CC1)CN(C)C(=O)O2 1857670159 XFTBZDLEHULFQJ-FQEVSTJZSA-N 386.427 2.971 0 50 GFAA Cc1cc(=N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)[nH]c(-c2cccnc2)n1 1857713480 XNWXJEZLMFXHFM-PCCBWWKXSA-N 387.487 2.895 0 50 GFAA COCCC(=O)N1C[C@H]2[C@@H](NC(=O)c3ccc(Cl)cc3OC)CCC[C@H]2C1 1857718266 QVBJDCLEBYSJRB-XKQJLSEDSA-N 394.899 2.742 0 50 GFAA COc1cccc(F)c1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857731731 YVNFEEQQSPSWJT-HMFYCAOWSA-N 396.418 2.749 0 50 GFAA CNC(=O)Cc1nc(-c2cccc(-c3ncc[nH]3)c2)n(CCc2ccccc2)n1 1857736034 NACDLTLPZBVYAG-UHFFFAOYSA-N 386.459 2.866 0 50 GFAA CN=c1ccnc(N2CCC(C3CCN(Cc4c(C)noc4C)CC3)CC2)[nH]1 1857737900 ILMJUXIQLUSCCI-UHFFFAOYSA-N 384.528 2.674 0 50 GFAA CC(C)N=c1[nH]c(C2CC2)nc2c1CC[C@]21CCCN(Cc2nccn2C)C1 1875246205 APPXFANGSRWVHD-QFIPXVFZSA-N 380.540 2.810 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)Nc3cc(Cl)ccc3C(=O)N(C)C)cn21 416954927 VHGCXDDLXNDABU-NSHDSACASA-N 396.900 2.936 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1ccn(-c3ccccc3)n1)CC2 115569126 OBBKEBWBZQEHIA-UHFFFAOYSA-N 382.489 2.685 0 50 GFAA O=C(O)CCN(C(=O)CCc1ccccc1Br)C1CCOCC1 238063735 ADLQEBMTISHARA-UHFFFAOYSA-N 384.270 2.864 0 50 GFAA COCc1ccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 240444237 FWUYTWLUXNZCRT-HNNXBMFYSA-N 394.518 2.934 0 50 GFAA N[C@H](CCNC(=O)NC[C@@H](c1cccc(O)c1)N1CCCC1)Cc1ccccc1 1875354574 JMBIBNZUPQDQOG-IRLDBZIGSA-N 396.535 2.788 0 50 GFAA CN(C)Cc1ccc(CNC(=O)c2cc3nccc(C(F)(F)F)n3n2)s1 2325770219 YHEOHGGKDJOQSP-UHFFFAOYSA-N 383.399 2.801 0 50 GFAA CC(C)C(C)(C)C(=O)N[C@@H]1CC12CCN(C(=O)[C@@H]1CN3CCC1CC3)CC2 2325794134 RMXAVGCUBLUECW-QZTJIDSGSA-N 375.557 2.508 0 50 GFAA CCCn1c(=O)n(CC(=O)N2CC[C@@H](CN)c3ccccc32)c2ccccc21 2325859218 RGZKGWYWHMCEPD-INIZCTEOSA-N 378.476 2.692 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 1152740 KSVHSOPWAWGHNR-UHFFFAOYSA-N 398.506 2.573 0 50 GFAA C[C@@H](C(=O)NC[C@H](C)c1ccccc1)N1CCn2c(Br)cnc2C1 225670541 HZFAVYYJFAYRIW-KBPBESRZSA-N 391.313 2.770 0 50 GFAA CCOC(=O)N1CCN(Cc2nc3cc(NC(C)=O)ccc3n2C(C)C)CC1 20707227 FYQGAWICZXSKQL-UHFFFAOYSA-N 387.484 2.850 0 50 GFAA Cc1nn(C)c(Cl)c1-c1c(-c2ccccc2)ncn1CCS(C)(=O)=O 65435275 IAMDWALIPMFBNW-UHFFFAOYSA-N 378.885 2.957 0 50 GFAA C[C@@H]1CN(c2ccccc2F)CCN1C(=O)Nc1ccc2c(c1)OCC(=O)N2 252481788 CRYZGFHECJJKLX-CYBMUJFWSA-N 384.411 2.899 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)NCCSC3CCCCC3)ccc21 67612400 YPYBGBIXCDETEQ-UHFFFAOYSA-N 382.551 2.940 0 50 GFAA Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)N1CC[C@@H](CCO)C1 475693748 KSMRLXQUZQDLJV-KRWDZBQOSA-N 382.460 2.743 0 50 GFAA CN1CCCc2ccc(S(=O)(=O)NCCc3nnc(-c4ccccc4)o3)cc21 122585510 QOYIAPDJKZUCKK-UHFFFAOYSA-N 398.488 2.640 0 50 GFAA COC(=O)[C@@](NC(C)=O)(Nc1ccc(OC(F)(F)Cl)cc1)C(F)(F)F 4543871 MSFHLNCVURDBHW-LLVKDONJSA-N 390.692 2.834 0 50 GFAA COc1cccc(C2=NO[C@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)C2)c1 4904228 LTIPTPJAOJDIGE-FQEVSTJZSA-N 383.423 2.676 0 50 GFAA CC1=NN(C(=O)c2ccccc2I)[C@](O)(C(F)(F)F)C1 6849414 WIYJCYKEUMEJRC-LLVKDONJSA-N 398.122 2.764 0 50 GFAA C[C@@H](CN1CC2(CCN(C(=O)Cn3cccn3)CC2)OC1=O)c1ccccc1 77376566 LNMLHVRZCIOOGF-KRWDZBQOSA-N 382.464 2.500 0 50 GFAA CCN1CCN(Cc2ccccc2CNC(=O)[C@H]2Cc3cc(F)ccc3O2)CC1 129041681 CXMDJBFQQXQKMP-JOCHJYFZSA-N 397.494 2.583 0 50 GFAA CCN1CC2(CCN(C(=O)c3cccc(-n4nc(C)cc4C)c3)CC2)OC1=O 77539620 SDPGUECBDUOOJK-UHFFFAOYSA-N 382.464 2.936 0 50 GFAA C[C@H](c1ccc(C(=O)N2CCC(N3CCC(O)CC3)CC2)o1)N1CCCCC1 72148762 WPCQWXVTLFEMSU-QGZVFWFLSA-N 389.540 2.888 0 50 GFAA Cc1cc(NC(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cc(C(N)=O)c1 455833737 KJTAMRHAHZMRLL-IBGZPJMESA-N 394.475 2.910 0 50 GFAA C[C@H]1CN(c2ccc(CNC(=O)N3CCOC4(CCCCC4)C3)cn2)CCO1 175424370 KAFZWNHNWPSJFB-KRWDZBQOSA-N 388.512 2.551 0 50 GFAA COc1ccnc(N2CCN(C(=O)N[C@H](C)c3ccc4[nH]ccc4c3)CC2)n1 426488087 APCVTTPXRVNKQJ-CQSZACIVSA-N 380.452 2.559 0 50 GFAA CCc1nc(-c2ccc(C(=O)N[C@@H]3CCS(=O)(=O)c4ccccc43)cc2)n[nH]1 178451735 IMQCIIAOEDGIAZ-MRXNPFEDSA-N 396.472 2.683 0 50 GFAA CN(C)c1ccc(CC(=O)N2CCC[C@@]3(CCC(=O)N(CC4CC4)C3)C2)cc1 92099678 JQUHRAKRZJNQEK-HSZRJFAPSA-N 383.536 2.936 0 50 GFAA Cc1nc(C)n(CCCN2C[C@](C)(Cc3ccc4c(c3)OCO4)CCC2=O)n1 91819213 BRBOHJNMGJEWGQ-NRFANRHFSA-N 384.480 2.885 0 50 GFAA Cc1ncsc1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91691237 DWAVTSZEOMGVGH-UHFFFAOYSA-N 384.505 2.892 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCCC[C@H]1CCC(=O)O)c1c(F)cccc1F 236717158 AOCJPLSBBSONEI-XJKSGUPXSA-N 382.407 2.778 0 50 GFAA Cc1nc(N)sc1C(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95370370 DLMMMNPTDAHRSE-WMLDXEAASA-N 382.533 2.738 0 50 GFAA CCc1ncnc(N2CCC[C@H](CNC(=O)Cc3ccc(OC)cc3)C2)c1F 95525321 GUVZFCSJXSNOIN-MRXNPFEDSA-N 386.471 2.762 0 50 GFAA COC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 97756729 FJCVKTNOERGECM-SFHVURJKSA-N 385.416 2.978 0 50 GFAA Cc1nn(C)c(NC(=O)N2CCC[C@]3(CC2)CNC(=O)O3)c1-c1ccccc1 95522032 JNAAFQVIHSBTLX-FQEVSTJZSA-N 383.452 2.892 0 50 GFAA O=C(c1ccsc1)N1CCC2(CCN(Cc3ccncc3)CC2)[C@@H](CO)C1 97213260 ZBXNJADDMZQZJB-LJQANCHMSA-N 385.533 2.880 0 50 GFAA CN1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CC[C@H](c4ccccc4)C[C@H]32)C1=O 248001722 APUVCZANMBRGLQ-BTCOZLQPSA-N 389.455 2.690 0 50 GFAA Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccc4[nH]ccc34)C2)c(=O)n1C 828161372 YTYDSQWZKKRKBL-KRWDZBQOSA-N 392.503 2.817 0 50 GFAA C[C@](O)(CN1CCc2c(F)ccc(F)c2C1)c1ccc(S(C)(=O)=O)cc1 272029112 BZYGKCIBCDRLHD-IBGZPJMESA-N 381.444 2.634 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)Cc2csc3nccn23)C1 170669720 JENPHWRAIJHQFZ-CYBMUJFWSA-N 378.498 2.796 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NOC[C@@H]1CCOC1)OCc1ccccc1 170607694 NEGGOQDKIWGWFP-UXHICEINSA-N 398.459 2.608 0 50 GFAA CCS(=O)(=O)C1CCN(CC(=O)N[C@H](c2ccccc2)C2CCCC2)CC1 193247258 OGIDVUMQIUSZFI-OAQYLSRUSA-N 392.565 2.933 0 50 GFAA Cc1cc(C)n(CCC(=O)N[C@H]2COC[C@@H]2Cc2ccnc3ccccc23)n1 1616074461 YPPHBEIZVQUXEJ-RXVVDRJESA-N 378.476 2.812 0 50 GFAA Cc1sc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)NCc1ncc[nH]1 1506413113 GXIUZYMKKBWACQ-UHFFFAOYSA-N 392.384 2.932 0 50 GFAA CC1CCN(C(=O)COc2ccccc2CN2C[C@@H]3CCCN3C(=O)[C@@H]2C)CC1 1772813545 GSVCYFKREWTXDM-ICSRJNTNSA-N 399.535 2.519 0 50 GFAA CCN(CCn1cccn1)C(=O)[C@@H]1CCC(=O)N(CCCc2ccccc2)C1 11714028 FQKLDVNXLGUHBJ-HXUWFJFHSA-N 382.508 2.603 0 50 GFAA O=C(Cc1ccccc1)NC[C@@H]1CCC2(CCN(Cc3cccnc3)CC2)O1 11971735 MMGIRZMYKAHPBE-NRFANRHFSA-N 379.504 2.954 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2F)CCCN(C(=O)Cn2cccn2)C1 12299493 WOUPVIBYPFNSBB-FQEVSTJZSA-N 391.418 2.576 0 50 GFAA CC(=O)NCC(=O)N1CCc2onc(C(c3ccccc3)c3ccccc3)c2C1 12439929 JCGDKFLUIGJTCZ-UHFFFAOYSA-N 389.455 2.876 0 50 GFAA CCOC(=O)c1nn(Cc2ccccn2)c2c1CN(C(=O)c1ccccc1)CC2 14745747 IGPNQZIURCWXRU-UHFFFAOYSA-N 390.443 2.702 0 50 GFAA Cc1ccc([C@H]2NC(=O)N(CC(=O)N(C)c3ccccc3)C3=C2C(=O)OC3)cc1 169757942 CHJSAIHVAYUCCZ-HXUWFJFHSA-N 391.427 2.535 0 50 GFAA Cc1nn(C)c2c1[C@@H](NS(=O)(=O)c1ccc3nc(O)cc(C)c3c1)CCC2 1857678908 CWVDJFZIILCBNG-INIZCTEOSA-N 386.477 2.647 0 50 GFAA O=C(O)[C@H]1CN(Cc2ccc(F)cc2F)CC12CCN(C(=O)C1CCC1)CC2 1857683452 GTXSAMVXBNWIGU-QGZVFWFLSA-N 392.446 2.890 0 50 GFAA NCCc1cc(=O)[nH]c(-c2ccc(CN3C[C@@H]4C[C@H]5C[C@H]3C[C@H](C5)C4)cc2)n1 102134117 DAGTUJJNJYASIK-GIVJOQJQSA-N 378.520 2.949 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@H]1c1ccc(Cl)cc1 13562848 SNYBQIIVGREIAE-RCJHGTSTSA-N 382.840 2.506 0 50 GFAA in-vitro Cc1cccnc1C(=O)N1C[C@H]2COC[C@@H](C1)CN2C/C=C/c1ccccc1 1704330869 HPCVTSWHIRWWBM-JXNRKETESA-N 377.488 2.876 0 50 GFAA C[C@H](NC(=O)c1ccc2[nH]nc(C(=O)O)c2c1)c1cccc(-n2cccn2)c1 1875300144 MWYJQMVHPQBURC-LBPRGKRZSA-N 375.388 2.938 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(N=c4cc[nH]cc4Cl)CC3)n[nH]c21 1875396458 IBLODHFXEAZVNF-NEPJUHHUSA-N 389.887 2.619 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)c1ccc(-c2ncon2)cc1 1875371113 PHCQZAOEINIMAG-LJQANCHMSA-N 388.427 2.606 0 50 GFAA COc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC(=O)c1cccnc1C)C2 1775993411 ZNHKXBPSJAHENG-BJWYYQGGSA-N 394.475 2.607 0 50 GFAA COC(=O)C1=CN(C[C@@H]2CCCO2)C=C(C(=O)OC)C1c1cccc(F)c1 717771 KTXCHNSJNZJNMR-HNNXBMFYSA-N 375.396 2.518 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)NCc2ccco2)c(Cl)cc1Cl 1083591 FMEIWHMUVJHASN-UHFFFAOYSA-N 377.249 2.767 0 50 GFAA Cn1ncc2ncc(C(=O)N3CCN(c4nsc5ccccc45)CC3)cc21 2100544702 FYXWXCNJVDGRLC-UHFFFAOYSA-N 378.461 2.540 0 50 GFAA CCO[C@@H](CC(=O)N1CC[C@@H](NC(=O)c2c(Cl)n[nH]c2C)[C@@H]1CC)C(C)C 2325793934 MBTOOXKHVPAKQV-ILXRZTDVSA-N 398.935 2.932 0 50 GFAA O=C(c1nn(-c2ccccc2)c2c1CCC2)N(C[C@@H]1CCCO1)c1ccnnc1 953100281 FPPDALLQEAROPY-SFHVURJKSA-N 389.459 2.977 0 50 GFAA COc1cc(NC(=O)CCN2C(=O)c3ccccc3C2=O)c(OC)cc1Cl 627743 YZXDRLGNIVRCMI-UHFFFAOYSA-N 388.807 2.982 0 50 GFAA CCn1nnnc1-c1ccc(OC)c(S(=O)(=O)Nc2ccc(C)c(C)c2)c1 972697 MSLHBYZBEOEIFP-UHFFFAOYSA-N 387.465 2.786 0 50 GFAA Cc1cc(C)cc(N2C(=O)C[C@@H](Sc3nnnn3-c3ccccc3)C2=O)c1 986305 ZRBULFJFAZMPTP-MRXNPFEDSA-N 379.445 2.703 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3n[nH]c4c3COCC4)C2=O)cc1 2356135205 TVGNTDGANXXSQN-QFIPXVFZSA-N 394.475 2.593 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(CC(=O)Nc3cnn(C)c3)C2)[C@@H]2CCCCN12 2356137348 WIOYMJRXDQQYNE-ZFMNYDKASA-N 387.572 2.970 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCCc2ccccn2)CC[C@@H]1Nc1ncccn1 2356149292 SXGYVJODRMKPHW-IHPCNDPISA-N 397.523 2.996 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)cc1 4904442 SVEXVGQTYPLFMA-MRXNPFEDSA-N 378.519 2.774 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)C[C@@H]3COc4ccccc4O3)n2)cc1 55054222 MHFDARGOHDKJKZ-MRXNPFEDSA-N 395.415 2.795 0 50 GFAA COc1ccc(CN2CCN(C3CSCCSC3)C[C@H]2CCO)cc1C 104357053 NMXSDKVVMSBXQS-GOSISDBHSA-N 396.622 2.721 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)c1nn(-c2ccccc2F)cc1O 134664352 XQKYQCRMLWGHFO-UHFFFAOYSA-N 397.410 2.509 0 50 GFAA O=C(CCc1ccccc1O)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 67773020 VPXVPJBOFFISPU-UHFFFAOYSA-N 392.459 2.605 0 50 GFAA CCC(=O)Nc1ccc2c(c1)nc(CCN1CCN(c3ccccn3)CC1)n2C 20533651 XWSQEGBKGLRTJF-UHFFFAOYSA-N 392.507 2.682 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3ccc(-c4cccc(Cl)c4)o3)C[C@H]2O)CC1 20541694 PXEMTEUHJBCMJE-WOJBJXKFSA-N 389.927 2.783 0 50 GFAA O=C(Nc1cc(F)ccc1F)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2794181 ZOTXVIHCDAHRNL-UHFFFAOYSA-N 381.346 2.573 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 6894657 QCFYBZZSVHHBCK-NRJQMVOHSA-N 379.435 2.774 0 50 GFAA COCc1ccc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)o1 39460739 HUEDPAHFEGIGDE-MRXNPFEDSA-N 380.435 2.773 0 50 GFAA CC(C)(C)NC(=O)c1ccccc1NC(=O)N1CCC(NC(=O)C2CC2)CC1 172459956 OEZAILDUVFHGEW-UHFFFAOYSA-N 386.496 2.737 0 50 GFAA COc1nc2ccccc2cc1CN1CCC2(CC1)CN(CCN(C)C)C(=O)O2 72408750 SAMQXFFBUCTRRC-UHFFFAOYSA-N 398.507 2.592 0 50 GFAA Cc1ccc(C(=O)N2CCc3c(nc(-c4cccnc4)nc3N(C)C)C2)c(O)c1 71749121 BEWPEBCOPIPVLB-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA O=C(CN1CCN(C[C@H](O)c2cccc(Cl)c2)CC1)N1CCc2ccccc21 174735777 RLNHBCDQBQJTIO-NRFANRHFSA-N 399.922 2.580 0 50 GFAA C[C@H]1CN(CCCCNC(=O)c2cc(N(C)C)c3ccccc3n2)C[C@@H](C)O1 241657589 PXNHVQLROSGRQR-CALCHBBNSA-N 384.524 2.920 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)Cc3cccc(SC)c3)CC2)cc1 82121480 CWMIMZFJZRVXMR-UHFFFAOYSA-N 384.501 2.944 0 50 GFAA Cn1c(SCC(=O)NCc2ccco2)nnc1-c1ccc(Br)o1 17081210 NGLOXRUBRLBTJM-UHFFFAOYSA-N 397.254 2.839 0 50 GFAA COc1ccc(-c2cc(C(=O)NC3CCN(Cc4ccncc4)CC3)[nH]n2)cc1 178010836 RCDRQYJIGBIUSG-UHFFFAOYSA-N 391.475 2.875 0 50 GFAA COCCN1C(=O)c2ccccc2[C@@H](C(=O)Nc2nncs2)C12CCCC2 49550935 LTNUYNMLFYIRRI-HNNXBMFYSA-N 386.477 2.675 0 50 GFAA O=C(CCN1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N2)Nc1cccnc1 426380684 RUORNTBOJUREAE-IBGZPJMESA-N 378.476 2.549 0 50 GFAA C[C@H](c1nc(-c2ccc(N3CCCN(C)CC3)c(Cl)c2)no1)S(C)(=O)=O 289974300 CWJPHVATADIKPO-GFCCVEGCSA-N 398.916 2.638 0 50 GFAA CCc1noc(-c2ccc(C)c(NC(=O)NC[C@H]3CCCN3CCOC)c2)n1 177149632 FPOUWSBLEKCEAS-MRXNPFEDSA-N 387.484 2.840 0 50 GFAA COCCN(Cc1ccncc1)C(=O)c1cnn2c(C(F)(F)F)cc(C)nc12 426698164 DBMITDNTWJXQML-UHFFFAOYSA-N 393.369 2.740 0 50 GFAA CC(C)=CCN1CC2(CCN(C(=O)c3[nH]nc4c3C[C@@H](C)CC4)CC2)CC1=O 95374256 ZXRFLGDPNOPALQ-INIZCTEOSA-N 384.524 2.955 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3cc[nH]c3)C2)c(OC)c1 95498509 FWYOZHOCQXYKTF-MRXNPFEDSA-N 399.491 2.981 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccccc3SC)C2)CCC1=O 91859808 RYFSWEBGPKCIMF-HXUWFJFHSA-N 376.522 2.900 0 50 GFAA O=C(O)[C@@H](c1ccc(-n2cccn2)cc1)N1CCN(Cc2ccsc2)CC1 95358850 YLSORUQZQXGYOS-LJQANCHMSA-N 382.489 2.877 0 50 GFAA CN(C)c1ccc(CC(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccn2)C3)cc1 95376853 RMBLVKKBTODHDD-SIKLNZKXSA-N 378.520 2.813 0 50 GFAA CNC[C@H]1CCN(C(=O)c2ccc(-n3nc(C)c(Br)c3C)cc2)C1 179015890 VKQWVTRSMTUWKH-CQSZACIVSA-N 391.313 2.933 0 50 GFAA Cc1ccnc(C[C@H](C)N2CCC(N3CCC(C(=O)NC4CC4)CC3)CC2)c1 23311689 QLRVRAFLVDNXCD-SFHVURJKSA-N 384.568 2.776 0 50 GFAA O=C(Nc1cc(C(=O)N2CCCC2)ccc1Cl)N1C[C@H]2CC[C@@H](C1)NC2 97446910 PVVXMHQLTFJMNU-ZFWWWQNUSA-N 376.888 2.792 0 50 GFAA COc1ccc(Cc2nc(CSc3nc(C)cs3)n(CCO)n2)cc1 96139346 MAQUKUPRGVXGKU-UHFFFAOYSA-N 376.507 2.927 0 50 GFAA CC(=O)[C@@H]1[C@@H]2C(=O)N(CCc3ccccc3)C(=O)[C@H]2[C@@H]2c3ccccc3C=CN12 245312825 XNWFJPNYSLRIKF-YSFYHYPLSA-N 386.451 2.829 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(COc3ccc(Cl)cc3C(C)=O)n2C)C1 244817181 SVPCQMJBKDJVSC-MQMHXKEQSA-N 376.844 2.632 0 50 GFAA COc1ccc(C[C@H](C)C(=O)N2CCC(Nc3cccnn3)CC2)cc1OC 181953337 IYGMZNPSBMGMOS-HNNXBMFYSA-N 384.480 2.776 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@@H]3Cc4cc(C)c(C)cc4O3)CC2)ncn1 183973134 FJCIVNJCDGQJFK-IBGZPJMESA-N 396.491 2.899 0 50 GFAA O=C(NCc1cccc(N2CCCS2(=O)=O)c1)N1CC[C@H](c2ccccc2)C1 184300010 RWHCREXBKZSAKD-IBGZPJMESA-N 399.516 2.926 0 50 GFAA O=C(NCc1ccco1)C1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263619189 XJYOOSLDQNFBLY-UHFFFAOYSA-N 379.464 2.734 0 50 GFAA COc1ncc(CN2CCN(CCOc3ccc(Cl)cc3C)CC2)cn1 824852098 SXAUDHYABROFTC-UHFFFAOYSA-N 376.888 2.644 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2ccc(N3CCOCC3)c(C)c2)cc1 843525778 LWMJSCCCCHXUAR-UHFFFAOYSA-N 383.448 2.669 0 50 GFAA O[C@H]1CN(Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@@H]1N1CCOCC1 1565512845 GSOZRCXXGVQTHG-OALUTQOASA-N 376.884 2.867 0 50 GFAA C[C@H](C(=O)N1CCCC1)N1CCN(Cc2cccc(CN3CCCCC3)c2)CC1 411319882 ATSDQXLVSZJAFT-OAQYLSRUSA-N 398.595 2.801 0 50 GFAA NC(=O)c1cnn2c(C(=O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@@H]43)ccnc12 275244784 HIZBMVQIWJIVNY-NXHRZFHOSA-N 389.459 2.627 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)c1ncccc1O)CC2 275846937 YCOUDNYFSHBEMF-QGZVFWFLSA-N 385.489 2.892 0 50 GFAA COc1ccc(CNC(=O)[C@@H](C)OC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cc1 169309219 XNEURKZZRITXSU-NSFRYCMZSA-N 387.476 2.574 0 50 GFAA O=S(=O)(Cc1ccc(Cl)cc1Cl)NCc1nnc2n1CCCC2 170613253 MCNWPYGESSAZNR-UHFFFAOYSA-N 375.281 2.541 0 50 GFAA C[C@@H]1CCc2c(sc3nc(CCC(=O)NO[C@H]4CCCCO4)[nH]c(=O)c23)C1 170608052 YADUMATZJGCGGN-BZNIZROVSA-N 391.493 2.616 0 50 GFAA OC[C@H]1CCCCN1c1cc(N2CCC(CCCN3CCCC3)CC2)ncn1 192345462 MJBKOMQNCIXZKK-HXUWFJFHSA-N 387.572 2.920 0 50 GFAA Cc1ccc2nc(NC(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)sc2c1 1062646 ZJPWDNQVWODQBH-YPMHNXCESA-N 377.466 2.914 0 50 GFAA CCCCc1ncc(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)[nH]1 1529155378 RUPMPZARNYXBAC-TZIWHRDSSA-N 389.496 2.704 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCC([C@@H](O)c4cccs4)CC3)c12 1529191448 YUBBHEACZGVKIS-QGZVFWFLSA-N 386.477 2.986 0 50 GFAA O=C(NC[C@H]1CC[C@H](CO)CC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704311516 MXJQESVKMPCJSQ-QAQDUYKDSA-N 399.491 2.707 0 50 GFAA Cn1cnc2ccc(-n3ccnc3-c3cnc(NC[C@@H]4CCCO4)nc3)cc21 1775977873 MZEVFRFIKUMOBS-INIZCTEOSA-N 375.436 2.807 0 50 GFAA O=C(c1cn(Cc2ccc(F)cc2Cl)nn1)N1CCCC[C@@H]1CCCO 11711420 LOFDOJYVXGLEKW-OAHLLOKOSA-N 380.851 2.886 0 50 GFAA CCOC(=O)C1(CCOc2ccccc2)CCN(C(=O)c2cc[n+]([O-])cc2)CC1 11843647 LANHUCQJHKXOGQ-UHFFFAOYSA-N 398.459 2.575 0 50 GFAA CCn1cc(CN2CCOc3ccc(CN4CCC(O)CC4)cc3C2)c(C)n1 12079661 TVKGCWRFISDWGD-UHFFFAOYSA-N 384.524 2.563 0 50 GFAA COc1ccc2nc(CNC(=O)c3cn(CCCc4ccccc4)nn3)[nH]c2c1 12433494 OQZBDSCEKUWDKB-UHFFFAOYSA-N 390.447 2.726 0 50 GFAA COc1cccc2cc(C(=O)N3CCN(Cc4ccccc4)CC3)c(=O)oc12 19799346 MTEUNHYCWMTJSD-UHFFFAOYSA-N 378.428 2.760 0 50 GFAA CCc1noc(-c2cn([C@H]3CCN(C(=O)c4cc(Cl)ccc4F)C3)nn2)n1 169780498 YHYMQTGPIHXFTB-NSHDSACASA-N 390.806 2.770 0 50 GFAA COc1ccccc1C=CCN1CC[C@@H](Oc2ccnc(CNC(C)=O)c2)C1 1857527832 IDBXUXQMLBWOGK-OAQYLSRUSA-N 381.476 2.893 0 50 GFAA COc1cc2c(cc1-c1nccn1-c1cccc(C3=NCCN3)c1)OCCO2 1857682636 YBLQOPAYHMMGPW-UHFFFAOYSA-N 376.416 2.669 0 50 GFAA CSCC(=O)N1CCC2(CC1)OCCc1sc(C(=O)NC(C)C)cc12 1857685625 MRFDSMJMDJUYIZ-UHFFFAOYSA-N 382.551 2.640 0 50 GFAA O=C(CCc1cc(O)no1)N[C@H]1CC[C@@H](NC(=O)CCCCc2ccccc2)C1 1857691369 IEUBFCGWBXBBTK-MSOLQXFVSA-N 399.491 2.879 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CC(c2ccncc2)C1 1857710269 OGZLTQZKYLWCLT-CQSZACIVSA-N 378.457 2.670 0 50 GFAA O=S(=O)(c1cnn([C@@H]2CCOC2)c1)N1CCC[C@@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 333437856 JCRJNAFIELAJKM-NNPSNHGLSA-N 379.526 2.824 0 50 GFAA COc1ccc(-n2ccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)O)n2)cc1 237446590 VDRORITYBKLWLC-LJQANCHMSA-N 377.400 2.533 0 50 GFAA CCOc1nc(C)ccc1C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 239882148 DAONFAIHRNSGNS-UHFFFAOYSA-N 385.439 2.962 0 50 GFAA CCc1cc(C(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2c(C)noc2C)ccn1 252370329 XOBUGZRLGRLJSW-AEFFLSMTSA-N 382.464 2.512 0 50 GFAA Cc1cc(F)c(Br)cc1NC(=O)C(=O)N1CC[C@@H]([C@H]2CCOC2)C1 377001521 PXJAZVCUZMGHMR-NEPJUHHUSA-N 399.260 2.720 0 50 GFAA CC(=O)N[C@@H](CC(=O)NCCC(C)(C)C(=O)O)c1ccc(Br)cc1 262881497 CFVKPGJWPPCGBP-AWEZNQCLSA-N 399.285 2.634 0 50 GFAA O=C(NC[C@@H](Cc1cccc2ccccc12)C(=O)O)[C@H]1CCc2nc[nH]c2C1 909269394 ZSUKNEMCKNFVCW-DLBZAZTESA-N 377.444 2.728 0 50 GFAA CC(=O)NCc1cc(O[C@H]2CCN(C[C@H]3CCc4ccccc4C3)C2)ccn1 886072107 RNBZODMIMFOBCU-MBSDFSHPSA-N 379.504 2.976 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N3C[C@H](C)C(=O)Nc4ccncc43)cnc21 1775962052 PRCRBLAQLMRVMR-ZDUSSCGKSA-N 378.436 2.717 0 50 GFAA O=C(C1CCC1)N1CC[C@@]2(O)CCN(Cc3ccc(OC(F)F)cc3)C[C@H]2C1 1073281459 XZRPKDWQXOFEGW-UWJYYQICSA-N 394.462 2.873 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)NC2(CN3CCCC3)CCCCC2)cc1 4745066 MOIYBPMIQGVSKF-UHFFFAOYSA-N 379.526 2.722 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc3nc(C(F)(F)F)[nH]c3c2)CC[C@@H]1O 2100557125 NJPNBLOCPXSVMG-SUMWQHHRSA-N 399.369 2.660 0 50 GFAA O=C(CCc1cccs1)NC[C@@H]1C[C@H](F)CN1C(=O)C1SCCS1 2325823401 RBJJAWWJSBCCRX-RYUDHWBXSA-N 388.555 2.542 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCC1)c1cc(C(F)(F)F)ccc1Cl 912581 WLLPRSGTBSBKER-UHFFFAOYSA-N 384.807 2.747 0 50 GFAA COC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(OC)c(Br)c1 955845 CUIUGEOMXIZQLP-CYBMUJFWSA-N 379.214 2.511 0 50 GFAA CCOC(=O)CCc1c(C)c2cc(Cl)c(OCC(=O)N(C)C)cc2oc1=O 1121132 SVPOPJIRBXPFNO-UHFFFAOYSA-N 395.839 2.718 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 1131373 AVIIGDFXTKGKAH-AWEZNQCLSA-N 376.478 2.953 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@H]1c1cc(Cl)c(O)c(OC)c1 4949329 UIWCYFRHVIRNJY-AWEZNQCLSA-N 396.852 2.877 0 50 GFAA O=S(=O)(N1C[C@H]2CC[C@H]1C2)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 246076534 FLKLZVVUYMDBDS-BHYGNILZSA-N 388.493 2.993 0 50 GFAA C[C@@H]1CN(Cc2ccccn2)CCN1C(=O)c1cncc(Br)c1 225384388 OITNCMREJRQHEG-CYBMUJFWSA-N 375.270 2.586 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(Cl)nc1)c1ccccc1OC1CCC1 118600226 CHNCIYIJBYYSSO-UHFFFAOYSA-N 380.853 2.926 0 50 GFAA CCOc1ccccc1CN1CCN(C2CCN(C(C)C)CC2)C[C@H]1CCO 104634305 RBZDTXMMXVXLBT-JOCHJYFZSA-N 389.584 2.827 0 50 GFAA COc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@H]2CCO)cc1C 106708303 GLWAUNYLBRVONT-OAQYLSRUSA-N 386.540 2.850 0 50 GFAA CCOCCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccoc3)nn2CC)C1 20878264 XTRZOTPNHRLVBG-KRWDZBQOSA-N 388.512 2.642 0 50 GFAA CN1C(=O)CC[C@H](C(=O)NCCc2ccc3c(c2)OCCO3)[C@H]1c1ccccc1 171985703 IKDPWPQBEGQURO-PGRDOPGGSA-N 394.471 2.726 0 50 GFAA CCO[C@@H](C)c1nc(C(=O)NS(=O)(=O)c2ccc3c(c2)CCC3)cs1 123829808 ARMYHWWHJZLUOQ-NSHDSACASA-N 380.491 2.848 0 50 GFAA COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1 8059045 KTSVQHMWSRQNRP-GFCCVEGCSA-N 378.450 2.702 0 50 GFAA CCn1cc(C(=O)N2Cc3cnc(Cc4ccc(OC)cc4)nc3C2)c(C)n1 216506166 HJPQTWBJWWDTJQ-UHFFFAOYSA-N 377.448 2.757 0 50 GFAA Cc1cc(NC(=O)N[C@@H]2CCCC[C@H]2S(C)(=O)=O)nn1C1CCCCC1 333165343 ICQXZWAJZHMRDH-HZPDHXFCSA-N 382.530 3.174 0 50 GFAA COc1ccccc1[C@H]1CCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)C1 363418237 FITLSTYEKRRPKA-OALUTQOASA-N 393.487 2.959 0 50 GFAA C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)Nc1cnn(-c2ncccn2)c1 376817563 CEGXXDYRPNAVEY-ZDUSSCGKSA-N 393.455 2.520 0 50 GFAA Cc1cnn(C2CCN(C(=O)CCC(=O)N3CCC(c4ccccc4)=N3)CC2)c1 369277554 MKZVPBNYVOYEOG-UHFFFAOYSA-N 393.491 2.772 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cccs1 238155076 VLVGCUXOAUHIFR-ZWNOBZJWSA-N 394.399 2.711 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N1CCCN2c3ccccc3C[C@@H]2C1 377978521 RXMMSFLFAJETBO-LJQANCHMSA-N 375.476 2.723 0 50 GFAA CS[C@@H]1CN(c2ncnc3c2cnn3-c2ccccc2)C[C@H]1N1CCCC1 242339396 ZHMJKCIAZFWUBK-QZTJIDSGSA-N 380.521 2.832 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CC4(CCNCC4)C[C@H]3C(=O)O)o2)cc1 72168216 QKVUUCKAWYIQOG-INIZCTEOSA-N 384.432 2.624 0 50 GFAA CCc1c(C)sc(NC(=O)COCC(=O)O)c1C(=O)Nc1ccccc1 17076962 KBGHRIWASUUWFH-UHFFFAOYSA-N 376.434 2.911 0 50 GFAA Cn1c([C@@H]2CCCN(C(=O)NCc3ccc(C(=O)O)o3)C2)nc2ccccc21 426547639 PINPVLBDSKEUER-CYBMUJFWSA-N 382.420 2.954 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@H]2CC(=O)OC23CCCC3)CC1(C)C 82146653 ILHMPMFGTIMWLR-MRXNPFEDSA-N 386.492 2.998 0 50 GFAA Cc1cc(=N/C(O)=C2\C=C(c3ccccc3)N=N2)n([C@H]2CCS(=O)(=O)C2)[nH]1 334159294 VGEYAFDIBLNVPJ-WQUZOCINSA-N 385.449 2.619 0 50 GFAA COc1ccccc1CN1CCN(C(=O)N[C@@H](C)Cc2cccc(C)n2)CC1 426712787 QSLYSCBMHIZDJS-SFHVURJKSA-N 382.508 2.857 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3ccc4nccnc4c3)C[C@H]2C(=O)O)c1 91988418 LJZVMMDOJMECJU-DLBZAZTESA-N 377.400 2.579 0 50 GFAA O=C(Cn1ccc([C@@H]2CCCNC2)n1)N1CCC(Oc2ccccc2F)CC1 426405144 MSBFJPGASUSRNA-MRXNPFEDSA-N 386.471 2.559 0 50 GFAA CC(C)NC(=O)c1ccc(S(=O)(=O)NCCCN(C)c2ccccc2)cc1 91665812 NEKOXFXJTNSULQ-UHFFFAOYSA-N 389.521 2.630 0 50 GFAA CCN(C(=O)Nc1ccccc1CN1CCCCC1)[C@@H]1CCS(=O)(=O)C1 95516511 LEKNASRAYCAHLJ-QGZVFWFLSA-N 379.526 2.713 0 50 GFAA COc1ccc(NC(=O)N2CCN(Cc3ccoc3)[C@H](CCO)C2)c(F)c1 96162792 BSRXEPVFMSDKTN-OAHLLOKOSA-N 377.416 2.528 0 50 GFAA CS(=O)(=O)NCCNC(=O)C[C@H](c1ccccc1)c1ccccc1Cl 95504171 UMIZJIRJCGRGLH-MRXNPFEDSA-N 380.897 2.527 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(CN(C)C)o2)C1 95503084 MIAXXYUITRPXRN-KRWDZBQOSA-N 387.528 2.509 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccc(F)cc3)CC2)C(=O)N1c1cccc(Cl)c1 97759518 WKSCQRLRRZYKCY-GOSISDBHSA-N 387.842 2.933 0 50 GFAA Cc1ccc(C(=O)[C@@H]2[C@@H]3C(=O)N(c4ccc(F)cc4)C(=O)[C@H]3[C@@H]3CCCN32)cc1 245329031 WZYOORBBJIMWMJ-HAGHYFMRSA-N 392.430 2.969 0 50 GFAA COCCn1c(CNC2(c3ccc(Cl)cc3)CC2)nnc1[C@H]1C[C@H](N)C1 252539885 OPZWIXFRGNJHIB-SAZUREKKSA-N 375.904 2.562 0 50 GFAA O=C1N(CCO)c2ccccc2[C@]12CCN(Cc1c[nH]nc1-c1ccccc1)C2 1940195302 KKBINGSKAODFEI-HSZRJFAPSA-N 388.471 2.559 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)NCCCc2cccnc2)[C@H]1c1ccccc1 1940197086 QXPBHTRRKOWGBF-RTWAWAEBSA-N 381.476 2.508 0 50 GFAA CCN1CCN(C(=O)c2cnn(-c3nccc(-c4ccco4)n3)c2C(C)C)CC1 299765447 AYVNLZUWXYIURR-UHFFFAOYSA-N 394.479 2.823 0 50 GFAA O=C(COc1ccccc1)N1CCCN(C(=O)NCCc2ccccc2)CC1 56504775 LBEAGJCVYUHWAQ-UHFFFAOYSA-N 381.476 2.552 0 50 GFAA Cc1cc(Br)c2ccccc2c1NC(=O)N1CCO[C@@H](C(N)=O)C1 268740383 TVPPEPYPCGSSSI-CQSZACIVSA-N 392.253 2.629 0 50 GFAA CCc1cc(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)[nH]n1 186462216 BJYMPVAJWCGORD-ZDUSSCGKSA-N 380.370 2.522 0 50 GFAA CC(C)(C)OC(=O)NC/C=C/CNS(=O)(=O)N1CCC(C(C)(C)C)CC1 170599204 QXWARVRTGRDVFC-BQYQJAHWSA-N 389.562 2.660 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N1CCC(NC(=O)C2CC2)CC1 194974148 LKONUZQNQIIVFO-UHFFFAOYSA-N 398.507 2.754 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CCCN(C(=O)c4cnccn4)CC3)coc2c1 1772701118 CAPVTYBZTWBFGZ-UHFFFAOYSA-N 392.459 2.757 0 50 GFAA COC[C@H]1CCN(C(=O)c2cc(COc3ccc(OC)cc3Cl)[nH]n2)C1 11818989 YJKAMGQPKPVGDX-LBPRGKRZSA-N 379.844 2.759 0 50 GFAA CCOC(=O)CN(C)C(=O)CCc1nnc(Cc2cccc(C(F)(F)F)c2)o1 12716197 IEVBVYYYWMTXDB-UHFFFAOYSA-N 399.369 2.633 0 50 GFAA CCN(CCn1cccn1)Cc1ccccc1OC[C@@H](O)CN1CCCCC1 15064984 OAQNLIFMCUOIIF-NRFANRHFSA-N 386.540 2.631 0 50 GFAA CO[C@H]1CN(Cc2ccc(OC(F)F)cc2)CC(=O)N(Cc2cccnc2)C1 19145908 HCLHYFIKMCCAFA-SFHVURJKSA-N 391.418 2.542 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)CCc1n[nH]c2ccccc12 1857527470 PCHDNCBIOYZYRU-LIRRHRJNSA-N 394.479 2.812 0 50 GFAA CCc1ccc(-c2nccn2-c2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)nc1 1857666825 GFVARGAYGBDCDO-INIZCTEOSA-N 385.493 2.670 0 50 GFAA Cc1cc(COc2ccccc2)oc1C(=O)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857669640 CDFASPVKZYZIDB-YCRPNKLZSA-N 385.416 2.730 0 50 GFAA O=C(NCc1csc(Cc2ccccc2)n1)[C@H]1CC(=O)N(c2nccs2)C1 1857674174 VSXDYOHAXUKZEH-AWEZNQCLSA-N 398.513 2.860 0 50 GFAA Cc1cccc(CN2CCOC3(CCN(Cc4c(C)n[nH]c4C)CC3)CC2=O)n1 1857688024 PSLLYQHERLNYMN-UHFFFAOYSA-N 397.523 2.514 0 50 GFAA Cc1ccc(OCC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1857727528 SETSQZKVKFJLMX-VIZSFHNOSA-N 392.455 2.675 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)CCn3cnc4ccccc43)C[C@H]12 1857728889 QCEBGBCWSJORHA-IAGYGMIVSA-N 381.476 2.886 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)C4CCC4)C[C@]34CC[C@H]2O4)c1C 1857738039 OWTTUDKBIGOUGM-DZCCDHAISA-N 382.504 2.839 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3nccs3)C[C@]23CC[C@H]1O3)c1ccc(Cl)o1 1875243940 FGIYMMKPCLUITK-SHFDMQKMSA-N 379.869 2.803 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCC(Cc3ccccc3)CC2)[C@H]1c1cnn(C)c1 115202144 RTYFSRMFCAAGJO-RBBKRZOGSA-N 394.519 2.811 0 50 GFAA Cn1cc(-c2ncc(C(=O)N(Cc3ccccc3)CC3(CO)CC3)s2)cn1 952845493 FAUJXGZXCSQXBT-UHFFFAOYSA-N 382.489 2.959 0 50 GFAA Cn1cnc2cc(NC(=O)[C@H]3C[C@@H]3C(=O)Nc3ccc4c(c3)ncn4C)ccc21 1875263114 PZQOIPNDUHLXCO-GJZGRUSLSA-N 388.431 2.673 0 50 GFAA C[C@](NC(=O)CCCN1Cc2ccccc2C1=O)(C(N)=O)c1cccc(Cl)c1 1875283368 PGLGXWOTYQNTCB-OAQYLSRUSA-N 399.878 2.593 0 50 GFAA C[C@H](C(=O)Nc1ccc(C(C)(C)C)cc1)n1cc(CNC(=O)C(F)(F)F)nn1 881013700 BAEUMPOYDJWWLI-LLVKDONJSA-N 397.401 2.954 0 50 GFAA COc1ccccc1N1CCCN(C(=O)/C(=C\c2cccs2)NC(C)=O)CC1 889476536 BCHSHQRRQCUVQF-OBGWFSINSA-N 399.516 2.973 0 50 GFAA CC1=C(C(=O)OCc2ccc3c(c2)OCO3)[C@H](c2ccccc2F)NC(=O)N1 706469 PMZDQUMBHKRUPR-SFHVURJKSA-N 384.363 2.926 0 50 GFAA CC(C)CCN1C[C@@H](CC(=O)NCC(C)(C)c2ccn(C)n2)OCC12CCC2 2325785393 WHWFMULLTDHCQD-GOSISDBHSA-N 390.572 2.874 0 50 GFAA CNC(=O)Nc1ccc(C(=O)N[C@H](C(=O)OC)C2CCCCC2)c(Cl)c1 2325801097 VVCXVUKIAZQBKV-HNNXBMFYSA-N 381.860 2.943 0 50 GFAA O=C(Nc1c[nH]nc1OCC(F)F)c1ccc2c(Br)cnn2c1 2325840492 CCDXWHKXUNNOCP-UHFFFAOYSA-N 386.156 2.716 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)N3CCc4ccccc4C3)C2)cc1 784602 QPNRGLIEFVASHN-HXUWFJFHSA-N 398.528 2.981 0 50 GFAA O=C(c1ccccc1-c1nn[nH]n1)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccccc2)C1 2356140108 URDARCKKJDTQLV-VQPPSCEASA-N 389.459 2.627 0 50 GFAA CCN(CC)C(=O)c1ccc(-c2cnc3c(N4CCC(O)CC4)nccn23)cc1 2356143777 WMRNEQGAJWKJAV-UHFFFAOYSA-N 393.491 2.839 0 50 GFAA O=C(c1cccc(F)c1F)N1CC[C@H]2[C@@H]1CCN2Cc1nc2ncccc2o1 2356166243 YOOCBWATCLBKNW-GJZGRUSLSA-N 384.386 2.990 0 50 GFAA CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1cc(C)ccc1OC 4858720 NCSRUZIJSAHVCM-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA COC(=O)c1c(NC(=O)C2CCN(C(C)=O)CC2)sc2c1CC[C@@H](C)C2 6730907 CJIYNJDKRYQJQX-LLVKDONJSA-N 378.494 2.857 0 50 GFAA O=C(CCc1cccc(F)c1F)NCCS(=O)(=O)CCc1ccccc1 225720892 BJLQVUGHGOFBIX-UHFFFAOYSA-N 381.444 2.671 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc2oc(CC)nc2c1 114680263 HOUZQPNWOZIGJE-HNNXBMFYSA-N 379.482 2.923 0 50 GFAA CCCCN(Cc1ccsc1)C(=O)Cc1nc2[nH]c3c(c(=O)n2n1)CCCC3 102507896 NJUUOPRFVHDFGI-UHFFFAOYSA-N 399.520 2.729 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)N2CCC[C@@H]2c2ccc(C(N)=O)s2)c1C 23399632 QCCVEEGIIVALSY-GFCCVEGCSA-N 389.477 2.946 0 50 GFAA N[C@@H]1c2ccccc2C2(CCN(C(=O)Cc3ccc(F)cc3Cl)CC2)[C@H]1O 72161536 FJAIQJOMACBDRV-UXHICEINSA-N 388.870 2.956 0 50 GFAA CN(C)[C@H](CNC(=O)c1cnn(-c2ccc(F)cc2)n1)c1c(F)cccc1F 118946222 RLCSOGGUYKLHQS-QGZVFWFLSA-N 389.381 2.717 0 50 GFAA Cn1cnc2cc(C(=O)N3CCCN(C(=O)c4cccc(F)c4)CC3)ccc21 123461904 SHMNDJCWLYUPMM-UHFFFAOYSA-N 380.423 2.701 0 50 GFAA CC[C@]1(C)CN(C(=O)NCc2ccc(C)nc2-n2cc(Cl)cn2)CCO1 252550192 SFLNHZUHDMSVFE-GOSISDBHSA-N 377.876 2.940 0 50 GFAA CCc1noc([C@H](C)NC(=O)c2cc(Cn3c(C)nc4ccccc43)on2)n1 67472871 JPYMZTHDZNRHMI-NSHDSACASA-N 380.408 2.817 0 50 GFAA CCCCNC(=O)C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72143101 USIPALWADDRLKA-NRFANRHFSA-N 379.504 2.960 0 50 GFAA O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCNC[C@@H]1c1cccnc1 261890670 ZPYHJEVPFKLRKU-TZIWHRDSSA-N 382.483 2.606 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC[C@]3(C2)C(=O)N(C)c2ccccc23)c1C 72159346 QXIYKXRTIGVJDF-JOCHJYFZSA-N 379.460 2.985 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C2CCCC2)[C@H](CCO)C1 39516190 FNMIWRGRNVOHQN-GOSISDBHSA-N 378.513 2.524 0 50 GFAA COc1cc(F)ccc1-c1cc(C(=O)O)cc(S(=O)(=O)N2CCCC2)c1 71775794 PEOOEQVLMYMLMM-UHFFFAOYSA-N 379.409 2.984 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)NCc3cccc(Cl)c3)n2)c1 40286752 AJUIDBRBNBEQHS-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA Cc1cc(C)n2c(C(=O)N3CCC[C@H]3c3nc4ccccc4n3C)nnc2n1 222928404 CWIXFZLKHAGXPN-INIZCTEOSA-N 375.436 2.605 0 50 GFAA NC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CC1 237942899 YJZYINPMGUOKRB-KRWDZBQOSA-N 375.472 2.560 0 50 GFAA COCCn1nnc2c1CCN(C(=O)N[C@@H](C)c1ccc3ccccc3c1)C2 292936751 DZZMPZUYBCHQSG-HNNXBMFYSA-N 379.464 2.907 0 50 GFAA Cc1ccc2nc(CN(C)C3CCN(c4ncnc5[nH]cnc45)CC3)[nH]c2c1 95521683 CKGJBGZBWLCXRO-UHFFFAOYSA-N 376.468 2.638 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N(C)Cc1nc(-c3cccnc3)no1)n2C 91505058 MSZVZGIYDDXXFM-UHFFFAOYSA-N 377.404 2.904 0 50 GFAA COc1ccc(C(=O)N2CCC(O)CC2)cc1OC1CCN(C(C)C)CC1 95523465 YVEBYIDMOHOROH-UHFFFAOYSA-N 376.497 2.544 0 50 GFAA Cc1cccc([C@@H](C)Nc2ncc(C(C)(C)C(=O)O)c(N3CCOCC3)n2)n1 96141936 NIOHMJIYRCCZRR-CQSZACIVSA-N 385.468 2.552 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)Cn2ccnc2-c2ccccc2)CC1 91650659 AGDQXPUEEZIWML-UHFFFAOYSA-N 375.476 2.598 0 50 GFAA CCc1nc2c(N3CCC[C@@H](CNC(=O)c4ccc(F)cc4)C3)ncnc2o1 95531759 OEQXYIKOUOGXDQ-ZDUSSCGKSA-N 383.427 2.966 0 50 GFAA COc1ccc(-c2n[nH]c(C)c2CC(=O)N[C@H](CO)Cc2ccccc2)cc1 252482996 DRZSIYZEQMQDNQ-SFHVURJKSA-N 379.460 2.656 0 50 GFAA Cn1cncc1[C@H]1N[C@](CO)(c2ccccc2)[C@H]2CN(Cc3ccccc3)C[C@@H]12 65467365 GGPPQPDBPHFIDR-AWAHEQQVSA-N 388.515 2.700 0 50 GFAA CCc1cccc(NC(=O)[C@@H]2CC(=O)N(c3cc(OC)c(OC)c(OC)c3)C2)n1 1940198215 VJEIGVBTXOUHRN-CYBMUJFWSA-N 399.447 2.661 0 50 GFAA O=C(NCCOc1cccc2cccnc12)N1CCC[C@@H](Cn2ccnc2)C1 584891459 FCIYOXKMWKJYGP-KRWDZBQOSA-N 379.464 2.932 0 50 GFAA O=C(NCCOc1ccccc1F)C12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 827676689 UREHTJZRCHKYHD-XBLGPDGASA-N 384.455 2.908 0 50 GFAA COCCN1C[C@H](C(=O)N2CCC(Oc3cccc(Cl)c3)CC2)CCC1=O 824412451 UAQQYSAFIZJBHN-OAHLLOKOSA-N 394.899 2.595 0 50 GFAA CC(C)[C@@H]1C(=O)NCCN1Cc1ccccc1-c1nc2c(c(=O)[nH]1)CCCCC2 63869720 AFCAZZIDNVAYTO-HXUWFJFHSA-N 394.519 2.662 0 50 GFAA Cc1ocnc1C(=O)N1CCC(CNC(=O)c2cc(-c3ccccc3)[nH]n2)CC1 952963157 ISCWOSSGTZNMAR-UHFFFAOYSA-N 393.447 2.655 0 50 GFAA COc1ccc(-c2cc(CNC(=O)Cn3nc(C)c(C(C)=O)c3C)no2)cc1 952861062 XNYVRUCEFRGXMW-UHFFFAOYSA-N 382.420 2.683 0 50 GFAA CCc1ccccc1C(=O)NC[C@H]1CCCN(C(=O)c2ccc(C)nc2O)C1 952991285 NAWNIVXTXGTCLS-MRXNPFEDSA-N 381.476 2.940 0 50 GFAA Oc1cccc(CN2CCC[C@H](NCc3cnc(N4CCCCC4)nc3)C2)c1 952988250 NBQQCDWCRDBSHO-FQEVSTJZSA-N 381.524 2.927 0 50 GFAA Cc1nn(C)c(C)c1NC(=O)C(=O)NC1(c2ccc(Br)cc2)CC1 170690233 RIXQYDJDSRWQAY-UHFFFAOYSA-N 391.269 2.543 0 50 GFAA CO[C@@H](CNC(=O)N1CCC(NC(=O)c2ccoc2C)CC1)c1ccccc1 171165048 IFFMIYZQLVKLTA-IBGZPJMESA-N 385.464 2.880 0 50 GFAA CN1C(=O)Cc2cc(NC(=O)[C@@H]3CCCN(C(=O)Cc4ccccc4)C3)ccc21 194611310 AICUHURUCRNWEA-QGZVFWFLSA-N 391.471 2.625 0 50 GFAA Cn1cc(-c2cncc(C(=O)N3CCO[C@H](c4ccc(F)c(F)c4)C3)c2)cn1 731188033 SLWSCENSDRRQJM-IBGZPJMESA-N 384.386 2.974 0 50 GFAA Cc1cnc(C)c(N2CCN(C[C@H]3CN(Cc4ccccc4)CCCO3)CC2)n1 1506401974 PDQRTBMFNCGEGY-QFIPXVFZSA-N 395.551 2.507 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3cc(-c4ccncc4)no3)C2)N1Cc1cscn1 1506401079 HVVMGHPKCGKNFN-DOTOQJQBSA-N 395.488 2.816 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)/C=C/c2c(Cl)cccc2Cl)cc1 657485 HONVAMQBMVCSBT-CMDGGOBGSA-N 385.272 2.970 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2cccc(Cn3cccn3)c2)CC[C@@H]1O 1529180661 HISMUIZSYIGVAC-BJKOFHAPSA-N 391.515 2.719 0 50 GFAA Cc1nn(C)cc1NC(=O)C1(c2ccc(S(C)(=O)=O)cc2)CCCCC1 1529172889 JVZKJLPXFROIPC-UHFFFAOYSA-N 375.494 2.973 0 50 GFAA COc1ccc(CNC(=O)CN2CCC[C@]3(CCC[C@H]3OC)C2)cc1OC 1704300615 ZOVVPYFMWGXODL-TZIWHRDSSA-N 376.497 2.601 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)CCc4cnccn4)C3)C2)c1 12713385 NXCWZZGUSMSCFM-HSZRJFAPSA-N 394.519 2.933 0 50 GFAA CCN(CCO)C(=O)c1cnn(-c2ncc3c(n2)-c2ccccc2CCC3)c1C 14958488 PHKQEIQUQOFPPJ-UHFFFAOYSA-N 391.475 2.581 0 50 GFAA CCN(CC)C(=O)c1cn([C@@H]2CCCN(Cc3ccc(OC)c(C)c3)C2)nn1 15001362 SUWMGOIAUCRDPA-GOSISDBHSA-N 385.512 2.914 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857676682 WNNROGASMQWAQG-UHFFFAOYSA-N 380.492 2.797 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)N3CCN(c4ccc(F)cn4)[C@@H](C)C3)c2n1 1857708770 MQFMSPGXTJSGQO-AWEZNQCLSA-N 382.443 2.540 0 50 GFAA CCc1ncc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cn1 1857713284 SNJDYMWQCZMQIJ-FPOVZHCZSA-N 380.492 2.717 0 50 GFAA Cc1ccc(-c2cc3c(s2)C2(CCN(C(=O)[C@@H]4CCOC4)CC2)OCC3)nn1 1857720135 GEHMZWNEOBGODS-MRXNPFEDSA-N 399.516 2.940 0 50 GFAA CCN(CC)C(=O)c1ccc(C(=O)N2CC[C@@](CO)(c3ccccc3)C2)cc1 462962690 BBKALVVNKARDGU-HSZRJFAPSA-N 380.488 2.945 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)c3cccc(OCc4noc(C)n4)c3)C2)n1 157292013 CSERZBGGWLIYFL-HNNXBMFYSA-N 383.408 2.668 0 50 GFAA O=C([C@@H](F)CN(Cc1ccccc1)Cc1ccccc1)N1CCn2cnnc2C1 864097076 ZDTKPMPAKIKXFO-FQEVSTJZSA-N 393.466 2.661 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2cccc(C(F)F)c2F)N(c2ccncn2)C1 864339938 QPXYNUVNOMUINW-RYUDHWBXSA-N 380.370 2.577 0 50 GFAA O=C1c2ccccc2CCN1NS(=O)(=O)c1ccc([C@H]2CC2(F)F)cc1 1875290666 WEUYJKJANYGVTM-MRXNPFEDSA-N 378.400 2.701 0 50 GFAA COc1ccc(C)cc1CCNC(=O)N1CCC[C@@]12CCC[S@](=N)(=O)C2 1875393794 SWLAQFKJKMTTAX-SIBVEZHUSA-N 379.526 2.931 0 50 GFAA COC(=O)[C@H]1CCCN(C(=O)Cn2nc(C(F)(F)F)c3c2CCCC3)CC1 1875319056 PKZBIKNUYFMMNN-LBPRGKRZSA-N 387.402 2.582 0 50 GFAA Cc1ccc(CNC(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)c(N2CCOCC2)c1 1875393706 LSCOGPOBPCWMLB-CABCVRRESA-N 384.480 2.507 0 50 GFAA COc1ccc([C@@H](NC(=O)N2CCO[C@@](C)(C(F)F)C2)c2nccn2C)cc1 888102068 XTHHXRXHZAJOBH-DNVCBOLYSA-N 394.422 2.584 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccccc1Br 4144276 TWCFGSSEBKLZLF-ZDUSSCGKSA-N 385.283 2.983 0 50 GFAA CCN(C)Cc1cc(O[C@H]2CCN(C(=O)[C@H]3CCCc4nc(C)[nH]c43)C2)ccn1 2325806417 SBISGPOZESQSOO-OALUTQOASA-N 397.523 2.665 0 50 GFAA O=C(Oc1cc2ccccc2cc1OC(=O)N1CCOCC1)N1CCOCC1 795454 QOLALTBIHKVSPB-UHFFFAOYSA-N 386.404 2.502 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@@H](c3cccc(OC)c3OC)C2)cc1 1165360 CBPUZZOZWLJICV-QGZVFWFLSA-N 390.461 2.823 0 50 GFAA CN1CCC(Oc2ccc(Nc3nccc(N4CCC[C@@H](O)C4)n3)cc2)CC1 2356134059 VYSWAPOASYWRII-QGZVFWFLSA-N 383.496 2.654 0 50 GFAA CC[C@H](C)NC(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccccc1 2961261 AYMLKKNPRIXCAU-HNNXBMFYSA-N 376.478 2.805 0 50 GFAA CCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccc(OC)c(Cl)c2)n1 4840314 HIQLPNSQGHIANV-UHFFFAOYSA-N 390.248 2.838 0 50 GFAA Cc1cc(S(=O)(=O)N2CCCC2)ccc1OCC(=O)NC1CCCCC1 6700743 RGTAJYIVUXUYIA-UHFFFAOYSA-N 380.510 2.607 0 50 GFAA Cc1ccc(S[C@H](C)C(=O)N2CCC(CN3CCN(C)CC3)CC2)cc1 57065990 SEBKZSXUMUFOAH-GOSISDBHSA-N 375.582 2.962 0 50 GFAA Cc1csc2nc(=O)c(-c3ccccc3NC(=O)[C@H]3CC(C(C)C)=NO3)nn12 55199999 MIXUOILMSWFVON-OAHLLOKOSA-N 397.460 2.866 0 50 GFAA Cn1nc([C@@H]2CCCN(C(=O)Nc3ccccc3)C2)n(-c2ccccc2)c1=O 67885816 UNHRYMRBAJHOQB-MRXNPFEDSA-N 377.448 2.983 0 50 GFAA CCCOc1nc(C)ccc1C(=O)N[C@H](C)Cn1ncc2ccccc2c1=O 252494339 NSMFQMZFXOSGBS-OAHLLOKOSA-N 380.448 2.707 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(Cc3cc(Cl)cc4cccnc34)C2=O)nn1 328611221 KSGLSVCCHNLUNL-MRXNPFEDSA-N 398.854 2.928 0 50 GFAA COC(=O)c1cncc(N2CCC[C@]3(CCC(=O)N(Cc4ccccc4)C3)C2)n1 72419097 XHYIPOUZMZZBIQ-QFIPXVFZSA-N 394.475 2.672 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1)N1CCCOCC1 71753930 TZSVHJMSOQHEBE-JOCHJYFZSA-N 399.579 2.654 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)N[C@H](C(=O)O)c1ccccc1 71328817 CVLOLYRNGSMQGV-IBGZPJMESA-N 397.818 2.506 0 50 GFAA CC(=O)N[C@H](CC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1 363362375 HCSBZNDHEKDASO-JTHBVZDNSA-N 393.531 2.935 0 50 GFAA CCNc1nc(C)c(C(=O)N2CCC(=O)N(CC3CC3)[C@H](C(C)C)C2)s1 71750390 BRQXLGPJNANAGM-HNNXBMFYSA-N 378.542 2.992 0 50 GFAA Cc1cnc(C2CCN(C(=O)NC3CCN(C[C@H]4CCOC4)CC3)CC2)s1 370446565 FJAAXENQCKXDPS-MRXNPFEDSA-N 392.569 2.841 0 50 GFAA CCNc1nc(C)c(C(=O)N2CCC(=O)N(CC3CC3)[C@@H](C(C)C)C2)s1 71750391 BRQXLGPJNANAGM-OAHLLOKOSA-N 378.542 2.992 0 50 GFAA CN(CC(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1)S(=O)(=O)c1ccc(F)cc1 242339187 ZFRDOOZVMDEQHL-HLLBOEOZSA-N 382.501 2.921 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](CN3CCCC3)C2)CC1 174217558 DESRKTIAQOOGFD-SFHVURJKSA-N 386.540 2.791 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](CNC(=O)c3cc(N)nc(Cl)c3)C2)c1 177106606 BERQZXMUYINXKC-GFCCVEGCSA-N 390.871 2.591 0 50 GFAA O=c1cc(-c2cccnc2)nc(-c2ccc(CN3CCC(CO)CC3)cc2)[nH]1 48241158 KSCKGLUZFOETMG-UHFFFAOYSA-N 376.460 2.703 0 50 GFAA COc1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cccc4nccnc24)C3)cn1 222460748 MHZOIHFWZCBIKW-UHFFFAOYSA-N 386.415 2.622 0 50 GFAA CCC(=O)NCc1cc2n(n1)CCN(Cc1ccccc1-n1nc(C)cc1C)C2 426503223 FSPAMMXTWDGEAV-UHFFFAOYSA-N 392.507 2.728 0 50 GFAA O=c1cc(-c2cccnc2)nc(-c2ccc(CN3CCC[C@H](CO)C3)cc2)[nH]1 48130348 FRUPFJINPQVFHO-KRWDZBQOSA-N 376.460 2.703 0 50 GFAA Cc1ccc2c(CC(=O)N3CCC[C@H](c4ccnn4CC(=O)O)C3)coc2c1 426380262 AJJSJPFSMVIQQS-HNNXBMFYSA-N 381.432 2.971 0 50 GFAA CN1CC[C@]2(CCC1=O)CN(Cc1cccc(F)c1C(F)(F)F)CCN2C 95379396 WIEYUJCTTXFYOB-GOSISDBHSA-N 387.421 2.973 0 50 GFAA CC(C)c1noc([C@H]2CCCN(C(=O)Cn3ccc4ccccc4c3=O)C2)n1 95512246 RLBMZDLRVVVCAP-INIZCTEOSA-N 380.448 2.914 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C(=O)C[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254418788 BIEADAHRODWPEW-HVNRUFHFSA-N 388.504 2.783 0 50 GFAA Cc1oc(CN(C)C(=O)c2nc(N3CCCC3)ncc2Cl)cc1C(=O)O 299751618 RAQCZSCPEBSLAD-UHFFFAOYSA-N 378.816 2.602 0 50 GFAA O=C(NCc1nn[nH]n1)c1ccc(-c2ccc(CN3CCCCC3)cc2)cc1 534638297 JMUFEHVEVFMNOO-UHFFFAOYSA-N 376.464 2.783 0 50 GFAA Cc1nc(CN2CC[C@@H](NC(=O)c3cc(Cl)ccc3C)[C@H](O)C2)cs1 299801466 YVKHCAKVXZPQIG-IAGOWNOFSA-N 379.913 2.779 0 50 GFAA COc1ccc(OC)c([C@H](C)NC(=O)N2CCN(C3CCCCC3)C(=O)C2)c1 584892009 PBOHCPQJRZFXMM-HNNXBMFYSA-N 389.496 2.951 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(I)cc1 239403348 RVGHVGYEUBBIMP-RBJBARPLSA-N 383.185 2.753 0 50 GFAA CCCc1cc(CNS(=O)(=O)c2cc(-c3ccno3)ccc2OC)on1 670450743 VKDIQQNPBWFYDS-UHFFFAOYSA-N 377.422 2.769 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 268944439 MBEYIXSPAJKZCP-KURKYZTESA-N 379.412 2.599 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)C(=O)c1cnc2ccccn2c1=O 952869625 XAIGSOBGDJJZJT-UHFFFAOYSA-N 375.432 2.584 0 50 GFAA CN(Cc1cccc(Cl)c1)C(=O)[C@@H]1Cc2ccccc2CN1S(C)(=O)=O 169913147 VOPBJROREAJGIT-SFHVURJKSA-N 392.908 2.685 0 50 GFAA CCc1csc([C@@H]2CCCN(C(=O)c3c(C)nn(C)c3-n3cccn3)C2)n1 189528006 CVPKRDKCZQQFPW-CQSZACIVSA-N 384.509 2.953 0 50 GFAA COc1cc(/C=C/C(=O)O)cc(S(=O)(=O)N2CCc3ccccc32)c1OC 715255 VOCNVRJXSJPINX-BQYQJAHWSA-N 389.429 2.553 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC[C@@]3(CCc4cnc(N)nc43)C2)cc1 1704307220 WAFRJJYIBRVLRL-JOCHJYFZSA-N 390.491 2.733 0 50 GFAA CCOc1ccccc1NC(=O)Cn1nc(-c2cccc(OC)c2)ccc1=O 5400093 CIBIDPMLXDJSJR-UHFFFAOYSA-N 379.416 2.956 0 50 GFAA CCCCn1c(CN2CCC(N3CCCC3)CC2)cnc1S(=O)(=O)CC 11936733 QAVXGTRSKXEDHC-UHFFFAOYSA-N 382.574 2.537 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N[C@H]1CCCN(CCCc2ccccc2)C1 12050698 RNLILUXWTYJJRT-IBGZPJMESA-N 393.487 2.808 0 50 GFAA O=C(N[C@H]1CCCN(CCc2ccccc2)C1)c1ccccc1N1CCOCC1 12435004 UQKKRNVOIVRPKJ-NRFANRHFSA-N 393.531 2.960 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)[C@@H]3CCCCN3C)CC2)cc1 12582194 HKBIRBARIVUGNC-QFIPXVFZSA-N 387.568 2.892 0 50 GFAA COc1ccc(C(=O)CSc2nc3nc(C)cc(C)c3c(=O)[nH]2)cc1OC 13125468 XUEUVOGSOKGQLH-UHFFFAOYSA-N 385.445 2.927 0 50 GFAA COCCS(=O)(=O)c1ncc(CN2CCCCCC2)n1Cc1ccccc1 15062147 PMSPTILEDCVKNS-UHFFFAOYSA-N 391.537 2.728 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CCC[C@@]2(CC1)CN(C)C(=O)O2 1857670160 XFTBZDLEHULFQJ-HXUWFJFHSA-N 386.427 2.971 0 50 GFAA Cc1ccnc(N2CCC3(CC2)OCCc2sc(C(=O)NC4CC4)cc23)n1 1857686193 LKQSMLVTVJELIM-UHFFFAOYSA-N 384.505 2.807 0 50 GFAA Cc1cc(N2CCO[C@]3(CCN(C(=O)C4CCOCC4)C3)C2)c2ccccc2n1 1857688113 UONHZPBCFNGRFD-HSZRJFAPSA-N 395.503 2.778 0 50 GFAA Cc1ccccc1-c1ncc(-c2nccn2-c2cnn(CCCC(N)=O)c2)cn1 1857690108 AGVRDZLSMDRTME-UHFFFAOYSA-N 387.447 2.767 0 50 GFAA COc1ccc(C(=O)N2CCN3CC[C@H]2C3)cc1Oc1cc(F)cc(CN)c1 1857690508 LMMKRMSBNGXHFW-KRWDZBQOSA-N 385.439 2.615 0 50 GFAA NC(=O)[C@@H]1CCCN(CCn2ccnc2-c2ccc3cc(Cl)ccc3n2)C1 1857691552 PVJPLEWVCPYQSL-OAHLLOKOSA-N 383.883 2.949 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(c1nnc(-c3ccccc3)s1)C[C@H]2O 1857718770 SCBDMEIOQZCNSN-NEYJZJCJSA-N 379.485 2.778 0 50 GFAA Cc1ccccc1CN1CCC(C2CCN(C(=O)CN3CCOC3=O)CC2)CC1 1857736522 KSOWSKMVALKBIT-UHFFFAOYSA-N 399.535 2.898 0 50 GFAA CCCNC(=O)[C@H]1CC[C@@H](NC(=O)Cc2ccc(OC)cc2)[C@H](OCCC)C1 1875246064 HJWVGHTWCCNUHJ-DFQSSKMNSA-N 390.524 2.844 0 50 GFAA Cc1cc(C(=O)N2C[C@H](c3ccccc3)[C@@H](C(=O)O)C2)c2c(C)nn(C)c2n1 219322646 JBNPCNQOCKBKBH-SJORKVTESA-N 378.432 2.526 0 50 GFAA Cc1cccc(C)c1OC1CCN(C(=O)c2nnn(C3CCNCC3)c2C)CC1 237643409 GBLJQPFIVVBIHY-UHFFFAOYSA-N 397.523 2.811 0 50 GFAA C[C@@H](OC(=O)[C@H]1CNC(=O)c2ccccc21)C(=O)N1CCSc2ccccc21 860417125 CXSITQJPUPEWMQ-CJNGLKHVSA-N 396.468 2.584 0 50 GFAA Cc1ncccc1CNC(=O)NC[C@@H]1CCCN(C2CC2)[C@H]1c1cncn1C 952852317 STXVFFJTJSOXPS-FXAWDEMLSA-N 382.512 2.538 0 50 GFAA C[C@]1(F)CCCCN(C(=O)N[C@@H](C(=O)N2CCOCC2)c2ccccc2)C1 1875265855 PSGOHWAZLQFIBU-XLIONFOSSA-N 377.460 2.510 0 50 GFAA CC[C@@]1(C)CCCN(C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)C1 1875350561 RTFXSUOHIASXGW-FQEVSTJZSA-N 381.436 2.741 0 50 GFAA O[C@@H]1C[C@H](Cn2cccn2)C[C@H]1NCc1cccc(OCc2ccccn2)c1 1875400041 PSGYRMDWRJATCF-STZQEDGTSA-N 378.476 2.786 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2 888101338 KWDPNRDYDWXHPX-SCRDCRAPSA-N 388.386 2.896 0 50 GFAA COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1ccc([C@@H]2CCCC(=O)N2)cc1 2325780612 AUNUMYCGFDWJLX-RBUKOAKNSA-N 381.428 2.969 0 50 GFAA O=C([C@H](c1ccccc1)n1sc2ccccc2c1=O)N1CC2(CCNCC2)C1 2325795755 WYBZAFAMONSKFE-IBGZPJMESA-N 393.512 2.864 0 50 GFAA O=C(O)C[C@@H]1CN(c2ncnc3[nH]c4ccccc4c23)C[C@H](C(F)(F)F)O1 2325809014 SKLFTKCPJNZFHT-BXKDBHETSA-N 380.326 2.722 0 50 GFAA CC(C)(C(=O)N1CC2(C[C@H](NC(=O)Cc3ccco3)c3nccn32)C1)C1CCC1 2332237815 MTNGCTWMDXVILE-KRWDZBQOSA-N 396.491 2.644 0 50 GFAA O=C(c1cc2nc(-c3ccccc3)cc(C(F)(F)F)n2n1)N1CCOCC1 756452 MVIZQXDQGRBUOO-UHFFFAOYSA-N 376.338 2.888 0 50 GFAA CCOC(=O)c1sc2ncn(CC(=O)Nc3ccc(C)cc3)c(=O)c2c1C 921199 CHRGEDJSVLDMBP-UHFFFAOYSA-N 385.445 2.890 0 50 GFAA CCOc1cc(NC(=O)N2CCCN(Cc3cnn(C)c3)CC2)ccc1OC 136766438 DQYUFYDELNMCDG-UHFFFAOYSA-N 387.484 2.567 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2C)cc1Cl 2886049 CQUHZIBXZGXTPN-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA O=C(Cn1cccn1)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2356154859 NCKHSZHXSIDLFT-JOCHJYFZSA-N 390.487 2.848 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC2(CC1)C[C@](C)(O)CCO2 2356156848 TYERYTPGZKXOAU-JOCHJYFZSA-N 397.519 2.954 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2nc(-c3ccc(C)cc3)no2)C1=O 2356156990 ZHMNUHCWAKGIIS-NRFANRHFSA-N 384.480 2.648 0 50 GFAA CCN(CCNC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccc1 4057601 HGEUSZSCXVEQEH-FQEVSTJZSA-N 379.504 2.720 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)N(C)Cc2cc(C)no2)[C@H](c2ccccc2C)N1C 55036748 CKLRINSSXSPAPW-IPJJNNNSSA-N 399.491 2.875 0 50 GFAA CCCc1ccc(-c2n[nH]c3c2CN(C(=O)c2cc(C)nc(N)n2)CC3)cc1 23582189 GPXMURLIKCRCNP-UHFFFAOYSA-N 376.464 2.908 0 50 GFAA CC1CCN(c2ccc(=O)n(CC(=O)Nc3cc(F)c(F)c(F)c3)n2)CC1 61720977 HVOIFUSXEUYNON-UHFFFAOYSA-N 380.370 2.536 0 50 GFAA Cn1cncc1[C@H]1C[C@H](NS(=O)(=O)/C=C/c2ccccc2Cl)CCO1 328625923 LDJKOPWESWEDBH-KZSTWYPGSA-N 381.885 2.884 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccc(OCC)cc3)[C@H](CCO)C2)CC1 39536943 ZJCZSTWPVBTVKY-JOCHJYFZSA-N 389.584 2.828 0 50 GFAA CC1CCN(C(=O)c2ccc(N3CCC[C@@H](N4CCCCC4=O)C3)nc2)CC1 363526220 CJAZNCHQHMEVED-LJQANCHMSA-N 384.524 2.935 0 50 GFAA O=C(O)c1ccc(CN2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cc1 71763798 YJTZDSKALHYHNO-FQEVSTJZSA-N 399.535 2.684 0 50 GFAA CC(=O)N[C@H](C(=O)Nc1nn(C)c2cccc(Oc3cccnc3)c12)C(C)C 77378228 LJFGFXORYDHPKM-SFHVURJKSA-N 381.436 2.860 0 50 GFAA CC(C)N1CCNC(=O)[C@H]1CC(=O)NCc1csc2ccc(Cl)cc12 72154350 PKZPKXGNGBYPFL-OAHLLOKOSA-N 379.913 2.770 0 50 GFAA CC(C)[C@@H](NC1CCOCC1)C(=O)NCc1cc(N(C)C)nc2ccccc12 173354127 SNCWRGVZPSBXQY-OAQYLSRUSA-N 384.524 2.710 0 50 GFAA NC(=O)c1cccc(C[C@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C2)c1 72140088 MNNATKQZTFSXMX-OAHLLOKOSA-N 376.412 2.597 0 50 GFAA COc1ccc2cc([C@@H]3CN(CC(=O)NCc4ccccn4)CCO3)ccc2c1 71753287 UDHYNVZLKIJVRM-QFIPXVFZSA-N 391.471 2.933 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3c(C)[nH]c(C)cc3=O)CC2)OC1=O 72463550 MXCNGJRBCRBSDW-CQSZACIVSA-N 375.469 2.607 0 50 GFAA COc1cccc(C2CCN(C(=O)c3c(C)oc4ncn(C)c(=O)c34)CC2)c1 194705254 DBQNPLCXORZNTM-UHFFFAOYSA-N 381.432 2.863 0 50 GFAA COc1ccc(CC(=O)N2CC(=O)N(c3cccc(C)c3)C[C@H]2C)cc1OC 82091344 CZRYIYYBQWPGFK-MRXNPFEDSA-N 382.460 2.819 0 50 GFAA COc1ccc(CN2CCCn3nc(CNC(=O)N(C)C)cc3C2)c(C)c1C 82120647 DSJLUFMUBBPNKW-UHFFFAOYSA-N 385.512 2.686 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC(=O)[C@H](C)N3CCc4ccccc43)cn2)n1 195082245 LOGWLOHEENUKHY-KRWDZBQOSA-N 375.476 2.952 0 50 GFAA CC[C@@H](c1cccnc1)N(C)C(=O)c1cnc(COc2ccccc2)[nH]c1=O 91381489 ONGNHDFPIVWVMD-SFHVURJKSA-N 378.432 2.967 0 50 GFAA Cc1ccccc1[C@@]1(O)CCN(C(=O)NCCc2nc3ccccc3n2C)C1 426360030 XYLQMIIPXXKRMR-JOCHJYFZSA-N 378.476 2.727 0 50 GFAA COc1nc2c(cc1C(=O)N[C@H](c1ccccc1)c1nnc(N)s1)CCC2 91416456 ZKVZOHAMMVBKCI-OAHLLOKOSA-N 381.461 2.532 0 50 GFAA Cc1cccc(-n2cnc(C(=O)N3CCC[C@H]3c3ccc(C(N)=O)s3)c2)n1 23128563 QARFLBWAALPLTL-AWEZNQCLSA-N 381.461 2.713 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC1CCN(C(=O)c3cccnc3)CC1)C2 95516665 RQKRGOLQVUUMGU-INIZCTEOSA-N 381.476 2.536 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(c3cccc(O)c3)CC2)CN1Cc1ccncc1 95352390 UVWFUIKCLSKKKT-IBGZPJMESA-N 379.460 2.542 0 50 GFAA CC[C@H](C)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O 252585005 FLMRIIGSFMEMHE-NDXORKPFSA-N 380.488 2.777 0 50 GFAA biogenic Cc1c(C(=O)N[C@H]2C[C@H](c3nnc(CO)n3C3CC3)C2)n(C)c2c(C)cccc12 252553185 VHLFTCFUYLZHOV-SHTZXODSSA-N 393.491 2.890 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(c2ncccn2)CC1 67431699 PMBLLRDEIMDHGK-UHFFFAOYSA-N 378.436 2.776 0 50 GFAA O=C(COCc1nc2ccc(F)cc2[nH]1)NCCN1CCCc2ccccc21 670456409 AJMQXKKPCRVYMJ-UHFFFAOYSA-N 382.439 2.788 0 50 GFAA Cc1c(NC(=O)N2CCN(c3cccnn3)CC2)noc1-c1ccccc1F 278924971 IYROYRHUPLQROU-UHFFFAOYSA-N 382.399 2.933 0 50 GFAA CCN1CCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C(C)(C)C1=O 188133423 AXFQZXNEWBWNPD-UHFFFAOYSA-N 390.871 2.792 0 50 GFAA COCCn1cnnc1[C@H](C)Nc1cc(Sc2cccs2)nc(N)n1 1529184525 ADFMLXSOEUUERL-JTQLQIEISA-N 377.499 2.683 0 50 GFAA NCC(=O)N1C[C@@H]2CN(C(=O)CCC3CCCC3)C[C@@]2(CCc2ccccc2)C1 1772701047 MDAZQHYEDXHXLE-URXFXBBRSA-N 397.563 2.835 0 50 GFAA CC(=O)N1C[C@H]2CN(C(=O)Cc3c(C)noc3C)C[C@]2(CCc2ccccc2)C1 1772708733 JAECZNAZIBSJOB-REWPJTCUSA-N 395.503 2.774 0 50 GFAA Cc1ccc(CN2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)s1 12308140 AJGKQLJLEPUZPS-NHCUHLMSSA-N 389.540 2.953 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)nc1 12725749 UIMRCNPTVVMUNO-KRWDZBQOSA-N 387.867 2.916 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)ccc1NCc1cccnc1 13151573 PMIVVJRCJYEVKM-HOTGVXAUSA-N 377.400 2.848 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1ccc(C)o1)C2 14536918 HSXGRYDWRTXMSZ-HNNXBMFYSA-N 388.537 2.641 0 50 GFAA CCN(CC)C(=O)c1cn([C@H]2CCCN(Cc3ccc(OC)c(C)c3)C2)nn1 15001365 SUWMGOIAUCRDPA-SFHVURJKSA-N 385.512 2.914 0 50 GFAA Cc1cccc(NC(=O)[C@@H](C)N(c2ccc3c(c2)OCCO3)S(C)(=O)=O)c1 16579368 GNIZYVPQUNVCQV-CQSZACIVSA-N 390.461 2.559 0 50 GFAA c1cnc(N2CCC3(CC2)OCCc2cc(OCCn4ccnc4)ccc23)cn1 1857678847 SNIIMKSENUSTFJ-UHFFFAOYSA-N 391.475 2.821 0 50 GFAA Cc1cc(F)cc(C(=O)NC[C@@H]2CCC[C@H](NC(=O)c3cccc(O)n3)C2)c1 1857680604 LWARJQDLWSHKNB-PBHICJAKSA-N 385.439 2.953 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCC[C@]2(C1)CN(c1ccncc1)CC[C@H]2O 1857683620 KLMYMWMDONXVEO-UYAOXDASSA-N 386.883 2.624 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(C3CCCC3)CC1)OCC2)N1CC[C@@H](O)C1 1857692843 WUFSVDDWTYRIAR-QGZVFWFLSA-N 390.549 2.761 0 50 GFAA O=C(NCCO)c1cc2c(s1)C1(CCN(Cc3ccsc3)CC1)OCC2 1857692936 ANGXOHPWTCNJCD-UHFFFAOYSA-N 392.546 2.596 0 50 GFAA CCOCc1nnc(N2C[C@@H](C(=O)NCC3(CC(C)C)CCC3)CC2=O)s1 1857738881 CISZWCVWXMZNJH-AWEZNQCLSA-N 394.541 2.760 0 50 GFAA O=C(c1cccc(O)c1)N1C[C@@H]2OC(=O)N(CCc3cccc(Cl)c3)[C@@H]2C1 211471659 LRZNNZHJITUQNJ-MSOLQXFVSA-N 386.835 2.934 0 50 GFAA CN(C)C1(CNC(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)CCOCC1 373869278 KKPVPRONGZJSBD-CQSZACIVSA-N 377.451 2.861 0 50 GFAA CCN(C)C(=O)c1cccc(NC(=O)N2CCN(c3ccncc3OC)CC2)c1 496897002 ATJGIDIPIPKOKE-UHFFFAOYSA-N 397.479 2.536 0 50 GFAA CO[C@@H](CNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(C)C 266695029 OHUZXSJAIHZAOM-HOCLYGCPSA-N 384.423 2.680 0 50 GFAA CN(C)Cc1nc2ccc(NC(=O)c3ccc([C@H]4CCC(=O)N4)cc3)cc2[nH]1 1875297155 FAKOEHKAPPMIDI-MRXNPFEDSA-N 377.448 2.828 0 50 GFAA O=C(O)Cc1cccc(S(=O)(=O)N2CCCn3c(cc4ccccc43)C2)c1 1875336353 XRBHWGPPPISUHD-UHFFFAOYSA-N 384.457 2.863 0 50 GFAA Cn1ccnc1CN1CCC[C@@H]([C@H]2CCCN(C(=O)CCCn3ccnc3)C2)C1 2325840119 QADLOVVJCGARHJ-UXHICEINSA-N 398.555 2.548 0 50 GFAA C[C@H]1CN(C(=O)c2c(C(F)F)nc3cnccn23)CC[C@H](C(F)(F)F)O1 893229451 GYEMBSABORCAEZ-DTWKUNHWSA-N 378.301 2.849 0 50 GFAA COc1ccc(C(=O)n2nnc3ccccc32)cc1I 676571 VPQNBZFKEXNWDG-UHFFFAOYSA-N 379.157 2.733 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)COc1ccc(OC)cc1 1136464 IVHLIDLZYJEAIT-UHFFFAOYSA-N 375.377 2.517 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSCc1ccccc1)c1ccccc1 2829858 DVUFINCEHJRHPF-UHFFFAOYSA-N 378.519 2.502 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2ccc(Cl)cc2OC)C1=O 2356164283 NFUZQSSDHMVDOE-LJQANCHMSA-N 380.872 2.592 0 50 GFAA O=C1NC(=O)[C@H](Cc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)cc2)N1 246109975 JSVBRMXPZCRCNI-BBWFWOEESA-N 383.835 2.833 0 50 GFAA Cc1noc(C2CC2)c1NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C1CCCCC1 225806557 DEFAGBDGLGHPCC-INIZCTEOSA-N 385.468 2.830 0 50 GFAA Cc1nnc(NC(=O)CSc2nnc(-c3cccnc3)n2CC(C)C)s1 9225899 GOQAYBGIDCHHAE-UHFFFAOYSA-N 389.510 2.887 0 50 GFAA C[C@@]12C(=O)N(c3ccc(I)cc3)C(=O)[C@@H]1[C@H]1C=C[C@H]2C1 101867546 RFKPHBPWISGQRV-BEAPKZTASA-N 379.197 2.993 0 50 GFAA Cc1cc(NC(=O)N2CCCO[C@@H](Cn3cccn3)C2)n(-c2ccccc2)n1 102540177 VESZCSHGOAVPMM-GOSISDBHSA-N 380.452 2.700 0 50 GFAA Cc1cc(C)nc(N2CCC(C(=O)NC[C@@H]3CCCN4CCCC[C@@H]34)CC2)n1 170613671 NFDKTFHFPOGECM-PMACEKPBSA-N 385.556 2.691 0 50 GFAA COCc1nc2n(n1)C[C@@H](NC(=O)Cc1csc(-c3cccc(C)c3)n1)CC2 135148637 AXYAOTIUPUXSHN-HNNXBMFYSA-N 397.504 2.530 0 50 GFAA CC1=C(C(=O)N(C)Cc2cnccn2)[C@H](c2c(F)cccc2Cl)NC(=O)N1 67642391 VECOAGHMJNRNCM-MRXNPFEDSA-N 389.818 2.556 0 50 GFAA COc1ccc(O[C@@H]2C(=O)N(C[C@@H]3CCCO3)[C@@H]2c2ccc3c(c2)OCO3)cc1 4686291 XDGXKYVFNMZNRW-WMQCIHAUSA-N 397.427 2.934 0 50 GFAA Cc1ccc(CNC(=O)c2cnn3ccc(C)nc23)c(OC[C@H]2CCCO2)c1 151927945 RZEOTOVXTXABKB-QGZVFWFLSA-N 380.448 2.834 0 50 GFAA O=C(c1ccc2n[nH]cc2c1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328627371 MSXKDHLAGUZPBW-KRWDZBQOSA-N 377.448 2.852 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(CCCOc3cccc(Cl)c3)C2=O)nn1 328610834 JFQRPVQPMKYUPS-MRXNPFEDSA-N 391.859 2.649 0 50 GFAA CC(C)c1nc(C(=O)N2CCSC[C@@H]2CC(=O)O)nn1-c1cccc(F)c1 262212184 UGCYXJWUDIMCKF-AWEZNQCLSA-N 392.456 2.562 0 50 GFAA COc1cc(OC)cc(N2C[C@H](C(=O)NC[C@H]3C[C@@H]3c3ccccc3)CC2=O)c1 177060215 RROYGBQSLXFREL-CBGDNZLLSA-N 394.471 2.977 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@@H]1Cn1ccnc1 177816513 SAWXODZYAZQVRH-OAHLLOKOSA-N 390.369 2.787 0 50 GFAA O=C1CC[C@]2(CCCN(C3CSCCSC3)C2)CN1CCc1c[nH]cn1 82116218 UXXWMYHBZXGWON-IBGZPJMESA-N 394.610 2.505 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)NCc1noc([C@H]2CCCO2)n1 96150557 YSRKVCNIRKNIHB-CQSZACIVSA-N 382.424 2.952 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95521132 YTNPXXCSACPLRK-HXUWFJFHSA-N 376.460 2.839 0 50 GFAA CCc1ncc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)cn1 95358683 VRZZDNNGUOKMIU-OXJNMPFZSA-N 376.504 2.743 0 50 GFAA COCCNC(=O)[C@@H]1C[C@H](NC2CCCCCC2)CN1C1Cc2ccccc2C1 23362482 ZTMMDXGKNNVRHJ-GMAHTHKFSA-N 399.579 2.672 0 50 GFAA CCc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1 95506030 XJANZMLYMKQWDH-UHFFFAOYSA-N 392.503 2.898 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Nc1ccc(Cl)c(Cl)c1 239415353 UFJHFFHNUULDFO-GQYKBVJTSA-N 391.254 2.985 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 236823303 OHVSZIBBSYUBAX-SFTDATJTSA-N 390.439 2.989 0 50 GFAA CCN(CCO)C(=O)Cc1c2c(n(Cc3ccc(F)cc3)c1C)CCCC2=O 95523022 OZJDDVOMKJVELA-UHFFFAOYSA-N 386.467 2.886 0 50 GFAA CCc1nc2cc(NC(=O)C(=O)N3CCO[C@@H](c4ccc(C)o4)C3)ccc2o1 162887117 FKPFQULUWSYMOO-QGZVFWFLSA-N 383.404 2.830 0 50 GFAA C[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)CC[S@@]1=O 297345420 SSOLJNUPEXOXAZ-XESHVACXSA-N 383.945 2.861 0 50 GFAA CC[C@H](C)[C@H](CO)NC(=O)C1CCC(Cn2cnc3ccccc3c2=O)CC1 252484089 FOFNAKDSIJPAQC-QVUWHDNHSA-N 385.508 2.726 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)Nc1ccc2occc(=O)c2c1 252571546 YEJFGUHOJYBMEZ-MRXNPFEDSA-N 391.383 2.912 0 50 GFAA Cc1[nH]nc(-c2ccc(S(=O)(=O)N(C)Cc3noc(CC(C)C)n3)o2)c1C 821483330 HHSBGSMCXLHZTL-UHFFFAOYSA-N 393.469 2.689 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(O)nn3)n2C[C@@H]2CCCO2)[C@@H]2CCCC[C@H]12 1344667783 PYCNUCCPLRHEFC-JYYAWHABSA-N 384.484 2.635 0 50 GFAA CSc1ccc(S(=O)(=O)N2CCCN(Cc3cccnc3)CC2)cc1 952983806 QUWOSXVHPQRXQI-UHFFFAOYSA-N 377.535 2.700 0 50 GFAA C[C@@]1(c2cccnc2)NC(=O)N(Cc2ccn(-c3ccc(F)cc3F)n2)C1=O 192141368 CLNGGBYTMLSFOF-IBGZPJMESA-N 383.358 2.513 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1nn(-c2ccc(F)cc2)cc1Br)C1CC1 767073049 BJXJAGBFDONHCB-CYBMUJFWSA-N 396.216 2.757 0 50 GFAA Cc1cccc(NC(=O)CC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 1506426421 GUDTWXDSRWCLQR-NRFANRHFSA-N 395.503 2.731 0 50 GFAA COc1cc(-c2onc(N3CCC[C@@H](CN(C)C)C3)c2C(=O)O)ccc1F 1704316421 ZYUBTDMFBFWJGF-LBPRGKRZSA-N 377.416 2.966 0 50 GFAA CC1CCN(CCCNS(=O)(=O)c2ccc(Br)s2)CC1 7728822 MSMWTGSVNGZJTD-UHFFFAOYSA-N 381.361 2.911 0 50 GFAA Cc1cc(Cl)c(Cl)cc1S(=O)(=O)N1CCC2(CC1)CN(C)CCO2 1772806606 CINHPGFSIMCVHB-UHFFFAOYSA-N 393.336 2.787 0 50 GFAA CCc1nc(C)c(CN2CCC[C@@H](CCC(=O)N(C)C3CCN(C)CC3)C2)[nH]1 11933601 FSBKWQBSAQYLKV-SFHVURJKSA-N 389.588 2.825 0 50 GFAA Cc1c(CC(=O)NCc2ccccn2)c2c(n1C[C@H]1CCCO1)CCCC2=O 12432945 HHSRWNIYTXNWHU-QGZVFWFLSA-N 381.476 2.748 0 50 GFAA CC[C@H](COC)NC(=O)[C@@H]1CCCN(c2nc(C)c3ccc(OC)cc3n2)C1 14879452 JOSMUJFDSMSULG-HZPDHXFCSA-N 386.496 2.704 0 50 GFAA COCCNC(=O)c1c(CC2CCCC2)n(Cc2cccnc2)c(C)cc1=O 14888022 QSHOBZKBVRBMPY-UHFFFAOYSA-N 383.492 2.709 0 50 GFAA Cc1c(NS(=O)(=O)Cc2ccccc2F)c(=O)n(-c2ccccc2)n1C 16579795 RSWZWOGCNIFTMU-UHFFFAOYSA-N 375.425 2.565 0 50 GFAA Cc1ccc(NC(=O)Cn2ccn3nc(-c4ccccc4)c(CO)c3c2=O)cc1 169759450 JWUDFZLZIWWYDF-UHFFFAOYSA-N 388.427 2.602 0 50 GFAA CCN1CCC[C@@H](n2ccnc2-c2cc3c(nc2OC)CN(C(C)C)C3=O)C1 1857700652 ZJUBGGSZWKIPJE-OAHLLOKOSA-N 383.496 2.975 0 50 GFAA O=C(c1cc(-c2ccco2)nc2c(Cl)cccc12)N1CC[C@H](CO)[C@@H](O)C1 1857717680 SMMGOWBSARZZPV-PXAZEXFGSA-N 386.835 2.964 0 50 GFAA CC(C)c1ncc(Cl)c(C(=O)N2CCOC[C@H]2c2noc(C(C)C)n2)n1 329252520 BYGNWEIDSXQKCL-LBPRGKRZSA-N 379.848 2.974 0 50 GFAA Cc1csc(C(=O)N2CCc3nc(NS(C)(=O)=O)sc3C2)c1Cl 331853980 HGLXDCMZYXISGJ-UHFFFAOYSA-N 391.927 2.736 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O 236587760 WOGXYBGPCYOVSG-TZIWHRDSSA-N 394.471 2.582 0 50 GFAA O=C(c1cccnc1)N1C[C@H]2CC[C@@H](C1)N(Cc1ccc3c(c1)OCCO3)C2 247954017 UPMGBKQBEHZDQI-HKUYNNGSSA-N 379.460 2.589 0 50 GFAA O=C1NCCN1[C@@H]1CCCN(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1 374681918 WXNVSUMIDORWPM-CQSZACIVSA-N 395.294 2.564 0 50 GFAA COc1cc(OC)cc([C@@H](O)CNC(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1 265417388 DVIQAQYEJXIRKK-XIKOKIGWSA-N 384.436 2.674 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N2CCC(Cn3ccnn3)CC2)CC1 164048346 XLXYKNWQAJMXAJ-UHFFFAOYSA-N 396.539 2.673 0 50 GFAA CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)Nc1ccc(-n2ccc(=O)cc2)nc1 832191291 SAYGYLLSCWSWML-IEBWSBKVSA-N 393.447 2.555 0 50 GFAA COCCCOCC(=O)N1CC(C)(C)[C@H]1c1nccn1-c1cccc(F)c1 952891213 XXVMKFJATXPQQP-GOSISDBHSA-N 375.444 2.974 0 50 GFAA N[C@@H]1CC12CC(NC(=O)c1cccc(Nc3nccc(C(F)(F)F)n3)c1)C2 1875277846 JPBMGUJBFTYHBQ-UIORMTCPSA-N 377.370 2.849 0 50 GFAA O=C(c1cccc(CN=c2ccnc[nH]2)c1)N1CC[C@@H](n2cc3ccccc3n2)C1 1875259791 JPVJPDNRLYXRMT-HXUWFJFHSA-N 398.470 2.948 0 50 GFAA NC(=O)CCN1CCC(NC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)CC1 1875319840 UYWWNVZMNVWFHV-OAQYLSRUSA-N 393.531 2.859 0 50 GFAA C[C@H](NC(=O)N1CC[C@@H](C)S(=O)(=O)CC1)c1ncc(-c2ccc(F)cc2)o1 1875301318 FCTUORUQABAOHP-OLZOCXBDSA-N 395.456 2.760 0 50 GFAA COC1(C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)CCC(C(F)F)CC1 888092803 GKBFDFCLOZRNQW-FHBSJOOWSA-N 387.448 2.862 0 50 GFAA C[C@H]1CO[C@@H](C(=O)NC2(C3CCN(c4ccc(C(F)(F)F)nn4)CC3)CC2)C1 1775991179 JDGPVDLFSARXSO-TZMCWYRMSA-N 398.429 2.786 0 50 GFAA COc1ccc2c(c1OC)CCN(c1ncc(S(C)(=O)=O)cc1Cl)C2 2325767250 ZQYGUPWDWVUJRF-UHFFFAOYSA-N 382.869 2.718 0 50 GFAA Cc1cc(CN2CC[C@]3(C2)c2ncn(C)c2CCN3C(=O)C[C@@H](C)C(C)C)on1 2325776915 NKFJDVIFVBKHLD-ZHRRBRCNSA-N 399.539 2.885 0 50 GFAA CCc1cncc(C(=O)N[C@H]2C[C@@H](CNC(=O)CCOc3ccc(F)cc3)C2)c1 2325786782 AHXOQJFLBQTPBB-UWUNEBHHSA-N 399.466 2.877 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)C1 2325889263 HVZRFVWXNUGMCN-YWZLYKJASA-N 376.884 2.575 0 50 GFAA O=C(Cn1cnc2ccc(I)cc2c1=O)c1ccccc1 639149 JCZHKVSXXPIZCM-UHFFFAOYSA-N 390.180 2.884 0 50 GFAA CCOc1ccc(Br)cc1S(=O)(=O)N1C[C@H](C)O[C@@H](C)C1 714125 UGHMAMGUUPUDOA-QWRGUYRKSA-N 378.288 2.646 0 50 GFAA O=C(Oc1ccc2ccc(OC(=O)N3CCOCC3)cc2c1)N1CCOCC1 789073 CJPMKQLONNYWQX-UHFFFAOYSA-N 386.404 2.502 0 50 GFAA Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)n1 993496 ADIGYJPISRQNFC-UHFFFAOYSA-N 382.445 2.767 0 50 GFAA O=C(CCc1cccnc1)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356149452 ATBANISOGNIWEF-QFIPXVFZSA-N 378.476 2.593 0 50 GFAA OCCn1c(CCCCc2nc3ccccc3n2CCO)nc2ccccc21 2857796 BNLWZTDXDYZHQE-UHFFFAOYSA-N 378.476 2.936 0 50 GFAA CNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 115354644 MIVUKPRRNKCQSF-CQSZACIVSA-N 382.386 2.987 0 50 GFAA COc1ccc(Cn2nc(C(=O)O)c3c2CCN(C(=O)c2occc2C)C3)cc1 67756210 JNPCOVWAXXAUQR-UHFFFAOYSA-N 395.415 2.738 0 50 GFAA Cc1ccc(C)c(Cn2cnc3c(=O)[nH]c(NC4CCCCC4)nc(=O)c32)c1 23128872 LRXKKRDLMHOBSB-UHFFFAOYSA-N 379.464 2.890 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)c1 65364671 MIBPLHDBWJWESF-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA C[C@H](CN1CC2(CCN(C(=O)c3cnccn3)CC2)OC1=O)c1ccccc1 77391940 FOABDNHJUPKBKY-MRXNPFEDSA-N 380.448 2.707 0 50 GFAA CN(Cc1ccc(Cl)cc1)c1ncc(S(C)(=O)=O)c([C@@H]2CCCNC2)n1 71754766 MTZSXOYDHLWCSC-CQSZACIVSA-N 394.928 2.637 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(Cc3nccs3)CC2)C1 71661235 GHHQOTHTQXVGBC-KRWDZBQOSA-N 399.564 2.531 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1)c1ccc(F)c(F)c1 125941970 JOSGCVSQOOWGMC-APWZRJJASA-N 388.414 2.809 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3cc(N4CCCCC4)ncn3)CC2)cc1 72115828 CIRCVWYFUWSMBZ-UHFFFAOYSA-N 379.508 2.992 0 50 GFAA CC[C@H](NC(=O)N1CCC(S(=O)(=O)N2CCCC2)CC1)c1cccs1 374398902 CSWRDBMFLXIIPX-HNNXBMFYSA-N 385.555 2.799 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@]4(CCOC4)C3)cc2)c(C)c1CCC(=O)O 237730944 CKQBVWCMSXWCMR-QFIPXVFZSA-N 397.475 2.759 0 50 GFAA Cc1ccc(C)c(CN2CCN(Cc3ccc(C)o3)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 72469407 AMFKSPPUTQZOGY-LEWJYISDSA-N 388.533 2.688 0 50 GFAA O=C(N[C@@H]1COCC[C@@H]1OCc1cscn1)C1(c2ccccc2F)CC1 220344573 OMEIJTKNHVAIPH-SJORKVTESA-N 376.453 2.804 0 50 GFAA CCc1ccc(CN2CCC3(CC2)CCN(C2CCOCC2)C[C@H]3CO)nc1 97578991 SGFBFFAIPHUYJZ-FQEVSTJZSA-N 387.568 2.719 0 50 GFAA COc1ccc(OC)c([C@H]2CCN(C(=O)c3ccccc3-n3cncn3)C2)c1 91725352 WNTUPDKEEAWYPN-HNNXBMFYSA-N 378.432 2.914 0 50 GFAA CC1(C)OC(=O)N(CC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)C1=O 95498637 VCBPLYPXOPQHRU-GFCCVEGCSA-N 387.461 2.760 0 50 GFAA Cc1cc(=N/C(O)=C2/C=C(c3ccccc3)N=N2)n([C@H]2CCS(=O)(=O)C2)[nH]1 334159293 VGEYAFDIBLNVPJ-WLGDJLJPSA-N 385.449 2.619 0 50 GFAA CCc1nnsc1C(=O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 91390687 GTCJXRXVBGLRGK-UHFFFAOYSA-N 388.541 2.765 0 50 GFAA O=C(O)CN1CCC(Oc2cc(Cl)ccc2C(=O)N2CCCCC2)CC1 95512030 LULSIODHQDTMMR-UHFFFAOYSA-N 380.872 2.894 0 50 GFAA O=C1[C@H]2[C@@H]3[C@@H]4[C@@H]5[C@@H]6[C@H](C=C[C@H]6[C@H]6C(=O)[C@H]([C@H]3[C@@H]56)[C@@H]2OCOCc2ccccc2)[C@@H]14 254380668 IMOUDSNFOYCYFR-HTNQDRLNSA-N 388.463 2.730 0 50 GFAA CN(CCn1ccnc1)C(=O)c1ccc(-c2ccc(N3CCCC3)nn2)cc1 534589456 FRUPRKWWOOKOQD-UHFFFAOYSA-N 376.464 2.713 0 50 GFAA CCCC[C@@H]1C(=O)N(C)CCN1S(=O)(=O)c1cc(C)cc2cccnc12 822831070 MGPJSYBFLJHMMH-MRXNPFEDSA-N 375.494 2.565 0 50 GFAA Cc1cccc(OC2CN(C(=O)N[C@H]3CCCN(C(=O)c4ccco4)C3)C2)c1 584901738 LKRFMSKOKYDUBS-INIZCTEOSA-N 383.448 2.665 0 50 GFAA CCOc1cc(CN(C)C(=O)NCc2cnc(SC)n2C)ccc1OC 584886299 RHUWXDQKVHIXFA-UHFFFAOYSA-N 378.498 2.891 0 50 GFAA COc1cc(NC(=O)c2cc(-n3cccn3)ccc2Cl)cc(-n2cnnn2)c1 952970308 ADAIIVDCWQSNSK-UHFFFAOYSA-N 395.810 2.762 0 50 GFAA O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cncc2nc(C(F)(F)F)[nH]c12 1448794079 WFPCIFGNEUVPBR-MRVPVSSYSA-N 380.330 2.846 0 50 GFAA Cn1nc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2CCOCC2)C3)cc1-c1ccccc1 1565528499 CEDYKNZSTWJCOY-XLIONFOSSA-N 394.519 2.803 0 50 GFAA CCc1nc(C)ccc1OCC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)C1CCC1)C2 1565510933 OEAGBRPZUBPASP-AEFFLSMTSA-N 385.508 2.581 0 50 GFAA COc1cccc(CN(C(=O)CC[C@@H]2NC(=O)NC2=O)C2CCCCCC2)c1 952868253 HHMQGDDYTSMOQT-SFHVURJKSA-N 387.480 2.735 0 50 GFAA O=C(Cc1cccs1)NC[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 952867261 LFSBNCQEJVTMPL-HNNXBMFYSA-N 394.500 2.902 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)c3ccccc3-n3cncn3)C2)n1 952971133 DMEKSLLNPPOSEC-HNNXBMFYSA-N 380.452 2.869 0 50 GFAA O=C(CN1CCCCCC1)N1CCC(C(=O)N2CCc3ccccc3C2)CC1 952991557 ZWUABVCPHMEDDE-UHFFFAOYSA-N 383.536 2.686 0 50 GFAA COc1ccc(F)c(C(=O)N2CCC[C@H](Cn3nc(C)nc3C)C2)c1OC 188465437 NIRNURAZSXRASH-AWEZNQCLSA-N 376.432 2.604 0 50 GFAA COc1cccc2c1CCN(C(=O)N[C@@H]1CCc3nnc(C(C)C)n3C1)CC2 194557061 ASTUZFMDKVHUTD-MRXNPFEDSA-N 383.496 2.535 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@@H](O)[C@H](Cc4cc(C)[nH]n4)C3)CCCC2)cc1 1529168251 YQNYWDITYBCVSE-OXQOHEQNSA-N 383.492 2.601 0 50 GFAA CNC(=O)c1ccnc(N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)c1 1704314641 VIDQVJUTXBGBDE-UHFFFAOYSA-N 376.460 2.991 0 50 GFAA COCCN[C@H]1CCc2c(sc3ncn(C4Cc5ccccc5C4)c(=O)c23)C1 12218581 RBLTUPLNUZAZPW-INIZCTEOSA-N 395.528 2.891 0 50 GFAA Cc1ccc2nc(CNC(=O)[C@@H]3CCC(=O)N(Cc4ccccc4F)C3)cn2c1 12301354 AJVZXAHPESHOGN-QGZVFWFLSA-N 394.450 2.837 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2cccs2)cc1 12406005 CGIQNKGNNATPNT-CQSZACIVSA-N 389.502 2.784 0 50 GFAA COC(=O)c1ccc(CNCC[C@H]2CCC(=O)N2CCCOC(C)C)cc1 15068229 PBRXNZQNEDPHSN-LJQANCHMSA-N 376.497 2.759 0 50 GFAA O=C(/C=C/c1ccco1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 169760326 MHCYPRFQKRWDMA-BQYQJAHWSA-N 377.448 2.563 0 50 GFAA COC(=O)C[C@@H](c1ccc(F)c(Cl)c1)c1c(O)n2ccccc2nc1=O 205973872 XNFUMMZYDMGHNR-NSHDSACASA-N 376.771 2.888 0 50 GFAA CCc1nc([C@H]2CN(C(=O)c3ccc(Cl)cc3NC)Cc3c[nH]nc32)n[nH]1 1857529948 NCJORQKHVVIPRG-ZDUSSCGKSA-N 385.859 2.573 0 50 GFAA Cn1nc(C2CC2)cc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857696756 BJFUCFJWADRJNS-JOCHJYFZSA-N 393.491 2.791 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857697642 GASKUZVOERUWOK-QFIPXVFZSA-N 393.491 2.782 0 50 GFAA O=C([C@H]1CC[C@H](c2ccccc2)N1)N1CCC2(CC1)C(=O)Nc1ccccc12 1857718269 QXWMRDSKYVCOAO-UYAOXDASSA-N 375.472 2.992 0 50 GFAA C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 854666814 GXKKHBXJEPAKSW-QQOZLPODSA-N 386.492 2.703 0 50 GFAA CC(C)c1ccc(-n2cc(O)c(C(=O)NC3CCC4(CC3)CNC(=O)C4)n2)cc1 1875313510 ONHBOEQIKDDAJY-UHFFFAOYSA-N 396.491 2.880 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2cc(NC(C)=O)cc(C(F)(F)F)c2)[C@@H](C)C1 1875370774 CSHSZMYYIBUKJG-NSHDSACASA-N 383.370 2.523 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2ccc(-c3noc([C@@H]4CCCO4)n3)cc2)cn1 1875384889 JSCCJTILBRSWCK-XOVJRCOKSA-N 381.436 2.585 0 50 GFAA COCCN1CCC[C@@H](Nc2ncnc3cc(Br)c(OC)cc23)C1 1875336267 BEVVFAXFRBHYSU-GFCCVEGCSA-N 395.301 2.924 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)C3CCN(CCc4ccncc4)CC3)n[nH]c21 1875393454 FZHFRACJJYZPRD-CVEARBPZSA-N 397.523 2.606 0 50 GFAA Cc1c(C(=O)N[C@H](C)[C@H](N)c2ccco2)nnn1-c1ccc(Cl)cc1F 1875340724 OVTOXMQXOBFXNP-PSLIRLAXSA-N 377.807 2.780 0 50 GFAA Cc1ccc2c(c1)[C@@H](CCC(=O)O)CN2S(=O)(=O)c1cn2c(n1)CCCC2 2325806965 QOLKWWLOROUVHR-AWEZNQCLSA-N 389.477 2.685 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 626473 AKJAQSYAGXVMKK-QGZVFWFLSA-N 380.400 2.733 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1 662120 LFLAWKQVSFSRQS-HNNXBMFYSA-N 376.478 2.508 0 50 GFAA COC(=O)CN(c1ccc(Br)cc1)S(=O)(=O)c1ccccc1 824298 SQOMUAHFMOTHIT-UHFFFAOYSA-N 384.251 2.817 0 50 GFAA Cc1ccc2nc3c(cc(C(=O)Nc4ccc5c(c4)OCCO5)n3C)c(=O)n2c1 2340319 JEBGVLOUWJSKMD-UHFFFAOYSA-N 390.399 2.518 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)Nc3ccc4nn(C)nc4c3)CC2=O)cc1Cl 2356166994 QQEBBKBIBYPCDC-NSHDSACASA-N 399.838 2.622 0 50 GFAA O=C(COc1ccc(S(=O)(=O)Nc2ccccc2)cc1)NCc1ccccn1 6139057 WTPMBBBSPNRCCQ-UHFFFAOYSA-N 397.456 2.578 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)N1CCCC1 8560356 YCWMOKYHSVHLDI-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA COc1ccc(-c2ncc(CN3CCN(CC(C)C)[C@@H](CCO)C3)cn2)cc1 22851430 ODIRTPBJLMZIEG-FQEVSTJZSA-N 384.524 2.677 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)[C@H](c2ccccc2)N1 225601121 PSPVYAFHZICRFR-CTNGQTDRSA-N 387.439 2.995 0 50 GFAA CN1C[C@H](NC(=O)CCc2nc3ccccc3n2-c2ccccc2)CCC1=O 133731287 JCHMFYAPNIDHSD-MRXNPFEDSA-N 376.460 2.695 0 50 GFAA Cc1ccc(CN2CCN(Cc3c(C)nn(C)c3Cl)C[C@@H]2CCO)cc1 20998802 MWDNVIMDGGXUNO-SFHVURJKSA-N 376.932 2.759 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC3(CC2)c2ccccc2[C@@H](N2CC=CCC2)[C@@H]3O)n1 20540403 SUFWJDAXRXOAKD-UXHICEINSA-N 392.503 2.570 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H](N(C)C)C[C@H]1C(=O)O 65492507 VGAFETZEKMSLFZ-RISCZKNCSA-N 377.828 2.533 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CNS(=O)(=O)/C=C/c3ccc(Cl)cc3)O2)n1 328615801 ZKGYMQFTNJHUNI-PQAPVRDISA-N 383.857 2.842 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)CCc3nc4ccc(F)cc4[nH]3)CC2)C[C@@H](C)O1 72411216 LTMYAENGBFQKHW-GASCZTMLSA-N 388.487 2.735 0 50 GFAA CCn1ncc2cc(C(=O)N[C@@H](C)C3(N4CCOCC4)CCCC3)c(C)nc21 282480171 SRJPRKBCTRBODS-INIZCTEOSA-N 385.512 2.523 0 50 GFAA C[C@H](CS(C)(=O)=O)N[C@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 368142546 PPXYERHEALFZPF-ZTQAJYAQSA-N 393.480 2.600 0 50 GFAA O=C(CCC1CCN(c2ncccn2)CC1)N[C@@H]1CCN(Cc2ccccc2)C1 77002433 CKYFXOXQKNGLLD-OAQYLSRUSA-N 393.535 2.864 0 50 GFAA O=C(CN1CCN(c2ccc(Cl)cc2)CC1)NCCc1ccc(F)cc1 13323493 GGZYPGRORKPWSY-UHFFFAOYSA-N 375.875 2.960 0 50 GFAA Cc1n[nH]cc1C1CCN(Cc2csc(-c3c(C)c(C)nn(C)c3=O)n2)CC1 375348839 KQXIWXBLGORZLV-UHFFFAOYSA-N 398.536 2.932 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCN(c2cc(C)ccc2C)CC1 158369020 OXMKBLBCHSDZIX-QHCPKHFHSA-N 391.515 2.925 0 50 GFAA CN1CCC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(F)cc4)CC3)CC[C@@H]21 137124241 DFUHJMZNFFDIBM-RXVVDRJESA-N 388.531 2.916 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)nc1)N1CCOC[C@@H]1c1ccc(F)cc1 454466230 LUUALUPELSCYMQ-GOSISDBHSA-N 386.427 2.663 0 50 GFAA CN1CCCC[C@@H]1C(=O)N1CCC2(CC1)CN(CCc1ccccc1)C(=O)O2 77456537 FGWGEDUBMZFSBU-LJQANCHMSA-N 385.508 2.527 0 50 GFAA CC[C@H](NS(=O)(=O)CC[C@H]1CCCCN1C(C)=O)c1ccc(OC)cc1 242164624 WWOKAWYPENNVMX-MJGOQNOKSA-N 382.526 2.857 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)sc2c1CCC2 17076986 WKSIYLJMSIUWGQ-NWDGAFQWSA-N 376.478 2.959 0 50 GFAA Cc1ccc(O[C@H]2COCC[C@H]2NC(=O)CCc2nc3ccccc3[nH]2)cn1 222441651 MYLSBPJYHSNXSJ-MOPGFXCFSA-N 380.448 2.552 0 50 GFAA Cc1cccc2nc(C(=O)N3CCC[C@H](Cn4cc(CC(C)C)nn4)C3)cn12 48063583 HZMFMDQEOWHNTI-KRWDZBQOSA-N 380.496 2.985 0 50 GFAA CCn1cc(CNC(=O)[C@H]2CC(c3cccc(Br)c3)=NO2)c(C)n1 20602109 XIDNQBVXVKKFFC-MRXNPFEDSA-N 391.269 2.783 0 50 GFAA O=C(O)[C@@H](c1ccc2c(c1)OCCO2)N1CCC(OCc2cccnc2)CC1 95374703 BUOIEISURLOCNO-HXUWFJFHSA-N 384.432 2.660 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2C=CCN2)CC1)NCc1cccc(Cl)c1 95529132 WQBHCKMHBBFTNP-GOSISDBHSA-N 375.900 2.503 0 50 GFAA C[C@H](C(=O)O)N1CC2(CCC1=O)CCN(C(=O)c1ccccc1Cl)CC2 91680666 OAYXOHXQBSYARW-CYBMUJFWSA-N 378.856 2.658 0 50 GFAA CCn1ncnc1[C@@H](NC(=O)Nc1cnn(Cc2ccccc2F)c1)C1CC1 97729612 CEMGFOFMSJNOLK-KRWDZBQOSA-N 383.431 2.955 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2cccc(F)c2)C1=O)N1CCc2ccccc2C1 252537618 LTUZLVUACJXWON-LJQANCHMSA-N 395.434 2.816 0 50 GFAA NC(=O)[C@@H]1CCCN(CCCNC(=O)c2cccc(-c3ccc(F)cc3)c2)C1 299789384 YXHCVZBVZKBVAX-LJQANCHMSA-N 383.467 2.810 0 50 GFAA CCC(=O)Nc1ccc(C)c(NC(=O)[C@@H](c2cccnc2)N2CCOCC2)c1 822535053 XBALPWQSSZKCJK-HXUWFJFHSA-N 382.464 2.751 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@H]2CCCc3c2[nH]c2ccccc32)cc1 827755340 QZBJAVJQLRZTLX-KRWDZBQOSA-N 383.473 2.552 0 50 GFAA O=C(CN1CCOCC1)NCC1CCN(Cc2ccc(-c3ccco3)cc2)CC1 827836849 LYFXPDFFSPRARW-UHFFFAOYSA-N 397.519 2.607 0 50 GFAA Cc1cccc(-n2cc(CN(C)C(=O)[C@H](O)COc3ccccc3C)cn2)c1 952869352 IXFFZPFNNYEHCB-HXUWFJFHSA-N 379.460 2.887 0 50 GFAA O=C(c1ccc(Nc2ncccn2)cc1)N1C[C@@H]2C[C@@H](C1)[C@H]1CCCC(=O)N1C2 888088892 WFCFIOQUJLRSGT-VDZJLULYSA-N 391.475 2.693 0 50 GFAA COC(=O)C[C@](C)(NC(=O)CCC(=O)NC1CCCC1)c1ccc(F)cc1 170609982 BKVAZNNDTSEROP-FQEVSTJZSA-N 378.444 2.559 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(Cc3cnc(N4CCOCC4)s3)C2)n1 1506399222 BZQUELHAAFHHRR-OAHLLOKOSA-N 391.541 2.941 0 50 GFAA COc1ccc(CCC(=O)N2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)cc1OC 1529134359 YVHMJOJIPFMVRZ-UZLBHIALSA-N 388.464 2.649 0 50 GFAA CCCn1cc(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c(C)n1 1529180969 OLYYLZBVTHYLCO-DYESRHJHSA-N 378.476 2.825 0 50 GFAA CN1CC[C@]2(C(=O)NCC3=CCCCC3)CCCN(C(=O)c3ccncc3)[C@H]2C1 1775984459 VBHXPYNVKOUFQU-NZQKXSOJSA-N 396.535 2.625 0 50 GFAA CC1(C)CNC(=O)C2(CCN(CC3=Cc4cc(Cl)ccc4OC3)CC2)NC1 1772804654 CHNSBHRZBPULFF-UHFFFAOYSA-N 389.927 2.696 0 50 GFAA O=C([C@@H]1CCCO1)N1CCCN(Cc2ccc(OCc3ccccn3)cc2)CC1 1772805344 LHKCKODFKRRJHF-QFIPXVFZSA-N 395.503 2.874 0 50 GFAA CC1(C)NC(=O)N(C[C@@H](O)COc2c(Cl)cc(Cl)cc2Cl)C1=O 5614183 RDOQRAQZSHKBNK-MRVPVSSYSA-N 381.643 2.717 0 50 GFAA CCN1CCC[C@@H]1CN(CC1CCN(CCOC)CC1)C(=O)c1ccoc1 12055869 WOMFGZFSODPOJN-HXUWFJFHSA-N 377.529 2.565 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)CCOc2ccccc2)CCC1=O 12112095 PVNTXSFUBCKBQI-LJQANCHMSA-N 396.487 2.971 0 50 GFAA C=Cc1ccc(Cn2cnc3c(=O)[nH]c(N(C)Cc4ccccc4)nc(=O)c32)cc1 19641335 NFUGNEVZYAFDCM-UHFFFAOYSA-N 399.454 2.808 0 50 GFAA CN(Cc1ccon1)c1ccc(C(=O)NCC[C@H]2COc3ccccc3O2)cn1 19794399 IVKCUFDHPAXYRD-KRWDZBQOSA-N 394.431 2.666 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)CCCN1CCCCC1=O)CC2 1857677021 PMAOHIDXBOEXRT-UHFFFAOYSA-N 394.519 2.807 0 50 GFAA O=C(NC1CC1)c1cc2c(s1)C1(CCN(C[C@H]3CCCNC3)CC1)OCC2 1857688351 FFZAPRIOCPYSJD-HNNXBMFYSA-N 389.565 2.504 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1C[C@@H]2COC[C@]2(C(=O)NC2CCCCC2)C1 1857704357 OUAZQYICMSWQSM-OPAMFIHVSA-N 381.476 2.705 0 50 GFAA CCC[C@]1(CO)CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)C[C@@H]1O 1875248120 ZRYFWZKVTLEKPJ-RBBKRZOGSA-N 380.492 2.742 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)c3cccnc3C)[C@H]3CC[C@]2(C1)O3 1875250626 SLLRAPHZRCIGBH-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA C[C@@H]1CN(C(=O)CCC(C)(C)C(=O)N2C[C@@H](C)OC(C)(C)C2)CC(C)(C)O1 408355213 QZOGXLUSRQICCQ-HZPDHXFCSA-N 382.545 2.845 0 50 GFAA COc1cc(N2CCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)ccc1F 1875395249 STVMQUYNRDDXJZ-QWHCGFSZSA-N 388.443 2.542 0 50 GFAA O[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1NCc1cccc(OCc2ccccn2)c1 1875400042 PSGYRMDWRJATCF-VLCRHTCISA-N 378.476 2.786 0 50 GFAA Cn1nc(C(=O)N2CCN(c3cccc(OC(F)F)c3)CC2)c2c1CCCC2 885739165 DRDAJJMTRFJCHS-UHFFFAOYSA-N 390.434 2.863 0 50 GFAA O=C(c1ccc2nn[nH]c2c1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2100540784 PKYLTZDMAKLEGZ-JOCHJYFZSA-N 389.459 2.755 0 50 GFAA CN(C)Cc1cnn2c1CN(C(=O)Cc1nc(-c3ccccc3)cs1)CC2 2325759865 AISVIUOAXVSCIO-UHFFFAOYSA-N 381.505 2.653 0 50 GFAA CS(=O)(=O)N1CCN(c2ccccc2NC(=O)c2ccc(Cl)cc2)CC1 1065165 ZRYZIAVMCILNBY-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(C(N)=O)cc2)nnc1-c1cccs1 2366706 YNZOHYYHAYRBPG-UHFFFAOYSA-N 387.490 2.856 0 50 GFAA COC[C@@H](N=c1[nH]oc(-c2ccc(F)c(OC)c2)c1C(=O)O)c1ccccn1 2356135721 QNIOSBWGYBFWLF-CQSZACIVSA-N 387.367 2.804 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)CCCn3cncn3)C2)c2cccc(=O)n21 2356162249 DPHBQTYKLXQOEN-HBFSDRIKSA-N 397.523 2.843 0 50 GFAA O=C(c1cccc(OCc2nnc3n2CCOC3)c1)N1CCc2ccccc2C1 280832998 WLCOSWPQKSFHFT-UHFFFAOYSA-N 390.443 2.586 0 50 GFAA NC(=O)c1cccnc1N1CCC(n2cc(-c3cccc(Cl)c3)nn2)CC1 55358590 GDZVSAUJXQJORG-UHFFFAOYSA-N 382.855 2.934 0 50 GFAA Cc1nn(-c2ccc(N3CCCC3)nn2)c2c1[C@@H](c1cccc(O)c1)CC(=O)N2 65362944 UZKCMVYHTQXAKI-MRXNPFEDSA-N 390.447 2.751 0 50 GFAA O=C(NCCCN1CCOCC1)c1cc(-c2ccc(Br)cc2)on1 20137417 IZPFCOUVEHHIKL-UHFFFAOYSA-N 394.269 2.556 0 50 GFAA Cc1ccc(C(=O)Nc2ccc3c(c2)nc(CN2CCN(C)CC2)n3C)cc1 20706742 UNARSDFGGVDASY-UHFFFAOYSA-N 377.492 2.881 0 50 GFAA COc1cccc(CNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c1OC 140964701 RGKCYAQNRQIIJC-SFHVURJKSA-N 382.460 2.554 0 50 GFAA COc1cc(CN(C)Cc2cc(C)no2)ccc1OC[C@H](O)CN(C)C(C)C 12745019 ZPKKZNGDHFGXPP-GOSISDBHSA-N 391.512 2.704 0 50 GFAA COc1ccc([C@H]2CC(c3cc(OC)ccc3OC)=NN2S(C)(=O)=O)cc1 252483665 FGTVXICJOKTSGZ-GOSISDBHSA-N 390.461 2.823 0 50 GFAA CCOC(=O)N[C@H](C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)C(C)C 252523292 CGRIRXFRWAPVDJ-LVCYWYKZSA-N 394.487 2.786 0 50 GFAA NC(=O)c1c(NC(=O)CCn2cc(Br)cn2)sc2c1CCCC2 2780609 QKGZJRKIROELCX-UHFFFAOYSA-N 397.298 2.714 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)Cn1nc(C(F)(F)F)c(Cl)c1C 2777947 BEVGUZXEJVJIOF-UHFFFAOYSA-N 377.798 2.873 0 50 GFAA Cc1nn(Cc2ccc(Cl)cc2)c(C)c1NS(=O)(=O)c1cnn(C)c1 2804956 ADVYJOZLHDFPOS-UHFFFAOYSA-N 379.873 2.736 0 50 GFAA CN(C(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O)c1nc2ccccc2o1 121268522 GQAMMNWBXJHRKD-UHFFFAOYSA-N 385.445 2.817 0 50 GFAA CN(C)c1nc(-c2ccccc2)nc2c1CCN(C(=O)[C@H](O)c1ccccc1)C2 71385633 QGSIEZQYGIEPJC-HXUWFJFHSA-N 388.471 2.828 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(Cc3cc(F)ccc3F)CC2)CN1C(=O)C1CC1 72480371 CJXBSRRWLBEGDU-KRWDZBQOSA-N 378.419 2.643 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)[C@H](O)C(C)C 77454960 YUHDSLLEWCRLGV-HFSMHLIXSA-N 394.471 2.695 0 50 GFAA Nc1nc(CN2CCN(CCc3ccc4c(c3)CCO4)CC2)nc2ccccc12 175524227 UWJMPNCYKAUYMA-UHFFFAOYSA-N 389.503 2.507 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@@H](C)c2nc(CC(C)C)no2)n(C)n1 215029913 MLPHWNQGMJDIKD-LBPRGKRZSA-N 385.472 2.510 0 50 GFAA COC(=O)c1c(NC(=O)CN(C)Cc2cn(C)nc2C)sc2c1CCCC2 17079741 HJSFOYLEONQERG-UHFFFAOYSA-N 390.509 2.526 0 50 GFAA O=C(Nc1cc(F)cc(F)c1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO 229849852 DIRZDXUOSTZEIU-DNVCBOLYSA-N 375.419 2.969 0 50 GFAA Cc1cc(C)c2c(c1)NC(=O)[C@@H]2Cc1nc(-c2c(C)ncc3c2CCNC3)no1 20601082 GUTSYRNMCAFLSP-MRXNPFEDSA-N 389.459 2.981 0 50 GFAA O=C(c1cnc2ccccn12)N1CCC(c2nccn2Cc2ccncc2)CC1 95524484 KUNSQXAHKWYSDF-UHFFFAOYSA-N 386.459 2.994 0 50 GFAA CC(C)C1=NO[C@H](C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)C1 91931407 MFIUJFAGXROVOX-IBGZPJMESA-N 398.507 2.614 0 50 GFAA Cc1nc(CC(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)cs1 95366869 UJLYLBLRRIGMLJ-CEWLAPEOSA-N 383.517 2.788 0 50 GFAA Cc1cccn2c(CC(=O)N3CC[C@]4(CC(=O)c5ccccc5O4)C3)cnc12 97654085 WWMDZOYZSXOMGF-QFIPXVFZSA-N 375.428 2.822 0 50 GFAA Cc1nc(-c2nc([C@@H](C)CN3CCOCC3)n(CC(F)(F)F)n2)cs1 96163001 HRRRFOIHDKAQAH-JTQLQIEISA-N 375.420 2.708 0 50 GFAA Cc1cc(NC(=O)N2CCC(N3CCOC3=O)CC2)n(Cc2ccccc2)n1 95525995 PDNDXMCREDGEMC-UHFFFAOYSA-N 383.452 2.688 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N(C)Cc2ncc(Cl)n2C)CC1 182533735 FRDFFPNVJHAENV-UHFFFAOYSA-N 391.903 2.893 0 50 GFAA CN1CCc2nc[nH]c2C12CCN(C(=O)c1cc(-c3ccccc3)on1)CC2 91505072 AGFGVTHKXGQVER-UHFFFAOYSA-N 377.448 2.684 0 50 GFAA Cc1cccc(C)c1OC1CN(C(=O)c2cnc(-c3cccnc3)nc2O)C1 91933288 JSNYIOQUFPPABR-UHFFFAOYSA-N 376.416 2.764 0 50 GFAA CN1[C@@H](c2ccc(Cl)cc2)[C@@H](C(=O)N[C@H]2CC[C@H](O)CC2)C[C@@]1(C)C(=O)O 244626645 FPTCZUGSYIRHBA-LLYLOPHFSA-N 394.899 2.596 0 50 GFAA O=C(NCC1(c2cccc(F)c2F)CCCC1)N1CCOC[C@@H]1c1nc[nH]n1 298143543 APFDIECLUZTNMT-OAHLLOKOSA-N 391.422 2.678 0 50 GFAA Cc1cc2sc(N)nc2cc1-c1cccc(C(=O)N2CCC[C@H]2C(N)=O)c1 534634256 RHMKZUGIIXGVDY-INIZCTEOSA-N 380.473 2.944 0 50 GFAA Cc1cccc(C(=O)N2CCC(=O)N(Cc3cn4cccc(C)c4n3)CC2)c1 299796725 PLXFUACNYUDBDB-UHFFFAOYSA-N 376.460 2.826 0 50 GFAA Cc1ccc(-c2nn3c([C@H]4CCCN(S(C)(=O)=O)C4)nnc3s2)cc1C 825186652 LUJPQNWQAVQJKE-AWEZNQCLSA-N 391.522 2.609 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)C1)c1ccoc1 952967630 MUWVHMCZOBLSOM-SFHVURJKSA-N 392.459 2.807 0 50 GFAA CSCC[C@H](NC(C)=O)C(=O)Nc1cc(C(=O)NCC(C)C)ccc1C 952970187 OFLXOHLZRNQGAT-INIZCTEOSA-N 379.526 2.577 0 50 GFAA Cc1c(C(=O)Nc2nc3cccnc3n2C)nnn1-c1cccc2cnccc12 170597700 XKBGYAVXQNMSLK-UHFFFAOYSA-N 384.403 2.658 0 50 GFAA CN(C(=O)N1CCC(c2c[nH]c3ccccc23)CC1)[C@H]1CCS(=O)(=O)C1 408018669 UTOYACNZUNXKOA-HNNXBMFYSA-N 375.494 2.586 0 50 GFAA CN(C)C(=O)c1cccc(S(=O)(=O)N(C)c2ccc(-c3ccccc3)nn2)c1 170617434 QUYUFUDBQQJGGD-UHFFFAOYSA-N 396.472 2.671 0 50 GFAA COc1ccccc1-c1nc(C2CCN(C(=O)NC[C@@H]3CCCO3)CC2)no1 190237979 NLSBFTRBJVBDDR-HNNXBMFYSA-N 386.452 2.813 0 50 GFAA COc1ccc(-n2nnc(C(=O)NCc3ccc(OC(C)C)nc3)c2C)cc1 192591344 HHKKBZVIDZKVQG-UHFFFAOYSA-N 381.436 2.697 0 50 GFAA COc1ccc2c(C(=O)N(CCN(C)C)Cc3cnc(C)[nH]3)cc(C)nc2c1 1704314116 OGSGYEHAALZOKH-UHFFFAOYSA-N 381.480 2.787 0 50 GFAA O=C(c1ccccc1OC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](O)C1 11667823 WVWVONMNJQYZMW-IBGZPJMESA-N 395.503 2.722 0 50 GFAA O=C([C@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1)N1CCOCC1 11818350 HKMASADMCQLLJN-SFHVURJKSA-N 392.503 2.708 0 50 GFAA Cc1cccc(-c2cnc(C)nc2[C@@H]2CCCN(C(=O)[C@@H]3CCC(=O)N3)C2)c1 11872838 SBWOVHJFSZLWBO-MJGOQNOKSA-N 378.476 2.745 0 50 GFAA COC(=O)CCC(=O)N(CC1CCN(C2CCCC2)CC1)C[C@H]1CCCO1 12198896 IHXKMUFIQZHITK-LJQANCHMSA-N 380.529 2.602 0 50 GFAA CN(Cc1ccccc1)[C@H]1CCCN(C(=O)Cn2cnc3ccccc3c2=O)C1 12209120 GCPQNKZAUDIZLB-IBGZPJMESA-N 390.487 2.520 0 50 GFAA CC[C@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCCCSC)c1=O 12279556 WYDGNSLIAVNMNC-AWEZNQCLSA-N 393.553 2.975 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@H]1CC(=O)NCCc1ccccc1Cl 12314415 AGZNCNFVLKKAEN-HXUWFJFHSA-N 399.922 2.698 0 50 GFAA CCOC(=O)c1nn(CCC(F)(F)F)c2c1CN(C(=O)c1cccnc1)CC2 14741797 MNFJXNUHPUWEAS-UHFFFAOYSA-N 396.369 2.606 0 50 GFAA O=C(N[C@@H]1CCN(c2cc(-c3cccs3)n[nH]2)C1)c1ccc2c(c1)OCO2 169755708 JHHNYKAAPBHIHZ-CYBMUJFWSA-N 382.445 2.876 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1cc3c(nc1O)CCC3)CC2 1857672850 IMFYCHFCZOTICN-UHFFFAOYSA-N 388.471 2.917 0 50 GFAA CCc1c(C)nn(CC(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c1C 1857732795 HKLYBLLSIZTADE-UNMCSNQZSA-N 384.524 2.593 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccc(Cl)o3)C[C@]23CC[C@H]1O3)c1ccoc1 1857734543 VEBDOYKSDZHWRO-WFXMFSGNSA-N 376.840 2.935 0 50 GFAA C[C@@H](O)C1CCN(C(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1 118731365 GOVWWNRARWOAMJ-UKRRQHHQSA-N 385.430 2.936 0 50 GFAA COc1ccc2c(c1)C1(CC1)CN(S(=O)(=O)c1cccc3c1OCCO3)C2 329844755 OMMZEESIEYWNMC-UHFFFAOYSA-N 387.457 2.703 0 50 GFAA O=C(O)CC[C@H]1CCCN(C(=O)[C@H]2CCN(c3ccc(Cl)cc3)C2=O)C1 238015601 BTDFASSEYOFPND-CZUORRHYSA-N 378.856 2.796 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)COc4ccc(F)cc4)CC3)n2)cn1 856525109 VDAMQPHLWZXXLH-UHFFFAOYSA-N 395.438 2.801 0 50 GFAA Cc1nc(C(=O)NC[C@H]2CN3CCCC[C@H]3CO2)nn1-c1ccccc1C(C)C 1875254158 IYLYWIFMMZCDBN-ROUUACIJSA-N 397.523 2.682 0 50 GFAA COc1cc2nc(CN3CCc4ccc(Cl)nc4C3)nc(O)c2cc1OC 1875281513 FFZJZZLOQDCRDH-UHFFFAOYSA-N 386.839 2.959 0 50 GFAA CC(C)(CO)c1nc2ccc(C(=O)Nc3cnn([C@H]4CC4(F)F)c3)cc2[nH]1 1875396295 BBSNSRJGVBDWIE-AWEZNQCLSA-N 375.379 2.862 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)c2nc3ccccc3s2)CC[C@H]1C(F)(F)F 1875385858 DDLLJEFXLLORAX-ZYHUDNBSSA-N 383.395 2.992 0 50 GFAA Cc1c(C(=O)N[C@@H](C)[C@@H](N)c2ccco2)nnn1-c1ccc(Cl)cc1F 1875340723 OVTOXMQXOBFXNP-BJOHPYRUSA-N 377.807 2.780 0 50 GFAA CCOC(=O)[C@H](CC1CC(F)(F)C1)NC(=O)c1ccc(C2(CN)CCC2)nc1 1875304819 VZHZIEGTSDPCCK-HNNXBMFYSA-N 395.450 2.559 0 50 GFAA COc1ccccc1NC(=O)c1ccccc1NS(=O)(=O)N1CCCC1 1062781 PRUBSSMKEQOCSE-UHFFFAOYSA-N 375.450 2.700 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100540491 JRVNCGXKGFRKDR-HSZRJFAPSA-N 392.503 2.738 0 50 GFAA CN(C[C@@H]1CCc2ccccc21)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 2325761165 BZCLFQFRQSUQJX-AWEZNQCLSA-N 399.472 2.606 0 50 GFAA Cc1nc(C)c(C(=O)N2CC[C@H](CN(C)C(=O)C3=C(Cl)CC3)C2)c(C)n1 2325824973 XRQQBJLQZQQDOQ-CQSZACIVSA-N 376.888 2.609 0 50 GFAA O=C(NCc1ccc(F)cc1)C1CCN(S(=O)(=O)c2ccccc2)CC1 1368700 KWXXJWFAUVSXKV-UHFFFAOYSA-N 376.453 2.543 0 50 GFAA CC(=O)N1CCN(c2ccccc2NC(=O)COc2ccc(C)cc2C)CC1 4412754 DNBLBRNRWCTAQG-UHFFFAOYSA-N 381.476 2.989 0 50 GFAA O=C(COCc1cc(-c2ccco2)on1)N1CCN(c2ccc(F)cc2)CC1 6876648 SFDGQQLYBKJENY-UHFFFAOYSA-N 385.395 2.939 0 50 GFAA Cc1cc(OCC(=O)NC(N)=O)ccc1NC1CCN(c2ccccc2)CC1 225498785 MIRLSQKZNNIJFZ-UHFFFAOYSA-N 382.464 2.650 0 50 GFAA CC(=O)Nc1nc(CC(=O)Nc2ccc(NC(=O)C(C)(C)C)c(Cl)c2)n[nH]1 55358498 UGEOKRHETFYTOY-UHFFFAOYSA-N 392.847 2.582 0 50 GFAA COc1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)ccc1F 104467036 QIWVUIGBYWIWAL-HXUWFJFHSA-N 393.547 2.576 0 50 GFAA Cc1ccc(C2=NS(=O)(=O)N(C)C(C(=O)N3[C@@H](C)CCC[C@@H]3C)=C2)cc1 20366859 NCCNEAOVYUYEEH-GJZGRUSLSA-N 375.494 2.648 0 50 GFAA CCc1ccc(CN2CCC(N3CCC[C@H](C(=O)NCCOC)C3)CC2)cc1 67723671 AGVZRWZDYXTWOE-NRFANRHFSA-N 387.568 2.688 0 50 GFAA NC(=O)c1cccc(Oc2ccc(NC(=O)[C@@H]3CCCc4[nH]ncc43)cn2)c1 135247752 QZVXJPKYAZFWMQ-OAHLLOKOSA-N 377.404 2.755 0 50 GFAA Cn1c(C(=O)N2CC[C@@H](c3ccc4c(c3)OCO4)[C@H](O)C2)cc2ccccc21 65370821 IPVMYFVYEQERPI-QFBILLFUSA-N 378.428 2.898 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N3CCOc4ccccc4C3)cnn2c1 67909225 ZJCLJINPOJUIKU-UHFFFAOYSA-N 379.464 2.606 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCOc2c(O)cc(-c3cccnc3)cc2C1 67713322 LECYTPIUXZLNTF-UHFFFAOYSA-N 376.416 2.701 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)c2[nH]c(C)cc2C)CC1 12587348 NFEYABBVTPEKET-LJQANCHMSA-N 388.556 2.864 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3ccc(F)cc3F)CC2)nc(C)n1 67601915 BJARXMGBOANKPY-UHFFFAOYSA-N 376.411 2.849 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3n[nH]c4c3CCC4)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72153525 IIPCRYPUFGQCTB-STZQEDGTSA-N 376.504 2.909 0 50 GFAA CC(=O)NC[C@@H]1CCC2(CCN(c3nccc(CCC(F)(F)F)n3)CC2)O1 71776938 UHUFSMQURIFPEY-HNNXBMFYSA-N 386.418 2.626 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)c1ccccc1O)C2 72128316 FXAOQZRATKMHPE-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA C[C@@H](N)[C@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237372927 MOYFLEUMNBMJNY-OLZOCXBDSA-N 377.286 2.834 0 50 GFAA C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(N)=O)c1ncc(-c2ccccc2)o1 363152395 VPOULRRWIVREHP-YOEHRIQHSA-N 378.432 2.798 0 50 GFAA Cc1cc(C)cc(OCc2noc(CN3CCCN(c4cccnn4)CC3)n2)c1 155039970 ZQLLNAWOKJRJKT-UHFFFAOYSA-N 394.479 2.768 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cccc(N4CCOCC4)c3)CC2)c1 72425337 SPOLVZIUAHWTCJ-UHFFFAOYSA-N 379.504 2.790 0 50 GFAA CCn1ccnc1[C@H]1OCCC[C@@H]1NC(=O)Nc1ccc2ccn(C)c(=O)c2c1 284720839 AUZBIYRAAFPIBI-ROUUACIJSA-N 395.463 2.797 0 50 GFAA COc1ncccc1-c1cnn(CC(=O)Nc2cc(-c3ccccc3)nn2C)c1 48090876 QHKFBAKMGITYHI-UHFFFAOYSA-N 388.431 2.993 0 50 GFAA COC(=O)CC[C@H]1NC(=O)N(c2ccc(OC(F)F)c(C(F)(F)F)c2)C1=O 285991633 NPTGYKBGMHCCTM-SECBINFHSA-N 396.268 2.685 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 136305431 RTARCSWGSRIDLF-CWLKWCNXSA-N 376.884 2.731 0 50 GFAA Cc1nc2ccc(Br)cn2c1NS(=O)(=O)c1ccc(N)cc1 45067923 WXCHIPKFAHVNEY-UHFFFAOYSA-N 381.255 2.788 0 50 GFAA Cc1nc(Cn2nnc(NC(=O)N3Cc4ccccc4OC(C)(C)C3)c2C)no1 288898669 RZQQZEFKASVVNW-UHFFFAOYSA-N 397.439 2.531 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CNC[C@H](C(=O)N(C)Cc3ncccc3C)C2)cc1 91914752 KVLKTXOPOPGMPY-ZWKOTPCHSA-N 380.492 2.521 0 50 GFAA Cc1ccc(-c2nc(C[C@H]3CCS(=O)(=O)C3)n(-c3cccc(F)c3)n2)o1 96136772 PNACMCOHBKUDSR-CYBMUJFWSA-N 375.425 2.952 0 50 GFAA CN(CCC1CCN(c2ccncc2)CC1)[C@@H]1CCN(CC(F)(F)F)C1=O 179397377 VRHNRMFXNYADEN-QGZVFWFLSA-N 384.446 2.783 0 50 GFAA Cc1ccc(-c2cc(C(=O)N[C@H](c3nc(-c4nc[nH]n4)no3)C(C)C)no2)cc1 334161940 HMYFTPOWKSZIPQ-HNNXBMFYSA-N 393.407 2.945 0 50 GFAA CN(Cc1n[nH]c(C(C)(C)C)n1)[C@H](C(N)=O)c1cccc(Br)c1 292959673 PBTSCMYOECYMDA-ZDUSSCGKSA-N 380.290 2.523 0 50 GFAA O=C1CCC2(CCN(Cc3cc(C4CCCCC4)no3)CC2)CN1CCO 91664158 XYHZCLKGBKKODM-UHFFFAOYSA-N 375.513 2.919 0 50 GFAA O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1csc(-c2ccoc2)n1 183731659 NAHNKDQOGJOAEO-UHFFFAOYSA-N 388.424 2.704 0 50 GFAA O=C1[C@@H](CCC(=O)N2CCCC[C@H]2c2cccnc2)N=C(O)N1Cc1ccco1 252550668 SXENBIPTXNGPEQ-MSOLQXFVSA-N 396.447 2.833 0 50 GFAA CCOC(CN(CCc1ccccc1)C(=O)[C@@H](N)COC(C)(C)C)OCC 261508600 VBLAZXNVUPZVOA-SFHVURJKSA-N 380.529 2.599 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@H](NCc2cccc(OC)c2)CNC3=O)cc1 263616313 IAXYIWQNDKGVJV-FQEVSTJZSA-N 378.432 2.599 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1CCC2(CC1)OCCc1ccsc12 541844805 ZYFBZJWXSGBMRS-UHFFFAOYSA-N 387.505 2.884 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNS(=O)(=O)CCOc2ccccc2)C1 670454108 QRAKKHWTWBQFSG-LJQANCHMSA-N 388.533 2.783 0 50 GFAA COc1cc(CCC(=O)N2CC[C@H](C(=O)O)C2)ccc1OCC(F)(F)F 269201717 RKSGBEIZSBFFDE-LBPRGKRZSA-N 375.343 2.502 0 50 GFAA Cc1onc2c(=O)n(C)nc(C(=O)NCCc3c(Cl)cccc3Cl)c12 170620495 AOCRRTCDZURUMY-UHFFFAOYSA-N 381.219 2.509 0 50 GFAA O=C1CCN(S(=O)(=O)c2ccc(OCC(F)(F)F)nc2)c2ccccc21 189262430 MCQJKRKYCRKELO-UHFFFAOYSA-N 386.351 2.804 0 50 GFAA CN(Cc1cccnc1)C[C@H]1CCN(S(=O)(=O)c2ccc(Cl)s2)C1 192936848 CMDFIQMAPYCTAX-CQSZACIVSA-N 385.942 2.939 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NC[C@H]2CCCO2)cc1 833118 DILBYBNSGKXCFZ-HZQOKBKYSA-N 380.444 2.761 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc4c5c([nH]c4c3)CCCC5)C[C@H]2O)n[nH]1 1704280442 JHKMQTMHNYVNJR-QVKFZJNVSA-N 378.476 2.754 0 50 GFAA O=C(O)c1c(NCCN2CCCC[C@@H]2CO)noc1-c1ccc(Cl)cc1 1704324622 BLDZUGWLRBMNPP-CQSZACIVSA-N 379.844 2.952 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCC2(CC1)OCCc1ccsc12 1704301138 MGIQFQMPRZNUGK-UHFFFAOYSA-N 392.546 2.989 0 50 GFAA COc1cc2nc(N3C[C@H](O)[C@H](Cc4ccncc4)C3)cc(C)c2cc1OC 1704310003 VWJAMMHWKQELMN-APWZRJJASA-N 379.460 2.995 0 50 GFAA CC1=C(CN2C[C@H]3CN(c4cc(C)nc(N)n4)C[C@@]3(CO)C2)C(C)(C)CCC1 1772810254 FKAVZCJLALYXRT-HTAPYJJXSA-N 385.556 2.624 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCc2ccccc2C)c1=O 11909027 ARACMGUIZNKVFC-UHFFFAOYSA-N 381.476 2.952 0 50 GFAA Cc1cc(C(=O)NC[C@H]2Cc3cc(Cl)cc(-c4ncccn4)c3O2)nn1C 11978685 SNSQHTBQWMGLBC-CQSZACIVSA-N 383.839 2.572 0 50 GFAA Cn1cc(CCNC(=O)c2cc(COc3ccc(F)cc3Cl)on2)cn1 12711063 HKQPPWYLSKRQOK-UHFFFAOYSA-N 378.791 2.752 0 50 GFAA COc1cccc(OC)c1C(=O)N1C[C@@H]2C[C@H]1C(=O)N2c1ccc(F)c(F)c1 14955849 BYHGBQQAAOHJQV-WFASDCNBSA-N 388.370 2.612 0 50 GFAA CCOC(=O)c1nn(CCN(C)C)c2c1CN(CCCc1ccccc1)CC2 19792943 GLMNQBYFKXHZKN-UHFFFAOYSA-N 384.524 2.612 0 50 GFAA O=C1CC2(CCN(CCC(F)(F)F)CC2)OCCN1C[C@H]1CCCCO1 1857691904 GBFYNSJUKBWUBW-OAHLLOKOSA-N 378.435 2.591 0 50 GFAA CCc1cc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc(N(C)C)n1 1857711410 XSZZWYNWFZJIQR-QFIPXVFZSA-N 394.523 2.962 0 50 GFAA COc1ccc(CN(C)C(=O)[C@H]2CC(=O)N(c3nccs3)C2)c2cccnc12 1857714002 HIZIUGLTCWEVGN-AWEZNQCLSA-N 396.472 2.711 0 50 GFAA CN(C)c1nc(Cl)c(CN2C[C@@H]3CC[C@H]2CN(C2CCOCC2)C3)s1 248146961 WCAOMPFSCBSLLF-HIFRSBDPSA-N 384.977 2.938 0 50 GFAA O=c1cc(-c2cccnc2)nc(-c2cccc(CN3CCN4CCC[C@@H]4C3)c2)[nH]1 19635554 CUQFDHGZUAAFNB-HXUWFJFHSA-N 387.487 2.779 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3nc4ccccc4[nH]3)C1)CC2 1704338306 QSZFSWQDEXQVAS-OAQYLSRUSA-N 376.464 2.539 0 50 GFAA Cc1ccc(N2CC[C@@H](NC(=O)c3ccc4c(c3)[C@@H](CN)CCC4)C2=O)cc1 851626643 FUKADRUAXVRWGN-WIYYLYMNSA-N 377.488 2.909 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCOC2)CC1 1875252318 OYGXSOHTMRSXKV-HXUWFJFHSA-N 376.884 2.582 0 50 GFAA Cn1nc(C(F)(F)F)cc1-c1noc([C@H]2Cc3ccccc3S2(=O)=O)n1 1875281186 UJLNVNOIVLCGKN-LLVKDONJSA-N 384.339 2.560 0 50 GFAA CCOc1ccccc1CNC(=O)c1c2c(nn1CCOC)[C@H](C)O[C@H](C)C2 1875315854 KCZLBKBMTCXDJG-CABCVRRESA-N 387.480 2.880 0 50 GFAA O=C(O)[C@H]1CC[C@H](N=c2nn[nH]n2Cc2ccc(-c3ccccc3)cc2)CC1 2100540744 OKFNTZUXWDMXPU-WGSAOQKQSA-N 377.448 2.866 0 50 GFAA COc1ccc([C@H]2NC(=O)[C@@H](C3CC4(CCC4)C3)NC2=O)cc1Br 2325776906 MWYNDMUWVDPDEN-HUUCEWRRSA-N 393.281 2.694 0 50 GFAA CC[C@H](O)c1cn(CC(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)nn1 2325869173 BGDHPLWXZOSUAR-IBGZPJMESA-N 383.427 2.658 0 50 GFAA CC[C@H](Sc1nc(=O)cc(N)n1-c1ccccc1)C(=O)Nc1cc(C)on1 917842 NXMZHCYVZKVFML-ZDUSSCGKSA-N 385.449 2.621 0 50 GFAA CCN(CC(=O)Nc1cc(OC)ccc1OC)S(=O)(=O)c1ccc(C)cc1 1060276 LSFHFHGIINKMHA-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA CCCOc1ccc(NC(=O)C(=O)NCCc2ccc(OC)c(OC)c2)cc1 2819049 MBKCSAIZOIPGDK-UHFFFAOYSA-N 386.448 2.790 0 50 GFAA Cc1ccc(SCCNC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc1 2984370 TWTSHKXLWAJMIS-UHFFFAOYSA-N 396.509 2.809 0 50 GFAA Cc1n[nH]c(C)c1CCc1nnc2n1[C@@H](C)C(=O)N(CCc1ccccc1)C2 2356154903 PAYIQBSJFRCURL-INIZCTEOSA-N 378.480 2.549 0 50 GFAA COc1c(C)cccc1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356154971 RJXVVBCGGSBTKE-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)Nc3ccc(OC)c(OC)c3)cnn2c1 67820990 LMPNQPVOECHGDM-UHFFFAOYSA-N 383.452 2.841 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)ncn1 67622981 LUBKRFWIWODKDM-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA O=C(Cn1cncn1)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67885690 CQLYBZQZVAUWIN-UHFFFAOYSA-N 384.823 2.725 0 50 GFAA CCc1noc(-c2ccc(CCNC(=O)c3ccc4c(c3)CCNCC4)cc2)n1 252496674 POKITAYZCMLYMQ-UHFFFAOYSA-N 390.487 2.960 0 50 GFAA O=C1NC(=O)c2cc(C(=O)N3CCC(Cc4nc5ccccc5[nH]4)CC3)ccc21 425311052 FMESUBMZUKTGSA-UHFFFAOYSA-N 388.427 2.541 0 50 GFAA COc1ccnc(N2CCN(Cc3ccccc3OCc3ccccn3)CC2)n1 129592331 BNELSAWTSFDTNU-UHFFFAOYSA-N 391.475 2.781 0 50 GFAA C[C@@H](CS(C)(=O)=O)NC(=O)N1CCC(c2nc3ccccc3s2)CC1 172274440 FALSEMBGGGPDKV-LBPRGKRZSA-N 381.523 2.618 0 50 GFAA CC(C)Oc1cccc2c1c(NC(=O)Cn1cncn1)nn2CC(F)(F)F 72427305 WCKQUSPZJKQGAY-UHFFFAOYSA-N 382.346 2.616 0 50 GFAA COc1ccc(C[C@@H]2[C@H](OC(C)=O)[C@@H](O)CN2C(=O)OCc2ccccc2)cc1 71769622 NJFLTRDUTARBJI-HKBOAZHASA-N 399.443 2.551 0 50 GFAA C[C@](NC(=O)c1cn(-c2ccc(Br)cc2)cn1)(C(=O)O)C1CC1 237460234 TXLYDNXZACTWHH-MRXNPFEDSA-N 378.226 2.618 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CNCC(=O)N1CCCc2ccccc21 237748958 CDLQHRIFSQIZGV-UHFFFAOYSA-N 396.413 2.739 0 50 GFAA CCOC(=O)c1ccsc1NC(=O)CN1CCOC[C@@H]1c1nc(C)cs1 375828959 DPOXVYDZUBLIPH-CYBMUJFWSA-N 395.506 2.702 0 50 GFAA O=C(Cc1cccc(Cl)c1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccn1 219718143 UEIKQNWSQDJHTQ-APWZRJJASA-N 383.879 2.927 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2[C@H]3CC[C@@H]2CNC3)Cc2ccccc2C1 72134494 ZVQDGFBJYHPYTB-ZRZAMGCNSA-N 389.543 2.661 0 50 GFAA NC(=O)[C@@H](NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1)c1ccc(F)cc1 290637355 DJPBVOGFGKZWTO-DYVFJYSZSA-N 375.831 2.648 0 50 GFAA Cc1cccc2c3c([nH]c12)CCN(C(=O)CC[C@]1(CCC(=O)O)CCC(=O)N1)C3 222747415 YNVSXIUHVJANDL-QFIPXVFZSA-N 397.475 2.655 0 50 GFAA COc1ccc(CCC(=O)N2CCN(c3ccccc3C)C(=O)C2)cc1OC 82121106 HHWLSUMOHMNTHE-UHFFFAOYSA-N 382.460 2.820 0 50 GFAA COC[C@@H]1CCCN1C(=O)c1ccc(-c2ccc3nc(O)nc(O)c3c2)cc1 426397627 SSUXCCPKGNREQY-INIZCTEOSA-N 379.416 2.959 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCc4noc(C)n4)csc3C2)nc1 426382810 SIRDDFNAQSEMDH-UHFFFAOYSA-N 397.504 2.885 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@H]1CCCN(Cc2ccc3c(c2)OCO3)C1 426423840 YDDXSTDKVSTPTD-KRWDZBQOSA-N 383.496 2.519 0 50 GFAA Cc1nc2c(c(NCCCN3CCC[C@@H](CO)C3)n1)Cc1ccccc1OC2 96149138 NAGAEPXSIWKOIA-QGZVFWFLSA-N 382.508 2.775 0 50 GFAA O=C1CN(C(=O)[C@@H]2CCOc3ccccc3C2)CCN1Cc1ccccc1F 97360247 MKHKWSJVOXIDJI-QGZVFWFLSA-N 382.435 2.638 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 95360712 NYNAFUHECUDEMA-DOTOQJQBSA-N 385.489 2.537 0 50 GFAA CCn1c(Cn2ccnc2C)nnc1C1CCN(Cc2scnc2C)CC1 96163750 GBXVEZAUEATLDN-UHFFFAOYSA-N 385.541 2.996 0 50 GFAA COc1ccc(OC)c([C@@H]2CCN(C(=O)c3ccc4c(c3)OCC(=O)N4)C2)c1 97797296 UBDWFGVDGNQENH-CQSZACIVSA-N 382.416 2.664 0 50 GFAA COC(=O)c1cn(Cc2cccc(-c3nc(C)cs3)c2)cc2c(=O)[nH]nc1-2 263587162 CXRPDTFUSTXTPZ-UHFFFAOYSA-N 380.429 2.943 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCCc4cccs4)c3CO2)cc1 263618595 UOBDKJMQPGGBOR-QGZVFWFLSA-N 384.461 2.592 0 50 GFAA Cc1ccc(-c2nc(NC(=O)c3n[nH]c(-n4cnnc4)n3)sc2C)c(C)c1 1940195410 BAVRUDXFSYBZLC-UHFFFAOYSA-N 380.437 2.686 0 50 GFAA CCOc1ccc(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)cc1OCC 299771336 WMQQYUUOAGBVNJ-GOSISDBHSA-N 376.497 2.857 0 50 GFAA CNC(=O)C[C@@H](C)N(C)C(=O)c1cccc(-c2cc(C)c(C(=O)O)c(C)n2)c1 584897735 OGUJTUBUZHQTHL-CYBMUJFWSA-N 383.448 2.660 0 50 GFAA COc1ccc(CC(=O)Nc2ccc(NC(=O)CN(C)C)c(C)c2)c(OC)c1 952976226 JXYFZRHUFFWTOW-UHFFFAOYSA-N 385.464 2.694 0 50 GFAA O=C1CCCN1C[C@H](NS(=O)(=O)Cc1noc2ccccc12)c1ccccc1 185696554 ANFSNRQNUNDKPM-KRWDZBQOSA-N 399.472 2.611 0 50 GFAA CC(C)[C@@H](CC(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276496867 PEEXBKYXVIASEW-RTBURBONSA-N 381.524 2.921 0 50 GFAA O=C(NCc1cccc(N2CCCC2=O)c1)c1ccccc1CN1CCOCC1 170647382 WZRNUBHUWWWUTC-UHFFFAOYSA-N 393.487 2.576 0 50 GFAA CNS(=O)(=O)c1cc(NC(=O)CN2CCC=Cc3ccccc32)ccc1C 191295589 KEGNNCLYWOTKKB-UHFFFAOYSA-N 385.489 2.765 0 50 GFAA Cc1noc2ncnc(N(C)CC3CCN(C[C@H](O)c4ccccc4)CC3)c12 192451371 JFJWMHZZRYMALJ-SFHVURJKSA-N 381.480 2.808 0 50 GFAA C[C@H](C1CCN(CCC(=O)NC2CCCCCC2)CC1)N1CCN(C)CC1 1529125697 WZGBDUBSCOPJOO-LJQANCHMSA-N 378.605 2.563 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)Cc2ccc(CO)cc2)CC1 1704343822 ZWEABRBBRXBWJS-UHFFFAOYSA-N 381.472 2.821 0 50 GFAA Cc1cc(=O)c(C2=NCCS[C@H](c3ccc(O)c([N+](=O)[O-])c3)C2)c(O)o1 137502397 NJUUVHXLARNCTB-HNNXBMFYSA-N 376.390 2.935 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(C/C(=C\C(C)C)c3ccccc3)C[C@@]2(CO)C1 1772819033 NSSZXSJTSASWTI-QVNWOMSLSA-N 386.536 2.515 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)c1cn(Cc2ccccc2F)nn1 12372988 VYSWYFCCQRADQJ-UHFFFAOYSA-N 390.422 2.640 0 50 GFAA COCCC(=O)N1CC[C@]2(CCCN(Cc3cccc(OC)c3OC)C2)C1 12479289 DBBQRAPKZRHYRN-NRFANRHFSA-N 376.497 2.555 0 50 GFAA CCC[C@@H]1NC(=O)[C@@H]2C[C@H](NCc3sc4ccccc4c3Cl)CN2C1=O 14740960 GIDDTTJOIXOGLQ-UBHSHLNASA-N 391.924 2.912 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)c2cccc(N3CCCC3=O)c2)C1)c1ccco1 19740300 WEKOWVGKGLXQRG-MRXNPFEDSA-N 395.459 2.689 0 50 GFAA Fc1cccc(OCc2nc([C@@H]3CCn4ncnc4C3)n(CC(F)(F)F)n2)c1 1857670134 VOQNXFHXCAQEHJ-LLVKDONJSA-N 396.348 2.880 0 50 GFAA O[C@@H](CN1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCNCC1 1857675390 WCWDTFYYVUGDDE-QHCPKHFHSA-N 379.548 2.754 0 50 GFAA COc1ccccc1CNC(=O)[C@@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857697147 XMLOVQNLEGQWOM-CQSZACIVSA-N 381.457 2.974 0 50 GFAA Cc1cncc(N2C[C@@H]3[C@H](CNC(=O)C4CCCCCC4)[C@H]4CC[C@]3(C2)O4)n1 1857718007 KDDYGGFQFWHODA-JZJXAQOMSA-N 384.524 2.855 0 50 GFAA O=C(C[C@H]1CCS(=O)(=O)C1)N1CCCc2c(F)cc(Br)cc21 408126554 QASHZABCRSGVON-SNVBAGLBSA-N 390.274 2.692 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NC1CCN(c3cccc(C)n3)CC1)C2 116667434 IPFVGJSBXFIPSG-KRWDZBQOSA-N 381.476 2.735 0 50 GFAA O=C(NCC1(c2cccc(Cl)c2)CC1)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 333808740 HQYKJEFEZDDDSK-GOSISDBHSA-N 396.940 2.982 0 50 GFAA CCN(C)C(=O)[C@H](C)NC(=O)NCCc1ccc(OCc2ccccc2)cc1 252510888 ZQSUTVZBVHUVGV-KRWDZBQOSA-N 383.492 2.974 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C1 265297555 ODIGEPMMVXTLHV-OAHLLOKOSA-N 380.423 2.769 0 50 GFAA O=C(OCc1ccccc1)N1CC[C@@H](S(=O)(=O)NCc2ccc(F)cc2)C1 809385663 JMFNVJHZAXSLRH-GOSISDBHSA-N 392.452 2.656 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1[C@@H]1COCCN1C(=O)CCc1ncc[nH]1 952887124 IFVGYLHJLRDQFO-SFHVURJKSA-N 379.464 2.745 0 50 GFAA C[C@@H]1C[C@H](CNC(=O)c2cc3cnccc3[nH]2)CN1C(=O)c1coc(C2CC2)n1 1875309655 HGCMECNOZMIRSK-CHWSQXEVSA-N 393.447 2.709 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cc(F)cc4nc[nH]c34)CC2)c2n1CCN(C)C2 1875394329 FPTANEIPCYUQFS-UHFFFAOYSA-N 396.470 2.672 0 50 GFAA CCc1ccccc1CN1CCC2(CC1)Cn1nc(C(=O)N(C)C)cc1CO2 1775962008 NKHSLWKBLSNJRP-UHFFFAOYSA-N 382.508 2.712 0 50 GFAA CCc1c(NC(=O)N2CCN(CC)[C@]3(CCOC3)C2)cnn1-c1ccccc1 1775961796 ARINQDGSMQGKFY-OAQYLSRUSA-N 383.496 2.763 0 50 GFAA Cc1ccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC[C@@H](C)C3)n2)cc1 1857797834 YZAKWXWHERAHCN-WBVHZDCISA-N 393.491 2.905 0 50 GFAA O=C(c1ccc2cccnc2c1)N1CCC2(C1)CN(C(=O)c1cncc(F)c1)C2 2325786779 AAHRGEWRSAXFHK-UHFFFAOYSA-N 390.418 2.757 0 50 GFAA Nc1ncnc2c1ncn2[C@H]1CCN(CCSc2ccc(F)cc2F)C1 2325804125 WQJTZHQNLKXLIS-LBPRGKRZSA-N 376.436 2.726 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)CC1 802756 AOGNFTOPBBITDX-UHFFFAOYSA-N 396.292 2.966 0 50 GFAA CN(C)C[C@]1(CO)CCCN(c2noc(-c3ccc(Cl)cc3)c2C(=O)O)C1 2356135846 VSWVAYAMJYPQPX-LJQANCHMSA-N 393.871 2.834 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C(=O)c2c[nH]nc2-c2cccc(F)c2)C1 2356146699 QSQHYCVCHJAQSC-OAQYLSRUSA-N 392.438 2.539 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccsc1 33955230 FYBFDIIAPRHIQS-KKBLUXBBSA-N 396.505 2.603 0 50 GFAA in-man COc1cccc(N2CCN(Cc3nnc(-c4ccc5c(c4)OCO5)o3)CC2)c1 58024170 WIIZLRSNEVLHPR-UHFFFAOYSA-N 394.431 2.796 0 50 GFAA Cc1nc2sccc2c(=O)n1CC(=O)N1CCC[C@@H](OCc2ccccc2)C1 20859260 OUJQMYQGBCMENC-QGZVFWFLSA-N 397.500 2.974 0 50 GFAA COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN(C)Cc1ccc([C@H]2C[C@@H]2C)o1 248029201 SSWIKTDWZHDCGS-YSSFQJQWSA-N 396.487 2.961 0 50 GFAA COc1cccc(CNC(=O)C2(N3C[C@H](C)O[C@H](C)C3)Cc3ccccc3C2)c1 20204647 GSZZTUDLTXUKIE-HDICACEKSA-N 394.515 2.958 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@H](O)c1ccccc1 67726998 DJRCXSBEDJTVSO-HXUWFJFHSA-N 376.460 2.505 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)NCCSC(C)(C)C)CC2)cc1 67087235 IDBAWEBIQLCMSE-UHFFFAOYSA-N 379.526 2.694 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@@H](CNC(=O)c3ccc(F)cc3)C2)cs1 12612148 TWERJLOLUHYKQN-AWEZNQCLSA-N 375.469 2.802 0 50 GFAA CN1CCN(c2cc(C(=O)N3CC[C@H](Cc4ccc(F)cc4)C3)ccn2)CC1 119507734 FMQSRESRBQGPFL-GOSISDBHSA-N 382.483 2.677 0 50 GFAA COCc1cccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1 25335384 QGMGWBZEPMUNMN-HNNXBMFYSA-N 394.518 2.934 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)[C@H](C)OC[C@H]3CCCO3)cc2F)C[C@@H](C)O1 229682791 KUKNUCIRXHTCAJ-QSJFSLAZSA-N 380.460 2.962 0 50 GFAA O=C(O)c1nn(CC2CC2)c2c1CN(C(=O)c1cccc3cccnc13)CC2 67803760 RVFGRACMXUYCRH-UHFFFAOYSA-N 376.416 2.738 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(NCc3cnn(C)c3)nc2)C1 67846881 GXMJBBBQORTOAM-SFHVURJKSA-N 383.496 2.895 0 50 GFAA CC(C)CCN1CC2(CCN(C(=O)CC[C@@H]3CCCN(C)C3)CC2)OC1=O 77340979 JNGUMHAQZUMZCF-SFHVURJKSA-N 379.545 2.968 0 50 GFAA CCCCC(=O)N1CCC(N2CCC[C@H](C(=O)NCc3ccccn3)C2)CC1 71498266 CFASILGBFKJTOQ-SFHVURJKSA-N 386.540 2.591 0 50 GFAA CCCCN1CCN([C@H](C(=O)NC2CCCCC2)c2ccccc2)C(=O)C1=O 77339772 IGOIZPIZLMGNJY-IBGZPJMESA-N 385.508 2.648 0 50 GFAA O[C@@H](COc1cccc(CNC2CCOCC2)c1)CN1CCc2ccccc2C1 14950922 DUHOQBOHBJTLMU-HSZRJFAPSA-N 396.531 2.753 0 50 GFAA CN(C(=O)[C@H]1CC12CCN(CC(=O)NCCC1CCCCC1)CC2)C1CC1 371553942 NXEIRBHZBYDUGH-LJQANCHMSA-N 375.557 2.796 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(CCSc3ccccc3)CC2)CN1C(=O)C1CC1 72122380 NCYQPQCXOQBDDG-SFHVURJKSA-N 388.533 2.956 0 50 GFAA O=C(c1ccc(CN2C(=O)CNC2=O)cc1)N1CCC=C(c2ccccc2)C1 375375437 DCZUMPBLEMZTAX-UHFFFAOYSA-N 375.428 2.668 0 50 GFAA O=C(Cc1csc(-c2ccccn2)n1)N1CCC(OC[C@H]2CCCO2)CC1 175517315 QVZWOFXKHAVJIT-QGZVFWFLSA-N 387.505 2.934 0 50 GFAA COC(=O)c1c(NC(=S)NCc2ccco2)sc(C(=O)N(C)C)c1C 17077982 PZCDFUUSQVDQRQ-UHFFFAOYSA-N 381.479 2.625 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(O)(c2ccccn2)CC1 426518963 LQLXQELOHYIGJC-FQEVSTJZSA-N 394.519 2.739 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@](NC(=O)OCc2ccccc2)(C(=O)O)C1 44136950 WFJMNSIPYXEIJT-IBGZPJMESA-N 378.425 2.767 0 50 GFAA COc1cc(Cl)cc(CN2C[C@@H]3CN(C)C[C@]3(C(=O)O)C2)c1OC(C)C 96166949 HHTKBXTWDVJRLE-LIRRHRJNSA-N 382.888 2.584 0 50 GFAA Cc1cccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CCC2)n1 91382279 NXNZZMPLDDPFFO-UHFFFAOYSA-N 379.508 2.789 0 50 GFAA O=C(N[C@H](c1ccncc1)c1ccc(Cl)cc1)N1CCN(CCCO)CC1 426478780 MPHUQQDMJREDJS-IBGZPJMESA-N 388.899 2.534 0 50 GFAA COc1cccc(F)c1[C@H](C)NCc1nnc2n(C)c(=O)c3cc(C)ccc3n12 179941574 VKOMSVNYVDFASV-ZDUSSCGKSA-N 395.438 2.888 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)c2ccccc2-c2nnn[nH]2)CC1 95511231 YDLHYLYYKLUYDT-UHFFFAOYSA-N 379.468 2.883 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@H]2C(=O)O)c1OC 91461961 HTPPWOYFGGFPHN-DLBZAZTESA-N 387.407 2.712 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(C)c(F)c1)CC2 95529320 KOMCFMWSXQFSFJ-UHFFFAOYSA-N 384.455 2.783 0 50 GFAA CSCC[C@H](O)C(=O)N1CCC2(CCC(=O)N(Cc3ccccc3)C2)CC1 91845925 LHMFASGDZDCXPI-SFHVURJKSA-N 390.549 2.532 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)NCC2CCN(Cc3cccs3)CC2)o1 299626467 FQTOHOCJEYDRRG-UHFFFAOYSA-N 396.534 2.528 0 50 GFAA NC(=O)CCn1cc(-c2cccc(C(=O)N[C@@H]3CCc4ccccc4C3)c2)cn1 534578311 ZRONCBLFVQRJMF-OAQYLSRUSA-N 388.471 2.713 0 50 GFAA Cc1nnc(SCC(=O)N2CCC(c3nc4cc(F)ccc4[nH]3)CC2)o1 299783958 YBCZIKVJXMQPJL-UHFFFAOYSA-N 375.429 2.892 0 50 GFAA CN(C)[C@@H](C(=O)N1CCC(C(=O)NCc2ccco2)CC1)c1cccc(F)c1 826609417 XGCPSPOIDWHILQ-LJQANCHMSA-N 387.455 2.576 0 50 GFAA CSc1ncc(CNC(=O)N2CCC([C@@H](O)c3cccs3)CC2)n1C 584888345 CAFOJSIJRXIFPW-OAHLLOKOSA-N 380.539 2.859 0 50 GFAA CCN(Cc1ccncc1)C(=O)[C@@H]1CNC[C@H](C(=O)Nc2ccc(C)cc2)C1 1565517117 RVLPXDDVKSOCLX-MOPGFXCFSA-N 380.492 2.603 0 50 GFAA O=C(c1ccncc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)NCc1ccccc1F 1565530692 BTULTUQVJPFRCP-QAPCUYQASA-N 382.439 2.667 0 50 GFAA Cc1nc(C)n(CCCNC(=O)[C@@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)n1 952860054 AZCPQIRZOKLBTK-GOSISDBHSA-N 383.496 2.578 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1ccc2ccccc2c1O 271221866 CUWWQYQWWREMHC-HNNXBMFYSA-N 399.472 2.971 0 50 GFAA COCc1c(C(=O)N[C@H](C)CCN2CCN(C)CC2)sc2ccccc12 170598029 WLWKWHALDVBTDW-OAHLLOKOSA-N 375.538 2.804 0 50 GFAA CCCC[C@H]1CN(C(=O)c2cc(S(N)(=O)=O)ccc2C)C[C@@H](C(C)C)O1 1615936023 IGZPTSLWFCZOQA-YJBOKZPZSA-N 382.526 2.698 0 50 GFAA COc1ccc(OC)c([C@H](C(=O)O)N2CCC(c3nnc4ccccn34)CC2)c1 1506420227 YYUQLFVWLMLFAO-LJQANCHMSA-N 396.447 2.752 0 50 GFAA OC[C@@]12CNC[C@@H]1CN(Cc1nc3ccccc3n1Cc1ccccc1Cl)C2 1772700429 ARSKLWAWYBXBMK-VGSWGCGISA-N 396.922 2.752 0 50 GFAA Cn1ccnc1CN1C[C@H]2CN(c3cnccn3)C[C@@]2(CCc2ccccc2)C1 1772815474 SEZGBKLJEOQZEA-NZQKXSOJSA-N 388.519 2.781 0 50 GFAA CN(C(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)[C@H]1CCOC1 12200451 VKTPBYRGLDDGJN-FQEVSTJZSA-N 395.503 2.986 0 50 GFAA Cc1cccc(C)c1Oc1ncccc1CNC(=O)C[C@H]1CCS(=O)(=O)C1 12306545 ZARWKXYPDMZUKU-MRXNPFEDSA-N 388.489 2.932 0 50 GFAA COc1ccccc1-n1cc(-c2ccnc(N3CC[C@H](n4ccnc4)C3)n2)cn1 19113241 UBWUEPVHQZUFAY-KRWDZBQOSA-N 387.447 2.986 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN([C@@H](C)CCO)CC2)c1 19745617 XXOVAZDOZTWMEZ-INIZCTEOSA-N 376.497 2.545 0 50 GFAA Cc1ccc(/C=C/C(=O)NCc2nnc3cc(-c4nc(C5CC5)no4)ccn23)o1 169776366 YATRWYCKKMXQAH-VOTSOKGWSA-N 390.403 2.888 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)NCc1cc(C)cc(OC)c1 1857529540 VPMPMPVKBZUCGN-UCNVEGJOSA-N 383.492 2.831 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cc4c(nc3O)CCCC4)C1)CC2 1857701036 LBWVQWKNNIYNPU-QFIPXVFZSA-N 394.475 2.590 0 50 GFAA CN(C)[C@H]1CCN(C(=O)C2CCN(c3nc4ccc(Cl)cc4o3)CC2)C1 1857718985 CESPYABPZPNETI-HNNXBMFYSA-N 376.888 2.860 0 50 GFAA C[C@@H](O)Cc1nnc(SCC(=O)n2c3c(c4c2CCCC4)CCCC3)n1C 1077868 PZCFJMBQZCROEL-CYBMUJFWSA-N 388.537 2.730 0 50 GFAA CCc1nsc(N2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)n1 121160133 XFVDTLMNCUQYGY-GOSISDBHSA-N 388.537 2.981 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)[C@H]2CC(Cc3cccc(F)c3)=NO2)CC1 19865126 MRMJULQCBRRUFV-OAQYLSRUSA-N 396.466 2.561 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H]2Cc3cccc(O)c3C2)(c2ccccc2)CC1 847905386 JMGUPVMYWUORBU-IBGZPJMESA-N 390.483 2.722 0 50 GFAA COc1ccc(Nc2cc(NC[C@H](CO)c3cccnc3)ncn2)c(OC)c1 952845939 ORTOCTLKNUJRFT-OAHLLOKOSA-N 381.436 2.820 0 50 GFAA CC(C)(C)OC(=O)N1CCO[C@H](c2noc(-c3cccc4nc(O)[nH]c34)n2)C1 1875267044 MTCOZSFCHZIUMI-LBPRGKRZSA-N 387.396 2.627 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc1Oc1ccncc1 1875402134 CFVMNVORDXEARR-NSISKUIASA-N 392.459 2.948 0 50 GFAA COCCCN1C(=O)[C@@]2(CCN(C(=O)c3cncc(Cl)c3)C2)c2ccccc21 2100483958 UYTQETAXVWZFSC-OAQYLSRUSA-N 399.878 2.902 0 50 GFAA N[C@@H]1CCN(C(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)CCC1(F)F 2325778626 GYULALOBAKWTRV-GFCCVEGCSA-N 377.222 2.769 0 50 GFAA Cc1oc2ccccc2c1CN(C)c1cncc(C(=O)N2CCN(C)CC2)n1 2325792762 KYRTXYXFAYGBOY-UHFFFAOYSA-N 379.464 2.555 0 50 GFAA Cc1ccc(-n2[nH]c(C(=O)N3CCCN[C@@H](c4ccccc4)C3)cc2=O)cc1C 2325798841 CXDNLHDHMNERNV-OAQYLSRUSA-N 390.487 2.959 0 50 GFAA C[C@@]1(CNC(=O)c2ccc3ncnc(O)c3c2)CCN(Cc2ccccc2)C1 2325804813 SPQADYFLRLEYRU-QFIPXVFZSA-N 376.460 2.977 0 50 GFAA COc1cccc(C2=NN(C(=O)COc3ccccc3)[C@](O)(C(F)(F)F)C2)c1 910790 WQZGAGMTWLROJG-GOSISDBHSA-N 394.349 2.962 0 50 GFAA CC(C)CNS(=O)(=O)c1ccc(OCC(=O)NC(C)(C)C)c(Cl)c1 1118281 JHFHSANFGOWSNC-UHFFFAOYSA-N 376.906 2.568 0 50 GFAA COc1ccc([C@@H]2CCCN2C(=O)Cn2cnc(C3CCC3)cc2=O)c(OC)c1 134378499 MMUPIRRXUJHAMT-IBGZPJMESA-N 397.475 2.892 0 50 GFAA O=C1CCC[C@@H]1CC(=O)N1CCC(Oc2ccc(Cl)cc2)(C(=O)O)CC1 65372549 YJVRESWAKAZBLQ-CYBMUJFWSA-N 379.840 2.924 0 50 GFAA COCc1cc(N[C@H](CN2CCOCC2)c2ccccc2)nc(C(C)(C)C)n1 469872161 OOESTGQWBVPTSU-LJQANCHMSA-N 384.524 3.406 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 110691693 HHHNKGIKVMIFDA-CYBMUJFWSA-N 396.896 2.894 0 50 GFAA Cc1ccc(NC(=O)c2cccc(OC(C)C)n2)cc1C(=O)N1CCOCC1 470441039 RQJRLGVZKTWXRM-UHFFFAOYSA-N 383.448 2.902 0 50 GFAA CNC(=O)c1ccc(NC(=O)N2CCCN(C(=O)c3cccc(C)c3)CC2)cc1 125066198 UXBOPSASIZRADY-UHFFFAOYSA-N 394.475 2.735 0 50 GFAA COc1cccc(CN2CCN(CC(=O)Nc3ccc(F)cc3F)CC2)c1 20274262 HSTMJFRLYDUOOH-UHFFFAOYSA-N 375.419 2.730 0 50 GFAA OCC1(CCOc2ccccc2)CCN(c2nnnn2-c2ccccc2)CC1 67982862 CILBMKZTRCEEQR-UHFFFAOYSA-N 379.464 2.710 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1)c1ccccc1 713258 ZMRQQNVSNKATDK-UHFFFAOYSA-N 376.416 2.597 0 50 GFAA COc1ccc(CCNC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(C)=O)cc1 2858130 ZHGSYPGFJHJQCB-OAQYLSRUSA-N 379.460 2.583 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@H]3CCCN3Cc3ccccn3)cn2)n1 364827037 PKYYTSCKQBNJEY-LJQANCHMSA-N 376.464 2.882 0 50 GFAA Cc1cccc(CN2CCN(c3ccnc(C(=O)NC4CC4)c3)[C@@H](C)C2=O)c1 71764701 MUPPOGQRUZNSOJ-INIZCTEOSA-N 378.476 2.520 0 50 GFAA CCCc1nnc(SCC(=O)N2C[C@@H]3CCCC[C@@]32c2ccccc2)n1N 365866093 LEMINWZXOFTFFD-OXJNMPFZSA-N 385.537 2.964 0 50 GFAA O=C([C@@H]1CC(F)(F)CN1)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 72475001 CCXDNSYCGKDZDK-ZDUSSCGKSA-N 378.341 2.513 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCC(=O)N(C)C)CCCN1Cc1ccc(F)cc1 72144719 LAHVPDOJEWDUML-IBGZPJMESA-N 377.504 2.753 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCOC[C@H]3C[C@H](O)c3ccco3)cc2)CC1 158903770 ZWYSFYMDMYMTQV-MOPGFXCFSA-N 383.448 2.830 0 50 GFAA O=C(Nc1cccc(CNC(=O)N2CCn3cncc3C2)c1)c1cccc(F)c1 378108569 HGHLEUMWRHJVAB-UHFFFAOYSA-N 393.422 3.000 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3CCCCC3)[C@H]4C2=O)cc1C 77486275 BHSJYKBURHIKJS-MXBUBSDBSA-N 380.488 2.598 0 50 GFAA CC(=O)N1CCN(Cc2ccc(-c3nc(O)c(C)c(C(F)(F)F)n3)cc2)CC1 48170738 BWTHLHMTURWUHQ-UHFFFAOYSA-N 394.397 2.841 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H]2CN2CCOCC2)cnn1-c1cccc(Cl)c1 174482322 WLDGILSIQHFWDJ-GOSISDBHSA-N 388.899 2.771 0 50 GFAA COCCOC[C@H]1CCN(C(=O)NCc2ccncc2OCc2ccccc2)C1 286980983 PXUQJYCZKYPPCM-IBGZPJMESA-N 399.491 2.855 0 50 GFAA CCS(=O)(=O)c1ccc(-c2cccc(C(=O)N3CCNC[C@H]3C)c2)s1 426443042 RXLDNQPHLKQIOO-CYBMUJFWSA-N 378.519 2.643 0 50 GFAA COc1cc(OC)cc(-c2cccc(NC(=O)[C@H]3CCc4nnn(C)c4C3)n2)c1 291000482 BXLXTDHYTSVUPJ-ZDUSSCGKSA-N 393.447 2.638 0 50 GFAA Cc1c(O)nc(-c2cccc(CN3CCN(C)C(=O)[C@@H]3C)c2)nc1C(F)(F)F 19836366 BPQGCJHSHDQYDV-LBPRGKRZSA-N 394.397 2.839 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@H](c2nccn2Cc2ccccc2)C1 82120976 SJDRYNZEEQKNMN-SFHVURJKSA-N 386.459 2.994 0 50 GFAA Cc1n[nH]c(C)c1[C@@H](C)NC(=O)N1CCCN(C2Cc3ccccc3C2)CC1 426536002 ZFNWHGHHGNGMBU-OAHLLOKOSA-N 381.524 2.972 0 50 GFAA C[C@@H]1CNCCN1C(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 95505068 XBRXZLSLHHIQGX-GOSISDBHSA-N 394.519 2.559 0 50 GFAA O=C(c1ncccc1O)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95373650 IAKXDJCKDRYIEE-PWIZWCRZSA-N 385.414 2.768 0 50 GFAA COCc1nc(O)cc([C@H]2C[C@H](NC(=O)CCc3ccc(F)cc3F)C2)n1 253535447 ZDHOOOKEWZGYRN-MQMHXKEQSA-N 377.391 2.602 0 50 GFAA O=C(CC[C@H]1N=C(O)N(CCc2ccccc2)C1=O)Nc1nc2c(s1)CCC2 252536323 IEDABWXOZMYBHP-OAHLLOKOSA-N 398.488 2.718 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)c2ccnc(O[C@@H]3CCOC3)c2)CC1 185026371 ANPNYHCIZPJSQU-OAQYLSRUSA-N 395.503 2.952 0 50 GFAA Cc1nccn1Cc1ccccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 952968674 NYVDGZLADYOFJA-SFHVURJKSA-N 389.459 2.622 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3[C@H](C(=O)O)C[C@H]4CCCC[C@H]43)n2)cc1 268950925 TVNGXMRPJPMBQR-OIISXLGYSA-N 399.447 2.922 0 50 GFAA Cc1c(NC(=O)c2cnn(-c3ccccc3)c2)cccc1C(=O)N1CCOCC1 409861735 ZDKWRGCMXBVTSK-UHFFFAOYSA-N 390.443 2.905 0 50 GFAA O=C(Nc1ncc(Cc2ccccc2Cl)s1)N1CCS(=O)(=O)CC1 170791962 BYPQIDNMUVFVSW-UHFFFAOYSA-N 385.898 2.650 0 50 GFAA Nc1nccc([C@@H]2CCCN(C(=O)Nc3nc(-c4cccnc4)cs3)C2)n1 192945428 KZMRZJALABMULD-CYBMUJFWSA-N 381.465 2.989 0 50 GFAA O=C1CN(C(=O)c2cc(Br)ncc2Cl)CN1Cc1ccccc1 779824699 SKRRNVDKJQJDHA-UHFFFAOYSA-N 394.656 2.940 0 50 GFAA CC(=O)Nc1ccc2nc(CN3C[C@@H](O)[C@H](Cc4cc(C)no4)C3)ccc2c1 1529196680 DFZMKVNLADVJOL-IIBYNOLFSA-N 380.448 2.525 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC(OC)CC2)ccc1F 1704326147 YOGVDMWUINZOOD-UHFFFAOYSA-N 377.416 2.806 0 50 GFAA O=S(=O)(c1cccc(OC(F)(F)F)c1)N1CCC[C@@]2(CCC[C@H]2O)C1 1704302066 ANJKYVTVXWKQKR-CABCVRRESA-N 379.400 2.901 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3ccc(N4CCCCC4)cc3)C[C@@H]12 1704297606 CQYDPLVKIXSECH-KNQAVFIVSA-N 385.508 2.688 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2C[C@H](C)O[C@H](C)C2)ccc1F 1704326111 XIOQNFMCOKAQLH-TXEJJXNPSA-N 377.416 2.805 0 50 GFAA O=C(CC1=CCCC1)N1C[C@@H]2CN(Cc3c(F)cccc3F)C[C@@]2(CO)C1 1772819768 SIQBZHHYRRNFSI-KKSFZXQISA-N 376.447 2.718 0 50 GFAA O=C(CCn1cccn1)N1CCCN(Cc2cccc(OC(F)F)c2)CC1 1772710857 WXSCFPRUFUHSBJ-UHFFFAOYSA-N 378.423 2.609 0 50 GFAA CC(=O)c1ccccc1-c1ccc2c(c1)C[C@@H](CNC(=O)c1ccc[n+]([O-])c1)O2 11973844 ASQUQTRPEHOCIU-IBGZPJMESA-N 388.423 2.923 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(C[C@@H]2CCOC2)CC1 12315025 JSWGVUIRIZUAPB-INIZCTEOSA-N 384.480 2.817 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCC2)N[C@H]1CCCc2c1[nH]c1ccccc21 169774011 BZEQBCNFSGYIAR-IBGZPJMESA-N 376.460 2.797 0 50 GFAA CCCN1CCC2(CC1)OCCc1cc(C(=O)N3CCC[C@H]3CO)sc12 1857695134 VLEXLNDYEDOCPK-INIZCTEOSA-N 378.538 2.619 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)C1(CCN(C[C@@H]3CCOC3)CC1)OCC2 1857699398 SVNVOOJKCLROAY-HNNXBMFYSA-N 390.549 2.931 0 50 GFAA CNS(=O)(=O)c1ccc(CNC(=O)[C@]2(C)CCCc3ccccc32)s1 159506820 NNHJJJBYLHQRDO-GOSISDBHSA-N 378.519 2.567 0 50 GFAA CN1CCN(C)[C@@H](CNC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 264675154 BSYPPWLEXDNSAV-IBGZPJMESA-N 393.487 2.987 0 50 GFAA CC(C)(C)OC(=O)NCc1cc(-c2nc(-c3cnc4cnccn34)no2)ccn1 809481082 DDVFJGHISNZQGV-UHFFFAOYSA-N 393.407 2.866 0 50 GFAA C[C@@H]1C[C@H](C(=O)N[C@H](c2c[nH]c3cccc(F)c23)C(F)(F)F)O[C@H]1C(=O)O 911771628 BNHXRUVSXFVPAU-JTSWKZJASA-N 388.317 2.905 0 50 GFAA C[C@@H](OC(=O)c1ccccc1OCc1cn2ccccc2n1)[C@H]1CCNC(=O)C1 1263661234 CNTGOJXBCIZSTO-CVEARBPZSA-N 393.443 2.985 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)COc4ccccc4F)CC3)n2)cn1 856524649 AIFHZYQSYDHYNL-UHFFFAOYSA-N 395.438 2.801 0 50 GFAA OC[C@@H]1C[C@H](O)CN1C[C@H](O)c1ccc(-c2ccc(Br)cc2)cc1 864097369 PRCGUUBQQAAUEU-FHWLQOOXSA-N 392.293 2.577 0 50 GFAA Cc1c(Sc2nnc(CN3CCCC3)o2)nn2c(C(F)(F)F)nnc2c1C 1875255947 LZDPMKWWDZEEQE-UHFFFAOYSA-N 399.402 2.890 0 50 GFAA CS[C@H](C)Cn1c(CN2CCCC2=O)nnc1N(C)C1Cc2ccccc2C1 1316387913 STMYNUOQVRBDSO-OAHLLOKOSA-N 399.564 2.756 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)C(=C(O)N[C@@H]1CCS(=O)(=O)C1)S2 2083176134 BKOZBLITUOKODU-SNVBAGLBSA-N 393.534 2.500 0 50 GFAA COCC[C@@H](NC(=O)N1C[C@H](O)C[C@@H](OC)C1)c1cccc(C(F)(F)F)c1 2325787158 GAKWRDHGSBJONG-BZUAXINKSA-N 390.402 2.574 0 50 GFAA CN1CCN(C(=O)NCc2cn3cccc(F)c3n2)C[C@H]1Cc1ccccc1 2325857059 NRIALIKDHGAKOU-GOSISDBHSA-N 381.455 2.542 0 50 GFAA Cc1ccc(N(CC(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)cc1Cl 882460 WIBXQABVGKPFAE-UHFFFAOYSA-N 396.852 2.782 0 50 GFAA COc1ccc([C@@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3ncnn32)cc1O 955875 FALJBSTUCBLZKU-GOSISDBHSA-N 377.404 2.920 0 50 GFAA CCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1 1162867 IHUSZFYKJBLMKO-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)s1 2461657 MOVNUQUFVMGGFY-UHFFFAOYSA-N 378.435 2.747 0 50 GFAA O=C(NCCc1nc2ccccc2[nH]1)c1cc2c(s1)CCOC21CCNCC1 2356142019 ABOUIMLERCHCEE-UHFFFAOYSA-N 396.516 2.748 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)N1CCC(OC(F)(F)F)CC1 2356143477 JHQTUHQPRHEFJN-UHFFFAOYSA-N 384.358 2.982 0 50 GFAA COc1cc(F)ccc1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356158064 BUZQAGJCQKCUGQ-OAQYLSRUSA-N 384.455 2.811 0 50 GFAA C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(c2ncccn2)CC1 6249367 WQCDVHFKRPYLQQ-LBPRGKRZSA-N 381.263 2.900 0 50 GFAA C[C@H](C(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1)c1cc2ccccc2o1 225716169 HVWAKAABCONMBQ-HOCLYGCPSA-N 376.478 2.563 0 50 GFAA CCN(C(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1)[C@@H](C)c1cccnc1 115223922 JIEUNUAPQNTEPQ-AWEZNQCLSA-N 391.493 2.991 0 50 GFAA O=C1COc2cc3c(cc2N1)[C@@H](c1cc(F)ccc1-n1cccn1)CC(=O)N3 65422859 HMMYSFDOYLJEPL-LBPRGKRZSA-N 378.363 2.816 0 50 GFAA COc1ccc(Nc2nc(-c3cnc(N4CCCC4)nc3C)cc(=O)[nH]2)cc1 39383741 KXZGUXOTOWXTDT-UHFFFAOYSA-N 378.436 2.888 0 50 GFAA O=S(=O)(c1ccc2c(c1)CCCO2)N1CC[C@H](n2ncc3ccccc32)C1 329715209 URECMIYBXLCPIL-KRWDZBQOSA-N 383.473 2.997 0 50 GFAA CN(CCc1ccc(F)cc1)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C 368646445 VCDNTWQMJCMXRH-NQIIRXRSSA-N 398.482 2.702 0 50 GFAA COc1cccc(CS(=O)(=O)N2CCNC[C@H]2c2ccccc2Cl)c1 261757352 QSIGYTPBZCNXDZ-SFHVURJKSA-N 380.897 2.825 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ncccc2O)CCC(=O)N1Cc1ccc(F)cc1 71759334 IDAPSAFAUHYXGT-KRWDZBQOSA-N 385.439 2.826 0 50 GFAA Cc1cccnc1OC1CCN([C@H](C)C(=O)Nc2ccc3nc(O)[nH]c3c2)CC1 377733406 WEKJWFFLKBDOBQ-CQSZACIVSA-N 395.463 2.842 0 50 GFAA CSCc1nc(CNC(=O)c2sc3ncn(C)c(=O)c3c2C)cs1 216139052 FPPTUPZMYMHMHZ-UHFFFAOYSA-N 380.520 2.553 0 50 GFAA CC(C)c1cc(NC(=O)Cn2ccc(-c3ccc4c(c3)OCCO4)n2)n(C)n1 48330164 XZCNAAMAZQETPU-UHFFFAOYSA-N 381.436 2.817 0 50 GFAA Cc1noc(-c2ccc(N3CCC(Oc4ccccc4)(C(=O)O)CC3)nc2)n1 82092252 QBVNMVKVACXKTA-UHFFFAOYSA-N 380.404 2.943 0 50 GFAA CCc1nnc(CNC(=O)N[C@@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)s1 291088430 SETJLBSBNUGAHH-GXFFZTMASA-N 389.481 2.770 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@@H](c2nccn2Cc2ccccc2)C1 82120975 SJDRYNZEEQKNMN-GOSISDBHSA-N 386.459 2.994 0 50 GFAA Cc1n[nH]c(C)c1CC(=O)N1CC[C@@]2(CCCN(CC3CCCCC3)C2=O)C1 426388230 XGXOIDZJTXTGFG-QFIPXVFZSA-N 386.540 2.990 0 50 GFAA Cc1c(CC(=O)N(C)C[C@@H](C)O)c2c(n1Cc1ccccc1F)CCCC2=O 95527629 DPHYNHPVPIGHBC-CQSZACIVSA-N 386.467 2.885 0 50 GFAA O=C(Nc1ccccc1Oc1cccnc1)[C@@H]1CCCN1C(=O)c1cnccn1 95528742 NWIFTOQNUPJUBW-SFHVURJKSA-N 389.415 2.907 0 50 GFAA O=C(C1CCC1)N1CC[C@]2(O)CCN(Cc3ccccc3OC(F)F)C[C@@H]2C1 95364387 MBTLHHIXQATWOR-DYESRHJHSA-N 394.462 2.873 0 50 GFAA C[C@@H](O)c1cccc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 95353192 RZQUFMFMTFWOGU-GOSISDBHSA-N 394.519 2.982 0 50 GFAA CN(CCC(C)(C)O)C(=O)[C@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 91906527 LVFYTNUOAQYNMK-INIZCTEOSA-N 380.916 2.741 0 50 GFAA Cn1cnnc1CN1CCC[C@@H](C(=O)Nc2ccc(-c3cscn3)cc2)C1 95527693 TWPTYSJKPDDTFN-OAHLLOKOSA-N 382.493 2.789 0 50 GFAA Cc1ccc(-c2cc(CN3CC[C@H](N4CCOCC4)[C@H](CCCO)C3)on2)cc1 91586044 XZCUHHUXVKIHQC-OFNKIYASSA-N 399.535 2.945 0 50 GFAA CCCNC(=O)c1ccc(Cl)c(NC(=O)N2CCC[C@H]2C(=O)NCC)c1 97480312 GDULKTNSRLFCQR-HNNXBMFYSA-N 380.876 2.612 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 95354811 KTRYUELWNDPJQA-CQSZACIVSA-N 383.431 2.611 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H](C3=CC(=O)OC3)[C@@H](O)C[C@]12O 242620152 PVAMXWLZJKTXFW-FTDBIHAPSA-N 390.520 2.575 0 50 GFAA CCC(=O)Nc1cc(NC(=O)NC2CCN(c3cnccn3)CC2)ccc1C 299788163 QMVIDUMHGJCZLS-UHFFFAOYSA-N 382.468 2.924 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)NC[C@H](c1ccc(F)cc1)N1CCCC1 827861862 XEDMVSZDQLVEHS-GOSISDBHSA-N 383.423 2.687 0 50 GFAA CCc1cc(N2CCN(Cc3ccc4cc(NC(C)=O)ccc4n3)CC2)ncn1 823557406 PRDBFAFERYFVSM-UHFFFAOYSA-N 390.491 2.868 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)NCCc1noc([C@H]2CCCO2)n1 952974856 KQPGSUHRMQETTA-OAHLLOKOSA-N 384.461 2.946 0 50 GFAA Cc1cccc(Oc2ccc(NC(=O)c3ccnc(S(N)(=O)=O)c3)cn2)c1C 170600697 VEGLZQKVEGLTHX-UHFFFAOYSA-N 398.444 2.785 0 50 GFAA CC1(C)[C@@H]2CC[C@@]13CS(=O)(=O)N(CC(=O)N(C1CCCC1)C1CC1)[C@H]3C2 192831959 HWBJVMHWZCKUHV-LIVBEALHSA-N 380.554 2.760 0 50 GFAA C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)C(=O)Nc1cccc(N2CCCC2)c1 195356180 KOPTVWOSZKYJAR-FOIQADDNSA-N 379.460 2.734 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NCc2ccc(CO)cc2)s1 1506416660 DIYPZBNDIMWBHC-UHFFFAOYSA-N 378.475 2.991 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)Cc3csc(-c4ccccc4)n3)C[C@@H]12 1704311561 BPRVBVWWNKISTJ-UTKZUKDTSA-N 399.516 2.750 0 50 GFAA CO[C@H]1CN(C(=O)C2(c3ccccc3)CCN(C)CC2)C[C@H]1Cc1cc(C)no1 1704350424 JEOSJBRRRMGFBE-NQIIRXRSSA-N 397.519 2.663 0 50 GFAA O=C(N[C@@H]1CCCN(CCc2ccccc2)C1)c1ccccc1N1CCOCC1 12435003 UQKKRNVOIVRPKJ-OAQYLSRUSA-N 393.531 2.960 0 50 GFAA CC[C@H](COC)Nc1ncnc2sc(C(=O)NCC(C)(C)CO)c(C)c12 12456384 HMQGKELMBJKIHB-GFCCVEGCSA-N 380.514 2.585 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2CCCO2)CC1)Nc1ccc2c(c1)OCCO2 12719079 WMALTXXQRZPEAN-SFHVURJKSA-N 388.464 2.594 0 50 GFAA CC(C)CN1C[C@H](OCc2cccnc2)CN(C(=O)c2cccs2)CC1=O 14538240 VWQAEDLEOARWEG-KRWDZBQOSA-N 387.505 2.669 0 50 GFAA CCOC(=O)CN(C)C(=O)CC[C@@]1(Cc2ccc3ccccc3c2)CCC(=O)N1 14878871 GTTAFMNUZCWJOV-HSZRJFAPSA-N 396.487 2.833 0 50 GFAA COc1ccc(CNCc2csc(C)n2)cc1OC[C@H](O)CN(C)C(C)C 14952746 FLILZPFIFMLGAX-GOSISDBHSA-N 393.553 2.830 0 50 GFAA COC[C@H]1CCN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)C1 15064013 DTBJSHNNBOEDIF-IBGZPJMESA-N 397.523 2.693 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4ccc(C)c(F)c4)nnc3c2)n1 169776168 DHTOEZZLWOBGGB-UHFFFAOYSA-N 380.383 2.719 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857684961 LMIZVGLQHSIJMW-OAQYLSRUSA-N 381.480 2.612 0 50 GFAA COc1ccc(C(=O)N2CCOC[C@H]2C)cc1Oc1cccc(OC)c1CN 1857687576 ZKBHLFCUDSFZPH-CQSZACIVSA-N 386.448 2.816 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N[C@H](C(=O)OC)c1ccccc1 1857701363 POKXCSWEAXVEGG-AWEZNQCLSA-N 382.445 2.807 0 50 GFAA Cc1ccc(CNC(=O)N2CCC[C@]3(CCc4c(O)nc(N(C)C)nc43)C2)cc1 1857708826 PHYUFNIAHMLKED-QFIPXVFZSA-N 395.507 2.746 0 50 GFAA O=C1CCOC2(CCN(C(=O)[C@H]3CC34CCC4)CC2)CN1Cc1ccccc1 1857711739 FCORQQNHGPNGMN-LJQANCHMSA-N 382.504 2.987 0 50 GFAA COc1cc(C)ccc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857731740 NWCVZNQVFIXYKY-NOXFTYBFSA-N 392.455 2.918 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC[C@H](CO)[C@H](O)C2)cc1 1857738351 DCFCANRNCYWWGE-WIYYLYMNSA-N 391.471 2.663 0 50 GFAA O=C(c1cc(-c2ccccn2)[nH]n1)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1875250449 ZPXIOCHBYZRJFZ-ZHRRBRCNSA-N 399.454 2.696 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@H](CC(=O)O)c1ccc(F)cc1 236584750 BOGARULPOPTJRJ-UXHICEINSA-N 398.434 2.994 0 50 GFAA C[C@@H]1CC[C@H](C(=O)O)CN1C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 263243437 RWDVXSFOBHDKCI-CJNGLKHVSA-N 388.851 2.875 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)N1C[C@H]2[C@H](O)C[C@H]2C1 1875268047 COLYPVMBKVZAFP-NILFDRSVSA-N 384.436 2.588 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C3)ccc21 1875371784 LZKZJLSXUXJYKX-QGZVFWFLSA-N 399.491 2.891 0 50 GFAA Cn1c(CNC(=O)[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)nc2cccnc21 2325811636 IOHJZAUBRAKPLY-KRWDZBQOSA-N 377.492 2.885 0 50 GFAA COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)COc2cccc(C)c2)c1 4412478 ADXZKUGDSKJWGL-UHFFFAOYSA-N 397.475 2.551 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCO[C@@H](c2nccs2)C1)c1c(F)cccc1F 110883360 WCSAWRGXZAMTJR-LSDHHAIUSA-N 395.431 2.589 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2cccc(Br)c2)ccc1OC 10008770 TZTCQSYZFYGFJG-UHFFFAOYSA-N 399.266 2.618 0 50 GFAA O=S(=O)(CCc1ccc(C(F)(F)F)cc1)N1CCC[C@H](C2OCCO2)C1 225834761 WATDZPCWQCQCMM-AWEZNQCLSA-N 393.427 2.663 0 50 GFAA O[C@H]1CCN(c2ccnc(NCc3cccnc3N3CCCCCCC3)n2)C1 67966444 OHPVZELMFFTJBU-SFHVURJKSA-N 382.512 2.825 0 50 GFAA C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](CNS(C)(=O)=O)C1 229646414 WSFUKHIVBRCTJR-OLZOCXBDSA-N 380.432 2.907 0 50 GFAA O=C(O)c1ccccc1S(=O)(=O)N1CCC([C@@H](O)c2cccs2)CC1 1506423026 TVVZYKMTIAXSSW-MRXNPFEDSA-N 381.475 2.581 0 50 GFAA O=C(COc1ccccc1-n1cnnc1)NCCn1ccc2ccc(F)cc21 170625272 UOVMQEYZVNKTTK-UHFFFAOYSA-N 379.395 2.556 0 50 GFAA COCc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)cc1 252508873 XWJDUJWKRLXGBB-OAHLLOKOSA-N 380.491 2.686 0 50 GFAA Cc1ccc([C@@H]2COCCN2S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)o1 172036344 LCNOFOAPZRULHI-KRWDZBQOSA-N 390.461 2.625 0 50 GFAA COc1cc(C(=O)NC2(c3ccccc3)CCCC2)sc1S(N)(=O)=O 151483774 JUVWQLCXLUCWBS-UHFFFAOYSA-N 380.491 2.603 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)C3CCN(C(=O)[C@H]4CCCO4)CC3)cc2c1C 72152371 UYWDNESCXUVFRS-HXUWFJFHSA-N 383.492 2.819 0 50 GFAA C[C@@H](C(=O)N1CCCc2cc(Cl)cc(Br)c21)S(C)(=O)=O 332706170 WYPDWXAMKBPHBC-QMMMGPOBSA-N 380.691 2.815 0 50 GFAA CC(=O)N1CCc2c(nc(N(C)C)nc2NCCc2c[nH]c3ccccc23)C1 77387925 GHDANOUICBXKPG-UHFFFAOYSA-N 378.480 2.583 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 236828542 OHVSZIBBSYUBAX-NHCUHLMSSA-N 390.439 2.989 0 50 GFAA O=C(Nc1cccc(N2CCCNC2=O)c1)c1ccc(OCC(F)F)nc1 127908166 YTDHHDJIWHMKOW-UHFFFAOYSA-N 376.363 2.898 0 50 GFAA Cc1sc2nc(Cc3noc([C@@H]4OC[C@@H]5COCC[C@H]54)n3)nc(O)c2c1C 377774312 GVVWMEBNTZGNBA-FIXISWKDSA-N 388.449 2.712 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)[C@@H](O)c1cc(Cl)cc(Cl)c1 378315269 OXOKFRDJIBEACG-INIZCTEOSA-N 377.231 2.924 0 50 GFAA Cc1cccc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCN(C)CC3)c2)c1C 71774535 VZAWVHMLLAXCSW-UHFFFAOYSA-N 388.489 2.605 0 50 GFAA O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)CCc1nc(C2CCCC2)no1 130131066 ZFRBUHIXMWPXKK-ZDUSSCGKSA-N 389.481 2.746 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1cc(F)ccc1F)CCC2 173636949 NTWCVADUPPORKQ-UHFFFAOYSA-N 394.443 2.737 0 50 GFAA O=C(c1ccc2ccccc2n1)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 72165006 ZPCVPDGTYFHRAM-UHFFFAOYSA-N 383.411 2.579 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4ccc(NS(C)(=O)=O)c(Cl)c4)[C@@H]1[C@H]3C2 287339024 YSHQKCDJKQVYID-JXNBKPOHSA-N 399.900 2.599 0 50 GFAA NC(=O)c1ccc(-c2nc3c([nH]2)CCN(C(=O)c2ccc4cc[nH]c4c2)C3)cc1 223216420 HLFGGCNUIYZMFF-UHFFFAOYSA-N 385.427 2.855 0 50 GFAA Nc1nc(Cl)cc(NCc2cccc(N3C(=O)NC4(CCCC4)C3=O)c2)n1 290747827 SETZJHRCFWMBDD-UHFFFAOYSA-N 386.843 2.693 0 50 GFAA O=C(CCN1CCCS1(=O)=O)N1CCCC[C@@H]1CCCc1ccccc1 179064864 SCLSMLQKCZFIKL-LJQANCHMSA-N 378.538 2.816 0 50 GFAA NCCCOc1cc(Cl)ccc1C(=O)N1CCC(Cn2ccnc2)CC1 426422731 CVKURRJMSSAPQE-UHFFFAOYSA-N 376.888 2.817 0 50 GFAA O=C(Cc1cccc(F)c1F)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccn1)C2=O 91830547 LIAFUEAFDCUZIG-DOTOQJQBSA-N 385.414 2.552 0 50 GFAA Cc1oncc1S(=O)(=O)N(C)C[C@@H]1CCCN(CCc2ccccc2F)C1 95515180 VHFJIFKEOUWOKM-INIZCTEOSA-N 395.500 2.697 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3cncnc3C)C2)c1 95517961 YTIVYGCXSSVAMA-QGZVFWFLSA-N 396.491 2.742 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)NCC1(CN2CCN(C)CC2)CC1 91289064 JQDQFKXXXJBJPN-UHFFFAOYSA-N 382.552 2.779 0 50 GFAA Cc1cc(=O)oc2c(C)c(OCC(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)ccc12 252694321 IYECSNOPLWSURQ-SHTZXODSSA-N 387.432 2.796 0 50 GFAA biogenic O[C@H](COc1ccccc1F)CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 298685359 AWLHCNUZEWBXSA-SJORKVTESA-N 388.487 2.763 0 50 GFAA CN(Cc1ccc(C(=O)O)cc1)C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 299750067 MOQLHKWNQSQHGD-UHFFFAOYSA-N 387.823 2.840 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@H](NCc2cc(F)ccc2F)CNC3=O)c1 263618997 WKXOPXKXRSJDEO-IBGZPJMESA-N 384.386 2.869 0 50 GFAA CSc1ncc(C(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)cn1 1940193581 DSPFDKWOKRFPSJ-KDOFPFPSSA-N 380.473 2.734 0 50 GFAA O=C1NCCN(C(=O)NCCCOC2CCCCC2)[C@H]1c1ccc(F)cc1 584892072 YAWXVZCBDKEVIA-SFHVURJKSA-N 377.460 2.748 0 50 GFAA O=C(c1ccnnc1)N1CCOC2(CCN(c3nccc4ccccc34)CC2)C1 885938900 HEVQVHWNTYVGBX-UHFFFAOYSA-N 389.459 2.536 0 50 GFAA Cc1ccc(C(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)n1C(F)F 952968331 BWYGJMOGTZUBDN-UHFFFAOYSA-N 393.390 2.682 0 50 GFAA Cc1cc(C)n2ncc(CN3CCN4[C@H](COC[C@H]4c4ccccc4)C3)c2n1 1615955615 SRIBJHPXIYFZEL-SFTDATJTSA-N 377.492 2.604 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)CN3CCCCC3)CC1)OCC2 1704327338 BSSAAKNGNLUGMK-UHFFFAOYSA-N 388.508 2.580 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3ncccc3C(=O)O)CC1)OCC2 1704332529 ZRPKSVAPRNXDHW-UHFFFAOYSA-N 384.432 2.865 0 50 GFAA COC(=O)CNC(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 11818669 MWDLAMKAEZGBGM-UHFFFAOYSA-N 396.487 2.675 0 50 GFAA O=S(=O)(NC[C@H]1CCCN(Cc2ccccn2)C1)c1cccc2cccnc12 12304190 ZHPWSPWRDGJAJW-QGZVFWFLSA-N 396.516 2.820 0 50 GFAA O=C(c1cn(Cc2ccc(F)cc2)nn1)N(Cc1ccncc1)C[C@H]1CCCO1 12436261 PZJCAUXZVJHJJB-LJQANCHMSA-N 395.438 2.682 0 50 GFAA CC(C)[C@H](NC(=O)c1csc2nc(-c3cccc(Cl)c3)cn12)C(N)=O 12445718 PTSQFPFGNOGDPC-AWEZNQCLSA-N 376.869 2.956 0 50 GFAA Cn1cc(CNCCN2CCNC2=O)c(-c2ccc(Oc3ccccc3)cc2)n1 12587555 CCMVAKYYYOQBJL-UHFFFAOYSA-N 391.475 2.994 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)CSC)C2)c(OC)c1 14954899 ODKQBWYIQVKREE-HNNXBMFYSA-N 394.537 2.702 0 50 GFAA Cc1cc2nc(N3CCC(C(=O)NCC(C)(C)CO)CC3)nc(C)c2cc1C 14993522 INRKMGJGIMZEDN-UHFFFAOYSA-N 384.524 2.906 0 50 GFAA O=C(Nc1ccnn1C1CCN(C2Cc3ccccc3C2)CC1)[C@H]1CCOC1 19835529 YSUVLDDBKUYFNP-SFHVURJKSA-N 380.492 2.662 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@@H]1O)c1cncc(-c2ccoc2)c1 1857531178 HKSCPVDSBFJAFM-UUWFMWQGSA-N 386.839 2.761 0 50 GFAA Cc1cccc(CN2CCC3(CC2)CN(Cc2ncc[nH]2)C[C@H]3C(=O)O)c1F 1857688189 WTNNTVBBNJVIDQ-KRWDZBQOSA-N 386.471 2.656 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)NC2CCC2)CC[C@H]1NC(=O)CCCCc1cccnc1 1875244144 AHMDTORFQXOHNG-DFQSSKMNSA-N 387.524 2.763 0 50 GFAA CN(C)S(=O)(=O)N1C[C@H]2CC[C@@H](C1)N(Cc1ccc(Cl)cc1Cl)C2 247938986 HVXARLMSFRYIGQ-WFASDCNBSA-N 392.352 2.696 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(C(=O)CCc1nc3c(C)c(C)ccc3[nH]1)C2 248340949 VNKBNQPBUUMZRT-ROUUACIJSA-N 384.524 2.682 0 50 GFAA CCOC(=O)CN1C(=O)C(F)(F)c2cc(NCc3c(C)noc3C)ccc21 815143580 LJPCDRWLZHAXBM-UHFFFAOYSA-N 379.363 2.905 0 50 GFAA CCOCCCC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)[C@@H]2COC[C@@H]21 839895711 LVZVPVGKRIGYFC-SJORKVTESA-N 396.528 2.678 0 50 GFAA O=C(Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1cc(Cl)ncc1F 1265321152 YCPYBCQIOVEIJN-UHFFFAOYSA-N 387.795 2.706 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N[C@@H]2Cc3n[nH]cc3[C@H](C(F)(F)F)C2)c1 1875367539 MMDUWGSGEUMHOA-GXTWGEPZSA-N 378.354 2.925 0 50 GFAA CC(C)n1cc(C2=CCCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)nn1 1875395107 LKPDTITXTDKTCT-UONOGXRCSA-N 384.484 2.924 0 50 GFAA C[C@H]1CN(C(=O)c2cc3cnccc3[nH]2)C[C@@H]1NC(=O)c1coc(C2CCC2)n1 1875333855 NYRAXUBPEKIVTI-SJCJKPOMSA-N 393.447 2.709 0 50 GFAA N=c1[nH]c2cccc(C(=O)N3CCc4nc[nH]c4[C@H]3c3ccncc3)c2s1 2100473542 QRIWVWMTRZXCFZ-MRXNPFEDSA-N 376.445 2.615 0 50 GFAA O=C(NCc1noc(COc2ccc(Cl)cc2)n1)c1cccc2c1CCNC2 2325775093 ZUSRFGWPUCGRHV-UHFFFAOYSA-N 398.850 2.878 0 50 GFAA O=C(O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@H]2CCCn3cnnc32)CC1 2325778012 XEJOTMHESXCMBJ-ZWKOTPCHSA-N 382.464 2.653 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N[C@@H](C(=O)O)[C@@H](O)c3ccncc3)ccc2c1 2325876192 MNGFXDHLPRCGOR-SVIJTADQSA-N 394.427 2.650 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccccc1F 815550 NIRSXDJGQRURCT-AWEZNQCLSA-N 378.425 2.535 0 50 GFAA O=C(Nc1nc2ccc(S(=O)(=O)N3CCCC3)cc2s1)c1ccco1 937601 IQRPDNUDVFDGQE-UHFFFAOYSA-N 377.447 2.926 0 50 GFAA Cc1ccccc1NC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cccc(Cl)c1 2200530 MZVIMDOZWBTGOT-QGZVFWFLSA-N 385.851 2.618 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)C[C@H]1C(=O)NCCN1C(=O)c1ccccc1 2434531 SSGYLVIVHULTSV-KRWDZBQOSA-N 385.851 2.618 0 50 GFAA O=C(c1cnc2cccnn12)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356141434 AOORRAFMMVGRRL-JOCHJYFZSA-N 389.459 2.527 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N1CCc2nc(C3CCOCC3)nn2CC1 2356148281 OTSFTHXPBIGSIY-UHFFFAOYSA-N 393.491 2.671 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3CC(=O)Nc3cnn(C)c3C)C2=O)cc1 2356164944 MZFAEEUIGNMSML-QFIPXVFZSA-N 395.507 2.637 0 50 GFAA COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1Br 7709752 GLHQZKYCCJIGQS-UHFFFAOYSA-N 391.331 2.612 0 50 GFAA CSc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CCCC3)CC2)cc1 8493445 TWLDAFJJAXSASV-UHFFFAOYSA-N 382.551 2.868 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccccc2F)CC1 9341472 UJNAZCBUFKCJOU-UHFFFAOYSA-N 384.407 2.723 0 50 GFAA Cc1nc(COc2ccccc2C(=O)Nc2cccc(-c3nnc[nH]3)c2)no1 114395881 WIBIUKFYYSUVLO-UHFFFAOYSA-N 376.376 2.994 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CN3CCc4ccccc4C3)C2=O)c1 20536990 CENPXVJKQBLMNM-HSZRJFAPSA-N 380.488 2.607 0 50 GFAA Nc1cc2c(cc1C(=O)c1ccccc1I)OCCO2 4342592 WAEDKJZDLYIPSR-UHFFFAOYSA-N 381.169 2.876 0 50 GFAA O=c1oc2ccccc2n1CCN1CCC[C@H]1c1nc(-c2ccncc2)no1 67847734 PKXVOLCVDLAUQV-INIZCTEOSA-N 377.404 2.877 0 50 GFAA O=c1c2c3c(sc2ncn1Cc1cccc(CN2CCCC2)c1)CNCC3 65464706 AWOZOVVVIDAPTD-UHFFFAOYSA-N 380.517 2.748 0 50 GFAA Cc1csc(CCNC[C@@]2(O)CCCN(CCC3CCCCC3)C2=O)n1 67834091 MHILBODTXDENOX-FQEVSTJZSA-N 379.570 2.908 0 50 GFAA Cc1cc(N2CCC([C@@H](C)N3CCN(C)CC3)CC2)nc(-c2cccnc2)n1 65376621 FGVLIPWTCPQERU-GOSISDBHSA-N 380.540 2.699 0 50 GFAA COc1ccccc1-c1noc(CNC(=O)CC2(n3cccc3)CCOCC2)n1 409414742 WAEDGJOYEOTIAZ-UHFFFAOYSA-N 396.447 2.759 0 50 GFAA O=c1c(CN2CC[C@@H](c3ccc4c(c3)OCO4)[C@H](O)C2)coc2ccccc12 65526491 QYESKVVNMNEWJF-FUHWJXTLSA-N 379.412 2.872 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)ncn1 67623109 SSBXCOHQMMMUCC-UHFFFAOYSA-N 396.882 2.515 0 50 GFAA CC(=O)N(CC(=O)O)[C@@H]1CCCN(C(=O)C[C@@H](C)c2ccccc2F)CC1 328626103 DVCOZJRHDJKEIB-GDBMZVCRSA-N 378.444 2.634 0 50 GFAA Cc1cccc(C[C@H](C)NC(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)n1 12320099 QEBXZDWERAOIDM-AWEZNQCLSA-N 394.431 2.849 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)Nc1nocc1C)CC2 328655831 YUCBZBHGKWOAON-INIZCTEOSA-N 388.493 3.480 0 50 GFAA COC(=O)CC(C)(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 253418582 UKMVHONIOUSOTR-LSDHHAIUSA-N 382.501 2.824 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2)C1 332298063 HFQNVVZSOPUTOL-LBPRGKRZSA-N 382.873 2.590 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C[C@@H]1CCCCO1 154496459 OAUJLBKSHWROTF-INIZCTEOSA-N 380.510 2.565 0 50 GFAA O=C(NC1CCN(c2ccccn2)CC1)N[C@@H]1CCN(c2ccccc2F)C1 487815002 DATZVUCOEGNUGU-QGZVFWFLSA-N 383.471 2.768 0 50 GFAA CN(C)CCN1C[C@]2(CCCN(c3noc(-c4ccccc4)n3)C2)CCC1=O 72411189 VIGLPGWLZJFHBG-NRFANRHFSA-N 383.496 2.507 0 50 GFAA COc1ccc2cc(CN3CCO[C@@H](C(N)=O)C3)c(-c3cccs3)nc2c1 72480957 UVBDRNULUOHAHG-QGZVFWFLSA-N 383.473 2.658 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1cc(N2CCCC2=O)ccc1F)c1cccs1 238170295 MSRKRWXONAVFTD-CQSZACIVSA-N 376.409 2.960 0 50 GFAA O=C(c1cnc2c(Cl)cccc2c1O)N1CCN(CCc2ccccn2)CC1 218183667 RELAQIXOBBVFJP-UHFFFAOYSA-N 396.878 2.989 0 50 GFAA O=C(CN1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1)N1CCc2ccccc2C1 378413257 UQHYBVDUNGWBIF-NRFANRHFSA-N 395.547 2.686 0 50 GFAA C[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cccc(-n2cccn2)c1 174086492 GLRHWXAWKIIPIE-INIZCTEOSA-N 376.464 2.756 0 50 GFAA CC(C)Oc1ccc(C2(C(=O)NC3CCS(=O)(=O)CC3)CCCC2)cc1 426465342 XFZBEEZEOBNWMA-UHFFFAOYSA-N 379.522 2.979 0 50 GFAA CN(Cc1nc(O)c2ccccc2n1)C(=O)N[C@H](Cn1ccnc1)C(C)(C)C 426527093 WRZNCSPFRJVOQY-MRXNPFEDSA-N 382.468 2.788 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@H]1CCOC2(CCCC2)C1 178162092 IKANFQUQEINRRB-KRWDZBQOSA-N 396.491 2.681 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)N3CCN(CCc4ccncc4)CC3)oc2c1C 95099719 XSHPIXOCPHXLLO-UHFFFAOYSA-N 391.471 2.805 0 50 GFAA CC[C@@H](NS(=O)(=O)c1cccc(C(=O)N(C)CC)c1)c1ccc(O)cc1 95366924 SAWGENMEKNQATM-GOSISDBHSA-N 376.478 2.914 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)[C@@H](F)c1ccccc1)CC2 91643867 KRTKMRRJTSBLLD-IBGZPJMESA-N 376.472 2.965 0 50 GFAA Cc1n[nH]c(C)c1[C@H](C)NC(=O)N1CCCN(C2Cc3ccccc3C2)CC1 426535998 ZFNWHGHHGNGMBU-HNNXBMFYSA-N 381.524 2.972 0 50 GFAA O=C(NC[C@@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2cccs2)cc1 95520953 GQORNXNCXIFBLC-ZDUSSCGKSA-N 380.491 2.883 0 50 GFAA O=C(NCCN1CC[C@H](c2ccccc2)C1)c1cc(=O)[nH]c2cc(F)ccc12 97514361 GPVSKTPNZYCWED-INIZCTEOSA-N 379.435 2.887 0 50 GFAA Cc1nc2cc(CC(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)ccc2[nH]1 92061725 NGEMSRXVUPYYHQ-UHFFFAOYSA-N 389.459 2.839 0 50 GFAA COC(=O)c1cncc(N2CCC3(CC2)C[C@H](c2ccccc2)CN(C)C3)n1 96138301 OCSJUWYEYRKOTC-SFHVURJKSA-N 380.492 2.969 0 50 GFAA Cn1cc(N2CC[C@H](NC(=O)c3ccc(C(F)(F)F)cc3Cl)C2=O)cn1 181874275 ZEQUUNYPBCMUCB-ZDUSSCGKSA-N 386.761 2.628 0 50 GFAA Cn1cc(CNC(=O)N2CCC(OC[C@H]3CCCO3)CC2)c(-c2ccccc2)n1 182732876 OHQITJZVIYOTJO-HXUWFJFHSA-N 398.507 2.957 0 50 GFAA CSCC[C@@H](CO)NC(=O)C1CN(C(c2ccccc2)c2ccccc2)C1 253408413 KRNJUCPKTZRUBL-FQEVSTJZSA-N 384.545 2.938 0 50 GFAA Cc1ccc([C@H](C(=O)N2CCN(c3cccc(C(=O)O)c3)CC2)N(C)C)cc1 95522929 KYNNGGMWUQCFTA-HXUWFJFHSA-N 381.476 2.645 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2ccccc2OC[C@@H]2CCCO2)CC1 827758242 ZTGCBZWELRGHPE-INIZCTEOSA-N 375.469 2.577 0 50 GFAA Cc1cc(C)cc(-n2ccnc2S(=O)(=O)Cc2nnc3n2CCCCC3)c1 278734999 LNFJECGHLRLLTE-UHFFFAOYSA-N 385.493 2.781 0 50 GFAA Cc1nc2n(n1)C[C@@H](NC(=O)Nc1cccc(NC(=O)c3ccccc3)c1)CC2 170751829 CVYJQQJNYMQUFC-SFHVURJKSA-N 390.447 2.975 0 50 GFAA COc1ccc(CS(=O)(=O)c2nnc(C3CC3)n2Cc2ccccc2)cn1 408519092 YWJFTOBLUPGAAU-UHFFFAOYSA-N 384.461 2.581 0 50 GFAA CCc1nc(CN2CCC[C@@H](CNC(=O)c3ccc(Cl)cc3F)C2)n[nH]1 1506405052 BQVCJSAOKDDYEB-LBPRGKRZSA-N 379.867 2.802 0 50 GFAA CSC[C@@H](C)N1CCC(N2CCC(C(=O)NCc3cccnc3)CC2)CC1 12308015 FXAOAPNMFYEQHZ-QGZVFWFLSA-N 390.597 2.626 0 50 GFAA O=C(NC1CC1)C1CCN(C2CCN(C(=O)c3ccc(Cl)cc3)CC2)CC1 12438819 HZQALBNMSAHGNV-UHFFFAOYSA-N 389.927 2.935 0 50 GFAA Cc1nn(C)cc1CN1CCC2(CC1)C(=O)N(C(C)C)C(=O)N2CCC(C)C 14753891 FQHKJNHJRTVFGS-UHFFFAOYSA-N 389.544 2.782 0 50 GFAA COc1ccc(CN2CCC(N3C[C@H](C)O[C@@H](C)C3)CC2)c(OC)c1OC 19888860 XSGXJXLAXIQGNN-HOTGVXAUSA-N 378.513 2.786 0 50 GFAA Cc1ncc2c(c1-c1noc(C(C)(C)NC(=O)c3cccs3)n1)CCNC2 19940009 KTOAOGTXAFFYQG-UHFFFAOYSA-N 383.477 2.812 0 50 GFAA O=C(C1CCC1)N1CCC[C@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169777629 PIEFRUHBNWONJG-INIZCTEOSA-N 378.436 2.959 0 50 GFAA CC[C@H](NC(=O)c1ccc(OC)c(Oc2ccc(CN)cc2F)c1)C(=O)OC 1857691847 YXAKSUXGPCNQBE-HNNXBMFYSA-N 390.411 2.767 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4nccn4C)C3)nc2c1 1857728999 JBTWRQSMCRQSDT-OAHLLOKOSA-N 397.479 2.535 0 50 GFAA COc1cccc(CCC(=O)N2CCC[C@@](O)(CN3CCC(F)(F)CC3)C2)c1 1857733409 JLEDRIIEXLZPHF-HXUWFJFHSA-N 396.478 2.712 0 50 GFAA COC(=O)c1sc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)c(C)c1Cl 788439059 PPBKNBDCOHRDAJ-UHFFFAOYSA-N 389.838 2.996 0 50 GFAA O=C(O)[C@@H](CNC(=O)[C@@H]1CCc2nc[nH]c2C1)Cc1cccc2ccccc12 909269395 ZSUKNEMCKNFVCW-IAGOWNOFSA-N 377.444 2.728 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2nc(C(=O)O)cs2)c2ccc(F)cc2N1 828317495 DWXXGZALOLHLIA-BXUZGUMPSA-N 389.408 2.770 0 50 GFAA Cn1c(-c2c[nH]c3ccccc23)nnc1N1CCC2(CC1)OC(=O)NC21CCC1 1875278636 QNYIMDVTQVNXGF-UHFFFAOYSA-N 392.463 2.965 0 50 GFAA Cc1c(C(=O)N2CCc3ccc(C(N)=O)cc3C2)[nH]c2c1C(=O)CC(C)(C)C2 1875274552 IJUBKVVAGWNYSU-UHFFFAOYSA-N 379.460 2.776 0 50 GFAA CCc1nc(-c2ccc3cccnc3c2)n(-c2ccc(S(N)(=O)=O)cc2)n1 1875324888 MXCVUPJIMUEQOY-UHFFFAOYSA-N 379.445 2.692 0 50 GFAA CC(C)C(C)(C)C(=O)N1CC2(CN(C(=O)c3cnc(C4CC4)s3)CCO2)C1 1775996954 OIWVOEGEGXKOGY-UHFFFAOYSA-N 391.537 2.756 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC2CCCC2)cc(OC)c1O 1152024 ILOSCKXGGPJYLS-MRXNPFEDSA-N 376.409 2.523 0 50 GFAA Cc1ccccc1-n1c(-c2ccccc2)cn2c3c(=O)n(C)c(=O)n(C)c3nc12 12342287 CNLJGMRBDRFRIX-UHFFFAOYSA-N 385.427 2.651 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCCC2)CC[C@H]1NC(=O)Cc1ccc(O)cc1 2100534877 YEXWZMWKNPTPRB-DFQSSKMNSA-N 388.508 2.637 0 50 GFAA CC(=O)Nc1cccc2c1ccn2CC(=O)N1CCC(N=c2cc[nH]cc2)CC1 2325790537 SHLJOVJHXYVKIT-UHFFFAOYSA-N 391.475 2.520 0 50 GFAA O=C(COc1ccc(Br)cc1)N[C@@H](Cc1ccccc1)C(=O)O 754458 YTQLPFOFYAZLCD-HNNXBMFYSA-N 378.222 2.640 0 50 GFAA O=C1NCCC[C@]12CCCN2CCCN1CCN(c2cccc(Cl)c2)CC1 2356134173 BWPBMPGTIMZNEH-NRFANRHFSA-N 390.959 2.597 0 50 GFAA COc1ccc(Cl)cc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C)cc1 2846265 SPNAWFPFBWDZEG-GFCCVEGCSA-N 382.869 2.963 0 50 GFAA COCCN1C(=O)N(c2ccc(C)cc2)C(=O)[C@@H]1CC(=O)Nc1ccccc1 2887395 KOCKOLMXAOHLFH-SFHVURJKSA-N 381.432 2.807 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N[C@H]1COc2ccccc2C1 2356163153 QPHHBQLLJMZZML-GOSISDBHSA-N 390.439 2.698 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356163477 FLMZOAVGQNWYPQ-JOCHJYFZSA-N 386.492 2.556 0 50 GFAA C[C@@H](c1ccccc1)N1C(=O)c2ccc(C(=O)NC[C@H]3CCCO3)cc2C1=O 4842587 ANZANGGBAZBILH-WMLDXEAASA-N 378.428 2.953 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)NCc1c(F)ccc(F)c1F 55358138 GFNFMDSBXNSWQJ-UHFFFAOYSA-N 375.350 2.910 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc2ccccc2n1 1151451 PCVLROIGRUDIRO-UHFFFAOYSA-N 397.456 2.508 0 50 GFAA COc1cc(CN2CCc3nnc(-c4ccccc4)n3CC2)cc(OC)c1O 20452862 LWHQHACCCCKSHA-UHFFFAOYSA-N 380.448 2.726 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc4ccccc4[nH]3)C[C@H]2CCO)CC1 104635365 ZAJXISKBHLXDGR-JOCHJYFZSA-N 384.568 2.909 0 50 GFAA CSCCNCc1c(C(=O)N2C[C@H](C)O[C@H](C)C2)nc2ccc(Cl)cn12 23505495 HFXNWVAZVBTVBF-BETUJISGSA-N 396.944 2.690 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CCC(CO)CC3)nc2)C1 67966248 OMBLZJXUQSAVGJ-LJQANCHMSA-N 387.524 2.758 0 50 GFAA CN(Cc1cccnc1)Cc1nc(C2CC2)nn1-c1ccc2c(c1)OCCO2 65526086 ZYIKZJXPJXPWBV-UHFFFAOYSA-N 377.448 2.943 0 50 GFAA CC(C)(C)C(=O)Nc1ccnn1C1CCN(c2nnnn2-c2ccccc2)CC1 67834308 QJBVAAXRARETRJ-UHFFFAOYSA-N 394.483 2.685 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)c2ccc4c(c2)CCO4)C3)no1 20541743 JKDLRQZTLYWLSN-UHFFFAOYSA-N 376.416 2.882 0 50 GFAA O=C(NC1CC1)C1CCN(C2CCN(Cc3ccc4nsnc4c3)CC2)CC1 11772119 XUOIARQPRWMOLF-UHFFFAOYSA-N 399.564 2.646 0 50 GFAA Cc1ccc2nc(C)cc(C(=O)N3CCC[C@@H](Cn4cc(C(=O)O)nn4)C3)c2c1 67805588 WUSMBLFWMQYPER-OAHLLOKOSA-N 393.447 2.694 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N3CCC[C@H]3C(=O)Nc3nccs3)c2c1 121225931 HYZUFGFQMUOIJF-INIZCTEOSA-N 384.461 2.805 0 50 GFAA Cc1ccc(O[C@@H](C)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1 6701740 TZAHBPOUNPTUMM-KRWDZBQOSA-N 381.476 2.789 0 50 GFAA NC(=O)c1c(NC(=O)CSc2nnc(-c3ccco3)o2)sc2c1CCC2 6926677 HHQHQZGKVAKXEP-UHFFFAOYSA-N 390.446 2.710 0 50 GFAA Cc1cccc(OC2CCN(C(=O)Cn3cnc4ccccc4c3=O)CC2)c1 77458041 RSZDRSVYNVAFAE-UHFFFAOYSA-N 377.444 2.775 0 50 GFAA CN(Cc1cc(=O)n2ccccc2n1)C[C@H]1CCc2nc(C(F)(F)F)cn2C1 328633412 LYPVKMNEWDCDGT-CYBMUJFWSA-N 391.397 2.604 0 50 GFAA Cc1nc(C)n(C[C@@H]2CN(c3ncc(C)c(-c4ccccc4F)n3)CCO2)n1 328723865 YGRFDUFPHFRIHX-INIZCTEOSA-N 382.443 2.705 0 50 GFAA C[C@H](C[S@](C)=O)NC(=O)NCC1(c2ccc(Br)s2)CCC1 376442458 QAZRMVXSAWLPCG-UZJPJQLHSA-N 393.372 2.999 0 50 GFAA O=C(c1cnc(-c2cccnc2)nc1)N1CCO[C@@H](Cc2cccc(F)c2)C1 71419512 QXAOIFDSSVIDIQ-IBGZPJMESA-N 378.407 2.761 0 50 GFAA C[C@@H]1CCc2n[nH]c(C(=O)Nc3nn(C)c4cccc(N5CCOC5=O)c34)c2C1 72476154 RXHFXVCPRNRNSF-LLVKDONJSA-N 394.435 2.630 0 50 GFAA Cc1c(NC(=O)N[C@H]2c3ccccc3O[C@@H]2C)cccc1S(=O)(=O)N(C)C 455968902 QPWZSCMWUOSVQA-FZKQIMNGSA-N 389.477 2.889 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)C1 290747342 OOWNFWWVLNYCHL-PMACEKPBSA-N 386.540 2.599 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@@H](Cc1ccccc1)n1cnnn1 220322482 INECYNYEVKIXPC-LJQANCHMSA-N 378.411 2.736 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCC[C@@H](c4cc(O)ncn4)C3)c2)nn1 426485563 IQCLVGZKSKLDDY-QGZVFWFLSA-N 375.432 2.967 0 50 GFAA COCCN1CCC[C@H](CN(C)C(=O)c2ccc(-c3cc(N)ccn3)cc2)C1 426398027 IKQRHYXZBPAPES-QGZVFWFLSA-N 382.508 2.761 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95527594 WYERVOBPPBDHEG-QGZVFWFLSA-N 377.448 2.750 0 50 GFAA CN1CC[C@H](NC(=O)NCC(=O)Nc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 179415036 KXOWILMVFMIXSZ-HKUYNNGSSA-N 388.418 2.648 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccccc3)C2)c2c(C)nn(C)c2n1 91504956 JBNPCNQOCKBKBH-DLBZAZTESA-N 378.432 2.526 0 50 GFAA O=C(NCCC[C@@H]1CCOC1)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91585956 LTFXGTFBQFVWNC-XSXQVXRUSA-N 385.508 2.784 0 50 GFAA O=C(NCC1CCOCC1)N(Cc1cccnc1)Cc1ccc2c(c1)OCO2 426517976 SSWKFHSVLGPLTE-UHFFFAOYSA-N 383.448 2.949 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCN(c3ccc(Cl)cn3)CC2)c(C)c1 95368646 RRUKCMMJFXFZLM-SFHVURJKSA-N 375.856 3.000 0 50 GFAA CCc1nn(C)c(NC(=O)NCCn2nc(C)nc2C)c1-c1ccc(F)cc1 95528671 QCYIABWXEHEHSL-UHFFFAOYSA-N 385.447 2.819 0 50 GFAA Cc1nn(C)c(C)c1CN1CCC[C@]2(CCC(=O)N(Cc3cccnc3)C2)C1 91656114 KMYCZHIYPKEGJI-QFIPXVFZSA-N 381.524 2.837 0 50 GFAA Cc1nc(CNC(=O)Nc2ccccc2N2CCOC2=O)nc2c1CCCC2 95501934 OMFYUWCTGIDPML-UHFFFAOYSA-N 381.436 2.942 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)Nc1ccc(F)cc1F)CCN2C 91860835 QMVRZBIBJQCPSA-IBGZPJMESA-N 380.439 2.515 0 50 GFAA CN(Cc1nnc[nH]1)C(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1 298543176 YTWRFMVHXKQHSX-LBPRGKRZSA-N 383.283 2.922 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@@H]([C@@H](C)N)C1)c1ccc(Br)cc1 299739273 MRTYWIVCKURNLK-SRCQZFHVSA-N 396.329 2.602 0 50 GFAA COc1ccc(/C=C/CN2CCn3nc(CNc4ncccn4)cc3C2)cc1 299791325 DAPVFFYTJOCPAL-DUXPYHPUSA-N 376.464 2.823 0 50 GFAA Cc1c(C(=O)N(C)Cc2nccs2)cnn1-c1nccc(-c2ccco2)n1 299776123 NJBLXRAYIBWZFQ-UHFFFAOYSA-N 380.433 2.959 0 50 GFAA O=C(NCCc1nc(-c2ccccn2)no1)c1cc2ccccc2c(=O)s1 828147378 ZHBCIEIMJLIQDP-UHFFFAOYSA-N 378.413 2.679 0 50 GFAA CCNC(=O)c1cc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)ccc1Cl 952989869 SUDOZSJTORCXBC-GFCCVEGCSA-N 377.872 2.819 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCCc1nc(O)c2ccccc2n1 268953179 USAGAUPNLUZWAI-XKQJLSEDSA-N 383.448 2.902 0 50 GFAA CCN1C(=O)CCc2cc(NC(=O)Cn3nnc(-c4ccc(C)cc4)n3)ccc21 185601354 IUWSQYZDVNDYAI-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA CNc1nnc(CC(=O)Nc2cccc(CN3CCSCC3)c2C)s1 170595072 SDKIRIHBIAENHE-UHFFFAOYSA-N 377.539 2.618 0 50 GFAA O=C(Cn1nnc(-c2ccc(Br)o2)n1)N1CCC[C@@H]2CCCC[C@@H]21 408158836 OOGAGYJAJGFXCB-RYUDHWBXSA-N 394.273 2.877 0 50 GFAA O=S(=O)(NC1CCC(N2CCCCC2)CC1)c1cccc2nsnc12 751124214 NFPQFJOBLHXQSX-UHFFFAOYSA-N 380.539 2.767 0 50 GFAA COc1ccc(-c2nnc(NC(=O)Cn3c(C)nc4ccccc43)[nH]2)c(OC)c1 195028435 UHVUPHFESPVERC-UHFFFAOYSA-N 392.419 2.786 0 50 GFAA O=C(Cc1ccc(Br)cc1)NS(=O)(=O)c1ccc(Cl)cn1 732613086 YRAMSRVCXGFOCI-UHFFFAOYSA-N 389.658 2.545 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1615953795 XXEKINNUQQEUTJ-AVRDEDQJSA-N 392.503 2.892 0 50 GFAA Cc1cccc(-n2cc(CNc3ccc(C(=O)N4CCOCC4)cn3)cn2)c1 1529153820 VPBBLEPQYRJSPF-UHFFFAOYSA-N 377.448 2.660 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCOC(C)(C)C2)ccc1F 1704312984 DBBPZIRPOWJRFZ-UHFFFAOYSA-N 377.416 2.806 0 50 GFAA O=C(NCc1nc(C2CC2)no1)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 1772810001 BWSZLKLQMNLXMF-CYBMUJFWSA-N 381.461 2.887 0 50 GFAA Cc1cccc(CC(=O)N2C[C@@H]3CN(CCO)C[C@]3(CCc3ccccc3)C2)c1 1772710522 SETGIZVRVOMYII-UKILVPOCSA-N 392.543 2.923 0 50 GFAA CCCC(=O)N1C[C@@H]2CN(Cc3ccccc3-n3nc(C)cc3C)C[C@@]2(CO)C1 1772709373 OZSYGOLMNNFZNH-REWPJTCUSA-N 396.535 2.542 0 50 GFAA O=C(CC[C@@]1(Cc2ccco2)CCC(=O)N1)NCc1nc(-c2ccccc2)no1 12193469 ABXWTHKRNSGOSU-NRFANRHFSA-N 394.431 2.618 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)CC[C@]2(Cc3ccsc3)CCC(=O)N2)C1 12244081 AQIXFVNJTIAVKO-UZLBHIALSA-N 392.521 2.521 0 50 GFAA Cc1c[nH]c(CN(C)C(=O)c2cn(Cc3ccccc3C(F)(F)F)nn2)n1 12301492 MQBOKSBRNBYSEW-UHFFFAOYSA-N 378.358 2.649 0 50 GFAA COc1cccc(C[C@]2(CCC(=O)N[C@H](C)Cc3cccnc3)CCC(=O)N2)c1 14885867 HPAUDVKXUTZQFE-HXOBKFHXSA-N 395.503 2.809 0 50 GFAA Cc1oc(-c2ccsc2)nc1CN1CCC(C(=O)N2CCOCC2)CC1 14963954 AWXKPQORWOCXPT-UHFFFAOYSA-N 375.494 2.782 0 50 GFAA O=C(CC1CC1)NC[C@H]1[C@H]2CN(Cc3c(F)cccc3F)C[C@]23CC[C@H]1O3 1857710093 HFKULLWGKOFPBK-IHLUGKFPSA-N 376.447 2.861 0 50 GFAA Cc1ccc2oc(CN3CC[C@@H](O)[C@H](NC(=O)c4ccncc4)C3)c(C)c2c1 1857712425 YWJVSCPMGMBBOJ-RTBURBONSA-N 379.460 2.810 0 50 GFAA COc1cccc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1OC 1857716637 OAKVAQMXMOOMSD-VIZSFHNOSA-N 394.471 2.978 0 50 GFAA Cc1ccccc1N1CCC(N[C@@H]2CN3CCCC[C@@]3(C(=O)NC3CC3)C2)CC1 1875250587 OLXROHUUXNTGHT-URXFXBBRSA-N 396.579 2.829 0 50 GFAA COC(=O)[C@H](Cc1cncn1COCc1ccccc1)NC(=O)OC(C)(C)C 4899528 OZTSHWHLUGXROY-KRWDZBQOSA-N 389.452 2.666 0 50 GFAA in-vitro O=S(=O)(c1ccc(OC[C@H]2CCOC2)c(F)c1)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 328868113 XGCZOEWCDMTCPX-FTAMUGHTSA-N 395.496 2.908 0 50 GFAA C[C@H](N)[C@H]1CCCCN1C(=O)[C@@H]1CCN(c2ccccc2Br)C1=O 237548231 JPWMAGHQRAHVDJ-KCQAQPDRSA-N 394.313 2.530 0 50 GFAA O=C(Cc1cncn1Cc1ccccc1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 253433464 XKDZVAFMGQKPNS-ONTIZHBOSA-N 378.520 2.807 0 50 GFAA O=C(N=c1ccn(-c2ncccc2Cl)[nH]1)N[C@@H]1CCO[C@@H](c2ccncc2)C1 1875265760 ZHPYKQKISAHQAC-GDBMZVCRSA-N 398.854 2.779 0 50 GFAA Oc1n[nH]c([C@@H]2[C@@H](C3CC3)CCN2c2nc(C3CC3)ncc2Br)n1 1875399703 HRAPZHYUAIWKLC-PWSUYJOCSA-N 391.273 2.918 0 50 GFAA CC(C)(C)O[C@H]1C[C@@H](NC(=O)N=c2nc(C3(C)CC3)[nH]s2)C12CCOCC2 1875396511 KINZGWKQOGMYEC-OLZOCXBDSA-N 394.541 2.886 0 50 GFAA CN(C)C(=O)N1C[C@H]2CC[C@@H](C1)N(C(=O)c1ccc(N3CCCCC3)cc1)C2 1073313210 ZLVMZOOMBKNXGP-XLIONFOSSA-N 384.524 2.895 0 50 GFAA CS(=O)(=O)Nc1nc(CC(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cs1 2325741686 UHSHWALXEDCWJS-AULYBMBSSA-N 399.925 2.773 0 50 GFAA CC(C)(CN1CCC(=O)N(C[C@@]23CCC[C@@H]2C3(F)F)C1=O)C(=O)N1CCCC1 2325783675 SPCQTPFDXPCALF-LIRRHRJNSA-N 397.466 2.725 0 50 GFAA CCC[C@@H](OC)C(=O)NC1(C)CCN(C(=O)CC[C@H]2CC(C)(C)CO2)CC1 2325793683 DHUKGPOINKRWCP-DLBZAZTESA-N 382.545 2.894 0 50 GFAA C[C@H](Cc1ccc(F)cc1F)C(=O)N1CC(N2CCN(C(C)(C)C)CC2)C1 2325810530 PQZOORXUXYLXFN-OAHLLOKOSA-N 379.495 2.770 0 50 GFAA CCc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(OC)c(C)c1 640338 KPBVYOMROYBBHF-UHFFFAOYSA-N 376.478 2.825 0 50 GFAA CC(=O)Nc1c(C(=O)N2CCOCC2)sc2nc3c(cc12)COC(C)(C)C3 1060052 VRWIFQNGGPFLST-UHFFFAOYSA-N 389.477 2.578 0 50 GFAA CN1C(=O)[C@@H](CC(=O)Nc2ccc(Cl)cc2)N(Cc2ccco2)C1=S 1125695 ZKJNGTCHEMHBLB-CQSZACIVSA-N 377.853 2.889 0 50 GFAA O=S(=O)(NCCc1ccccc1)c1ccc(I)cc1 1156579 NJWLJNTWDVAGFN-UHFFFAOYSA-N 387.242 2.812 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(CC2=Cc3ccccc3OC2)CC[C@@H]1O 2356135822 UXEZTICANGKECZ-GOTSBHOMSA-N 383.463 2.890 0 50 GFAA COc1ccccc1-c1noc(-c2ccccc2C(=O)N2CCN(C)CC2)n1 2874477 FTGFGFLYWFXEEZ-UHFFFAOYSA-N 378.432 2.800 0 50 GFAA COC(C)(C)CS(=O)(=O)Nc1cc(C(=O)O)c(Br)cc1C 414388577 ZFHFTPBAEDGQKE-UHFFFAOYSA-N 380.260 2.622 0 50 GFAA O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1cccc(Br)c1 101534324 JDMPTMXEWXNHEO-KBPBESRZSA-N 377.238 2.729 0 50 GFAA COc1cc(C[C@H](C)N2CCCn3nc(C(=O)N4CCCC4)cc3C2)ccc1O 65469781 SZFYILILUKAVRK-INIZCTEOSA-N 398.507 2.670 0 50 GFAA COc1ccc(-c2noc(CN(C)C[C@H](O)c3ccccc3)n2)c(OC)c1OC 20784781 XDUFXOQXCGPXCJ-INIZCTEOSA-N 399.447 2.928 0 50 GFAA C[C@@H](N)C(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 67947787 HHOCDJAOUAZHRN-GFCCVEGCSA-N 390.875 2.691 0 50 GFAA CN1C(=O)[C@](CCC(=O)N2CCC(N)CC2)(Cc2ccccc2)c2ccccc21 71589509 JEVDJXZMQSFLDP-XMMPIXPASA-N 391.515 2.873 0 50 GFAA CCN(C)C(=O)c1ccc(N2CCN(Cc3ccc(C)c(C)c3)C(=O)C2)nc1 77487254 CRWOOHOBHYVLKH-UHFFFAOYSA-N 380.492 2.639 0 50 GFAA CN(C[C@H](O)c1ccccc1)C(=O)c1coc(Cn2cnc3ccccc32)n1 11938281 MNMMVURVBWCJGB-IBGZPJMESA-N 376.416 2.878 0 50 GFAA Cn1nnc(CNC(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)n1 486791264 PISWTWFIERBDFS-UHFFFAOYSA-N 377.326 2.951 0 50 GFAA COc1cc(CN2CCN(CCCc3ccccc3)[C@H](CCO)C2)ccc1O 39541238 ZZCYBPJHHDEQSJ-OAQYLSRUSA-N 384.520 2.902 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)CCO1 238051941 IKKLVXUANSZSTK-AWEZNQCLSA-N 378.812 2.630 0 50 GFAA Cc1cc(C)n(-c2cccc(CN(C)c3cc(C4CC(N)C4)nc(N)n3)c2)n1 219025568 POIJARZQSYCVOY-UHFFFAOYSA-N 377.496 2.702 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@@H](C)N2CC[C@@H](c3nc(C4CC4)no3)C2)c1 375466287 SURHEKQGXXTDHH-IUODEOHRSA-N 383.452 2.722 0 50 GFAA CCc1ccccc1C(=O)N1C[C@@H](C(=O)O)C[C@@H](C(=O)Nc2ccc(C)nc2)C1 72145235 UGVNFCLYUXEFFL-SJORKVTESA-N 395.459 2.754 0 50 GFAA COc1ccc(C2(C(=O)N[C@H](C)CCS(C)(=O)=O)CC3(CCC3)C2)cc1 376157429 QPOTWBCWYBTOET-OAHLLOKOSA-N 379.522 2.837 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCO[C@H](c3ccccc3)O2)c(=O)n(-c2ccccc2)n1C 240333202 FCHAZXJKNFRNAS-AVRDEDQJSA-N 393.443 2.927 0 50 GFAA O=C(NCCOc1cccc(C(F)(F)F)n1)c1ccnc(NC(=O)C2CC2)c1 285856967 UUDRQUDXXFGXLQ-UHFFFAOYSA-N 394.353 2.653 0 50 GFAA Cn1cc(-c2cccc(C(=O)N[C@H]3CCCN(Cc4cccnc4)C3)c2)cn1 426667405 MQSXMRNYSDMTHF-NRFANRHFSA-N 375.476 2.877 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)n1 95509546 MRNKIAFYGQFMAJ-INIZCTEOSA-N 384.509 2.607 0 50 GFAA C[C@H](C(=O)O)N1CC2(CCC1=O)CCN(CCSc1ccccc1)CC2 91858238 JPQHQQSFYCBRMN-MRXNPFEDSA-N 376.522 2.956 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccnn3C)CC2)C[C@@H](c2ccccc2)C1=O 92028309 DNOJRMXVKHFFBY-SFHVURJKSA-N 380.492 2.679 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95510933 TWTJPSHYYDQBCK-KRWDZBQOSA-N 382.489 2.895 0 50 GFAA O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@H]1c1nc(-c2ccncc2)no1 91270095 HOFATTCXCUIJKP-KRWDZBQOSA-N 387.403 2.690 0 50 GFAA Cc1cccc(-c2nc3ccc(NC(=O)N4C[C@@H](CO)[C@H](CO)C4)cc3o2)c1 97696244 RAZAROKJRNUSGA-HOTGVXAUSA-N 381.432 2.868 0 50 GFAA O=C(CCC(=O)N1CCn2nc(Cc3ccccc3)cc2C1)NC1CCCC1 97600903 SRGMFUVZTWPVFY-UHFFFAOYSA-N 380.492 2.655 0 50 GFAA COc1ccc(-c2ccc(C(=O)N[C@@H](c3cnn(C)c3)[C@H]3C[C@@H](O)C3)o2)cc1 244866442 VWGARLOZNFGTQZ-PTSWNOGYSA-N 381.432 2.931 0 50 GFAA COc1ccc(NC(=O)CN2CCC(Oc3ncccn3)CC2)cc1Cl 240825136 QNFFYVYGMQSFKY-UHFFFAOYSA-N 376.844 2.621 0 50 GFAA CCOc1cc(CN(C)C(=O)c2cnc3c(c2)nnn3C)ccc1OC(F)F 183385127 KYLHUIAGMPAPJI-UHFFFAOYSA-N 391.378 2.636 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCO[C@@H]4CCC[C@H]43)cc2)c(C)c1CCC(=O)O 299746648 YVXKKGSKINHTRP-WOJBJXKFSA-N 397.475 2.900 0 50 GFAA O=C(O)C[C@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1cccs1 299749514 KNWVDFPHPKBNAC-LBPRGKRZSA-N 393.852 2.877 0 50 GFAA O=C(N[C@H]1COC[C@@H]1N1CCCC1)c1cccc(-c2cnn3ccccc23)c1 534666517 CVVQBIJVUZTGNM-FPOVZHCZSA-N 376.460 2.594 0 50 GFAA CCCCn1nccc1NC(=O)N1CCCC[C@H]1CCN1CCN(C)CC1 299767024 ANJKIVUMDZUYFJ-SFHVURJKSA-N 376.549 2.707 0 50 GFAA COC[C@@H](C)N(Cc1cc(F)ccc1F)C(=O)Cn1c(=O)oc2ccccc21 824338478 XYOMXKUTQUSDFW-CYBMUJFWSA-N 390.386 2.936 0 50 GFAA O=C1C[C@H](C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)C2(CCCC2)O1 952991336 XNJBUJUXEXDGBF-GFCCVEGCSA-N 384.436 2.683 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3c(C)cc(C)[nH]c3=O)CC2)OC1=O 72439494 VKPPTABXESPYRL-HNNXBMFYSA-N 375.469 2.607 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3ccc4oc(=O)ccc4c3)CC2)cc1 784404984 FTZAHKIBOUUGAX-UHFFFAOYSA-N 384.457 2.612 0 50 GFAA O=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCC(F)(c2ccccn2)CC1 408516794 ZAFUHAJBSRWUAY-UHFFFAOYSA-N 392.434 2.793 0 50 GFAA C[C@@H](CCc1ccccc1)NC(=O)COC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 221960398 SNRRSISAICTNDZ-YGWBJJMXSA-N 385.504 2.998 0 50 GFAA NS(=O)(=O)c1cc(C(=O)Nc2ccccc2OCC(F)(F)F)cs1 170630492 XFUZNIANUIEOII-UHFFFAOYSA-N 380.369 2.589 0 50 GFAA Cc1cc(C(=O)NS(=O)(=O)N2CCc3sccc3C2)c(C)n1C(C)C 170621930 GLJPUGPFQWDMCI-UHFFFAOYSA-N 381.523 2.780 0 50 GFAA Cc1sc(NC(=O)[C@H]2C[C@H](O)CN2)nc1-c1ccc(Br)cc1 277839603 LUYSZFIBHIOCGD-NWDGAFQWSA-N 382.283 2.542 0 50 GFAA COc1ccc(F)cc1CN1CCN(CC(=O)N(C2CCCC2)C2CC2)CC1 195664374 NFUVUYVSQAZWMR-UHFFFAOYSA-N 389.515 2.886 0 50 GFAA C[C@@H](O)c1nc2cc(-n3ccnc3-c3ccc(S(C)(=O)=O)cc3)ccc2n1C 1772818616 VKFOQRFRGOBGKW-CYBMUJFWSA-N 396.472 2.883 0 50 GFAA C[C@@H](C(=O)N1CCN(C)C2(CCOCC2)C1)N1C(=O)c2cccc3cccc1c23 1775980135 SMCJFSCCKMZWNS-INIZCTEOSA-N 393.487 2.512 0 50 GFAA Cc1noc(CN2C[C@H]3CN(Cc4cc[nH]n4)C[C@@]3(CCc3ccccc3)C2)n1 1772813995 DRMBNYRLKVYTEO-KNQAVFIVSA-N 392.507 2.668 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3cccc(C)n3)C[C@@]2(CCc2ccccc2)C1 1772808609 VTNCAHMOTLBSCC-URXFXBBRSA-N 393.531 2.930 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cccc(NC(C)=O)c3)n2)cc1 5388854 PBBYHIBPMUNOTG-UHFFFAOYSA-N 392.415 2.516 0 50 GFAA CCN(CCn1cccn1)C(=O)c1cc(Cn2c(C)nc3ccccc32)on1 11667868 PZNZAFFARAYYPO-UHFFFAOYSA-N 378.436 2.740 0 50 GFAA CCOC(=O)[C@@]1(CCOc2ccccc2)CCCN(C(=O)c2cnccn2)C1 11840477 WTZYQLXLVGODCJ-OAQYLSRUSA-N 383.448 2.731 0 50 GFAA O=C(C[C@@]1(c2ccccc2)CC(=O)N(Cc2cccs2)C1=O)N1CCCC1 12050437 FNWAKESSDYOIDN-NRFANRHFSA-N 382.485 2.958 0 50 GFAA CCOC(=O)N1CCN(C[C@H](O)COCCC23CC4CC(CC(C4)C2)C3)CC1 19956908 AVSSJCYKBFPSJZ-QPCUBCJCSA-N 394.556 2.745 0 50 GFAA O=C1CCOC2(CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)CN1 1857735014 CORIYNJDSXFEDW-UHFFFAOYSA-N 380.444 2.990 0 50 GFAA O=C(c1cn2cc(Cl)ccc2n1)N1CCC([C@@H](O)CN2CCCCC2)CC1 1857741284 LSLILUGRCVJTCD-SFHVURJKSA-N 390.915 2.687 0 50 GFAA COc1ccccc1CN1C[C@@H]2OC(=O)N(Cc3ccc(OC)c(OC)c3)[C@@H]2C1 247885447 KQKSSTKDBOGAOJ-UTKZUKDTSA-N 398.459 2.918 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O)c1cnn(C)c1 164169475 POERQIHEEDXADC-KUHUBIRLSA-N 392.459 2.761 0 50 GFAA CCNC(=O)C[C@@H]1CCCCN1C(=O)c1cnn2c(-c3cccs3)ccnc12 952845511 KRDDGBCIYVPVES-AWEZNQCLSA-N 397.504 2.979 0 50 GFAA C[C@@H]1COC[C@@](CO)(CNC(=O)c2ccoc2C2CC2)N1Cc1ccccc1 1875396709 RTLYEOLQPOYPJU-ZHRRBRCNSA-N 384.476 2.539 0 50 GFAA Cn1cc([S@](C)(=O)=NC(=O)c2csc(COc3ccc(F)cc3)n2)cn1 1875354869 RDZCJWVYBIJWQL-SANMLTNESA-N 394.453 2.892 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCCN(c3ccccc3Cl)CC2)CC1 1776002653 XVDBYKQVEVLKBZ-UHFFFAOYSA-N 375.900 2.803 0 50 GFAA Cn1cnc2nc(N3CCC(O)(c4cccc(C(F)(F)F)c4)CC3)ncc21 2100483811 NDRULZJGVFUZAJ-UHFFFAOYSA-N 377.370 2.870 0 50 GFAA CNC(=O)C[C@H](NC(=O)c1ccc2c(c1)ncn2-c1cccc(C)c1)C1CC1 2325898408 AWRBJSYZRZKRLF-SFHVURJKSA-N 376.460 2.978 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)CCn2c(O)nc3ccccc32)C1=O 2356146836 XICLEUROAZFHGF-OAQYLSRUSA-N 384.480 2.524 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)CCc2c[nH]c3ccccc23)C1=O 2356150318 WUNXKIFSNIUSLW-QFIPXVFZSA-N 383.492 2.731 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C2CCN(Cc3ccccc3)CC2)C1 2356161462 WOOSMYBJFCDYRL-QHCPKHFHSA-N 377.536 2.834 0 50 GFAA O=C(CCc1cnccn1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356168714 CETVSDSLVJTXOP-QFIPXVFZSA-N 378.476 2.593 0 50 GFAA COc1ccc(CC(=O)N2CCC(Cc3nnc(SC)n3C)CC2)cc1C 55037098 ZGNQXFQMVJHUOT-UHFFFAOYSA-N 388.537 2.878 0 50 GFAA Cc1cc(S(=O)(=O)NCc2ccc(S(C)(=O)=O)cc2)sc1Cl 252509383 YMPAJWMJDHNETP-UHFFFAOYSA-N 379.912 2.592 0 50 GFAA COc1ccc(C(=O)N2C[C@H](O)[C@@H](N(C)Cc3cc4cc(F)ccc4[nH]3)C2)cc1 12372755 NYRXZXSSHVYEMW-SFTDATJTSA-N 397.450 2.633 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCO[C@@H](c3cccc(OC(F)F)c3)C2)cn1 262714341 CJEOHMSHUDZMLL-OAHLLOKOSA-N 378.331 2.595 0 50 GFAA CO[C@H](C)c1cccc(NC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)c1 127752464 TUUISDWNEHLZEM-OAHLLOKOSA-N 393.447 2.805 0 50 GFAA NCc1ccc(C(=O)N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)o1 237955510 GNFWAAHIRNHBSB-UHFFFAOYSA-N 388.777 2.768 0 50 GFAA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)s1 242167641 WYFLJIQTBOSTTC-GRYCIOLGSA-N 378.947 2.963 0 50 GFAA CCN1C(=O)[C@H]2[C@@H](C1=O)[C@@H](C(=O)c1ccc(C)cc1)N1N=Cc3ccccc3[C@@H]21 43191182 CRRARLBQFDLNJC-YRPNKDGESA-N 387.439 2.572 0 50 GFAA O=C(NCc1cnn(-c2ccc(F)cc2)c1)[C@@H]1CCCN(C2CCOCC2)C1 95384364 WJPQCKZTGHGUPX-QGZVFWFLSA-N 386.471 2.519 0 50 GFAA Cc1cccc(Cn2nc([C@@H](O)c3ccccc3)nc2CN2CCOC2=O)c1 95496586 LWOSJGXFTDMOBR-IBGZPJMESA-N 378.432 2.669 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C(=O)OCc3ccccc3)CC2)CC1 95503468 MEIFGHLFEDMWMO-UHFFFAOYSA-N 387.524 2.980 0 50 GFAA CC(C)NC(=O)c1cc(NC(=O)N[C@H](C)c2nnc(N)s2)ccc1Cl 97823030 GYKLETNKKFQUDJ-MRVPVSSYSA-N 382.877 2.795 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)cnc1C 91933194 DTPFAPUIDQFSAO-IBGZPJMESA-N 385.508 2.722 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1ccc3nsnc3c1)CC2 91997945 RTVDSJYLLTWXRU-UHFFFAOYSA-N 388.537 2.932 0 50 GFAA C[C@@H](C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnc2ccccc2c1=O 249691988 MEEDLRIVMRQAIR-ZDUSSCGKSA-N 380.452 2.837 0 50 GFAA Cc1cc(NC(=O)N(C)C[C@@H]2CCCN(C)[C@H]2c2ccnn2C)cn2ccnc12 297000259 OZSZTKMFYAZVHL-QFBILLFUSA-N 395.511 2.923 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)cc1 299388316 ZHGFCSFVZRVFJJ-UAGQMJEPSA-N 379.478 2.727 0 50 GFAA O=C(c1cc[nH]c1)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940193446 KTMMILXCFXCCOT-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA O=C1CO[C@H](C(=O)N2CCC(Cc3ccc(F)cc3)CC2)[C@@H](c2ccccc2)N1 1940195278 SHUNJKPVPVBQDH-YADHBBJMSA-N 396.462 2.863 0 50 GFAA C[C@@H]1CN(c2ccc(CNC(=O)c3cc(COC(C)(C)C)on3)cn2)CCO1 185199797 OUMPPNNBCKMQCQ-CQSZACIVSA-N 388.468 2.540 0 50 GFAA Cc1ccc(OCCCC(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)cc1C 276194805 CIBKQNUWCOGDBP-GOSISDBHSA-N 397.523 2.568 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCO[C@@H](c2nccs2)C1 186810494 PXFRQXDCWJFEKY-CQSZACIVSA-N 375.841 2.591 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OC4CCCC4)c(F)c3)C(=O)[C@@H]2C1 278264724 YCARLYMICNIYPI-LRDDRELGSA-N 390.411 2.867 0 50 GFAA CCc1ccccc1NC(=O)C[C@@H](C)Nc1ccc(OC)c(OCC(N)=O)c1 170592222 FUIMZHRDNULEEW-CQSZACIVSA-N 385.464 2.951 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@@H](c3ccc(OC)cc3OC)C2)c1 170614151 HYJZUXTWPXBNIO-GOSISDBHSA-N 390.461 2.823 0 50 GFAA CCn1c(S)nc2cc(C(=O)N[C@@H]3CCCCC[C@@H]3OC)ccc2c1=O 170653345 UZPXGKVIPMIQIL-ZBFHGGJFSA-N 375.494 2.783 0 50 GFAA C[C@H](CC(=O)N1CCCN(C(=O)c2ccccc2)CC1)NC(=O)C1CCCCC1 171367185 MLCWGQOMGCHLCF-GOSISDBHSA-N 399.535 2.836 0 50 GFAA O[C@@H](CN1CCN(Cc2nc(-c3cccs3)no2)CC1)C1CCCCC1 190371068 CCYOVAPJFPFIMX-INIZCTEOSA-N 376.526 2.857 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@H]1CCCN(CC(F)(F)F)C1)C2 194188330 PMKSAJIFKSKORO-HNNXBMFYSA-N 383.414 2.804 0 50 GFAA Cc1ccc(OC[C@H]2CCCN(CC(=O)Nc3ccc(C(N)=O)cc3)C2)cc1 1529181628 STICPFVZZLLIDG-KRWDZBQOSA-N 381.476 2.823 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)Nc3ccc(Cl)cc3Cl)CC2)[C@H]1O 1704338652 WNUDQHDSOJCHHD-GOEBONIOSA-N 389.279 2.892 0 50 GFAA O=C(CN1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1)NC1CCCCCC1 1704338721 YGEYDCOQYTVAQI-GCJKJVERSA-N 381.520 2.909 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccccc3Cl)n2)cc1 5388993 HRRJCILPISRVTR-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA CCOC(=O)N1CCC(N2CCC[C@H](CNC(=O)c3cccs3)C2)CC1 11879024 JJMLPRJAFPRYMK-OAHLLOKOSA-N 379.526 2.811 0 50 GFAA COCCN1CCC(CN(C[C@H]2CCCO2)C(=O)CCC(F)(F)F)CC1 11948600 KKNQVBLXTQQLIH-MRXNPFEDSA-N 380.451 2.695 0 50 GFAA COc1ccc2cc(C(=O)[C@H]3CCCN(C(=O)Cn4cncn4)C3)ccc2c1 12052871 VGEKXENGWHMKBX-SFHVURJKSA-N 378.432 2.561 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2cc(COc3ccccc3F)[nH]n2)C1 12301133 YKBUOMHTJZXJFS-ZDUSSCGKSA-N 375.400 2.543 0 50 GFAA O=C(CCC1CCN(C(=O)C(=O)c2ccccc2)CC1)NCc1cccnc1 12435791 LYEOPSYBXDCUDH-UHFFFAOYSA-N 379.460 2.600 0 50 GFAA COCCN(Cc1nccn1C)CC1CCN(Cc2ccccc2OC)CC1 12446851 BHHLKQCHRTUMCX-UHFFFAOYSA-N 386.540 2.789 0 50 GFAA O=C(NCC1CCCCC1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12580673 PEZVYVIHXMXDCV-LJQANCHMSA-N 375.557 2.796 0 50 GFAA Cc1ccc(CN[C@H]2C[C@H]3C(=O)N[C@@H](CC4CCCCC4)C(=O)N3C2)cc1F 14743655 GYJKWBJCVHLBRP-IHPCNDPISA-N 387.499 2.662 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)CCOC21CCN(C[C@H]2CCCNC2)CC1 1857707710 YVTGNTDBNMHJBY-INIZCTEOSA-N 391.581 2.750 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2cccc3c2OCCO3)C[C@H](C2CC2)O1 1875246388 FERJZNSHBNEDCN-NVXWUHKLSA-N 381.494 2.816 0 50 GFAA O=C(NC1CC1)c1cccc(OCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)c1 462680140 JGPVQOMBQRUHQU-FQEVSTJZSA-N 398.434 2.697 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCCOc3ncccc3C(F)(F)F)n[nH]c21 1875394224 ZTLVWJUDCMKKKR-ZJUUUORDSA-N 384.358 2.655 0 50 GFAA Cc1cnn(C)c1S(=O)(=O)Nc1cc(C(F)(F)F)c(Br)cn1 888096825 NGIWGKFJXLRZGB-UHFFFAOYSA-N 399.192 2.706 0 50 GFAA O=C1N[C@H](CC(=O)N2CCCN(c3nc4ccccc4o3)CC2)c2ccccc21 2100534385 GERZINGTQCCUFT-GOSISDBHSA-N 390.443 2.741 0 50 GFAA O=C(c1ccncc1)N1CCC[C@H](C(=O)N2CCC[C@H]2Cc2ccncc2)C1 2325794601 JWHOOCRWEOCCNR-PMACEKPBSA-N 378.476 2.563 0 50 GFAA C[C@@H](NC(=O)c1cc(C2CCNCC2)[nH]n1)c1ccc(-n2cccn2)c(F)c1 2325796083 RUEGTRGQIQZCOA-CYBMUJFWSA-N 382.443 2.693 0 50 GFAA CC(C)[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc2c(-c3nn[nH]n3)c[nH]c12 2325807977 PUPZJIRYAKTGPM-KDOFPFPSSA-N 393.495 2.683 0 50 GFAA O=C(NCc1ccc2nc[nH]c2c1)c1sc2c(c1Br)CNC2 2325856368 MQYDZRGLNGOYQF-UHFFFAOYSA-N 377.267 2.920 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)Nc3ccccc3N=S(C)(C)=O)cn21 886406158 NVGWILPFFGYLHU-LBPRGKRZSA-N 382.511 2.940 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 1073317 VIMKZVIFVRPDFX-QGZVFWFLSA-N 390.480 2.585 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCCc2nccs2)C[C@H]1NC1CCOCC1 2356164427 SELJQSFZLSHTHA-CGTJXYLNSA-N 395.569 2.534 0 50 GFAA COc1ccc(OC)c(C2=NO[C@H](C(=O)N3CCN(c4ccccc4)CC3)C2)c1 4904409 GLPQVDFPYBWRMB-NRFANRHFSA-N 395.459 2.546 0 50 GFAA O=C(NC[C@@H]1CSCCN1Cc1ccccc1)c1ccc(-n2ccnn2)cc1 225438923 GMEYKEMYOGCTOO-HXUWFJFHSA-N 393.516 2.615 0 50 GFAA CCCOc1ccc(C(=O)N2CCO[C@H](Cn3cc(C)cn3)C2)cc1OCC 112062596 LSVVXOJWPHZDER-SFHVURJKSA-N 387.480 2.920 0 50 GFAA CCC(=O)Nc1cccc(C(=O)N[C@H]2CCCN(c3cc(CC)ncn3)C2)c1 112500649 OIUDTTVTAXMBBR-SFHVURJKSA-N 381.480 2.786 0 50 GFAA CCSc1nnc(-c2ccccc2NC(=O)[C@@H](CC)n2cccn2)c(=O)[nH]1 55393513 RWDIODQGUZKQSQ-CQSZACIVSA-N 384.465 2.730 0 50 GFAA C[C@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCC[C@@H](CN2CCCCCC2)C1 246988560 HQQBAJRRFDSIRT-MOPGFXCFSA-N 398.551 2.948 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(C[C@H]2CCCO2)CC1 67805834 BWSSTPHOLLYDPM-QGZVFWFLSA-N 384.480 2.960 0 50 GFAA Cn1cc(C(=O)N2CCOc3c(O)cc(-c4ccc(Cl)cn4)cc3C2)cn1 67850888 YVGVUANFWGQZPS-UHFFFAOYSA-N 384.823 2.876 0 50 GFAA CC(C)CN1CC[C@H](C(=O)N2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)C1 252512690 UTBBBJFCODTSID-XLAORIBOSA-N 379.545 2.726 0 50 GFAA COC(=O)c1csc(S(=O)(=O)N(C)[C@H](C)[C@H]2Cc3ccccc3O2)c1 433486137 JXUPXOVEWQVEHO-IAQYHMDHSA-N 381.475 2.547 0 50 GFAA O=C(O)c1cc(-c2ccc3c(c2)OCO3)cc(S(=O)(=O)N2CCCC2)c1 72154710 AGTFWMOUGRKNHX-UHFFFAOYSA-N 375.402 2.565 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCOC[C@H]1c1nc(-c2ccccc2)no1 374319838 CGGKRODFUFOQFU-HNNXBMFYSA-N 379.372 2.679 0 50 GFAA Cn1ncc(CS(=O)(=O)CC(=O)Nc2ccc(Cl)cc2)c1C(F)(F)F 130328708 YEUNDUHSWWIMDU-UHFFFAOYSA-N 395.790 2.646 0 50 GFAA O=C(C[C@@H]1COCCN1C(=O)c1coc2c1C(=O)CCC2)Nc1ccccc1 72475427 OTVMMMXWBISPQK-OAHLLOKOSA-N 382.416 2.668 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCOC[C@H]2OCC(=O)O)sc1-c1ccccc1 223091216 LFYVJURUZIYPSX-HUUCEWRRSA-N 375.446 2.712 0 50 GFAA COc1ccc(CNC(=O)N2CCC([C@H](O)c3ccccn3)CC2)c(OC)c1 426373849 RDEARQAOSRJNMV-FQEVSTJZSA-N 385.464 2.754 0 50 GFAA COc1cc(-c2cnn(CC(=O)Nc3ccnn3C3CCCCC3)c2)ncn1 48194346 CUHJBSCRMSRXIM-UHFFFAOYSA-N 381.440 2.689 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)N1CC[C@H](Oc2ccccc2)C1 426395955 MSXJAZKUEPNSIV-SFHVURJKSA-N 377.444 2.857 0 50 GFAA CNC(=O)[C@@H](NC(=O)NC1CCN(c2cccc(C)c2)CC1)c1ccccc1 426509295 FRHFJJPTWKPXCD-FQEVSTJZSA-N 380.492 2.750 0 50 GFAA Cc1c(C(=O)N(C)Cc2nnc(-c3ccccc3)o2)sc2[nH]cnc(=O)c12 426538461 UDOJPRVFQFBIKO-UHFFFAOYSA-N 381.417 2.615 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@@]3(CCC(=O)N(C4CC4)C3)C2)c(C)s1 91907881 SPYLWWYWTFEZBN-GOSISDBHSA-N 382.551 2.921 0 50 GFAA CNc1nc(C(=O)N2CCc3ccc(NC(=O)[C@@H]4CCCO4)cc3C2)cs1 95498202 BKIMFQGILXTAHU-INIZCTEOSA-N 386.477 2.501 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95501420 GWZGKDWMJVEVPA-GOSISDBHSA-N 386.459 2.994 0 50 GFAA O=C(NCc1csc(N2CCOCC2)n1)c1c[nH]nc1C1CCCCC1 91829111 JXNLMUWRHFMBHY-UHFFFAOYSA-N 375.498 2.681 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1CCC[C@@H](c2cccc(C(=O)O)c2)C1 95366549 XUDCWYFRIISNQK-GOSISDBHSA-N 385.464 2.946 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4cncc(F)c4)CC3)CC2=O)c1 95525776 ZFKCYSUBYOKTPG-UHFFFAOYSA-N 397.450 2.884 0 50 GFAA CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)C1=O 239338740 LDFNPLDMEUZCKT-NIZXYWGZSA-N 389.471 2.924 0 50 GFAA O=C1CCC2(CCN(c3ncnc4c3CCC4)CC2)CN1Cc1cccnc1 92038175 KHLLYWUJULPQGU-UHFFFAOYSA-N 377.492 2.770 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N3CCN(c4ccc(F)cc4)CC3)cn12 1940194950 FBLTWLDADWWXLQ-LJQANCHMSA-N 397.454 2.520 0 50 GFAA CN(C)CC(=O)Nc1ccccc1NC(=O)CCc1nc2ccc(F)cc2[nH]1 823678297 GEBGUMREDFRWNK-UHFFFAOYSA-N 383.427 2.773 0 50 GFAA O=C(c1ccc(-c2cccc(F)c2)cc1)N1CCN(CCn2cncn2)CC1 826618818 ODPGNQCBTGFACW-UHFFFAOYSA-N 379.439 2.542 0 50 GFAA Cc1ccc(CN2CCOC3(CCN(C(=O)c4ncoc4C)CC3)C2)s1 825199504 LEGRMSQVWXFVMR-UHFFFAOYSA-N 375.494 2.860 0 50 GFAA Nc1ncc(C(=O)NCCc2cnn(-c3ccccc3)c2)c(-c2ccccc2)n1 827587526 KOYAZIMEQPZEEU-UHFFFAOYSA-N 384.443 2.884 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)cc1C(=O)N(C)C 824699828 RAYGYFXHIARMHL-OAHLLOKOSA-N 382.464 2.647 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)c2cccc3nsnc23)n1 952971401 DEWJENXFXVUZMX-NSHDSACASA-N 379.467 2.724 0 50 GFAA COc1ccc(/C=C/CN2C[C@@H]3CC[C@H]2CN(C(=O)c2cnccn2)C3)cc1 1565528687 UGWIYBDDNQZFGL-XVXNLHAJSA-N 378.476 2.735 0 50 GFAA O=C(c1cccc(-c2ccc(OC(F)F)cc2)c1)N1C[C@H](CO)[C@@H](CO)C1 1565530169 KTUCCIICQUNGSA-IAGOWNOFSA-N 377.387 2.628 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)[C@H]2CCOc3ccccc32)cc1OC 268936041 HSVYPFNDLSKBNE-HOTGVXAUSA-N 385.416 2.902 0 50 GFAA Cc1cc2nc(O)[nH]c2c(NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)c1C 952971750 VNERQZFHFZYNHB-HNNXBMFYSA-N 378.432 2.840 0 50 GFAA NC(=O)c1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(Cl)ccc2Cl)co1 170595202 QSIWTQZVZFHVQE-ZDUSSCGKSA-N 396.230 2.929 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CC(NC(=O)C4CC4)C3)ccc21 189485838 QIACOEABIGICFP-UHFFFAOYSA-N 394.397 2.987 0 50 GFAA O=C(NC1CCN(CCc2ccccc2)CC1)N1CCN(c2ccccn2)CC1 192983365 QQSXRHOVPFKBKM-UHFFFAOYSA-N 393.535 2.620 0 50 GFAA O=C(O[C@H]1CCN(c2ccccc2Cl)C1=O)c1nnc(O)c2ccccc12 732323809 UIRSSXPTNNFSBI-HNNXBMFYSA-N 383.791 2.951 0 50 GFAA Cc1noc(C)c1CCC(=O)NCC1CCN(CCn2cc(Cl)cn2)CC1 1506416422 BDQNIGRMVKNVTJ-UHFFFAOYSA-N 393.919 2.602 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC[C@H]1CCCN1C 1704325546 PJNWBADFRXXOGZ-OAHLLOKOSA-N 392.887 2.877 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1 1848443832 CDMVQQAHEQVSMF-JYFSTPETSA-N 390.520 2.577 0 50 GFAA COCCC(=O)N1C[C@H]2CN(Cc3ccccc3-c3ccccc3)C[C@]2(CO)C1 1772701609 LNADRGGQIWHUAR-ZJSXRUAMSA-N 394.515 2.643 0 50 GFAA Cc1noc(CCCNC(=O)[C@H]2CC[C@H](CN3Cc4ccccc4C3=O)CC2)n1 1775942343 BKMRZJDQMQBBFO-QAQDUYKDSA-N 396.491 2.889 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(Cc4cnc(C)n4C)C3)C2=O)c1 12444933 FAMPUNVYUUUTLN-QFIPXVFZSA-N 382.508 2.752 0 50 GFAA OC1CCN([C@@H]2CCN(Cc3ccc(OCc4ccccc4)cc3)C[C@H]2O)CC1 12705166 FWRMJBKTZHERCZ-DNQXCXABSA-N 396.531 2.658 0 50 GFAA O=C1CCN(C(=O)Cc2cccc3ccccc23)CCN1CCN1CCCC1 14966042 CVSGXILFLWPTEK-UHFFFAOYSA-N 379.504 2.539 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)CCC2CCOCC2)CCC1=O 14976865 JLVDEAFXMHYSPL-IBGZPJMESA-N 388.508 2.709 0 50 GFAA CC(=O)Cc1nsc(NC(=O)c2nnn(-c3ccc(C)cc3)c2C2CC2)n1 16649655 KPBBOEOHDVKFPK-UHFFFAOYSA-N 382.449 2.688 0 50 GFAA COc1ccc([C@H]2Cn3nnc(-c4nc(-c5cccnc5)no4)c3CO2)cc1 169758340 QBIZGCAURJKOSF-MRXNPFEDSA-N 376.376 2.670 0 50 GFAA COc1ccccc1Cc1nc([C@@H]2CCn3ncnc3C2)n(-c2ccccn2)n1 1857677076 WMOAXNKDRPKQPS-MRXNPFEDSA-N 387.447 2.583 0 50 GFAA COc1cc(Oc2cc(C(=O)N3CCCC[C@@H]3CN)ccc2OC)ccc1CN 1857692675 OSHKWXYBMPBLFT-QGZVFWFLSA-N 399.491 2.908 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NCc3ccc(F)c(Cl)c3)CC2=O)s1 1857724784 CPECYTURPQLAND-SNVBAGLBSA-N 382.848 2.562 0 50 GFAA COCCN1C(=O)[C@@H]2CC[C@H]1CN(Cc1cccc(-n3nc(C)cc3C)c1)C2 247877362 ASRKICZHLCEOIP-CTNGQTDRSA-N 382.508 2.558 0 50 GFAA COCc1cc(C(=O)N[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)no1 266283740 GAEVVSLVOCGLEY-LLVKDONJSA-N 385.342 2.728 0 50 GFAA COc1cc(C(=O)N2CCc3nnn(C4CC(C)C4)c3C2)cc2c1O[C@@H](C)C2 870739097 WIWVNEKEIDQIIV-UYJPIKCFSA-N 382.464 2.780 0 50 GFAA CC(=O)N(C)CCCC(=O)N1CCOC[C@@H]1c1c(C)nn(-c2ccccc2)c1C 952886766 AKDMMCLFLNRWGR-HXUWFJFHSA-N 398.507 2.648 0 50 GFAA Cc1cc2c[nH]nc2cc1NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1 1875293638 XIFKIQKJEHPZNX-SFHVURJKSA-N 384.461 2.663 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1cc(C)ccc1F)C[C@H](C)O[C@@H]2C 1875314569 GJSWARILSRGJAG-UONOGXRCSA-N 375.444 2.929 0 50 GFAA Cc1csc(C(=O)NC[C@]2(O)CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)c1 1875305694 YOAGFFKVCZDIOB-SIKLNZKXSA-N 398.528 2.944 0 50 GFAA CC(C)[C@H](C(=O)NC[C@H]1C[C@@H](CC(N)=O)CO1)c1cccc(C(F)(F)F)c1 1875310624 WDVFTRMMUTZTQU-MJEQTWJJSA-N 386.414 2.842 0 50 GFAA CNC(=O)C[C@@H]1CN(Cc2cccc3c(Br)cccc23)C[C@H]1O 1875399064 NMHDZQZPTQDYSE-CXAGYDPISA-N 377.282 2.531 0 50 GFAA COc1cc(C2(C(=O)N[C@@H]3C[C@H](Cn4cccn4)C[C@H]3O)CCC2)ccc1C 1875402510 ICGSLKDDNDDYHM-QXAKKESOSA-N 383.492 2.578 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1cc(C(F)(F)F)ncc1Cl 1875400610 GFLJEHBTQNBPMK-OASPWFOLSA-N 388.777 2.520 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)Nc1cc(-c2cccnc2)nn1C 2100482258 MBDURAFLCYSFPN-CQSZACIVSA-N 377.404 2.555 0 50 GFAA CC[C@@H](NC(=O)[C@@H]1C[C@@H]2CNC[C@@H]2C1)c1ccccc1OCC(=O)N1CCCC1 2325780313 XPYBIUPHQZZUGI-FTEYMNFISA-N 399.535 2.501 0 50 GFAA Cn1ccnc1CN1CCC[C@H]([C@@H]2CCCN(C(=O)CCCn3ccnc3)C2)C1 2325840120 QADLOVVJCGARHJ-VQTJNVASSA-N 398.555 2.548 0 50 GFAA CN1CCN(C(=O)c2cccc(-n3nccc3-c3ccccc3)c2)[C@@H](CCO)C1 2325855604 HUBDDWXVJZIBCY-NRFANRHFSA-N 390.487 2.678 0 50 GFAA Cc1ccc(Cl)cc1N(CC(=O)N1CCc2ccccc2C1)S(C)(=O)=O 882583 LMKHBSPLTAUZBW-UHFFFAOYSA-N 392.908 2.999 0 50 GFAA COC(=O)c1cc(Cc2ccc(NC(C)=O)c(C(=O)OC)c2)ccc1NC(C)=O 994934 SMWZAUUOKPEDMU-UHFFFAOYSA-N 398.415 2.767 0 50 GFAA O=C(CN(C(=O)c1ccc(Cl)cc1)N1C(=O)CCC1=O)c1cccs1 1077752 PAZFNBSILPGRER-UHFFFAOYSA-N 376.821 2.791 0 50 GFAA CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)N(CC)CC)c(Cl)cc1O 4867097 RZIQTBQXYVUKTQ-MRXNPFEDSA-N 381.860 2.941 0 50 GFAA O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCN(c2cccc(Cl)c2)CC1 6697653 KFXWZKJPQLKMCO-HNNXBMFYSA-N 375.900 2.780 0 50 GFAA CCOc1cc(-c2nnn(CC(=O)N[C@@H](C)c3ccccc3)n2)ccc1OC 10337813 OVJIIKVNROAGRN-AWEZNQCLSA-N 381.436 2.625 0 50 GFAA Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c1 113567389 BRVIBMVJJBINOP-LJQANCHMSA-N 394.475 2.969 0 50 GFAA CC(=O)[C@@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CC2CCCCC2)C1 55072402 IPZJDHDFWNSBDF-QGZVFWFLSA-N 381.542 2.668 0 50 GFAA CC[C@H](N)C(=O)N1CCc2c(cnc(C)c2-c2noc(CCC(F)(F)F)n2)C1 23338311 ZVWHZTUHERGLLK-ZDUSSCGKSA-N 397.401 2.557 0 50 GFAA COc1ccc(-n2ccnc2-c2nc3c(cnn3C3CCN(C)CC3)[nH]2)cc1 20913519 CJFDDLGEHTXBIZ-UHFFFAOYSA-N 377.452 2.887 0 50 GFAA Cn1nnc2cc(C(=O)N3Cc4cnn(Cc5ccc(F)cc5)c4C3)ccc21 67907849 XDNNORCYMNMDLN-UHFFFAOYSA-N 376.395 2.508 0 50 GFAA Fc1ccc(F)c(-c2n[nH]c3c2CN(c2cc(-n4cccn4)ncn2)CC3)c1 23368655 VJUPHQLFIVLZHE-UHFFFAOYSA-N 379.374 2.893 0 50 GFAA CC1(C)[C@@H]2C[C@@H]1CC(=O)[C@]2(C)OC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21 252485009 GMFYNJHSTOUGIQ-MTXLYNKOSA-N 394.537 2.649 0 50 GFAA CCOc1cc2c(cc1/C=C/C(=O)N(CC(=O)O)C1CCOCC1)O[C@@H](C)C2 328594997 ICPCRSPDHVTYHA-NNTXTVRGSA-N 389.448 2.514 0 50 GFAA COc1ccc(S(=O)(=O)NCCCn2nc(C(F)(F)F)cc2C)cc1 2805016 NBSNRYVREHHOQN-UHFFFAOYSA-N 377.388 2.588 0 50 GFAA OC1CCN(CCn2ccnc2-c2sc(N3CCCC3)nc2Cl)CC1 71762731 OIFHQGJERCAALC-UHFFFAOYSA-N 381.933 2.717 0 50 GFAA O=C(C(=O)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1)c1ccco1 71638830 DEFCYXWGCTVLEP-NIKGAXFTSA-N 386.398 2.829 0 50 GFAA CC(C)(C(=O)N[C@H]1CCN(c2ncccc2F)C1)c1ccc2c(c1)OCCO2 153463850 LNCIWFYQPCBKBQ-HNNXBMFYSA-N 385.439 2.665 0 50 GFAA Cn1cc(C[C@@H]2CCN(CC(=O)Nc3ccc(N4CCCCC4)cc3)C2)cn1 363306948 MWBNCBGAJIDQDM-SFHVURJKSA-N 381.524 2.914 0 50 GFAA O=C(CN[C@H]1CCc2ccccc2OC1)Nc1nc(CN2CCCC2)cs1 366977080 RGGLICXIHPPUJF-INIZCTEOSA-N 386.521 2.661 0 50 GFAA O=C(c1cc(C(=O)N2CCNC[C@H]2c2ccccc2Cl)c[nH]1)N1CCCC1 262046288 UOJPLOIRAXLCFJ-SFHVURJKSA-N 386.883 2.691 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(c3cnc4ccccc4n3)CC2)C1)N1CCCC1 71746698 UFJDCRJRFOXNMJ-GOSISDBHSA-N 393.535 2.933 0 50 GFAA CN1C(=O)Cc2cc(S(=O)(=O)N3CC[C@@](F)(c4ccccc4F)C3)ccc21 451519959 YLCLCNUGTYFNTI-IBGZPJMESA-N 392.427 2.604 0 50 GFAA COc1ncccc1NC(=O)[C@@H]1C[C@H](C(=O)O)CN(Cc2ccc(C)s2)C1 71771594 VCFMVZKFJKORRH-KGLIPLIRSA-N 389.477 2.622 0 50 GFAA CC(C)c1cc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)nc2ncnn12 215000433 XATCFFHEHAODQC-CQSZACIVSA-N 384.509 2.704 0 50 GFAA CCSCCN1CCC(N2CCC[C@@H](C(=O)NCc3ccccn3)C2)CC1 71776475 PMDWLCDQCIWPIV-GOSISDBHSA-N 390.597 2.627 0 50 GFAA CCc1nc(-c2ccc(C(=O)NC3CCN(Cc4cccnc4)CC3)cc2)n[nH]1 178546351 WCDAYCCLGYILNO-UHFFFAOYSA-N 390.491 2.824 0 50 GFAA CCCCc1cc(=O)[nH]c(-c2ccc(CN3CCN(C(=O)N(C)C)CC3)cc2)n1 48179403 IJSDIQRNKCQMGP-UHFFFAOYSA-N 397.523 2.579 0 50 GFAA NC(=O)c1cccc(OCCC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)c1 175852460 HPGRCYUBIXIQFX-UHFFFAOYSA-N 392.459 2.837 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H](C)c2nc(N)n[nH]2)cc1 426396650 RIABMEWGIVLFAA-AWEZNQCLSA-N 387.447 3.039 0 50 GFAA Cn1cc2c(n1)CCC[C@H]2C(=O)N1CCC[C@H](c2nnc3n2CCCCC3)C1 329817106 FFKVFWPUVUCSMC-JKSUJKDBSA-N 382.512 2.564 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N[C@@H]3CCCN(C(=O)C4CC4)C3)cc2)c(N)n1 426674416 XUSGBZNYNKNQBH-GOSISDBHSA-N 378.476 2.770 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)NCc2nnc3n2CCCCC3)cc1 97323958 JEBMWSHXMKQVHX-CQSZACIVSA-N 382.468 2.842 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)OC)cc2C)C1 95527523 AEVOPUKKXZJYEP-MRXNPFEDSA-N 375.469 2.894 0 50 GFAA O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc([C@@H]2CCCNC2)cc1 95383404 NNMUDQMFWYLYPX-HXUWFJFHSA-N 378.520 2.943 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC3(CC2)c2nc[nH]c2CCN3C)cc1 95507298 CNBPBOYBBJTTIL-UHFFFAOYSA-N 392.507 2.583 0 50 GFAA Cc1ccc2cc(CN3CCC[C@H](c4ccn(CC(=O)O)n4)C3)c(O)nc2c1 426478169 UUAXTFLEAYJZPU-INIZCTEOSA-N 380.448 2.910 0 50 GFAA C[C@@H](NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1nccs1 95376413 XLKYEOUPNJBKKD-GFCCVEGCSA-N 379.507 2.855 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(Cc4c(C)nn(C)c4C)C3)CCC2=O)cn1 91943046 ITIYMSKCNDUNFM-QFIPXVFZSA-N 396.539 2.540 0 50 GFAA CCN1CCN(C[C@H](O)CN2CCn3c4c(c5cc(C)ccc53)CCC[C@H]42)CC1 239309068 HFDBNPIDCZKBSN-WMZHIEFXSA-N 396.579 2.641 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2ccc(F)cc2)CC3)cn1 91895787 ISJXYHRAHOKEHT-UHFFFAOYSA-N 396.466 2.969 0 50 GFAA CO[C@@H]1Cc2ccccc2N(C(=O)Nc2ccc(C)c(N3C(=O)CNC3=O)c2)C1 297473377 JBMURYHRCLCHMO-MRXNPFEDSA-N 394.431 2.661 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2CC[C@@]2(C)[C@H](C3=CC(=O)OC3)[C@@H](O)C[C@]12O 253498962 PVAMXWLZJKTXFW-MJBBHHHRSA-N 390.520 2.575 0 50 GFAA Cc1cccc(C[C@@H](CNC(=O)[C@H]2CC(=O)N(C)c3ccccc32)C(=O)O)c1 299749078 JDLDXBVQNZDHNO-WMZOPIPTSA-N 380.444 2.505 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 252483900 FKVDIIBMALYXSD-CQSZACIVSA-N 398.394 2.713 0 50 GFAA CC[C@H](C)Oc1cccc(CNC(=O)N2CCc3c(c(CO)nn3CC)C2)c1 534667733 BEVKSVFVZLLSKF-HNNXBMFYSA-N 386.496 2.841 0 50 GFAA CC(C)Cc1ncc2c(n1)CN(C(=O)Nc1ccc3c(c1)N(C)C(=O)CO3)C2 534643562 PJXJFDQYHKMXES-UHFFFAOYSA-N 381.436 2.578 0 50 GFAA COC(=O)c1cc(NC(=O)c2cccc(Cl)c2)c(=O)oc1/C=C/N(C)C 49581132 CSXVLISILLQSSS-BQYQJAHWSA-N 376.796 2.864 0 50 GFAA O=C(CCn1cnc2ccccc21)NC[C@H]1CCCN(c2noc(C3CC3)n2)C1 952983651 UNEGVNJMNQPRQQ-OAHLLOKOSA-N 394.479 2.720 0 50 GFAA O=C(CSc1ccncc1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccc1 1565529219 VSXFNXYNHZBCDZ-MSOLQXFVSA-N 381.501 2.823 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCC[C@H](c2nnc3ccccn23)C1 952967795 DKHIURZLIVYVFW-INIZCTEOSA-N 379.464 2.938 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@H]1CC12CCOCC2)c1ccc(Br)cc1 170066334 ZFCBUZYFESATAV-ZIAGYGMSSA-N 382.254 2.898 0 50 GFAA CCOC(=O)C[C@](C)(NC(=O)CCNC(=O)c1ccc(F)cc1F)C(C)C 170599342 YFCALQPXKRRFLM-IBGZPJMESA-N 384.423 2.569 0 50 GFAA Nc1nccc([C@H]2CCCN(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2)n1 192756252 IHILSTXMIGHCSO-NSHDSACASA-N 386.399 2.736 0 50 GFAA COc1ccc(CN2CCC[C@H](OCc3ccccn3)C2)cc1Cn1cncn1 1506396588 CQDKDAAZQLIZJR-NRFANRHFSA-N 393.491 2.911 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)c2cc3c(nc2O)CCCC3)n1 1506425052 LICDAYCGAMZZRJ-MRXNPFEDSA-N 386.452 2.605 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)Cc2cccc(C)c2)cc1OC 1529158646 HWHDBIOVOXJOMR-IFMALSPDSA-N 385.460 2.516 0 50 GFAA CCc1ccc(CN2C[C@H]3CN(Cc4ccc(C(=O)O)o4)C[C@]3(CO)C2)s1 1772805737 RLVXDZZBQRXJNK-JLTOFOAXSA-N 390.505 2.528 0 50 GFAA CNC(=O)CN(c1ccc(C23CC4CC(CC(C4)C2)C3)cc1)S(C)(=O)=O 5027819 QJAMXYFLUKVTII-UHFFFAOYSA-N 376.522 2.666 0 50 GFAA Cc1c(C(=O)NCc2cccnc2)sc2ncnc(NC[C@H]3CCCO3)c12 12048905 YZRMQWFJSUSQFX-CQSZACIVSA-N 383.477 2.916 0 50 GFAA COc1ccccc1OCc1cc(C(=O)N(CCO)Cc2ccccc2)no1 12058514 AAUSEZREVYEGQX-UHFFFAOYSA-N 382.416 2.897 0 50 GFAA CC12CN3CC(C)(CN(C1)C31C(=O)N(Cc3ccccc3)c3ccccc31)C2=O 19312994 DWJDGOVIFATAQU-UHFFFAOYSA-N 387.483 2.613 0 50 GFAA biogenic CCc1noc(-c2cn([C@@H]3CCN(C(=O)c4cc(Cl)ccc4F)C3)nn2)n1 169780497 YHYMQTGPIHXFTB-LLVKDONJSA-N 390.806 2.770 0 50 GFAA CCn1cc(C(=O)N2CCC[C@@]3(CN(Cc4ccc(C)cc4)CC[C@H]3O)C2)cn1 1857685676 OZHDQMNBTDAMGH-FYYLOGMGSA-N 396.535 2.701 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccc(C(F)(F)F)cc2)[C@H]1c1cnn(C)c1 1857721243 GKHIOQUEYLCITQ-IRXDYDNUSA-N 396.413 2.583 0 50 GFAA COC(=O)C(C)(C)NC(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857732291 KQTQOZJUMXIAJS-NSHDSACASA-N 379.844 2.765 0 50 GFAA Cc1ccc(C)c(OC[C@H](O)Cn2cnc3c(N4CCCC4)ncnc32)c1C 114215521 IVKGVUBXFVLRGG-QGZVFWFLSA-N 381.480 2.792 0 50 GFAA COCCCn1nccc1[C@H]1OCC[C@@H]1C(=O)N(C)Cc1ccc(F)c(F)c1 328602349 BGMSPZMWHQLQRS-KXBFYZLASA-N 393.434 2.934 0 50 GFAA C[C@@H](NC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1)[C@@H]1CCOC1 363421145 BHOZEGXCNZDOBV-GDBMZVCRSA-N 379.888 2.623 0 50 GFAA O=C(NC[C@@H](O)c1cccc(Br)c1)c1c[nH]nc1-c1cccnc1 802314357 CCHMDQCLLJNHJT-OAHLLOKOSA-N 387.237 2.698 0 50 GFAA COCc1csc(NC(=O)N2CC(O)(c3cccc(Br)c3)C2)n1 856843065 WQJZYSXOLVCZKC-UHFFFAOYSA-N 398.282 2.787 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)CCN2c3ccccc3CC[C@H]2C)C1 952852906 ONBXAFBAQQGBRQ-LSBZLQRGSA-N 384.480 2.898 0 50 GFAA CN1C[C@@H]2CN(c3cc(-c4cccnc4)nc4ncnn34)C[C@@H]2[C@H]1c1ccccc1 1875260720 WUEJVJZOQLWMIV-XQBPLPMBSA-N 397.486 2.925 0 50 GFAA Cc1ccc(CNC(=O)c2cccc(CN3CCCCC3)c2)c(-n2cncn2)n1 1875265929 YDCUMXMXULKYHC-UHFFFAOYSA-N 390.491 2.887 0 50 GFAA Cc1ccc(-c2csc(=O)n2CC(=O)N2C[C@H]3CCCC[C@@]3(CN)C2)cc1 1875287429 KHSATXRXUFYUNY-DYESRHJHSA-N 385.533 2.863 0 50 GFAA CCn1nc2c(c1C(=O)NCc1ccc(-n3ccnc3C)nc1)C[C@H](C)O[C@@H]2C 1875314454 YJSHGNUEEICLAN-UONOGXRCSA-N 394.479 2.744 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(-c2ccncc2)c(F)c1 1875403148 RFOVBRNXCSGOCR-JSNMRZPZSA-N 380.423 2.654 0 50 GFAA COC(=O)c1nccc(N2CCC(C3(NC(=O)C[C@H](C)C(C)C)CC3)CC2)n1 1775991206 JMRXTCUNEADXII-HNNXBMFYSA-N 388.512 2.811 0 50 GFAA CCCC[C@@H]1CN(C(=O)CN2C(=O)COc3ccc(C)cc32)C[C@H](C2CC2)O1 2100539763 XHIYBDCNKYNMPU-YLJYHZDGSA-N 386.492 2.917 0 50 GFAA Cc1ccc(OCCc2nnc(NC(=O)[C@@]3(C)CCC(=O)O3)s2)cc1C 2100554932 IIQIHPBCDIEELK-GOSISDBHSA-N 375.450 2.811 0 50 GFAA O=C(/C=C/c1cn(Cc2ccccc2)nn1)N1CCN[C@@H](c2cccc(F)c2)C1 2325700882 JEKROGYEDNMKAC-LCCNJJIFSA-N 391.450 2.652 0 50 GFAA CC(C)(C)[C@@H](C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12)N1CCCC1=O 2325813187 UOVDRIIQPUROBM-GOSISDBHSA-N 383.492 2.536 0 50 GFAA COC(=O)c1cc(C(=O)NCc2ccsc2C(=O)O)ccc1Br 2325866212 DKFZTSOXQYOEKW-UHFFFAOYSA-N 398.234 2.925 0 50 GFAA CCOc1ccccc1NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 816822 CMPPUZPIWRULJL-UHFFFAOYSA-N 392.477 2.807 0 50 GFAA CCOc1ccc(C(=O)NC(=S)Nc2ccccc2C(N)=O)cc1Cl 1129600 GKWIUOFLSRAKOC-UHFFFAOYSA-N 377.853 2.964 0 50 GFAA CCCNS(=O)(=O)c1ccc(OCC(=O)NC2CCCCC2)c(Cl)c1 2877008 ZUDMGRMNWDHHDA-UHFFFAOYSA-N 388.917 2.856 0 50 GFAA O=C(c1ccc2ccccn12)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 2356155357 DGKJCOPPJPYHLR-QFIPXVFZSA-N 375.428 2.829 0 50 GFAA COc1nc2c(cc1C(=O)N[C@H]1CC[C@H](OC)CC1)C(=O)N(C1CCCC1)C2 2356158425 JXWMKIUZOGOIIA-CTYIDZIISA-N 387.480 2.676 0 50 GFAA CCc1ccccc1NC(=O)c1cccc(NC(=O)Cn2cccnc2=O)c1 55211704 MRCQGZXRYMTXHU-UHFFFAOYSA-N 376.416 2.697 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)CC2=CSC3=NCCCN23)C[C@H]1O 101859806 JGBOFWGCSAEVQP-HUUCEWRRSA-N 377.535 2.773 0 50 GFAA Cc1nn(C)c(C)c1CN1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)CC1 115388046 KDYJYVIEJXOVJW-UHFFFAOYSA-N 394.441 2.943 0 50 GFAA CCn1nc(C)c(CN(CCOC)Cc2cc(OC)c3c(c2)OCO3)c1C 55327421 XOLVQVWITIZWLK-UHFFFAOYSA-N 375.469 2.906 0 50 GFAA CC(C)CN(C)C(=O)C[C@H]1C(=O)NCCN1Cc1cccc(C(F)(F)F)c1 55327993 JRMBHCNETVXVPV-INIZCTEOSA-N 385.430 2.510 0 50 GFAA Cc1nc(CCNC(=O)c2cnn(-c3ccccn3)c2C)nc2c1CCCC2 65502779 KRGWNQJXBGPNMP-UHFFFAOYSA-N 376.464 2.525 0 50 GFAA Cc1cccc(CNC(=O)c2ccccc2NC(=O)[C@H](C)N2CCCC2=O)c1 55154971 WKVBFKQUDFFERV-INIZCTEOSA-N 379.460 2.874 0 50 GFAA FC(F)(F)c1nnc(N2CCN(C[C@@H]3CCCN4CCCC[C@H]34)CC2)s1 63855270 BBFHDIWRTHAGQG-UONOGXRCSA-N 389.491 2.943 0 50 GFAA CC[C@@H](C(=O)NCCc1cc(=O)[nH]c(C)n1)n1cc(C(C)=O)c2ccccc21 65405314 XPKKWQXMXMPJJP-SFHVURJKSA-N 380.448 2.546 0 50 GFAA CCS[C@@H](C)c1noc(CN2C[C@@H](C(=O)N(C)C)Oc3ccccc32)n1 229892907 ROUITSMQDHAZPD-WFASDCNBSA-N 376.482 2.740 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C[C@@H]2OCCc3ccccc32)cc1 129658424 DMDPXNGJHNGCKK-UZLBHIALSA-N 387.501 2.978 0 50 GFAA CCc1cc(C(=O)N(C2CC2)[C@@H]2CCS(=O)(=O)C2)c2c(C(C)C)noc2n1 328824777 SFHANYSPHTZOSK-CQSZACIVSA-N 391.493 2.700 0 50 GFAA CN1C(=O)[C@](CC(=O)N2CCC(CN)CC2)(Cc2ccccc2)c2ccccc21 71415702 BTDUNJXQEMIOHM-DEOSSOPVSA-N 391.515 2.731 0 50 GFAA NC(=O)[C@H](NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1 363663834 GSLYTCAFJGNPHA-HNAYVOBHSA-N 384.455 2.568 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1 173348182 WZGRWVPKICOBTL-QFBILLFUSA-N 379.460 2.629 0 50 GFAA Cc1nc(CC2CCN(C(=O)NCc3cccc(-n4cccn4)c3)CC2)no1 426383807 KDAOFJHMLZCFKE-UHFFFAOYSA-N 380.452 2.728 0 50 GFAA Cc1ccc(F)c(CNC(=O)N2CCN(c3ncnc(C)c3C)CC2)c1F 426739102 TXGMQYXKYVFIGZ-UHFFFAOYSA-N 375.423 2.712 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@@H](C)NC(=O)Cn1c(=O)oc2ccccc21 91871767 JIMVRROYEJEJSP-CYBMUJFWSA-N 389.415 2.632 0 50 GFAA CN1CC2(CCN(C(=O)Cc3cccnc3)CC2)C[C@H](c2ccccc2)C1=O 95373234 TXSPOFCEVFBDPC-HXUWFJFHSA-N 377.488 2.879 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC[C@H](c3cccc(C(=O)O)c3)C2)c1C 95361198 XCYJEZGFIDAYPV-SFHVURJKSA-N 383.448 2.807 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cncn1-c1ccc(F)cc1 179396736 WOCGZMJNRKMLFV-LJQANCHMSA-N 392.434 2.932 0 50 GFAA CCOc1ccccc1CCCNC(=O)c1ccc(N2CC(=O)NC2=O)cc1 91656561 KCDJQDABJNTGOM-UHFFFAOYSA-N 381.432 2.504 0 50 GFAA O=C1CC[C@@]2(CCCN(Cc3nnc(C4CC4)o3)C2)CN1Cc1ccccn1 91645678 NOWJOKCCWURSDB-OAQYLSRUSA-N 381.480 2.747 0 50 GFAA Cc1c(CC(=O)N[C@H]2CCOC2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 95522131 CNJASXLYNNSOES-KRWDZBQOSA-N 384.451 2.951 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)Cc2cc(C)no2)C1 95519944 UPSYHXQJJKKCLT-SFHVURJKSA-N 385.508 2.947 0 50 GFAA N[C@@H]1CC[C@H](NC(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)C1 95497303 OGWXOWJSUSOFMK-MOPGFXCFSA-N 394.519 2.735 0 50 GFAA COc1cccc2[nH]cc(CC(=O)NCC3(N4CCOCC4)CCCCC3)c12 179948004 KMGSFMVQKQIMGI-UHFFFAOYSA-N 385.508 2.870 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95525666 MNOAAIHIXYPWOG-IBGZPJMESA-N 376.460 2.981 0 50 GFAA COCCN(Cc1nccs1)C(=O)c1cnc(-c2cccs2)nc1O 91906834 KSEXMZYAFYOWCQ-UHFFFAOYSA-N 376.463 2.656 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(CCOC)CC2)cc1C(F)(F)F 95522746 VCJTUFNFHAPYDK-UHFFFAOYSA-N 375.391 2.900 0 50 GFAA O=C(NCC(=O)N1CCC[C@H](c2ncc[nH]2)C1)c1cc(Cl)ccc1Cl 95517279 CWYKVWJGOBACAP-NSHDSACASA-N 381.263 2.853 0 50 GFAA CCCc1nnsc1C(=O)NCc1cc2n(n1)CCN(C1CCCCC1)C2 91819117 GZRXNAGPNIVDAG-UHFFFAOYSA-N 388.541 2.765 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252527713 DESAFWQTYPEIAN-SVMVAKDDSA-N 383.492 2.533 0 50 GFAA Cc1ccc(N2CCCC2=O)c(C(=O)NCc2cccc(OCC(=O)O)c2)c1 299748346 HAUVHNVNEICBDG-UHFFFAOYSA-N 382.416 2.515 0 50 GFAA Cc1cccc(-c2noc([C@H](C)NC(=O)N3CCC(c4nc[nH]n4)CC3)n2)c1 534587752 OXPRXWMDEYJEON-ZDUSSCGKSA-N 381.440 2.813 0 50 GFAA CS(=O)(=O)N1CCC[C@H](c2nnc3sc(-c4ccc(Cl)cc4)nn23)C1 825554383 HVKJGAXVOQRQNI-NSHDSACASA-N 397.913 2.645 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(Oc2ccccc2)C1 584895661 KYVKGBNTKTUIOU-UHFFFAOYSA-N 379.460 2.895 0 50 GFAA CC(C)=CCN1CCC2(CC[C@H](CNC(=O)N(C)Cc3ncc[nH]3)O2)CC1 584884438 JSFKCAFMTPFRJT-QGZVFWFLSA-N 375.517 2.531 0 50 GFAA Cc1n[nH]c(C)c1CCNC(=O)[C@H]1CC(=O)N(c2ccc(OC(C)C)cc2)C1 670453421 REYXVGAJMPPXAB-INIZCTEOSA-N 384.480 2.526 0 50 GFAA COCCc1noc([C@@H]2CCCCN2Cc2cc3c(cc2OC)OCO3)n1 952865834 YFCHWHXJDLMDIZ-AWEZNQCLSA-N 375.425 2.723 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)COCc1nc2ccc(F)cc2[nH]1 952980140 WHQKBJQJGAKQHP-UHFFFAOYSA-N 384.411 2.536 0 50 GFAA COCCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1[nH]c3ccc(Cl)cc3c1C)C2 1565507401 SYYVBIBMAKJCGI-HIFRSBDPSA-N 389.883 2.839 0 50 GFAA Cc1cc(OC[C@H](O)CNC(=O)/C=C/c2cc(CO)cs2)ccc1Cl 952966911 HIWMFWKTBJEGEW-LYKUJDHUSA-N 381.881 2.772 0 50 GFAA COCC(=O)Nc1cc(NC(=O)[C@H](c2ccc(C)cc2)N(C)C)ccc1OC 952964339 LKRXHFAJQCCAPN-FQEVSTJZSA-N 385.464 2.830 0 50 GFAA O=C(NCc1cccc2c1OC(F)(F)O2)Nc1ccc2c(c1)C(=O)NCC2 1476291525 ORLXEUGRUAGMER-UHFFFAOYSA-N 375.331 2.616 0 50 GFAA Cc1cc(C)c(N2CC[C@H](NS(=O)(=O)c3ccccc3F)C2=O)c(C)c1 188624964 BJBTUHJFDUQJCN-INIZCTEOSA-N 376.453 2.835 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)N2CCC(c3ccncc3)CC2)CC1=O 192273360 UWZJEKLYPSXNPE-GOSISDBHSA-N 379.460 2.849 0 50 GFAA C[C@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1nnnn1C1CC1 193018977 ZOYTWEWFNSLNBZ-JTQLQIEISA-N 395.389 2.769 0 50 GFAA CCS(=O)(=O)C1CCN(CC(=O)Nc2cccc(Cl)c2Cl)CC1 193229126 WGBHUYDLYPMYNZ-UHFFFAOYSA-N 379.309 2.831 0 50 GFAA O=C(c1ccccc1SCc1ccc(F)cc1)N1CC[C@@H](CO)[C@@H](O)C1 1616077771 RSHCHFQGFKSTFX-YJBOKZPZSA-N 375.465 2.933 0 50 GFAA CC1=CC2(CCN(C(=O)[C@H](C)N(c3ccccc3)S(C)(=O)=O)CC2)OCC1 1704338698 XJJSXRMVNPEFEQ-KRWDZBQOSA-N 392.521 2.569 0 50 GFAA O=C(C1CC1)N1CCC(N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)CC1 1704297995 BHLGKLMSUMPYMK-GCJKJVERSA-N 379.504 2.783 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(NCCOC)noc2-c2ccc(Cl)cc2)CCN1 1704329690 AUJAYOUFNSBHCY-OAHLLOKOSA-N 392.887 2.877 0 50 GFAA CSc1ccc(NC(=O)N2CCCN(C(=O)c3cc(C)n(C)n3)CC2)cc1 1775981328 KGVMMADYSCGVJS-UHFFFAOYSA-N 387.509 2.830 0 50 GFAA CCOC(=O)N1CCC(N2CCCN(C(=O)c3cccc4cc[nH]c34)CC2)CC1 1775981518 ACWAPEUKEKKXLH-UHFFFAOYSA-N 398.507 2.937 0 50 GFAA Cc1c2c(=O)n(-c3ccc(Cl)cc3)c(O)nc2nc(=O)n1-c1ccccc1 1776111438 XEYDDPZCVMZLKI-UHFFFAOYSA-N 380.791 2.599 0 50 GFAA Cc1ccc(-c2nnc(CN3CCCN(C(=O)CC4CCCC4)CC3)o2)n1C 1772710897 SZMIJXUHSSMBJQ-UHFFFAOYSA-N 385.512 2.998 0 50 GFAA CN1CCC[C@@H](C(=O)N2CCCN(C(=O)Nc3ccc(Cl)cc3)CC2)C1 1775981525 AFCXBHWMCTZQHR-OAHLLOKOSA-N 378.904 2.748 0 50 GFAA c1cncc([C@@H]2CCCCN2c2nc3nonc3nc2N2CCSCC2)c1 11937037 ODDOOWWHCTZFGO-AWEZNQCLSA-N 383.481 2.693 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(Cc3cn(C)c4ccccc34)C2)CC1 11938551 FNGAQVHDYCUWIB-LJQANCHMSA-N 382.552 2.945 0 50 GFAA CCn1cc(C(=O)Nc2ccc(Cn3cncn3)cc2)c(=O)c2ccc(C)nc21 12322519 CIXUZJUOJLANFW-UHFFFAOYSA-N 388.431 2.617 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)NCc2cccc(-c3ccccc3)c2)nn1 12595229 XHDGGZYZLAGGGY-UHFFFAOYSA-N 391.475 2.744 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@H](CNC(=O)c3ccc(F)cc3)C2)nc(N)n1 12597261 OIGXAAJNLGBKPA-CQSZACIVSA-N 399.470 2.604 0 50 GFAA CCN1CCN(C2(C(=O)N(C)CC[C@H]3CCCCO3)Cc3ccccc3C2)CC1 19740986 XLZVUQOSSMSELJ-JOCHJYFZSA-N 399.579 2.579 0 50 GFAA COc1cc(-c2nc(CNC(=O)c3cnn4ccccc34)c(C)o2)ccc1O 1857675687 CIHCFGJXYRZYQB-UHFFFAOYSA-N 378.388 2.942 0 50 GFAA CC[C@@]12COC(=O)N1CCN(C(=O)c1ccccc1OC(F)(F)C(F)F)C2 1857679057 FBMRUFACOLMRMD-MRXNPFEDSA-N 390.333 2.980 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CCC(F)(F)F)C[C@]23CC[C@H]1O3)c1ccc(F)cc1 1857719826 VLUBGROCOVBAIP-BVIKNXMNSA-N 386.389 2.987 0 50 GFAA O=C(C1CCN(c2nc3ccc(Cl)cc3o2)CC1)N1C[C@H]2C[C@@]2(CO)C1 1857741511 WDSKWPHYLBJELU-YJYMSZOUSA-N 375.856 2.538 0 50 GFAA C[C@@H](O)C1CCN(C(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)CC1 118731368 GOVWWNRARWOAMJ-HIFRSBDPSA-N 385.430 2.936 0 50 GFAA CCOc1ccccc1CN1CCC(n2cc(C(=O)N3CCCC3)nn2)CC1 11787005 IHANECGWKYBCMC-UHFFFAOYSA-N 383.496 2.750 0 50 GFAA CCOC(=O)N1CCC(NC(=O)CN2CC[C@H](C(F)(F)F)C(C)(C)C2)CC1 240551577 GUTMNTILCZNSJO-AWEZNQCLSA-N 393.450 2.634 0 50 GFAA CC1(C)CN(Cc2ccc(-c3nc([C@@H]4CCCNC4)cc(=O)[nH]3)cc2)CCO1 23368612 RWTKDDMBLXIYQB-GOSISDBHSA-N 382.508 2.515 0 50 GFAA Cc1sc2ccc(Cl)cc2c1S(=O)(=O)N1CC[C@H](N2CCNCC2)C1 262350102 UIWPNOMJNQDYRQ-AWEZNQCLSA-N 399.969 2.531 0 50 GFAA CCOC(=O)c1cnc2cc(C3CCN(C(=O)OC(C)(C)C)CC3)nn2c1O 390822489 ASLWZCCWFUJDFQ-UHFFFAOYSA-N 390.440 2.726 0 50 GFAA in-vitro CN=[S@]1(=O)CCC[C@@]2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1 1875396180 YCKMASXQLVUKIT-MQNRADLISA-N 375.416 2.967 0 50 GFAA COc1ccc(/C=C(\C)CNC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)cc1 886048033 IAZOOVPUXCWELE-MPBOFQORSA-N 382.508 2.950 0 50 GFAA O=C1[C@@H](NS(=O)(=O)c2ccccc2)CCN1c1ccccc1C(F)(F)F 1309411824 RPJCFWNCXZTYMF-AWEZNQCLSA-N 384.379 2.789 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)O)CN(Cc1cnc(-c3ncccn3)s1)C2 2325780272 UODATLLPOKISRH-MRXNPFEDSA-N 382.445 2.793 0 50 GFAA Cn1ncc(CNC(=O)CCCc2ccccc2Br)c1C(=O)O 2325812710 ASYHBKZJHLWIBM-UHFFFAOYSA-N 380.242 2.520 0 50 GFAA O=C(NCc1cccc2c1CCNC2)c1ccc(=O)n(-c2ccc(F)cc2)c1 2325856523 SQTJWIGLKLUEBH-UHFFFAOYSA-N 377.419 2.552 0 50 GFAA CN(C)c1ccccc1CNC[C@@H]1C[C@H](C(=O)N[C@@H](C2CC2)C(F)(F)F)CO1 2332237617 DZLXUICVUPJUKT-BQFCYCMXSA-N 399.457 2.704 0 50 GFAA CC(=O)N(Cc1ccco1)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1=O 715134 JBDRWVRGEDGSIT-OAHLLOKOSA-N 391.221 2.723 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2cccc(Cl)c2)S(C)(=O)=O)c1 821131 CEWJBFXKIFCODG-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA Cc1ccccc1N(CC(=O)NCc1cccnc1)S(=O)(=O)c1ccccc1 882612 MGAORVBUJOSRTH-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA COC(=O)C1=CN(C)C=C(C(=O)OC)C1c1cccc(OC)c1OC(C)C 1074886 AYQWWZDZNJDEMA-UHFFFAOYSA-N 375.421 2.625 0 50 GFAA CCC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)c2ccco2)cc1 2163544 BUBLODFABGWBOT-UHFFFAOYSA-N 376.463 2.629 0 50 GFAA O=C(NCc1ncnn1-c1ccccc1)c1cnc(S)n1-c1ccccc1 225628489 OIZQTOXJPNWRGB-UHFFFAOYSA-N 376.445 2.672 0 50 GFAA O=C1CCCN1CC[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCNC3 65531794 RLUFYKDTBWYWKL-AWEZNQCLSA-N 385.537 2.708 0 50 GFAA COc1ccc(CN2CCN(Cc3cc(C(C)C)[nH]n3)C[C@@H]2CCO)c(F)c1 22914120 TXWXHOQTGWBSGJ-SFHVURJKSA-N 390.503 2.750 0 50 GFAA O=C(CN1C[C@@H]2CCC[C@H]21)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 230172194 XEGBLBTVPANGKR-XJKSGUPXSA-N 383.414 2.965 0 50 GFAA Cc1nc2sc3c(c2c(=O)n1NC(=O)c1ccn(C(F)F)n1)CCCC3 2778789 BEVVMZMMRPIUGV-UHFFFAOYSA-N 379.392 2.621 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 12443338 YSZQGTCOSLLRPG-NRFANRHFSA-N 387.430 2.727 0 50 GFAA CC(C)c1noc2ncc(C(=O)N3CCC[C@H](c4nn(C)cc4C(=N)O)C3)cc12 328606379 RIEVFXAWJLPKTP-LBPRGKRZSA-N 396.451 2.983 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)C1 151645786 IOJWBCMGZRLVNA-KRWDZBQOSA-N 397.479 2.637 0 50 GFAA O=C(N[C@H]1CC(=O)N(C2Cc3ccccc3C2)C1)c1cc2cc(F)ccc2[nH]1 72153862 OOMFKAHYECXXJL-KRWDZBQOSA-N 377.419 2.805 0 50 GFAA COc1cccc(-c2cnc([C@@H]3CCCN3C(=O)c3cc4n(n3)CCO4)[nH]2)c1 368229715 UTPGDZBJBPDABT-KRWDZBQOSA-N 379.420 2.652 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCNC[C@@H]1c1cccc(Cl)c1 261862485 SIWATISNHCKQPZ-GOSISDBHSA-N 398.898 2.500 0 50 GFAA Cc1ncc(S(=O)(=O)N2CCC3(CC2)C[C@@H]3N(C)Cc2nccs2)s1 374745146 UNTSTDBNZKCAMG-ZDUSSCGKSA-N 398.579 2.583 0 50 GFAA NC(=O)c1ccc2cccc(OCc3nc(-c4ccc5c(c4)OCO5)no3)c2n1 71749523 ZLFFSPNPOGMBOE-UHFFFAOYSA-N 390.355 2.691 0 50 GFAA COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]1(C)CC1(Cl)Cl 130259163 AANOQNYJWGJELJ-MRXNPFEDSA-N 387.263 2.690 0 50 GFAA C[C@]1(O)CCCC[C@@H]1[C@H]1CCCN1c1cc(S(=O)(=O)N2CCCC2)ccn1 284512686 DXCDCXKMAIRJNU-GGPKGHCWSA-N 393.553 2.776 0 50 GFAA CCCC(=O)c1cn(CC(=O)N2C[C@@H]3CCC[C@H](C2)C(=O)N3)c2ccccc12 221239555 LKPJYCPOSAHEKY-CVEARBPZSA-N 381.476 2.751 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 226566150 FFFCLQNIVMMTCY-NCOADZHNSA-N 385.851 2.868 0 50 GFAA CCc1nc(CCNC(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)no1 97515114 YVZFMNWXHWRREC-UHFFFAOYSA-N 379.848 2.788 0 50 GFAA N[C@@H]1CCCN(C(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)C1 95528513 WZNDGDOYKGFJSL-LJQANCHMSA-N 394.519 2.688 0 50 GFAA CCCc1cnc(C)nc1N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C(=O)O)C1 96131474 FNFLGBQRLRGAOJ-UGKGYDQZSA-N 380.492 2.761 0 50 GFAA CC(=O)N1CCO[C@H](CNC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 95522983 PMQDEBKONMNTGF-LLVKDONJSA-N 379.766 2.728 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)N(C(=O)c1cnn3ccccc13)C2 95379480 JGPDVATWLFLNHR-DLBZAZTESA-N 379.464 2.676 0 50 GFAA CCCc1ccc(S(=O)(=O)N2CCN(Cc3ncc(C)s3)CC2)cc1 180412491 FKSVCEPHPZAWEJ-UHFFFAOYSA-N 379.551 2.911 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95510934 TWTJPSHYYDQBCK-QGZVFWFLSA-N 382.489 2.895 0 50 GFAA COc1ccc([C@@H](NC(=O)Cc2nc3ccccc3[nH]2)[C@H]2C[C@@H](O)C2)cc1F 244899466 ZKKPNIZKFOPQLQ-HKZYLEAXSA-N 383.423 2.882 0 50 GFAA CC[C@H](C(=O)Nc1ccccc1CCC(=O)NC)N1Cc2ccccc2C1=O 952963826 KYNFIXGDAYDERF-LJQANCHMSA-N 379.460 2.738 0 50 GFAA Oc1cccc(CN[C@@H]2C3CN4CCN(C3)CC2(c2ccccc2)C4)c1Cl 952974217 INKZDYCVJVRKDW-PDRFFQIWSA-N 383.923 2.703 0 50 GFAA Cc1occc1-c1nnc(SC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1N 170635882 VFOCUMVERAONJB-GFCCVEGCSA-N 379.486 2.909 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NCC1(O)CCCCC1 170649095 CYKYATCHHDSLBJ-UHFFFAOYSA-N 380.901 2.699 0 50 GFAA CC[C@H](C)C(=O)Nc1cccc(CNC(=O)[C@H]2CC23CCS(=O)(=O)CC3)c1 170600209 LRAMVDKHWQSYRU-WMLDXEAASA-N 392.521 2.502 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CCN(c3nc(C)cs3)[C@@H](C)C2)cc1 736580429 IZUCWSMUZLVOJM-HNNXBMFYSA-N 384.505 2.605 0 50 GFAA CCOCC(=O)N1CCC(C(=O)Nc2ccnn2[C@@H](C)c2ccccc2)CC1 1529113017 AYDCQPKLMOFKJQ-INIZCTEOSA-N 384.480 2.706 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccncc1)c1ccc(-c2noc(C3CC3)n2)cc1 1529158618 GPJOQRBTDGDBPJ-RTBURBONSA-N 390.443 2.997 0 50 GFAA O[C@H]1CCCN(c2ccnc(N3CCC4(CC3)OCCc3ccsc34)n2)C1 1704308753 JKNVBGHGUSPTGB-INIZCTEOSA-N 386.521 2.568 0 50 GFAA COc1cccc(-c2cc(CNc3cncc(C(=O)N4CCCC4)n3)on2)c1 1704330071 VWRAUGHSOQKJHI-UHFFFAOYSA-N 379.420 2.988 0 50 GFAA O=C1OCC2(CCN(C(=O)[C@@H]3CCc4sc(-c5ccncc5)nc4C3)CC2)O1 1772810455 HCKDHGXWLOAEII-CQSZACIVSA-N 399.472 2.838 0 50 GFAA COc1ccc(NC(=O)N2CCCN(C(=O)CCc3ccncc3)CC2)cc1 1775977944 KTKWJUJTWMXOEH-UHFFFAOYSA-N 382.464 2.789 0 50 GFAA CSCCCN1CCC[C@H](CNS(=O)(=O)c2cccc3cccnc23)C1 11701850 BJVRNCYHOMNWIJ-MRXNPFEDSA-N 393.578 2.978 0 50 GFAA CC(=O)N1CCC(C(=O)N(CCc2ccccc2)C[C@H]2CCCN(C)C2)CC1 11932767 VAUBCYFCZHBHTF-NRFANRHFSA-N 385.552 2.658 0 50 GFAA CC(C)S(=O)(=O)c1ncc(CN2CCCCO2)n1Cc1ccccc1F 12445344 FNNYGONUVCKDER-UHFFFAOYSA-N 381.473 2.780 0 50 GFAA CC(=O)NC[C@@H]1CCCN(C(=O)c2cc(COc3c(C)cccc3C)on2)C1 12582993 WQMJECJDRMRXPE-KRWDZBQOSA-N 385.464 2.859 0 50 GFAA CCN(CC)CCN(CC)C(=O)CCc1nnc(-c2ccc3c(c2)OCO3)o1 12590460 XHWJEWDSDHYQBM-UHFFFAOYSA-N 388.468 2.588 0 50 GFAA COCCN1C(=O)N(C)C(=O)C12CCN(Cc1ccc(-c3ccco3)cc1)CC2 14537149 YDVXCIDIZYXTTL-UHFFFAOYSA-N 397.475 2.822 0 50 GFAA COCCSc1nnc(C2CCN(Cc3ccc4c(c3)OCO4)CC2)n1C 14992009 MXNWVNABYZHZHN-UHFFFAOYSA-N 390.509 2.662 0 50 GFAA Cn1c(CCNC(=O)/C=C/c2cccs2)nnc1SC[C@H]1CCCO1 14995286 TUKGHLBLVOQDGL-KTRBRXNASA-N 378.523 2.520 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)N2CCN(c3ccccc3F)CC2)cc1 16552679 YKFMZKUBAYXYOL-UHFFFAOYSA-N 391.468 2.550 0 50 GFAA COc1ccc(CNC(=O)C2(N3C[C@H](C)O[C@H](C)C3)Cc3ccccc3C2)cc1 19224798 CARIRQHQOQPCDH-HDICACEKSA-N 394.515 2.958 0 50 GFAA O=C(CCc1ccccc1)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169749784 ZMJGZOXUYQWBRQ-UHFFFAOYSA-N 376.460 2.899 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)CCCn2cccn2)CC1 1857683739 MPLSFZPAQSGUSF-UHFFFAOYSA-N 389.477 2.514 0 50 GFAA CCCn1ncc(CN2[C@H]3CC[C@@H]2C[C@]2(C3)CN(c3cnccn3)CCO2)c1C 1857731979 WMYTYRXLENYQNA-XVAYZXCPSA-N 396.539 2.794 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N3CC[C@H](O)[C@](CC4CC4)(C(=O)O)C3)c2)n1 1875242438 SZPNHFPICCHWOK-SIKLNZKXSA-N 397.475 2.567 0 50 GFAA CS(=O)(=O)c1ccccc1CNC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 413545773 BBTCKEAMOHYKBM-CQSZACIVSA-N 396.415 2.691 0 50 GFAA CC[C@]1(C(=O)N2CCCCC2)C[C@H]2CC[C@@H]1N2S(=O)(=O)c1c(C)noc1C 1704313420 MXNUCENVANXTEX-GJYPPUQNSA-N 395.525 2.626 0 50 GFAA O=C(O)c1ccc2c(c1)N(C(=O)c1cccc(NC(=O)[C@@H]3CCCO3)c1)CC2 908049105 ZJMQDLWGLNVBIY-SFHVURJKSA-N 380.400 2.705 0 50 GFAA Cc1ccc(N2C(=O)CCC2=O)cc1NC(=O)C[C@H](n1cccn1)C(F)(F)F 952885664 RSZZGYYQKCAYRY-AWEZNQCLSA-N 394.353 2.977 0 50 GFAA NC(=O)Cn1ncc(N2CCC[C@H]2c2cc(F)ccc2Cl)c(Cl)c1=O 1875294154 BRVMQOUUDPIYQB-LBPRGKRZSA-N 385.226 2.516 0 50 GFAA CCCc1ccc(CN2CCN(CCNC(=O)c3ncccc3F)CC2)cc1 1875329564 CWLMPZRNOFVURP-UHFFFAOYSA-N 384.499 2.721 0 50 GFAA COCn1ncc(C)c1CN[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875398668 AXZNVBVUJQBZCX-YFVAEKQCSA-N 395.507 2.588 0 50 GFAA Cc1nn(CC(F)(F)F)cc1C(=O)N1CC[C@H](CC(=O)O)C(F)(F)CC1 1875300397 BLOJIVUOUHNMDM-SNVBAGLBSA-N 383.317 2.716 0 50 GFAA Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)Cc2cccc(C(=O)O)c2)C1 887557515 RMYBQHSMAXTHQQ-INIZCTEOSA-N 387.505 2.673 0 50 GFAA O=C1N[C@@H](CC(=O)N2CCCN(c3nc4ccccc4o3)CC2)c2ccccc21 2100534386 GERZINGTQCCUFT-SFHVURJKSA-N 390.443 2.741 0 50 GFAA Cc1ccc2oc(CNc3cc(N4C[C@H](O)C[C@@H]4CN(C)C)ncn3)cc2c1 2325785627 GKRRTFCAEWGLSV-IAGOWNOFSA-N 381.480 2.645 0 50 GFAA C[C@@H](CC(=O)Nc1cccc(NC(=O)c2cc3ccccc3n2C)c1)NC(N)=O 2325874261 GBVGAGSLECPWEL-ZDUSSCGKSA-N 393.447 2.816 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCCCC1)c1ccccc1Br 869409 NTTPVSDUVORHBP-UHFFFAOYSA-N 389.315 2.618 0 50 GFAA O=C(CN(c1ccccc1F)S(=O)(=O)c1ccccc1)NCc1ccccn1 882390 KNOKGLQROGGTSU-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA O=C1CCC(=O)N1c1ccc(-c2nc3ccc(N4C(=O)CCC4=O)cc3[nH]2)cc1 1234961 LIKMMMOLHCUBTC-UHFFFAOYSA-N 388.383 2.537 0 50 GFAA C[C@]1(O)CCOC2(CCN(C(=O)c3cnc(Nc4ccccc4)nc3)CC2)C1 2356147078 GXHTUJLAWLZTBC-FQEVSTJZSA-N 382.464 2.756 0 50 GFAA CCOc1ccccc1CCCNC(=O)c1ccccc1N(C)S(C)(=O)=O 10110978 AKUVMYIMBUKJQE-UHFFFAOYSA-N 390.505 2.844 0 50 GFAA CC(C)C[C@H](CCC(=O)N1C[C@H](C)O[C@H](C)C1)C(=O)N1C[C@H](C)O[C@@H](C)C1 246385751 AMVBREKNZILUQJ-PJVZLEMVSA-N 382.545 2.701 0 50 GFAA COC(=O)c1ccc(CN(C)Cc2nnc(SC)n2C[C@H]2CCCO2)cc1 55052967 AIGNRDUZYYGIEO-MRXNPFEDSA-N 390.509 2.598 0 50 GFAA Cc1c(C)n(CCCN2CCOCC2)c2ncn3nc(-c4ccco4)nc3c12 20622190 MULYSWPZORGEQC-UHFFFAOYSA-N 380.452 2.678 0 50 GFAA COC(=O)C[C@@H]1CC(=O)[C@H]2C(=O)c3c(OC)ccc(Br)c3[C@@H]2C1 55529253 KIBDKRPJUGKECL-UTEYVOQOSA-N 381.222 2.896 0 50 GFAA CCC(=O)N(Cc1ccc(OC)cc1)[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1=O 100560713 LRGOVSMXMNWQGQ-LJQANCHMSA-N 396.443 2.775 0 50 GFAA CC[C@H](C)N1CCc2c(c(C(=O)N3CCOCC3)nn2Cc2ccccc2)C1 20908565 JABCPQCYCNPBFT-KRWDZBQOSA-N 382.508 2.560 0 50 GFAA Cc1oc2cc3oc(=O)c(CCC(=O)N4CCC[C@@H]4C(N)=O)c(C)c3cc2c1C 32124186 NRQIKEHHMWGULM-QGZVFWFLSA-N 396.443 2.873 0 50 GFAA biogenic C[C@@H](c1ccc(F)cc1)N(C)S(=O)(=O)c1cccc(C(=O)NCCF)c1 215856000 YNKYFIAPOJKVAD-ZDUSSCGKSA-N 382.432 2.907 0 50 GFAA Cc1ccnc(C2CCN([C@H](C)C(=O)Nc3ccc4c(c3)OCCO4)CC2)n1 363789378 FKDMRIQGWYEYCJ-OAHLLOKOSA-N 382.464 2.763 0 50 GFAA O=C(N[C@@H]1C[C@H]1C1CCCCC1)N1CCC(S(=O)(=O)N2CCCC2)CC1 369108008 YPGPDAYTFYOIGU-ZWKOTPCHSA-N 383.558 2.555 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCCC(=O)O)(Cc2ccccc2)c2ccccc21 71758871 XJQCRUQJYODUDT-QFIPXVFZSA-N 380.444 2.515 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccncc3)nc2NCCCC(C)(C)CO)C1 71711993 JNEXIRJAWUKOLE-UHFFFAOYSA-N 383.496 2.654 0 50 GFAA CCOCCn1c(=O)[nH]c2cc(C(=O)NCc3ccc(F)c(F)c3)ccc21 77286210 ALJCYNOUWMRDRJ-UHFFFAOYSA-N 375.375 2.574 0 50 GFAA Cc1nc2ccc(C(=O)N3CCN(C4CCCC4)[C@H](CCO)C3)cc2nc1C 72480486 IHZBJYJRCFYKGN-LJQANCHMSA-N 382.508 2.698 0 50 GFAA O=C(CN1CCC[C@H]1c1nc(-c2ccccn2)no1)NCCc1ccccc1 77524928 SSRVQQQHPQUGIQ-SFHVURJKSA-N 377.448 2.627 0 50 GFAA Nc1nccc(-c2ccc(C(=O)NC3CCN(Cc4ccco4)CC3)cc2)n1 426666978 KTRVGZLLMXEMTK-UHFFFAOYSA-N 377.448 2.713 0 50 GFAA CCc1cc(N2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)nc(C)n1 91493954 ZPNMXFRRYCSUMG-OAQYLSRUSA-N 382.512 2.522 0 50 GFAA CC1(C)COCCN1CCNC(=O)N1CC[C@H](Oc2ccccc2Cl)C1 179217365 YTTMFHIKWKQPEJ-HNNXBMFYSA-N 381.904 2.614 0 50 GFAA CC1CCN(c2ccc(C(=O)NCc3ccnc(O[C@H]4CCOC4)c3)cn2)CC1 162628332 BSMJICBGWLKUJG-IBGZPJMESA-N 396.491 2.811 0 50 GFAA CC(C)(C)CN1CCC[C@H]1c1ccc(C(=O)NCCCc2nnn[nH]2)s1 23430477 FQOIQXDWFHGKGQ-ZDUSSCGKSA-N 376.530 2.807 0 50 GFAA CCc1nc2c(N3CCC[C@H](CNC(=O)c4ccc(F)cc4)C3)ncnc2o1 95531758 OEQXYIKOUOGXDQ-CYBMUJFWSA-N 383.427 2.966 0 50 GFAA Cc1ccc(-c2nnn(CC(=O)N[C@H]3CCCOc4c(F)cccc43)n2)cc1 181054901 JCRQBBRAIJTOJK-KRWDZBQOSA-N 381.411 2.818 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91951203 UENNGRKTSGMZSJ-UHFFFAOYSA-N 382.464 2.731 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC[C@]2(CCC(=O)N(CCC(C)C)C2)C1 95387944 JXIFLEIDTQQIMT-LJQANCHMSA-N 378.542 2.925 0 50 GFAA NC(=O)CCn1cc(-c2cccc(C(=O)N[C@H]3CCc4ccccc4C3)c2)cn1 534578310 ZRONCBLFVQRJMF-NRFANRHFSA-N 388.471 2.713 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(F)cc2)n1 826593235 RGNUGNAAOHFCFJ-INIZCTEOSA-N 377.441 2.711 0 50 GFAA O=C(NCc1nc(Cc2ccccc2)no1)[C@@H]1CCCN(Cc2ccco2)C1 827733154 GQQYBCSQXYUAHF-QGZVFWFLSA-N 380.448 2.782 0 50 GFAA CC(C)n1ncnc1-c1cccc(C(=O)N[C@@H]2CCCN(C(=O)C3CC3)C2)c1 584900563 PSPGLWYZFIATMM-GOSISDBHSA-N 381.480 2.657 0 50 GFAA CC(C)C(=O)Nc1cccc(C(=O)N2CCN(c3ccc(C(=O)O)cc3)CC2)c1 952868349 LLMRMFDKCZOYMK-UHFFFAOYSA-N 395.459 2.942 0 50 GFAA Cc1cccc(-c2nc3ccc(NC(=O)N4C[C@H](CO)[C@@H](CO)C4)cc3o2)c1 1565526007 RAZAROKJRNUSGA-HZPDHXFCSA-N 381.432 2.868 0 50 GFAA COc1ccc(F)cc1CN1CCN(C(=O)c2cccc(OC(C)C)n2)CC1 168878096 UTXRAKYZSZEWPP-UHFFFAOYSA-N 387.455 2.975 0 50 GFAA O=C(C[C@@H]1C(=O)Nc2ccccc21)NCCc1ccc(OCC(F)(F)F)nc1 186417181 GLOPEFQETUXXEG-AWEZNQCLSA-N 393.365 2.807 0 50 GFAA COc1c(F)cc(CN2CCN(Cc3noc(C(C)(C)C)n3)CC2)cc1F 170611951 OFSQPYPADFESEB-UHFFFAOYSA-N 380.439 2.972 0 50 GFAA O=C(NCCc1ccccc1F)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772804895 DRWCQCWXNFRXOZ-OAHLLOKOSA-N 389.496 2.583 0 50 GFAA O=CN1CCCN(Cc2nc(C(c3ccccc3)c3ccccc3)no2)CC1 12112327 HNQUROUBZNFGKQ-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA Cc1ccc(C)c(CN2CCc3nnc(CCNC(=O)c4ccoc4)n3CC2)c1 19223273 ZPHGYESXEBLNTN-UHFFFAOYSA-N 393.491 2.519 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)CCc4ccccc4)nnc3c2)n1 169780333 LNNBKSJZAYZCRT-UHFFFAOYSA-N 376.420 2.591 0 50 GFAA Cc1nc2c(c(=NCCO)[nH]1)CC[C@]21CCCN(Cc2cccc3[nH]ccc23)C1 1875245975 VIBMGVAZXKRZLP-QHCPKHFHSA-N 391.519 2.572 0 50 GFAA O=C(c1cccc2cc[nH]c12)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328617613 CXIWPZOJYAIZCX-GOSISDBHSA-N 377.448 2.772 0 50 GFAA CC(C)C(=O)NCC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704340057 FHYQIFHOVTUXRM-QHCPKHFHSA-N 392.503 2.722 0 50 GFAA O=C(OCC1c2ccccc2-c2ccccc21)N1CC(C(=O)O)(n2cccn2)C1 1857783204 YMOUHJRSCSPVRP-UHFFFAOYSA-N 389.411 2.928 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)NCCC(=O)N1CCOc2ccccc2C1 1875257960 IYXSQOIZRBZKTH-LJQANCHMSA-N 382.460 2.772 0 50 GFAA Cn1ccnc1[C@@H]1CN([C@@H]2CCc3c(F)ccc(F)c32)C[C@H]1NC(=O)C1CC1 1875282606 LDSNTBWYSSVVIY-ZTFGCOKTSA-N 386.446 2.680 0 50 GFAA COc1cccc([C@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397518 CRRHRSHMNOBXDB-FUHWJXTLSA-N 397.523 2.733 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(Nc2cccnc2)cc1 1875400584 FKGMMICNUWXBKO-CDHQVMDDSA-N 377.448 2.591 0 50 GFAA CC(C)CCn1nc(CNC(=O)N2CC[C@H](O)C(F)(F)C2)c2ccccc21 888101779 GMBPGDXKKDLRAR-KRWDZBQOSA-N 380.439 2.994 0 50 GFAA CC1=C(C(=O)OCC(Cl)(Cl)Cl)[C@H](c2ccc(O)cc2)NC(=O)N1 1023164 RDZRAUZWYJKICO-NSHDSACASA-N 379.627 2.934 0 50 GFAA Cn1c(=O)c2c(-c3ccc(Cl)cc3)n(-c3ccccc3N)cc2n(C)c1=O 4623151 AFDMXHKAFPLMIX-UHFFFAOYSA-N 380.835 2.931 0 50 GFAA O=S(=O)(c1cnc(-c2ccccc2)s1)N1CCC([C@H]2CCNC2)CC1 923641409 TXXUBLWFZGLGAN-INIZCTEOSA-N 377.535 2.820 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(SCc1ccccc1)n2Cc1ccccc1 820929 CNCRCPYPMPVUCK-UHFFFAOYSA-N 378.457 2.764 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc(F)c2)cc1Cl 1057665 QUVXSIWRWGLMDY-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA CNC(=O)CN(Cc1ccc(Cl)c(Cl)c1)S(=O)(=O)c1ccccc1 1174915 NFVNDAHAPBVIAB-UHFFFAOYSA-N 387.288 2.930 0 50 GFAA O=C(Nc1cccc(Cl)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 4031543 BCZHYDLEIGALBI-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA CCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 6244066 OQGKXYLPHLWRSS-UHFFFAOYSA-N 390.461 2.789 0 50 GFAA O=C(Cn1nc2n(c1=O)CCCCC2)N1CCCSc2ccc(Cl)cc21 225457904 WQIGMIQISYOCEB-UHFFFAOYSA-N 392.912 2.954 0 50 GFAA Cc1cc(C)c(OC[C@@H](O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1 20481676 LVOFHPSRXLEMJE-NRFANRHFSA-N 382.504 2.810 0 50 GFAA CN[C@@H](C)C(=O)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67458616 VWXQKDBOWMHELS-LBPRGKRZSA-N 383.473 2.998 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CNCCc3cscn3)C2=O)cc1 67433011 MXIGDDVYSQHOHN-NRFANRHFSA-N 387.549 2.952 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](C(=O)c3ccccn3)C2)cnn1-c1ccccn1 1506405673 KTKDMPXWTSFIQV-MRXNPFEDSA-N 375.432 2.706 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)Cc2cccnc2)CC1)C1CCCC1 12449428 FQZYSKXPCJVSQJ-UHFFFAOYSA-N 381.480 2.813 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)NC(=O)C[C@@H]2c1ccc(O)cc1Cl 65372109 PQPIXLCZANNVGE-LLVKDONJSA-N 396.852 2.900 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)n(CCN(C)C)n1 67722848 JARDZOVUEYRWLK-GOSISDBHSA-N 376.888 2.620 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)cc2)c(=O)[nH]n1 33026747 QCRJOPWCUWMEKM-ZBQZNYHESA-N 389.521 2.772 0 50 GFAA O=C(N[C@@H]1CCc2[nH]ncc2C1)c1cccc(-n2ccc(C(F)(F)F)n2)c1 123179367 IBMZEOASBDNFQK-CYBMUJFWSA-N 375.354 2.902 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccccc3OCC)[C@H](CCO)C2)CC1 39442155 LPPQBFKMIXRZEI-JOCHJYFZSA-N 389.584 2.828 0 50 GFAA CCC[C@@H](C(=O)N1CCc2c(nc(-c3cccnc3)[nH]c2=O)C1)n1cccc1 71756837 NCBOKNUAOJVZSB-SFHVURJKSA-N 377.448 2.560 0 50 GFAA O=C(Nc1cccc(-c2nc[nH]n2)c1)c1ccc(Cl)c(N2CCNC2=O)c1 365584259 LDXVTRPHZXFMEG-UHFFFAOYSA-N 382.811 2.907 0 50 GFAA CCc1nnc(O)c(C(=O)N2CCn3c(C4CCCC4)nnc3[C@@H]2C)c1CC 366085633 LHFOBUHQEFVFRJ-LBPRGKRZSA-N 384.484 2.773 0 50 GFAA O=C(NC1C[C@@H]2CC[C@H](C1)N2)c1ccn(-c2cccc(Br)c2)n1 236676432 OJYGDKFOTSRWER-PBWFPOADSA-N 375.270 2.648 0 50 GFAA O=C(O)c1cc(-n2ccc(-c3ccco3)n2)cc(S(=O)(=O)N2CCCC2)c1 72157182 SCXKQABIGGIPDQ-UHFFFAOYSA-N 387.417 2.615 0 50 GFAA Cn1c(=O)n(CC(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c2ccccc21 129528519 RGFBUDWOVMTYKU-HNNXBMFYSA-N 398.438 2.709 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3CCCCC3)[C@H]4C2=O)cc1C 77486279 BHSJYKBURHIKJS-SRYPRDQNSA-N 380.488 2.598 0 50 GFAA Cc1ccccc1OC[C@@H](O)CN1CCc2c(cccc2N2CCOC2=O)C1 174063986 UWWDQDOYHIIQHB-SFHVURJKSA-N 382.460 2.750 0 50 GFAA Cc1c(NC(=O)[C@H]2CCO[C@H](c3ccccc3)O2)c(=O)n(-c2ccccc2)n1C 240333204 FCHAZXJKNFRNAS-GCJKJVERSA-N 393.443 2.927 0 50 GFAA C[C@H](c1cccnc1)N1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)CC1 175936331 XIRZZBPAWWJTCD-QGZVFWFLSA-N 391.479 2.632 0 50 GFAA COc1ccc2[nH]cc(CC(=O)NC3CCN(c4cc(C)nc(C)n4)CC3)c2c1 178177302 TXEXNHMLAWHABJ-UHFFFAOYSA-N 393.491 2.911 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3ccccn3)C[C@@H]2CCO)o1 20205153 HEUMVCNLGNXQON-IBGZPJMESA-N 380.492 2.843 0 50 GFAA CCn1ccnc1CN1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 95507943 LOGOABSAOLDWIY-UHFFFAOYSA-N 381.524 2.745 0 50 GFAA O=C(O)CCC/C=C\C[C@@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 95644642 LYXKJZCRLQWIIN-PTTQHRFMSA-N 388.460 2.750 0 50 GFAA in-vitro CCCN(Cc1nccn1C)C(=O)Nc1cc(NS(C)(=O)=O)ccc1C 96131599 HMYLWJARKOMFBC-UHFFFAOYSA-N 379.486 2.544 0 50 GFAA COCCN1C[C@@H](NC(=O)Nc2ccccc2Oc2ccccc2F)CC1=O 97759226 DHMFBUAAKDVNJK-AWEZNQCLSA-N 387.411 2.987 0 50 GFAA Cn1ccc(CC(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)n1 183743187 HGIDMZBRMNRVCQ-UHFFFAOYSA-N 381.307 2.656 0 50 GFAA CC(C)c1ccc(N2C(=O)[C@H](CCC(=O)NCCc3ccccn3)N=C2O)cc1 252492588 MPTJLFVGTVGPBZ-IBGZPJMESA-N 394.475 2.973 0 50 GFAA CS(=O)(=O)Cc1ccc(-c2ccc(C(=O)N3CCC(F)CC3)cc2)nc1 534635644 RZESXUXMDVOQNI-UHFFFAOYSA-N 376.453 2.867 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCCN3CCCc4ccccc43)cn12 1940193548 SVEOLTURMIYDJU-FQEVSTJZSA-N 393.491 2.601 0 50 GFAA Cc1cc(N2CCN(Cc3ccc([C@@H]4CCCO4)s3)CC2)n2ncnc2n1 825138881 ASUWWKDEOGZFHA-INIZCTEOSA-N 384.509 2.668 0 50 GFAA Fc1cccc(-n2cc(CN(CCN3CCOCC3)Cc3ccco3)cn2)c1 826621234 UMQPILHFFVCVSX-UHFFFAOYSA-N 384.455 2.939 0 50 GFAA COCCn1cnnc1CCn1cnc2cc(-c3ccccc3)sc2c1=O 584901116 NRUXHPYUMGJAQK-UHFFFAOYSA-N 381.461 2.606 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCC[C@@H]2CN)CC1 1342087116 KHAJGGRXABCUES-WIYYLYMNSA-N 396.535 2.583 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2C[C@H](C(C)C)[C@@H](NC(=O)N(C)C)C2)cc1 1565528128 LTLZRLITGWOANC-MOPGFXCFSA-N 385.512 2.813 0 50 GFAA C[C@H](O)c1nc2ccc(NC(=O)c3ccc(N4CCN(C)CC4)cc3)cc2[nH]1 952982793 QYWJURQNWVWRAW-AWEZNQCLSA-N 379.464 2.620 0 50 GFAA Cc1ncsc1C(=O)NC[C@@H]1CCCN(C(=O)c2ccc(Cl)cn2)C1 952977295 VBEZBPKQCMKPSC-LBPRGKRZSA-N 378.885 2.782 0 50 GFAA CCOc1cnc(C(=O)N(Cc2ccc(O)cc2)C[C@H]2CCCN2CC)cn1 187247606 ZLHZRBBIACOMPO-QGZVFWFLSA-N 384.480 2.708 0 50 GFAA CC(C)c1cc(C(=O)NCC2CCN(S(=O)(=O)c3cccs3)CC2)on1 1506414673 ICDRIGQGORGPDL-UHFFFAOYSA-N 397.522 2.690 0 50 GFAA COc1ccc(CN2C(=O)N[C@H](CC(=O)Nc3cccc4[nH]ccc34)C2=O)cc1 1772492612 NZFJBPWZBRKNKR-GOSISDBHSA-N 392.415 2.626 0 50 GFAA O[C@@H](COc1ccccc1CNCCCOc1cccnc1)CN1CCCCC1 12431981 MKQCESACJKCKPN-OAQYLSRUSA-N 399.535 2.866 0 50 GFAA O=C(CN1C(=O)N[C@H](c2ccccc2Cl)C2=C1COC2=O)Nc1ccccc1 169758037 MNZAAKPJKLXQNI-GOSISDBHSA-N 397.818 2.856 0 50 GFAA Cc1ccc([C@H]2NC(=O)N(CC(=O)Nc3ccc(F)cc3)C3=C2C(=O)OC3)cc1 169764774 QOVINZDEKOEIBG-LJQANCHMSA-N 395.390 2.650 0 50 GFAA CCOc1cccc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1 1857673958 USGVKGBVGNEZHA-QFIPXVFZSA-N 380.444 2.975 0 50 GFAA Cc1nn(C)c(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1C 1857674183 WDIKIZDHFUGPIK-OAQYLSRUSA-N 381.480 2.530 0 50 GFAA c1ncc(CN2CCC3(CC2)OCCc2cc(O[C@@H]4CCOC4)ccc23)cn1 1857680998 YYPZTRCPDVQKNK-HXUWFJFHSA-N 381.476 2.708 0 50 GFAA CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1cccnc1)C2)c1ccc(F)cc1 1857686614 DRIAMXZENADSKT-XMGTWHOFSA-N 396.510 2.850 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1cc3c(nc1O)CCC3)CC2 1857695678 UFEIKFFAXVHDDY-UHFFFAOYSA-N 388.471 2.917 0 50 GFAA Cn1ccnc1CN1CCC(C2CCN(c3ncnc4[nH]ccc34)CC2)CC1 1857725669 HYARBMIRJQEZGB-UHFFFAOYSA-N 379.512 2.820 0 50 GFAA Cn1cccc(CN2CCC[C@@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)c1=O 1857729851 HUQXDJNZUVTOAA-JOCHJYFZSA-N 382.508 2.658 0 50 GFAA O=C1CCc2c1cccc2C(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857733637 RVISFLDOZJDPTP-HYFFOGBASA-N 376.456 2.760 0 50 GFAA CC(C)=CCN1C[C@@H]2[C@H](CNC(=O)c3sc(C)nc3C)[C@H]3CC[C@]2(C1)O3 1857740843 PATFDKIJLJINJS-TVKQPGBESA-N 375.538 2.935 0 50 GFAA CS(=O)(=O)CCN1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1875248859 TZTNTYDWKSMGCZ-VQTJNVASSA-N 389.473 2.575 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)cc1C(=O)O 120742901 APLCRQFSDMRNGI-XJKSGUPXSA-N 384.432 2.854 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(NC2CCN(c3ncccn3)CC2)ncn1 328638588 PFFHHLWWUPKVHS-XLIONFOSSA-N 397.527 2.963 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N[C@H]1CC[C@@H](CO)CC1 127122879 ZDRKNZQQKWBVOL-KOMQPUFPSA-N 381.467 2.780 0 50 GFAA Cc1c(C(=O)N(C)Cc2csc(Br)c2)nnn1C1CCNCC1 237186114 SKEAPOPROBWHFW-UHFFFAOYSA-N 398.330 2.607 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2CCN(CC)CC2)sc2c1CC[C@@H](C)C2 19792110 SFTUPUGBURZIJK-CQSZACIVSA-N 393.553 2.626 0 50 GFAA CCOc1cccc(CNC(=O)N[C@H]2CCc3[nH]ncc3C2)c1OC(F)F 152289653 GVEJSVNGQZLODY-ZDUSSCGKSA-N 380.395 2.767 0 50 GFAA CC1(C)CCN(C(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)CC(C)(C)C1 822182408 IRHQSFZMDARGEB-UHFFFAOYSA-N 397.541 2.573 0 50 GFAA CN(c1ccccc1)c1ccc(CN[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cn1 1875399366 APUPFHLGSGIDPH-HMXCVIKNSA-N 377.492 2.975 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 1875402275 DPFAJUZSWZJXIK-HFBAOOFYSA-N 388.855 2.596 0 50 GFAA COc1cc(-c2ccc(C(=O)NCCn3nc(C)cc3C)cc2)c(=N)[nH]c1C 2100534322 CPSWGYJVDSWKBF-UHFFFAOYSA-N 379.464 2.722 0 50 GFAA O=C(C[C@@H]1CC=CCC1)N[C@@H]1CCN(C(=O)Cn2sc3ccccc3c2=O)C1 2325873009 VGUQYSCJOUGWTC-HZPDHXFCSA-N 399.516 2.527 0 50 GFAA CN(CC1(c2ccccc2)CC1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 880981780 DCCDQEMXTIOEFO-UHFFFAOYSA-N 399.472 2.608 0 50 GFAA CCOC(=O)c1ccc(NC(=S)N2CCN(C(=O)c3ccco3)CC2)cc1 1154092 STRVIBYJAMLPHX-UHFFFAOYSA-N 387.461 2.611 0 50 GFAA Cc1ccc(NS(=O)(=O)c2ccc(CCC(=O)N3CCOCC3)cc2)cc1 2872059 JUTCYBCEQSMXJC-UHFFFAOYSA-N 388.489 2.587 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2cc(-c3ccc(O)cc3)[nH]n2)C1=O 2356149839 WRWGODZZTPGWJF-OAQYLSRUSA-N 382.464 2.788 0 50 GFAA NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc2oc3ccccc3c2c1 4694477 TZKQUNRGRAEZIZ-SFHVURJKSA-N 394.452 2.961 0 50 GFAA Cn1nccc1C(=O)Nc1sc2c(c1C(=O)NCc1cccnc1)CCCC2 6699828 VSJSXKSEWJFWGW-UHFFFAOYSA-N 395.488 2.938 0 50 GFAA OC[C@H]1CCCN1c1cc(NCc2cccc(COC3CCOCC3)c2)ncn1 110603207 MBIJDTUUSZTBMK-LJQANCHMSA-N 398.507 2.745 0 50 GFAA COc1ccc(NC(=O)CCSc2nnnn2-c2ccc(OC)cc2)cc1 8208471 QVAVYYMAZHTVSG-UHFFFAOYSA-N 385.449 2.800 0 50 GFAA COC(=O)Cc1cn2cc(C(F)(F)F)cc(I)c2n1 22995882 HRHUMTJCPYZLKV-UHFFFAOYSA-N 384.095 2.673 0 50 GFAA OC[C@]1(CCOc2ccccc2)CCCN(c2nnnn2-c2ccccc2)C1 67714084 YSRRTLUVHOUBGE-NRFANRHFSA-N 379.464 2.710 0 50 GFAA CCNC(=O)[C@H]1CCN(C(=O)c2csc3nc(-c4cccc(OC)c4)cn23)C1 67804605 YNBOVNVQYFQUOV-AWEZNQCLSA-N 398.488 2.670 0 50 GFAA C[C@H](NC(=O)N1CCC(n2cc(CCO)nn2)CC1)c1ccc(Cl)cc1 23478670 VKQKJBVCBYKHEY-ZDUSSCGKSA-N 377.876 2.574 0 50 GFAA CC[C@H](C(=O)NCc1cccnc1)N(c1cc(C)ccc1C)S(C)(=O)=O 65362399 FEQLJKOMHQHDDR-QGZVFWFLSA-N 375.494 2.559 0 50 GFAA CC(C)[C@H](C(=O)N[C@H]1CCN([C@@H](C(=O)O)C(C)C)C1=O)c1cccc(Cl)c1 478981531 IFVRFUWKNGBWSM-YESZJQIVSA-N 394.899 2.906 0 50 GFAA Cc1ccn(-c2ccccc2NC(=O)NCc2cccnc2N2CCOCC2)n1 151070211 OYCGFCGXRRTCBV-UHFFFAOYSA-N 392.463 2.734 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCc2nncn2C)CCCN1Cc1ccc(F)cc1 72142210 USUVDKJATKANHI-IBGZPJMESA-N 387.503 2.646 0 50 GFAA O=C(CCc1ccccc1OC(F)(F)F)N1CCN(Cc2ccon2)CC1 172796289 XROPEOUUMWQBRR-UHFFFAOYSA-N 383.370 2.850 0 50 GFAA Cc1nc2cc(NC(=O)N3CCO[C@@H](c4ccnc(N(C)C)n4)C3)ccc2o1 372465704 NOZGPVSEPCWOSH-QGZVFWFLSA-N 382.424 2.598 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)c3ccccc3-n3cncn3)C2)cc1 72165200 RVQIRTAXEVQRGU-QGZVFWFLSA-N 377.448 2.993 0 50 GFAA Cc1noc(C)c1CO[C@@H]1COCC[C@H]1NC(=O)Cc1c[nH]c2ccccc12 219929103 IXNPIJKZKCIUAF-WOJBJXKFSA-N 383.448 2.806 0 50 GFAA Cc1n[nH]c(-c2ccccc2)c1NC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1 239352217 ABPMYMUFDVCMFP-UHFFFAOYSA-N 388.449 2.789 0 50 GFAA Cc1cc(C(=O)NC[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c2cnn(C)c2n1 131255828 KXMFLUSKVDCWHM-FUHWJXTLSA-N 377.492 2.917 0 50 GFAA CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)NCC1(c4ccc(F)cc4)CCOCC1)C[C@@H]3C2 287235910 QVTATTUQASVVQN-HVXNZKGKSA-N 388.483 2.939 0 50 GFAA O=C(c1cccc(-c2ccc([C@H](O)CN3CCOCC3)cc2)c1)N1CCCC1 426403856 XKYSKWAPIFOKAB-JOCHJYFZSA-N 380.488 2.955 0 50 GFAA Cn1c(C(C)(C)C)nc2cc(NC(=O)C(=O)N3CCOC4(CCC4)C3)ccc21 161707935 QRJNRWNRNLPLMA-UHFFFAOYSA-N 384.480 2.591 0 50 GFAA CN(C(=O)Nc1ccc2oc(=O)n(C)c2c1)[C@H]1CCN(Cc2ccccc2)C1 96138457 BWHDUKOAMBRIEC-KRWDZBQOSA-N 380.448 2.870 0 50 GFAA O=C(NCC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1)c1ccccc1 181316375 TVZUYRFDCXMZHY-SFHVURJKSA-N 389.459 2.608 0 50 GFAA CC(C)c1noc(CN2CCC[C@]3(CCC(=O)N(Cc4ccccn4)C3)C2)n1 91780791 UYABWNWYYXHZBF-NRFANRHFSA-N 383.496 2.993 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95530638 FYCJGRXGEIZATC-AWEZNQCLSA-N 383.477 2.811 0 50 GFAA Cc1nc(-c2ccc(NC(=O)c3cccc(-n4cnnn4)c3)cc2Cl)n[nH]1 182691555 MDMSVNMHCRRSSD-UHFFFAOYSA-N 380.799 2.662 0 50 GFAA O=C(NCCn1c(CO)nc2ccccc21)[C@@H](Cc1ccccc1)n1cccc1 253400915 FFKOTZZACMJSKS-OAQYLSRUSA-N 388.471 2.930 0 50 GFAA C[C@@H](O)c1cccc(-c2cccc(C(=O)NCC(C)(C)N3CCOCC3)c2)n1 534649913 CJKOUDMAZLZWRU-MRXNPFEDSA-N 383.492 2.643 0 50 GFAA CC(C)c1ccc(-c2cccc(C(=O)NCCCN3CCC(O)CC3)c2)nn1 299793041 IAVLPIAXPPNBNP-UHFFFAOYSA-N 382.508 2.844 0 50 GFAA Cc1cc(C)n2ncc(CN3CCC(CNC(=O)c4oc(C)nc4C)CC3)c2n1 825302662 YKJNNFNUCLOKBF-UHFFFAOYSA-N 396.495 2.593 0 50 GFAA CC(=O)N1CC[C@@H](NS(=O)(=O)c2c(F)cccc2F)c2ccc(F)cc2C1 185935876 ALRXNKWOVBBJDH-QGZVFWFLSA-N 398.406 2.876 0 50 GFAA Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)N2CCN(c3ncccn3)CC2)cc1 170645002 MEBINYKNDHTMPK-WOJBJXKFSA-N 395.507 2.785 0 50 GFAA Cc1noc(C2CCN(CC(=O)N[C@@H](c3ccccc3)c3nccs3)CC2)n1 170985012 CYRYJCWEKNBTBY-SFHVURJKSA-N 397.504 2.920 0 50 GFAA Nc1cc(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)cc(Cl)n1 171197887 SYOUDWAGJIDJAL-UHFFFAOYSA-N 380.826 2.990 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(c2cncc(C(=O)N3CCOCC3)n2)C1 1506414703 RAFPRMFJERICLI-GOSISDBHSA-N 396.491 2.553 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@H]2O)on1 1529141512 LIXIWYZEGGGFLW-XMSQKQJNSA-N 379.460 2.992 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)CCO1 1704330820 GSKIBWPWMKMCCZ-CYBMUJFWSA-N 377.416 2.806 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(C4CCCCC4)s3)C[C@@H]2O)CC1 206862532 JRHVYEIGMGZTJJ-PMACEKPBSA-N 377.598 2.978 0 50 GFAA CO[C@@H]1CCC[C@]12CCCN(S(=O)(=O)c1ccc3c(c1)OCCCO3)C2 1704305538 ROWWCHWFININAO-RTBURBONSA-N 381.494 2.818 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1ccc(OC)c(C)c1)CC2 14950544 IKLHWSUAMAFCJT-GOSISDBHSA-N 386.492 2.546 0 50 GFAA CCNC(=O)c1cn(CCc2ccccc2)cc(C(=O)N2CCC[C@@H](C)C2)c1=O 14990585 SDHOOGOBKXVRKI-QGZVFWFLSA-N 395.503 2.713 0 50 GFAA CCN(CC)CCNC(=O)c1sc2ncnc(NC[C@@H]3CCCO3)c2c1C 15008373 GBYNFTRCFRVWOD-AWEZNQCLSA-N 391.541 2.662 0 50 GFAA CCSc1nnc(NC(=O)CSc2nnc(-c3ccncc3)n2C)s1 16623908 AJKHPZLRJPJENY-UHFFFAOYSA-N 393.523 2.571 0 50 GFAA CC[C@@]12COC(=O)N1CCN(c1nc(-c3ccc(OC)cc3)ccc1C(=O)O)C2 1857672926 JVMWLBVTIKUJJJ-OAQYLSRUSA-N 397.431 2.876 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2-c2ccc3cccc(OC)c3n2)cn1 1857690192 FGBJCCZGNFLYRZ-UHFFFAOYSA-N 390.447 2.819 0 50 GFAA CCOc1ccc(C(=O)N2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)cc1Cl 1857731505 SUUBIGFFHTWRCY-DKYLXPRQSA-N 378.900 2.920 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)Cc2noc3ccccc23)[C@H]1c1ccccc1 1857739464 KYKCXZXGCYYNLI-UNMCSNQZSA-N 379.460 2.901 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1875240653 DFBKSOQEOKIXJL-WIYYLYMNSA-N 393.487 2.564 0 50 GFAA C[C@H](N)[C@@H]1CCCCN1C(=O)[C@@H]1CCN(c2ccccc2Br)C1=O 237434920 JPWMAGHQRAHVDJ-YDHLFZDLSA-N 394.313 2.530 0 50 GFAA CC(C)c1nc([C@@H]2CCCN2C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)no1 246726586 VEJRYRTVSOSXML-ILXRZTDVSA-N 377.489 2.829 0 50 GFAA C[C@@H](N1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1)C(F)(F)F 267398860 JAAKDXSCTOVQRM-MRXNPFEDSA-N 383.458 2.994 0 50 GFAA O=C([C@H](c1cccc(F)c1)N1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1 862803274 KOISSFMVYLPCNP-GMAHTHKFSA-N 398.478 2.709 0 50 GFAA CC1(C)CC[C@@H](CNC(=O)c2cccc(-n3[nH]nnc3=N)c2)c2ccccc21 1295123406 HSUFDUIHNLOCAD-HNNXBMFYSA-N 376.464 2.660 0 50 GFAA Cc1nc2cc(C(=O)N3CCN(c4ncc(Cl)cc4Cl)CC3)cnc2[nH]1 1875259486 ZLICOUPQNOCZFG-UHFFFAOYSA-N 391.262 2.931 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ncccc1Cl)C[C@H](C)O[C@@H]2C 1875314482 BAAXKCOTLHAGEJ-NWDGAFQWSA-N 378.860 2.530 0 50 GFAA CNC(=O)CN(Cc1ccc(C2CCC2)cc1)C(=O)c1cc2c([nH]1)CCOC2 1875379540 VOKCFRCQMCOTSP-UHFFFAOYSA-N 381.476 2.743 0 50 GFAA Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)N[C@H]1[C@H]2CC[C@@H]1C[C@H](CO)C2 1875321719 SJRIMCHTLAGVPA-XYGUIBQMSA-N 380.488 2.981 0 50 GFAA CN(C[C@@H]1CCCO1)C(=O)c1ccccc1Cn1cc([C@H](O)C(C)(C)C)nn1 1875316437 RAPXSBRHRWPURS-LPHOPBHVSA-N 386.496 2.657 0 50 GFAA C=CC(=O)N1CCN(C(=O)Cc2cccc(NC(=O)OC(C)(C)C)c2)[C@@H](C)C1 1875381482 WMVOAQSZCBRYPP-HNNXBMFYSA-N 387.480 2.821 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3ccc4occc4c3)C2)c1C 1875397133 NAPXFEBXQIEMSD-GOSISDBHSA-N 393.491 2.910 0 50 GFAA CCCOc1cccc(C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C)cc2O3)c1 1875394841 YPHYGPVFXGSUER-QGZVFWFLSA-N 385.464 2.700 0 50 GFAA O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCCCC1 3635558 PTEAZVSMJLAEEN-QGZVFWFLSA-N 390.530 2.876 0 50 GFAA CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Br)c(O)c(OC)c1 4143203 KVUGONHEFAHWIB-ZDUSSCGKSA-N 399.241 2.744 0 50 GFAA C[C@@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)CC1CC(n2cnnc2)C1 2325796238 CHFJFZYYBCLTBB-SYJJWHGVSA-N 383.452 2.796 0 50 GFAA CN1CCN(c2ccnc3c(Br)cnn23)C[C@@H]1Cc1ccccc1 2325858651 WBAFYHRZGRCOCP-HNNXBMFYSA-N 386.297 2.855 0 50 GFAA CC[C@@H](CNS(C)(=O)=O)Nc1ccnc2cc(OC(F)(F)F)ccc12 2325862007 FYYPBSBFTXZVHI-JTQLQIEISA-N 377.388 2.873 0 50 GFAA CCOC(=O)C1CCN(C(=O)COc2ccc(Br)cc2C)CC1 724951 GJYGBHPGHOZZMY-UHFFFAOYSA-N 384.270 2.938 0 50 GFAA c1ccc(-c2nc(CN3CCc4nc(C5CCOCC5)nn4CC3)co2)cc1 2356137736 XIZXDJIIPBWDQV-UHFFFAOYSA-N 379.464 2.885 0 50 GFAA CN1CCN(c2nc(N3CCN(c4ccccc4)CC3)nc3ccccc23)CC1 6368181 NADWKTWVFRLPCK-UHFFFAOYSA-N 388.519 2.708 0 50 GFAA CC[C@@H](Oc1ccccc1OC)C(=O)Nc1ccccc1C(=O)N1CCOCC1 8478093 GSTPULJGDOFTKC-GOSISDBHSA-N 398.459 2.964 0 50 GFAA O=C(CN1CCN(c2ccccc2)CC1)Nc1ccc(Br)cn1 55058988 LAUPMKFOYWYJEX-UHFFFAOYSA-N 375.270 2.605 0 50 GFAA COCCC[C@@H]1CCCN(C(=O)CC(=O)Nc2ccc(OC)cc2OC)C1 55168535 XHFLCEYUIQTVEW-HNNXBMFYSA-N 378.469 2.698 0 50 GFAA COc1ccc2cc(CN3CCC([C@@H](O)c4ccccn4)CC3)c(=O)[nH]c2c1 67817068 RQVFWQNDDCMXHM-OAQYLSRUSA-N 379.460 2.877 0 50 GFAA Cc1cc(C[C@@H](C)Nc2ccc(C(=O)NCc3noc(C(C)C)n3)cn2)[nH]n1 67817296 QAKZCJLWHAXGSE-GFCCVEGCSA-N 383.456 2.593 0 50 GFAA Cc1c(C(=O)NCCSc2ccccc2)cccc1N(C)S(C)(=O)=O 65362109 CHTCJRJYYAIXRI-UHFFFAOYSA-N 378.519 2.913 0 50 GFAA CN(c1ccc(C(=O)Nc2ccc3c(c2)OCCO3)c(Cl)c1)S(C)(=O)=O 65364515 NKBUIOSXYHZULO-UHFFFAOYSA-N 396.852 2.759 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N[C@H](C)CCn2cccn2)n[nH]1 11663894 PZTOBUGCOFIGMQ-CQSZACIVSA-N 377.452 2.521 0 50 GFAA Cc1ccc(NC(=O)c2cccnc2NC(C)C)cc1C(=O)N1CCOCC1 427796211 HDICXZNYUGWNPK-UHFFFAOYSA-N 382.464 2.935 0 50 GFAA Cc1sc(NC(=O)C(C)C)c(C(=O)N2CCC3(CC2)CNC(=O)C3)c1C 77339040 FPWROVHGVQYXIT-UHFFFAOYSA-N 377.510 2.702 0 50 GFAA CCCc1cc([C@H]2CCCN2S(=O)(=O)c2ccc3c(c2)OCCO3)no1 33270212 UXCXEAYRARONMY-MRXNPFEDSA-N 378.450 2.924 0 50 GFAA COc1cc(C(=O)N2CCC3(CC2)C[C@H]3N(Cc2ccsc2)C(C)=O)on1 328625114 CTEUGLGZWVUHKI-MRXNPFEDSA-N 389.477 2.788 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C[C@H]1CCCCO1 154489710 ZSGJKWMWMMQSDP-QGZVFWFLSA-N 394.537 2.956 0 50 GFAA C/C(=C\C(=O)N1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1)c1ccc(F)cc1 372778082 ZZXWJIBZIGCOGO-LPQFERQCSA-N 384.411 2.868 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)C(=O)Cn1c(=O)cnc2ccccc21 173720738 OKQLPRADLJNHGJ-UHFFFAOYSA-N 382.367 2.530 0 50 GFAA CN(C)c1ncn(-c2cccc(NC(=O)N3CCCC[C@H]3c3ccnn3C)c2)n1 333419220 FSBBOYHNDDHUKE-SFHVURJKSA-N 394.483 2.826 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCN2CCCC2=O)CCCN1Cc1ccc(F)cc1 72153127 QNYXCLFQXFDKKF-FQEVSTJZSA-N 389.515 2.897 0 50 GFAA CCN1CC2(CCN(Cc3ccccc3OCCn3ccnc3)CC2)CC1=O 72447912 ZYFFRHVEHKDJCA-UHFFFAOYSA-N 382.508 2.797 0 50 GFAA CCc1nsc(N2CCN(CC(=O)N(C)[C@@H]3CCCc4ccccc43)CC2)n1 174322652 ODPPMAVQBBHAKY-GOSISDBHSA-N 399.564 2.759 0 50 GFAA NC(=O)[C@H](c1ccccc1)N1CCN(Cc2ncc(C(F)(F)F)s2)CC1 289919380 VRBDRSJQTMHAKH-HNNXBMFYSA-N 384.427 2.506 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(Cc3cccc(OC)c3)CC2)cc1 20176942 GDQLFYSYLSRKRX-UHFFFAOYSA-N 390.505 2.600 0 50 GFAA Nc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4ccccc4)C3)C2)cn1 95522327 WKYBUUSYAISLAQ-HSZRJFAPSA-N 392.503 2.751 0 50 GFAA CN1CC2(CCN(C(=O)Cc3cccnc3)CC2)C[C@@H](c2ccccc2)C1=O 95373235 TXSPOFCEVFBDPC-FQEVSTJZSA-N 377.488 2.879 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)c2cccc3cnccc23)CC1 96153425 ZYNGIBPSECCHLQ-UHFFFAOYSA-N 392.507 2.928 0 50 GFAA COc1cc(CN(C)CC2CCC2)ccc1OC[C@@H](O)CN1CCSCC1 95524005 QAGSANRXWFWTIF-IBGZPJMESA-N 394.581 2.716 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95376896 QSAGJDASQYHYHB-VLCRHTCISA-N 388.471 2.971 0 50 GFAA O=C(c1cnc(-c2ccccc2)[nH]c1=O)N1CCc2[nH]nc(C3CCC3)c2C1 91536233 BKPYJDPIQVLCEQ-UHFFFAOYSA-N 375.432 2.626 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CCO[C@@H](CC(=O)O)C3)ccc21 236701257 FDFFAQSNJOEDGD-LBPRGKRZSA-N 399.369 2.952 0 50 GFAA COc1ccc(OCC2CCN([C@H](C)C(=O)Nc3nncs3)CC2)cc1 244748524 OJCLHLXJFUWWTE-CYBMUJFWSA-N 376.482 2.665 0 50 GFAA Cc1ccccc1NC(=O)CCN1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 244719060 LWGLXXOLULMMIO-PKOBYXMFSA-N 382.460 2.903 0 50 GFAA COc1cccc2c1CCN(CC(=O)N1CCO[C@@H](c3ccc(F)cc3)C1)C2 182666353 SFGVUVRJKSZMIH-OAQYLSRUSA-N 384.451 2.793 0 50 GFAA CCc1oc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1CN1CCCC1 299790161 AQRHZYLRJZZPLN-QGZVFWFLSA-N 381.476 2.973 0 50 GFAA Cc1sc2nc(CCNS(=O)(=O)c3ccccc3F)nc(O)c2c1C 670467437 FKOKNOKBZKWHSE-UHFFFAOYSA-N 381.454 2.674 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)[C@H](C)c3ccccc3C(F)(F)F)CC2)[nH]1 1875297833 FJTKTQGAGGYBSY-LLVKDONJSA-N 382.386 2.866 0 50 GFAA O=C(NCc1nc(O)c2ccccc2n1)N[C@@H](CN1CCCC1)c1ccccc1 1875276860 JNIXVRUCOZPHLG-IBGZPJMESA-N 391.475 2.972 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@@H](CNC(=O)c2ccc3ccccc3n2)C1 952980685 RPTWQQBHUBHQQR-INIZCTEOSA-N 389.521 2.807 0 50 GFAA Cn1cc(-c2ccc(C(=O)N3CC[C@@H](C4CC4)[C@H]3c3nc(O)n[nH]3)cc2)cn1 1875401992 XYIZUHAQJHZZBU-IRXDYDNUSA-N 378.436 2.524 0 50 GFAA Cc1cc(C(=O)NCC[C@@H]2CCCCN2S(C)(=O)=O)c2ccc(F)cc2n1 952964722 DHTQCMNBZFHXHT-HNNXBMFYSA-N 393.484 2.616 0 50 GFAA C[C@H](NC(=O)NC[C@@H]1C[C@H](c2ccccc2)CO1)c1nnnn1-c1ccccc1 888101411 UATFYMDMBSEEJH-IEZWGBDMSA-N 392.463 2.595 0 50 GFAA CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)O)cc3OC)nc2N1C(C)C 95628816 QNLSHJVWZNHSED-CQSZACIVSA-N 399.451 2.897 0 50 GFAA in-vitro COc1ccccc1N1CC[C@H](C)N(C(=O)CN(C)C(=O)OC(C)(C)C)CC1 170597648 CVXOUBHVODZUJF-INIZCTEOSA-N 391.512 2.989 0 50 GFAA CN1CCN(Cc2nnnn2-c2ccc(OC(F)F)cc2)c2ccc(F)cc21 744424107 SWVRKLPREZMSET-UHFFFAOYSA-N 390.369 2.859 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)n1 1529114194 MICVGZLDMDBPNZ-WIYYLYMNSA-N 378.476 2.500 0 50 GFAA CN1C(=O)[C@H](CC(=O)Nc2c(-c3ccccc3)cnn2C(C)(C)C)N(C)C1=O 1529153723 UORIYHYVNXDEPE-HNNXBMFYSA-N 383.452 2.526 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@H](C)CN2CCCC2)ccc1F 1704315523 ILZWIKKLYLHVNS-CYBMUJFWSA-N 390.459 2.769 0 50 GFAA O=C(c1nnc2n1CCCC2)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704315747 VHXLFMGGYZNRBU-UHFFFAOYSA-N 391.475 2.800 0 50 GFAA Cc1nc(CN2C[C@@H]3CN(C(=O)C4CCC4)C[C@]3(CCc3ccccc3)C2)n[nH]1 1772708426 BGVIIWLSJLGYEM-OFNKIYASSA-N 393.535 2.806 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2CCCN(c3ccccn3)C2)CC1)NC1CC1 12026088 HKQVFOZZKPXNMD-SFHVURJKSA-N 384.524 2.595 0 50 GFAA O=C1CCN(C(=O)c2ccccc2-n2cccn2)CCN1Cc1cccc(F)c1 12035296 CASMAMFGDXHQSH-UHFFFAOYSA-N 392.434 2.886 0 50 GFAA O=C1CCN(C(=O)c2cccc(-n3cccn3)c2)CCN1Cc1cccc(F)c1 12150175 VEQNLFNXTVGHEK-UHFFFAOYSA-N 392.434 2.886 0 50 GFAA CCN(CC)C(=O)c1cn(C2CCN(C(=O)CCc3ccc(C)cc3)CC2)nn1 12279497 HAZDUBJBMMBPMJ-UHFFFAOYSA-N 397.523 2.865 0 50 GFAA COCCNC(=O)CCC1CCN(Cc2cc(Cl)c(O)c(OC)c2)CC1 12303160 HRFFORFDBHLUFX-UHFFFAOYSA-N 384.904 2.809 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3ccc(C)o3)C2)cc1 13545277 FTUXJDNCSVUYSV-MRXNPFEDSA-N 378.494 2.787 0 50 GFAA COc1ccccc1CN1C(=O)N[C@H](CC(=O)NC2CCCCCCC2)C1=O 206256575 OPZMNLPWDJJPQJ-QGZVFWFLSA-N 387.480 2.735 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1[C@H]1CCCCC1=O)c1ccccc1OC(F)F 155240910 TXJHSLAVDNPKGA-HIFRSBDPSA-N 394.418 2.768 0 50 GFAA CS(=O)(=O)N1CCCC[C@@H]1CCn1ccnc1-c1ccnn1-c1ccccc1 1857690107 AFLYTTXYWLKITG-QGZVFWFLSA-N 399.520 2.940 0 50 GFAA COc1cc(CN2CC[C@@]34OCCN3C(=O)C[C@@H]24)c(Cl)cc1OC(C)C 1857710647 INJPWNHMLRQKCY-MJGOQNOKSA-N 380.872 2.669 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3ccc4cc(O)ccc4c3)C[C@H]2CO1 1857727477 TWJFJLUEDMHZLW-ZJOUEHCJSA-N 379.460 2.806 0 50 GFAA CC(C)c1cccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ncc[nH]4)C[C@]34CC[C@H]2O4)c1 1857736936 ROTOFJSIBIMPFS-DZCCDHAISA-N 394.519 2.943 0 50 GFAA O=C(Cc1noc2ccccc12)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1857737672 YFGKXJAAXBSXSZ-IIBYNOLFSA-N 387.439 2.981 0 50 GFAA COCc1nc(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)cs1 109176517 YDNRULKVVGFSOT-UHFFFAOYSA-N 381.448 2.962 0 50 GFAA CCC(C)(C)NC(=O)[C@H](C)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 109797260 MTCZKZSSASVZSD-KRWDZBQOSA-N 381.524 2.959 0 50 GFAA COC(=O)c1ccc(Oc2coc3cc(OS(C)(=O)=O)ccc3c2=O)cc1 2406700 CNKNDCIPMYPHPE-UHFFFAOYSA-N 390.369 2.710 0 50 GFAA biogenic O=C(Nc1cccc(OCC(=O)N2CCC[C@H]3CNCCC[C@@H]32)c1)c1ccco1 373561129 HWAMHQKGQFSEJQ-LPHOPBHVSA-N 397.475 2.901 0 50 GFAA O=C(CC1CS(=O)(=O)C1)Nc1nc(-c2ccccc2C(F)(F)F)ns1 906029823 ZCGDBDWECMTBKF-UHFFFAOYSA-N 391.396 2.597 0 50 GFAA Cn1cccc1-c1nnc2ccc(C(=O)N3CC(c4nc5ccccc5[nH]4)C3)cn12 2100480395 IJYKVPCYYUQOEC-UHFFFAOYSA-N 397.442 2.851 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)Cc2cccs2)CCCCN1 2100533323 KHAKFJJIHKZDFG-QGZVFWFLSA-N 377.554 2.664 0 50 GFAA CC(C)Cn1nccc1CNS(=O)(=O)Cc1ccccc1Br 2325783818 DGGQLSHJTRGIFE-UHFFFAOYSA-N 386.315 2.921 0 50 GFAA O=C1COc2ccc(C(=O)N3CCC[C@H](c4cccc(C(=O)O)c4)C3)cc2N1 2325810061 BCKGIAUCRQIMBE-INIZCTEOSA-N 380.400 2.736 0 50 GFAA C[C@@H](NC(=O)c1ccc(N2CCN(C)CC2)cc1)c1nc(-c2cccs2)n[nH]1 2325820744 XZWVIHLBWPUSAL-CQSZACIVSA-N 396.520 2.776 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 791975 BVPGOXBDAZGAKJ-ZDUSSCGKSA-N 382.869 2.650 0 50 GFAA CCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(OC)c(C)c1 1064198 DQQJUPNOHSOPTI-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1OC 1162850 HRHWXNNAOYVIBQ-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA COC(=O)c1ccc2c(COC(C)=O)c(OC(C)=O)ccc2c1COC(C)=O 1233983 UAGMSOHTYCLXHB-UHFFFAOYSA-N 388.372 2.678 0 50 GFAA O=C(C[C@@H]1CS(=O)(=O)C[C@@H]1CC(=O)Oc1ccccc1)Oc1ccccc1 4076197 GVCFLJQZKCZCLA-IYBDPMFKSA-N 388.441 2.639 0 50 GFAA Cc1cccc(N2C[C@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)CC2=O)c1 9096478 XYLLAICWNBZWEB-QGZVFWFLSA-N 381.451 2.836 0 50 GFAA CCOCCOc1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 9819113 PZBULZQOCQPEDO-UHFFFAOYSA-N 398.459 2.827 0 50 GFAA O=C1N[C@@H](CC(=O)N2CCC(CCC(=O)N3CCCC3)CC2)c2ccccc21 11879330 VZWXDLDHXKERPU-IBGZPJMESA-N 383.492 2.502 0 50 GFAA O=C1NCCN(Cc2ccc(-c3ccccc3)cc2)[C@H]1CC(=O)N1CCCCO1 12072747 LSYNWVGBWQEWSD-NRFANRHFSA-N 393.487 2.598 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)[C@H]2CC(CCc3ccccc3)=NO2)C1 12097205 QEEDTWHYYWJGSN-UYAOXDASSA-N 385.508 2.871 0 50 GFAA c1ccc(COC2CCN(c3nc4nonc4nc3NC3CCCC3)CC2)nc1 12297315 GFZMHUUTGWLQNH-UHFFFAOYSA-N 395.467 2.948 0 50 GFAA COCCOc1ccccc1C(=O)Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1 12406057 JILCDPJFSOSNAP-GOSISDBHSA-N 398.459 2.873 0 50 GFAA Cc1nnc(SCC(=O)N[C@@H]2CCCc3c2cnn3-c2ccccn2)s1 12439568 KTCZMEIQBAUYKH-CYBMUJFWSA-N 386.506 2.713 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CN3CCc4sccc4C3)C2=O)c1 12593136 WTRSYZDTUKXKIQ-NRFANRHFSA-N 386.517 2.669 0 50 GFAA COc1ccccc1CCNC(=O)[C@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12707444 QOLAYUYSONMAAF-SFHVURJKSA-N 384.451 2.932 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ocnc1C 14976199 URDFKSGCHVWIBG-GOSISDBHSA-N 397.519 2.951 0 50 GFAA CO[C@H](C(=O)Nc1ccnn1C1CCN(C(=O)C2CC2)CC1)c1ccccc1 15065148 SEKTXPRAMPFEEN-IBGZPJMESA-N 382.464 2.783 0 50 GFAA COc1cc2c(cc1OC)[C@@H]([C@@H]1c3cc4c(cc3CCN1C)OCO4)OC2=O 22242050 FLMLIWNNRKBNAQ-PMACEKPBSA-N 383.400 2.873 0 50 GFAA CCN1CCN(C2(C(=O)N[C@@H]3C[C@H]3c3ccccc3)Cc3ccccc3C2)CC1 23360059 OCSMSUKCAPXXIR-XZOQPEGZSA-N 389.543 2.834 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCN(C)CC3)no2)c2ccccc12 55060577 LPECBINUSHODGB-UHFFFAOYSA-N 381.432 2.803 0 50 GFAA COc1cccc(-n2cc(CNCc3nnc(-c4ccc(C)n4C)o3)cn2)c1 65529326 WRHNXLJEJZBVMW-UHFFFAOYSA-N 378.436 2.868 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@@]1(O)CNCc1cnc2c(c1)CCC2 67688570 WPUFAWHJPYSWEO-XMMPIXPASA-N 393.531 2.646 0 50 GFAA CCCOc1ccc(Cl)cc1CNC(=O)[C@@H]1CC2(CCNCC2)CN1C 72476588 BJTWUGWVAMDWMY-KRWDZBQOSA-N 379.932 2.819 0 50 GFAA COc1ccc(-n2ccnc2-c2ccccc2C(=O)O)cc1NS(C)(=O)=O 77356004 MGQALCZNRYPFQT-UHFFFAOYSA-N 387.417 2.618 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCCO[C@@H](CN2CCCC2)C1 91693891 RGSOBFZWMYJOKV-IBGZPJMESA-N 381.480 2.547 0 50 GFAA CCN1CC2(CCC1=O)CCN(C(=O)Nc1ccc(OC)c(OC)c1)CC2 91829525 DYFSBGQLYZOPBH-UHFFFAOYSA-N 375.469 2.960 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3cn4cccnc4n3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95356159 ABXLQLCBZYXURO-HMXCVIKNSA-N 387.487 2.740 0 50 GFAA COc1ccc(CCC(=O)N2CCC[C@H](c3nccn3CCN(C)C)C2)cc1 95371063 NYNWZNVCSZKVHR-IBGZPJMESA-N 384.524 2.792 0 50 GFAA CCCCn1ccnc1[C@@H]1CCCN(C(=O)c2cnc3ccccn3c2=O)C1 95506302 HKUXKUQYZMBXCD-MRXNPFEDSA-N 379.464 2.711 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)[C@H]2CCCN(C(=O)N(C)C)C2)CC1 95517234 GXFVFTNVNGSWGY-SFHVURJKSA-N 389.544 2.783 0 50 GFAA CCC(=O)N1CCCN(C(=O)Nc2ccccc2C(=O)N2CCCCC2)CC1 124404557 IJVUKMGLVRNZKX-UHFFFAOYSA-N 386.496 2.789 0 50 GFAA CCc1n[nH]c([C@H]2CN(C(=O)Nc3ccccc3N3CCCCC3)CCO2)n1 152213890 QRJNSJRQQPBZFK-QGZVFWFLSA-N 384.484 2.963 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN([C@@H](C)c3ccccn3)CC2)[nH]n1 152654004 KPZFGYCAMNCACT-INIZCTEOSA-N 391.475 2.999 0 50 GFAA NC(=O)c1cccc(NC(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)n1 152809471 WEXJKDUCNJJJKB-UHFFFAOYSA-N 376.203 2.925 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1 170596461 VEJUXPDCSVLEGA-CHWSQXEVSA-N 380.297 2.975 0 50 GFAA CC1CCC(N2C[C@@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)CC1 170998575 ZGTOPUPLUFCXRY-RMXPPQQLSA-N 381.480 2.692 0 50 GFAA O=C(Nc1ncc(Cc2cccc(F)c2)s1)N1CC[C@@H](N2CCOCC2)C1 173784665 VFQVNMYGXZXFRM-MRXNPFEDSA-N 390.484 2.811 0 50 GFAA Cc1sc(-c2ccco2)nc1C(=O)N(C)CC1CCN(C[C@H](C)O)CC1 176889463 BBCBMFMLAYJFKJ-ZDUSSCGKSA-N 377.510 2.876 0 50 GFAA CCOc1cn(-c2ccccc2)nc1C(=O)N1CCC(c2n[nH]c(CC)n2)CC1 191486746 CBDZUJPQIAMNTR-UHFFFAOYSA-N 394.479 2.971 0 50 GFAA O=C(NCc1ccco1)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)cc1 239174191 PMCXEGKYIKKDNM-YDRVBMSGSA-N 388.423 2.767 0 50 GFAA CCCC[C@]12[C@@H]3[C@H]4[C@H]([C@@H]5[C@@H]1[C@@H]3[C@@]4(Br)C51OCCO1)C21OCCO1 252428368 ZTNRQRIGEAIPNV-FDJNSHFRSA-N 383.282 2.548 0 50 GFAA COC(=O)c1cnc(O)c([C@@H](CC(N)=O)c2ccc(-c3ccccc3)o2)c1O 253624015 ZDDPBGXHVRLXCS-LBPRGKRZSA-N 382.372 2.547 0 50 GFAA biogenic CCC[C@@H](NCC(=O)Nc1nc(-c2ccc(OC)cc2OC)cs1)C(=O)O 263561897 CKQBGHABZWFTMI-CYBMUJFWSA-N 393.465 2.609 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 268890021 JHZAPNACRUYFMX-VQTJNVASSA-N 378.428 2.984 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)N3CCC[C@@H]3C(=O)O)cc2)cc1 269129670 AOYHVMRDIYZAQU-GOSISDBHSA-N 387.457 2.658 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)c1cnns1)CC2 275634060 JRPTWVQTBHLLAS-OAHLLOKOSA-N 376.507 2.643 0 50 GFAA CN(Cc1ccccn1)[C@H]1CCCN(C(=O)C2CCN(CC(F)F)CC2)CC1 288023911 XTBXTUNFWGHYGX-IBGZPJMESA-N 394.510 2.872 0 50 GFAA CCCC(=O)NCc1cc(NS(=O)(=O)c2cccs2)cc(C(=O)OC)c1 299761772 YZAKLURJJTUJAG-UHFFFAOYSA-N 396.490 2.752 0 50 GFAA Cn1nc(C(F)F)c2cc(C(=O)N3CCC[C@@H]3[C@@H]3COCC[C@]3(C)O)sc21 329006527 NASRURNWGKMYRD-IUUKEHGRSA-N 399.463 2.965 0 50 GFAA Cn1cc(NC(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)c(C2CCCCC2)n1 333654189 LALOZXUAVIBGEF-CQSZACIVSA-N 382.530 2.756 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21 363728013 VUWHIYCXTFKJLI-RCVZYCBYSA-N 395.503 2.815 0 50 GFAA COCc1noc(CN[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)n1 366426218 YJDOHVGNLPHONC-VQIMIIECSA-N 399.422 2.896 0 50 GFAA O=C(NCc1ccnc(-n2cccn2)c1)N1CCOC[C@H]1c1ccc(F)cc1 457660775 HAFKVBVBDAVAIR-SFHVURJKSA-N 381.411 2.690 0 50 GFAA C[C@@H](C(N)=O)n1cc(-c2cccc(C(=O)N(Cc3cccnc3)C3CC3)c2)cn1 534579675 BKGKAOKSPDMILL-HNNXBMFYSA-N 389.459 2.796 0 50 GFAA CC(=O)Nc1cccc(CNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)c1 811999555 QXISXIRGIXFEFC-MRXNPFEDSA-N 375.375 2.726 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@@H]2CC(=O)N(c3cccc(Cl)c3)C2)CC1 1506421511 HTDAAWMBZRQHQP-GOSISDBHSA-N 398.894 2.735 0 50 GFAA Cc1nc2ncccn2c1C(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529162283 YPCLKHSRUJULLX-VQIMIIECSA-N 387.443 2.573 0 50 GFAA CC[C@H](CNc1noc(-c2ccc(OC)cc2)c1C(=O)O)N1CCOCC1 1704311233 AIRWELSBGFXJRF-CQSZACIVSA-N 375.425 2.571 0 50 GFAA O=C(CN1C[C@H]2CNC[C@]2(CCc2ccccc2)C1)N1CCc2ccccc21 1772804342 MYBBYXLZWSIGAQ-ZJSXRUAMSA-N 375.516 2.730 0 50 GFAA O=C(NCCc1noc(C2CC2)n1)[C@H]1CCc2sc(-c3ccncc3)nc2C1 1772818427 DZAPHNSJARIFRP-AWEZNQCLSA-N 395.488 2.929 0 50 GFAA Cc1noc2nc3c(c(C(=O)N4CCC[C@@]5(CCc6c[nH]nc65)C4)c12)CCC3 1775979681 XWVGZNKIKLREGF-OAQYLSRUSA-N 377.448 2.863 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)n1 1857698656 CBPTXDUWFBDBBG-WOJBJXKFSA-N 383.492 2.774 0 50 GFAA Cc1nc(N2C[C@@H](O)[C@H](F)C2)c2c(n1)C1(CC2)CCN(Cc2ccccc2)CC1 1857699011 DXFZTSXOUOLOAP-WOJBJXKFSA-N 396.510 2.784 0 50 GFAA CCCc1nc(C)cc(N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)n1 1857720113 FIZFVJQGKVLSFO-OALUTQOASA-N 380.492 2.744 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4cc5cc(F)ccc5n4C)[C@@H]2CC(=O)N13 1857729774 SJUSTXSIVVODGH-UEXGIBASSA-N 385.439 2.515 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCc4ccncc4C)CC3=O)sc2c1 1857731503 STKLWQLRKHXXNO-OAHLLOKOSA-N 380.473 2.977 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC(N5CCCC5)CC4)CC3)nc2n1 1857736947 RVWRLMSSIMPLGC-UHFFFAOYSA-N 397.523 2.834 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc(C)c(C(=O)N3CCCCC3)c2)CC1 1875365507 LNPZLYLXYURFBP-UHFFFAOYSA-N 383.492 2.984 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3cc(C(F)F)ccc3F)CC1)O2 1875394829 YFMYNVRPQAAJDV-AWEZNQCLSA-N 395.381 2.988 0 50 GFAA O=C(N[C@@H](c1ccccc1)[C@H](O)c1ccccc1)C1=NN[C@@H](C(F)(F)F)C1 2325804468 RENKAEHHOWYDHR-IXDOHACOSA-N 377.366 2.858 0 50 GFAA CCCN1CCC[C@]2(CCCN2S(=O)(=O)c2cc(C)c(C)cc2OC)C1=O 2356138078 DRZBGZCCBPKBBH-FQEVSTJZSA-N 394.537 2.868 0 50 GFAA Cn1c(=O)n(Cc2cccc(Cl)c2)c(=O)c2c1ncn2Cc1ccccc1 717445 AMVYIWDUIZXASU-UHFFFAOYSA-N 380.835 2.647 0 50 GFAA biogenic CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1-c1ccccn1 2389038 OLNYKKGYROGYHF-UHFFFAOYSA-N 383.433 2.820 0 50 GFAA O=C(CNC(=O)c1cccs1)NCCN1CCC(Cc2ccccc2)CC1 2913169 XUSKSADZEHKFPQ-UHFFFAOYSA-N 385.533 2.549 0 50 GFAA CS(=O)(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 4270536 ODALNVRTPRWQTH-UHFFFAOYSA-N 379.381 2.910 0 50 GFAA CC(=O)OCCCNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccco1 5092256 YERKLPJJGFGFFV-FOWTUZBSSA-N 390.823 2.773 0 50 GFAA Cc1nn([C@@H](C)C(=O)NCc2ccco2)c(=O)c2nn(-c3ccccc3)c(C)c12 6943968 QDPYBPUCMXNKFQ-HNNXBMFYSA-N 391.431 2.669 0 50 GFAA COc1ccc(OC)c(-c2ccnc(-n3ncc(C(=O)N4CCCC4)c3C)n2)c1 12282564 KEJYQQZUPWYGHQ-UHFFFAOYSA-N 393.447 2.891 0 50 GFAA CN(C)CCCN(C)Cc1cccc(OC[C@H](O)CN2CCCCCC2)c1 12464537 BYDIYPUDTKONIG-OAQYLSRUSA-N 377.573 2.686 0 50 GFAA COc1cccc(C[C@@]2(CCC(=O)N[C@H](C)Cc3cccnc3)CCC(=O)N2)c1 14885864 HPAUDVKXUTZQFE-UZUQRXQVSA-N 395.503 2.809 0 50 GFAA O=C(NCCc1cscn1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 19112052 HFBOTFZCWWYEDH-UHFFFAOYSA-N 399.516 2.895 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccco2)c2c1CC[C@@H](NCCCSC)C2 19839669 GJMOQOXOMDELSV-OAHLLOKOSA-N 390.553 2.968 0 50 GFAA CCCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCc1ccncc1)C2 20906350 VJNBYQZNOJXZSF-SFHVURJKSA-N 381.524 2.961 0 50 GFAA CCn1cc(NC(=O)Cn2ccc3cc(-c4ccc(OC)nc4)ccc32)nn1 23191457 HZEDDGMTYQCCEC-UHFFFAOYSA-N 376.420 2.962 0 50 GFAA Cc1cc(NC(=O)CN2CCN(C(=O)c3ccccc3)CC2)c2ccccc2n1 36054503 OTAAOGOSOMLTGP-UHFFFAOYSA-N 388.471 2.940 0 50 GFAA biogenic CCOc1ccccc1NC(=O)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528354 VMONJBATFDFKOU-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(Cc3ccc(-n4cccn4)cc3)C2)CC1 39551464 NDEYEEPNAVLILT-FQEVSTJZSA-N 395.551 2.639 0 50 GFAA COc1cc(CNc2ncnc3sc4c(c23)CCNC4)cc(OC)c1OC 65491467 CUOSCWFNBFMXAR-UHFFFAOYSA-N 386.477 2.975 0 50 GFAA Cc1csc(SCC(=O)N2CC[C@H](Cc3cccc(C(N)=O)c3)C2)n1 72153648 CSWWEANLRKDGMN-CQSZACIVSA-N 375.519 2.734 0 50 GFAA Cc1cc(=O)c(C(=O)N2CC[C@]3(CCCN(Cc4ccc(F)cc4)C3)C2)c[nH]1 72160932 QMBFLBYNKWGGCN-QFIPXVFZSA-N 383.467 2.951 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)C2)CN1CC1CC1 77386890 QKWFMYBUQGGHBS-JOCHJYFZSA-N 393.491 2.727 0 50 GFAA O=C(O)c1cc2c(nc1N1CCC3(CC1)Nc1ccccc1NC3=O)CCC2 82121956 KRTFACINFXKHPA-UHFFFAOYSA-N 378.432 2.672 0 50 GFAA O=C(COc1ccccc1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95352506 MYHHBPGQJWTHLK-MDNUFGMLSA-N 378.472 2.860 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)c1ccc(=O)n(C)c1 95517537 KZKPKIKUHXXREH-SFHVURJKSA-N 385.483 2.551 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)NCCc1nc(C)c3c(n1)CCCC3)C2 95519161 FOKRTIROKNOUAX-INIZCTEOSA-N 381.476 2.582 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)CCc4ccccc4)C3)nn2)n1 169778147 AJPHGEZEGNMTEC-INIZCTEOSA-N 380.452 2.858 0 50 GFAA CS(=O)(=O)Cc1nc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)cs1 173782469 PYEZHNBVVACDKZ-CQSZACIVSA-N 396.509 2.922 0 50 GFAA COc1ccccc1N1CC[C@@H](N(C)Cc2ccccc2N2CCOCC2)C1=O 176957696 XHAFBFJEYHVZIL-OAQYLSRUSA-N 395.503 2.769 0 50 GFAA O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 194928133 MTWZCXZERNTIAN-QUCCMNQESA-N 384.451 2.850 0 50 GFAA CCOC(=O)[C@@H]1C(=O)[C@H](C(=O)OCC)[C@@H](c2ccccc2)N[C@H]1c1ccccc1 230030975 NTLGEBKONYGIQW-FGYAAKKASA-N 395.455 3.000 0 50 GFAA COC(=O)[C@H]1[C@H](C(=O)OC)Sc2[nH]c(=O)sc2[C@H]1c1ccc(Cl)cc1 238901392 LXGQUFZYANWWRC-HOSYDEDBSA-N 399.877 2.658 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1cccc(Cl)c1Cl 239309220 HIJAFHPBJXZJSR-FSYDCMNOSA-N 384.215 2.673 0 50 GFAA C[C@@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1)[C@@]1(C)CCCO1 239636957 BHUSKJQLELFQKN-ANEJOOLBSA-N 396.535 2.998 0 50 GFAA COC(=O)N1CC[C@H](NC(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)C1 253428692 DSAVKRLZFBROAH-ZBFHGGJFSA-N 397.516 2.617 0 50 GFAA CC(=O)N[C@@H](C(=O)Nc1cccc(-n2ncc(C(=O)O)c2C)c1)C1CCCC1 262309568 NLWMWPDSEURRDV-GOSISDBHSA-N 384.436 2.512 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCC[C@@H](c4cc(C(N)=O)[nH]n4)C3)cc2s1 273381740 DVIOLZMEDFPVNX-LLVKDONJSA-N 384.465 2.838 0 50 GFAA O=C(Nc1cncc(F)c1)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O 281424744 DRQPMAZRBATKEH-MRXNPFEDSA-N 378.354 2.812 0 50 GFAA O=C(O)C[C@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1ccccc1 299749063 JARRPEAIUUUXSB-HNNXBMFYSA-N 387.823 2.815 0 50 GFAA CCC(=O)NC[C@H](C)Oc1ccc(CN2CCN(Cc3cccnc3)CC2)cc1 299793015 HTLMNZHCTJSUIB-IBGZPJMESA-N 396.535 2.693 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2CCCN(C)C2=O)cc1NC(=O)c1ccccc1F 480146295 RKAARRSZEUDKJF-QGZVFWFLSA-N 383.423 2.737 0 50 GFAA COc1ccc(CN(C[C@H]2CCCO2)C(=O)CCN2CCCCCC2=O)cc1 824668746 LGOKLHZGUSVEFK-HXUWFJFHSA-N 388.508 2.996 0 50 GFAA Cc1cccc(CC(=O)N2C[C@@H](C(=O)O)C[C@@H](c3cnn(C)c3)C2)c1Cl 868457651 ZVTGYBJDRMBQGV-CABCVRRESA-N 375.856 2.641 0 50 GFAA O=C1COc2c(cc(C(F)(F)F)cc2NC(=O)[C@H]2CCC(=O)c3cccn32)N1 886091116 OIGZTXBFXUBZIW-CYBMUJFWSA-N 393.321 2.994 0 50 GFAA COc1ccc(NC2(C(=O)NCCNC(=O)c3cccnc3)CCCCC2)cc1 952981558 NHTAVXXSULWQFV-UHFFFAOYSA-N 396.491 2.751 0 50 GFAA CC(C)Oc1cccc(CN2CCCN(S(=O)(=O)N3CCCCC3)CC2)c1 952989008 RGONVDNANSZDDH-UHFFFAOYSA-N 395.569 2.712 0 50 GFAA O=C(N1CCCC1)N1CC[C@@]2(O)CCN(Cc3ccccc3Cl)C[C@H]2C1 1073294837 ZIGVNTOLRMGBNV-PXNSSMCTSA-N 377.916 2.815 0 50 GFAA COc1c(F)ccc(C(=O)NCC2CCN(C(=O)C3CC=CC3)CC2)c1F 1506413146 HFMDUGJEORWCRA-UHFFFAOYSA-N 378.419 2.908 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC2CCN(C(=O)c3cccnc3)CC2)n1 1506419474 QHERXAYGXHQQNN-UHFFFAOYSA-N 393.413 2.636 0 50 GFAA COc1cc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)ccc1OCc1cccc(F)c1 1529110063 KMRVJOYHITWVTG-ROUUACIJSA-N 389.423 2.681 0 50 GFAA COc1cc(C(=O)N2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)nc2ccccc12 1704278275 LZULCMZTLKWAPE-VLIAUNLRSA-N 381.432 2.870 0 50 GFAA COc1ccc(F)c(F)c1CN1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704304265 BWPCFWXJFIMYCJ-WIYYLYMNSA-N 391.414 2.854 0 50 GFAA O=C1CCc2c1cccc2C(=O)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857674740 WLIOGFJMHRVHBC-QHCPKHFHSA-N 390.439 2.705 0 50 GFAA CCn1cc(CN2CCC[C@@]3(C(=O)NCC4=CCCCC4)CCN(C)C[C@H]23)cn1 1857678705 LKTYYVRNQHVJRJ-JTHBVZDNSA-N 399.583 2.806 0 50 GFAA COc1ccc(C(=O)NCCc2cnc[nH]2)cc1Oc1cccc(OC)c1CN 1857682996 OKWZUVLJUOAZEL-UHFFFAOYSA-N 396.447 2.650 0 50 GFAA Cc1nc[nH]c1CC(=O)N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857713268 NYROTPVGUBKHAM-OAQYLSRUSA-N 383.496 2.560 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4c[nH]nc4-c4cccc(F)c4)[C@@H]2CC(=O)N13 1857719676 SLHQUSUTAKYAHU-UEXGIBASSA-N 384.455 2.774 0 50 GFAA O=C1CCO[C@H]2CN(CCCOc3ccccc3)C[C@@H]2N1Cc1ccccc1 1857727175 MPAJDCYNOMSWNZ-VXKWHMMOSA-N 380.488 2.957 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857732850 KEQBZEJODUOIDX-QFIPXVFZSA-N 395.507 2.770 0 50 GFAA Cn1nccc1CCC(=O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857740701 VLKRFEMABDYGEF-WOJBJXKFSA-N 383.492 2.627 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(F)cc1F 1875304805 VRYOIEUIMDPDCR-HZMBPMFUSA-N 394.340 2.871 0 50 GFAA CS(=O)(=O)Cc1ccc(NC(=O)[C@@H]2CCc3cc(F)ccc3O2)cc1F 1875306379 CMYWDYWAQNRVTE-KRWDZBQOSA-N 381.400 2.842 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)Cc2ccc3c(c2)COCC3)C[C@H]1c1ccccc1 1875383572 ZNQLCEGOGWNURI-FCHUYYIVSA-N 390.483 2.599 0 50 GFAA Cc1ccc2nc(CNC(=O)C(=O)Nc3ccc4c(c3)CN(C)CCC4)[nH]c2c1 2325799409 VDATVNDCXUNEIK-UHFFFAOYSA-N 391.475 2.504 0 50 GFAA CCc1ccccc1NC(=O)CNC(=O)CN1CCN(C)c2ccc(C)cc21 2325851395 YRJQDVPMGQXNNZ-UHFFFAOYSA-N 380.492 2.569 0 50 GFAA CC(=O)Oc1ccccc1-c1nc2s/c(=C\C=C\c3ccccc3)c(=O)n2n1 1134030 WJMXIVZBZBHGCG-DQBOXZGESA-N 389.436 2.956 0 50 GFAA CSCC[C@H](NC(C)=O)C(=O)Oc1ccc2c3c(c(=O)oc2c1)CCCC3 2998131 VWRFWVKNUVYEDF-KRWDZBQOSA-N 389.473 2.835 0 50 GFAA O=C1C[C@H](C(=O)N2CCN(c3ccccc3)CC2)CN1CCc1ccc(F)cc1 6715827 ATOBNJNVCABOKI-IBGZPJMESA-N 395.478 2.566 0 50 GFAA O=C(Nc1ccccn1)[C@@H]1CCCN(c2ncnc3c2nc2n3CCCCC2)C1 6899823 LQZSOJGMZXTBII-OAHLLOKOSA-N 391.479 2.803 0 50 GFAA C[C@@H]1C[C@@]2(C[C@](C)(C(=O)CSc3nc4ccccc4s3)OC2=O)C(=O)O1 7991394 UBMQUKPOVZTBAS-AQQIJUCISA-N 391.470 2.985 0 50 GFAA aggregator COC[C@@H](C)N1CCC(Oc2ccc(C(=O)NCc3ccncc3)cc2)CC1 12203878 WOLUIVUGDGUYQZ-QGZVFWFLSA-N 383.492 2.890 0 50 GFAA CCCS(=O)(=O)c1ncc(CN(C)Cc2ccsc2)n1C[C@@H]1CCCO1 12317006 KVVPITSZOWCTSO-KRWDZBQOSA-N 397.566 2.939 0 50 GFAA Cc1cccc(NC(=O)CCC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)c1 12386696 GDMYMWWXJKMNRY-UHFFFAOYSA-N 384.480 2.561 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCC[C@@H](Nc2ccc(F)c(F)c2)C1 12432064 BTELGUXZWHEUON-QGZVFWFLSA-N 398.417 2.716 0 50 GFAA Cc1ccc(Cl)cc1N([C@@H](C)C(=O)NCc1ccncc1)S(C)(=O)=O 13679952 DHIYCHJSZJZFEF-ZDUSSCGKSA-N 381.885 2.514 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCc2c(cc(-c3ccccc3)c(=O)n2C)C1 14531663 OTLYFSRIBIQLTG-UHFFFAOYSA-N 376.460 2.776 0 50 GFAA COc1ccc(OC)c2c1cc(C(=O)NCCCc1nnc3ccccn13)n2C 36367244 GSXBPLAONOLZSS-UHFFFAOYSA-N 393.447 2.601 0 50 GFAA COC(=O)C[C@]1(c2ccccc2)C(=O)NC(=O)N1CCCOCc1ccccc1 44126558 QGGRJWAPHNVPFG-QFIPXVFZSA-N 396.443 2.604 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)N1CCC[C@H](OCc2ccccn2)C1 55090804 HYULMUYYFUWTSJ-INIZCTEOSA-N 387.505 2.859 0 50 GFAA CC(=O)Nc1cc(NC(=O)CN2CCN(c3ccc(F)cc3)CC2)ccc1C 55566603 KQJQEFZDQSKOOO-UHFFFAOYSA-N 384.455 2.853 0 50 GFAA O=C(CCN1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2)NC1CC1 77521829 LMKKQRVJRRVBSF-UHFFFAOYSA-N 389.927 2.823 0 50 GFAA CN1CCN(c2ccc(C(=O)N3CCC[C@](CC4CC4)(C(=O)O)C3)cc2)CC1 91269998 QAYWLVNTDQYAIB-JOCHJYFZSA-N 385.508 2.546 0 50 GFAA C[C@@H](NC(=O)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O)c1ccncn1 91656454 KSCAWLFHOWHOFU-CSNVJCEJSA-N 379.464 2.519 0 50 GFAA O=C(c1cnoc1-c1ccccc1)N1C[C@H]2CC[C@@H]1CN(c1ncccn1)C2 91656649 DLSOWHKZGFGNDI-DOTOQJQBSA-N 375.432 2.873 0 50 GFAA CC(C)c1ccc(N2C[C@@H](C(=O)NCc3cnn4cccnc34)CC2=O)cc1 91663700 UCGATYOGZDOITE-INIZCTEOSA-N 377.448 2.522 0 50 GFAA CCn1cc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95369754 TUWNPUCHEFOSAD-PWRODBHTSA-N 380.492 2.614 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cn1ccc3ccccc31)C2 95370487 PUFOKZLSHGNGQJ-PKOBYXMFSA-N 388.471 2.800 0 50 GFAA CN1C(=O)C[C@@H](C(=O)O)C12CCN(Cc1cccc(OC3CCCC3)c1)CC2 95380980 LJLFPQVWNORXCR-IBGZPJMESA-N 386.492 2.906 0 50 GFAA COCC(=O)Nc1cccc(NC(=O)N2CCCC[C@H]2CCn2cccn2)c1 96130317 UROAILLWIUHULL-SFHVURJKSA-N 385.468 2.945 0 50 GFAA CS(=O)(=O)NCCc1nc(CCc2ccccc2)nn1C1CCCCC1 96132990 ARHNWYVBYNOPJO-UHFFFAOYSA-N 376.526 2.660 0 50 GFAA Cc1ccc2nc(CNC(=O)Nc3ccc(CN4CCOCC4)cc3)cn2c1 96162530 YSSJEKKOXGSYCN-UHFFFAOYSA-N 379.464 2.797 0 50 GFAA O=c1cc(CN2CCN(Cc3ccsc3)[C@H](CCO)C2)[nH]c2ccccc12 96792292 ZRNUFCUCBFKMEM-GOSISDBHSA-N 383.517 2.658 0 50 GFAA Cc1cc2c(cc1NC(=O)N1CCNC(=O)[C@@H]1c1cccc(F)c1)OCCO2 97679811 ZZFSAGBLZMAKNF-SFHVURJKSA-N 385.395 2.610 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)Nc1ccc(CC(=O)N2CCOCC2)cc1 115028118 QNEBAATYYNQFAV-OAQYLSRUSA-N 394.471 2.731 0 50 GFAA C[C@@H](NC(=O)c1cccs1)C(=O)N[C@@H](CC(=O)O)c1ccc(Cl)c(F)c1 170592128 JPXTYANJFCGXMN-RNCFNFMXSA-N 398.843 2.991 0 50 GFAA Cc1ncc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c(C(C)C)n1 188298087 PLUBKXQMGUMKOM-UHFFFAOYSA-N 386.427 2.772 0 50 GFAA CCc1nc(C2CCN(C[C@@H](O)COc3cc(C)ccc3Cl)CC2)n[nH]1 190658906 CAVPOXFJTKUOED-OAHLLOKOSA-N 378.904 2.948 0 50 GFAA CCN(C(=O)NCCC(=O)N1C[C@H](C)O[C@@H](C)C1)[C@@H](C)c1ccc(F)cc1 229582674 FVZDMJVUQOXYSL-JYJNAYRXSA-N 379.476 2.944 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)CCCCc2ccc(Br)cc2)CCO1 238193319 PLDSMIJSQJOJCW-OAHLLOKOSA-N 384.270 2.864 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](CNC(=O)c3ccc(NC=O)cc3)C2)c1 363958525 HKZFNXUBSYQXHF-HNNXBMFYSA-N 383.448 2.528 0 50 GFAA COc1ccccc1-n1cnnc1CN1CCC(C(=O)n2nc(C)cc2C)CC1 409444230 TZBHMTIAQSXFPE-UHFFFAOYSA-N 394.479 2.642 0 50 GFAA CN(CCOc1cccc(Cl)c1)C(=O)Cn1nccc1[C@@H]1CCCNC1 426388228 XDROAWBDMMGSEG-OAHLLOKOSA-N 376.888 2.541 0 50 GFAA CC[C@@H]1CN(CCNC(=O)c2onc3c2CCCC3)Cc2cc(OC)ccc2O1 426547506 BEBOFTJGIJXHNX-MRXNPFEDSA-N 399.491 2.965 0 50 GFAA CC(C)N1C(=O)CN(S(=O)(=O)Cc2ccccc2C(F)(F)F)CC1(C)C 462595640 USXBQGTXGXEKAJ-UHFFFAOYSA-N 392.443 2.866 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)c3cc(CC(C)C)nc(O)n3)CC2)cc1 670441144 OEZPXCHCYOZDNE-UHFFFAOYSA-N 396.491 2.724 0 50 GFAA Cc1ccc(N2CCC(C(=O)N(C)[C@@H](Cc3ccccc3)C(=O)O)CC2)nc1 738280772 SPEQROGMVLKECJ-IBGZPJMESA-N 381.476 2.761 0 50 GFAA O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)[C@H]1CC[C@@H](c2ccccc2)O1 952963426 LCDGDZIFAPSKAS-JKSUJKDBSA-N 384.398 2.966 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cc1C(=O)N(C)C 952983739 QWFQGSUAGYRQLR-CQSZACIVSA-N 385.395 2.601 0 50 GFAA O=C(O)[C@H](Cc1ccc(O)cc1)NC1CCN(c2ccc(F)c(F)c2)CC1 1506423817 FQPUVLYVWYXVFN-IBGZPJMESA-N 376.403 2.925 0 50 GFAA COc1ccc2ccc(OC)c(CN3C[C@@H](O)[C@H](Cc4cc(C)[nH]n4)C3)c2c1 1529090270 FSKILNQALBVNPV-IIBYNOLFSA-N 381.476 2.924 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)CC1CCN(Cc2ccccc2)CC1 1704330475 DHEZVRWDBUEBFF-UHFFFAOYSA-N 397.567 2.911 0 50 GFAA O=C1CCCN1CCN1C[C@@H]2CN(CC3CC3)C[C@]2(CCc2ccccc2)C1 1772809241 PZVFKQWABYPPAK-VWNXMTODSA-N 381.564 2.885 0 50 GFAA CCC[C@H](CC)C(=O)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(C)n2)C1 1775990970 GRLUROXIBPNFMT-LAUBAEHRSA-N 375.513 2.872 0 50 GFAA Cc1cccc(OC(C)(C)C(=O)N2C[C@@H](C(=O)O)C3(CCOCC3)C2)c1C 1800414885 XLGNZNNUCYYLID-INIZCTEOSA-N 375.465 2.801 0 50 GFAA CSc1ccc2cc(-c3nccn3[C@@H]3CCS(=O)(=O)C3)c(O)nc2c1 1857692549 KBRFBZLERXJFFL-GFCCVEGCSA-N 375.475 2.885 0 50 GFAA Cc1oc(-c2ccccc2Cl)cc1C(=O)N1C[C@@H]2OCCC(=O)N(C)[C@H]2C1 1857709487 AEDXTYPWLZTZIE-WMZOPIPTSA-N 388.851 2.980 0 50 GFAA COc1cccc(-c2ncc(CN3C[C@@H](O)[C@H](Cc4cnccn4)C3)s2)c1 1857723063 VSGNAQSECGKKKL-DNVCBOLYSA-N 382.489 2.644 0 50 GFAA Cc1nc2c(c(=NCCO)[nH]1)CC[C@@]21CCCN(Cc2cccc3[nH]ccc23)C1 1875245974 VIBMGVAZXKRZLP-HSZRJFAPSA-N 391.519 2.572 0 50 GFAA Oc1nc(N2CCC[C@H](n3nccn3)C2)nc2ccc(Br)cc12 1875273537 HMUNYBIRFMCLHL-NSHDSACASA-N 375.230 2.531 0 50 GFAA C[C@H]1c2ccccc2CCN1C(=O)NCc1cccc(CNS(C)(=O)=O)c1 1875295826 RTYBZBSSMNSSMM-HNNXBMFYSA-N 387.505 2.565 0 50 GFAA CCc1cc(OC)cc(OC)c1C(=O)N1CC[C@@](C(=O)O)(C2CCOCC2)C1 1875319330 XPLXKLHMSXUHSU-NRFANRHFSA-N 391.464 2.610 0 50 GFAA O=C(NCc1ccccc1N1CCCC1)N1CC[C@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401767 REFLRKYKOFRXCV-SJLPKXTDSA-N 396.495 2.793 0 50 GFAA O=C(N[C@H]1C[C@H](C(=O)N2CCCCC2)C[C@@H]1O)c1ccc(N2CCCCC2)cc1 2100556820 IUBKIJZZKWEAFO-JBACZVJFSA-N 399.535 2.559 0 50 GFAA COc1ccccc1[C@H](N)CNC(=O)COc1ccc(Br)cc1 2325745475 GPDCCDNNGCWFEV-OAHLLOKOSA-N 379.254 2.653 0 50 GFAA Cn1cccc(CN2CC[C@H]3[C@@H]2CCN3CCCOCc2ccccc2)c1=O 2356160560 YBHCQWYLWKXTNQ-VXKWHMMOSA-N 381.520 2.641 0 50 GFAA COc1cccc(OC)c1C(=O)Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1 1109980 SWJWJVKOFQNUGU-MRXNPFEDSA-N 384.432 2.865 0 50 GFAA Cc1cc(Cl)c(S(=O)(=O)N2CCCc3ccccc32)cc1OCC(N)=O 1112290 BRIYDUAVZIGTLQ-UHFFFAOYSA-N 394.880 2.654 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)NC(=O)N(c2ccccc2F)C1=O)C1CCCCC1 4858576 FGPFGJGWMKJMCW-MRXNPFEDSA-N 387.333 2.837 0 50 GFAA CCN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1 110815812 ZCCYNOFJQFVTNP-INIZCTEOSA-N 376.476 2.624 0 50 GFAA CCOc1ccc(OC[C@@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)cc1 225835831 WWKCPAAOUHAXQF-AOMKIAJQSA-N 397.427 2.646 0 50 GFAA Cc1ccc(CC(=O)N2CCN([C@@H]3CCN(c4ccccc4)C3=O)CC2)s1 112623087 MRQPXVCEFXAGBC-LJQANCHMSA-N 383.517 2.549 0 50 GFAA COc1ccc2nc(CCNC(=O)CC(=O)Nc3cc(C)cc(C)c3)[nH]c2c1 55134156 RMHOZJRQJIJTSB-UHFFFAOYSA-N 380.448 2.876 0 50 GFAA CCCCn1cnc2sc3c(c2c1=O)CC[C@H](NCc1cn(C)nc1C)C3 23581469 FSQHMZZOAFRUCM-HNNXBMFYSA-N 385.537 2.947 0 50 GFAA CCNC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cnn(CC)c3C)n2)C1 20452157 FEPVTBCNHBOLIJ-UHFFFAOYSA-N 395.467 2.719 0 50 GFAA C[C@H](c1ncnc(Cl)c1F)[C@@](O)(Cn1cncn1)c1ccc(F)cc1F 21298435 BQDLXFABVRRDFU-ABKXIKBNSA-N 383.761 2.830 0 50 GFAA in-vitro CS(=O)(=O)c1ccc2ncnc(NCc3cccnc3OCC(F)F)c2c1 252489811 KBGWANGGKCVYST-UHFFFAOYSA-N 394.403 2.684 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(N2CCO[C@H](c3nccs3)C2)n1 328635678 NOQDKIZJQYWXJJ-ZOBUZTSGSA-N 389.525 3.127 0 50 GFAA COC(=O)[C@@H]1CCCCN1C(=O)c1cc(COc2cccc3cccnc23)on1 12707684 JSGOQQHZONDRGT-KRWDZBQOSA-N 395.415 2.970 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)c1cn(-c2ccccc2)nn1 155677537 UTLKHOUBOBALQZ-QAPCUYQASA-N 393.447 2.732 0 50 GFAA CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1ccc(F)cc1F 127329920 AYDZHGJXRPINGJ-GOSISDBHSA-N 394.443 2.926 0 50 GFAA COc1cc(NC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)ccc1NC(N)=O 378151357 QXSYCFLDCQFTRO-SFHVURJKSA-N 396.447 2.660 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3cnn(-c4ccc(F)cc4)n3)c2)n1C 378217451 KQSYXPJUZUVDOH-UHFFFAOYSA-N 377.383 2.763 0 50 GFAA CCn1c(C)ccc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCC(C)C)C2)c1=O 72475667 GDWJWOYLEGLQQS-PKOBYXMFSA-N 387.524 2.676 0 50 GFAA C[C@@H]1CCN(C(=O)NCc2nnc3ccccn23)CCN1Cc1ccccc1 174726303 PITGRFBXMJNAGY-QGZVFWFLSA-N 378.480 2.535 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)N[C@H](CN3CCCC3=O)c3ccccc3)C2)n1 130863089 BJPHINPXLXFOAI-ZWKOTPCHSA-N 397.479 2.631 0 50 GFAA CCCN1CCC(N2C[C@H](NC3CCC(CC)CC3)C[C@H]2C(=O)NC)CC1 20909707 MUDXULPCSQHYKV-BRAJZSMUSA-N 378.605 2.608 0 50 GFAA CN(CC(=O)N1CCC[C@]2(CCC(=O)N(C3CC3)C2)C1)Cc1ccc(F)cc1 91594292 HSYYQQNZMCEEMR-QFIPXVFZSA-N 387.499 2.651 0 50 GFAA CC(C)=CCN1CC2(CCN(c3cc(C(=O)NC4CC4)ccn3)CC2)CC1=O 91474367 PNMAZBBATFFURL-UHFFFAOYSA-N 382.508 2.759 0 50 GFAA COc1ccccc1-n1nc(CCc2ccccc2)nc1C[C@@H]1CNCCO1 96152252 FVXHRCPODLETJA-GOSISDBHSA-N 378.476 2.592 0 50 GFAA CN1CC[C@@H]2[C@H](CCCN2C(=O)NC2CCN(CCc3ccccc3)CC2)C1 182301069 XQEXVPXHJKDNJV-IFMALSPDSA-N 384.568 2.819 0 50 GFAA Cc1cc(OCC(=O)NC[C@H]2CC[C@H](C(=O)O)CC2)c2c(C)cc(=O)oc2c1 245241020 WKVKJOYONAXNFU-SHTZXODSSA-N 387.432 2.796 0 50 GFAA biogenic CC(C)c1cccc(-n2cc(O)c(C(=O)N3CCOCC4(CCOCC4)C3)n2)c1 182925845 WBFKUYQEKZOCPV-UHFFFAOYSA-N 399.491 2.971 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCC(n4ccnc4)CC3)C2)cc1 299531439 NBIXEACCNMFTKC-LJQANCHMSA-N 380.492 2.907 0 50 GFAA CC[C@H](CNC(=O)N1CCC(Oc2ccc(C)cc2)CC1)N1CCOCC1 534644186 ZTIOXZJSMXCFML-GOSISDBHSA-N 375.513 2.659 0 50 GFAA Cc1ccc(-c2nc(NC(=O)C[C@@H]3C(=O)N(C)C(=O)N3C)sc2C)c(C)c1 1940197767 OXMZZOKWKFFLCW-CQSZACIVSA-N 386.477 2.956 0 50 GFAA Cc1cc(C(=O)NC(C)C)ccc1NC(=O)N1CCN(c2cccnc2)CC1 299769632 SQZJAQRTNRWMJV-UHFFFAOYSA-N 381.480 2.882 0 50 GFAA COc1ncnc(C)c1-c1cccc(C(=O)NCCc2noc(C3CC3)n2)c1 584902270 NLWJVOVDCHZYMI-UHFFFAOYSA-N 379.420 2.694 0 50 GFAA CC[C@@H](C)C(=O)Nc1ccccc1NC(=O)c1ccc(Cn2cnnn2)cc1 822559932 GELKBVRTRIHOKQ-CQSZACIVSA-N 378.436 2.958 0 50 GFAA Cc1csc2c(N3CCN(c4ccc(C(N)=O)cn4)CC3)nc(C3CC3)nc12 1875286344 OZDQOUMZLQFNCX-UHFFFAOYSA-N 394.504 2.698 0 50 GFAA CCc1nc([C@H]2CN(C(=O)Cc3cccc(OC(C)C)c3)Cc3c[nH]nc32)n[nH]1 1875393397 MGVYQVDTYCCJTR-KRWDZBQOSA-N 394.479 2.594 0 50 GFAA COc1cc(C)cnc1C(=O)N[C@H]1CC[C@H](CNC(=O)c2coc(C3CC3)n2)C1 1875333627 FAGURRYVMPXENA-ZFWWWQNUSA-N 398.463 2.593 0 50 GFAA O=C1CCCCN1C1CCN(c2cc(-c3ccccc3)nc3ncnn23)CC1 301646978 DKHTVFVQQAYJLU-UHFFFAOYSA-N 376.464 2.773 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(CC[C@@H]1CCOC1=O)CC2 276402468 KMDPWPAEVCCAHG-QZTJIDSGSA-N 376.522 2.904 0 50 GFAA C[C@@H](NC(=O)c1ccoc1)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1 170614970 GOXYNQATWDTYDL-CZUORRHYSA-N 393.484 2.598 0 50 GFAA O=C1CCCc2cc(NS(=O)(=O)c3cnn(-c4ccccc4)c3)ccc2N1 171267655 HWLRSAPGCGOQAL-UHFFFAOYSA-N 382.445 2.948 0 50 GFAA CC(C)N(Cc1ccccc1)C(=O)CN1CCN(c2cc(C3CC3)n[nH]2)CC1 189703525 HAQCKZBVBTURBV-UHFFFAOYSA-N 381.524 2.846 0 50 GFAA Cc1ccc(CN2CC[C@H](NC(=O)c3cc(F)c(F)c(O)c3F)C2=O)cc1 192294165 WRBDFMDTXDOHKP-AWEZNQCLSA-N 378.350 2.649 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@@H](c3nccn3C)C3CC3)o2)c1C 1506399267 LGVJOOJHEBLREZ-OAHLLOKOSA-N 376.438 2.715 0 50 GFAA CCc1cc(NCCc2nc(C)cc(C(F)(F)F)n2)nc(N2CCOCC2)n1 1529125061 HFSPCBCKNULBSQ-UHFFFAOYSA-N 396.417 2.647 0 50 GFAA CCOC(=O)[C@]1(CCOc2ccccc2)CCCN(C(=O)c2cnccn2)C1 11840479 WTZYQLXLVGODCJ-NRFANRHFSA-N 383.448 2.731 0 50 GFAA COc1ccccc1C(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)noc2C)C1 12005310 KIWFPMPFZBQAGS-CQSZACIVSA-N 378.450 2.584 0 50 GFAA COc1ccccc1CCC(=O)N1C[C@@H]2C[C@H]1C(=O)N2c1cc(C)ccc1OC 12279545 NHVBLEPVSIEQJA-HKUYNNGSSA-N 394.471 2.961 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H]2CC(=O)N(Cc3cccc(F)c3)C2)c(C)c1 12707039 SWNDCMMVRBFYJH-QGZVFWFLSA-N 376.453 2.522 0 50 GFAA CCN(C)C(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)c1cn(C)cn1 1857708843 QDTUOCZXUBQSPT-LRXVAGHRSA-N 380.492 2.504 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCN[C@H](c2ccccc2)C1 1857713036 AOLZYQMALDCUEY-INIZCTEOSA-N 379.489 2.949 0 50 GFAA O=C(CNC1CC1)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1857718105 OCOJGJCMGISMEX-LEWJYISDSA-N 380.444 2.809 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3CCCC3)C[C@]23CC[C@H]1O3)c1cnc(C2CC2)nc1 1857719797 VPWQUWIRICGBEQ-JZJXAQOMSA-N 382.508 2.506 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3c(-c4ccccc4)ccnc3C)C[C@H]2O)n[nH]1 1857720974 SRAVMRZZSLBDOB-YLJYHZDGSA-N 376.460 2.764 0 50 GFAA CS(=O)(=O)NCCN(Cc1nc(-c2c(F)cccc2F)cs1)C1CC1 225844470 AUPCCWCIUYIZIS-UHFFFAOYSA-N 387.477 2.602 0 50 GFAA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)[C@@H]1CCCN(Cc2ccccc2)C1 263823965 RBVNNIJMWKZORB-QZTJIDSGSA-N 383.458 2.899 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1cccc(I)c1 100237366 VFDICGXUUGFPGQ-TXFQPVFDSA-N 379.197 2.993 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N(CCc3ccccc3)C(C)=O)C2=O)cc1 100059348 QFHHPDSLYUNOOV-HXUWFJFHSA-N 380.444 2.808 0 50 GFAA CN1CCO[C@H](CN(C)C(=O)C2C[C@@H]3CCC[C@H](C2)C32SCCS2)C1 2325760317 JFJTYKHQNZWCSL-HMQMGEFJSA-N 384.611 2.778 0 50 GFAA OC[C@]1(NCc2ccc(-n3cncn3)cc2)CCc2cc(Br)ccc21 2325812821 KETBFUQUUXEREX-LJQANCHMSA-N 399.292 2.953 0 50 GFAA C[C@H](c1ccccc1)N1C[C@@H](C(=O)N2CCC(c3ccnn3C)CC2)CC1=O 124355134 HKFAMGOWBOMOIE-APWZRJJASA-N 380.492 2.736 0 50 GFAA CC(C)n1c(SCC(=O)c2ccc(Cl)cc2)nc2c1c(=O)[nH]c(=O)n2C 626340 MSPJLELOYZXLLI-UHFFFAOYSA-N 392.868 2.633 0 50 GFAA O=S(=O)(NNC(=S)NCc1ccccc1)c1cc(Cl)ccc1Cl 1117480 CDYCULNIIJBALY-UHFFFAOYSA-N 390.317 2.851 0 50 GFAA O=C(c1cn(CC(=O)N2CCC[C@@]23CCCNC3=O)c2ccccc12)C1CC1 2356150154 OITTVUQCVCJJJB-JOCHJYFZSA-N 379.460 2.505 0 50 GFAA CN1C[C@H]2C[C@@H](N(C)S(=O)(=O)c3ccccc3C(F)(F)F)C[C@H]2CC1=O 2356156920 WWEXOVHQAHXVMJ-XQQFMLRXSA-N 390.427 2.583 0 50 GFAA Cc1ccccc1N1C[C@@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)CC1=O 7450860 OHOMGHVCOGIWCG-KRWDZBQOSA-N 381.451 2.836 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N(C)CC2(CO)CCOCC2)cc1C 55088912 WXYRGTJMTPBMEI-UHFFFAOYSA-N 377.481 2.604 0 50 GFAA C[C@H](CNC(=O)C1CCN(S(C)(=O)=O)CC1)Cc1cccc2ccccc12 65363464 FYXRUXCNLIETEU-INIZCTEOSA-N 388.533 2.806 0 50 GFAA O=C(CC[C@@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1nc2c(s1)CCC2 170625633 IEDABWXOZMYBHP-HNNXBMFYSA-N 398.488 2.514 0 50 GFAA COC(=O)CCn1cc([C@@H]2C[C@H](NC(C)=O)C[C@H](C3CCCCC3)O2)cn1 65371736 ZYUVXJIWUCPPME-QRVBRYPASA-N 377.485 2.751 0 50 GFAA CC(=O)Nc1ccc(C)c(C(=O)Nc2ccc(C)c(C(=O)N3CCOCC3)c2)c1 470443385 GIDSMBYDLIAJJV-UHFFFAOYSA-N 395.459 2.987 0 50 GFAA Cc1cnc(C(=O)N2CCOc3c(O)cc(-c4nc(C)cnc4C)cc3C2)cn1 67770787 ZPEWTUQIFVTWPH-UHFFFAOYSA-N 391.431 2.599 0 50 GFAA O=C(Nc1ccc(Sc2ccncc2)cc1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252532858 FINDNAJGWYPGRY-OAHLLOKOSA-N 393.472 2.568 0 50 GFAA COc1ccc(OCCN2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1 65397736 YFIBYGVBGZPEKJ-UHFFFAOYSA-N 388.415 2.767 0 50 GFAA CCOC(=O)c1sc2ncn3nc(CCn4nc(C)cc4C)nc3c2c1C 2791481 XOMKEZMUDUCXKQ-UHFFFAOYSA-N 384.465 2.880 0 50 GFAA COC(=O)c1sc(NC(=O)[C@@H](C)n2ncc(Br)c2C)nc1C 2802369 CNDFSKJLPBGSDE-MRVPVSSYSA-N 387.259 2.705 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccc(N(C)C)nc3)CC2)cn1 328654974 XXBLDNQQHPEBNO-QGZVFWFLSA-N 382.512 2.715 0 50 GFAA CC1=NN(C(=O)[C@H](C)Cn2nc(C(F)(F)F)cc2C)[C@](O)(C(F)(F)F)C1 6787427 LBJVAORUMNJEIL-JMCQJSRRSA-N 386.296 2.706 0 50 GFAA CN1CCC[C@H](N2CCN(C(=O)Cc3csc(-c4cccs4)n3)CC2)C1 363218115 FSXBNNAANLOWGV-INIZCTEOSA-N 390.578 2.653 0 50 GFAA NC(=O)c1cnc(NC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)s1 363369990 YEBIDWKAOUPSOL-INIZCTEOSA-N 398.410 2.635 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1C 373140174 MDWVHQCPRANTJL-DLBZAZTESA-N 380.510 2.781 0 50 GFAA Cn1ccnc1[C@@H]1CCN(C(=O)c2cccc(NC(=O)c3cccnc3)c2)C1 378267722 MBKTUVNIJNHPOS-QGZVFWFLSA-N 375.432 2.697 0 50 GFAA Cc1nc(C2(NC(=O)CN3CCOc4ccc(Cl)cc43)CCCC2)no1 174191131 WMRXPEMTNGPSMG-UHFFFAOYSA-N 376.844 2.816 0 50 GFAA Cc1cc(N2CCC(NC(=O)c3ccc4c(c3)OC(F)(F)O4)CC2)nc(C)n1 450059651 UMODTAYTAIWUQW-UHFFFAOYSA-N 390.390 2.814 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1cc[nH]c1 95524350 WLWSSORVXUKZMD-SFHVURJKSA-N 381.520 2.983 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCC4(CC3)c3[nH]cnc3CCN4C)cc2c1 91270340 LUWVMKYYJFMTDC-UHFFFAOYSA-N 379.464 2.519 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(Cc1cccc(OC(F)F)c1)CCN2C 91873187 YNBXFRZVRLKKGK-FQEVSTJZSA-N 381.467 2.807 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(C(=O)CN3CCCC3=O)CC2)C1 96162365 NXPZHCDUCUYUKJ-HXUWFJFHSA-N 383.536 2.727 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@@H]3CC[C@H]1[C@@H]32 248042633 OQPJCJPJPNWQBN-SZMOUFAASA-N 379.504 2.873 0 50 GFAA O=C(Nc1cc(C(F)(F)F)cnc1O)[C@@H]1CCCN1C(=O)Cc1ccccc1 299201708 OCZPAVWCZGBAPT-HNNXBMFYSA-N 393.365 2.978 0 50 GFAA FC(F)(F)c1cc(N2CCN(CCn3cncn3)CC2)c2ccccc2n1 252480509 CBFKJNLAFQDUKY-UHFFFAOYSA-N 376.386 2.667 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCc1nc(O)c2ccccc2n1 253623638 CQEABHXMZGKDIQ-QFBILLFUSA-N 382.508 2.991 0 50 GFAA biogenic COc1ccc([C@H]2Cn3nnc(C(=O)NCc4ccccc4C)c3CO2)cc1 263619570 ZIBGEMJOCPNGHK-LJQANCHMSA-N 378.432 2.797 0 50 GFAA Cc1c(Cl)cccc1NC(=O)N1C[C@H]2COCC[C@@]2(O)[C@@H]2COCC[C@@H]21 299754910 CAYVPUSGMAOQPK-CSHUHZATSA-N 380.872 2.669 0 50 GFAA Cc1cc(C(=O)Nc2ccccc2CN2CCOCC2)ccc1N1CCOCC1 648250953 BLEAHRVXINFUQO-UHFFFAOYSA-N 395.503 2.916 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCCN(C3Cc4ccccc4C3)CC2)n[nH]1 828211439 CMDPYXYUAIPKQV-UHFFFAOYSA-N 389.503 2.731 0 50 GFAA CCN(CC)C[C@@H]1CCCN1C(=O)c1ccc(-c2cnc3ncnn3c2)cc1 584886358 CLZGERRRUCQWDA-IBGZPJMESA-N 378.480 2.738 0 50 GFAA O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@@H](OCc2cccnc2)C1 670468177 MDVYZKCCAMQZLW-GOSISDBHSA-N 383.448 2.744 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2Cc3ccc(O)cc3C2)(c2ccccc2)CC1 862609958 WATWCIZJXONHJH-UHFFFAOYSA-N 376.456 2.981 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCC([C@@H](CN)c2ccccc2)CC1)c1ccccc1 1875302005 WLXMOKHLTSWJGP-VXKWHMMOSA-N 379.504 2.845 0 50 GFAA C=CC(=O)N1CCc2c(CNC(=O)Cc3nn(C)c4ccccc34)cccc2C1 1875389716 ZCKYANCFPLWJEI-UHFFFAOYSA-N 388.471 2.503 0 50 GFAA Cc1nc([C@@H](C)NC(=O)N2CCc3ccc(S(C)(=O)=O)cc3CC2)cs1 888102329 RZGZJUZSNPYYIX-GFCCVEGCSA-N 393.534 2.726 0 50 GFAA C[C@@H](CNS(=O)(=O)Cc1noc2ccccc12)N1CCc2sccc2C1 185671222 RUKREHRUOLREQJ-ZDUSSCGKSA-N 391.518 2.756 0 50 GFAA O=S(=O)(c1c[nH]c2cccc(F)c12)N1CCC(OCCN2CCCC2)CC1 189681953 BUKYCGFUGBAETC-UHFFFAOYSA-N 395.500 2.573 0 50 GFAA O=C(NCC1CCN(Cc2ccccc2)CC1)[C@H]1COCCN1C1CCCC1 192906026 OWGHQNSVWMJJIH-JOCHJYFZSA-N 385.552 2.658 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC2(CC1)Nc1ccccc1NC2=O 1506419249 XYLPVQZHBGOITK-UHFFFAOYSA-N 393.491 2.647 0 50 GFAA Cc1ccc(OC[C@@H]2CCCN(CC(=O)Nc3ccc(C(N)=O)cc3)C2)cc1 1529181631 STICPFVZZLLIDG-QGZVFWFLSA-N 381.476 2.823 0 50 GFAA O=C(c1ccc(-c2noc(C3CC3)n2)cc1)N1C[C@@H](O)[C@H](Cc2ccncc2)C1 1704280041 KXYFUSMMGARTFZ-RTBURBONSA-N 390.443 2.685 0 50 GFAA CN1CCC[C@H](c2nc(-c3cn(C)c4ccccc34)n(-c3ccnn3C)n2)C1 1772804456 AMDHNVJRQQGRAN-HNNXBMFYSA-N 375.480 2.969 0 50 GFAA COCCC(=O)N1CCC(Oc2ccc(C(=O)NCc3ccco3)cc2)CC1 11773555 NYYMTPGPJPHFFG-UHFFFAOYSA-N 386.448 2.616 0 50 GFAA CN1C(=O)N(Cc2cccnc2)C(=O)C12CCN(CCc1ccccc1)CC2 14742115 FRGBXFPJPAQBAO-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccccc1F)NC1CCCCCCC1 15068829 WWAGFZLSWZIIRC-LJQANCHMSA-N 375.488 2.745 0 50 GFAA Cc1c(NC(=O)c2ccc(N3CCCC3=O)cc2)c(=O)n(-c2ccccc2)n1C 15269388 DYTNMTHRYOBYNZ-UHFFFAOYSA-N 390.443 2.864 0 50 GFAA COc1ccc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c(OC)c1 1857684014 VWEKWUSSCOURSF-JOCHJYFZSA-N 396.443 2.593 0 50 GFAA O=C(CCc1cccnc1)N[C@@H]1CCC[C@@H](NC(=O)c2ccc3nc[nH]c3c2)C1 1857688538 OPSOKZLECOBAON-QZTJIDSGSA-N 391.475 2.748 0 50 GFAA COc1cc2c(cc1CN1CCC3(CC1)C[C@H](O)C[C@H](C(C)C)O3)OCCO2 1857711362 VSHTWMIPGYOOHF-QZTJIDSGSA-N 391.508 2.997 0 50 GFAA C/C=C(\C)CN1CCC([C@@]2(CCC)NC(=O)N(C[C@H]3CCCO3)C2=O)CC1 12037915 JZYMWOSJBQOJSQ-VXJOIYKGSA-N 377.529 2.934 0 50 GFAA CC1(C)CN(Cc2ccc(-c3nc([C@H]4CCCNC4)cc(=O)[nH]3)cc2)CCO1 23368616 RWTKDDMBLXIYQB-SFHVURJKSA-N 382.508 2.515 0 50 GFAA Cc1csc(C[C@H]2CCCN(C(=O)c3cc4c(N(C)C)ncnc4n3C)C2)n1 924347891 FBHRXNZOFJEFLQ-CQSZACIVSA-N 398.536 2.894 0 50 GFAA Cc1nc2c(C(=O)N3CCCN(c4nc5ccccc5o4)CC3)ccnc2n1C 2100557499 WEZDUHCRNPVQSY-UHFFFAOYSA-N 390.447 2.770 0 50 GFAA Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@H](NCc1ccncc1)C2 14746218 QLHHACWCQUWKPO-SFHVURJKSA-N 393.466 2.531 0 50 GFAA O=C1CC[C@H](CCNC(=O)Nc2ccc(-c3cc(C(F)(F)F)n[nH]3)cc2)N1 2325782050 RLEXXQLPHJGLSC-GFCCVEGCSA-N 381.358 2.886 0 50 GFAA CCN(C(=O)c1ccc(Cl)c2occc12)[C@@H]1CCN(CC(=O)N2CCC2)C1 2325793454 VGFMRZKIOOVHGP-CQSZACIVSA-N 389.883 2.855 0 50 GFAA O=C(CCn1cnc2cc(F)c(F)cc21)NC[C@H]1NCCc2sccc21 2325810550 RCGBMXMLVVMGIA-OAHLLOKOSA-N 376.432 2.769 0 50 GFAA COc1ccccc1-c1ccc(C(=O)N=c2cc[nH]cc2N2CCNCC2)s1 2325857783 OUSOJJBJVSBMFA-UHFFFAOYSA-N 394.500 2.903 0 50 GFAA CC(=O)c1cccc(NC(=O)Cn2c(-c3nonc3N)nc3ccccc32)c1 678352 GAJUQJLKLWPSNR-UHFFFAOYSA-N 376.376 2.510 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2SC)cc1 1113177 GWVWRWUYWUTOFA-UHFFFAOYSA-N 380.491 2.676 0 50 GFAA CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)OCc1ccccc1 4763283 YNGMSYLLRMTJGH-FQEVSTJZSA-N 398.459 2.797 0 50 GFAA CCOc1ccc(CN(C(=O)c2cccs2)[C@H]2CCS(=O)(=O)C2)cc1 4840069 MLFGWYJQINCZTH-HNNXBMFYSA-N 379.503 2.976 0 50 GFAA CC1=C(C(=O)OCCOC(C)C)[C@@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987013 GVXFRGOAEGOJBH-MRXNPFEDSA-N 378.379 2.813 0 50 GFAA O=C([C@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(c2ccccc2F)CC1 8782426 GERNWVLBSRCXPN-HNNXBMFYSA-N 385.414 2.667 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)[C@H]1CCCO1 11814312 PEJRHUJEIUVODX-NHCUHLMSSA-N 386.536 2.928 0 50 GFAA COc1cc(CN2CCSCC2)ccc1OC[C@H](O)CN1CCCCCC1 11840261 VXAATRFYUQQHJD-LJQANCHMSA-N 394.581 2.860 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(C(=O)C3CC3)CC2)O1)c1c(F)ccc(F)c1F 11881170 LDORPWRTQBUPBR-ZDUSSCGKSA-N 396.409 2.784 0 50 GFAA CN(Cc1cscn1)[C@H]1CCc2c(c(C(=O)N3CCCCCC3)nn2C)C1 14538396 NEHRWYASALPEJC-INIZCTEOSA-N 387.553 2.882 0 50 GFAA CC[C@@H](COC)NC(=O)[C@H]1CCCN(c2nc(C)c3ccc(OC)cc3n2)C1 14879453 JOSMUJFDSMSULG-HOTGVXAUSA-N 386.496 2.704 0 50 GFAA CC(C)CCn1cnc2sc3c(c2c1=O)CC[C@@H](NCc1cnn(C)c1)C3 14996017 FFXGVEXLDFIDDG-OAHLLOKOSA-N 385.537 2.885 0 50 GFAA CNc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(-n3cccn3)cc2)ccn1 19334093 GWJRXESRCBMULS-GOSISDBHSA-N 390.447 2.552 0 50 GFAA CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3ccc(OC)cc3n2)cn1 20540489 SXKMMXXEZACLMK-UHFFFAOYSA-N 380.448 2.989 0 50 GFAA CCCOCCN1CCN(C(=O)c2ccc(Cl)cc2NC(=O)CC)CC1 55370432 MAHOZDVAWBLSTD-UHFFFAOYSA-N 381.904 2.873 0 50 GFAA Cc1ccn2cc(C(=O)N3CCC(n4c(=O)[nH]c5ccccc54)CC3)nc2c1 58304425 WSEXCXSXPARFHN-UHFFFAOYSA-N 375.432 2.763 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)NCCC(=O)Nc1ccc(F)cc1 65375410 YOHGEVYLRLUPFG-UHFFFAOYSA-N 377.441 2.541 0 50 GFAA COc1ccc2nc(CCN(C)c3nc(CCN)nc4ccccc34)[nH]c2c1 67725894 BXWNTJHFFFNMJH-UHFFFAOYSA-N 376.464 2.695 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCc3ccc(F)cc3)C2=O)c1 67966265 XJPINULSODBSLO-NRFANRHFSA-N 390.430 2.617 0 50 GFAA CC(C)[C@H]1CN(C(=O)CN2CCCC2=O)CCCN1Cc1ccc(F)cc1 71752042 KUJJNVJBCIHEGW-LJQANCHMSA-N 375.488 2.507 0 50 GFAA COc1c(C)cnc(Cn2nc([C@H]3CCCNC3)n(-c3ccccc3)c2=O)c1C 72121086 LPVJMHICHFSHRJ-KRWDZBQOSA-N 393.491 2.570 0 50 GFAA NC(=O)NCC(=O)N1CCC[C@@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 72133665 TZLNQGRBEZJNRK-MRXNPFEDSA-N 381.432 2.569 0 50 GFAA O=C(CCCn1ccnc1)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72157977 IDGAXXSMJMIMKW-IBGZPJMESA-N 376.460 2.734 0 50 GFAA Cc1cccn2cc(C(=O)N3CC[C@@]4(CCCN(CC5CCC5)C4=O)C3)nc12 72165593 YSJWUBANBAGLQN-QFIPXVFZSA-N 380.492 2.898 0 50 GFAA COC(=O)c1ccc(N2CCN(Cc3cnc(-c4ccco4)nc3)CC2)cc1 72418288 AVYWXBCMAHUQPZ-UHFFFAOYSA-N 378.432 2.845 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@@H]1CCCN(CCCC2CCCC2)C1 72426186 OTVSSJFVTOXSAI-LJQANCHMSA-N 375.561 2.797 0 50 GFAA O=C1CC[C@]2(CCCN(CCn3c(=O)oc4ccccc43)C2)CN1CC1CC1 77436906 VQZXJAWSVDILPD-QFIPXVFZSA-N 383.492 2.709 0 50 GFAA COCC(=O)N1CCC(C(=O)N2CCCC[C@@H]2CCc2cccs2)CC1 91626290 YFPZSKLSNGSTLK-QGZVFWFLSA-N 378.538 2.947 0 50 GFAA O=C(CCCN1CCCC1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91656582 JJVFUELWJVPXTK-UHFFFAOYSA-N 398.551 2.689 0 50 GFAA CCN(Cc1noc(C)n1)C(=O)[C@@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91713933 BANJQHFDSUDHTJ-OAHLLOKOSA-N 390.871 2.819 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(S(=O)(=O)N(C)CC)CC2)C1 91964527 FBSYFLOJXYAAHA-LJQANCHMSA-N 379.570 2.775 0 50 GFAA CN(CC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccc1)C2)c1ccccc1 95380195 RWAGAZFPUGPSFP-GHTZIAJQSA-N 377.488 2.886 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3nn(C)c(C)c3Cl)C[C@H]2N(C)C)cc1 95506689 GAVCIAVSVIUULF-JKSUJKDBSA-N 376.888 2.560 0 50 GFAA CSc1nc(N)cc(N2CCC(c3nccn3Cc3cccnc3)CC2)n1 95525890 ZRNVJTXIOBBCAS-UHFFFAOYSA-N 381.509 2.805 0 50 GFAA CCC(=O)N(CCc1ccc(OC)cc1)[C@H]1CC(=O)N(c2ccccc2)C1=O 95528625 YOSVYZRIBXIDEC-IBGZPJMESA-N 380.444 2.808 0 50 GFAA O=C(Cn1c2c(sc1=O)CCCCC2)Nc1ccc(N2CCOCC2)cc1 112973041 TWOUSYKSSDVUQU-UHFFFAOYSA-N 387.505 2.654 0 50 GFAA COCc1nc2n(n1)C[C@H](NC(=O)c1ccc(CCC(F)(F)F)cc1)CC2 122557508 OUYGVPWNZQAVNA-CQSZACIVSA-N 382.386 2.664 0 50 GFAA COc1cccc(OC)c1C(=O)N1CCN(C(=O)c2ccc(C)c(F)c2)CC1 126137270 KYQVKLFQOSOPNM-UHFFFAOYSA-N 386.423 2.750 0 50 GFAA CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NCc1ccc(CO)c(F)c1 174514190 XVACUNFSDGJWNN-LJQANCHMSA-N 385.483 2.982 0 50 GFAA Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N2CCC(C)(O)CC2)cc1 177745945 AHLLXALLBXJVIZ-UHFFFAOYSA-N 377.444 2.681 0 50 GFAA O=C(CCc1ccc(O)cc1)NCC1CCN(C[C@H](O)c2ccccc2)CC1 183966460 HRTFIXQBSWEECU-QFIPXVFZSA-N 382.504 2.887 0 50 GFAA O=C1COc2cc(N[C@H]3CCCN(Cc4ccc(F)cc4F)C3=O)ccc2N1 189785275 AXUWJPDBBIBPJJ-KRWDZBQOSA-N 387.386 2.899 0 50 GFAA COc1ccccc1-c1csc(C2CCN(CCNS(C)(=O)=O)CC2)n1 191508654 IPGJKCJPTOWYGO-UHFFFAOYSA-N 395.550 2.547 0 50 GFAA Cc1cc(-c2noc(CCC(=O)N3CCC(c4nncn4C)CC3)n2)ccc1F 194166030 QIZBGRZTVNFQHG-UHFFFAOYSA-N 398.442 2.651 0 50 GFAA CCN1CCN(C2(C(=O)N[C@H]3C[C@@H]3c3ccccc3)Cc3ccccc3C2)CC1 206062750 OCSMSUKCAPXXIR-PKTZIBPZSA-N 389.543 2.834 0 50 GFAA CCCOc1ccc(CNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c(C)c1 241262021 LAQAVZKRCCHCFS-UHFFFAOYSA-N 390.505 2.680 0 50 GFAA Cc1csc(NC(=O)C[C@H]2N=C(O)N(Cc3ccccc3Cl)C2=O)n1 252552518 UUYYBRBUUIJPLI-GFCCVEGCSA-N 378.841 2.759 0 50 GFAA CCOc1ccc(OCCNC(=O)CN2CCC[C@H](c3ccncc3)C2)cc1 253428948 MAHVOMTWHQYJGY-IBGZPJMESA-N 383.492 2.855 0 50 GFAA C[C@H](NC(=O)N1CCn2c(nnc2C(F)(F)F)C1)c1ccc(F)c(F)c1 265801600 SWUHROUNZLSHFK-QMMMGPOBSA-N 375.301 2.862 0 50 GFAA COC[C@@H]1CN(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCO1 266330536 DXVBUNRMRAONLI-HNNXBMFYSA-N 375.450 2.880 0 50 GFAA COc1cc(C(=O)N2CCC3(CC2)C[C@@H]3N(Cc2ccsc2)C(C)=O)on1 328625113 CTEUGLGZWVUHKI-INIZCTEOSA-N 389.477 2.788 0 50 GFAA O=C(c1ccc(O)cc1)C1CCN(C(=O)c2ccc(N3CCNC3=O)cc2)CC1 363138110 NSPHRFCITILTBE-UHFFFAOYSA-N 393.443 2.657 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)N1CCc2cnc(C(C)C)nc2C1 372105604 NZXFGKCNCJSPDV-UHFFFAOYSA-N 396.495 2.730 0 50 GFAA COc1cccc2c1C[C@@H](N[C@H](C(N)=O)c1ccc(Br)cc1)C2 419334212 SPUBQMVLHASNBW-YOEHRIQHSA-N 375.266 2.741 0 50 GFAA Cc1c(Cl)c(C(=O)N2CCC[C@@H](N(C)Cc3ccccn3)CC2)nn1C 421877985 UMEXOHUAQMLSLA-MRXNPFEDSA-N 375.904 2.904 0 50 GFAA Cc1nccn1-c1ccccc1CNC(=O)N1CCC[C@H](Cn2ccnc2)C1 426387352 XFTMFQJBDYFDMI-GOSISDBHSA-N 378.480 2.999 0 50 GFAA O=C(Cn1nccc1[C@@H]1CCCNC1)NCc1csc(-c2cccs2)n1 426740402 HQODJIYPWXVNRV-CYBMUJFWSA-N 387.534 2.852 0 50 GFAA Cc1cc(C)n(CCNC(=O)c2ccc(CSc3ccccn3)cc2)c(=O)n1 825132061 QOBXUHUOJHASQE-UHFFFAOYSA-N 394.500 2.977 0 50 GFAA O=C(NCC1CCN(C(=O)c2ccsc2)CC1)c1ccccc1-c1nc[nH]n1 828184100 DBDWZLWLLXSNHJ-UHFFFAOYSA-N 395.488 2.815 0 50 GFAA CCn1ccc(CC(=O)N2CC3(CCOCC3)[C@@H]2c2cnn(C(C)(C)C)c2)n1 888101106 CIGNPWYOQFZVFO-IBGZPJMESA-N 385.512 2.777 0 50 GFAA Cc1cc2nc(O)[nH]c2c(NC(=O)CN2C[C@H](c3ccccc3)CC2=O)c1C 952971776 VNERQZFHFZYNHB-OAHLLOKOSA-N 378.432 2.840 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCC(O)(c2ccccc2)CC1 1506416057 DHCDFWLVOSTDGA-UHFFFAOYSA-N 375.490 2.984 0 50 GFAA CC1=C(CCN2CCCN(C(=O)[C@H]3CCC(=O)NC3)CC2)C(C)(C)CCC1 1529120327 XBBHEUYPURXRNO-SFHVURJKSA-N 375.557 2.964 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3n[nH]c4c3CCC4)CC1)OCC2 1704306885 XDTDWLSUQCAEOP-UHFFFAOYSA-N 397.475 2.620 0 50 GFAA CCn1cc(CN2CC[C@@]3(C2)Cn2c(nnc2-c2ccccc2Cl)CO3)cn1 1857670091 PWCWWMVWOWYKKY-HXUWFJFHSA-N 398.898 2.990 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(c4ncccc4F)C[C@]34CC[C@H]2O4)cc(C)n1 1857719915 XJAXVHOQHLALNH-ODULNIPZSA-N 396.466 2.646 0 50 GFAA O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1C[C@@H]2C[C@H]1CS2(=O)=O 1875265826 ACBIBCQWCPGAPF-QWRGUYRKSA-N 387.301 2.736 0 50 GFAA Cc1ccccc1C1(C(=O)NC[C@H](CC2CCOCC2)C(=O)O)CCOCC1 1875268153 XBFABPLYHQZDLS-SFHVURJKSA-N 389.492 2.677 0 50 GFAA OCCCc1nc([C@H]2CCCc3nc[nH]c32)n(-c2ccc(OC(F)F)cc2)n1 1875348707 ZPXLKHXHBJXXSE-AWEZNQCLSA-N 389.406 2.985 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)[C@H]2CC(=O)OC23CCCC3)CC1 2356150853 CFATYPUZPGOELP-LJQANCHMSA-N 399.487 2.962 0 50 GFAA CN1CCC[C@]2(CCCN2S(=O)(=O)c2cc(Cl)ccc2Cl)C1=O 2356136600 ATZQHGJWMVTYJV-HNNXBMFYSA-N 377.293 2.769 0 50 GFAA O=C(c1cccc2c1NCCC2)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356163177 RAJSVELPMLYGOB-AUSIDOKSSA-N 394.471 2.565 0 50 GFAA O=C(CCCn1cccn1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356164801 HNFBFIDTULJCBW-JOCHJYFZSA-N 380.492 2.847 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCOC4(CCNCC4)C3)ncnc21 2356169167 VPAYAXJCBTXYMP-UHFFFAOYSA-N 386.544 2.784 0 50 GFAA Cc1cc(C(=O)Nc2ccccc2CN2CCOCC2)c2c(C)nn(C)c2n1 55816763 OHRJRHBSUDLGRT-UHFFFAOYSA-N 379.464 2.670 0 50 GFAA CN(Cc1ccc2ccccc2n1)C(=O)c1ccc(N2CCC[C@H]2CO)nc1 20204077 UDASUGNGBHNXKQ-IBGZPJMESA-N 376.460 2.863 0 50 GFAA O=C(O)c1ccccc1CN1CCC(Cc2n[nH]c(=O)n2-c2ccccc2)CC1 67934054 DBEVYKCQMNIWDG-UHFFFAOYSA-N 392.459 2.714 0 50 GFAA CCn1cnc(NC(=O)c2cccc(CN3CCC[C@@H]3c3nonc3C)c2)n1 65509260 IKSQLDSEBHAGEB-MRXNPFEDSA-N 381.440 2.579 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCCN1CCC(O)CC1 128594206 OWTWXGJTGRRLHT-UHFFFAOYSA-N 380.895 2.910 0 50 GFAA CC(C)(NS(=O)(=O)c1ccc(Cl)cc1F)C(=O)NCC1CCCC1 433502470 PYVPRFJMFKCOSS-UHFFFAOYSA-N 376.881 2.842 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc3[nH]nnc3c2)CCC(=O)N1Cc1ccccc1 71755031 CSELFQZWRXSPPS-QGZVFWFLSA-N 377.448 2.611 0 50 GFAA O=C(CSc1nn(-c2ccc(Cl)cc2)c(=S)s1)Nc1nnn[nH]1 253428208 POEHLIHHWZRMAA-UHFFFAOYSA-N 385.887 2.561 0 50 GFAA CCO[C@H](C)c1nc(C(=O)NS(=O)(=O)c2cc(C)c(F)cc2F)cs1 151799063 YGSNPXSKGBPPKN-SECBINFHSA-N 390.433 2.946 0 50 GFAA Cc1cccc(-c2noc(CNC(=O)c3ccc(CN4CCOCC4)cc3)n2)c1 72434073 BILOMRPUOCLTOC-UHFFFAOYSA-N 392.459 2.807 0 50 GFAA CCn1cc(CC(=O)N[C@@H]2CCN(C(=O)c3ccccn3)C2)c2ccccc21 242047959 VRNMLOGTVBHPLT-QGZVFWFLSA-N 376.460 2.630 0 50 GFAA Cc1ccc(OCc2ccc(C(=O)N3CCNC[C@@H]3c3nccn3C)o2)c(C)c1 261767682 QYHGVRHOAXTSLB-GOSISDBHSA-N 394.475 2.996 0 50 GFAA C[C@@H]1CCCN(C(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)[C@H]1CN 237446956 BOMCJDSDVWXLMH-UZLBHIALSA-N 386.517 2.860 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4cccc(C(F)(F)F)c4)ccc3n2n1 71375968 NECKCTUFQADONH-UHFFFAOYSA-N 378.339 2.564 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)/C=C/c1ccc(Cl)cc1 129417513 DJIRBVCLDVYWCE-QSYFUGGGSA-N 382.873 2.503 0 50 GFAA CN(C(=O)Cc1c[nH]c2ncccc12)C1CCN(CCc2ccccn2)CC1 158186755 PRFYPFNXUOBNBM-UHFFFAOYSA-N 377.492 2.666 0 50 GFAA CCc1c(C(=O)NCC[C@@H]2CCNC2)cnn1-c1ccc(Br)cc1 262577163 JZBVXUVYPDXCCR-ZDUSSCGKSA-N 391.313 2.927 0 50 GFAA C[C@@H]1CCC[C@@H](C)N1C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 17081362 KSZZWHZFRCYRAH-HUUCEWRRSA-N 397.566 2.667 0 50 GFAA Cc1ccc(N2CC[C@H](Nc3cccc(C(=O)N4CCOCC4)c3)C2=O)cc1 177145198 RRQBNHCDBJQDDV-FQEVSTJZSA-N 379.460 2.685 0 50 GFAA Cc1nc2nc3ccn(Cc4ccccn4)c(=O)c3c(-c3ccc(F)cc3)n2n1 40398571 SLODVUIGCCBEJP-UHFFFAOYSA-N 386.390 2.997 0 50 GFAA Cc1ccc2nc(COc3cccc(C(=O)N4CC[C@@H](C(=O)O)C4)c3)cn2c1 178268374 BRKZRXBKAVEZPY-MRXNPFEDSA-N 379.416 2.768 0 50 GFAA CO[C@H]1CC[C@@]2(OC)CCN(C(=O)C3(c4ccccc4)CCN(C)CC3)[C@H]2C1 426550636 OHXCWGNUQSXXIW-SXWKCWPCSA-N 386.536 2.835 0 50 GFAA O=C(NCCN1CC[C@@H](c2ccccc2)C1)c1cc(=O)[nH]c2cc(F)ccc12 97514360 GPVSKTPNZYCWED-MRXNPFEDSA-N 379.435 2.887 0 50 GFAA Cc1nccn1CCC(=O)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95378431 JJDCHQTWKSDJNA-IBGZPJMESA-N 378.480 2.628 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)cn1 95503861 RWYBNQXLMBTJTQ-MRXNPFEDSA-N 376.464 2.699 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CNC[C@H](C(=O)NCc3ccc(C)c(F)c3)C2)cc1 92099269 OKHWZFMBRJHGPS-MSOLQXFVSA-N 383.467 2.923 0 50 GFAA O=C([C@H](Cc1ccccc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)N1CCCCC1 239121018 JDDRWAWQYISXHT-WKWVNEEDSA-N 380.488 2.641 0 50 GFAA CCN(C)CC(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C1CC1)C2 95372751 SMWXKZRQODWBOO-HXUWFJFHSA-N 383.536 2.725 0 50 GFAA O=C(NC1CC1)c1ccc([C@@H]2CCCN2C(=O)c2nnc3n2CCCC3)s1 23542738 GSWJHNHACDITDE-ZDUSSCGKSA-N 385.493 2.545 0 50 GFAA C[C@H]1CCCCN1C1CN(C(=O)c2c(OCc3ccccc3)c(=O)ccn2C)C1 1940195349 NNOXXGGUNSVYQN-KRWDZBQOSA-N 395.503 2.663 0 50 GFAA Cc1ocnc1C(=O)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940195789 MPUAJUKPRXTGKK-UHFFFAOYSA-N 391.431 2.661 0 50 GFAA CCc1ncc2c(n1)CN(C(=O)c1cccc(-c3c(C)ncnc3OC)c1)C2 584897821 JKGWMJMSWSSPBQ-UHFFFAOYSA-N 375.432 2.969 0 50 GFAA CCCCc1ccc(CCNCc2cnn([C@H]3CCS(=O)(=O)C3)c2)cc1 1875290750 BYXOMMRCMZQHPR-FQEVSTJZSA-N 375.538 2.918 0 50 GFAA C=CC(=O)N1C[C@@H](NC(=O)C(C)(C)n2ccc(C3CC3)n2)Cc2ccccc21 1875389614 VGMXIOBYRJGBFP-KRWDZBQOSA-N 378.476 2.756 0 50 GFAA O=C(NCCn1nnc2ccccc21)c1cc2c(Br)[nH]nc2s1 1875359256 ZGIMUDDCBFCBQI-UHFFFAOYSA-N 391.254 2.562 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2CN2CCn3nnc(CO)c3C2)o1 894803698 SESVPWVDDPAIFY-UHFFFAOYSA-N 390.447 2.540 0 50 GFAA COc1cc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)ccc1OCc1ccccc1F 1529152621 NBFDVOJUADHOKR-WMZOPIPTSA-N 389.423 2.681 0 50 GFAA CO[C@@H](C)C(=O)N1CCC2(CC1)C[C@H](NC(=O)c1ccc(C)cc1C)CCO2 1775997999 XXXRPOVYSWHINS-ZWKOTPCHSA-N 388.508 2.608 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565529850 GOBKMJSCUAGQHV-ZBFHGGJFSA-N 380.473 2.888 0 50 GFAA C[C@@H](C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccc(Cl)s1 275867476 ZRDBLMDTRWVIPA-VXGBXAGGSA-N 379.917 2.610 0 50 GFAA COC(=O)c1cc(F)c(Br)c(S(=O)(=O)Nc2ccccn2)c1 170598276 ULJUQNLCNMWVSE-UHFFFAOYSA-N 389.202 2.571 0 50 GFAA C[C@@H]1CO[C@H](c2ccccc2Cl)CN1Cc1nnc(S(C)(=O)=O)s1 170607425 AKLLKBQHOLGPKM-MFKMUULPSA-N 387.914 2.557 0 50 GFAA CS(=O)(=O)c1ccc(N[C@@H]2CCCc3ccccc32)c(S(C)(=O)=O)c1 170620540 ZRJBCVKTDRDCAP-MRXNPFEDSA-N 379.503 2.983 0 50 GFAA Cc1ccc(-c2cc(C(=O)N(Cc3cccnc3)C[C@@H]3CCC(=O)N3)n[nH]2)cc1 1506403991 DNJJUABOLJSYPY-SFHVURJKSA-N 389.459 2.701 0 50 GFAA O=C(c1cccnc1)N1CCC(NCc2noc(-c3c(F)cccc3F)n2)CC1 1506420669 BLGMEVCHDFPHER-UHFFFAOYSA-N 399.401 2.804 0 50 GFAA COc1cc(OC)c(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1Cl 641102 JBXKIDQDNDYNKO-UHFFFAOYSA-N 385.829 2.649 0 50 GFAA CO[C@H]1CN(C(=O)CCn2c(C)nc3ccccc32)C[C@H]1Cc1cc(C)no1 1529195260 HNVJOUQUUSQHMA-UZLBHIALSA-N 382.464 2.747 0 50 GFAA COCCCNCc1ccc(OC)cc1OC[C@H](O)CN1CCCCCCC1 11878506 KSKMPTQHXJNEGP-HXUWFJFHSA-N 394.556 2.827 0 50 GFAA O=C(Cn1nc2ccccc2n1)N1CCC(CO)(CCc2ccccc2)CC1 12002996 QPYVUEOENSDCIT-UHFFFAOYSA-N 378.476 2.665 0 50 GFAA CCOc1ccc2nc(N3CCC[C@H]3C(=O)N3CCC(OC)CC3)nc(C)c2c1 12244859 MOFUZGHEEXLIKO-FQEVSTJZSA-N 398.507 2.943 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)n[nH]1 12434077 UCGDEDMIHCTTGO-FQEVSTJZSA-N 388.418 2.651 0 50 GFAA CCc1nnc(SCC(=O)N2CCC[C@@H](Nc3ccc(OC)cc3)C2)o1 12440979 OHMYAEUPEYBNHO-CQSZACIVSA-N 376.482 2.836 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C[C@H]3CCOC3)CC2)c(Cl)c1 12718704 MZVRSTRSAFFUQR-OAHLLOKOSA-N 396.915 2.596 0 50 GFAA CC[C@@H](C(=O)N1CCN(Cc2ccccc2)CC1)n1cnc2ccccc2c1=O 13686343 JFZFZPGYXSQNKZ-NRFANRHFSA-N 390.487 2.692 0 50 GFAA Cc1ccc(F)c(CN2CCN3C(=O)[C@H](CC4CCCCC4)NC(=O)[C@H]3C2)c1 14533285 GUBVZGZBTWOSIR-VQTJNVASSA-N 387.499 2.616 0 50 GFAA CS(=O)(=O)Nc1ccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1 16489747 IUCPGWFOPLDKDW-VMPITWQZSA-N 399.516 2.529 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(c2ccccc2)=NO3)cc1OC 169755037 FCXZUYSCPFQVQV-UHFFFAOYSA-N 381.432 2.618 0 50 GFAA CCOC(=O)CN1C(=O)S/C(=C/c2cc(Cl)c(OC)c(OC)c2)C1=O 4819256 CWMRNSRPDORXEG-KPKJPENVSA-N 385.825 2.957 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(OC)c1OC 4603814 VHRREUSYQCPEHL-OAHLLOKOSA-N 380.466 2.628 0 50 GFAA CCn1cncc1CNC(=O)C[C@@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857700049 KKYHZLMLKQHKEU-HNNXBMFYSA-N 397.479 2.976 0 50 GFAA COc1ncccc1C(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 219308186 IEMMKLAUNWVBGV-APWZRJJASA-N 377.488 2.794 0 50 GFAA COc1cccc([C@@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)c1 130853201 LKIBEOZHCJVEDB-IBGZPJMESA-N 391.493 2.769 0 50 GFAA CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCC(OC3CCCC3)CC1)CC2 161575400 HETPVYZCLYSKNR-HNNXBMFYSA-N 375.517 2.850 0 50 GFAA O=C(Nc1ccc(N2CCN(C(=O)C3CC3)CC2)cn1)c1ccc(F)c(F)c1 2325727572 LKAFCANACAGFNN-UHFFFAOYSA-N 386.402 2.671 0 50 GFAA COc1cc(C(=O)NCCc2nc3ccc(C(=O)O)cc3[nH]2)cc2c1O[C@@H](C)C2 2325875411 QVHMUOWTKCPJNK-NSHDSACASA-N 395.415 2.566 0 50 GFAA COC(=O)c1c(NC(=O)c2cccc(OC)c2)sc2c1[C@H](C(=O)OC)CC2 944929 MUVHBANWNVPFTC-GFCCVEGCSA-N 389.429 2.998 0 50 GFAA C[C@@H]1CCc2nc(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)sc2C1 1195994 JAJKPZDJEPWBKI-LLVKDONJSA-N 379.507 2.771 0 50 GFAA O=C(CF)N[C@H](NC(=S)Nc1ccc(Cl)cn1)C(Cl)(Cl)Cl 2706940 WSNSZMAMGWQBAI-MRVPVSSYSA-N 394.086 2.803 0 50 GFAA O=C1COc2ccc(C(=O)c3ccccc3C(=O)NCc3ccco3)cc2N1 5898308 HDXSARWNNICIIC-UHFFFAOYSA-N 376.368 2.772 0 50 GFAA C/C=C(\C)CN1CCC([C@@]2(CCC)NC(=O)N(C[C@@H]3CCCO3)C2=O)CC1 12037910 JZYMWOSJBQOJSQ-QOTQGGMVSA-N 377.529 2.934 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(N(C)Cc3cc(C)no3)nc2)CCN1C(C)C 12593842 WWBRCZBCNGOAAP-GOSISDBHSA-N 385.512 2.959 0 50 GFAA O=C(COc1ncnc2ccccc12)N[C@H]1CCCN(CCc2ccccc2)C1 14969620 LHRRXBGFPPLKQI-IBGZPJMESA-N 390.487 2.832 0 50 GFAA O=C1NCCN(Cc2cccs2)[C@@H]1CC(=O)N1CCC(c2ccccc2)CC1 15072181 SKXDTONSXBQLOB-HXUWFJFHSA-N 397.544 2.845 0 50 GFAA CN(c1ccc(C(=O)NCc2cccnc2)cc1)S(=O)(=O)c1cccs1 16652416 FQDLDCSHJFLTGQ-UHFFFAOYSA-N 387.486 2.898 0 50 GFAA O=C(Cc1ccncc1)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 19836677 RGCAMYWFOPVFLQ-QFIPXVFZSA-N 381.451 2.805 0 50 GFAA CSc1ccc(CN2C[C@H](Sc3nccn3C)C[C@H]2C(=O)N(C)C)cc1 19851316 BIDKFVSQYKWYPG-SJORKVTESA-N 390.578 2.965 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528425 FRWBJMNTEBSKFY-UHFFFAOYSA-N 387.434 2.708 0 50 GFAA Cc1ccc(OC[C@@H]2CCCN(C(=O)c3ccc(-n4cnnc4)nc3)C2)cc1 55073924 TVDJJTOQBQQSKE-QGZVFWFLSA-N 377.448 2.902 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)NCc1ccc(C(=O)O)cc1 61720040 DNOZALKSRNFRKD-UHFFFAOYSA-N 397.818 2.578 0 50 GFAA O=C(O)c1ccc2c(c1)n(Cc1ncccn1)c(=O)n2Cc1ccc(F)cc1 65385727 MPMHWJBTGSIERQ-UHFFFAOYSA-N 378.363 2.527 0 50 GFAA O=C(Cc1ccccc1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71753167 LWPXCCJFLLJGQP-HXUWFJFHSA-N 383.536 2.555 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1)NCC1CC1 72124202 HXNNNPJYHGTOHY-QFIPXVFZSA-N 391.515 2.535 0 50 GFAA Cc1ccc(CN(C(=O)C[C@H]2C(=O)NCCN2Cc2ccoc2)C(C)C)cc1 72174538 OPVQGLVPCOLJJS-FQEVSTJZSA-N 383.492 2.716 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)COc2ccc(F)c(Cl)c2)CC1 72422864 VHZCJPNJORHYQX-UHFFFAOYSA-N 377.847 2.906 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CC[C@](O)(c3ccccc3C)C2)cn1 91365181 PQYNDDGCLJKWFP-JOCHJYFZSA-N 377.444 2.923 0 50 GFAA O=C1CC2(CCN(C(=O)c3cnccn3)CC2)CN1C/C=C/c1ccccc1 92020934 LCUVLCMQQUKPQD-QPJJXVBHSA-N 376.460 2.645 0 50 GFAA CCN1C[C@H](NC(=O)c2ccc3nc(-c4ccc(F)cc4)cn3c2)[C@@H](OC)C1 95364349 SAXVRGDCISMRPD-OALUTQOASA-N 382.439 2.589 0 50 GFAA Cc1ncncc1C(=O)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95370565 NKCCREHWTPLZED-XUVXKRRUSA-N 384.430 2.766 0 50 GFAA CN1CCN(Cc2ccc(N3CCC[C@H](c4nccn4CC4CC4)C3)nc2)CC1 95518499 RLGJCFWWPVRNTD-NRFANRHFSA-N 394.567 2.820 0 50 GFAA COc1ccccc1NC(=O)CS[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O 100277535 KSNYJTZJEZUTDQ-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA O[C@]12C[C@H](C(Cl)(Cl)Cl)O[C@]1(O)C[C@H](C(Cl)(Cl)Cl)O2 101356981 ILZPXCIRVHHHJM-KAZBKCHUSA-N 380.866 2.682 0 50 GFAA CC(C)c1ccc(CCCNC(=O)C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1 117073120 HJIAJJVPUYMGLC-UHFFFAOYSA-N 385.439 2.736 0 50 GFAA Cn1ccnc1C[C@@H]1CCCN(S(=O)(=O)Cc2cc(Cl)ccc2F)C1 124894706 FVONUIVPMUQROB-ZDUSSCGKSA-N 385.892 2.997 0 50 GFAA CC(C)Oc1cc(CNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)ccn1 130021545 QNPAUWQSYUCGBX-UHFFFAOYSA-N 376.420 2.903 0 50 GFAA Cc1ccc(-c2nc(C(=O)N3CCCN(Cc4cnn(C)c4)CC3)cs2)n1C 130700216 XGFKBCXKDWUDBV-UHFFFAOYSA-N 398.536 2.539 0 50 GFAA CNC(=O)c1cccc(CCNC(=O)NC2CCN(Cc3ccccc3)CC2)c1 133929962 OUMSFIOTALSLPL-UHFFFAOYSA-N 394.519 2.553 0 50 GFAA COc1ccc(Cl)cc1NC(=O)Cn1ccn2nc3c(c2c1=O)CCCC3 169760046 QOWJYKDXVKBHPS-UHFFFAOYSA-N 386.839 2.676 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CC1)NC(=O)N(c1ccc(F)cc1)N2 169764143 RXUOMZYBDAMGDW-UHFFFAOYSA-N 382.439 2.730 0 50 GFAA COc1ccc(C(=O)N[C@@H](C(=O)N2CCC(c3ccn[nH]3)CC2)C(C)C)cc1 172385439 JGEROXWKUIHUSC-LJQANCHMSA-N 384.480 2.579 0 50 GFAA CC(C)[C@H](NC(=O)c1cnc(-c2ccccc2F)s1)C(=O)N1CCOCC1 175293112 VDFPGNJDEYCCMQ-INIZCTEOSA-N 391.468 2.562 0 50 GFAA CS(=O)(=O)N1CCc2cc(C(=O)Nc3ccc4c(c3)C(=O)CCC4)ccc21 177982780 LYJVNBFVMQSRHM-UHFFFAOYSA-N 384.457 2.780 0 50 GFAA CC1(C)CN(CCNC(=O)N2CC[C@H](Oc3ccccc3Cl)C2)CCO1 179253750 QCKKFMOCEATGNQ-HNNXBMFYSA-N 381.904 2.614 0 50 GFAA O=C(Cc1ccc(OC(F)F)cc1)N1CCS(=O)(=O)c2ccccc2C1 185083560 CKKHEGCLUSNLAW-UHFFFAOYSA-N 381.400 2.647 0 50 GFAA Cc1cc2c(N3CCN(C(=O)NC[C@H]4CCC(C)(C)O4)CC3)ncnc2s1 186704103 DQJFXLHNYPZWAA-CQSZACIVSA-N 389.525 2.789 0 50 GFAA O=C(N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)[C@H]1CCOc2ccccc21 238209992 QSPPYEOQIHMNSL-FUHWJXTLSA-N 382.391 2.985 0 50 GFAA C[C@H](OC(=O)CCn1cnc2ccccc2c1=O)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C 241810007 SCKSQEPVVFHCLJ-UIBIWLFHSA-N 399.491 2.659 0 50 GFAA O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1cnn2c1CCCC2 252484875 GJVZGPZRTKZFPE-CYBMUJFWSA-N 380.217 2.985 0 50 GFAA CCOC(=O)/C=C1\C[C@@H]2[C@H]3[C@@H]4[C@H]5[C@H]([C@@H]6O[C@H]6[C@H]5[C@@H]5/C(=C/C(=O)OCC)C[C@H]2[C@H]45)[C@H]13 257347053 PQZHGKNYSHTADS-UAXUSOIGSA-N 396.483 2.757 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@H](NCc2cc(F)cc(F)c2)CNC3=O)c1 263616000 GLCARDLFUFWDPQ-IBGZPJMESA-N 384.386 2.869 0 50 GFAA CCOc1ccnc(N2CCCN(C(=O)Nc3ccc(OC)c(F)c3)CC2)n1 269231592 YBOIBPVKRMXFKP-UHFFFAOYSA-N 389.431 2.767 0 50 GFAA O=C(O)CCN(Cc1ccccn1)S(=O)(=O)CCc1cccc(Cl)c1 285294170 XOYOEHSAZCQCAE-UHFFFAOYSA-N 382.869 2.584 0 50 GFAA O=C(NCc1ccc(F)cc1)C1CCN(c2ncnc3c2ncn3C2CC2)CC1 292430289 LPZBLPDUNRHVAQ-UHFFFAOYSA-N 394.454 2.833 0 50 GFAA CC(C)n1c([C@H]2OCC[C@H]2C)nn(Cc2nc(Cc3ccccc3)no2)c1=O 328653811 WZTUTFWUBAROTJ-KDOFPFPSSA-N 383.452 2.745 0 50 GFAA COC1(c2nc(C3CCOCC3)no2)CCN(c2nc(C3CCC3)no2)CC1 425255070 OPKRIUSDVYYLBE-UHFFFAOYSA-N 389.456 2.756 0 50 GFAA CC(=O)c1cn([C@@H](C)C(=O)NCc2nc(C(F)(F)F)n[nH]2)c2ccccc12 426399102 WQOLVJUXCCQJJA-VIFPVBQESA-N 379.342 2.858 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCc4n[nH]c(C)n4)csc3C2)nc1 426552137 VQQCTNDYUCDIOH-UHFFFAOYSA-N 396.520 2.620 0 50 GFAA CCS(=O)(=O)c1cccc(CNC(=O)N2Cc3ccccc3O[C@H](C)C2)c1 490317772 WCRWGCRWRROZHH-OAHLLOKOSA-N 388.489 2.973 0 50 GFAA CCc1ncc(CN2CCC[C@@H](CNC(=O)Cc3sc(C)nc3C)C2)cn1 823556151 VGRFKGNZLFVWHS-INIZCTEOSA-N 387.553 2.683 0 50 GFAA CC(C)c1noc([C@]23CCC[C@H]2CN(C(=O)c2ccc(OCC(=O)O)cc2)C3)n1 856927643 SGWPUBUYXJHFAR-BTYIYWSLSA-N 399.447 2.850 0 50 GFAA O=C(c1ccccc1Cn1cncn1)N1CC[C@@H](Oc2ccc(C3CC3)cn2)C1 858077155 KGZICTXTNXBGBE-LJQANCHMSA-N 389.459 2.892 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCC[C@@H]1C(O)(c1ccccc1)c1ccccc1 913206531 VCIZBZQMYPDQCT-HXUWFJFHSA-N 378.472 2.558 0 50 GFAA O=C(c1cnc2ccccc2n1)N1C[C@H](Cc2ccnc3ccccc23)[C@@H](O)C1 1616068344 AXGYFHGBNQFNNU-AOMKIAJQSA-N 384.439 2.854 0 50 GFAA CC[C@@H](CNc1noc(-c2ccc(OC)cc2)c1C(=O)O)N1CCOCC1 1704311232 AIRWELSBGFXJRF-AWEZNQCLSA-N 375.425 2.571 0 50 GFAA Cc1cc(C)n(CCNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)n1 1772808169 HPRLOZFSARZBMW-INIZCTEOSA-N 381.505 2.940 0 50 GFAA CCC[C@@H](CC)C(=O)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(C)n2)C1 1775990972 GRLUROXIBPNFMT-UTKZUKDTSA-N 375.513 2.872 0 50 GFAA COCC1(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](CNC(=O)[C@H]2C[C@@H]2C(F)F)C3)CC1 1775992430 SJBMCSYOJYRCFL-QRJUGERDSA-N 384.467 2.590 0 50 GFAA CNC(=O)Cc1ccccc1-n1ccnc1-c1cc2cc(OC)ccc2[nH]c1=O 1857686069 GRPKZESSIPQRSL-UHFFFAOYSA-N 388.427 2.678 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(C2)CN(C2CCOCC2)CC[C@H]3O)c(C)c1 1857686320 QNXUZWZYLJDOAC-FYYLOGMGSA-N 386.536 2.771 0 50 GFAA CCOC(=O)CCNC(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857701513 MEWUWEPEUJZMMC-LBPRGKRZSA-N 379.844 2.767 0 50 GFAA COc1ccccc1C(=O)N1CCC2(CC1)CC(=O)N(CC1CCC1)CCO2 1857703616 PIFCSZJFICTWKK-UHFFFAOYSA-N 386.492 2.719 0 50 GFAA COc1c(C)cccc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857731989 WVGJGIPUVVQUPF-YYDVJCTNSA-N 392.455 2.918 0 50 GFAA CC(=O)Nc1cnc(C)c(C(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)c1 1875274140 MSAQADPYKOYYTC-ZDUSSCGKSA-N 380.448 2.966 0 50 GFAA COCCN(C(=O)[C@@H](O)CN1CCCC1)[C@H](C)c1cccc(C(F)(F)F)c1 1875308800 YHCPLVVCHKRMMN-PBHICJAKSA-N 388.430 2.698 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NC3(c4nccc(C(F)(F)F)n4)CC3)n[nH]c21 1875404218 AAKVBXDRXCNCPN-BDAKNGLRSA-N 381.358 2.660 0 50 GFAA CCCN(CCNC(=O)c1ccc(C)n1C)C(=O)C[C@H]1OCc2ccccc21 2325794789 RKJSQBTYMHHVBI-HXUWFJFHSA-N 383.492 2.964 0 50 GFAA CCS(=O)(=O)c1cc(Cl)cc(COC(=O)c2cnc3ccnn3c2C)c1 2325819570 JIYBYLXGVJYHAQ-UHFFFAOYSA-N 393.852 2.842 0 50 GFAA CC(C)c1nc2ccccn2c1NC(=O)c1ccc2c(c1)CC[C@@H](N)C(=O)N2 2325857561 GMOARKDCHMISCG-OAHLLOKOSA-N 377.448 2.922 0 50 GFAA COc1ccc(CN2CCC[C@@]23CCCN(C(C)C)C3=O)cc1OCC(=O)O 2356133866 IWHQXIBJUKZIAW-NRFANRHFSA-N 390.480 2.524 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)cn1 2356151774 YQDLZXCZJOLGKE-HSZRJFAPSA-N 393.487 2.930 0 50 GFAA O=C(c1cc[nH]n1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1cccc(F)c1 2356159113 MJRGZYNWWGGNJB-LPWQTFTOSA-N 396.466 2.633 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc4nc[nH]c4c3)C1)CC2 2356153505 JTHZHDQNKRAEDL-OAQYLSRUSA-N 376.464 2.539 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2cnn(Cc3ccccc3)c2)C1=O 2356165564 JMJMZMZDOSCFBR-JOCHJYFZSA-N 380.492 2.937 0 50 GFAA Cc1n[nH]c(SCC(=O)Nc2nnc(SCc3ccccc3)s2)n1 4777341 CLWYJPFYIUOMLK-UHFFFAOYSA-N 378.508 2.988 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCO[C@H]1c1ccnn1C)c1ccc(Br)cn1 225434917 LGMGIXMZQQQAGV-IXPVHAAZSA-N 379.258 2.533 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 55211518 YJSOOLIMNGHFCQ-IBGZPJMESA-N 381.476 2.805 0 50 GFAA O=C1C[C@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1Cc1cccs1 101424076 ZZSYGCAGGUDIEK-BFSLETRISA-N 395.528 2.707 0 50 GFAA Cc1cccc(-c2cccc(CNC(=O)C(=O)N[C@@H]3CC[C@@H]4CNC[C@@H]4C3)c2)c1 419512774 KXQTWEYONSPJPQ-BHIFYINESA-N 391.515 2.783 0 50 GFAA C[C@H](CO)CN(Cc1ccccc1)C(=O)COc1ccc2ccc(=O)oc2c1 55107876 YAWHCOOSVBIODW-INIZCTEOSA-N 381.428 2.829 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCC3CCCCC3)C2=O)c1 67804355 HWGWLQJBXHLAGO-OAQYLSRUSA-N 378.488 2.858 0 50 GFAA Cn1cc(N2CC[C@H](N3CCO[C@@H](c4ccccc4C(F)(F)F)C3)C2=O)cn1 248431446 CCWDEVSRABLSKR-DLBZAZTESA-N 394.397 2.618 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)CCc2nnc(-c3ccsc3)o2)C1 20907625 KDYIGFRZDCWMLO-ZDUSSCGKSA-N 399.476 2.586 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)cc1=O)Nc1cc(-c2ccccc2)no1 20535548 JPPZQBVRYYSCEX-UHFFFAOYSA-N 379.420 2.527 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1 173348206 WZGRWVPKICOBTL-VQIMIIECSA-N 379.460 2.629 0 50 GFAA O=C(c1ccc(CN2C(=O)CNC2=O)cc1)N1CC[C@H](Cc2ccc(F)cc2)C1 119529580 SVDXXNNFAGXTDX-QGZVFWFLSA-N 395.434 2.582 0 50 GFAA COc1ccc(-c2nc(CN3C[C@H](O)[C@@H](N4CCCCC4)C3)c(C)o2)c(F)c1 71738422 SMJSCLDATPZWFV-PMACEKPBSA-N 389.471 2.829 0 50 GFAA COc1ccccc1C(=O)[C@@H]1CCCN(C(=O)CCN2CCCCCC2=O)C1 72169290 PREZBVVGWFTEEC-QGZVFWFLSA-N 386.492 2.909 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(Cc1c(F)cccc1F)CC2 72129017 JZNXITJBBZHIFR-UHFFFAOYSA-N 387.434 2.591 0 50 GFAA CCc1ncc(CN2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)cn1 72438845 KTJQCIJPSSLXFI-QFIPXVFZSA-N 379.508 2.839 0 50 GFAA Cc1cccc(-c2n[nH]cc2C(=O)N2CCCN(C(=O)c3ccco3)CC2)c1 426555434 HRKNTSQTGZUFQU-UHFFFAOYSA-N 378.432 2.966 0 50 GFAA COc1cc(CN(C(=O)c2ccc3c(c2)ncn3CCO)C2CC2)ccc1O 97425499 LEBAWKGAIHMXNW-UHFFFAOYSA-N 381.432 2.548 0 50 GFAA CNC(=O)CNC(=O)c1ccc(OC2CCN(CC(C)(C)C)CC2)c(Cl)c1 95508545 ZSWLYKXAZYFSMK-UHFFFAOYSA-N 395.931 2.705 0 50 GFAA O=C(NCCn1ccc2c(Cl)cccc21)[C@H](Cc1ccccc1)n1cnnn1 253407373 JVAWMFGEMYFBFN-IBGZPJMESA-N 394.866 2.881 0 50 GFAA Cc1nn(C)cc1-c1cccc(C(=O)N[C@@H]2CCCN(c3cnccn3)C2)c1 299790359 AXZSEESOWLBLLL-GOSISDBHSA-N 376.464 2.584 0 50 GFAA Cc1nc([C@@H](C)N(C)C(=O)NCc2csc(N3CCOCC3)n2)c(C)s1 584888785 TZUFSLINQFSGGF-LLVKDONJSA-N 395.554 2.956 0 50 GFAA Cc1sc2nc(CCNC(=O)c3ccc(-n4cnnc4)cc3)nc(O)c2c1C 670471897 KEHGAZFYTFKXJJ-UHFFFAOYSA-N 394.460 2.567 0 50 GFAA CCCc1nc(-c2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)co1 952894736 QCANJZDTJITQSX-LBPRGKRZSA-N 384.440 2.893 0 50 GFAA CC1(C)CN(C(=O)CCCc2cnn[nH]2)[C@@H]1c1nccn1Cc1ccccc1 952894183 XCEDFTMUIVLJBK-LJQANCHMSA-N 378.480 2.982 0 50 GFAA Cc1nccn1CC(=O)NCC1CCN(Cc2cc(F)c(F)cc2F)CC1 952965040 BPRMBIPHLXMMIM-UHFFFAOYSA-N 380.414 2.637 0 50 GFAA Cc1nc(COc2ccccc2C(=O)Nc2cnn([C@@H]3CCOC3)c2C)no1 1875268335 IJGXUYWDYZNAJT-CQSZACIVSA-N 383.408 2.676 0 50 GFAA Cc1nc(C)c(C(=O)NCCCCc2cn(-c3cccc(C(=O)O)c3)nn2)s1 1875324572 DLTGUPQMHKZCNV-UHFFFAOYSA-N 399.476 2.792 0 50 GFAA Cc1ccc(Cc2nc(-c3cn(CCO)nn3)n([C@H]3CCOC(C)(C)C3)n2)cc1 1875336150 TWMUXPFRGYVNKY-KRWDZBQOSA-N 396.495 2.558 0 50 GFAA FC(F)c1nnc2n1C[C@H](CN=c1cc(Cl)nc([C@@H]3CCCO3)[nH]1)CC2 1875395081 KEFVQHZXVQMKLQ-UWVGGRQHSA-N 384.818 2.607 0 50 GFAA O=C(C[C@@H]1CCNC[C@H]1F)Nc1nccn1Cc1ccc(Br)cc1 888101813 PFDBIXJKERLJDM-DZGCQCFKSA-N 395.276 2.970 0 50 GFAA O=C(NS(=O)(=O)C[C@H]1CCCCO1)c1ncoc1-c1ccccc1Cl 170645652 FGZUFUCHEIFDEB-LLVKDONJSA-N 384.841 2.624 0 50 GFAA Cc1ccc(N2CCC(N[C@H](C)c3n[nH]c(CC(=O)O)n3)CC2)cc1Cl 1506399786 IVQRMIBKNNUYGB-GFCCVEGCSA-N 377.876 2.713 0 50 GFAA Cn1nnc(-c2ccc(C(=O)N3CCC([C@H](O)c4cccs4)CC3)cc2)n1 1506429140 VPQDELUDEDOCDF-KRWDZBQOSA-N 383.477 2.524 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3C[C@@H]4CC[C@H]3CN(S(C)(=O)=O)C4)oc2c1 216568821 HTWMRXFICNCMQL-CABCVRRESA-N 376.478 2.546 0 50 GFAA O=C(O)c1c(NCCN2CCC[C@@H](CO)C2)noc1-c1ccc(Cl)cc1 1704307958 NSRVJWDYTPJLHV-GFCCVEGCSA-N 379.844 2.809 0 50 GFAA CC(C)c1ccc(OCC(=O)N2CCC(C(N)=O)CC2)c(Br)c1 1141584 WDBRYQQSEQTAGP-UHFFFAOYSA-N 383.286 2.675 0 50 GFAA O=C(O)CSc1nnc(NC(=O)c2cccc(OC(F)(F)F)c2)s1 4107172 RAIBXQFEDDRDPH-UHFFFAOYSA-N 379.341 2.866 0 50 GFAA in-vivo O=C(c1ccccc1Cl)N1CCC(C(=O)N2CCC[C@H]2C2(O)CC2)CC1 1772813358 YJXAVBUQTGYOCQ-KRWDZBQOSA-N 376.884 2.708 0 50 GFAA CC[C@@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCCCSC)c1=O 12279555 WYDGNSLIAVNMNC-CQSZACIVSA-N 393.553 2.975 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCC[C@H](Nc2ccc(F)c(F)c2)C1 12432065 BTELGUXZWHEUON-KRWDZBQOSA-N 398.417 2.716 0 50 GFAA CNC(=O)Cn1ccc(-c2cccc(-c3cc(N4CCCCC4)ncn3)c2)n1 19799520 VHIKRUWHNHAYDV-UHFFFAOYSA-N 376.464 2.743 0 50 GFAA COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1Cl 4694570 SJMCYHWSLPUHLQ-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA Cc1nc([C@@H](N)C(C)C)n(CC(=O)NCCCc2nc3ccccc3s2)n1 1857681350 JYQVVUWNNNEBDJ-SFHVURJKSA-N 386.525 2.601 0 50 GFAA CN1CC2(C1)CN(C(=O)C[C@@H]1CCCN(c3nc4ccc(Cl)cc4o3)C1)C2 1857722138 PFKJTGOUXRTKPL-AWEZNQCLSA-N 388.899 2.862 0 50 GFAA COC(=O)c1ccc(NC(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)cc1 1857723767 VQMWBFSBKZCLKI-HSALFYBXSA-N 395.459 2.809 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3ccc4c(c3)CCCO4)C1)CC2 1875250999 JXPIPHPQSNYNAK-JOCHJYFZSA-N 379.460 2.936 0 50 GFAA Cc1cc(C(=O)N(CC(=O)O)C2CC2)nn1-c1ccc(Br)cc1 237667483 XZUSWNWYHTXBRS-UHFFFAOYSA-N 378.226 2.632 0 50 GFAA C[C@H](NC(=O)N[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C)c1cccc(S(N)(=O)=O)c1 241897381 TYFXVEQOJQUCHG-PQIIZBDJSA-N 379.526 2.909 0 50 GFAA CCc1nn(C)c2[nH]nc(NC(=O)[C@@H]3COc4ccc(Br)cc43)c12 134949364 ZZWHRHHDICNHEO-SNVBAGLBSA-N 390.241 2.736 0 50 GFAA O=C(NCc1nccn1CC(F)(F)F)[C@@H]1CCCN(Cc2ccccc2)C1 363625651 GFPJYQMMSIZFEE-MRXNPFEDSA-N 380.414 2.974 0 50 GFAA COc1ccnc(N2CCN([C@@H]3CCCN(c4ccccc4F)C3=O)CC2)c1 156804377 GOLRNRRWBQDNAT-LJQANCHMSA-N 384.455 2.547 0 50 GFAA Cn1cncc1[C@@H]1C[C@H]1C(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O 909262160 RBPWOLHSEUVORE-IPMKNSEASA-N 377.444 2.737 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N[C@H](CO)[C@H](O)C1CCCCC1 913047654 AOZJSFSZTCVOCX-CRAIPNDOSA-N 378.494 2.672 0 50 GFAA Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)N[C@H]1CCC(=O)NC1=O 1857797799 UDPCOPADDKOCEO-HNNXBMFYSA-N 392.242 2.899 0 50 GFAA Cc1c(NC(=O)Cn2cc([C@H]3CCOC3)cn2)cccc1C(=O)N1CCCC1 2325771211 FVKGQCDDRCHLID-INIZCTEOSA-N 382.464 2.570 0 50 GFAA O=C(NC[C@@H](O)C1CCOCC1)c1cccc(Nc2ncnc3ccccc23)c1 2325779951 SPZCEGNSTZJOCM-HXUWFJFHSA-N 392.459 2.891 0 50 GFAA CC1(Cn2cc(C(=O)N3CCC(Oc4ccc(Cl)cc4)CC3)nn2)COC1 2325782325 OHEVNWKQLARYKJ-UHFFFAOYSA-N 390.871 2.652 0 50 GFAA O=C(NC[C@@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCC2)o1 2325791237 FBECUWHPROWJSM-AWEZNQCLSA-N 392.452 2.663 0 50 GFAA O=C1N[C@@H](c2ccc(OCc3ccccc3)cc2)C(=O)N2CC3(CCC3)OC[C@H]12 2325808995 PIXRPUUEAZDNSD-UXHICEINSA-N 392.455 2.587 0 50 GFAA Cc1cccc(CN(C)C2CCN(C(=O)c3cc4c(O)ncnc4cn3)CC2)c1 2325822248 LWSOLWZHIFQKAV-UHFFFAOYSA-N 391.475 2.775 0 50 GFAA NC(=O)[C@@H](OC(=O)c1ccc2c(c1)CCOC2)c1cccc(Br)c1 2325870696 KTKLZQZQUTZCER-INIZCTEOSA-N 390.233 2.905 0 50 GFAA COC(=O)c1cc(Cl)c(NC(=O)[C@H]2COc3ccccc3O2)cc1OC 943589 QQSDBQLKFQKIKJ-MRXNPFEDSA-N 377.780 2.914 0 50 GFAA Cc1oc(-c2ccccc2F)nc1CN1CCN(C)[C@]2(CCNC(=O)CC2)C1 108036400 LSYZAJKGVAXEEN-OAQYLSRUSA-N 386.471 2.575 0 50 GFAA O=C(O)c1nn(CC2CC2)c2c1CN(C(=O)Cc1c[nH]c3ccccc13)CC2 67689030 YUPPPYNWBJVKGY-UHFFFAOYSA-N 378.432 2.600 0 50 GFAA COc1cc2c(cc1OC)[C@H]([C@@H]1c3cc4c(cc3CCN1C)OCO4)OC2=O 22242053 FLMLIWNNRKBNAQ-VQTJNVASSA-N 383.400 2.873 0 50 GFAA Cc1nccc(-c2cccc(N3CCC(N[C@@H](C)c4nncn4C)CC3)c2)n1 23581992 ZPIZQKMMOKAFND-HNNXBMFYSA-N 377.496 2.900 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(c2ncc(F)cn2)CC1 67805069 AWMRPKPUHNHTOF-UHFFFAOYSA-N 396.426 2.915 0 50 GFAA O=C(c1cccnn1)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67817112 IPAXTXKYXCKRGY-UHFFFAOYSA-N 382.807 2.932 0 50 GFAA CCCn1nnnc1CN1CCC2(CC1)C[C@@H]2N(Cc1ccsc1)C(C)=O 328627275 FZUOOPKNKXZMIH-KRWDZBQOSA-N 388.541 2.548 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@H](C)c3ccccc3)cc2)c(=O)[nH]n1 33026729 IPBUFHBUKMFYBJ-OAHLLOKOSA-N 383.473 2.709 0 50 GFAA CCN1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)C[C@@H]1c1ncc[nH]1 328630208 PPKORBCPSPXBSI-GFCCVEGCSA-N 389.308 2.784 0 50 GFAA O=S(=O)(c1cnc2ccc(F)cc2c1)N1CC[C@@H](c2nc(C3CC3)no2)C1 329256214 DOYYNTJGFRJHQB-GFCCVEGCSA-N 388.424 2.813 0 50 GFAA CC1(C)C[C@@H](NC(=O)Cn2nnc(-c3ccccc3)n2)c2ccc(F)cc2O1 484867823 RRZMAJTVQVUSMR-MRXNPFEDSA-N 381.411 2.898 0 50 GFAA Cc1nn(C)c2ncc(CN3CCC(n4c(=O)[nH]c5ccccc54)CC3)cc12 261372314 HWJBZRAKNIMLNO-UHFFFAOYSA-N 376.464 2.757 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)CC2)cc1 128983636 MJDBBESFAUKUEE-TZIWHRDSSA-N 387.524 2.870 0 50 GFAA O=C(CCN1CCC2(CC1)CN(CCc1ccccc1)C(=O)O2)N1CCCC1 77486188 QVKDAWZAVPHNTE-UHFFFAOYSA-N 385.508 2.528 0 50 GFAA COc1ccc(C)cc1CCNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1 172701039 YGXCQILYGOPDKG-NRFANRHFSA-N 386.467 2.875 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1 34858997 UOYRSRZLDNYMBL-VMPITWQZSA-N 399.516 2.665 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(c3cc(N(C)C)ncn3)C2)cc1OC 72474462 MDSXIYURTVLUIT-GOSISDBHSA-N 399.539 2.703 0 50 GFAA O=C(Nc1cccc(C(=O)N[C@@H]2COc3ccccc3[C@H]2O)c1)c1cccnc1 378142013 WPRPDLJNZZPMEE-UYAOXDASSA-N 389.411 2.558 0 50 GFAA CCNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(CC(C)C)cc2)cc1 14225267 BZNLKEOGTOGLMN-UHFFFAOYSA-N 396.534 2.984 0 50 GFAA Cc1ccc(OC2CCN(C(=O)NCC3(CS(C)(=O)=O)CC3)CC2)cc1C 175500890 KBKKEEMQWBLVPA-UHFFFAOYSA-N 394.537 2.681 0 50 GFAA C[C@H](N1CCN(C(=O)C2CCN(C(=O)c3ccccc3)CC2)CC1)C(F)(F)F 177131242 ZDNACUKAJCHXAZ-HNNXBMFYSA-N 397.441 2.634 0 50 GFAA Cc1cc(C(=O)N[C@@H]2COCC[C@@H]2OCC(=O)O)sc1-c1ccccc1 220489881 YFLBFLYRKWIDNG-CABCVRRESA-N 375.446 2.712 0 50 GFAA COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N(C)[C@H]1CCNC1 179055852 BHMGQQVFJZAJBG-KRWDZBQOSA-N 376.460 2.982 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCSc1ncn[nH]1 95531141 CMHVBEUCCGHYEJ-INIZCTEOSA-N 396.472 2.964 0 50 GFAA CC(C)NC(=O)CCN1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 426486538 WPHHMNKDAAQTJP-NRFANRHFSA-N 393.478 2.694 0 50 GFAA CCc1cnc(C)nc1N1CCC(NCc2nc(-c3ccccc3)n[nH]2)CC1 95526808 ASWNVBIEVADZRZ-UHFFFAOYSA-N 377.496 2.891 0 50 GFAA Cc1c(C(=O)N2CC[C@@H](C(=O)O)C2)nnn1-c1ccc(-c2ccccc2)cc1 237763526 DOFNWMMRFBYXGI-QGZVFWFLSA-N 376.416 2.789 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@H]2CC[C@@H]1CN(CC(=O)N(C)C)C2 91551135 VUKWXOBKXKZZGC-LSDHHAIUSA-N 378.904 2.665 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)[C@@H]1CCCN(c2ncnc3[nH]ccc23)C1 95506077 HUNVEUIRLRPXGJ-OAHLLOKOSA-N 387.447 2.999 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)ccn1 293512890 XKLWGVWCOWCILC-LJQANCHMSA-N 377.391 2.592 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4cccnc4)C3)CC2)nc1 91746484 URUUDDSJYKEUBN-UHFFFAOYSA-N 378.476 2.830 0 50 GFAA Cc1n[nH]c(C)c1CCN1CCC[C@]2(CCC(=O)N(Cc3ccccn3)C2)C1 91808366 VVFADFFVTTZMIN-QFIPXVFZSA-N 381.524 2.869 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cc(-c3ccccc3O)n[nH]1)C2 95522677 AKYKCGDFFNIHPM-ZDUSSCGKSA-N 379.416 2.772 0 50 GFAA O=C(Cc1cn2ccccc2n1)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 182877920 PGIMGAGMUVXSFA-AWEZNQCLSA-N 377.370 2.956 0 50 GFAA C[C@H](C(N)=O)n1cc(-c2cccc(C(=O)N(Cc3cccnc3)C3CC3)c2)cn1 534579676 BKGKAOKSPDMILL-OAHLLOKOSA-N 389.459 2.796 0 50 GFAA C[C@@H](NC(=O)c1cccc(-c2ccc(N3CCCC3)nn2)c1)c1cnn(C)c1 534589027 OMIOZHYKCQBPKX-OAHLLOKOSA-N 376.464 2.968 0 50 GFAA O=C(c1nnn2c1CO[C@@H](c1ccccc1)C2)N1CCN(C2CCCCC2)CC1 263616238 HSMVVZMTZFIFCO-HXUWFJFHSA-N 395.507 2.640 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)[C@@H](c2cccnc2)N2CCCC2)n1 825264414 FQAODENBHWCMOD-MRXNPFEDSA-N 379.386 2.652 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)Cc1n[nH]c2c1CCCC2 1875401539 KYQXMGXFHHKTPE-KUHUBIRLSA-N 398.511 2.709 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)Nc3ccccc3OC[C@@H]3CCCO3)nn2)CC1 952979199 NATCIGXGKTVESE-XHSDSOJGSA-N 385.468 2.531 0 50 GFAA CCc1nc(CN2CCC[C@H](NC(=O)NCc3cccc4occc34)C2)no1 888101296 HPDOGPXGWWRFKU-HNNXBMFYSA-N 383.452 2.842 0 50 GFAA CCOC(=O)N1[C@H](C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)CC[C@@H]1c1ccc(C)o1 222080113 ZGCILIIUXPJJDC-XDNAFOTISA-N 389.496 2.945 0 50 GFAA Cc1[nH]c2ccccc2c1CCNC(=O)c1nc(S(C)(=O)=O)n2ccccc12 170620446 STZZYOGZTRINSZ-UHFFFAOYSA-N 396.472 2.500 0 50 GFAA COc1ccc(Cl)cc1CNC(=O)N1CCN(C2CCOCC2)C[C@@H]1C 279407791 DLWPPGLWUCXJRR-AWEZNQCLSA-N 381.904 2.743 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)S(=O)(=O)c1cc(C)c(C)cc1OC 1506400077 HSADNLUSBVKUAC-QGZVFWFLSA-N 379.478 2.762 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2cnc(-c3cccs3)nc2)CC[C@@H]1O 1529119207 DBDWBMYXICFTPN-RBBKRZOGSA-N 395.528 2.993 0 50 GFAA COC(=O)c1cc(NC(=S)NC(=O)c2ccccc2F)cc(C(=O)OC)c1 1182599 DLXAZFWKRMPMMG-UHFFFAOYSA-N 390.392 2.526 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 5158332 CVIIAOKGVLTYJI-HNNXBMFYSA-N 397.880 2.836 0 50 GFAA O=C(N[C@@H]1CCOC1)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 11668212 CVDHXNZJARLTQG-LJQANCHMSA-N 381.476 2.644 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3ccc(F)cc3)C2)cc1 11770678 JGUHSFJDWGIJMU-HNNXBMFYSA-N 398.434 2.895 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)N3c4ccccc4C[C@H]3C)c2)C1=O 12003299 RTLYDQFQCNZRIU-ZIAGYGMSSA-N 384.457 2.591 0 50 GFAA CSc1ncccc1C(=O)NC[C@@H]1Cc2cccc(-c3cnccn3)c2O1 12079781 NFSLIFUBWRSUIB-AWEZNQCLSA-N 378.457 2.994 0 50 GFAA O=C(C1CC1)N1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(F)c(F)c2F)C1 12184762 QVRVXNXNEAOQFG-ZBFHGGJFSA-N 380.410 2.896 0 50 GFAA COc1ccc(CCN2C[C@@H](NC(=O)Nc3cccc(OC)c3)CC2=O)cc1 12304323 BSRKANDCKJISQD-KRWDZBQOSA-N 383.448 2.669 0 50 GFAA O=C(NC[C@@H]1OCCc2ccccc21)c1cn(Cc2c(F)cccc2F)nn1 12315148 DFNQVNFYPQRTGB-IBGZPJMESA-N 384.386 2.648 0 50 GFAA Cc1ccccc1CC(=O)N[C@@H]1CC(C)(C)Cc2nc(N3CCOCC3)ncc21 12459597 IFAUBOHJJNMAOW-LJQANCHMSA-N 394.519 2.994 0 50 GFAA Cc1ccccc1CC(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCOCC3)ncc21 12459598 IFAUBOHJJNMAOW-IBGZPJMESA-N 394.519 2.994 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)C1CCN(CCc2ccccc2)CC1 15074479 FGLPWWTWLDFUIR-UHFFFAOYSA-N 376.464 2.556 0 50 GFAA Cn1c(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)nc2ccccc21 15077793 LGPXABUTNNOYMZ-KRWDZBQOSA-N 395.551 2.528 0 50 GFAA CN(CCN1CCCCC1)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 19795229 CEGBGGSOSIADIO-UHFFFAOYSA-N 396.601 2.785 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CCN([C@H]1CC(=O)N(C)C1=O)[C@@H]3c1ccccc1 169680741 QTGLBIQKIDRKJE-SIKLNZKXSA-N 389.455 2.881 0 50 GFAA biogenic COc1ccc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c(OC)c1 1857684015 VWEKWUSSCOURSF-QFIPXVFZSA-N 396.443 2.593 0 50 GFAA Cc1nc(CN2C[C@@H]3[C@H](CNC(=O)C4(C)CC4)[C@H]4CC[C@]3(C2)O4)sc1C 1857732351 MUAMVHYZYJBSRM-QCBUCWTNSA-N 375.538 2.656 0 50 GFAA COc1ncccc1CN1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1875251612 AILMISVJFMNSEU-SIKLNZKXSA-N 384.476 2.751 0 50 GFAA CNc1nc(C)cc(N2CC[C@H]3[C@H](CCC(=O)N3CCc3ccccc3)C2)n1 212981865 ZOZYQFNIDNWFOB-MOPGFXCFSA-N 379.508 2.887 0 50 GFAA CNC[C@@H]1CCCN(C(=O)c2cc(O)nc3ccc(Br)cc23)C1 237246946 GEYDXEAHZFLPAW-NSHDSACASA-N 378.270 2.775 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)c3ccccc3F)CC2)n1 17012588 JUKGMXOOOPBCEE-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)[C@H]1Cc3ccccc31)CC2 262867494 WBRMXNVMUZLFMT-ROUUACIJSA-N 381.428 2.944 0 50 GFAA Cc1cccc(C2=CCN(S(=O)(=O)C[C@@H]3CCCS(=O)(=O)C3)CC2)c1C 908496767 IAYRFIYURVHIHA-QGZVFWFLSA-N 397.562 2.547 0 50 GFAA CC(C)S(=O)(=O)CC[C@H]1N=C([C@H]2CCOC2)c2ccc(Cl)cc2NC1=O 2325796284 GLGOCGALWNVTFC-SWLSCSKDSA-N 398.912 2.700 0 50 GFAA O=C(N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2C(=O)O)c1cc(Cn2cc(Cl)cn2)cs1 2325799655 NJGUHJREAFCAOE-HBJVGIJOSA-N 379.869 2.875 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CCC[C@](O)(c3ccc(Cl)cc3)C2)C1 2325889261 HVZRFVWXNUGMCN-MGPUTAFESA-N 376.884 2.575 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 663912 LPUZQJZCNFPGJC-UHFFFAOYSA-N 384.807 2.969 0 50 GFAA CN(C)C(=O)c1cc(Br)c(C(=O)N(C)C)cc1Br 690052 GMJQUVSKFRHXAA-UHFFFAOYSA-N 378.064 2.615 0 50 GFAA NC(=O)c1ccc(NC(=O)c2ccc(N3C(=O)c4ccccc4C3=O)cc2)cc1 914973 QAPMMCWVMIHXBB-UHFFFAOYSA-N 385.379 2.838 0 50 GFAA Cc1ccc2nc(NC(=O)[C@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)sc2c1 1062647 ZJPWDNQVWODQBH-WCQYABFASA-N 377.466 2.914 0 50 GFAA CC(=O)OC[C@@H]1O[C@@H]2OC3(CCCCC3)O[C@@H]2[C@H]2OC3(CCCCC3)O[C@@H]12 2101344 AVMIIKLVEDAPFQ-NNPSNHGLSA-N 382.453 2.795 0 50 GFAA biogenic CC(=O)c1cccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1 2857676 CFDWEAMXVKQKAJ-LLVKDONJSA-N 380.853 2.848 0 50 GFAA COCCNC(=O)c1ccc(N(Cc2ccc(Cl)cc2)S(C)(=O)=O)cc1 2932745 MNFOEVQVXGBCIW-UHFFFAOYSA-N 396.896 2.682 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)N(CCc2ccccc2)c2cnccn2)cc1 4110335 BHAOTZRHRMOWBV-UHFFFAOYSA-N 396.472 2.933 0 50 GFAA O=C(C1CCN(Cc2cccnc2)CC1)N1CCN(c2ccccc2F)CC1 5593754 FNKUCRHKRUACGG-UHFFFAOYSA-N 382.483 2.782 0 50 GFAA Cc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)cs2)c(C)c1 6680819 PJPIMIIWWKRWEV-UHFFFAOYSA-N 380.491 2.638 0 50 GFAA COc1cccc(CNC2CCCCCC2)c1OC[C@H](O)CN1CCOCC1 11753796 LESYKIMINXSROZ-HXUWFJFHSA-N 392.540 2.580 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCN4CCC[C@@H]4C3)n[nH]2)c(Cl)c1 11818922 BSAKPSDJLYDRBI-CQSZACIVSA-N 390.871 2.571 0 50 GFAA CCN1CCN(c2ccc(-c3nc(Cc4ccc(OC)cc4)no3)cn2)CC1 11839226 ORXDCIAJYVQPED-UHFFFAOYSA-N 379.464 2.873 0 50 GFAA COc1ccccc1/C=C/CNCc1cccnc1N1CCN(C(C)=O)CC1 11998239 KISJBHOPWHPHJM-VMPITWQZSA-N 380.492 2.562 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@@H](CNC(=O)[C@@H]2CCCN(C)C2)O3)n1 12162091 BVPRELCESISOTN-MJGOQNOKSA-N 380.492 2.522 0 50 GFAA CCC[C@@H](CC(=O)OCC)NC(=O)c1cn(Cc2ccc(Cl)cc2)nn1 12387428 JGQWOJBMAVZXNO-HNNXBMFYSA-N 378.860 2.832 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CCN(C(=O)c1ccc3[nH]ccc3c1)C2 14744256 AIBDQBRUQREYHB-UHFFFAOYSA-N 391.475 2.819 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)N1CCN(CCC(N)=O)CC1)c1ccccc1 15065755 VKZCJZBEKHHDMG-NRFANRHFSA-N 379.504 2.537 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1ccsc1)CC2)C1CCCCC1 15068953 QZFVBGUTKWWEHL-UHFFFAOYSA-N 387.553 2.637 0 50 GFAA O=C(NCc1ccccc1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1ccc(F)cc1 15074251 SPZGDLWRTNKVPK-RBUKOAKNSA-N 383.423 2.783 0 50 GFAA CN(CC(=O)Nc1nccs1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 16621931 CLGJOORYQXZITG-UHFFFAOYSA-N 380.278 2.709 0 50 GFAA COC(=O)c1ccc(CN2CCN(Cc3ccccc3C)[C@@H](CCO)C2)cc1 23358402 HGRKTTWNGMFETB-QFIPXVFZSA-N 382.504 2.850 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3cccc(=O)[nH]3)n1)CCN(c1ccccn1)C2 23581031 GPSZYUJJNXMPSR-UHFFFAOYSA-N 386.415 2.753 0 50 GFAA NC(=O)[C@@H]1CCCN1C(=O)Cc1csc(-c2ccc(OC(F)(F)F)cc2)n1 32089528 GYUYJHDANBCRKI-ZDUSSCGKSA-N 399.394 2.728 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1)NC12CC3CC(CC(C3)C1)C2 55089013 DRXXMTAXOKJGSB-ZTLYHTANSA-N 399.510 2.601 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1ccccc1 65361820 KWQFNUYJICIHRC-FQEVSTJZSA-N 386.517 2.872 0 50 GFAA COc1nc2c(cc1CNC(=O)c1ccc(C)nc1)C(=O)N(C1CCCC1)C2 71752629 COMUNLHKHFJXPL-UHFFFAOYSA-N 380.448 2.622 0 50 GFAA CN(Cc1ccccc1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71761950 CBNFVAQWRYDILN-HXUWFJFHSA-N 383.536 2.758 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CCc3n[nH]c(C)c3C)CC2)OC1=O 72448232 PQUDGJAXMYGGJT-CQSZACIVSA-N 376.501 2.961 0 50 GFAA O=C(CN1CCC[C@@H]1c1nc(-c2ccccn2)no1)NCCc1ccccc1 77524920 SSRVQQQHPQUGIQ-GOSISDBHSA-N 377.448 2.627 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3cccc(F)c3)C2)CN1CCc1c[nH]cn1 91486855 CCJPBKGRJTXEBB-OAQYLSRUSA-N 384.455 2.636 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)N[C@@H]2CCSC2)CC1 95512235 ZUNCSNBOKPNROH-CQSZACIVSA-N 382.913 2.965 0 50 GFAA CN1CC[C@@H](N(C)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)C1 95512898 YAAWCXNDHXPZFC-HXUWFJFHSA-N 380.492 2.827 0 50 GFAA O=C(NCCCN1CCOCC1)Nc1cccc(-c2nc3ncccc3o2)c1 95529484 LFQHKLHBBXHOBO-UHFFFAOYSA-N 381.436 2.734 0 50 GFAA Cc1ccc(S(=O)(=O)n2ccc3c(I)ncnc32)cc1 95708042 KLDSFRZUPGWQCX-UHFFFAOYSA-N 399.213 2.581 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCC[C@H](Cn3nc(C)nc3C)C2)[nH]n1 116778292 WFDGTBKOVWWBBB-INIZCTEOSA-N 394.479 2.846 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2ccc(OC(F)F)cc2)C1=O 157418875 ASDIQWKMYIJTOZ-AWEZNQCLSA-N 376.359 2.832 0 50 GFAA O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 163069723 PNPVAHKEZCUACR-QGZVFWFLSA-N 391.479 2.957 0 50 GFAA C[C@@H](NC(=O)c1cccs1)C(=O)N[C@H](CC(=O)O)c1ccc(Cl)c(F)c1 170592130 JPXTYANJFCGXMN-NOZJJQNGSA-N 398.843 2.991 0 50 GFAA Cc1csc(NC2CCN(C(=O)[C@@H]3CSCN3C(=O)C(C)(C)C)CC2)n1 170598530 NKBIIXKBTHNUOF-AWEZNQCLSA-N 396.582 2.802 0 50 GFAA C[C@H](NC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)c1ccc(Cl)cn1 170605966 ZVYHTFZVZAGZHP-JTQLQIEISA-N 377.235 2.919 0 50 GFAA C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CSC[C@H]1C(=O)N(C)C 170620623 NNIVWWNTMOBJFI-ZANVPECISA-N 377.293 2.750 0 50 GFAA CCc1n[nH]c(=O)c(CNC(=O)c2ccc(OCc3ccccc3)nc2)c1CC 178492197 HZYXUPSCEWECEB-UHFFFAOYSA-N 392.459 2.799 0 50 GFAA C[C@@H](c1cnn(C)c1)N(C)C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 182730118 PHLMSTDZUMJRMM-ZDUSSCGKSA-N 399.520 2.680 0 50 GFAA COCCNc1nc2cc(C(=O)NCc3nc4ccccc4o3)ccc2n1C 216376271 NHRDZLWGOPLSNJ-UHFFFAOYSA-N 379.420 2.703 0 50 GFAA O=C(NCCc1csc(-c2cnccn2)n1)c1cc(=O)c2ccccc2o1 222600551 RZWGXFGUDZEMDC-UHFFFAOYSA-N 378.413 2.679 0 50 GFAA C[C@H](CCC(=O)O)NC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 237406910 YOGPDOJTFVMEGR-QMTHXVAHSA-N 387.263 2.968 0 50 GFAA CCCOc1ccc(CNC(=O)N2CCO[C@](C)(c3cnn(C)c3)C2)c(C)c1 241911242 UAVXAHPSJYNLNM-NRFANRHFSA-N 386.496 2.975 0 50 GFAA COc1ccc(C2=NO[C@@H]3[C@H]4C[C@H]([C@H]5C(=O)N(c6ccccc6)C(=O)[C@@H]45)[C@H]23)cc1 245255289 HCESIQRAMXQCCX-DBENCMRHSA-N 388.423 2.870 0 50 GFAA COc1ccc([C@H](NC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)C2CC2)cc1 248142699 QPDTXUORMNYSHY-QWFCFKBJSA-N 384.476 2.828 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4ccc(C)cc4)c3CO2)cc1 263619010 WMMZQTNTJSBHGL-IBGZPJMESA-N 378.432 2.797 0 50 GFAA C[C@H]1Sc2ccc(C(=O)Nc3cc(CSCCO)ccn3)cc2NC1=O 269619068 NEJCAGBFVQNHGL-LLVKDONJSA-N 389.502 2.992 0 50 GFAA C[C@H]1CN(Cc2ccccc2NC(=O)N2CCc3ccnc(O)c3C2)C[C@@H](C)O1 276949531 OOGPBYFVZCGBIV-IYBDPMFKSA-N 396.491 2.987 0 50 GFAA CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)[C@H]31 287339022 YSHQKCDJKQVYID-DYZFCQSDSA-N 399.900 2.599 0 50 GFAA NC(=O)[C@H](NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1)c1ccc(F)cc1 290637350 DJPBVOGFGKZWTO-CXAGYDPISA-N 375.831 2.648 0 50 GFAA O=C(O)C[C@H](NC(=O)CN1C(=O)CSc2ccccc21)c1cccs1 299739691 ABDBDQAIGRLZFD-NSHDSACASA-N 376.459 2.519 0 50 GFAA CNC(=O)N1CCN(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)CC1 469742067 QHUYTFSUGGNZMT-UHFFFAOYSA-N 382.464 2.765 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N[C@@H]1CCCN(Cc2cccs2)C1 670469348 DNCYTSBCKOLYLR-OAHLLOKOSA-N 396.516 2.698 0 50 GFAA C[C@@H](CO)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1Br 821376680 HUSMAPOPKDILGE-GWCFXTLKSA-N 387.274 2.512 0 50 GFAA N=C1Nc2nc3cc4c(cc3n2[C@H](c2ccc3c[nH]nc3c2)N1)OCCCO4 877843359 QABRVODNYZYJOO-QGZVFWFLSA-N 375.392 2.571 0 50 GFAA CC[C@@]12C[C@H]3C[C@@](O)(C1)C[C@@](C(=O)NCCNC(=O)c1ccc(F)cc1)(C3)C2 952965120 FOTLWDNFWOLWJY-WWGKXEARSA-N 388.483 2.783 0 50 GFAA CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@H]1SCCc2ccccc21)C(C)(C)O 1326067433 YHBMMSZUONWHSR-HZPDHXFCSA-N 394.537 2.797 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)NC[C@@H]1CCCN(C(C)=O)C1 1506398102 LFFMRBIMPBVIFL-AWEZNQCLSA-N 388.917 2.584 0 50 GFAA CC(=O)N1C[C@@H]2CN(CCn3cc(Cl)cn3)C[C@]2(CCc2ccccc2)C1 1772705385 HHYSOZAVDCTKGX-PZJWPPBQSA-N 386.927 2.950 0 50 GFAA COc1ccc(OC)c2[nH]c(C(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc12 1772715405 MZESNCWBDQSSBX-UHFFFAOYSA-N 389.452 2.878 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@@H](C(=O)NCCc1nccn1C)C2 1772810376 LJPKXGVZGBWIFD-CYBMUJFWSA-N 385.493 2.612 0 50 GFAA Cc1cnc(C)c(N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4ccccc4)C3)C2)n1 1857681200 BYNMRVZIDWWRMH-DENIHFKCSA-N 380.492 2.587 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(S(=O)(=O)Cc3ccc(F)cc3F)C[C@H]12 1857697323 PDSZQHUFWNKSMZ-YFPWBOGZSA-N 399.459 2.728 0 50 GFAA O=C1C[C@H](CN2[C@H]3CC[C@@H]2C[C@]2(C3)CN(C/C=C/c3ccccc3)CCO2)CN1 1857701825 QMYCBUSIQGIHKM-KWDVVKPESA-N 395.547 2.534 0 50 GFAA NC(=O)Cc1nc([C@H]2C[C@@H]3CC[C@H]2O3)n(-c2ccnc3cc(Cl)ccc23)n1 1857718265 QUGWRLFYLJHGQJ-DETPVDSQSA-N 383.839 2.532 0 50 GFAA CN(CC(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)Cc1ccc(F)cc1 1857721211 FEYGGWAUNRKPRV-BHIFYINESA-N 397.494 2.588 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2C[C@@H](O)[C@H](Cc3cnccn3)C2)c1 1857738770 XXCJNXMFSMLSGN-WIYYLYMNSA-N 389.455 2.828 0 50 GFAA Cc1nnc([C@H]2CCCN2CC(=O)N2CCN(c3cccc(Cl)c3)CC2)o1 1875292218 ALTPFKRYRSUHTR-QGZVFWFLSA-N 389.887 2.517 0 50 GFAA N=[S@@]1(=O)CCC[C@]2(CCCN2C(=O)c2cnn(-c3ccccc3F)c2)C1 1875395354 BQFXEMYUIUEGQS-WXTAPIANSA-N 376.457 2.827 0 50 GFAA CCc1ncoc1C(=O)N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403249 UEVRIOMMZUVRLQ-BMGDILEWSA-N 380.448 2.670 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(Nc2cccnc2)cc1 1875403567 YYHPRBNIQXHHBO-CWFSZBLJSA-N 377.448 2.591 0 50 GFAA O=C1CO[C@H](C(=O)N2CCC3(C=Cc4ccccc43)CC2)[C@@H](c2ccccc2)N1 1940195499 UEYDEROAMPRGHX-YADHBBJMSA-N 388.467 2.830 0 50 GFAA O=C(Cn1cc2ccccc2n1)N1CCC2(CC1)CNCc1ccccc1O2 2325774616 CVHNGJIBOZKJPL-UHFFFAOYSA-N 376.460 2.580 0 50 GFAA O=C(NCc1ccncc1)Nc1cccc(NC(=O)[C@@]23CCC[C@@H](CN2)C3)c1 2325774788 TVUHIFKBVWYPGH-IERDGZPVSA-N 379.464 2.874 0 50 GFAA Oc1ccc2c(c1)[C@H](Nc1ncnc3nc(N4CCOCC4)sc13)CCO2 2325789245 GVQIZJOEEZBAMU-CYBMUJFWSA-N 385.449 2.564 0 50 GFAA Cc1ccc([C@H](C)C(=O)NC[C@](C)(NC(=O)C2(CN(C)C)CC2)C2CC2)cc1 2325793791 HZUSYWIXRRDCEJ-JTSKRJEESA-N 385.552 2.841 0 50 GFAA Cn1cc(C(=O)N2CCC[C@H](NC(=O)C(C)(C)C)C2)c(CCC(F)(F)F)n1 2325798473 SQPVECYUTUBBQP-LBPRGKRZSA-N 388.434 2.682 0 50 GFAA O=C([C@@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC[C@@H](N2CCCC2)CC1 2325807665 KZDXGUFIXMNDIS-UYAOXDASSA-N 394.523 2.764 0 50 GFAA O=C(O)[C@H](CNCc1ccc2nc(O)[nH]c2c1)Cc1cc(F)c(F)c(F)c1 2325876893 DLHBWFPNAJMFRB-NSHDSACASA-N 379.338 2.719 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cnn4ccn(C)c34)C2=O)cc1 2356138763 HUJISHGWSXWBNN-QFIPXVFZSA-N 391.475 2.783 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)Nc2cc(C)ccc2OC)S(C)(=O)=O)cc1 880177 SEORNKNZYGJHDY-AWEZNQCLSA-N 392.477 2.805 0 50 GFAA COc1ccccc1C(=O)Nc1nnc(SCC(=O)N2CCCCC2)s1 1115752 GRRCEQLLRJUARR-UHFFFAOYSA-N 392.506 2.904 0 50 GFAA Oc1nc(-c2cccnc2)nc2c1CCC21CCN(C[C@H]2CCCNC2)CC1 2356135506 HNQNMUYCIKMWCK-INIZCTEOSA-N 379.508 2.524 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCC[C@]3(CCc4c[nH]nc43)C2)cn1 2356156391 ZRGTVNAWIQNPSB-NRFANRHFSA-N 377.448 2.724 0 50 GFAA Cn1ncc2ncc(C(=O)N3C[C@@H]4[C@@H](CCC[C@@]4(O)c4ccccc4)C3)cc21 2356168008 LVAKRPXJUVPCLT-QXATTWAWSA-N 376.460 2.728 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)N2CCC[C@@H](c3nccs3)C2)cc1 114741390 UAQUXBJMXFHXMK-CQSZACIVSA-N 391.518 2.838 0 50 GFAA COC(=O)c1c(N2C(=O)[C@@H]3[C@H]4CC[C@@H](O4)[C@@H]3C2=O)sc2c1CCCCCC2 101709540 JDLSIIZPYMLWOH-BHTHQVBYSA-N 389.473 2.861 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3cc(F)ccc3F)CC2)C1 67431970 GSUXRDCSXIBGLQ-OAHLLOKOSA-N 377.479 2.920 0 50 GFAA COC[C@H](C)NC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 64609996 CWENEJXHEOFTHA-IBGZPJMESA-N 387.568 2.823 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4ccnc4C)ncn3)CC2)c(C)c1 67620779 GQQRBTRHVNQPJQ-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)c1cncc2ccccc12 122074414 GGLWGXZRUZJFAW-OAHLLOKOSA-N 396.472 2.921 0 50 GFAA Cc1ccc(CS(=O)(=O)NC(=O)[C@@H]2CCCN2Cc2ccccc2)c(F)c1 252482971 DRHIOPFSWWNZMW-IBGZPJMESA-N 390.480 2.745 0 50 GFAA O=C1[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)N1CCS(=O)(=O)c1ccc(Cl)cc1 252516572 UJOARQYFMKELOE-MAZHCROVSA-N 396.896 2.709 0 50 GFAA COc1ccc(OC)c([C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)c1 77422892 BBEKKBOOJHSZEM-MRXNPFEDSA-N 378.432 2.914 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)cc1 363293531 AELUTZDAQPQGBV-OAQYLSRUSA-N 394.519 2.804 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)c2ncn(-c3ccccc3)n2)CC1 153508349 VPATULZQYFIQRS-UHFFFAOYSA-N 389.459 2.610 0 50 GFAA CCC(O)(CC)CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 363557704 KVPONURUCZYXNL-AWEZNQCLSA-N 398.450 2.808 0 50 GFAA Cc1nc2cc(C(=O)N3CCOC[C@H]3CC(=O)NCC3=CCCCC3)ccc2[nH]1 72125489 YDCUYZZZFJJHCL-GOSISDBHSA-N 396.491 2.719 0 50 GFAA O=C1NC[C@@H]2[C@H]1CCCN2c1nnc(-c2cc(Br)ccc2F)s1 366841546 IFTHMUIASSONHO-BXKDBHETSA-N 397.273 2.822 0 50 GFAA COc1cc(/C=C/C(=O)N[C@H]2CCC(=O)NC23CCC3)cc(Cl)c1OC 374743946 MRKWGGVLJDVKQX-DRDHIDPGSA-N 378.856 2.688 0 50 GFAA CN1CCN(C(=O)NCc2coc3ccccc23)C[C@@H]1c1nc(C2CC2)no1 286655274 CTZGGONLUHLONP-MRXNPFEDSA-N 381.436 2.892 0 50 GFAA Cn1cc(-c2nn(CC(=O)Nc3nn(C)c4ccccc34)c3ccccc23)cn1 48090890 BOFNZMYGUSESSD-UHFFFAOYSA-N 385.431 2.962 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)C1(N2CCOCC2)CCCCC1 222619742 DZQOMJSKWSYDPE-UHFFFAOYSA-N 382.508 2.566 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)N(Cc2ccncc2)C2CCN(C)CC2)n1 426634086 CXGUBTGGCDCSEV-QGZVFWFLSA-N 384.528 2.589 0 50 GFAA O=S1(=O)CCC[C@H](Cc2nc(-c3cc(OC(F)F)ccc3F)no2)C1 293259174 GPMPZLFOHPEGSQ-SECBINFHSA-N 376.356 2.844 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)N2CCN(c3ccc(F)cc3F)CC2)n1 426370778 QRQCFHFWRQANLR-AWEZNQCLSA-N 377.439 2.698 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)CSCCN3CCCC3)C2)cc1 95370728 WZUACITUPKPCRR-SFHVURJKSA-N 376.522 2.920 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)C(=O)c2cccn2C)C1 95496788 PAZUQJBQCKNWMI-GOSISDBHSA-N 397.519 2.630 0 50 GFAA Cc1cc(I)c(C(=O)O)c(I)c1 95910969 KVHAZRZKGVIBAU-UHFFFAOYSA-N 387.942 2.902 0 50 GFAA Cc1ccccc1[C@H](CC(=O)NCCc1nc(N)cc(=O)[nH]1)c1ccccc1 95519237 APNQONZDHOTUHJ-GOSISDBHSA-N 376.460 2.541 0 50 GFAA CC(C)c1ccc(N2C[C@@H](C(=O)N3CCN(c4ccccn4)CC3)CC2=O)cc1 244279882 WTLINOHQQWLGLW-IBGZPJMESA-N 392.503 2.907 0 50 GFAA COc1ccc([C@@H](NS(=O)(=O)c2cc(C)sc2C)[C@H]2C[C@H](O)C2)cn1 244626736 FRQIQOTVLIMDCE-CKEIUWERSA-N 382.507 2.559 0 50 GFAA COC(=O)[C@@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 299035225 TUVCFAYOSZKLJN-IAQYHMDHSA-N 399.274 2.620 0 50 GFAA COc1cc(CO)c(OCc2nn(-c3ccccc3)c3c2CCC3)c(CO)c1 184219053 JATFMSKSMPDWBP-UHFFFAOYSA-N 380.444 2.933 0 50 GFAA O=C(CSCc1ccccc1Cl)N1CC[C@H]2OCc3cnnn3[C@H]2C1 299796280 OGXLCTXFRBWHSG-JKSUJKDBSA-N 378.885 2.537 0 50 GFAA Cc1ccn(CC(=O)NC[C@@H]2CCCN(Cc3cc(-c4ccccc4)no3)C2)n1 827860867 MXEHVKGXTMLJOJ-SFHVURJKSA-N 393.491 2.875 0 50 GFAA O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@H](OCc2cccnc2)C1 670468178 MDVYZKCCAMQZLW-SFHVURJKSA-N 383.448 2.744 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c1nn(C)c2C(=O)NCCOc1ncccc1C(F)(F)F 1875314661 KZUDBCGBNTWOJR-MNOVXSKESA-N 398.385 2.665 0 50 GFAA COc1cccc(C(C)(C)C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C)cc2O3)c1 1875394731 UVGODNOLMXMAGN-QGZVFWFLSA-N 399.491 2.584 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2C[C@@H]3CN(C)[C@@H](c4ccccc4)[C@H]3C2)cc1 1775996519 AOGJJDLBSYGZPT-HARLFGEKSA-N 392.503 2.818 0 50 GFAA CO[C@H](C)C(=O)N(Cc1scnc1C)C[C@H]1CCN(C(=O)CCC2CC2)C1 1775989605 QNWKNQARCJIZRA-WBVHZDCISA-N 393.553 2.854 0 50 GFAA O=C(CCCc1cccs1)N[C@H]1COCC[C@@H]1Oc1ccc(CO)cc1 1565512456 ISFCUZGBIYSICF-OALUTQOASA-N 375.490 2.916 0 50 GFAA O=C(Nc1nc(-c2cccnc2)cs1)C(=O)N[C@H]1CCOc2ccccc21 170609832 RGCCBDKJAZOVAN-AWEZNQCLSA-N 380.429 2.784 0 50 GFAA Cc1ccc(-n2nnc(C(=O)NC[C@@H]3Cc4ccccc4N(C)C3)c2C)cc1 170602408 IATZCVHYHYXYIU-KRWDZBQOSA-N 375.476 2.923 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@]2(CCc2ccccc2)C1 1772705143 WYKYZFBFJQXKCI-NFBKMPQASA-N 397.519 2.831 0 50 GFAA CCOC(=O)C1(CCc2ccccc2)CCN(C(=O)Cc2nonc2C)CC1 12075617 JAUKMMOETOHNIC-UHFFFAOYSA-N 385.464 2.725 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@H](C(=O)NCc4ccccc4)C3)CC2)CC1 12756895 YMRPUTGTEUUTLI-IBGZPJMESA-N 383.536 2.806 0 50 GFAA CC[C@H](C)C(=O)C(=O)N1CCc2c(cnc(C)c2CNC(=O)c2ccsc2)C1 14883038 KYKAHQPGQDVDAS-ZDUSSCGKSA-N 399.516 2.881 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)Cc3cccnc3)C2)cc1OC 15074892 DVGOOLURWYHKOH-HXUWFJFHSA-N 397.519 2.807 0 50 GFAA CSc1ccc(CNC(=O)CCn2ccn3nc4c(c3c2=O)CCCC4)cc1 169760131 DXRAXQQALRKDJD-UHFFFAOYSA-N 396.516 2.803 0 50 GFAA COc1ccc(C(=O)CSc2nnc(CNC(=O)c3ccccc3)n2C)cc1 2861309 VFKKCNLGAVGRSX-UHFFFAOYSA-N 396.472 2.729 0 50 GFAA Cc1cnc(CN2C(=O)C[C@H]3[C@@H]2CCN3Cc2coc(-c3ccccc3)n2)cn1 1857689409 CRDTVAQGSDOQTA-PMACEKPBSA-N 389.459 2.815 0 50 GFAA COc1ccc(C(=O)NCC2CCNCC2)cc1Oc1cc(F)cc(CN)c1 1857695123 UXCOGTOEVXXASX-UHFFFAOYSA-N 387.455 2.815 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccc3sc(=N)[nH]c3c2)[C@H]1c1ccccc1 1857713257 NPUQBOMMOMFWME-HKUYNNGSSA-N 396.516 2.853 0 50 GFAA O=C(CCCc1cn[nH]c1)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857723517 JNFVGLXHLYZSNR-GBESFXJTSA-N 388.899 2.716 0 50 GFAA CN(C)C(=O)C[C@H]1CN2C[C@H](n3ccnc3-c3cccc4cc[nH]c34)C[C@H]2CO1 1857733798 ZFPROMMBHBIDEZ-SQNIBIBYSA-N 393.491 2.524 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875250624 SCYZLHSBERQIRE-ROUUACIJSA-N 375.808 2.643 0 50 GFAA Cc1nsc2ncc(C(=O)NCc3nnc4n3C[C@H](C(F)(F)F)CC4)cc12 2325700250 CUPAGSQJDHTMNV-SNVBAGLBSA-N 396.398 2.646 0 50 GFAA c1ccc2c(c1)N=C(N1CCN(C[C@@H]3COCCO3)CC1)c1ccccc1O2 2325760111 WHFUFUIBTMBZTI-QGZVFWFLSA-N 379.460 2.904 0 50 GFAA O=C(NCc1ccn(-c2ccc(Br)cc2)n1)C(F)=C1CCNCC1 2325801141 XVOFCIQTRFXTFX-UHFFFAOYSA-N 393.260 2.858 0 50 GFAA CCOC(=O)c1c(NC(=O)c2nccnc2C(=O)O)sc2c1CCCC2 754199 DTUJELMVBNOSPP-UHFFFAOYSA-N 375.406 2.544 0 50 GFAA O=C(NCc1ccccc1)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 1077803 AZKDFFBDOIGHEQ-MRXNPFEDSA-N 376.453 2.543 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(N)=O)Cc2ccc(Cl)cc2Cl)cc1 1161694 CMYVHCHGSSJRTA-UHFFFAOYSA-N 387.288 2.978 0 50 GFAA CC(=O)SC[C@@H](Cc1ccccc1)C(=O)NCC(=O)OCc1ccccc1 1546844 ODUOJXZPIYUATO-LJQANCHMSA-N 385.485 2.985 0 50 GFAA biogenic,world COCCOC(=O)c1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 1891377 AHAUXXCBCURTIY-UHFFFAOYSA-N 389.404 2.768 0 50 GFAA COc1ccc(Cl)cc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(F)cc1 4810754 UNIZTTJWHNHZGI-JTQLQIEISA-N 386.832 2.793 0 50 GFAA CN(C)CCNC(=O)[C@@H](NC(=O)c1ccccc1)C12CC3CC(CC(C3)C1)C2 5073629 ACHXVCADWUHXDY-ZTLYHTANSA-N 383.536 2.679 0 50 GFAA CC(=O)[C@@H]1CCCN(C(=O)c2cn(Cc3cccc(C(F)(F)F)c3)nn2)C1 12205179 KVIPIBMITNYPQJ-CQSZACIVSA-N 380.370 2.786 0 50 GFAA Cc1cc(N)n(CC(=O)N[C@H]2CCCN(Cc3ccc(CC(C)C)cc3)C2)n1 15065167 QUVXVEAQIAJSGU-FQEVSTJZSA-N 383.540 2.753 0 50 GFAA O=C(c1nc2ccccn2c1CN(CCO)Cc1ccccc1)N1CCCC1 20207232 OKLINKSREZCUJX-UHFFFAOYSA-N 378.476 2.565 0 50 GFAA Cc1nn2c(N3CCN(CCO)CC3)c3c(nc2c1-c1ccccc1)CCCC3 20503816 VNYPARHJACZIQX-UHFFFAOYSA-N 391.519 2.698 0 50 GFAA Cc1nonc1CN(C)Cc1c(C(=O)N2CCCCC2)nc2c(C)cccn12 20600088 JCYPVPSOPYLTDM-UHFFFAOYSA-N 382.468 2.592 0 50 GFAA O=c1cc(-c2ccccn2)nc(-c2ccc(CN3CCN4CCC3CC4)cc2)[nH]1 23214952 FMBOZQNCCJKZSQ-UHFFFAOYSA-N 387.487 2.779 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)N[C@H](CO)C(C)C)co3)ccc2s1 67675678 IAVLBJJHURFWIN-CQSZACIVSA-N 375.450 2.918 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)c3c[nH]c(=O)cc3O)C2)cc1 67834353 YROXXADKBZTJCE-OAHLLOKOSA-N 378.432 2.799 0 50 GFAA CC(C)c1ccc(N2CCC[C@@H](n3cc(C(=O)NC4CCCC4)nn3)C2)nn1 67871444 NPWHLDHJXHKRRO-MRXNPFEDSA-N 383.500 2.705 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4cccc(C)n4)C3)CCC2=O)cn1 91435082 HIXKLCZWODPYIV-QFIPXVFZSA-N 393.491 2.533 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC(c2nccn2Cc2ccccn2)CC1 91621073 POKFBEAWTXLBJB-UHFFFAOYSA-N 378.480 2.778 0 50 GFAA Cc1cc(N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)nc(N)n1 91933334 RSOZYKCNECIYGS-UHFFFAOYSA-N 379.508 2.819 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@@H]2NC(=O)c1cnc[nH]c1=O 92066697 BESGNHCGDAFIIB-INIZCTEOSA-N 377.448 2.708 0 50 GFAA COc1ccc(CN2C[C@@H]3c4ccc(OC)cc4OC[C@]3(C(=O)O)C2)c(F)c1 95382073 MTYZEVPNYYTKGD-DYESRHJHSA-N 387.407 2.906 0 50 GFAA Cc1ccccc1CN1CCC(CN(CC(=O)N(C)C)C[C@H]2CCCO2)CC1 95505973 BYYDOKFRKVMICN-JOCHJYFZSA-N 387.568 2.776 0 50 GFAA O=C(c1cn2cccnc2n1)N1C[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2 95512052 YVRLOFWIJWHDSS-VQTJNVASSA-N 389.503 2.899 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc3c(c2)CC(=O)N3)s1 96159824 CABPVKDIEBWBPL-AWEZNQCLSA-N 384.461 2.971 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)N1CCOC2(CCOCC2)C1 134759858 RBJNSYQTLUNYJE-AWEZNQCLSA-N 397.878 2.649 0 50 GFAA CCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1ccc(OC2CCCC2)cc1 157086596 ZSMUPTCGJRJPKW-QGZVFWFLSA-N 390.509 2.975 0 50 GFAA Cc1cccn2cc(COc3ccc(CN(C)[C@H]4CCS(=O)(=O)C4)cc3)nc12 157636049 HVJALELSZGDRKY-IBGZPJMESA-N 399.516 2.841 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCC[C@H]3CN)cc2)c(C)c1Br 237659872 HHDRUDUEDAKSQG-HNNXBMFYSA-N 377.286 2.815 0 50 GFAA CC(C)(C)C(=O)COC(=O)c1cccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)c1 239433973 YVPPPSSLWAFOTN-RPLLJCPNSA-N 383.444 2.994 0 50 GFAA O=C(O)CCC/C=C/C[C@@H]1[C@H](O)C[C@H](O)[C@@H]1/C=C/[C@H](O)COc1ccsc1 245204671 FYBFDIIAPRHIQS-BKFPYKODSA-N 396.505 2.603 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N[C@H]1C[C@@H](c2cc(O)nc(N)n2)C1 253535055 GIXNUZCATFHCAL-GASCZTMLSA-N 375.432 2.811 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(CO)[C@H]3CC[C@]21C 253595423 DDRIWSPLTXTFNE-KRQFHDJASA-N 378.509 2.577 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)Nc4ccc5c(c4)OCO5)c3CO2)cc1 263617794 PQXMKADWXHBNSV-SFHVURJKSA-N 394.387 2.539 0 50 GFAA CC(C)Oc1cccc(CC(=O)N(C)C2CCN(CCn3cccn3)CC2)c1 264543698 OZACUHHRFDERNM-UHFFFAOYSA-N 384.524 2.836 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OCc4ccccc4)cc3)C(=O)[C@H]2C1 278227466 YDVWABZWCCVOEK-VQIMIIECSA-N 394.427 2.986 0 50 GFAA O=C(O)CN(C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)C1CCOCC1 299750007 MJVTXIDMEZMDCM-KBPBESRZSA-N 387.354 2.781 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CCCN3Cc3ccccn3)cn2)n1 364827036 PKYYTSCKQBNJEY-IBGZPJMESA-N 376.464 2.882 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)CC1 375724808 NDWIUAMVJDHNHI-INIZCTEOSA-N 398.511 2.673 0 50 GFAA CCN(Cc1nccn1C)C(=O)c1ccc(-c2cc(OC)nc(OC)n2)cc1 426403540 PVWMQZZWILZZMY-UHFFFAOYSA-N 381.436 2.557 0 50 GFAA Cn1cncc1-c1ccc(C(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1 426512052 HHYLHJJJYBJBMB-UHFFFAOYSA-N 378.432 2.668 0 50 GFAA C[C@@H](C(=O)N(CCN1CCOCC1)Cc1ccco1)n1cnc2ccccc21 457033173 WYLNWTCBXFIHDO-KRWDZBQOSA-N 382.464 2.551 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2nncn2CCc2ccccc2)cc1 670454634 VPQBQWMBOVSPTR-UHFFFAOYSA-N 388.518 2.721 0 50 GFAA O=C(c1cc(Cl)c2c(c1)OCCO2)N1CCS(=O)(=O)C2(CCCCC2)C1 753712170 URBLFRSHZWUPMW-UHFFFAOYSA-N 399.896 2.685 0 50 GFAA O=C(c1ccnc(OCC(F)F)c1)N1CC[C@@H](c2ccccc2)S1(=O)=O 814085234 SXYQCJIMUOJLSL-AWEZNQCLSA-N 382.388 2.643 0 50 GFAA CC1([C@@H]2CCCN(C(=O)N[C@H](C[C@@H]3CCCO3)C(F)(F)F)C2)OCCO1 847244358 CCHZZQJMBSHQKD-HZSPNIEDSA-N 380.407 2.671 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@](CO)(C(C)C)C2)(c2ccccc2)CC1 848144348 RELREZIODQYGEY-QHCPKHFHSA-N 398.547 2.990 0 50 GFAA Cn1ncc2c1C[C@H](C(=O)Nc1ccc(-c3nncn3-c3ccccc3)cn1)CC2 886027713 JDHRVCMRBOWDJM-OAHLLOKOSA-N 399.458 2.806 0 50 GFAA O=C(NC1(CN2CCN(c3ccc(F)cc3)CC2)CC1)[C@H]1CCc2cccnc21 888100772 QWSWKEDUWXZDPC-FQEVSTJZSA-N 394.494 2.722 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)N1CCC(CNC(=O)c3ccoc3)CC1)C2 952964227 CDNHNBWAQRHFNH-SFHVURJKSA-N 398.459 2.508 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1529169363 XXEKINNUQQEUTJ-GCJKJVERSA-N 392.503 2.892 0 50 GFAA COc1ccc(C(=O)N[C@H]2COCC[C@@H]2Oc2ccc(C(=O)O)cc2)cc1C 1565527584 QQDZDUGOMZRNLN-HKUYNNGSSA-N 385.416 2.668 0 50 GFAA Cc1cnn(CCCN2C[C@@H]3CN(Cc4ccccc4)C[C@]3(CCC(=O)O)C2)c1 1772809440 WOQZTCQNVMQKFF-GGAORHGYSA-N 396.535 2.880 0 50 GFAA O=C(O)CC[C@@]12CN(CCOc3ccccc3)C[C@H]1CN(Cc1ccccn1)C2 1772819198 QGQQDHPCYXJGSP-CVDCTZTESA-N 395.503 2.759 0 50 GFAA Cn1c(=O)c(-c2nc(C3CCOCC3)nn2[C@H]2CCOC2)cc2ccccc21 1772819985 ZJKQOSRVVBSUST-INIZCTEOSA-N 380.448 2.652 0 50 GFAA O=C(O)[C@H]1CN(Cc2nccs2)CC12CCN(C(=O)CC1=CCCC1)CC2 1857685682 PJEYDDGOSNXRIN-MRXNPFEDSA-N 389.521 2.769 0 50 GFAA Cc1ccc2ncccc2c1-c1nccn1CCCN1CCC[C@@H](C(N)=O)C1 1857692930 AHROWSMNHSZMGP-QGZVFWFLSA-N 377.492 2.994 0 50 GFAA CCn1nc(C)cc1C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857719838 VPXHUYLUASQHPW-JENIJYKNSA-N 388.899 2.809 0 50 GFAA Cc1cc(CN2C[C@@H]3[C@H](CNC(=O)C4C(C)(C)C4(C)C)[C@H]4CC[C@]3(C2)O4)on1 1857729401 ZGWQCDZVIYOAQT-QNFHRHJVSA-N 387.524 2.761 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N[C@H](CO)c4ccccc4)CC3)nc2n1 1857734896 XKQUPQBIRPYENK-QGZVFWFLSA-N 380.448 2.597 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cccc(OCCCn4ccnc4)c3)C[C@@H]2O)on1 1875244610 VSOTZAFZDWHHIY-KNQAVFIVSA-N 396.491 2.684 0 50 GFAA NC(=O)CO[C@@H]1CCN(C(=O)c2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 1875263912 OKLNJXYERNAZLA-CYBMUJFWSA-N 382.338 2.682 0 50 GFAA CC(C)[C@H]1C[C@H](C(=O)NS(=O)(=O)c2ccccc2Br)CCO1 1875283732 CSBSTWUPGSJQAC-DGCLKSJQSA-N 390.299 2.705 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@@H](CO)Cc2ccccn2)nn1-c1ccccc1 1875284284 PGGJSJSPYHUEBS-GOSISDBHSA-N 378.476 2.799 0 50 GFAA O=C(O)C[C@H](COCc1ccccc1)NC(=O)C[C@@H]1COCc2ccccc21 1875293879 GMHVIMIGMPUEKP-RTBURBONSA-N 383.444 2.867 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccco1)N1CCN(C(=O)C2(c3cccc(F)c3)CC2)CC1 1875327040 WRJOVEUECXOVRN-QZTJIDSGSA-N 382.435 2.925 0 50 GFAA CN(Cc1cnc(-n2cccn2)s1)C(=O)[C@H]1CC(=O)N[C@@H](c2ccccc2)C1 1875396643 PRMLGNZTJCUKQP-NVXWUHKLSA-N 395.488 2.555 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cn(C2CC2)cn1 1875403355 UIPISFJKZDDDHV-QKYXUNIQSA-N 391.475 2.651 0 50 GFAA Cc1nc2c(C(=O)N3CCCN(C4Cc5ccccc5C4)CC3)ccnc2n1C 2100483164 WAUPOMYWLLGBIE-UHFFFAOYSA-N 389.503 2.592 0 50 GFAA Cc1nc[nH]c1CN1C[C@H](CC(=O)N(C)[C@@H](C)c2cccnc2)OCC12CCC2 2325785322 QCTWTKFKGKAHAT-HKUYNNGSSA-N 397.523 2.846 0 50 GFAA O=C([C@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC(N2CCCCC2)CC1 2325807674 LPLBOUDVDJPWRW-FQEVSTJZSA-N 394.523 2.764 0 50 GFAA Cc1[nH]nc2c1CC[C@H](NC(=O)N[C@H]1CN(Cc3ccccc3)C(C)(C)C1)C2 2325828447 HPZQGXBTEGBSDI-ZWKOTPCHSA-N 381.524 2.928 0 50 GFAA C[C@H]1CN(C(=O)c2cnoc2-c2ccoc2)C[C@H]1NC(=O)/C=C/c1ccoc1 2325872625 HAFZHOMRHXYWQD-OJHZYUNUSA-N 381.388 2.818 0 50 GFAA O=C(c1cocn1)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1[C@H]2Cc1ccccc1 2356138724 GHVUOLGEORCZLO-UMGGQSCQSA-N 379.460 2.759 0 50 GFAA CN(CC(=O)N1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1 780740 PEGNBFIKHFPRAW-UHFFFAOYSA-N 378.881 2.545 0 50 GFAA CS(=O)(=O)N(CC(=O)NCc1ccccc1)c1cccc(Br)c1 824130 VRORNFHWEGOWQU-UHFFFAOYSA-N 397.294 2.532 0 50 GFAA O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1)NCc1ccncc1 879856 LUPXOYLGVNOSHL-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA COc1ccccc1N(CC(=O)N1CCCC1)S(=O)(=O)c1ccc(C)cc1 916098 WSTSIKZAEZGZRZ-UHFFFAOYSA-N 388.489 2.821 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccco2)C(=O)NCc2ccco2)cc1OC 1142490 SIDYGPOOYGGCKA-LFIBNONCSA-N 396.399 2.977 0 50 GFAA CCn1c(SCC(=O)NCc2ccc(OC)cc2)nnc1-c1ccc(N)cc1 1143564 ZEKAJACUNHVYRJ-UHFFFAOYSA-N 397.504 2.964 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1nn(Cc2ccc(F)cc2)cc1Cl 2804750 GOEXEBDFBPKDLX-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA COCCNC(=O)[C@@H](CSCc1ccccc1)N1Cc2ccccc2C1=O 5190010 RENJTWZHTMPQRI-LJQANCHMSA-N 384.501 2.707 0 50 GFAA O=C(Cn1nnc(-c2ccc(OCc3ccccc3)cc2)n1)NC1CCCC1 10338298 JJRDYUDXFGZEHM-UHFFFAOYSA-N 377.448 2.978 0 50 GFAA Cc1nn(C)cc1CN1CCC2(CC[C@H](CNC(=O)c3ccccc3)O2)CC1 11815498 MYGIUHOJQFRKHH-HXUWFJFHSA-N 382.508 2.672 0 50 GFAA CC1=C(C(=O)N2CCC(CCC(=O)NCc3ccc(F)cc3)CC2)OCCO1 11842437 AFLYNBWCBVCZJO-UHFFFAOYSA-N 390.455 2.739 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)CCn2cncn2)C1 11844036 CZADSRCCXAJXRX-CQSZACIVSA-N 380.370 2.809 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1)[C@@H]1CCCO1 11966089 VLRDVESDIFMCFM-HKUYNNGSSA-N 376.472 2.635 0 50 GFAA CN(Cc1cnccn1)C(=O)[C@@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 12373206 YPDAHHLKNYWMPL-MRXNPFEDSA-N 386.883 2.570 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1cccc(-c2cccc(C)c2)c1 14963017 IQSZIDNKCAOXTG-FQEVSTJZSA-N 379.460 2.728 0 50 GFAA O=C1CCCN1CCC1CCN(C(=O)c2cn(CC3CCCCC3)nn2)CC1 15069635 MKQWJPQJWGPQJW-UHFFFAOYSA-N 387.528 2.723 0 50 GFAA C[C@H](NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1)c1nc[nH]n1 15073654 WRJXJCBPKVJQMN-KRWDZBQOSA-N 389.503 2.694 0 50 GFAA CCc1cc(C(=O)OC)c(NC(=O)CSc2nnc(C3CC3)n2C)s1 17077809 XZXKJTSDRRSNDL-UHFFFAOYSA-N 380.495 2.834 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@@H]2CCO)cc1 20362960 BBDLPJSUXWPYTQ-NRFANRHFSA-N 386.540 2.932 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3nsnc3c2)CCN1Cc1ccc(F)cc1 20543207 PTIUGRKZDFLXNX-GOSISDBHSA-N 386.496 2.899 0 50 GFAA OCC[C@H]1CN(Cc2cnc(N3CCCC3)s2)CCN1Cc1ccsc1 23373132 QIPKLXALSUPTHB-KRWDZBQOSA-N 392.594 2.874 0 50 GFAA COc1cc(OC)c(CN2CCN(C3CCCC3)[C@H](CCO)C2)c(OC)c1 39478411 MXRPTZMSHUGZCI-QGZVFWFLSA-N 378.513 2.524 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)NCc2ccon2)[C@H](c2ccc(Cl)cc2)N1C 55368555 LZSQLJUAEGVPDT-BXWFABGCSA-N 391.855 2.569 0 50 GFAA NCCc1nc(N2CCC[C@@H]2c2nc(-c3ccncc3)no2)c2ccccc2n1 65380858 KWWWYZVNNVACJX-QGZVFWFLSA-N 387.447 2.918 0 50 GFAA COC(=O)c1cc2n(n1)CCCN(C(=O)c1cc(C)nc3ccc(C)cc13)C2 67676900 QTFCHRVPZHMTQG-UHFFFAOYSA-N 378.432 2.881 0 50 GFAA CCCc1cncnc1N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71405646 FSBDTPFOIBVYJX-LJQANCHMSA-N 385.556 2.732 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(c3nccs3)CC2)C1 71735887 QTLGBRBGBZYBPK-KRWDZBQOSA-N 385.537 2.535 0 50 GFAA Cc1ccnn1CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 72167987 TZOHNRHQPANLFA-LJQANCHMSA-N 386.471 2.616 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)N1CCC[C@H](COc2cccc(F)c2)C1 91877075 HNRNWRZTKQFIGZ-INIZCTEOSA-N 395.434 2.853 0 50 GFAA CN(C)c1ccccc1C(=O)N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)O)C1 95361656 YHSZHSYPEJPRMI-KSFYIVLOSA-N 380.444 2.531 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2ccccc2C)CC1 96152181 JKTNYLOBOPIYDA-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA Cc1cc(CC(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)n[nH]1 124438228 BFSAPMJGUXLONV-UHFFFAOYSA-N 381.307 2.954 0 50 GFAA O=C(Cc1c[nH]c2ncccc12)NCC1CCN(C[C@@H](O)c2ccccc2)CC1 124820996 SPIPDFOPJGUFJA-OAQYLSRUSA-N 392.503 2.667 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(N2CCCC2=O)c1 134830691 SJUIMEALRAXQKA-HNNXBMFYSA-N 384.867 2.871 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 155414590 FKFILCBSCFLCND-VWNXMTODSA-N 390.483 2.660 0 50 GFAA O=C(c1cccc(F)c1)N1CCC(n2cc(-c3nc(C4CC4)no3)nn2)CC1 169777445 OLTLZSIXVZTIBQ-UHFFFAOYSA-N 382.399 2.822 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1 173348168 WZGRWVPKICOBTL-LPHOPBHVSA-N 379.460 2.629 0 50 GFAA Cc1cc2c(cc1C)O[C@H](C(=O)N1CCC(C(=O)NCc3cccnc3)CC1)C2 173462510 HBQFGDRXVFXIMB-NRFANRHFSA-N 393.487 2.557 0 50 GFAA CCN(C(=O)c1ccc(N2CCCC2)nn1)[C@@H]1CCN(Cc2ccccc2)C1 186324760 KGAYHHCNZRPTEB-LJQANCHMSA-N 379.508 2.813 0 50 GFAA Nc1nccc([C@H]2CCCN(C(=O)Nc3nc(-c4cccnc4)cs3)C2)n1 192945411 KZMRZJALABMULD-ZDUSSCGKSA-N 381.465 2.989 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H](c3cccnc3)N3CCCC3)n1)CCNC2 200508132 JCVQNLONYFOIRN-LJQANCHMSA-N 376.464 2.666 0 50 GFAA O=C(c1cnc2ccccc2c1)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210294835 ISHHZRXRBYYGSU-MJGOQNOKSA-N 376.412 2.954 0 50 GFAA CSc1ccc(CN2C[C@@H]3CN(Cc4cccnc4)C[C@]3(C(=O)O)C2)cc1 215271663 VVTROCJKQLYQMR-WIYYLYMNSA-N 383.517 2.822 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)NC1CC(N2CCCCC2)C1 225436847 ABHDRSYJQHRDQR-LADRWXRNSA-N 375.488 2.713 0 50 GFAA O=C(c1cn(C2CCNCC2)nn1)N1CCC[C@@H]1c1nc2ccccc2s1 237879474 RPGLRYHVJZBCHY-MRXNPFEDSA-N 382.493 2.790 0 50 GFAA Cc1cc(C)c2nc(C)cc(C(=O)N3C[C@H]4CCN(C)C[C@@]4(C(=O)O)C3)c2c1 248135922 OOLKOVVCCMUEIY-OPAMFIHVSA-N 381.476 2.639 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2[C@H](O)C[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254487958 FLMSQRUGSHIKCT-MPOGTKMKSA-N 390.520 2.575 0 50 GFAA COc1cc(C(=O)N2CCO[C@@H](C(=O)O)C2)cc(Cl)c1OCCC(C)C 262987874 NYVMYPKJCIRGLX-OAHLLOKOSA-N 385.844 2.699 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)[C@@H]1CCCN1c1ncnc2sccc12 264020079 RHIIWBQCGQSMBQ-AWEZNQCLSA-N 382.445 2.705 0 50 GFAA CCOc1ccc(-c2nc(C)c(C(=O)N3CCc4n[nH]c(=O)cc4C3)s2)cc1 274797074 NUDCKBSXSMSSHR-UHFFFAOYSA-N 396.472 2.799 0 50 GFAA CC(C)C(=O)N1CCn2nc(CNC(=O)C[C@H]3CCc4ccccc43)cc2C1 299769443 PNFXHLXXQIUEQO-QGZVFWFLSA-N 380.492 2.618 0 50 GFAA O=C(C1CCN(c2ncnc3[nH]ncc23)CC1)N(Cc1ccccc1)C1CC1 301327657 BXEDLHHCQXTXHB-UHFFFAOYSA-N 376.464 2.761 0 50 GFAA Cc1oc(C(=O)N2CCC[C@@H]2[C@H]2CCCc3ccccc32)cc1S(N)(=O)=O 370394717 LXDCLZBPJWYJRE-DLBZAZTESA-N 388.489 2.960 0 50 GFAA CC(C)(C)Oc1ccc(CNC(=O)NCc2ccnc(-n3ccnc3)c2)cn1 378489650 DCSPGQYBHISJQW-UHFFFAOYSA-N 380.452 2.839 0 50 GFAA O=C(Cc1noc2ccccc12)N1C[C@H]2CN(C3CCCCC3)C[C@@]2(C(=O)O)C1 426361866 APXJYKQGKYVPLQ-IVZQSRNASA-N 397.475 2.548 0 50 GFAA O=C(NCc1ccc(CN2CCCC2)cc1)N1CCN(Cc2ccco2)CC1 426395112 CCJMHRDHGCKAHZ-UHFFFAOYSA-N 382.508 2.903 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@@]12CCN(Cc1cc(O)nc(O)n1)C2 426526839 HDZJZBYPQQSPMJ-NRFANRHFSA-N 388.512 2.673 0 50 GFAA O=S(=O)(Nc1cnccc1-n1ccnn1)c1ccc(C(F)(F)F)s1 461116051 ZTSLVZKZJXVOPQ-UHFFFAOYSA-N 375.357 2.543 0 50 GFAA CCSc1ncc(CN2CC[C@]3(OC)CC[C@@H](NC(=O)CC)C[C@H]23)cn1 534657480 VLLCYXNLTZGJQY-JTDSTZFVSA-N 378.542 2.627 0 50 GFAA COc1ccccc1N1C[C@@H](NC(=O)N(C)C2Cc3ccccc3C2)CC1=O 584903663 GKCKSNWYCIVVJQ-KRWDZBQOSA-N 379.460 2.609 0 50 GFAA C=CC(=O)N1CCC(C(=O)NC[C@H](O)c2ccc(F)cc2)(c2ccccc2)CC1 847574212 JGVMMVFUVBNZRT-FQEVSTJZSA-N 396.462 2.722 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1 915817307 IFKJORDJJGUEHW-UHFFFAOYSA-N 381.457 2.788 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)Nc1cc(C)c2nc(N)sc2c1 952860580 QIGHTSJDYGUAQT-UHFFFAOYSA-N 381.465 2.813 0 50 GFAA Cc1ccnc(SCC(=O)Nc2ccc(NC(=O)CN3CCCCC3)cc2)n1 952872416 NYHAHHCYZKJVHB-UHFFFAOYSA-N 399.520 2.940 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC([C@@H](O)CCc3ccccc3)CC2)cn1 952974608 UQPHPEVTMDCKQD-FQEVSTJZSA-N 391.537 2.688 0 50 GFAA CN(C)CC(=O)Nc1cccc(NC(=O)[C@@H]2CCCN2Cc2ccccc2)c1 952976597 SANXCOXCSSCKQK-FQEVSTJZSA-N 380.492 2.790 0 50 GFAA CCc1c(NC(=O)N2C[C@@H](OC)C[C@@H]2c2nnc(C)o2)cnn1CC(C)C 1775959168 LPTMHWCFIVKGKC-XJKSGUPXSA-N 376.461 2.787 0 50 GFAA COc1ccc(O)c(-c2ccc3c(O)nc(=O)n(Cc4ccccc4)c3n2)c1 1857526283 SPGVWYYULPLAHQ-UHFFFAOYSA-N 375.384 2.927 0 50 GFAA O=C(NCC1(O)CCCC1)N[C@H]1CN(CC(F)(F)F)C[C@@H]1c1ccccc1 1857532315 HPTMWKWPIDAORC-CVEARBPZSA-N 385.430 2.621 0 50 GFAA Cc1cccc(CN2CCOC3(CCN(Cc4nccs4)CC3)CC2=O)n1 1857690198 WFCIRPWRHBZKIK-UHFFFAOYSA-N 386.521 2.630 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3nc4ccc(C)cn4c3F)C[C@H]12 1857695297 CYMWSBHHOWKKHK-JKQORVJESA-N 385.439 2.855 0 50 GFAA Cc1ccc2ncnc(N3CCC(C(=O)NCCc4ccccc4)CC3)c2n1 1857701863 SLGNGHYWDXXXHB-UHFFFAOYSA-N 375.476 2.909 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2csc3c2CCCC3)[C@H]1c1cnn(C)c1 1857716128 XTJIDLOFOMTRAJ-HKUYNNGSSA-N 388.537 2.504 0 50 GFAA CC(=O)Nc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)ccn1 1875268568 HFOKSXNRUCMLOQ-QWHCGFSZSA-N 376.457 2.510 0 50 GFAA Cn1ccc(CSc2cnn3c2CN(C(=O)OC(C)(C)C)CC3)cc1=O 1875292147 YKRRLTJBAKLKHQ-UHFFFAOYSA-N 376.482 2.625 0 50 GFAA COc1ccc2nc(Cl)ccc2c1S(=O)(=O)N1C[C@@H](CN)CC12CCC2 1875305957 NZXRVVSKUCECRT-GFCCVEGCSA-N 395.912 2.789 0 50 GFAA COCc1cc(NC(=O)c2cc(S(=O)(=O)NC(C)C)c[nH]2)ccc1Cl 1875361932 IOAYDMSVYYYVCN-UHFFFAOYSA-N 385.873 2.754 0 50 GFAA C=CC(=O)N(CC)CC(=O)N[C@@H](Cc1nccn1C(F)F)c1ccccc1 1875367205 NVVQRZKICRSJJQ-HNNXBMFYSA-N 376.407 2.713 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3ccccc3OCC3CC3)CC1)O2 1875394796 WZRLQKHRULGAKJ-KRWDZBQOSA-N 397.475 2.700 0 50 GFAA CC[C@@H]1CN(C)c2ccccc2CN1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 2325730293 NWXLJRXGVGFQNM-UXHICEINSA-N 395.503 2.529 0 50 GFAA CN(C(=O)C12CCCN1CCC2)C1CC(NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1 2325794118 QYONLYJFMAWHHH-FCCDEINASA-N 375.557 2.793 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)C[C@H]1O 2356142772 HEWKLVAWELJYFG-KNQAVFIVSA-N 394.475 2.834 0 50 GFAA C[C@H]1CN2C[C@@H](NC(=O)c3ccc(-c4nccc5ncccc45)cc3)C[C@H]2CO1 2356146594 MOWAXRFKURXBBM-SNRMKQJTSA-N 388.471 2.888 0 50 GFAA Cc1ccc(CN(C)C[C@@H]2[C@@H](c3ccccc3)[C@]23CN(CCO)C[C@@H]3O)s1 2356150983 LKXXNCPVIBUQHH-CIAFKFPVSA-N 386.561 2.557 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCC[C@@]3(CCc4c[nH]nc43)C2)cn1 2356156392 ZRGTVNAWIQNPSB-OAQYLSRUSA-N 377.448 2.724 0 50 GFAA CCc1nc2cc(C(=O)N[C@H]3CCC(=O)NC3=O)ccc2n1C1CCCCC1 1857797716 CYJDQUTWODMLCK-HNNXBMFYSA-N 382.464 2.639 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCCc3ccccc3)C2)cc1 791669 NVCDSFGOCFZFFO-IBGZPJMESA-N 386.517 2.755 0 50 GFAA Cc1ccc(C2(C(=O)NCc3cccnc3-n3ccnc3)CCOCC2)cc1 110622461 BLYMOIDKAOBRIJ-UHFFFAOYSA-N 376.460 2.940 0 50 GFAA CCc1ncc(CN[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cn1 59436851 MXCFLZNTTOJELZ-OAHLLOKOSA-N 378.398 2.949 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)N2CCC[C@@H](n3cncn3)C2)C[C@@H](C)O1 246754342 CITIFVOLDHOWJS-BRWVUGGUSA-N 384.484 2.761 0 50 GFAA C[C@@H](C(=O)NCc1cc(-c2ccccc2)[nH]n1)N(c1ccccc1)S(C)(=O)=O 55341835 LHFYPHVXHBBLFP-HNNXBMFYSA-N 398.488 2.548 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N2CCC[C@H](CN3CCCC3)C2)[nH]n1 20204515 UNOUQKWCPKZVCO-QGZVFWFLSA-N 384.528 2.726 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c1 67604381 JBGCCJVAEKDSKM-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)CC1 67601817 QNHIKUXPKGBWNP-INIZCTEOSA-N 380.554 2.921 0 50 GFAA CCO[C@H](C)c1noc(CN2CCCC[C@H]2c2ccc(C(=O)NC)n2C)n1 328623674 CBKPTMCBBFHTDV-HIFRSBDPSA-N 375.473 2.592 0 50 GFAA O=C(c1ccn2cncc2c1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328626931 MEZZIPAMKBKYLI-SFHVURJKSA-N 377.448 2.623 0 50 GFAA Cc1ccc([C@](O)(CC(=O)Nc2ccc(N3CCOCC3)cn2)C(F)(F)F)o1 123360705 OLPCJEFDKPRAPF-QGZVFWFLSA-N 399.369 2.598 0 50 GFAA O=C(Nc1ccc(-c2noc(=O)[nH]2)cc1)c1cccc(OCC(F)(F)F)n1 172396873 ZOLVEELJNJFWLA-UHFFFAOYSA-N 380.282 2.618 0 50 GFAA CCCN(CCC)C(=O)c1cccc(C(=O)N2CCO[C@H](c3nc(C)n[nH]3)C2)c1 173086710 KELPTJOEHPCHAN-SFHVURJKSA-N 399.495 2.589 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCN[C@@H](C)C3)cc2)c(C)c1Br 155210473 DWZIYYXIJYYEKV-NSHDSACASA-N 377.286 2.686 0 50 GFAA COc1c(NC(=O)N2CCOc3cc(O)ccc3C2)cc(Cl)cc1C(N)=O 376593164 QLAZDZDFEKBZAC-UHFFFAOYSA-N 391.811 2.580 0 50 GFAA Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CNCCCN1CCC(O)CC1 128594662 HTKDUOLHBUEULF-UHFFFAOYSA-N 394.922 2.969 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@@H]1COc2ccccc2C1=O 128975903 APATZDSLTDSSLN-LJQANCHMSA-N 375.428 2.792 0 50 GFAA COc1cccc(CN2CCCN(C3CCCC3)CC2)c1O[C@H](C)C(=O)O 77407454 ZKBIMVQFRXQGLI-MRXNPFEDSA-N 376.497 2.997 0 50 GFAA O=C(Cc1cccnc1)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 72156620 NEZXUCKTLOHOTD-KSEOMHKRSA-N 383.442 2.991 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](N(C)C(=O)C=C3C[C@@H]4CC[C@H](C3)N4C)C2)c1 241383548 MWDDBPCXWULRCR-OTWHNJEPSA-N 399.535 2.924 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCCn3nc([C@@H](O)C4CCC4)cc3C2)s1 219579196 XPEDFJBULUFPGE-KRWDZBQOSA-N 381.523 2.681 0 50 GFAA Cc1ccc2cc(CN3CCN(CC(N)=O)CC3)c(-c3cccs3)nc2c1 72410598 QGKWJNZTMGUPAI-UHFFFAOYSA-N 380.517 2.875 0 50 GFAA COc1cccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)c1 71775579 SORUCCAIKSHSGD-IBGZPJMESA-N 399.535 2.634 0 50 GFAA O=S(=O)(Nc1ncccn1)c1ccc(NC(=S)N2CCCCCC2)cc1 17080006 CLNPZJPRBZRSNI-UHFFFAOYSA-N 391.522 2.850 0 50 GFAA COC(=O)c1ncsc1S(=O)(=O)N[C@@H]1C[C@H]2CCCc3cccc1c32 161965383 RHPMRRLJDGHEIL-DGCLKSJQSA-N 378.475 2.773 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C(=O)N[C@@H]2CCc3ccccc32)CC1 426445655 QVUSENLIJSCDBV-HXUWFJFHSA-N 378.476 2.807 0 50 GFAA O=C(CN1CCN(Cc2ccc(F)cc2)CC1)Nc1cccc2nsnc12 22752131 HJRXGVAKFWIQPI-UHFFFAOYSA-N 385.468 2.587 0 50 GFAA CS(=O)(=O)N1CC[C@@H](C(=O)N[C@H]2C[C@H]3CC[C@H]2C3)Oc2ccc(Cl)cc21 245279144 FIHZKTAGBXEHIW-GWIFVGGISA-N 398.912 2.562 0 50 GFAA COc1ccc(-c2ccc(C(=O)NCCCc3csc(N)n3)c(O)n2)cc1 824689333 WBGARTIZYJIJDY-UHFFFAOYSA-N 384.461 2.864 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@H]1CCCN(Cc2cccs2)C1 827836861 NGKOIKVHXQYFKU-SFHVURJKSA-N 385.533 2.723 0 50 GFAA N=[S@@]1(=O)CCC[C@@]2(CCCN2C(=O)c2ccnn2CCC(F)(F)F)C1 1875395613 GWHLALSZTAOAJX-HWRSSNJWSA-N 378.420 2.651 0 50 GFAA O=C1N[C@H](Cc2c[nH]c3cccc(F)c23)C(=O)N[C@@H]1Cc1cc2ccccc2o1 1875320244 MLAUQOJSGGLQLU-QZTJIDSGSA-N 391.402 2.822 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnn(C2CC2)c1 1875403375 UYDMANISKZGNPI-CWFSZBLJSA-N 391.475 2.651 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(CNC(=O)c3ccsc3)CC2)C2(CCCC2)O1 952967217 ZJTDXOXMWSDEQN-INIZCTEOSA-N 390.505 2.592 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)[C@@H]1CCc2ccccc21 952981085 SKGPFBYJVFXCJS-HXUWFJFHSA-N 380.444 2.593 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OC(C)C)c(Cl)c3)C(=O)[C@@H]2C1 277948513 CJEMQBWHXRPTRT-FZMZJTMJSA-N 380.828 2.847 0 50 GFAA Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCC[C@H]4C(=O)NC[C@H]43)cc12 170609908 ARRRYDQWBYPUPZ-GDBMZVCRSA-N 380.473 2.746 0 50 GFAA Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)N2CCN(c3ncccn3)CC2)cc1 170645004 MEBINYKNDHTMPK-UXHICEINSA-N 395.507 2.785 0 50 GFAA Cc1ccc(-n2ncc(C(=O)OCC3(CS(C)(=O)=O)CCC3)c2C)cc1 753332281 WGYKDUPQHFXCQP-UHFFFAOYSA-N 376.478 2.861 0 50 GFAA C[C@H]1CN(CCN(C)C(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)C[C@@H](C)O1 194749207 FDOIZPAXYVTFFT-CALCHBBNSA-N 389.540 2.530 0 50 GFAA O=C(CCc1nc2ccc(F)cc2[nH]1)N1CCCN(C(=O)c2ccco2)CC1 1506399747 QDIVXLZOINTKIX-UHFFFAOYSA-N 384.411 2.602 0 50 GFAA Cn1ncc2c(N)nc(N3CC[C@@](O)(c4ccccc4)[C@H]4CCCC[C@H]43)nc21 1529099954 JKEDRJHGHURBKD-CSODHUTKSA-N 378.480 2.602 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@H]1CC(=O)Nc1ccnn1C1CCCC1 1529180069 IEROXNFAZYUMEA-LJQANCHMSA-N 395.507 2.636 0 50 GFAA CN1CCC(CCC(=O)N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)CC1 1704280233 XDAGNDHRVYAUBN-KNQAVFIVSA-N 381.520 2.719 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1ccccc1OC 717140 FJLZQXGWWVXSLG-UHFFFAOYSA-N 388.445 2.792 0 50 GFAA COC(=O)c1ccccc1NS(=O)(=O)c1ccc(N2CCCCC2=O)cc1 11906598 CDBQUWIIIIFBCR-UHFFFAOYSA-N 388.445 2.791 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@H](NC(=O)CN2CCCC2=O)C1 12572488 VAHVVFSOVJHJBE-QGZVFWFLSA-N 384.455 2.764 0 50 GFAA Cc1cc(CN2CCC(N3CCC(C(=O)NC4CC4)CC3)CC2)cc(C)c1O 12710666 XPMITFNIDVOPAI-UHFFFAOYSA-N 385.552 2.964 0 50 GFAA O=C(c1ccc(F)c(F)c1F)N1CCN(Cc2ccc3c(c2)OCO3)CC1 16649853 ABZIEBVZESOCLO-UHFFFAOYSA-N 378.350 2.791 0 50 GFAA Cc1ccc(N2C(=O)C[C@@H](NC3CCN(C(=O)C4CCCCC4)CC3)C2=O)cc1 19894202 YBSOAUNHQSBYCV-HXUWFJFHSA-N 397.519 2.788 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)c4ccc5ccccc5n4)nnc3c2)n1 169776253 FSNVCFITOCOFLI-UHFFFAOYSA-N 385.387 2.566 0 50 GFAA O=C1C[C@@H](C(=O)N2CCN(c3ccccc3)CC2)CN1CCc1ccc(F)cc1 6715826 ATOBNJNVCABOKI-LJQANCHMSA-N 395.478 2.566 0 50 GFAA CC(=O)Nc1ccc(NC(=O)[C@@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 2882331 JVQMJSIXZBPIAE-CQSZACIVSA-N 389.477 2.747 0 50 GFAA C[C@H]1CN(Cc2nc(-c3cccc(Cl)c3)cs2)CCN1S(C)(=O)=O 1857530585 AGJWUXVVEJVUCG-LBPRGKRZSA-N 385.942 2.929 0 50 GFAA O=C1CCCCCN1CCC(=O)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857677543 HGNLKUXVBRRIOR-MZKRTTBSSA-N 384.520 2.764 0 50 GFAA O=C1CC2(CCN(Cc3ccsc3)CC2)OCCN1CC[C@@H]1CCOC1 1857684361 KYAXWQVJSRBWIL-QGZVFWFLSA-N 378.538 2.758 0 50 GFAA O=C(O)c1cc2c(s1)C1(CCN(C(=O)CCc3ccncc3)CC1)OCC2 1857684649 WPBPFIZNWXOOGU-UHFFFAOYSA-N 386.473 2.865 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N[C@@H](C)c3cnn(C)c3)cc12 1857699615 WMQHCUBUMFOJDN-AWEZNQCLSA-N 388.537 2.856 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857708393 RFRMHQKEVATYGC-IBGZPJMESA-N 381.542 2.889 0 50 GFAA Cc1cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccncc4)[C@H]4CC[C@]3(C2)O4)oc1C 1857722478 JMYOILFKBSTYMU-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA COc1ccc([C@@H]2CCNC[C@@H]2NC(=O)N2CCOC3(CCCCC3)C2)cc1 333730371 VZNSLLARKNZYHZ-PMACEKPBSA-N 387.524 2.885 0 50 GFAA O=C(Nc1ccccc1N1CCCC1=O)c1cn(Cc2cccc(F)c2)nn1 164694750 XISRXQLTDTUIQI-UHFFFAOYSA-N 379.395 2.845 0 50 GFAA Cc1nc2ccccn2c(=O)c1CCNC(C)(C)c1nc2ccccc2n1C 809979347 UGNHFDJUHDZQDM-UHFFFAOYSA-N 375.476 2.957 0 50 GFAA O=S(=O)(c1sccc1Br)N1CCC([C@@H]2CCOC2)CC1 371711844 WNAFEBRCUJPOKB-LLVKDONJSA-N 380.329 2.948 0 50 GFAA Cn1nc(C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)c(=O)c2ccccc21 2325699518 LCZLZODOSPFWLS-HSZRJFAPSA-N 390.487 2.576 0 50 GFAA O=C(O)c1cnn(C[C@H]2C[C@@H](O)[C@H](NCc3ccc(Oc4ccccc4)o3)C2)c1 2325786182 MZIMOLKYPBSEIF-NIKGAXFTSA-N 397.431 2.896 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)[C@H]1CCCN1C1CCOCC1 245638857 XZTVJGAVVYZKNP-VQIMIIECSA-N 377.916 2.678 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C2)c2c(C)noc2n1 2356158585 PWZAOHZGAPCXLH-FOIQADDNSA-N 389.452 2.554 0 50 GFAA C[C@@H](Sc1nnc(-c2ccc3c(c2)OCO3)n1C)C(=O)Nc1nccs1 4736384 LYOXCLPPVXGUPP-SECBINFHSA-N 389.462 2.787 0 50 GFAA CNC(=O)c1ccn([C@H]2CCCN(Cc3nc(C(C)C)n4ccccc34)C2)n1 225423860 CJLQKDKKPMMJIZ-INIZCTEOSA-N 380.496 2.851 0 50 GFAA Cc1ccc(CS(=O)(=O)NC[C@H](c2cccs2)N2CCOCC2)cc1C 225832933 KOEGQJQCXABQQS-GOSISDBHSA-N 394.562 2.858 0 50 GFAA CC[C@@]12C[C@H]3C[C@@](O)(C1)C[C@@](C(=O)NCCC(=O)Nc1nccs1)(C3)C2 102794067 LVFADNXJBOMYEY-VUKOWNLVSA-N 377.510 2.699 0 50 GFAA CC[C@@H](C)C(=O)NCc1nnc2n1CCN(Cc1cccc3cccnc13)CC2 20997499 FDZUVOREPRJHPY-MRXNPFEDSA-N 392.507 2.547 0 50 GFAA O=C(c1ccc(N2CCCCCCC2)nc1)N1CCCN(c2ncccn2)CC1 20600361 QBGBMMQDQFPCHX-UHFFFAOYSA-N 394.523 2.995 0 50 GFAA CCC(=O)C(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2C)CC1 67726499 FCLULJVXZJUXEQ-UHFFFAOYSA-N 383.452 2.978 0 50 GFAA CC[C@@H]1CN(C(=O)Nc2ccc(N3CCCC3)nc2C)CCN1CCOC 122550139 OYANOKBWFJZOPI-QGZVFWFLSA-N 375.517 2.565 0 50 GFAA Cc1nn(C)cc1CN(C)C(=O)c1cc2cc(Br)ccc2oc1=O 2749631 WPKCWVUVTUVHAA-UHFFFAOYSA-N 390.237 2.870 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2cn3c(C)cc(C)nc3n2)n1C 328626713 FJFHHVJGAQKPLU-SFHVURJKSA-N 380.496 2.771 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCn3ccnc3C2)c(Cl)c1Cl 328637929 WCNXWELPYZHODA-SNVBAGLBSA-N 390.292 2.739 0 50 GFAA CCCCCN1CCN(C(=O)Nc2ccccc2C)[C@H]2CS(=O)(=O)C[C@H]21 72419975 AMLLMGAOLIRIEP-MSOLQXFVSA-N 379.526 2.500 0 50 GFAA CCOc1ccc(OCCNC(=O)CN2CCC[C@@H](c3ccncc3)C2)cc1 253428954 MAHVOMTWHQYJGY-LJQANCHMSA-N 383.492 2.855 0 50 GFAA CCCCCNC(=O)C[C@@H]1COCCN1C(=O)c1c[nH]nc1C1CCCCC1 72421188 IKYOIQUOGGHWPC-QGZVFWFLSA-N 390.528 2.995 0 50 GFAA O=C(Nc1nnc(-c2ccccn2)s1)[C@@H]1CCCCN1C(=O)c1cccnc1 172833635 ZWSKEUQDQFRZKL-HNNXBMFYSA-N 394.460 2.629 0 50 GFAA O=C(NCc1nnc(C2CC2)n1C1CC1)[C@H]1CCCCN1C(=O)c1ccccc1 363835969 OQSPQFIEMYDZGR-GOSISDBHSA-N 393.491 2.802 0 50 GFAA O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cc2c(s1)CCOC2 155058051 WLHQWOJBQAZNKW-KRWDZBQOSA-N 384.501 2.784 0 50 GFAA CCC[C@@H](C(=O)N1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1)n1cccc1 71765291 BDUHOPDNINBXMC-SFHVURJKSA-N 377.448 2.560 0 50 GFAA O=C1CC[C@]2(C(=O)N3CCC(O)(C(F)(F)F)CC3)Sc3ccccc3N12 157264159 PDXRNMHHLFMCQS-MRXNPFEDSA-N 386.395 2.531 0 50 GFAA C[C@@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C[C@H]1C(=O)O 263030345 RWBHCNVTBCDYMT-VCTAVGKDSA-N 399.274 2.777 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3cccnc3O)C2)cc1OC 72147072 PVVMTZQWKBEZRW-KRWDZBQOSA-N 399.491 2.584 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](C)C[C@H](C(=O)O)C2)c1NC(=O)c1ccncc1 263398177 ZQKNDBZILDACMC-BBRMVZONSA-N 381.432 2.825 0 50 GFAA COc1ccc(CN2CC[C@]3(CC(=O)NC3=O)C2)cc1OCc1ccccc1 82115359 XWKDAIPPZLROSM-QFIPXVFZSA-N 380.444 2.513 0 50 GFAA Cc1nc(CNC(=O)N2CCC(O)(c3ccccc3)CC2)nc2c1CCCC2 426657012 TYDCMPLXCZKLHZ-UHFFFAOYSA-N 380.492 2.857 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3c[nH]nc3-c3ccc(F)cc3)C2)n[nH]1 426369410 UNJROKUVBNWKAE-CQSZACIVSA-N 383.431 2.732 0 50 GFAA Cn1ccnc1SCCNC(=O)N1CCC(Oc2ccccc2F)CC1 426545127 UGHMNGAGQOLTKR-UHFFFAOYSA-N 378.473 2.904 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]3(CCCN(CC4CC4)C3=O)C2)c2c(C)noc2n1 91461030 CDIDYKVZHYTQNQ-NRFANRHFSA-N 382.464 2.704 0 50 GFAA CC[C@@H]1CCc2c(sc(NC(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)c2C(N)=O)C1 239164859 NAYFKERATFMCGJ-YRRINSJYSA-N 388.489 2.823 0 50 GFAA Cc1nc(-c2cc3c(s2)CCN(C(=O)[C@H]2CCN(C)C(=O)C2)C3)cs1 180269268 XRSMJMLBXXIRTA-LBPRGKRZSA-N 375.519 2.933 0 50 GFAA CN1C[C@@H](C(=O)N2CCC(c3nccn3CC3CC3)CC2)Oc2ccccc21 95530747 AMUJOKVRJWIWKG-FQEVSTJZSA-N 380.492 2.897 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95531310 NCINDXACOKXXFL-KRWDZBQOSA-N 386.459 2.994 0 50 GFAA Cc1ccc(N2CCOC2=O)cc1NC(=O)N1CCCN(CC(F)F)CC1 162848421 ZSZQQVBYYCSLIP-UHFFFAOYSA-N 382.411 2.756 0 50 GFAA COc1ccc2c(c1)OC[C@]1(C(=O)O)CN(Cc3cncn3CC(C)C)C[C@H]21 95520069 PBHUPJHDUOCWDT-WIYYLYMNSA-N 385.464 2.611 0 50 GFAA Cc1ccc(CCNC(=O)[C@H]2CNC[C@@H](C(=O)Nc3ccc(C)cc3)C2)cc1 92078285 RRLUHEKMDDZQQJ-UXHICEINSA-N 379.504 2.827 0 50 GFAA COc1ccnc(N2CCC3(CC2)CC(=O)N(Cc2ccc(F)c(F)c2)C3)n1 91562800 KPQPDASFADJYGJ-UHFFFAOYSA-N 388.418 2.783 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H](C3=CC(=O)OC3)[C@H](O)C[C@]12O 242620154 PVAMXWLZJKTXFW-ZPMFUVBBSA-N 390.520 2.575 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1nc(-c2cccs2)no1 299750507 NPRUJWGNLPAVCD-XQQFMLRXSA-N 375.450 2.975 0 50 GFAA COC(=O)[C@@]1(CF)CCN(C(=O)c2ccn(-c3ccccc3C(F)(F)F)n2)C1 1875297141 DOUCYECHAURSSB-QGZVFWFLSA-N 399.344 2.866 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCC([C@@H](CN)c2ccccc2)CC1)c1ccccc1 1875302003 WLXMOKHLTSWJGP-FCHUYYIVSA-N 379.504 2.845 0 50 GFAA C[C@H](CN(C)C(=O)Cc1ccccc1OCc1ccccc1)N1CCOCC1 952968636 CWRXGIBRDATBEY-LJQANCHMSA-N 382.504 2.987 0 50 GFAA COc1cc(C)cnc1C(=O)N[C@@H]1CC[C@H](CNC(=O)c2coc(C3CC3)n2)C1 1875333624 FAGURRYVMPXENA-DZGCQCFKSA-N 398.463 2.593 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2cc(Br)c3cn[nH]c3c2)C1 1875380731 XWMJSCFORBFVCY-JTQLQIEISA-N 377.242 2.689 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)CSc3nnc(C)s3)C[C@@H]2N(C)C)cc1 1565509270 NTLIKIAXFNYWIM-CVEARBPZSA-N 376.551 2.803 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCCN(c3cccnn3)CC2)ncn1 275700891 NMUVZWAVWGEZBA-UTKZUKDTSA-N 397.527 2.599 0 50 GFAA NC(=O)[C@H]1CCCN1Cc1cccc(NS(=O)(=O)c2cccc(Cl)c2)c1 170609142 IUFMMTXTYBRQHO-QGZVFWFLSA-N 393.896 2.591 0 50 GFAA O=C(Nc1ccc(-n2cccn2)nc1)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 279982752 JUAMULKTMSOQIL-KDURUIRLSA-N 388.475 2.863 0 50 GFAA O=C1[C@@H](N2CCN(c3cccnn3)CC2)CCN1c1ccc(Cl)cc1Cl 190499687 HWRBUXQAXPWBIG-INIZCTEOSA-N 392.290 2.711 0 50 GFAA O=C(c1nc(-c2ccccc2)n2c1CCCCC2)N1CCN2C(=O)OCC[C@H]2C1 764261362 YZVURYKNJNMOSF-KRWDZBQOSA-N 394.475 2.943 0 50 GFAA CC(=O)N1CCc2c(NS(=O)(=O)c3ccc(C(=O)O)cc3Cl)cccc21 768901009 PZZMVNMYZLRVSX-UHFFFAOYSA-N 394.836 2.748 0 50 GFAA CCn1nc(CO)c2c1CCN(C1CCN(c3ccc(F)c(F)c3)CC1)C2 1506395005 AFUONNBNVRGSHM-UHFFFAOYSA-N 376.451 2.701 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC[C@@H]1CCOC1 1704311912 WPEYPBHBMTWEQQ-LBPRGKRZSA-N 379.844 2.820 0 50 GFAA COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc(Br)cn2)c1 1183245 DGYMGHMXXWVYFN-UHFFFAOYSA-N 396.266 2.988 0 50 GFAA COCCSc1nnc(CCNC(=O)C2(c3ccc(Cl)cc3)CC2)n1C 12040840 HQUPPSUWHPBMMR-UHFFFAOYSA-N 394.928 2.598 0 50 GFAA O=C(Nc1nnc([C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)s1)[C@H]1CCCO1 12862862 OBYZZRVZLAMFDR-ZWNOBZJWSA-N 392.868 2.830 0 50 GFAA CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](NCCOC(C)C)C2 14754364 KQSLRVZEULYSHE-QGZVFWFLSA-N 376.545 2.791 0 50 GFAA CCCC[C@H]1CN(CCNC(=O)[C@@H]2CCCN2C(C)=O)Cc2ccccc2O1 14882904 FVXYPRCPHVCUBD-PMACEKPBSA-N 387.524 2.567 0 50 GFAA COCCCNC(=O)c1sc2ncnc(NCCN3CCCCC3)c2c1C 14975931 QSBMGXJWRQEFDA-UHFFFAOYSA-N 391.541 2.664 0 50 GFAA C[C@@H](CCN1CCC(n2cc(C(=O)N3CCOCC3)nn2)CC1)c1ccccc1 14994847 BODZKKMCGPBGMS-SFHVURJKSA-N 397.523 2.581 0 50 GFAA O=C(c1ccccc1NS(=O)(=O)Cc1cccc(Cl)c1)N1CCOCC1 16577037 HBJNUBNXSUVNLI-UHFFFAOYSA-N 394.880 2.754 0 50 GFAA O=C1O[C@@H]2CN(Cc3cccn3-c3nccs3)C[C@@H]2N1CCc1ccccn1 19772794 YZSALOVLBDOYIA-ZWKOTPCHSA-N 395.488 2.577 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2cccc(Br)c2)NC(=O)N1 4201976 AWIYWWFBNRXJEF-DZGCQCFKSA-N 395.253 2.799 0 50 GFAA COc1cccc(NC(=O)CN(Cc2ccc(Cl)cc2)S(C)(=O)=O)c1 2877162 WCIIYLWAAKNRGJ-UHFFFAOYSA-N 382.869 2.749 0 50 GFAA O=C(O)c1n[nH]c2ccc(C(=O)N(CCCO)Cc3cccc(Cl)c3)cc12 1857531080 AXDVKLSLSOGEQC-UHFFFAOYSA-N 387.823 2.939 0 50 GFAA Cc1c(CN2CCC3(CC2)OCCc2cc(O[C@H]4CCOC4)ccc23)cnn1C 1857670077 OOKVMDRQPLJCFI-NRFANRHFSA-N 397.519 2.960 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)Cc3ccc4nc(C)[nH]c4c3)C[C@H]12 1857670772 BPRMHMHJMXRTRV-GDEPLPEGSA-N 381.476 2.874 0 50 GFAA CN(CC(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1)Cc1ccncc1 1857677475 DDNHUUSZURCKLD-UHFFFAOYSA-N 389.503 2.541 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccnc3)C[C@]23CC[C@H]1O3)c1ccc(F)cc1 1857715252 IYOKGNZOXCXSII-GPQLQYNLSA-N 381.451 2.630 0 50 GFAA COc1ncccc1CCNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857732478 RYPWKSPPFNHHAY-HNNXBMFYSA-N 395.463 2.592 0 50 GFAA Cn1nc(C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cc1C1CC1 1875251512 QJUJQIKERPFZOV-UHFFFAOYSA-N 375.476 2.939 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCNC1)c1ccc(Cl)cc1 120250147 GFMDGIKOIQJFSD-OALUTQOASA-N 385.895 2.549 0 50 GFAA C[C@@H](CN(C)C(=O)C1(c2cccc(Br)c2)CCOCC1)C(=O)O 237371166 RPAGVJGAPXEVBT-LBPRGKRZSA-N 384.270 2.676 0 50 GFAA C[C@@H](NS(=O)(=O)c1ccc(OCc2ccccc2)cc1)c1nnnn1C1CC1 242302123 YPQQYHXJFQCAMD-CQSZACIVSA-N 399.476 2.627 0 50 GFAA CC(C)NC(=O)c1cn(CC[C@@H]2CCCCN2C(=O)c2ccccc2F)nn1 14964740 OSFRIDIMBARPTF-HNNXBMFYSA-N 387.459 2.640 0 50 GFAA CC(C)N1CCN(C2CCN(C(=O)c3cccc4c3OCC4(C)C)CC2)CC1 363766891 POATYIVTJGXRIO-UHFFFAOYSA-N 385.552 2.987 0 50 GFAA CCOCCOc1ccccc1C(=O)N1CCC2(CC1)C[C@](C)(O)CCO2 1704299421 PFTXWNHCAUUEBD-HXUWFJFHSA-N 377.481 2.638 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1CCc2c(cccc2C(=O)O)C1 856968569 NUPOXVDPMQMFKU-NRFANRHFSA-N 392.455 2.806 0 50 GFAA O[C@@H]1CN(Cc2ncc[nH]2)C[C@]12[C@H](c1ccccc1)[C@H]2CN1C[C@H]2CCC[C@H]2C1 2356168148 RLCYXXHHRXANIS-SUXPABQQSA-N 392.547 2.718 0 50 GFAA CC[C@H](C(=O)OC)N(C)CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1 225339227 FBZACFGNGIVXDE-HUUCEWRRSA-N 389.477 2.902 0 50 GFAA CCSCCCNC(=O)CCNC(=O)c1cc(F)ccc1Br 225709081 NVNKPMHFVUDTNA-UHFFFAOYSA-N 391.306 2.968 0 50 GFAA CC[C@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)n1cnc2ccccc2c1=O 9422324 LHIXGWFCQBZJMZ-HXUWFJFHSA-N 394.450 2.836 0 50 GFAA CCCCn1c(CN2CCN(C)CC2)cnc1S(=O)(=O)CCCC(C)C 22913938 RXJGAXZVLWOKII-UHFFFAOYSA-N 384.590 2.641 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2ccc3c(c2)CCC(=O)N3)CC1 138727056 ZQJPMWNWCZHJGK-UHFFFAOYSA-N 379.460 2.979 0 50 GFAA O=C(COc1cccnc1)N1CCCn2nc(-c3nc4ccccc4[nH]3)cc2C1 67741348 CDDSCWDHCXCFOC-UHFFFAOYSA-N 388.431 2.633 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)Nc2ccc(Br)c(Cl)c2)CC1 65363501 MGVLOXXMKORPLW-UHFFFAOYSA-N 395.706 2.713 0 50 GFAA CCC1(CC)NC(=O)N(CC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1=O 121348308 XJAXPDRXASAEMK-GOSISDBHSA-N 398.438 2.537 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cn(CC)nc3C)C[C@H]2CCO)cc1 36385813 IVWUYTVSAJWEBD-OAQYLSRUSA-N 386.540 2.679 0 50 GFAA COc1cc(C2(C(=O)N3CCC[C@@H](N4CCNC4=O)C3)CCCC2)ccc1C 363034536 SVPHUEOLXTXWAS-GOSISDBHSA-N 385.508 2.832 0 50 GFAA O=C(Cc1c[nH]c2ccccc12)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O 72130853 CWDMSRQDLGJGPN-YADHBBJMSA-N 375.472 2.564 0 50 GFAA NCCN(CCc1ccccc1)C(=O)c1cc(N2CCNC2=O)ccc1Cl 261673341 GSHHAWAHLBTEDT-UHFFFAOYSA-N 386.883 2.513 0 50 GFAA CS(=O)(=O)N1CC[C@@H](C(=O)N2CCCc3ccccc32)Oc2ccccc21 30946846 PTKJHXNPLOJROL-IBGZPJMESA-N 386.473 2.583 0 50 GFAA COc1cccc(-c2cn([C@@H]3c4ccccc4C4(CCNCC4)[C@H]3O)nn2)c1 72138938 KRLSHDOFAIHQFA-RTWAWAEBSA-N 376.460 2.539 0 50 GFAA CN(Cc1ccsc1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71750214 FGBOLBIWSQMIQV-SFHVURJKSA-N 389.565 2.820 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N1CCC[C@H]1c1nc(-c2ccccn2)no1 77406249 VPJZNZOVKNBPLP-HNNXBMFYSA-N 378.388 2.767 0 50 GFAA NC(=O)CC[C@H]1CCCN(c2nnnn2-c2ccc(-c3ccccc3)cc2)C1 77355684 HEWQOUACSDSFIK-MRXNPFEDSA-N 376.464 2.811 0 50 GFAA C[C@H](OC(=O)CCn1cnc2ccccc2c1=O)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C 241810008 SCKSQEPVVFHCLJ-XLMAVXFVSA-N 399.491 2.659 0 50 GFAA COc1ccc(CNC(=O)Cn2nc(-c3ccc(SC)cc3)ccc2=O)cc1 49546138 CPAWXZZVCYIQBI-UHFFFAOYSA-N 395.484 2.957 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)CC1 44742928 OTBTTWMURGGFPM-UHFFFAOYSA-N 378.498 2.630 0 50 GFAA COC[C@@H](NC(=O)c1ccc2nc(-c3ccccc3)cn2c1)c1ccnn1C 82093020 WMONHYCDNRIYEO-GOSISDBHSA-N 375.432 2.852 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)c3ccc(N4CCCC4)cc3)CC2)cc1 41246288 RJEGTUHKIANUCT-UHFFFAOYSA-N 393.487 2.894 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)nc(C)n1 95507572 UVHRBTTXGGVJFJ-HNNXBMFYSA-N 382.493 2.815 0 50 GFAA O=C([C@H]1COc2ccccc2C1)N(CCCn1ccnc1)Cc1ccncc1 95529126 PPQJJEIYTVPATO-HXUWFJFHSA-N 376.460 2.948 0 50 GFAA COc1ncccc1C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 95525849 KZTKBQRNNREUCP-UHFFFAOYSA-N 377.448 2.750 0 50 GFAA O=C(NCC1(CO)CCOCC1)c1cc(-c2ccncc2)nc2ccccc12 95383668 IZCOGFSXUATVKZ-UHFFFAOYSA-N 377.444 2.816 0 50 GFAA Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccco3)C2)cc1N1CCNC1=O 96133445 KGPAZGDHSKMUFW-KRWDZBQOSA-N 396.491 2.760 0 50 GFAA Cc1cccnc1C[C@H](C)N(C)C(=O)Nc1cccc(N2C(=O)CNC2=O)c1 95524817 BHSVYUHKTFNLRR-AWEZNQCLSA-N 381.436 2.541 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(C(=O)CCc2nc(-c3cccnc3)no2)C1 95508239 CBMMGIBEDWVUEH-MRXNPFEDSA-N 380.452 2.687 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2CCOC2)cc1OC1CCN(C(C)C)CC1 95509442 WXSIDBKTBWNGBI-INIZCTEOSA-N 376.497 2.713 0 50 GFAA CC1(C)CN(C(=O)NCc2ncc(C(F)(F)F)cn2)C[C@@H](C(F)(F)F)O1 297579709 QYLWSYDQCCZDLC-VIFPVBQESA-N 386.296 2.747 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NCc1cn2ccsc2n1 298335076 YCDTWBAVTPUEJB-MRXNPFEDSA-N 398.488 2.716 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1cccs1 299749513 KNWVDFPHPKBNAC-GFCCVEGCSA-N 393.852 2.877 0 50 GFAA Cc1nnc(Cc2ccc(NC(=O)N3CCC[C@@H](Cn4ccnc4)C3)cc2)[nH]1 299787087 VFNYMCVDNYWWJS-KRWDZBQOSA-N 379.468 2.845 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCCC2)C1 298756497 NUWJMPCXEICKFI-KRWDZBQOSA-N 378.538 2.965 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@H]2Cc3cc(Cl)ccc3O2)c(F)c1 1875386466 RAXUJWPRFDUECP-GOSISDBHSA-N 388.826 2.901 0 50 GFAA O=c1cc(CN2C[C@@H]3COC[C@]3(c3ccccc3)C2)nc2[nH]c3ccccc3n12 1875392135 FAWJGIVZVIKWLI-HXOBKFHXSA-N 386.455 2.576 0 50 GFAA NC(=O)CO[C@H]1CCN(C(=O)N[C@H](CCc2ccc(F)cc2)c2ccccc2)C1 1875304274 FVTJZRZZDCPQQM-VQTJNVASSA-N 399.466 2.785 0 50 GFAA C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Cn2cc(-c3cncc(C(=O)O)c3)nn2)C1 1875355203 CVSNJJKGJMYVEI-LIRRHRJNSA-N 391.431 2.648 0 50 GFAA COCCc1noc([C@@H]2CCCCN2Cc2cc3c(cc2OC)OCCO3)n1 952986009 VZIMCBPNGQBUBG-HNNXBMFYSA-N 389.452 2.766 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)C2CCOCC2)C1)c1ccc2ccccc2n1 952979701 IFJNLTRPLQLCBA-MRXNPFEDSA-N 381.476 2.630 0 50 GFAA CC[C@H]1CN(S(=O)(=O)c2cc(-n3cccn3)ccc2C)CCN1C(C)C 952984845 BZTGZWRWYGJJFN-KRWDZBQOSA-N 376.526 2.674 0 50 GFAA Cc1cc(C)c2nccc(N3CC[C@H](NC(=O)c4ccccn4)[C@@H](O)C3)c2c1 1565514279 JSWQOBBPBWBVPN-PXNSSMCTSA-N 376.460 2.616 0 50 GFAA CCS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](c3noc(C4CC4)n3)C2)c1 270739727 UMXFMOFBHAUGST-OAHLLOKOSA-N 389.477 2.760 0 50 GFAA Cn1c(C(F)F)nc2cc(C(=O)N3CCCN(c4cccnn4)CC3)ccc21 409660500 SCDOVUKQACQGMM-UHFFFAOYSA-N 386.406 2.653 0 50 GFAA CC[C@@H](C(=O)N1CCC(NC(=O)Cc2c(C)n[nH]c2C)CC1)c1ccccc1 187054005 QEUQYETTWXHLIW-LJQANCHMSA-N 382.508 2.870 0 50 GFAA C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)Cc1ccc(S(C)(=O)=O)cc1 1506430410 ZEOFIMTXJSNTKJ-CQSZACIVSA-N 389.473 2.623 0 50 GFAA CN(C)CCOc1ccc(-c2nccn2-c2ccc3c(c2)C(=O)NCC3)cc1 1772813555 HFCJPYNVRWEPOO-UHFFFAOYSA-N 376.460 2.766 0 50 GFAA CCCCn1c(-n2ncnc2[C@H]2CCCN(C(=O)CO)CC2)nc2ccccc21 1772814636 KVPCBASNKDKKBE-INIZCTEOSA-N 396.495 2.506 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)CCCN3CCCC3=O)C2)cc1OC 11938013 UAZKXYYSVUJLKV-KRWDZBQOSA-N 389.496 2.509 0 50 GFAA CCCN1CCC(NC(=O)c2cn(Cc3ccc(F)cc3Cl)nn2)CC1 12021091 IMTIPYATBRCQGJ-UHFFFAOYSA-N 379.867 2.723 0 50 GFAA O=C(c1ccc2c3c(cccc13)CC2)[C@H]1CCCN(C(=O)CN2CCCC2=O)C1 12025334 LHJPCWSIVKLFCD-SFHVURJKSA-N 390.483 2.982 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)CCn2cnnn2)cc1 12301724 CRDRZYQCPVSPSI-SFHVURJKSA-N 393.495 2.740 0 50 GFAA CC(C)(C)CN1CCN(c2cccc3c2C(=O)N(C[C@@H]2CCCO2)C3=O)CC1 12338128 LQHBTSLPHIFPFR-INIZCTEOSA-N 385.508 2.630 0 50 GFAA CN(Cc1cnccn1)C(=O)[C@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 12373207 YPDAHHLKNYWMPL-INIZCTEOSA-N 386.883 2.570 0 50 GFAA CC(C)CN1C[C@@H](OCc2cccc(F)c2)CN(C(=O)c2ccncc2)CC1=O 14534958 KTWYRWPTSUTRBY-HXUWFJFHSA-N 399.466 2.747 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(Cc3nnc(-c4ccccc4)o3)CCN12 1857693895 RCRZYTSQUPBIND-JOCHJYFZSA-N 390.443 2.986 0 50 GFAA CO[C@H]1C[C@@H](C(=O)NCCc2nc3ccccc3[nH]2)CC[C@@H]1NC1CCCC1 1857695083 SSTHAZABZKIWRA-YSSFQJQWSA-N 384.524 2.938 0 50 GFAA Fc1cccc(-c2nnc(CN3[C@H]4CC[C@@H]3[C@@H]3CN(C[C@H]5CCOC5)C[C@@H]34)o2)c1 1857702041 XKXWWOWAZYMDKY-QSWMPLQWSA-N 398.482 2.807 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NC1CCNCC1 1857738237 YFIWLOAHZUTADV-CYBMUJFWSA-N 376.888 2.956 0 50 GFAA C[C@H]1CN(C(=O)C2CCN(c3ccc(Cl)cn3)CC2)C[C@]2(CCCOC2)O1 225470535 DLFRIYQHIZEOFU-YWZLYKJASA-N 393.915 2.748 0 50 GFAA Cc1[nH]c(-c2ccccc2)nc1C(=O)N1C[C@H](C(=O)O)[C@@H](c2ccccn2)C1 248068243 XSGAYKFDHWRNFV-HOTGVXAUSA-N 376.416 2.721 0 50 GFAA O=C(c1cc(Br)cnc1OCC1CC1)N1CC([C@H]2CCOC2)C1 376091075 IJUROHWXEISGGE-LBPRGKRZSA-N 381.270 2.741 0 50 GFAA COc1ccc(N2C(=O)C[C@H](N3CCN(c4ccc(Cl)cc4)CC3)C2=O)cc1 821680 VRAPZTFJWHSKHS-IBGZPJMESA-N 399.878 2.803 0 50 GFAA COc1cc(CN2C[C@@H](CC(=O)NC3(C)CC3)OCC23CCC3)cc2nc[nH]c12 2325785317 PODDPYMMEWSXNT-MRXNPFEDSA-N 398.507 2.754 0 50 GFAA CN(CCc1ccc(Br)cc1)C(=O)c1cnn2ccc(CN)cc12 2325855897 SXJVCWUXWGCHTQ-UHFFFAOYSA-N 387.281 2.870 0 50 GFAA COC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(OC)c2)cc(C(=O)OC)c1 1160230 RKYQSVJMVZESFQ-SOFGYWHQSA-N 399.399 2.929 0 50 GFAA O=C(O)c1cncc(C(=O)N2CC[C@]3(CCCN(Cc4ccccc4)C3)C2)c1 911362559 NEQPAYRIEKERMW-QFIPXVFZSA-N 379.460 2.908 0 50 GFAA O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 794196 WKLJTSBXAWSUKP-SJORKVTESA-N 394.493 2.691 0 50 GFAA c1ccc(-n2nc(C3CCOCC3)nc2[C@@H]2CCCN(C3CCOCC3)C2)nc1 2356145418 AZOHGDLCBQOKNQ-GOSISDBHSA-N 397.523 2.915 0 50 GFAA COc1cc(F)c(CN2CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C2)cc1OC 2356147341 SCRXDSNPHZAGDG-UYAOXDASSA-N 383.460 2.917 0 50 GFAA CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSc1nc(C)cc(C)n1 6530887 MXUQGHVBDMUJLL-UHFFFAOYSA-N 392.481 2.708 0 50 GFAA CCCN(CC(=O)NCCc1nc2ccccc2s1)[C@H](C)C(=O)OCC 225672227 QOIQBAFAFUSCKS-CQSZACIVSA-N 377.510 2.619 0 50 GFAA COc1ccc(CN2CCN(Cc3nc4ccccc4[nH]3)C[C@H]2CCO)c(F)c1 104461625 KKOPHZJLGWKCJF-QGZVFWFLSA-N 398.482 2.779 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4ccnc4C)ncn3)CC2)cc1C 67604641 LKFHEOGBCPKKSX-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA NC(=O)CCn1cc(CN2CCCC[C@H]2CCN2CCCC2=O)c2ccccc21 55119380 AMCJYPXLBJRHPD-IBGZPJMESA-N 396.535 2.884 0 50 GFAA Cn1cnc2c(-c3nc(-c4cccc(NC(=O)NC5CC5)c4)no3)ccnc21 350009774 DTQLTCVYYWPTLV-UHFFFAOYSA-N 375.392 2.969 0 50 GFAA Cc1cc(C)n([C@@H](C)C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)n1 139396023 RKJNXOWFAJQLPM-SFHVURJKSA-N 382.508 2.801 0 50 GFAA CCN(Cc1ccccc1)S(=O)(=O)c1ccc(Cc2cc(C)n[nH]c2=O)cc1 33026612 KNHNCACKEKEJQV-UHFFFAOYSA-N 397.500 2.880 0 50 GFAA C[C@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1=O 120205911 YIIDEKKXECQWBS-RHSMWYFYSA-N 399.878 2.640 0 50 GFAA Nc1c(C(=O)NCC(=O)O)sc2nc(-c3cccnc3)cc(C(F)(F)F)c12 4709031 RKDGTYCATQDYJX-UHFFFAOYSA-N 396.350 2.774 0 50 GFAA Cc1ccc(N2CC[C@H](NC(=O)c3sc(-c4cnn(C)c4)nc3C)C2=O)cc1 152896318 LVQPQMOSTJXLBN-INIZCTEOSA-N 395.488 2.696 0 50 GFAA O=C(NCC[C@H]1CCCN1)c1cn(C(c2ccccc2)c2ccccc2)nn1 72121043 DAMBPOVXMLWTNG-LJQANCHMSA-N 375.476 2.788 0 50 GFAA Cn1cc(OCc2ccccc2Cl)c(=O)cc1C(=O)Nc1nncs1 218338087 YGAJVYOOIOOGEM-UHFFFAOYSA-N 376.825 2.722 0 50 GFAA COCC1(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)CCC1 72158074 SIDZJWINSXDLTC-CQSZACIVSA-N 384.398 2.739 0 50 GFAA Cc1ccc([C@@H]2OC[C@@H]3O[C@@H](c4ccc(C)cc4)O[C@H]([C@H](O)CO)[C@@H]3O2)cc1 38189449 LQAFKEDMOAMGAK-DRGMGAIOSA-N 386.444 2.553 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1 173348192 WZGRWVPKICOBTL-APWZRJJASA-N 379.460 2.629 0 50 GFAA Cc1cccnc1OC1CCN([C@@H](C)C(=O)Nc2ccc3nc(O)[nH]c3c2)CC1 377733405 WEKJWFFLKBDOBQ-AWEZNQCLSA-N 395.463 2.842 0 50 GFAA Cc1cnccc1-c1cccc(C(=O)N2CCCN(C)C3(CCNCC3)C2)c1 426544382 MMBJUCZUVZUVNL-UHFFFAOYSA-N 378.520 2.957 0 50 GFAA C[C@H]1CN(c2ccc(CNC(=O)N(Cc3ccccn3)C3CC3)cn2)CCO1 193316806 SWSFIERSNLUIAO-INIZCTEOSA-N 381.480 2.576 0 50 GFAA O[C@@H]1CN(Cc2cc3ccccc3o2)CC[C@H]1N1CCN(c2ccccn2)CC1 20210583 WIPNHQXZXLKPBQ-NHCUHLMSSA-N 392.503 2.585 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc(O)c(Cl)c3)C[C@H]2NC(C)=O)cc1 95530350 YCCPTYFIXPCXBV-FUHWJXTLSA-N 388.851 2.799 0 50 GFAA NC(=O)c1nc(CNC(=O)C[C@@H](c2ccccc2)c2cccc(Cl)c2)no1 95498067 LLCVFAMNKRQLRD-HNNXBMFYSA-N 384.823 2.660 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1 97743606 VWQYNWKGMWTFAT-FQEVSTJZSA-N 380.492 2.761 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)OCc1ccccc1Cl 239432997 XBUIVWSKYHUACM-HSGSIZQLSA-N 385.847 2.826 0 50 GFAA Cc1cccc(OC2CCN(C(=O)[C@H](c3cccnc3)N3CCOCC3)CC2)c1 95372869 FXBQMINWMSIHEE-QFIPXVFZSA-N 395.503 2.833 0 50 GFAA CCc1cc(C(=O)NC2CCN(Cc3cc(F)cc(F)c3)CC2)cc(=O)[nH]1 97578677 QUCKSWPLBMOBFE-UHFFFAOYSA-N 375.419 2.610 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)[C@H]1CCC(=O)N(Cc2ccccc2F)C1 91793032 ZJKFVOOJUOTIMD-KRWDZBQOSA-N 386.471 2.735 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(C(=O)N3CCCC3)CC2)cc1Cl 95376336 KYZMZQMQSKVHCN-QGZVFWFLSA-N 380.872 2.809 0 50 GFAA O=C(N[C@@H](c1cccs1)[C@H]1C[C@@H](O)C1)C1CCN(C2CCOCC2)CC1 252572249 ZAXWSTXOOSFYJG-HHXXYDBFSA-N 378.538 2.567 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccs2)cc1C(=O)O 299747200 CITYIHWEEQOJSU-XJKSGUPXSA-N 376.434 2.526 0 50 GFAA CC1(Cn2cc(C(=O)N3CCCc4cccc(OC(F)F)c43)nn2)COC1 184288463 OLINUTCZYGRDFZ-UHFFFAOYSA-N 378.379 2.509 0 50 GFAA CSc1cccc(CN(C)C(=O)NCC2(CN3CCN(C)CC3)CC2)c1 534576756 UWLINRWSTMHOGU-UHFFFAOYSA-N 376.570 2.578 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)N1CC[C@@]2(O)CCCC[C@H]2C1 534649370 RRXUGLMCMOROKC-UWJYYQICSA-N 384.480 2.540 0 50 GFAA CC(C)C(=O)N1CCn2nc(CNC(=O)Nc3ccccc3Cl)cc2C1 299785927 LBEMRJQMYWFSCY-UHFFFAOYSA-N 375.860 2.856 0 50 GFAA CN1CCN(C(=O)c2cccc(NC(=O)NCCSC(C)(C)C)c2)CC1 299791793 CYMRLJMVARDAGK-UHFFFAOYSA-N 378.542 2.727 0 50 GFAA COc1cccc2c1OCC(CN(CCN1CCOCC1)Cc1ccco1)=C2 824801200 AFWMETAHLJMPPQ-UHFFFAOYSA-N 384.476 2.898 0 50 GFAA Cc1nc[nH]c1C(=O)NC[C@@H]1CCCN(Cc2ccc3c(c2)OC(F)(F)O3)C1 828132195 SZSWPULWTNGSHE-AWEZNQCLSA-N 392.406 2.682 0 50 GFAA CC(C)c1nccn1CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2 670448132 GQBQVZIHKQYNFP-UHFFFAOYSA-N 379.482 2.536 0 50 GFAA O=C(N[C@H](CO)C(=O)O)c1cccc(-c2ccc(CN3CCCCC3)cc2)c1 1875281312 DBVTWIHBCIYCHN-HXUWFJFHSA-N 382.460 2.515 0 50 GFAA COc1cn(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1C[C@@H](C)CNC[C@H]1C 1875301576 MZQLVJAIJXCIRN-QWHCGFSZSA-N 396.413 2.970 0 50 GFAA C[C@H](c1nc2ccccc2s1)N1CCN(c2ncc3ncn(C)c3n2)CC1 1875305450 RGKWKAOKOFHKEN-CYBMUJFWSA-N 379.493 2.856 0 50 GFAA Cc1csc2nc(CC(=O)NCC3CN(Cc4ccc(F)c(F)c4)C3)cn12 1875336807 HUCLOLAWNRACHJ-UHFFFAOYSA-N 390.459 2.773 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N1CCCN(c2ccncc2C)CC1 952982729 MHLAKDXMYFVBQK-KRWDZBQOSA-N 394.475 2.563 0 50 GFAA c1csc(CN2CCCN(Cc3cnc(NC[C@@H]4CCCO4)nc3)CC2)c1 952960352 JFIOZGLATAENBV-SFHVURJKSA-N 387.553 2.837 0 50 GFAA C[C@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1cnc(C2CC2)s1 888101354 LLELYYZMYPESGT-GWCFXTLKSA-N 377.491 2.577 0 50 GFAA O=C1CN(C(=O)[C@H]2CCO[C@@H]2c2cccnc2)CCN1Cc1ccc(Cl)cc1 276700056 WUPCXJZKJKWGPR-AZUAARDMSA-N 399.878 2.684 0 50 GFAA Cc1cc(C(=O)N2CC[S@@](=O)C[C@@H]2c2cnn(C)c2)cc(C)c1OC(F)F 277416498 HZUXOLDATNFWHT-YVORESIASA-N 397.447 2.584 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@H](c1ccccc1)[C@@H]1CCCO1 170680076 FIKKBHRRTJQLKI-RBUKOAKNSA-N 377.448 2.987 0 50 GFAA C[C@@H]1CN(Cc2cccc(CNC(=O)c3cc(N4CCCC4)ccn3)c2)CCO1 188757847 SIDUXNQPCDLABL-GOSISDBHSA-N 394.519 2.833 0 50 GFAA CC(C)(C)n1cc(C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)nn1 190805212 DRAWKEUQWXTMHQ-UHFFFAOYSA-N 396.495 2.572 0 50 GFAA O=C([C@@H](Cc1ccccc1)NCc1cnc(-c2ccco2)s1)N1CCOCC1 193212509 HGJBSQXNQCMFQP-GOSISDBHSA-N 397.500 2.963 0 50 GFAA CNC(=O)CC[C@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2F)C1 1506431615 RTEHAVRBMOUTHZ-GFCCVEGCSA-N 376.881 2.547 0 50 GFAA Cc1cc(N2CCCN(C3CCN(C(=O)c4ccncc4)CC3)CC2)ccn1 1506424340 JVOHKSXLFDOXEN-UHFFFAOYSA-N 379.508 2.602 0 50 GFAA C[C@@H]1CN(CC(=O)NCc2c[nH]nc2-c2ccccc2)Cc2ccccc2O1 11909030 JNGWLGBJENSTHQ-MRXNPFEDSA-N 376.460 2.976 0 50 GFAA CCN(CC)C(=O)c1sc2ncnc(NCCCN3CCCC3=O)c2c1C 12279897 BZKRZXMKNDALSA-UHFFFAOYSA-N 389.525 2.906 0 50 GFAA COc1ccc(CN(C)Cc2cccnc2)cc1OC[C@@H](O)CN1CCCCC1 12297204 IVXXNUPGKYEOCB-NRFANRHFSA-N 399.535 2.948 0 50 GFAA COC(=O)CCC(=O)N1CC[C@]2(CCCN(Cc3cc(OC)ccc3F)C2)C1 12717867 JJFJQLAFOIOVFH-NRFANRHFSA-N 392.471 2.602 0 50 GFAA CCOC(=O)C1(Cc2ccc(Cl)cc2)CCN(C(=O)CCNC(C)=O)CC1 14981600 BOJZLNQFRGDBHQ-UHFFFAOYSA-N 394.899 2.581 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NCc2c(F)cccc2F)CN1C/C=C/c1ccccc1 19740100 MZDAGGJKKJSKKP-UYVLIOPYSA-N 385.458 2.957 0 50 GFAA O=C(NCc1ccccc1)c1cc2n(n1)C[C@H](c1ccc3c(c1)OCO3)OC2 169759851 DXOBEQGKNPUQJD-HXUWFJFHSA-N 377.400 2.813 0 50 GFAA O=C(c1ccc(OCc2ccccc2F)cc1)N1C[C@@H]2CCOC[C@]2(CO)C1 1857668997 KKEORAGYUGKQMQ-PGRDOPGGSA-N 385.435 2.876 0 50 GFAA O=C(O)CN1CCC2(CC1)OCCc1cc(C(=O)N[C@H]3C=CCCC3)sc12 1857703549 MRRMRXWJEXBCQU-HNNXBMFYSA-N 390.505 2.535 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N(C)Cc4cc[nH]n4)C3)nc2c1 1857707949 BCMHKFKPTOQKNX-CQSZACIVSA-N 383.452 2.825 0 50 GFAA Cc1cccn2c(CC(=O)N[C@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)cnc12 1857738822 ZVMHBDWPYMUSBE-SESVDKBCSA-N 390.487 2.516 0 50 GFAA NC[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1C(F)(F)F 238058321 YERDJMDMHJOSMH-SECBINFHSA-N 387.221 2.580 0 50 GFAA CS(=O)(=O)CC1(CNC(=O)N2C[C@H]3CCCC[C@]32c2ccccc2)CC1 361029130 JFEHDUKGIQGAQE-XLIONFOSSA-N 376.522 2.922 0 50 GFAA CN(Cc1cccc(-c2nc(=O)cc(CN)[nH]2)c1)Cc1ccc2nsnc2c1 23312284 UJKYMTLEXAMHEA-UHFFFAOYSA-N 392.488 2.532 0 50 GFAA CC1(C)CCCC[C@@H]1CC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2ncnn12 2325794037 OZVHEVZKFGOMAM-IKGGRYGDSA-N 395.507 2.761 0 50 GFAA Cn1ccnc1[C@@H]1CNCCN1C(=O)c1cc2c(Cl)cc(Cl)cc2[nH]1 2325795287 WQBOFVNWQFJQJM-HNNXBMFYSA-N 378.263 2.995 0 50 GFAA O=C(Nc1cccc(Br)c1F)c1csc([C@@H]2CNCCO2)n1 2325865675 LVSTWYQGNDQDAN-NSHDSACASA-N 386.246 2.958 0 50 GFAA O=C(NCc1cccnc1)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)cc1 1110181 UMIUPTYUPYTYTA-ROUUACIJSA-N 381.432 2.841 0 50 GFAA COc1ccc(NC(=O)C[C@@H]2C(=O)N(C)C(=S)N2CCc2ccccc2)cc1 1185142 LJHPZZGRGZLJAI-GOSISDBHSA-N 397.500 2.694 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2cnc(-c3ccccc3)n2C)CC[C@@H]1O 2356144882 QAEXTQWWFYGHPU-PGRDOPGGSA-N 399.491 2.801 0 50 GFAA Cc1ccn2cc(C(=O)N3CCC[C@@]4(CCc5cnc(N(C)C)nc54)C3)nc2c1 2356153828 WUONURIJOMYNQB-JOCHJYFZSA-N 390.491 2.619 0 50 GFAA Cc1cccnc1NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 6702859 XYSMDPYWIRTFEY-OAHLLOKOSA-N 379.869 2.835 0 50 GFAA CC(C)=CCN1CCN(c2nccc(-c3ccc(C)nc3C)n2)C[C@@H]1CCO 106984346 VKZNJRAGRLHSRA-IBGZPJMESA-N 381.524 2.995 0 50 GFAA Cc1ccc(F)c(NC(=O)CCC(=O)NC[C@@H](O)COC2CCCCC2)c1 55133052 YDKMQPLVRMBINH-OAHLLOKOSA-N 380.460 2.679 0 50 GFAA CC(=O)N1CCN(Cc2nc3cc(NC(=O)C4CCCCC4)ccc3n2C)CC1 20472329 BMRGXAMMZCPRIW-UHFFFAOYSA-N 397.523 2.756 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccoc3)n1)CCN(C(=O)[C@H]1CCCO1)C2 23620196 KKMIORWMRUDXQR-MRXNPFEDSA-N 380.404 2.764 0 50 GFAA CC(C)Nc1ncc(CN2CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C2)cn1 67514310 QNOJZNJQBZJXRX-UHFFFAOYSA-N 392.463 2.974 0 50 GFAA COc1ccc(F)c(F)c1C(=O)N1CCCC[C@@H]1CCN1CCN(C)CC1 219830049 PYHPUQSBWISHFD-OAHLLOKOSA-N 381.467 2.606 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1ccc3c(c1)CCC3)CC2 172171376 WHFRFRAHMAMLTO-UHFFFAOYSA-N 384.501 2.557 0 50 GFAA COCc1c(C(=O)N2CCC[C@H](N3CCNC3=O)C2)sc2cccc(F)c12 360025457 YRYTYDAOWLUITL-LBPRGKRZSA-N 391.468 2.817 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)N1CCC[C@H](c2nnc(O)o2)C1 328591332 DNQJVYJLRAZRGM-NSHDSACASA-N 389.362 2.567 0 50 GFAA O=C(NCCc1cnc(C2CC2)nc1)NCc1ccc(-n2ccnc2)c(F)c1 378264790 LKPZKEOKESJOBQ-UHFFFAOYSA-N 380.427 2.721 0 50 GFAA Cc1cnn(C2(C(=O)O)CCN(Cc3cn(-c4ccccc4)nc3C)CC2)c1 77300792 OYGUDXLRBLNXBZ-UHFFFAOYSA-N 379.464 2.762 0 50 GFAA COc1cc2c(cc1OC)[C@@H](C)N(S(=O)(=O)NCc1ccccc1)CC2 72164724 BKYJNVSSYDEMLG-CQSZACIVSA-N 376.478 2.658 0 50 GFAA O=C([C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)N1CCOC2(CCC2)C1 128021850 BUKXDKZSZXDQDE-HNNXBMFYSA-N 394.418 2.674 0 50 GFAA CC(C)(C)CN1C[C@]23C=C[C@H](O2)[C@H](C(=O)N2CCc4ccc(F)cc4C2)[C@@H]3C1=O 77505890 PYEMTYMZCINUMD-XWQURZDVSA-N 398.478 2.539 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CCCN(Cc3ccc(-n4ccnc4)nc3)C2)n1 177034557 HLGCJKIDXQESCV-GOSISDBHSA-N 376.464 2.821 0 50 GFAA CC(=O)Nc1ccc(-c2cn([C@@H]3CCCN(C(=O)c4ccco4)C3)nn2)cc1 82096216 UVKMUQLYCXTXMO-QGZVFWFLSA-N 379.420 2.974 0 50 GFAA Cc1cccc(CN(C[C@@H]2CCCO2)C(=O)Cn2c(=O)[nH]c3ccccc32)c1 95505706 HZJUNKRDTDQNBF-SFHVURJKSA-N 379.460 2.846 0 50 GFAA CN1CCN(C(=O)c2ccnc(NC[C@@H]3CCOc4ccccc4C3)c2)CC1 95391131 XMAXWNXCGCVFQX-QGZVFWFLSA-N 380.492 2.523 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)N(Cc1c(C)nn(C)c1C)C1CC1)CC(=O)N2 97785256 FDHMSKGIMZOGJA-KRWDZBQOSA-N 382.464 2.663 0 50 GFAA C[C@@]1(Cc2ccc3c(c2)OCO3)CCC(=O)N(Cc2nnc3n2CCCC3)C1 91593966 OFZBRZDMNGHKCX-NRFANRHFSA-N 382.464 2.715 0 50 GFAA CC[C@H](NC(=O)Nc1cc2c(cc1OC)n(C)c(=O)n2C)c1cc(C)ccn1 96164414 YCMBUYQZWQAAFV-ZDUSSCGKSA-N 383.452 2.862 0 50 GFAA CCCc1nnsc1C(=O)N[C@H](c1cc(F)ccc1OC)[C@H]1C[C@@H](O)C1 244764129 PBVNTIPDEQCXQM-IETSOEAISA-N 379.457 2.880 0 50 GFAA Cc1cc(=O)c2cc(-c3cccc(C(=O)N[C@@H]4CCC(=O)N(C)C4)c3)ccc2[nH]1 534657122 AMPVBIQJEPIWLG-GOSISDBHSA-N 389.455 2.854 0 50 GFAA COc1ccc(CNC(=O)C2CCN(C(=O)NCc3coc(C)c3)CC2)cc1 1875295739 PEJVAOWIMAGCGA-UHFFFAOYSA-N 385.464 2.835 0 50 GFAA O=C(O)c1cc(F)cc2c1CCN(C(=O)Cc1ccccc1O[C@@H]1CCOC1)C2 1875300723 OKPJLIYCJUQNJP-QGZVFWFLSA-N 399.418 2.819 0 50 GFAA Cc1ccc2cc(CNCc3noc(C4CC4)n3)c(N3CCOCC3)nc2c1 952983305 JZHOSXQIUGWVPU-UHFFFAOYSA-N 379.464 2.930 0 50 GFAA O=C(NCc1cccc(F)c1)N1CCCS(=O)(=O)C[C@H]1c1ccccc1 891770024 FNIUTRRQQPEGER-SFHVURJKSA-N 376.453 2.897 0 50 GFAA COCc1nc(OC)cc(N2CCC([C@@H](C)NC(=O)C3(C)CCCC3)CC2)n1 1775993011 WPRZNBMYJZLRSQ-OAHLLOKOSA-N 390.528 2.933 0 50 GFAA Cc1nn(-c2ccccc2)c(N)c1[C@]1(O)C(=O)Nc2ccc(Br)cc21 170625874 HQCLWXJRFDKCFI-SFHVURJKSA-N 399.248 2.713 0 50 GFAA COc1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3F)CC2)ccc1F 187105788 ILTBVCNPRZCZGS-UHFFFAOYSA-N 389.402 2.892 0 50 GFAA COc1ccc(CC(C)(C)NC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)cc1 187213040 DIGJJIBJTGNGQQ-QGZVFWFLSA-N 385.512 2.718 0 50 GFAA CS(=O)(=O)c1cc(C(=O)N2CCOC[C@@H]2Cc2ccccc2)ccc1Cl 752420530 PWSYIJJGZWXVKD-INIZCTEOSA-N 393.892 2.827 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N(C)CCCn3cccn3)c(C)s2)n[nH]1 1506397398 SISSKYAJCQSZHD-UHFFFAOYSA-N 379.511 2.662 0 50 GFAA Cc1cc(N(CC(=O)N2CCCCC2)S(C)(=O)=O)ccc1Br 1110615 BKVHBEJPSIWDHN-UHFFFAOYSA-N 389.315 2.536 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)Nc2ccc3c(c2)OCO3)c(C)c1 802519 XRFQUIPMGAURLB-UHFFFAOYSA-N 390.461 2.600 0 50 GFAA O=C1CCCN1CCCc1nc(-c2ccc(F)c(F)c2)nn1[C@H]1CCOC1 1772806825 KMAAYISNDPNUGW-AWEZNQCLSA-N 376.407 2.740 0 50 GFAA CCCC(=O)N1C[C@H]2CN(Cc3ccccc3-n3nc(C)cc3C)C[C@]2(CO)C1 1772709364 OZSYGOLMNNFZNH-NFBKMPQASA-N 396.535 2.542 0 50 GFAA O=C1CCCCCN1CCc1nc(COc2ccccc2)nn1[C@H]1CCOC1 1772807950 DAXNWXTVWSKZRP-KRWDZBQOSA-N 384.480 2.764 0 50 GFAA CC(C)c1cc(CN2CCC[C@@H](CNS(=O)(=O)Cc3ccccc3)C2)n[nH]1 11753578 GEOPVVVJQALHIP-SFHVURJKSA-N 390.553 2.865 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4OC)CC3)C2)o1 12307534 APFZUNNDMYLJMS-QGZVFWFLSA-N 399.491 2.724 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(Cc4cnn(C)c4C)C3)C2=O)c1 14979813 ZVVSQRGRRXXQIZ-JOCHJYFZSA-N 382.508 2.752 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSC1CCCCC1)c1ccccc1F 16213705 WTWFDMWHUAJVDY-UHFFFAOYSA-N 388.530 2.774 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccc(C(C)(C)C)cc2)C(=O)NCCO)cc1 2995215 IGVMMRUYCSRGFF-HMMYKYKNSA-N 396.487 2.872 0 50 GFAA Cn1cnc2cc(C(=O)N3CCc4[nH]nc(-c5ccccc5)c4CC3)ccc2c1=O 1857697795 MWMSTVUJKQWMAI-UHFFFAOYSA-N 399.454 2.565 0 50 GFAA O[C@@]1(CN2CCC(c3ccccc3)CC2)CCCN(c2nnc3ccccn23)C1 1857725293 OSPCIICOSXZHOQ-HSZRJFAPSA-N 391.519 2.940 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(CCOc3ccc(Cl)cc3)C[C@]23CC[C@H]1O3 1857734192 NKMDAXFBFSEDSW-JRBPQWBISA-N 378.900 2.724 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1C[C@H](O)[C@H](Cc2ccncc2)C1 1875245848 AJWNRVVUBPXQGC-QUCCMNQESA-N 377.444 2.650 0 50 GFAA Cc1cc(C)nc(N2C[C@@H]3[C@H](CNC(=O)c4ccncc4)[C@H]4CC[C@]3(C2)O4)c1 1875248135 YXEVBAQWLDCLQL-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA COCCCn1c(C(=O)N2CCC(C)CC2)cc2c(=O)n3ccccc3nc21 5324306 USNBWCSTWKVEFT-UHFFFAOYSA-N 382.464 2.558 0 50 GFAA CC[C@@H](Cc1ccccc1Br)C(=O)N1CCO[C@@H](CC(=O)O)C1 237036834 UTPWMNXUGZXPQE-JSGCOSHPSA-N 384.270 2.720 0 50 GFAA CC(C)NC(=O)c1cn(CC[C@H]2CCCCN2C(=O)c2ccccc2F)nn1 14964744 OSFRIDIMBARPTF-OAHLLOKOSA-N 387.459 2.640 0 50 GFAA COc1cc(OC)cc([C@H](O)CNC(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1 265417386 DVIQAQYEJXIRKK-KZULUSFZSA-N 384.436 2.674 0 50 GFAA COc1ccc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1OC 792238 XXBOUUDAEGAJES-HNNXBMFYSA-N 386.423 2.555 0 50 GFAA Cc1cc(C)n(CC(=O)N2CC[C@@]3(C2)C(=O)N(CC(C)C)c2ccccc23)n1 2100555357 SDMLFWWGVOZFTD-QFIPXVFZSA-N 380.492 2.673 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=S)N[C@H]2c2ccc(O)cc2)c(OC)c1 8769686 ZNSWBSHLMZUPJA-SFHVURJKSA-N 399.472 2.841 0 50 GFAA Cn1nc2c(c1NC(=O)C[C@@H](CN)c1ccc(Br)s1)CCC2 2325768327 FLJRXQMYEBFQKT-VIFPVBQESA-N 383.315 2.804 0 50 GFAA C[C@](O)(Cc1cn(C[C@H](O)CCOCc2ccccc2)nn1)c1cccs1 2325772820 OXVLHDVAWNXBQU-QUCCMNQESA-N 387.505 2.758 0 50 GFAA CCc1ccc([C@H](C)NC(=O)Cn2cc(-c3ccc4c(=N)[nH][nH]c4c3)nn2)cc1 2325869409 MHTAJSZZXPJWSV-ZDUSSCGKSA-N 389.463 2.674 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccc2c(c1)OCCO2)c1ccccc1Cl 785571 CWSNMMVRYMNYIM-UHFFFAOYSA-N 396.852 2.516 0 50 GFAA COc1cccc(N2C(=O)N(c3ccccc3Cl)[C@@H]3CS(=O)(=O)C[C@@H]32)c1 1019177 QDGMBDNHDQYNFO-DLBZAZTESA-N 392.864 2.961 0 50 GFAA O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc1ccccc1C(F)(F)F 1127033 DMTBRSRPNLUEST-UHFFFAOYSA-N 398.362 2.879 0 50 GFAA CC(C)(C)n1ccc(-c2nc(-c3ccccn3)nn2[C@H]2CCS(=O)(=O)C2)c1 2356139685 HOFBORFKZITZIZ-HNNXBMFYSA-N 385.493 2.923 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(c4nncs4)C3)[C@@H]3CCCC(=O)N23)c1 2356143570 NIFNCENXSJRTSA-NEPXVJNWSA-N 398.532 2.995 0 50 GFAA Cc1cc(Br)c2c(c1)[C@](O)([C@@H]1C(=O)Nc3ccccc31)C(=O)N2C 2868748 IOKGCPVYEXWMOL-KSSFIOAISA-N 387.233 2.657 0 50 GFAA COCCCNC(=O)CN(c1cccc(C)c1C)S(=O)(=O)c1ccccc1 2986084 IFXQSOYJGUMKKS-UHFFFAOYSA-N 390.505 2.651 0 50 GFAA O=S1(=O)CC[C@@H](NC(=S)SCc2ccccc2Br)C1 4531300 UTLJHPMPJMKBNK-SNVBAGLBSA-N 380.354 2.744 0 50 GFAA CCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCSC)cc1OC 4536235 AFJGIJMFROEVOD-INIZCTEOSA-N 380.466 2.628 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCN(S(=O)(=O)c2ccccc2)CC1 6741688 SEYMURLCTUPQHJ-UHFFFAOYSA-N 379.869 2.878 0 50 GFAA C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCO1 7999252 ANBKWOVLQRFZTG-CGTJXYLNSA-N 392.496 2.780 0 50 GFAA O=C(Nc1nnc(-c2ccccc2Cl)[nH]1)[C@H]1CN(Cc2ccccc2)CCO1 133751603 UIWVLLCXFNSWMR-QGZVFWFLSA-N 397.866 2.965 0 50 GFAA Cc1ccc(OCc2cc(=O)[nH]c(-c3cccc(CN4CCNCC4)c3)n2)cc1 23158258 BHGOUIUSFJRMHW-UHFFFAOYSA-N 390.487 2.730 0 50 GFAA Cn1nc(-c2ccccc2)c(-c2ccccc2)c(C(=O)N2CCOCC2)c1=O 8844320 YJHJBQCPRZPJEA-UHFFFAOYSA-N 375.428 2.587 0 50 GFAA CC(C)c1noc(CNC[C@@]2(O)CCCN(CCC3CCCCC3)C2=O)n1 67821169 ADJSJAOVQOMXKV-FQEVSTJZSA-N 378.517 2.607 0 50 GFAA COc1cc(C(=O)N[C@H]2CCCN(C3CCN(C)CC3)C2)c2ccccc2n1 15073880 VGCNNFNPFDBMHS-INIZCTEOSA-N 382.508 2.532 0 50 GFAA CCn1cc(-c2c(-c3ccccc3)ncn2CCSc2nnnn2C)cn1 65421924 OLMATUOOSWDOSV-UHFFFAOYSA-N 380.481 2.749 0 50 GFAA CCOC(=O)N1CCC(N2CCN(CC3CCCCC3)[C@@H](CCO)C2)CC1 22926122 MAXSBCXMDXNYPL-FQEVSTJZSA-N 381.561 2.556 0 50 GFAA Cc1ccc(CS(=O)(=O)NC(=O)[C@H]2CCCN2Cc2ccccc2)c(F)c1 252482972 DRHIOPFSWWNZMW-LJQANCHMSA-N 390.480 2.745 0 50 GFAA Cc1nc2sccn2c1CN1CCN(Cc2cccs2)[C@H](CCO)C1 39446955 MBGOLBCRQDJXKH-OAHLLOKOSA-N 376.551 2.835 0 50 GFAA CCNC(=O)c1ccnc(N2C[C@H](c3ccccc3)[C@@H]3[C@H]2C2CCN3CC2)c1 72129504 DVVXCCPKCAPMJH-CEMLEFRQSA-N 376.504 2.898 0 50 GFAA Cc1noc(C2CCN(c3nccc(N[C@@H]4CCCO[C@@H]4C(C)C)n3)CC2)n1 328652966 WREQVOQFRDZSQC-SJLPKXTDSA-N 386.500 3.168 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1cscn1)c1cc(-c2ccccc2)n[nH]1 219798122 VNSOXNPTPUCOAQ-CRAIPNDOSA-N 384.461 2.637 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)NCc2cccc(CN3CCOCC3)c2)no1 363025023 AWIIARYGRFHGFP-FQEVSTJZSA-N 384.480 2.862 0 50 GFAA CCC(=O)N1CCCC[C@H]1C(=O)N1CC[C@](O)(Cc2cccc(Cl)c2)C1 331587969 XVMXFORROGRUAJ-PXNSSMCTSA-N 378.900 2.637 0 50 GFAA Cc1ncsc1C(=O)N1CCC(C(=O)O)(n2ccc(-c3ccco3)n2)CC1 72429531 XLRPOLAKDVRCEZ-UHFFFAOYSA-N 386.433 2.624 0 50 GFAA COC(=O)C[C@@H](c1cccc(O)c1)c1oc(CN2CCCCC2)cc(=O)c1O 217641262 XXMYEOAWSCYDFA-KRWDZBQOSA-N 387.432 2.732 0 50 GFAA biogenic O=C(Cn1ccc(O)nc1=O)N1CC[C@@H](c2cccc(Oc3ccccc3)c2)C1 369888587 STFLSWYMSPBDAT-QGZVFWFLSA-N 391.427 2.757 0 50 GFAA Cc1cnn(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1 72134734 ZXCXDJNMHLBREZ-IBGZPJMESA-N 386.471 2.616 0 50 GFAA CCc1nc(CN2CCC[C@H](NC(=O)[C@@H](C)Cc3ccc(OC)cc3)C2)no1 378275177 UNKHPZDEFZEQTN-RDJZCZTQSA-N 386.496 2.600 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)N(CC)C(=O)N[C@@H]1c1ccccc1 20045790 URTRDOCGVZYUSW-GOSISDBHSA-N 389.521 2.639 0 50 GFAA Cc1cc2nc(C(=O)NC3CCN(Cc4ccccc4F)CC3)cc(C)n2n1 97288670 MJRBJPLGAWQSKN-UHFFFAOYSA-N 381.455 2.880 0 50 GFAA Cc1noc(-c2ccc(NC(=O)N[C@@H]3CCCN(c4cnccn4)C3)cc2)n1 95523948 ZPDLGZYJLNNALC-MRXNPFEDSA-N 379.424 2.626 0 50 GFAA CCc1noc([C@@H]2CCCN2C(=O)Nc2cccc(-c3nnn(CC)n3)c2)n1 96165445 RDSYOXDERFLVLA-AWEZNQCLSA-N 382.428 2.674 0 50 GFAA CC(C)c1ccc(N2C[C@H](C(=O)N3CCN(c4ccccn4)CC3)CC2=O)cc1 244279883 WTLINOHQQWLGLW-LJQANCHMSA-N 392.503 2.907 0 50 GFAA CCc1nnc(NC(=O)[C@H](C)N2CCC(OCc3ccccn3)CC2)s1 243885896 ADJNHKFQUHKJRJ-ZDUSSCGKSA-N 375.498 2.504 0 50 GFAA COc1cccc(CN2CCN(C[C@H]3CC(c4ccccc4)=NO3)CC2=O)c1 252500819 TVUCKQFOHWCFGZ-HXUWFJFHSA-N 379.460 2.533 0 50 GFAA CC[C@@H](NC(=O)N1CCN(Cc2cccc(OC)c2)C(=O)C1)c1cccnc1 534578494 RIAWSWXTAPZUNZ-LJQANCHMSA-N 382.464 2.595 0 50 GFAA COC(=O)[C@@H](Cc1ccccc1)NC(=O)N1CCc2cc(OC)c(OC)cc2C1 65363883 IVGSSVDZXWHDSJ-GOSISDBHSA-N 398.459 2.556 0 50 GFAA biogenic CCCc1cc(CNS(=O)(=O)c2ccc3c(c2)NC(=O)CCS3)on1 670473429 BFQQOEICCCVZLU-UHFFFAOYSA-N 381.479 2.540 0 50 GFAA Cc1nc2ccc(CNC(=O)N3CCC([C@H](O)c4ccccn4)CC3)cc2[nH]1 584901515 MSUWRMSARCGSEZ-FQEVSTJZSA-N 379.464 2.922 0 50 GFAA O=C(NCCOc1ccc(Cl)cc1)N1CCC(O)(c2cccnc2)CC1 584894795 OBGGSNXWYWBRKJ-UHFFFAOYSA-N 375.856 2.807 0 50 GFAA Cn1c([C@@H](O)C2CC2)nnc1N1CCCN(Cc2ccccc2)CC(F)(F)C1 1875392361 CVXPZNVBSBYFLO-KRWDZBQOSA-N 391.466 2.606 0 50 GFAA CC(C)c1n[nH]c(CC2CCN(C(=O)c3ccc4[nH]nc(C(=O)O)c4c3)CC2)n1 1875300283 WBDFQVGHTWZLEM-UHFFFAOYSA-N 396.451 2.598 0 50 GFAA COc1ccc(C(=O)NC2(C)CCN(c3ncnc4c3CCC4)CC2)c(OC)c1 1875328253 IDUVDWKVGSYNFI-UHFFFAOYSA-N 396.491 2.771 0 50 GFAA Cc1ccc([C@@H](C)N[C@H]2CCN(c3cc(O)nc(O)n3)C2)cc1Br 1875400397 YMQFBGKLTYXDBN-YPMHNXCESA-N 393.285 2.888 0 50 GFAA COc1ccc2cc(C(=O)N3C[C@@H]4C[C@@H](C3)[C@@H]3CCCC(=O)N3C4)n(C)c2c1 888088484 BRTJPWSEVDLZHZ-ZVZYQTTQSA-N 381.476 2.660 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCc2cc(C3CC3)n(C)n2)(c2ccccc2)CC1 885904377 QFHUYHCRRJQXRW-UHFFFAOYSA-N 392.503 2.660 0 50 GFAA CO[C@H](C)C(=O)N1CCC2(CC1)C[C@@H](NC(=O)c1ccc(C)cc1C)CCO2 1775997996 XXXRPOVYSWHINS-MSOLQXFVSA-N 388.508 2.608 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cn1 276011251 PVFYGDKJGWJCOM-TYCQWZJGSA-N 397.523 2.717 0 50 GFAA COC(=O)CC[C@H]1NC(=O)N(c2ccc(Sc3nc(C)cs3)cc2)C1=O 277962145 DDPVPCSPOYAKCG-CYBMUJFWSA-N 391.474 2.981 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)NC1CCN(C2CCCC2)CC1 189131897 VEUXJBAEJGLHMJ-UHFFFAOYSA-N 390.494 2.967 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3cnc(C)nc3-c3ccccc3)CCN12 1529154902 LOOIZFVJQUOHLP-RBUKOAKNSA-N 380.492 2.777 0 50 GFAA COc1ccc(-c2cc(F)cc3c2O[C@@H](CNC(=O)Cc2ccccc2)C3)nn1 12157090 JLIYXKUMQXOGQA-QGZVFWFLSA-N 393.418 2.954 0 50 GFAA O=C(c1cn(C(c2ccccc2)c2ccccc2)nn1)N1CCC[C@H](CO)C1 12752106 FVSCLKDIRHBMCR-KRWDZBQOSA-N 376.460 2.760 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccccc2Cl)C(=O)NCCCO)cc1 13400870 SMCBQBYICQKTMY-QGOAFFKASA-N 388.851 2.618 0 50 GFAA COc1cccc(C(=O)NCCc2nnc(SCC(C)C)n2C)c1OC 14994491 KTFBDJVETHUCMT-UHFFFAOYSA-N 378.498 2.553 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860229 VQSQYACJQQXRBM-OAHLLOKOSA-N 396.896 2.791 0 50 GFAA O=c1c2c(CO)c(-c3ccc(F)cc3)nn2ccn1CCOc1ccccc1 169752378 VJKRCUXITRGIOU-UHFFFAOYSA-N 379.391 2.873 0 50 GFAA COc1ccccc1C(=O)N1CCC(n2cc(-c3nc(C4CC4)no3)nn2)CC1 169777517 UYHQBMWXYJFLFE-UHFFFAOYSA-N 394.435 2.691 0 50 GFAA COc1ccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c(OC)c1 1857682708 LYMBUIMKORKZAH-SFTDATJTSA-N 384.476 2.848 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1C[C@@H](C(=O)O)C2(CCOCC2)C1 1857686678 BRILJMRZIARPQQ-KRWDZBQOSA-N 384.476 2.975 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)[C@@H]2CCCNCC2)CC1 1857718672 NSXSASUIDFGTLC-OAHLLOKOSA-N 386.540 2.676 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCc4cnc(C)cn4)C3)nc2c1 1857730537 VZPOXDCZOLXLJJ-HNNXBMFYSA-N 395.463 2.858 0 50 GFAA C[C@H](NC(=O)N(C)C1CCN(CCc2ccccn2)CC1)C(C)(C)CN(C)C 121274405 JWRYNORHGOVLJN-SFHVURJKSA-N 389.588 2.706 0 50 GFAA CC(C)C1(C(=O)N2CC[C@@]3(C2)c2ncn(C)c2CCN3C(=O)[C@H]2CC2(C)C)CC1 2325776799 AAXGAIYWHLILLY-WAIKUNEKSA-N 398.551 2.715 0 50 GFAA Cc1cnn([C@@H]2CCCNC2)c1C(=O)N1CCC[C@@H](c2cc(O)cc(F)c2)C1 2325779087 GGICEFZCHCAEGD-CRAIPNDOSA-N 386.471 2.981 0 50 GFAA CS/C=C/C(=O)N[C@]12CCC[C@H]1N(C(=O)c1cc(-c3ccccn3)[nH]n1)CC2 2325872417 XBKGWCMYJRIPGI-GDCUJEKNSA-N 397.504 2.602 0 50 GFAA CCC[C@@H](C)NS(=O)(=O)c1ccc(OC)c(I)c1 1076606 FDAATYAJXWAPLP-SECBINFHSA-N 383.251 2.767 0 50 GFAA Cc1ccc(C(=O)O)c(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)c1 2495366 JDUVJTGOCLNTML-UHFFFAOYSA-N 390.442 2.959 0 50 GFAA O=C(NCc1cccnc1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 4331371 BFPZQVGXSIZHPW-UHFFFAOYSA-N 393.896 2.840 0 50 GFAA CC[C@H](C)C(=O)C(=O)NC[C@@H]1Cc2c(F)ccc(-c3nc(C)cnc3C)c2O1 20449128 NUICAKHNYJKLNM-FZMZJTMJSA-N 385.439 2.934 0 50 GFAA CCN1CCN(CC(=O)Nc2sc3c(c2C(=O)OC)CCCCCC3)CC1 20608816 VWOCDBWYARCHEG-UHFFFAOYSA-N 393.553 2.770 0 50 GFAA Cn1cc(-c2csc(CNc3ccc(C(=O)N4CCOCC4)cc3)n2)cn1 252481844 CTPRFRWLEWOEJU-UHFFFAOYSA-N 383.477 2.628 0 50 GFAA CNC(=O)[C@@H](NC(=O)COc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 432330436 BAIOGYQRTYGTQV-NRFANRHFSA-N 393.443 2.941 0 50 GFAA Cc1[nH]c2c(c1C(=O)N1CCC(c3nnc4ccccn34)CC1)C(=O)CCC2 219619103 LEKOHGMCYQUUOE-UHFFFAOYSA-N 377.448 2.905 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c(Cl)c1 72436877 OOEPUXGLZNDRSP-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](CNC(=O)c3cnn(C(C)(C)C)c3)C2)c1 157529959 HYTKTAPSOOSVDG-HNNXBMFYSA-N 386.496 2.912 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cccc(CCC(C)(C)O)c3)CC2)cc(=O)[nH]1 72435624 QMMOOVTWRVIYHS-UHFFFAOYSA-N 383.492 2.802 0 50 GFAA COc1ccc(Cl)cc1NC(=O)Cn1ncc(N2CCCC2)c(Cl)c1=O 72115672 WMBFGKOBMSAHBI-UHFFFAOYSA-N 397.262 2.798 0 50 GFAA COc1ccc(CN2CCN(Cc3ccnn3-c3ccccc3)CC2=O)cc1 72433305 HBWSLCXWCZUDMP-UHFFFAOYSA-N 376.460 2.725 0 50 GFAA C[C@H]1[C@@H](C)N(Cc2ccc3c(c2)oc(=O)n3C)CCN1C(=O)OC(C)(C)C 241439888 NNDCAHOMLCUQCB-KGLIPLIRSA-N 375.469 2.961 0 50 GFAA O=C(Nc1ccc(OCCc2ccccc2)nc1)N1CC[C@H](N2CCOCC2)C1 173904036 VWAKUCZWJKRKOB-FQEVSTJZSA-N 396.491 2.642 0 50 GFAA Cc1nn2c(nnc3c(=O)n(Cc4cccnc4)ccc32)c1-c1ccc(F)cc1 40392061 FYCOIIRVXIGUTI-UHFFFAOYSA-N 386.390 2.997 0 50 GFAA O=C(NC[C@H]1CCCCO1)c1ccc(-c2cc(C(=O)NC3CC3)ccn2)cc1 426510848 OITSDHRYCJJQTB-LJQANCHMSA-N 379.460 2.940 0 50 GFAA Cc1cc(=O)c(C2=Nc3c(C(N)=O)cnn3[C@@H](c3ccc(Cl)cc3)C2)c(O)o1 198834455 FIAKYRIVUNCAQR-CQSZACIVSA-N 398.806 2.717 0 50 GFAA CC(=O)N(C[C@@H]1CCCO1)c1nc(C)c(C(=O)N=c2[nH]c3ccccc3[nH]2)s1 44891780 DFEHUNIUAYWMEL-ZDUSSCGKSA-N 399.476 2.534 0 50 GFAA Cc1ccc(N2C[C@@H](C)N(C(=O)c3ccccc3-c3nc[nH]n3)CC2=O)cc1 82106528 ARMCOSUHNITSLN-OAHLLOKOSA-N 375.432 2.658 0 50 GFAA NC[C@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 178540998 KDBJAMQJNONJRS-GFCCVEGCSA-N 378.270 2.844 0 50 GFAA Cc1nc(CN2CCN(C(=O)Nc3ccnn3-c3ccccc3)CC2)cs1 96130470 HGDARYZTVKGMQR-UHFFFAOYSA-N 382.493 2.987 0 50 GFAA Cc1cc(N2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)nc(-c2ccccc2)n1 91416591 XOTCTEYICPAYRZ-QFIPXVFZSA-N 379.508 2.585 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)c2cc3c(nc2OC)CCC3)s1 23398431 IKOPLMDYJRDRCK-HNNXBMFYSA-N 385.489 2.977 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)n(C)n1 95386050 FIQIGVFCKDHILE-AZUAARDMSA-N 381.524 2.750 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(C(=O)[C@H]1CCc3ccccc31)CC2 95383428 YAGLHVBIOMUNDH-FQEVSTJZSA-N 383.536 2.509 0 50 GFAA COCCN1CCC[C@]2(CCN(c3nc4c(C)cccc4cc3CO)C2)C1=O 95367042 ALMMRWASIYDBAG-JOCHJYFZSA-N 383.492 2.501 0 50 GFAA O=C(c1nnc2n1CCCC2)N1C[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2 91381595 GYXAOTOMIPSSCB-VQTJNVASSA-N 393.535 2.784 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@H]2CC[C@@H]1CN(Cc1cn3ccccc3n1)C2 95531213 DNOCTDWOHZZLKH-FUHWJXTLSA-N 379.464 2.562 0 50 GFAA Cc1ccccc1CNC(=O)CN1CCC[C@@]2(CCC(=O)N(CC3CC3)C2)C1 92019285 KRQFMFSBDAYJPT-HSZRJFAPSA-N 383.536 2.726 0 50 GFAA CSc1nc(N)cc(N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)n1 95502314 XEZFZKDELOPFCG-OAHLLOKOSA-N 381.509 2.805 0 50 GFAA O=C(CCc1cccnc1)NC[C@H]1CCCN(Cc2cccc3nonc23)C1 827822437 LLLZFCKIQMFSHI-QGZVFWFLSA-N 379.464 2.579 0 50 GFAA CN1CCC(CNC(=O)c2ccccc2N2CCOCC2)(c2ccccc2)CC1 823759381 CYESYLHOTFAVRB-UHFFFAOYSA-N 393.531 2.917 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)N1CCC(c2cc[nH]n2)CC1 584891753 IODVWMDQOLWYBS-UHFFFAOYSA-N 377.558 2.659 0 50 GFAA CCNc1cnc(-c2noc([C@@H]3CCc4nnn(C5CCCC5)c4C3)n2)cn1 952893163 HZDDBCASZKTYPW-GFCCVEGCSA-N 380.456 2.938 0 50 GFAA CCOc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc3cnnn3c2)cc1 1875295714 OOYXDWBABAGEAE-IBGZPJMESA-N 394.431 2.649 0 50 GFAA O=C([C@H]1CC[C@](O)(c2ccccc2)C1)N1CCN(c2cc(C3CC3)[nH]n2)CC1 1875271631 KZWIZOLCKRSNMR-HTAPYJJXSA-N 380.492 2.624 0 50 GFAA Cc1ccc(N2CCCCC2)cc1NC(=O)c1ccc2c(c1)NC(=O)CNC2=O 1875278467 BPWZGBQDZFFIMY-UHFFFAOYSA-N 392.459 2.920 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)CC1 1875363432 XCXAOZUMPXGKIM-UHFFFAOYSA-N 385.291 2.739 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCN(c2ncnc3ccccc23)CC1 952973366 XDINGIRPQPRZEX-UHFFFAOYSA-N 390.491 2.513 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)C1 270204929 FKRXTENGJCFADC-INIZCTEOSA-N 379.464 2.734 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](N(C)C)CC[C@H]2C1 1356153592 KNZSJCRBUNJOOO-ZGXWSNOMSA-N 387.524 2.533 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)cc1C 1565506726 QTVWDWNDRYGXEU-APWZRJJASA-N 379.460 2.775 0 50 GFAA CC(=O)NCC1CCN(C(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)CC1 409866235 JKAMXILVJYKSPM-UHFFFAOYSA-N 396.369 2.744 0 50 GFAA O=C(CCCNC(=O)c1ccsc1)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 170602573 CFFRRLDQGGQIDR-CZUORRHYSA-N 392.443 2.858 0 50 GFAA C[C@]1(c2ccc(C(=O)N[C@@H]3C[C@H]3c3cccc(Cl)c3)cc2)NC(=O)NC1=O 280889380 BKCRJRLGMJGSCZ-RZQQEMMASA-N 383.835 2.681 0 50 GFAA Cc1nc(C(F)(F)F)ccc1C(=O)N1CCS(=O)(=O)c2ccccc2C1 187386535 LWLSBRQOACBXCQ-UHFFFAOYSA-N 384.379 2.839 0 50 GFAA Cc1nc([C@@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)cs1 188007310 GHIYRUUUGGRKBB-INIZCTEOSA-N 382.511 2.525 0 50 GFAA Cc1nn(CCN2CCCCC2)c(C)c1S(=O)(=O)N1CCc2ccccc21 192827647 KAZHVDXHFUHTCO-UHFFFAOYSA-N 388.537 2.737 0 50 GFAA O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccn(CC(F)F)n1 193937855 OHGXJDYLRGQKDP-INIZCTEOSA-N 398.841 2.605 0 50 GFAA CCn1c(-c2ccccn2)nnc1S(=O)(=O)Cc1cccc(OC(F)F)c1 195196961 ITVNSVZNUFJYIR-UHFFFAOYSA-N 394.403 2.935 0 50 GFAA Cn1nc(C(F)F)cc1C(=O)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 1506399738 DANZTZZCWHGASR-UHFFFAOYSA-N 376.367 2.792 0 50 GFAA CCOc1cc(Br)cc(/C=C2/C(=O)N(CC)C(=S)N2C)c1O 1113565 KCJUDIRKKQLCPO-XFFZJAGNSA-N 385.283 2.973 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCC[C@@]4(CCc5cnc(N)nc54)C3)cc2c1 1704315334 SLOAOMWKTXCQNX-OAQYLSRUSA-N 377.448 2.669 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@@](C)(CO)C2)ccc1F 1704331306 QVCAHNHOLSIIEO-HXUWFJFHSA-N 391.443 2.790 0 50 GFAA COc1ccc(C(=O)N2CCCN(C(=O)Cc3c(F)cccc3F)CC2)cc1 1772702271 RAJAFNPGRFNYPG-UHFFFAOYSA-N 388.414 2.891 0 50 GFAA Cc1ccc2oc(CN3CCCN(C(=O)[C@H]4CCC(=O)NC4)CC3)c(C)c2c1 1775979615 KHBVYQJZUVPUBX-KRWDZBQOSA-N 383.492 2.610 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(Cc3cnn(C)c3)CC2)c1 12024616 XQXOCMFZQRJGTC-UHFFFAOYSA-N 398.507 2.708 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)Cc4cccnc4)C3)C2=O)c1 12440515 YVWXSFHUMFQJSW-QHCPKHFHSA-N 377.488 2.974 0 50 GFAA NC(=O)C1CCN(C(=O)C[C@H](c2ccccc2)c2ccc3c(c2)OCO3)CC1 12480384 SSQIBDZIGUCVHF-GOSISDBHSA-N 380.444 2.661 0 50 GFAA CCOC(=O)c1nn(CCCc2ccccc2)c2c1CN(Cc1cn[nH]c1)CC2 14741047 UPLLCUJKCHMRLU-UHFFFAOYSA-N 393.491 2.974 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@@H](OCc3cccnc3)C2)nn1 15065253 JSGIKLXNSHRUCS-HXUWFJFHSA-N 391.475 2.851 0 50 GFAA COCCCNC(=O)c1cnn(-c2ncc3c(n2)-c2ccccc2CC3)c1C 19227077 XSYYWPKDMDXRMO-UHFFFAOYSA-N 377.448 2.503 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(c3cc(N4CCCCC4)ncn3)CCN12 1857670834 FCSKTHJRVRLEDF-QFIPXVFZSA-N 393.491 2.721 0 50 GFAA Cc1nc(CCNC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)no1 1857717375 MYXFSXDSZRSXQC-LBPRGKRZSA-N 389.843 2.748 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCCn4cccn4)C3)nc2c1 1857737535 RKSCXMCKOMLQDD-INIZCTEOSA-N 397.479 2.846 0 50 GFAA O=C(O)[C@H]1CCCN1C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 238070847 UWXYIWAKVOOKPQ-CQSZACIVSA-N 380.853 2.994 0 50 GFAA O=C(c1ccccn1)N1C[C@H]2CC[C@@H](C1)N(Cc1nnc(-c3ccccc3)o1)C2 247792627 ARRKLHWUJRJWNQ-WMZOPIPTSA-N 389.459 2.868 0 50 GFAA CN(Cc1nccn1CC(F)(F)F)S(=O)(=O)[C@H]1C[C@@H]1c1cccc(F)c1 914054873 LGKHDVZHYIRKSD-KGLIPLIRSA-N 391.390 2.902 0 50 GFAA O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccccc1)c1ccc2c(c1)CCO2 837858697 ZJNJMCSOFGCGOB-GOSISDBHSA-N 379.412 2.652 0 50 GFAA Cc1ccc(OC2CCN(C(=O)CC[C@@H]3C[C@H](C(=O)O)CO3)CC2)cc1C 2325760477 VSFVDIAOTJORAN-FUHWJXTLSA-N 375.465 2.943 0 50 GFAA NC1(c2cccc(NC(=O)c3ccc(Cc4nc[nH]n4)cc3)c2)CCOCC1 2325859031 LJZFRIAIPWYNKT-UHFFFAOYSA-N 377.448 2.612 0 50 GFAA CCCn1c(=O)n(CC(=O)N2CC[C@H](CN)c3ccccc32)c2ccccc21 2325859219 RGZKGWYWHMCEPD-MRXNPFEDSA-N 378.476 2.692 0 50 GFAA Cc1nnc(SCc2nc3ccccc3c(=O)n2-c2ccccc2Cl)n1N 643483 BQCMUZBRGIQEAZ-UHFFFAOYSA-N 398.879 2.945 0 50 GFAA Cc1ccnc(-n2c(CN3C(=O)c4ccccc4C3=O)nc3ccccc3c2=O)c1 1178044 ABZVQSHYQKFIGY-UHFFFAOYSA-N 396.406 2.885 0 50 GFAA O=C(N[C@@H]1COc2ccccc2C1)c1cc2c(s1)C1(CCNCC1)OCC2 2356162945 VASOWSSNMGBIME-INIZCTEOSA-N 384.501 2.633 0 50 GFAA O=C(c1cc(CN2CCC[C@H](O)C2)on1)N1CCC(Cc2ccccc2)CC1 67604592 FCPBTZKDRZSJGQ-IBGZPJMESA-N 383.492 2.726 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CN3CCCCCCC3)C2=O)c1OC 67758122 FDZYOEPOVYSVJR-QFIPXVFZSA-N 390.524 2.823 0 50 GFAA COC[C@@H](C)N1CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC1 39518634 OOWSXVHEVLEYHK-OAHLLOKOSA-N 397.947 2.510 0 50 GFAA O=C(Nc1ccc(-n2cccn2)c(F)c1)[C@H]1CCCN(C(=O)c2ccncc2)C1 172840642 IIJQZGFXPMKXDZ-INIZCTEOSA-N 393.422 2.897 0 50 GFAA CCO[C@@H](C)c1noc(CN2CCC(NC(=O)c3cc(C)oc3C)CC2)n1 120657316 MJDKUEJSVFACJH-AWEZNQCLSA-N 376.457 2.771 0 50 GFAA CCOc1cccc(CN2CC[C@@H]3[C@@H](CCC(=O)N3CCc3c[nH]cn3)C2)c1 72433309 PVEITTVUBUJPPQ-GHTZIAJQSA-N 382.508 2.864 0 50 GFAA COC[C@@H](Nc1nc(-c2ccccn2)nc2c1c(C)nn2C)c1ccccn1 72418099 IGVRUGYFYPOWIA-MRXNPFEDSA-N 375.436 2.928 0 50 GFAA COC(=O)c1n[nH]c2c1CN(C(=O)CCc1ccc(OC(F)(F)F)cc1)CC2 456357637 VMEZPCPHACBHTR-UHFFFAOYSA-N 397.353 2.612 0 50 GFAA COc1ccc(OC2CCN(C(=O)C3CC3)CC2)c(C(=O)N2CCCCO2)c1 76857468 VDNWFBCXZQOVPK-UHFFFAOYSA-N 388.464 2.643 0 50 GFAA CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)c1cc(N2CCOCC2)ccn1 132368292 HTFZCOGCXRCKTM-UHFFFAOYSA-N 377.448 2.581 0 50 GFAA O=C(CCC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1)N1CCC(O)CC1 378481808 BNSNLPFFWPBQDT-INIZCTEOSA-N 376.472 2.685 0 50 GFAA COCCN1CCC(CNC(=O)c2nn(-c3c(F)cccc3F)cc2C)CC1 241644738 PTAGWQBMPIUPLK-UHFFFAOYSA-N 392.450 2.547 0 50 GFAA CC[C@H]1[C@@H](CO)CCN1C(=O)Nc1ccc(Cl)c(F)c1N1CCOCC1 455426952 ZRGBQEWWLGPHTM-DOMZBBRYSA-N 385.867 2.940 0 50 GFAA CC(C)(C)S(=O)(=O)CC(=O)NC[C@H]1CCCCN(Cc2ccccc2)C1 291209016 NRQCXORNUOAQEM-GOSISDBHSA-N 380.554 2.618 0 50 GFAA Cc1nn(-c2cccc(C(=O)NCCCn3ccnc3)c2)c(=O)c2ccccc12 426379701 KNBYCVQRIBHLHG-UHFFFAOYSA-N 387.443 2.711 0 50 GFAA COc1ccc([C@@H](CC(=O)NC2CCS(=O)(=O)CC2)c2ccccc2)cc1 95520003 KDYJKHMEAALINM-FQEVSTJZSA-N 387.501 2.911 0 50 GFAA CN(Cc1ccccc1CN1CCCC1)C(=O)Nc1cccc(CC(N)=O)c1 97532534 JELXPTADYACKTB-UHFFFAOYSA-N 380.492 2.974 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@]3(CCC(=O)N(C4CC4)C3)C2)c(C)s1 91907880 SPYLWWYWTFEZBN-SFHVURJKSA-N 382.551 2.921 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)COc2ccccc2Cl)C1 95518385 NAVLDYQSDDPWEU-OAHLLOKOSA-N 377.872 2.968 0 50 GFAA COCCN(C)c1ccc(CNC[C@H]2CCN(c3ccccc3OC)C2)cn1 239869306 CYAZSJDNAQCQLC-LJQANCHMSA-N 384.524 2.789 0 50 GFAA O=C(c1cc(Cl)ccc1OC1CCN(C2CCCC2)CC1)N1CC(O)C1 95508020 HAAJDZYUPOYPPI-UHFFFAOYSA-N 378.900 2.943 0 50 GFAA COc1ccccc1CN1C[C@H](c2nc(CC3CCN(C)CC3)no2)CCC1=O 91586622 GVPCZBHFJOPHOE-GOSISDBHSA-N 398.507 2.869 0 50 GFAA CC(C)NC(=O)c1ccc(C(=O)NCC2CCN(c3ccncc3)CC2)cc1 180551154 DTZITDDITREAEQ-UHFFFAOYSA-N 380.492 2.866 0 50 GFAA O=C1CC[C@]2(CCCN(c3ncnc4[nH]cnc34)C2)CN1CCc1ccccc1 91643318 CIMWHQFQQJFFOU-JOCHJYFZSA-N 390.491 2.805 0 50 GFAA C[C@H]1CCCN1S(=O)(=O)c1cccc(C(=O)N(C)Cc2nccs2)c1 95372293 FKKLXWITAXDHLU-ZDUSSCGKSA-N 379.507 2.588 0 50 GFAA O=C(CCn1cc(Cl)cn1)N1CC[C@]2(CCCN(CC3CCC3)C2=O)C1 91459258 KMPUGQXVSCXIDG-LJQANCHMSA-N 378.904 2.568 0 50 GFAA CCn1ncnc1[C@@H](C)NC(=O)c1cnc(CSc2ccccc2)nc1O 91586942 XDYHFNPGIQHNNL-GFCCVEGCSA-N 384.465 2.577 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)Nc4ccc5c(c4)OCO5)c3CO2)cc1 263617793 PQXMKADWXHBNSV-GOSISDBHSA-N 394.387 2.539 0 50 GFAA Cc1cc(C)n(CCC(=O)N(Cc2ccccc2C)C[C@@H]2CCCO2)c(=O)n1 55280780 KKJUVHYNSRPWGP-FQEVSTJZSA-N 383.492 2.766 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](c2nnc3sc(-c4cccc(Cl)c4)nn23)C1 825591164 UFLUVGVSLPISQT-LLVKDONJSA-N 397.913 2.645 0 50 GFAA CCc1[nH]c(-c2ccc(Cl)cc2)nc1C(=O)N1CCOC[C@H]1c1nc[nH]n1 952961813 JLRHNANINNJAJL-AWEZNQCLSA-N 386.843 2.624 0 50 GFAA CC(C)(C)C[C@H](O)CC(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894985 VVJFVHROYQGQQV-QGZVFWFLSA-N 383.496 2.827 0 50 GFAA Cn1nc(C(F)(F)F)c(NC(=O)c2ccnc(O[C@H]3CCOC3)c2)c1Cl 953099088 RGWYQUAIAWLLOI-VIFPVBQESA-N 390.749 2.907 0 50 GFAA CCOc1cccc(-c2nc(CC3CCN(C)CC3)n(-c3ccn(C)n3)n2)c1 1875330729 AQWUBIJXPGGJKG-UHFFFAOYSA-N 380.496 2.951 0 50 GFAA c1csc(CN2CCC(NCc3cnc(NC[C@H]4CCCO4)nc3)CC2)c1 952960381 PAECIHNHPRKIJT-GOSISDBHSA-N 387.553 2.883 0 50 GFAA CN(C(=O)c1ccccc1OC[C@H]1C[N@]1Cc1cnn(C)c1)c1ccccc1 1875385099 MRAGOCZAWOMNAB-BCHFMIIMSA-N 376.460 2.960 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)Cc1n[nH]c2c1CCCC2 1875401537 KYQXMGXFHHKTPE-AUUYWEPGSA-N 398.511 2.709 0 50 GFAA O=C(Cc1ccc(NC(=O)C2CCN(C(=O)C3CCCC3)CC2)cc1)NC1CC1 952981665 OKCPMCUFYTXFGI-UHFFFAOYSA-N 397.519 2.875 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12 952868545 ACSWNGQNIHXBFH-NRFANRHFSA-N 389.499 2.946 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(CCO[C@H]3CCCC[C@H]3C)C2)ccn1 886072080 NTPADHSHVRPWRP-HBGVWJBISA-N 375.513 2.766 0 50 GFAA Cc1noc([C@H]2CN(C(=O)NCc3cn(-c4ccccc4)nc3C)C[C@@H](C)O2)n1 888099925 DKVKZJGUJZVQET-FZKQIMNGSA-N 396.451 2.544 0 50 GFAA Cc1nc2ccccc2c(C)c1CC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 186669061 IAPHAUOZFXFVGM-QGZVFWFLSA-N 383.492 2.792 0 50 GFAA CCc1cc(N(C)Cc2nnc(-c3ccccc3)o2)nc(N2CCOCC2)n1 1529098418 FRQSKTSMIMCNAF-UHFFFAOYSA-N 380.452 2.562 0 50 GFAA Cc1cc2c(c(-c3cnccn3)c1)O[C@H](CNC(=O)Cc1c(C)noc1C)C2 12080191 SROBWNKLNRHDOU-INIZCTEOSA-N 378.432 2.719 0 50 GFAA CCn1nc(C)c(CNCc2c(C(=O)N3CCCC3)nc3sccn23)c1C 12438507 FTTJYBANQPXFDY-UHFFFAOYSA-N 386.525 2.755 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 14950756 LLOHWHMIWGENGS-FQEVSTJZSA-N 389.402 2.916 0 50 GFAA Fc1cccc(-c2cnnc(NC[C@H](c3ccccn3)N3CCOCC3)n2)c1 19223731 NYUKAHFRPLDMEC-LJQANCHMSA-N 380.427 2.558 0 50 GFAA O=c1c2cc(-c3ccc(F)cc3)nn2ccn1C[C@@H](O)c1ccc2c(c1)OCO2 169758085 QGEMQAQPDOSGGM-GOSISDBHSA-N 393.374 2.764 0 50 GFAA COc1ccc(C(=O)N2CC[C@@H](n3cc(-c4nc(C(C)C)no4)nn3)C2)cc1 169778166 VJPHRVVHYHWKSS-CQSZACIVSA-N 382.424 2.547 0 50 GFAA O=C(c1ccc(N2CCCC2)c(Cl)c1)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857668960 NXRUGGWGZDVSDH-IFXJQAMLSA-N 378.856 2.504 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(Cc2ncc[nH]2)CC1)N1CCCC1 1857683737 MMLBKTQXFYSWKC-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA O=C(NC1CC1)c1cc2c(s1)CCOC21CCN(c2ncc(F)cn2)CC1 1857687754 CSWOUNITIKKIDW-UHFFFAOYSA-N 388.468 2.638 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(CCC3=C(C)CCCC3(C)C)C[C@@]2(CO)C1 1857690034 STCNRXQJVUFBSW-AVRDEDQJSA-N 378.557 2.692 0 50 GFAA Cc1nc2ccc(CC(=O)N3CCC4(CC3)C[C@H](O)C[C@H](C(C)C)O4)cc2[nH]1 1857713788 NWHXEDQWRMRQPD-YLJYHZDGSA-N 385.508 2.971 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N[C@H](C)c4nc(C5CC5)no4)CC3)nc2n1 1857732185 GPXKDGMXLIXWEZ-GFCCVEGCSA-N 396.451 2.885 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875246956 ICWGJHVXZLYMAQ-HKUYNNGSSA-N 378.856 2.838 0 50 GFAA CCCN1CCC[C@]2(CCc3c(N4CCc5c(O)ncnc5C4)nc(C)nc32)C1 1875249178 JUXDZXMWUWFAHC-QFIPXVFZSA-N 394.523 2.533 0 50 GFAA COc1ccc(OC)c(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)c1 4538544 FNDNZUCZCNTWLQ-MRXNPFEDSA-N 387.413 2.826 0 50 GFAA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)C1CCN(Cc2ccccc2)CC1 263809770 MXQJURHEFUMMDQ-KRWDZBQOSA-N 383.458 2.899 0 50 GFAA COc1ccc(Oc2ccc(C(=O)N3C[C@H]4COC[C@@H](C3)CN4C)cc2)cc1 1704329262 PIBGHZMUIQDRPF-AEFFLSMTSA-N 382.460 2.890 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc3nnc([C@@H](O)C(C)C)n3c2)cc1 2100534337 DDXKAYMJZNIMIT-IBGZPJMESA-N 382.464 2.790 0 50 GFAA Cc1cccc(CNC(=O)[C@H]2CC[C@@H](O)[C@H](NC(=O)c3ccccc3)C2)c1C 2100555306 PYLMKXKMRZYVNU-CEWLAPEOSA-N 380.488 2.879 0 50 GFAA Cc1cccc(CC(=O)NCC2[C@@H]3CN(C(=O)[C@H]4C[C@@H]4C(F)F)C[C@@H]23)c1Cl 2325794803 RVDSEFVJYIWJHG-SDADXPQNSA-N 396.865 2.913 0 50 GFAA C[C@H](c1cccc(N2CCOC2=O)c1)N(C)C(=O)CC1CC(n2cnnc2)C1 2325796237 CHFJFZYYBCLTBB-KSTDHSDQSA-N 383.452 2.796 0 50 GFAA O=C(O)C[C@H]1CN(c2ncnc3[nH]c4ccccc4c23)C[C@@H](C(F)(F)F)O1 2325809015 SKLFTKCPJNZFHT-CABZTGNLSA-N 380.326 2.722 0 50 GFAA Cc1oc(C(=O)N[C@H]2CCCN(C(=O)[C@H](O)C(C)C)C2)cc1-c1ccccc1 2325828379 FUJOJFULRRFAAT-FXAWDEMLSA-N 384.476 2.993 0 50 GFAA CCc1nocc1C(=O)N1CC[C@H]([C@@H](C)Nc2ncc(Br)cn2)C1 2325841286 MWTUZBHRWCZVPU-MNOVXSKESA-N 394.273 2.752 0 50 GFAA COC(=O)c1ccc(-n2nnnc2SCC(=O)Nc2ccc(C)c(C)c2)cc1 786069 WGAIXHQCRLROGP-UHFFFAOYSA-N 397.460 2.797 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)c1 857883 KZFJPTRFUWUEOU-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA Cc1nn(CCCC(=O)Nc2nccs2)c(C)c1I 4784246 UKJXQIMKSGDVFH-UHFFFAOYSA-N 390.250 2.980 0 50 GFAA Cc1ccc(-n2ncc3c(=O)nc(SCC(=O)N4CCCCC4)[nH]c32)cc1 8584043 VRNQPCARTXBASB-UHFFFAOYSA-N 383.477 2.522 0 50 GFAA C[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)n1c(=O)[nH]c2ccccc2c1=O 9172286 SSKCDTUANZHXHS-MRXNPFEDSA-N 391.471 2.732 0 50 GFAA O=C(CCc1cn[nH]c1)N1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 11772976 CIGHCTRQZDQXTJ-OAQYLSRUSA-N 384.455 2.523 0 50 GFAA CCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1CCN1CCCCC1 12053815 HIDWYGJDICJYKE-UHFFFAOYSA-N 382.508 2.530 0 50 GFAA CCN(Cc1ccncc1)Cc1ccc(OC)cc1OC[C@H](O)CN1CCCC1 12442928 XTMSGWUHJRZTIT-OAQYLSRUSA-N 399.535 2.948 0 50 GFAA COc1cccc(CCNC(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)c1 12580192 GODLWSASOMPVKD-UHFFFAOYSA-N 395.415 2.765 0 50 GFAA O=C(NCC1CCCCC1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12580683 PEZVYVIHXMXDCV-IBGZPJMESA-N 375.557 2.796 0 50 GFAA CSc1ccccc1C(=O)N1CCC[C@H](CCC(=O)N2CCOCC2)C1 12713852 YQEOMLZJEDBYPZ-MRXNPFEDSA-N 376.522 2.900 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CNCCc2cccnc2)cc1OC 15068105 UUHTVLVZRNSING-FQEVSTJZSA-N 387.524 2.504 0 50 GFAA Cc1ccc(-c2csc(NC(=O)COCC(=O)O)c2C(=O)NC2CC2)cc1 17079302 QVQOWBHPPFDVEE-UHFFFAOYSA-N 388.445 2.655 0 50 GFAA CC[C@@H](NC(=O)C1(N2CCN(CC)CC2)Cc2ccccc2C1)c1ccncc1 20208370 APTBICJSGHTNAU-JOCHJYFZSA-N 392.547 2.824 0 50 GFAA Cc1ccccc1CN1CC[C@H]2[C@H](CCC(=O)N2CCCN2CCCC2=O)C1 20540944 XAPSQJGJXXLZBU-RTWAWAEBSA-N 383.536 2.820 0 50 GFAA Cc1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)cc(C)c1O 23374327 HIXDFCZDSGJZHW-QFIPXVFZSA-N 389.584 2.750 0 50 GFAA COc1ccccc1CN1C[C@H]2[C@@H](C1)OC(=O)N2Cc1ccc(OC)c(OC)c1 55071984 KQKSSTKDBOGAOJ-LAUBAEHRSA-N 398.459 2.918 0 50 GFAA CN(Cc1nc(C2CC2)no1)C(=O)c1cc(Cn2ccc3ccccc32)[nH]n1 67788002 RAPKBOYDPDPXGS-UHFFFAOYSA-N 376.420 2.945 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCCn2cncn2)CCCN1Cc1ccc(F)cc1 72162044 SCVJMPMKKZYIFM-HXUWFJFHSA-N 387.503 2.957 0 50 GFAA Cn1c(=O)cc(C(=O)N2CC[C@H](c3ccc(C(=O)O)cc3)C2)c2ccccc21 72169879 AACDDKBNGNMTDA-INIZCTEOSA-N 376.412 2.866 0 50 GFAA Cc1cc(C)n(CCCC(=O)N2CCN(c3ncnc4ccccc34)CC2)n1 72431033 WKRJWJRNSBVSKQ-UHFFFAOYSA-N 378.480 2.572 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3c(C)cc(C)[nH]c3=O)CC2)OC1=O 72439492 VKPPTABXESPYRL-OAHLLOKOSA-N 375.469 2.607 0 50 GFAA CCCc1nn(-c2ccccc2)c(=O)n1CC(=O)N[C@@H](C)c1nc(C)cs1 77287944 HPOFRLGERBXRIA-AWEZNQCLSA-N 385.493 2.629 0 50 GFAA Cc1ccc(OC2(C(=O)NCCN3CCc4ccccc43)CCNCC2)cc1 77421639 UKOZQVSQONBWOQ-UHFFFAOYSA-N 379.504 2.675 0 50 GFAA CN(Cc1cnn(-c2ccc(F)cc2)c1)C(=O)C[C@H]1NC(=O)c2ccccc21 77486282 JBOOVRLMVJBTHN-LJQANCHMSA-N 378.407 2.845 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 91713780 DNQXBDCUCOOKKV-QFIPXVFZSA-N 380.444 2.658 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(C(=O)CN3CCCCC3=O)CC2)C1 95361727 XAWKPIFFVJGQJR-HXUWFJFHSA-N 383.536 2.727 0 50 GFAA CCc1nc2c(N3CCC(NCc4cc(C(C)(C)C)[nH]n4)CC3)ncnc2o1 95362106 PTIMLFHGBBMESA-UHFFFAOYSA-N 383.500 2.959 0 50 GFAA CN(CC(=O)N1C[C@H]2CC[C@@H]1CN(Cc1ccccc1)C2)Cc1cccnc1 95387050 OUWANJIOMVQKPP-FCHUYYIVSA-N 378.520 2.636 0 50 GFAA CN(Cc1ccccc1)C(=O)CCC1CCN(C(=O)c2cccc(=O)[nH]2)CC1 95501908 UDXLJGAUADAOGK-UHFFFAOYSA-N 381.476 2.666 0 50 GFAA CCSc1ncc(CN2C[C@@H]3c4ccc(OC)cc4OC[C@]3(CO)C2)cn1 95505838 XAMJMQAHCSDMCG-YLJYHZDGSA-N 387.505 2.568 0 50 GFAA COc1ccc(CN2CC(c3cccnc3)C2)c(OC[C@H](O)CN2CCCC2)c1 95507731 UUUJOXVFIXUYHM-OAQYLSRUSA-N 397.519 2.525 0 50 GFAA Cc1cc(COc2ccccc2)oc1C(=O)N1Cc2nc[nH]c2C[C@@H]1C(=O)O 95517936 LSDUWIXMTWBCDH-QGZVFWFLSA-N 381.388 2.542 0 50 GFAA Cc1cc(C)c(CNC(=O)Nc2ccc(C(=O)NC[C@@H]3CCCO3)cc2)cn1 96139566 LIRIIPAKANIEPT-IBGZPJMESA-N 382.464 2.929 0 50 GFAA CCc1nnc(N2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)s1 96151582 FYCJFOCNKWNJPU-UHFFFAOYSA-N 384.513 2.656 0 50 GFAA CCN(CC)[C@H](CNC(=O)Nc1cc(C)ccc1-n1cnnn1)c1ccco1 96152759 MRRXSPZKJDSSQJ-QGZVFWFLSA-N 383.456 2.768 0 50 GFAA CC[C@@H](C)n1nccc1NC(=O)N1CCN(Cc2cccc(OC)c2)C(=O)C1 96179874 RGPFQVWIFIWMTA-OAHLLOKOSA-N 385.468 2.739 0 50 GFAA CC(C)N1CCC2(CC[C@H](CNC(=O)c3ccccc3-c3nc[nH]n3)O2)CC1 97578999 XCEDMLKLKNVNKL-MRXNPFEDSA-N 383.496 2.624 0 50 GFAA C[C@@H](C(=O)N(C)Cc1cccc(F)c1)N1CCC(CN2CCCCC2=O)CC1 118851820 OHYVKWJJOTZHIE-KRWDZBQOSA-N 389.515 2.897 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)Cc4cccc(F)c4)nnc23)n1 169775930 LQSJVIAZXBQZGW-UHFFFAOYSA-N 394.410 2.901 0 50 GFAA CCn1c(=O)c2ccccc2n2c(CNc3cc(Cl)ccc3CO)nnc12 170080000 NAXCNKKBFJWHQL-UHFFFAOYSA-N 383.839 2.822 0 50 GFAA C[C@H]1C[C@H](O)CN1c1cnn(CCOc2ccc(Cl)cc2)c(=O)c1Cl 170088627 QPLRDDVAKQRSJZ-AAEUAGOBSA-N 384.263 2.589 0 50 GFAA COCCOCCOCCCNC(=O)[C@@H]1CCCCN1Cc1cccc(C)c1 170597538 LRFQAMILCZTJFI-NRFANRHFSA-N 392.540 2.535 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCC[C@H]4C(=O)NC[C@H]43)cc12 170609925 YIXOMQOITNMJMP-NVXWUHKLSA-N 394.500 2.805 0 50 GFAA C[C@H]1Oc2ccccc2O[C@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 192566436 HBVPHAXSOXGVAQ-FOIQADDNSA-N 398.434 2.729 0 50 GFAA O=S(=O)(Cc1ccccc1F)N[C@@H]1CCOC[C@H]1OCc1ccccc1 223686660 ICVHYSOSEJDOJX-RTBURBONSA-N 379.453 2.619 0 50 GFAA COC(=O)NCCc1ccc(S(=O)(=O)N[C@H](C)c2ccc(C)cc2)s1 252504544 VKAJECPOAQFNEI-CYBMUJFWSA-N 382.507 2.995 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263615348 BWXLBBHGQTUEJR-QGZVFWFLSA-N 390.491 2.536 0 50 GFAA O=C(Nc1cnn(CCN2CCOCC2)c1)c1ccc(Oc2cccnc2)cc1 264357345 YAZHRYNTBCPTDT-UHFFFAOYSA-N 393.447 2.655 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 268890013 JHZAPNACRUYFMX-PMACEKPBSA-N 378.428 2.984 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)Nc3cccc(-c4noc(C)n4)c3)C2)n(C)n1 277913611 PDYXVJUZPIKJJF-KRWDZBQOSA-N 395.467 2.877 0 50 GFAA O=C([C@H]1CCc2[nH]nnc2C1)N1CCN(C2c3ccccc3-c3ccccc32)CC1 284886824 SGLIDVLOSNWTQM-INIZCTEOSA-N 399.498 2.824 0 50 GFAA Cn1cncc1CNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 291247400 OSHFINYKSQITLI-OAHLLOKOSA-N 381.263 2.648 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CC[C@@H]4OCc5cnnn5[C@H]4C3)o2)c1 299764377 SCAXPXPEKIKVHU-WMZOPIPTSA-N 380.404 2.533 0 50 GFAA Nc1ncc(-c2ccc(C(=O)N3CCCC[C@H]3CCn3cccn3)cc2)cn1 426677761 ROKLSSKGIGYXJG-IBGZPJMESA-N 376.464 3.007 0 50 GFAA Cc1ccc(NC(=O)c2ccc(OC(C)C)nc2)cc1C(=O)N1CCOCC1 487081386 AOBPFQCYLSZMJV-UHFFFAOYSA-N 383.448 2.902 0 50 GFAA O=C(NC[C@@H](c1cccnc1)N1CCCCC1)N1CCC(c2cc[nH]n2)CC1 584889124 KNONFNRQFQOAEB-FQEVSTJZSA-N 382.512 2.921 0 50 GFAA COCCCNC(=O)C[C@H](c1ccc(OC)cc1)c1cc2c(cc1O)OCO2 824390213 SGDNEWKPTRFBHV-MRXNPFEDSA-N 387.432 2.804 0 50 GFAA O=C(OCc1cccc2c1CCOC2)[C@@H]1CCCN(C(=O)c2ccncc2)C1 869500165 BJCMENPVTQNQBX-QGZVFWFLSA-N 380.444 2.750 0 50 GFAA CN1C(=O)COc2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCO3)cc21 952970820 BZNOOFZKTIBBAP-OAHLLOKOSA-N 382.416 2.852 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N(Cc1ccccn1)C[C@H]1CCCO1 952981541 IDTQLCWYBIUTAD-GOSISDBHSA-N 377.444 2.604 0 50 GFAA COc1cc2c(cc1CN1CCCN(C(=O)c3ccco3)CC1)OCCCO2 1506423164 UJKOLSKJMRKVDP-UHFFFAOYSA-N 386.448 2.798 0 50 GFAA O=C(c1nnc2n1CCCCC2)N1CCCN(c2nc3ccccc3s2)CC1 1506428539 XPQPWEFSDROXMM-UHFFFAOYSA-N 396.520 2.967 0 50 GFAA CC(C)C(=O)N[C@H]1CCOC2(CCN(C(=O)c3cc4c([nH]3)CCCC4)CC2)C1 1775997484 KWDMLEAQSYBNIX-KRWDZBQOSA-N 387.524 2.820 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)c4ccoc4)C[C@]34CC[C@H]2O4)cc1 1857726482 TUJVILGOOZSRMP-JZJXAQOMSA-N 380.444 2.638 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N[C@@H](C)c4nc(C5CC5)no4)CC3)nc2n1 1857732186 GPXKDGMXLIXWEZ-LBPRGKRZSA-N 396.451 2.885 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)N1C[C@@H]2C[C@H](O)[C@H]2C1 1875268045 COLYPVMBKVZAFP-CQDKDKBSSA-N 384.436 2.588 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(c3nccc(-n4ccnc4)n3)C[C@@H]21 1875273615 UFQPIGVJJRMTMR-QZWWFDLISA-N 396.495 2.744 0 50 GFAA C[C@H](CC(=O)NCc1cn([C@H]2C[C@H](C(=O)O)C2)nn1)Cc1ccc(Cl)cc1 1875306131 UQPAMCMMEGLOQO-JDFRZJQESA-N 390.871 2.852 0 50 GFAA NC(=O)c1ncn2c(-c3ccccc3)cc(C(=O)Nc3ccc(F)cc3)nc12 1875350390 KUCLWYNPHFWHPQ-UHFFFAOYSA-N 375.363 2.887 0 50 GFAA O=C(c1ccccn1)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940196580 TZNXWRXHPMUKQC-UHFFFAOYSA-N 387.443 2.759 0 50 GFAA CC(C)(C)NS(=O)(=O)Cc1cccc(-c2nc(Cc3ccno3)no2)c1 2325735995 WJDGWDCKWIFFLN-UHFFFAOYSA-N 376.438 2.533 0 50 GFAA O=C(CCCNC(=O)c1cccs1)NCC(=O)N[C@@H]1CCCc2ccccc21 2325783494 AJEXIQRCDSBFQE-QGZVFWFLSA-N 399.516 2.568 0 50 GFAA Cc1nc(N[C@@H]2C[C@H](Cn3cc(Cl)cn3)C[C@H]2O)cc(-c2ccccn2)n1 2325785851 QEBSYVZEUBTNKV-MORSLUCNSA-N 384.871 2.949 0 50 GFAA CC[C@H](C(N)=O)N1CC[C@@]2(CCN(C(=O)c3coc4cc(C)c(C)cc34)C2)C1 2325793778 HMLYZMRKYPXKGA-XMSQKQJNSA-N 383.492 2.852 0 50 GFAA CC1(C)C[C@@H](S(N)(=O)=O)CN1C(=O)c1c(C(F)(F)F)oc2ccccc12 2325810980 VHAFOAJROKKZFM-SECBINFHSA-N 390.383 2.733 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)c1sc2c(c1Br)CNC2 2325856409 OOORWNBPJHBCIV-UHFFFAOYSA-N 390.266 2.947 0 50 GFAA O=C(O)[C@H]1c2ccc(F)c(F)c2CCN1C(=O)c1cc(-n2ccnc2)ccc1O 2325875712 ACVJIHZGUJPIRR-GOSISDBHSA-N 399.353 2.680 0 50 GFAA O=C(O)[C@H](Cc1csc(Br)c1)NC(=O)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 2325875920 FTEPQQCFVSEAMR-YERPJTIDSA-N 384.295 2.915 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCc3cnccn3)C2=O)cc1 2356134617 UXOFKXRTAVQDRV-JOCHJYFZSA-N 378.476 2.906 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCN[C@H](c2ccccc2)C1 2356152752 ZOQTVZUKORKJOT-SFHVURJKSA-N 397.544 2.686 0 50 GFAA O=C(NCc1cccnc1-n1cncn1)c1ccc(-c2cncc3nc[nH]c23)cc1 2356167460 PDUGBVQSBKAZHQ-UHFFFAOYSA-N 396.414 2.531 0 50 GFAA COc1ccc2c(c1)C=C(CN1CCC[C@@]3(CCc4c[nH]c(=N)nc43)C1)CO2 2356144624 GLHZECJWKNJRCE-JOCHJYFZSA-N 378.476 2.654 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2ncsc2c1 2356149745 UIILJXNBGBTSNS-ROUUACIJSA-N 392.484 2.749 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@@H](NCCc3ccc(Cl)cc3)C2=O)cc1 4890763 DOECSZDLQFTPSZ-GOSISDBHSA-N 385.851 2.763 0 50 GFAA Cc1ccc(C)c(OCC(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)c1 6702955 IRMPTIPAFCIALN-UHFFFAOYSA-N 381.476 2.709 0 50 GFAA COc1ccc(-c2noc([C@@](C)(O)CN3Cc4ccccc4C3=O)n2)c(OC)c1 225507158 QIHRGHWKOAWFHV-NRFANRHFSA-N 395.415 2.617 0 50 GFAA COc1ccc([C@H]2c3[nH]c4ccccc4c3C[C@H]3C(=O)N(C)C(=S)N32)cc1O 22018287 KDBIECCTXGPLJB-KXBFYZLASA-N 393.468 2.955 0 50 GFAA O=C(c1cnccn1)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67921492 VZCBNQJYHVDHDN-UHFFFAOYSA-N 382.807 2.932 0 50 GFAA CC(C)N1CCO[C@H](CN2CCN(C(=O)Nc3cc(Cl)ccc3F)CC2)C1 117437918 CLAKWCLLFXFNJL-MRXNPFEDSA-N 398.910 2.738 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)C1 136111130 HMXIASVYYSIJHR-ZDUSSCGKSA-N 382.445 2.933 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)CN2CCOC2=O)CCO3)s1 67725942 IEQDWRAIWJKLML-UHFFFAOYSA-N 388.445 2.602 0 50 GFAA CNC(=O)c1cc2cc(NC(=O)C(=O)N[C@H](C)c3cccc(Cl)c3)ccc2[nH]1 472562839 SJIVXQXLMWEIPP-LLVKDONJSA-N 398.850 2.997 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)[C@@H]2CCOC2)CC1 12718429 HYYRUIGDLCMQNH-MRXNPFEDSA-N 382.464 2.644 0 50 GFAA COc1ccc(-c2c3c(=O)n(-c4ccccn4)ccc3nc3nc(C)nn23)cc1 38828797 SNXQUCCYKNKLSL-UHFFFAOYSA-N 384.399 2.807 0 50 GFAA Cc1[nH]c(=O)c(C(=O)N[C@H]2CC(=O)N(C3CCCCCC3)C2)c(C)c1Cl 72143307 BYEFBSJDPLGXCM-ZDUSSCGKSA-N 379.888 2.699 0 50 GFAA Cc1cc(C)n2c(CNC[C@@H]3CCc4nc(C(F)(F)F)cn4C3)cnc2n1 328655647 YPSYCRQYNWWONJ-ZDUSSCGKSA-N 378.402 2.914 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2csc([C@@H]3CCCO3)n2)C1 328606722 SPDDQZIVOIEYTQ-CJNGLKHVSA-N 389.525 2.799 0 50 GFAA O=C(OC[C@@H]1CCCCN1Cc1cn(Cc2cccnc2)nn1)N1CCCCC1 368037930 NYVZVOFGHYFPDJ-FQEVSTJZSA-N 398.511 2.698 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N[C@H](C)C(C)C)c2=O)cc1 77355936 BFAGPOREHFDWRP-MRXNPFEDSA-N 394.475 2.870 0 50 GFAA Cc1cnc2c(C(=O)N3CCC[C@H](Cc4ccc(C(=O)O)cc4)C3)cnn2c1 72156891 YXRRCFUUVBSYKB-MRXNPFEDSA-N 378.432 2.831 0 50 GFAA O=C(Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1)N1CCN(C2CC2)CC1 175000216 COBJIQXSNFUCNG-UHFFFAOYSA-N 387.875 2.505 0 50 GFAA COc1nccnc1-c1ccc(C(=O)N2CCC[C@H](c3ccncn3)C2)cc1 426489309 CTRNRBLXZJWDKR-KRWDZBQOSA-N 375.432 2.962 0 50 GFAA Cc1nc(CN2CCN(C(=O)c3cccc(-c4ccncc4C)c3)CC2)no1 426574876 JJGHOHXSGSYQTC-UHFFFAOYSA-N 377.448 2.706 0 50 GFAA CCOc1ccc(Cl)cc1CN(C)C(=O)[C@H]1CCCN(C(=O)COC)C1 97156154 CZKYQKXYSCAFNT-AWEZNQCLSA-N 382.888 2.582 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N2CC[C@H](N)C2)c1 95519269 STTBUBXANRTVMM-INIZCTEOSA-N 387.524 2.654 0 50 GFAA COc1nc(C)cc(C)c1CNC1CCN(c2cc(C)nc(N(C)C)n2)CC1 95501827 BVOLZWPHQKMPLU-UHFFFAOYSA-N 384.528 2.630 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CCC(=O)N(CCCn4ccnc4)C3)CC2)n1 91914787 VRVIEPKPFUWNCN-UHFFFAOYSA-N 395.507 2.522 0 50 GFAA CCN1CCN(C[C@@H](O)COc2cccc(CN(C)CC(C)(C)C)c2)CC1 95512465 GQXFXYWZOTVPLY-HXUWFJFHSA-N 377.573 2.542 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C(=O)c1cnc(-c2ccccn2)nc1O 91586171 JEYGRBBGNSNGHV-UHFFFAOYSA-N 388.387 2.566 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1OC(F)F 239637008 BIGADBIRMVIQAA-CYZMBNFOSA-N 394.374 2.575 0 50 GFAA COCCN1CC[C@@]2(CCC1=O)CN(Cc1ccc(Cl)s1)CCN2C 95390441 DHRBFRIGYGCLHZ-SFHVURJKSA-N 385.961 2.547 0 50 GFAA Cc1ccc([C@@H]2[C@H](C(=O)OC(C)C)C(=O)C[C@](C)(O)[C@H]2C(=O)OC(C)C)cc1 244691874 JKLWHFRPHNOWMT-YXTQBTIXSA-N 390.476 2.938 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C(=O)N1c1ccc(I)cc1 243915063 BMJVLFNSTCZFLG-GXYBRJDSSA-N 391.208 2.849 0 50 GFAA CC(=O)c1ccc(NC(=O)N[C@@H](CC(C)C)c2nc(-c3nnc[nH]3)no2)cc1 182600815 JGPWIPUWEIGBSH-AWEZNQCLSA-N 383.412 2.966 0 50 GFAA COCCN1Cc2cc(C(=O)Nc3cc(F)ccc3F)ccc2OCC1=O 263616984 LMPCQIZJPSKRMH-UHFFFAOYSA-N 376.359 2.585 0 50 GFAA CCc1nc(CN2CCN([C@@H](C)c3nc(-c4ccc(C)cc4)no3)CC2)n[nH]1 185184446 UTZWZVFQDGOPJC-HNNXBMFYSA-N 381.484 2.604 0 50 GFAA COc1ccc(C)nc1-c1cccc(C(=O)N2CCN(c3ncccn3)CC2)c1 299778021 OMMDXSOXIBIMTH-UHFFFAOYSA-N 389.459 2.818 0 50 GFAA CC(C)N1CCO[C@H](CC(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)C1 827812437 FEQGHHPGXUVGON-OAHLLOKOSA-N 378.904 2.764 0 50 GFAA CCn1ncnc1CN1CCC[C@H](CNC(=O)CCc2c[nH]c3ccccc23)C1 823609882 WNNXWAPDVAXHAL-QGZVFWFLSA-N 394.523 2.740 0 50 GFAA O=C1CC[C@@H](Cn2nnc(-c3ccc(Br)cc3C(F)(F)F)n2)O1 864097115 KNTHXTYYFZSFPJ-QMMMGPOBSA-N 391.147 2.827 0 50 GFAA CC1(C)CN(C(=O)NCc2ccc(O)nn2)[C@@H]1c1nccn1Cc1ccccc1 952892653 PIHOJGGCQHTEOC-GOSISDBHSA-N 392.463 2.720 0 50 GFAA O=C(NC[C@@]12CC[C@@](CO)(CO1)C2)c1cc(-c2ccccn2)nc2ccccc12 1875299600 PPIPSCZUZGFCNC-PKTZIBPZSA-N 389.455 2.958 0 50 GFAA O=C1CCN(CCCc2ccc(Cl)s2)C(=O)N1CC1(n2cncn2)CC1 1875298474 BRNWPXPTQOEUJV-UHFFFAOYSA-N 393.900 2.769 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c1nn(C)c2C(=O)N1CCC(O)(C2CCCCC2)CC1 1875314634 JUQYEMBWTVLXMP-CABCVRRESA-N 375.513 2.990 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)C2CC(F)(F)C2)C1)c1ncoc1-c1ccccc1 1875332373 YREBADXXYWOUQK-CQSZACIVSA-N 375.375 2.718 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N=[S@@]3(=O)CCC[C@]4(CCCN4)C3)cnc21 1875393594 PXRAERWZYZUHAQ-XHCCPWGMSA-N 389.525 2.612 0 50 GFAA Cc1nc([C@H](C)N(C)S(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c(C)s1 952978424 ZLTSLTTZRUISAH-VIFPVBQESA-N 381.479 2.587 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@H](c3c(OC)cccc3OC)C2)c1 408525714 WNEWLPJWIMNAIT-INIZCTEOSA-N 390.461 2.823 0 50 GFAA CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc(Br)nc2)CC1 222252229 NJBUKHATDHIPII-UHFFFAOYSA-N 384.274 2.927 0 50 GFAA C[C@@H]1CN(C[C@@H]2CCCN2C(=O)Nc2ccc([S@](C)=O)cc2)C[C@@H](C)O1 170014491 RPIAJMJOPXQZEP-COVFZUJOSA-N 379.526 2.530 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)[C@H](C)n1ccc2ccccc2c1=O 279157445 HWRUZJGAGWNYPB-INIZCTEOSA-N 392.459 2.741 0 50 GFAA CCn1ccnc1[C@H]1CCCCN1S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 1322498946 XUPDBXTYDZOJBD-QGZVFWFLSA-N 388.493 2.704 0 50 GFAA Cc1cccnc1C(=O)NS(=O)(=O)c1cccc(Cl)c1Br 755899388 LOAACJOEDZYODL-UHFFFAOYSA-N 389.658 2.925 0 50 GFAA CC[C@H]1CN(S(=O)(=O)c2cc(C(=O)O)c(Cl)cc2F)CCN1C(C)C 1506407985 AHXJEMJSPVJEQI-NSHDSACASA-N 392.880 2.671 0 50 GFAA Cc1cc(S(=O)(=O)NCCc2noc([C@@H]3CCCO3)n2)c(Cl)cc1F 1506407394 RNYBCYFQEDGXQC-LBPRGKRZSA-N 389.836 2.543 0 50 GFAA COc1ccc(C(=O)N2CCCN(Cc3sccc3C)CC2)c(OC)n1 1772817859 YAYQCQPFXCAUFH-UHFFFAOYSA-N 375.494 2.817 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(N(C)Cc3cc(C)no3)nc2)CCN1C(C)C 12593847 WWBRCZBCNGOAAP-SFHVURJKSA-N 385.512 2.959 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1cccc(O)c1)CC2 14542098 CJXGEUWHIQHCQV-UHFFFAOYSA-N 393.487 2.864 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@H](NCc3ccc(Cl)cc3)C2=O)cc1 19782467 MYMWMEKHLYUVLQ-KRWDZBQOSA-N 386.835 2.938 0 50 GFAA CCc1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(F)cc4Cl)C3)nn2)n1 169778093 PSUZDBWYYKBFAO-NSHDSACASA-N 390.806 2.770 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN(c3ccc(F)cn3)[C@H](C)C2)n[nH]1 1857679633 OKYBCXQAGDYPNY-CQSZACIVSA-N 395.438 2.970 0 50 GFAA Cc1cnc(CN2CCC3(CC2)CN(Cc2ccccc2C)C[C@@H]3C(=O)O)[nH]1 1857689514 RODMLHXYSWPLDT-LJQANCHMSA-N 382.508 2.825 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCn4nc(C)cc4C)CC3=O)sc2c1 1857697306 OJSNIQGLVXLFAH-HNNXBMFYSA-N 397.504 2.587 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCC[C@H](c2cc[nH]n2)C1 1857703461 QLEGTAJVUHAGNZ-HNNXBMFYSA-N 386.521 2.642 0 50 GFAA Cc1cccc(CN2CCOC3(CCN(Cc4cncnc4)CC3)CC2=O)c1 1857704774 FOJYIHQWUVKDMW-UHFFFAOYSA-N 380.492 2.569 0 50 GFAA Cn1cc(Cl)c(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)n1 1857706350 GNWXDCKEARWIGI-IJEWVQPXSA-N 395.290 2.671 0 50 GFAA CC1(C)COc2c(CN3CCC4(CC3)CNC(=O)CCO4)cc(Cl)cc21 1857708473 WBQVMZRAZJNKHV-UHFFFAOYSA-N 378.900 2.881 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)Cn2cc(C(=O)C3CC3)c3ccccc32)C[C@@H]1O 1857713327 VJWTXYNVXQKYSV-NZQKXSOJSA-N 398.503 2.606 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@@H](c3ccccc3F)C2)n(-c2ccccc2)n1 237981007 CLTKLCFPEVPKBB-LJQANCHMSA-N 395.390 2.923 0 50 GFAA CN(Cc1cccc(-c2nc(O)cc(C(F)(F)F)n2)c1)C[C@@H]1COCCO1 20820467 PTFCZNKANWNMSR-CQSZACIVSA-N 383.370 2.715 0 50 GFAA Cc1ccccc1OCC(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 1704328168 YFUNCHPUYKNRSN-JOCHJYFZSA-N 380.492 2.736 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(CCCOc3ccc(C(N)=O)cc3)C1)CC2 1704312614 VZAXECLRNYKCIB-QFIPXVFZSA-N 380.492 2.633 0 50 GFAA Cc1noc([C@H](C)NC(=O)[C@@H](Cc2ccccc2)N2Cc3ccccc3C2=O)n1 906461869 ZISPRLKELQVNRN-IFXJQAMLSA-N 390.443 2.823 0 50 GFAA CCOC(=O)C[C@@H]1C(=O)N[C@@H]2CCCC[C@@H]2N1C(=O)Nc1ccc(Cl)cc1 4196063 KPQPVPCXNWMUJO-OWCLPIDISA-N 393.871 2.937 0 50 GFAA O=C(CCS(=O)(=O)C1CCCC1)N[C@H]1CCc2c1cc(F)c(F)c2F 2325813079 JHWINQHYEFAUGM-AWEZNQCLSA-N 375.412 2.955 0 50 GFAA COC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Cl)cc(Br)c1OC 1158918 UZSJJHGMEFRFDH-NSHDSACASA-N 389.633 2.912 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)Nc1ccccc1F)S(C)(=O)=O 1172972 NRCQFSUAPRBHFW-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA CCCOC(=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1 1801452 MYOGSHVKYADVHW-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA COc1ccc(N([C@H](C)C(=O)NCc2ccc(Cl)cc2)S(C)(=O)=O)cc1 2980114 UEHFWGKRBAMTGJ-CYBMUJFWSA-N 396.896 2.820 0 50 GFAA COc1nc2c(cc1CN1CCC[C@@]3(CCc4c[nH]nc43)C1)C(=O)N(C(C)C)C2 2356161749 IFHGDCGMEQOZSE-JOCHJYFZSA-N 395.507 2.658 0 50 GFAA CCNS(=O)(=O)c1cc(N(C)S(=O)(=O)c2ccc(C)cc2)c(C)cc1C 4275636 WRAQDTJRFKRCGY-UHFFFAOYSA-N 396.534 2.735 0 50 GFAA Cc1ccc2nc(NC3=N[C@@H](C(=O)Nc4ccccc4)CC(=O)N3)nc(C)c2c1 8995587 UFBKHNPTUMBVFO-QGZVFWFLSA-N 388.431 2.542 0 50 GFAA CC1CCN(C(=O)C[C@@H]2C(=O)NCCN2Cc2cccc(C(F)(F)F)c2)CC1 55182602 KXIHZGZPYSSTHZ-QGZVFWFLSA-N 397.441 2.654 0 50 GFAA O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccccc1Br 100099589 JIKGUVORMWLCCS-TXEJJXNPSA-N 377.238 2.729 0 50 GFAA CN(Cc1cnc(S(=O)(=O)CC2CC2)n1CC1CCCCC1)[C@@H]1CCOC1 20878045 QXQSBBXEVQWHHT-GOSISDBHSA-N 395.569 2.868 0 50 GFAA CC(C)CN(C)C(=O)C[C@H]1C(=O)NCCN1Cc1ccccc1C(F)(F)F 55244673 CAVAPJATFYABDW-INIZCTEOSA-N 385.430 2.510 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)cc1CO 23360333 UOFPUVRPTJXAIM-IBGZPJMESA-N 390.549 2.708 0 50 GFAA O=C(c1cc(=O)c(O)co1)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1 67805201 PUGUTIUZNYLBDL-UHFFFAOYSA-N 379.416 2.679 0 50 GFAA CCOC(=O)C[C@H](NS(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1 3626803 FGJBAWRVRCPOEY-SFHVURJKSA-N 377.462 2.976 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)c(Cl)c1=O)Nc1cc(F)ccc1F 72115711 NCZKVLCMADGASH-UHFFFAOYSA-N 382.798 2.804 0 50 GFAA COc1ccc(CNC(=O)[C@H](C)N2CCC(c3nccc(C)n3)CC2)cc1OC 363772946 AQRAJCHGHCIXRY-INIZCTEOSA-N 398.507 2.687 0 50 GFAA O=C(c1ccccc1)N1CCCN(C(=O)c2cc3nccnc3cc2F)CC1 366306501 VEYVLLCXIGWRCM-UHFFFAOYSA-N 378.407 2.757 0 50 GFAA C[C@H]1CC[C@@H](C(=O)N[C@H]2CC(C)(C)C[C@@](C)(CNC(=O)[C@H]3CC[C@@H](C)O3)C2)O1 333615440 XLMYPUIANFGQKC-GFWFYGOOSA-N 394.556 2.939 0 50 GFAA CN1CCN(C(=O)c2ccc(Cl)nc2Cl)C[C@@H]1c1nc(C2CC2)no1 370293167 CQJJQWQVESTLLJ-LLVKDONJSA-N 382.251 2.778 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@@]4(CCOC4)C3)cc2)c(C)c1CCC(=O)O 237730790 CKQBVWCMSXWCMR-JOCHJYFZSA-N 397.475 2.759 0 50 GFAA O=C(NC1C[C@@H]2CC[C@H](C1)N2)c1ccc(S(=O)(=O)Cc2ccccc2)cc1 129480714 CKRXCVCUAFAEBH-DFNIBXOVSA-N 384.501 2.673 0 50 GFAA CN(Cc1ccc(F)c(F)c1)c1nnc(C2CCN(c3ncccn3)CC2)n1C 283873245 SYTDPKXMFPDDKU-UHFFFAOYSA-N 399.449 2.904 0 50 GFAA Cc1cc(C(=O)NC[C@@H](N)c2ccc(C(C)C)cc2)cc(S(N)(=O)=O)c1C 262552625 TYRKDVBHCBWDIL-GOSISDBHSA-N 389.521 2.504 0 50 GFAA O=C([C@H]1CCCN1C(=O)c1ccccc1O)N1CCC(c2ccccn2)CC1 378284222 DNGRKVFQMRRKER-LJQANCHMSA-N 379.460 2.798 0 50 GFAA CN1C[C@@H]2[C@@H](CCCN2C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)C1=O 284775243 FWNUPDODNFXXOX-QZTJIDSGSA-N 398.438 2.775 0 50 GFAA CC(C)c1nccn1Cc1cccc(NC(=O)[C@@H]2CC[C@H](C(=O)N(C)C)O2)c1 286571916 FORGJCCIBVSSPQ-ZWKOTPCHSA-N 384.480 2.629 0 50 GFAA O=c1oc2ccccc2n1Cc1cn([C@H]2CCN(Cc3ccccc3)C2)nn1 91382004 KZHZMVVUVACSPB-SFHVURJKSA-N 375.432 2.681 0 50 GFAA C[C@H](c1cccnc1)N(C)C(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C 95362134 FEHSIKUTJTXCHQ-OAHLLOKOSA-N 379.464 2.638 0 50 GFAA CC1(C)C[C@@H](CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)CCO1 95527219 FSEFPTDMSFVOCU-INIZCTEOSA-N 386.540 2.701 0 50 GFAA Cc1nc2cc(CC(=O)N3CCC[C@@H](c4nccn4CCN(C)C)C3)ccc2[nH]1 95376090 OVSIKSIUHYVFQS-GOSISDBHSA-N 394.523 2.578 0 50 GFAA C[C@H](C(N)=O)N1CCC(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)CC1 95499846 AJPIUJWPOXMYNW-CQSZACIVSA-N 391.475 2.754 0 50 GFAA CC(=O)c1cc(CN2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)n(C)c1 91452282 UPABUUAZKWNMAN-FQEVSTJZSA-N 387.524 2.611 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCN(Cc2ccccn2)CC1 95381866 QKXMSFUGYYMVIF-SFHVURJKSA-N 375.856 2.687 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N[C@@H]2CCCN(Cc3cccnc3)C2)c1 97635048 ZKCCPIHQXLRAGI-QGZVFWFLSA-N 385.443 2.965 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2cnco2)C1)NCc1ccc(F)c(F)c1 95509758 ATRPUJXKMCEXAA-CYBMUJFWSA-N 377.391 2.902 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](C(=O)O)N(C(=O)OCc3ccccc3)[C@@H]2C1 91302677 CSYNHJIDCIEPDB-HRCADAONSA-N 390.436 2.718 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 91468780 VGBUHWMCNJIVMV-UHFFFAOYSA-N 382.493 2.693 0 50 GFAA O=C(NCc1ccccc1N1CCCCC1)N1CCC(N2CCCNC2=O)CC1 183687502 CGHXXLXYRZUMOQ-UHFFFAOYSA-N 399.539 2.766 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)cc1 299388311 ZHGFCSFVZRVFJJ-PVAVHDDUSA-N 379.478 2.727 0 50 GFAA COCCN(Cc1ccccc1C)C(=O)NC1CCN(C(=O)C(C)C)CC1 534648636 CFUACDIOLDJZIG-UHFFFAOYSA-N 375.513 2.800 0 50 GFAA COC(=O)N1CCCc2cc(NC(=O)NCCc3noc(C4CC4)n3)ccc21 299798365 SQDUWBDTIBTGRY-UHFFFAOYSA-N 385.424 2.830 0 50 GFAA NCc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(NC(=O)c3ccsc3)CC2)c1 1875287264 BSAYBCMRLSTZIN-RBUKOAKNSA-N 383.517 2.731 0 50 GFAA CN(Cc1ccc([S@](C)=O)cc1)c1nnnn1Cc1cccc2c1CCC2 1875322833 JXOMYQZYBZIKHB-MHZLTWQESA-N 381.505 2.584 0 50 GFAA CCc1nnc([C@]23CC[C@H]2CCN3C(=O)c2cc(C)n(-c3cnn(C)c3)c2C)o1 1875404706 RABLJTFQTNWUEP-BTYIYWSLSA-N 394.479 2.924 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)CCc2nc3ccccc3[nH]c2=O)C[C@@H]1O 1565529420 PEOVZLXWACQWJX-KSSFIOAISA-N 397.500 2.603 0 50 GFAA CCCn1nc(C(=O)Nc2cccc(-c3ccc4c(c3)OCCO4)n2)ccc1=O 170623166 RTVXRMXOELJZBK-UHFFFAOYSA-N 392.415 2.739 0 50 GFAA Cc1cc(C(=O)N[C@H](C)c2nnnn2C2CC2)nc(-c2ccc(Cl)cc2)n1 190292374 HKJOKHDQHHNJOR-LLVKDONJSA-N 383.843 2.918 0 50 GFAA COc1ccc(CN(C)c2ccc(C(=O)N3CCOCC3)cn2)c2cccnc12 1529146512 ZXZHICDTNDSOIU-UHFFFAOYSA-N 392.459 2.747 0 50 GFAA CCCNc1ncc(CN2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)cn1 1616070949 KWZYQFSTIFBKSO-RXVVDRJESA-N 377.492 2.882 0 50 GFAA O=C1CCC2(CCN(C(=O)[C@H]3CCc4sc(-c5ccncc5)nc4C3)CC2)N1 1772811190 UJVTWZWPUHVTDW-HNNXBMFYSA-N 396.516 2.581 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)NCc4nccn4C)no3)ccc2s1 12301267 YIFCZSZWVHBOEY-UHFFFAOYSA-N 383.433 2.835 0 50 GFAA O=C(CCc1nnc(Cc2cccc(C(F)(F)F)c2)o1)N1CCC[C@H]1CO 12387408 XEHQDGPOEQJVPS-AWEZNQCLSA-N 383.370 2.595 0 50 GFAA Cc1occc1C(=O)N1CC(=O)N(Cc2ccccc2)C[C@@H](OCC2CC2)C1 14535634 PMTNKLMQOOGOIG-LJQANCHMSA-N 382.460 2.868 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)N3CCC(O)CC3)CC2)CC1 15074568 MJBICXQCTSYOBM-UHFFFAOYSA-N 399.579 2.655 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3cccc(F)c3)CC2)c(OC)c1OC 19552788 IFTNDGZXPCMXFQ-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA CC(C)CS(=O)(=O)c1ncc(CN2CCSCC2)n1Cc1ccccc1 19837590 GUXOVNKBMLRVGD-UHFFFAOYSA-N 393.578 2.910 0 50 GFAA O=C(NCc1cccs1)c1cc2n(n1)C[C@H](c1ccc3c(c1)OCO3)OC2 169771901 YSOIFCIMEGVCAB-GOSISDBHSA-N 383.429 2.875 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)Cc4ccccc4Cl)nnc3c2)n1 169776258 FOCJUYXJTORHKP-UHFFFAOYSA-N 382.811 2.600 0 50 GFAA O=C(C[C@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1ccc2cc[nH]c2c1 206240714 ZVCUTLUWFKATLY-GOSISDBHSA-N 376.416 2.660 0 50 GFAA COc1ccc(OC)c(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)c1 6477800 XIIVZSGRXWCUIW-GZTJUZNOSA-N 379.441 2.691 0 50 GFAA CO[C@H](CNC(=O)N1C[C@H](C)O[C@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 1857530079 AQHZAKHMPKMFMK-XZJROXQQSA-N 394.859 2.891 0 50 GFAA CC(C)N1C[C@@H](C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)CCC1=O 1857673509 UOVZBOVOXKJMFI-SFHVURJKSA-N 394.519 2.661 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)[C@H]3CC[C@@H](O)CC3)C1)CC2 1857697151 XTRAGVUIAUCCPV-ZCCHDVMBSA-N 387.524 2.837 0 50 GFAA COc1nccnc1N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857731245 DMEWMQMLYJOFOU-NRFANRHFSA-N 390.447 2.527 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857731603 LUBPQSFHJKRREF-VQIMIIECSA-N 381.476 2.786 0 50 GFAA N[C@@H]1C[C@H](C(=O)NC2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)C[C@H]1O 1857738469 JDUROXPXQFYNOR-MDNUFGMLSA-N 393.531 2.532 0 50 GFAA CCC(=O)N1CCC[C@@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NC(C)C)C1 1875246889 GLEAHTPWRUFAPO-JOCHJYFZSA-N 379.508 2.997 0 50 GFAA O=C(Nc1ccccc1)c1sccc1S(=O)(=O)N1CCCC[C@H]1CCO 745477092 SSJILDSEPBKDJL-HNNXBMFYSA-N 394.518 2.926 0 50 GFAA CCOc1ccc(-n2c(SCC(=O)Nc3nnn[nH]3)nc3ccccc32)cc1 253416703 BGDYMUMMYZQPAF-UHFFFAOYSA-N 395.448 2.668 0 50 GFAA COc1ccc(OC)c(NC(=O)C(=O)NC2CCN(C3CCCCC3)CC2)c1 267001553 CNEUGMRXMHOVFF-UHFFFAOYSA-N 389.496 2.556 0 50 GFAA CCN(Cc1ccccc1)S(=O)(=O)N1Cc2ncccc2N2CCC[C@H]2C1 908253199 BEFJDGPEMHDIFM-SFHVURJKSA-N 386.521 2.633 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)Cn3nc(C(F)F)cc3C3CC3)CCN2)c1 825207358 GCNKBRHYDWRMMW-KRWDZBQOSA-N 390.434 2.880 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2100477158 KUNCCPSFWUNNJP-JOCHJYFZSA-N 389.459 2.755 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)c2ccc3nc(C(F)(F)F)[nH]c3c2)C[C@@H]1O 2100547908 RQKYACPRHGJGDW-GUYCJALGSA-N 399.369 2.660 0 50 GFAA CC(C)S(=O)(=O)Cc1ccc(C(=O)N2CCN(c3ccccc3)CC2)o1 1857797817 VYBRBOSDMYCNDO-UHFFFAOYSA-N 376.478 2.565 0 50 GFAA Cc1cccc(-c2n[nH]c(NC(=O)c3ccc(CN4CCSCC4)cc3)n2)n1 2325702141 JOFVQCLZOCNSMN-UHFFFAOYSA-N 394.504 2.976 0 50 GFAA Cn1cnnc1C1CCN(C(=O)[C@H]2CN(Cc3ccccc3)C(C)(C)C2)CC1 2325807867 ZONCEZCMXDBIJR-LJQANCHMSA-N 381.524 2.822 0 50 GFAA COc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1 800952 WIXHFNOISZHPQM-UHFFFAOYSA-N 384.417 2.538 0 50 GFAA S=C(NCc1ccccc1)N1CCN(C(=S)NCc2ccccc2)CC1 2799601 BNAJSYIDNBCHKD-UHFFFAOYSA-N 384.574 2.753 0 50 GFAA CC(=O)Oc1ccc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 9111342 GRJYWNXLFDMZRW-UHFFFAOYSA-N 390.442 2.877 0 50 GFAA CC(=O)c1cccc(N(CC(=O)N2c3ccccc3C[C@H]2C)S(C)(=O)=O)c1 10449850 PXCBFEMKFLCWDZ-CQSZACIVSA-N 386.473 2.633 0 50 GFAA O=C1NCCN(C2CCCC2)[C@H]1CC(=O)N(Cc1ccccc1)CC1CCC1 12207469 SAIDIXYKPIWABV-NRFANRHFSA-N 383.536 2.948 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3cn(Cc4ccccc4F)nn3)CC2)cc1 12429835 PXMZPESPUCUNFI-UHFFFAOYSA-N 379.439 2.736 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)[C@H]3CCCCN3C)CC2)cc1 12582201 HKBIRBARIVUGNC-JOCHJYFZSA-N 387.568 2.892 0 50 GFAA O=C(c1cccc(OC2CCN(C(=O)C3CCCC3)CC2)c1)N1CCOCC1 12596175 ICYSZXVZSNJWFC-UHFFFAOYSA-N 386.492 2.719 0 50 GFAA CC(C)S(=O)(=O)c1ncc(CN2CCSCC2)n1CCc1ccccc1 23340047 MGKIRHYSJXYXII-UHFFFAOYSA-N 393.578 2.857 0 50 GFAA COc1nccnc1N1CCOc2c(O)cc(-c3nc(C)cnc3C)cc2C1 67459816 QDCKDDASBBTPOR-UHFFFAOYSA-N 379.420 2.664 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](N)CN1C(=O)C1c2ccccc2-c2ccccc21 67975317 PPRVLWONXKUJJJ-QRWLVFNGSA-N 377.488 2.596 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@@H](CC(=O)N(C)C(C1CC1)C1CC1)CO2 71747605 LLUZJXLRYWUPDH-KRWDZBQOSA-N 385.508 2.623 0 50 GFAA C[C@H]1CN(C(=O)c2nc3ccc(Cl)cn3c2CN2CCCC2)C[C@@H](C)O1 71750445 WBYCEHWWAMEXAN-OKILXGFUSA-N 376.888 2.833 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)ncn2)c1C 72115776 QUUOINASUAJHRU-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA O=C1CCC2(CCN(c3nnc4ccccn34)CC2)CN1CCc1cccnc1 95368765 OPPMBSHXLITOSB-UHFFFAOYSA-N 390.491 2.576 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)C2CC2)C1)N1CCN(Cc2ccccc2)CC1 95508053 HIYVVPVUEKEHQE-HXUWFJFHSA-N 383.536 2.760 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 95511584 JXHUUOZEPIOAEA-QGZVFWFLSA-N 384.480 2.583 0 50 GFAA O=C(C1CCN(c2ccc(C(F)(F)F)cn2)CC1)N1CCc2[nH]cnc2C1 96147904 VUEFCVDHUNBWIC-UHFFFAOYSA-N 379.386 2.625 0 50 GFAA COCCN(Cc1cccnc1)C(=O)Nc1ccc2c(c1)O[C@H](C)C(=O)N2C 96163402 OHRGPXAGJBVMEZ-CQSZACIVSA-N 384.436 2.506 0 50 GFAA CN1CC(=O)N(c2cccc(NC(=O)N3CCC[C@@H]3c3ccccn3)c2)C1=O 97568785 KDSFKTRTPUNSJP-QGZVFWFLSA-N 379.420 2.849 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)N2CCC[C@H]2c2c(C)noc2C)c1 97674234 ICLKKMKQFGQIMW-HNNXBMFYSA-N 378.454 2.569 0 50 GFAA CC(C)(C)c1noc(-c2ccccc2C(=O)NC[C@H]2CN(C3CC3)CCO2)n1 114858008 PKFYZQPIWGXJGG-HNNXBMFYSA-N 384.480 2.627 0 50 GFAA COc1cccc(-c2nc(C(=O)N[C@H]3CCN(c4ccccn4)C3)c(C)[nH]2)c1 161594461 GDUHOLJKIHRPTG-INIZCTEOSA-N 377.448 2.797 0 50 GFAA O=C(Cc1ccccc1F)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779766 LWGUSFSYYSSJQC-UHFFFAOYSA-N 380.423 2.648 0 50 GFAA CCC[C@H](NS(=O)(=O)c1cc(C)oc1C)C(=O)N1CCc2sccc2C1 183155904 HUQWCQCTYFWVSV-HNNXBMFYSA-N 396.534 2.990 0 50 GFAA O=C(CN1CCCCC1=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1 192567389 OPHRGUAIQKCVRP-LJQANCHMSA-N 397.544 2.976 0 50 GFAA O=C(NCc1ccnc(OCC(F)(F)F)c1)NC1CCN(CC2CC2)CC1 193681310 GGCAAJLRFDGPER-UHFFFAOYSA-N 386.418 2.696 0 50 GFAA Cc1cc(C(=O)NCCN2C(=O)Cc3ccccc32)c2c(C(C)C)noc2n1 195396774 AGTVHBAWFXFLLU-UHFFFAOYSA-N 378.432 2.974 0 50 GFAA Cc1ccn2cc(CNC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)nc2c1 217061309 BNCOCYYDARGRIT-IBGZPJMESA-N 376.460 2.954 0 50 GFAA C[C@@]12C=C[C@@](CO)(O1)[C@@H]1C(=O)N(c3cc(C(F)(F)F)ccc3Cl)C(=O)[C@@H]12 222248863 PPIVCBCOLCHEFG-KNPMLCFXSA-N 387.741 2.554 0 50 GFAA COC(=O)C(C)(C)N(Cc1ccccc1)C(=O)c1ccc(S(C)(=O)=O)cc1 225795335 CCJCSCVYQAVLJM-UHFFFAOYSA-N 389.473 2.684 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2)C[C@@H](C)O1 237628291 ZHJKUYHYTRQXDN-IYBDPMFKSA-N 382.460 2.924 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N(CCC(=O)O)C1CCOCC1 237837250 QLZZTNWWCNVWNJ-UHFFFAOYSA-N 385.464 2.514 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1ccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 239433485 XTMMVXNSTFFHAS-YPSWNZPLSA-N 392.455 2.902 0 50 GFAA CC(C)[C@H](CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccccc1 252498620 RGEXJFIEEYUOOO-FQEVSTJZSA-N 389.517 2.899 0 50 GFAA COC(=O)c1cccc(NC(=O)c2ncn(-c3ccc(OC(F)F)cc3)n2)c1 261490542 GDQATMPZQLYVCC-UHFFFAOYSA-N 388.330 2.908 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)CC1(n3cccc3)CCOCC1)CC2 263586383 TXPPABDGCTVCFQ-UHFFFAOYSA-N 384.476 2.986 0 50 GFAA biogenic CN1CCC(=O)Nc2cc(C(=O)Nc3cccc(N4CCCNC4=O)c3)ccc21 266871068 DEGWBZQVWZWBKA-UHFFFAOYSA-N 393.447 2.637 0 50 GFAA Cc1sc(NC(=O)[C@H]2C[C@@H](O)CN2)nc1-c1ccc(Br)cc1 276638048 LUYSZFIBHIOCGD-VXGBXAGGSA-N 382.283 2.542 0 50 GFAA CCC[C@@]1(CO)CCN(C(=O)NC2CCN(c3ccccc3OC)CC2)C1 291439629 ZSXFEHXHWYXDPD-OAQYLSRUSA-N 375.513 2.858 0 50 GFAA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCN1C(=O)c1ccccc1 295803131 SRYRQTDPBXRJHE-SVFBPWRDSA-N 390.487 2.872 0 50 GFAA COc1cc(C(=O)N2CCCC[C@@H]2CN)ccc1OCc1csc(C)n1 299738826 GZYGSLLWYRBPFA-MRXNPFEDSA-N 375.494 2.993 0 50 GFAA O=C(O)C[C@@H](NC(=O)C[C@@H]1Sc2ccccc2NC1=O)c1ccc(F)cc1 299746465 XOYKZURYRWKWBL-ZBFHGGJFSA-N 388.420 2.961 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2nnc(C3CC3)n2C2CC2)n1C 328648411 UMGVTCAVEIPGRX-QGZVFWFLSA-N 382.512 2.916 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)N3C[C@@H](n4cccn4)Cc4ccccc43)cn21 333172251 NZHBTWWHFBMRAF-WBVHZDCISA-N 397.504 2.970 0 50 GFAA C[C@@H]1CN(C(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)CC2(CCOCC2)O1 333223733 SICVDFFILSYWCG-KZNAEPCWSA-N 379.545 2.619 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1)[C@H](O)c1cccc(F)c1 363720333 GWBJPWYLRRSKPQ-IXDGSTSKSA-N 390.480 2.659 0 50 GFAA COc1ccc2c(c1)CN(C(=O)c1ccc(=O)n(C)n1)[C@H](C1CCCCC1)C2 364026581 WKELOKAOUMGMFK-FQEVSTJZSA-N 381.476 2.936 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)C[C@@H]2C[C@H]3CC[C@H]2O3)c(Br)c1 408496372 PIJGNVIDWXDNSA-DMDPSCGWSA-N 388.283 2.520 0 50 GFAA COc1cc(Cl)ccc1C(=O)N1CC[C@]2(OC)CC[C@H](OCCO)C[C@H]12 426503507 WTXCYXHQZFBEBC-UCLAIMLFSA-N 383.872 2.510 0 50 GFAA O=C1NCCN(C(=O)NCc2nc3c(s2)CCCC3)[C@H]1c1ccc(F)cc1 426693710 JXZWBXMZIJICEQ-KRWDZBQOSA-N 388.468 2.544 0 50 GFAA CCCCN1CCn2nc(CNC(=O)N3CCC[C@@H](OCCC)C3)cc2C1 534581862 GHSRITNOIUJIAA-LJQANCHMSA-N 377.533 2.599 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)NCCCc1nnc2ccccn12 584891715 LLVWZBPEDZLFQO-UHFFFAOYSA-N 383.456 2.544 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1C[C@]2(C)CN(C)C[C@]2(C)C1)c1ccc(Cl)cc1 823754871 IBCTXPKRIKCZNH-YSIASYRMSA-N 377.916 2.708 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCCC[C@H]2CCN2CCOCC2)c1 824628581 BWMKYXIRLMLQOU-FQEVSTJZSA-N 384.524 2.958 0 50 GFAA Cn1nncc1C(=O)N[C@@]1(C)CN(Cc2ccccc2)C[C@@H]1c1ccccc1 888450435 UNHOMUGPFMHGMM-KNQAVFIVSA-N 375.476 2.603 0 50 GFAA CCOc1cc(CN2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)c(Cl)cc1OC 1529190413 IWOLWZBDQDKIQC-RHSMWYFYSA-N 379.888 2.814 0 50 GFAA COc1cc(OC)c2nc(N3C[C@H](Cc4ccccn4)[C@@H](O)C3)cc(C)c2c1 1615733537 HQFXTCRPTRKZQU-KXBFYZLASA-N 379.460 2.995 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cc3c(nc2O)CCCC3)[C@H]1c1ccccc1 1857710017 DGINUJOHFAWLEU-SFTDATJTSA-N 395.503 2.810 0 50 GFAA Clc1cnn(CCN2CCC(C3CCN(Cc4cnc[nH]4)CC3)CC2)c1 1857738606 PPBXUNFDRDNBCQ-UHFFFAOYSA-N 376.936 2.884 0 50 GFAA CCc1ccnc(C(=O)NC[C@H]2CCC[C@H]2NC(=O)COc2ccc(F)cc2)c1 1875306826 CZFUAEQZUGHAOY-VQIMIIECSA-N 399.466 2.877 0 50 GFAA CC[C@@H](C)c1cn2c(n1)CN(C(=O)N[C@@H]1CCO[C@H]1c1ccc(O)nc1)CC2 1875392373 GCEBBGNWBZRRSC-MUKKUYKPSA-N 385.468 2.553 0 50 GFAA Cc1ccsc1CCCC(=O)N1CCC2(CC1)C[C@@H](O)c1nn(C)cc1O2 1875394879 ZNVKSPKYVNXGJG-OAHLLOKOSA-N 389.521 2.990 0 50 GFAA O=C(NC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O)[C@@H]1[C@@H]2CC[C@@]1(c1ccc(Cl)cc1)C2 1875405986 UHQBICYQRITPCB-HKCYJEQXSA-N 375.896 2.502 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)NCc2ccc3ccccc3n2)OCC(=O)N1C 1940198097 MWJWWSHZMYUQNT-YADHBBJMSA-N 389.455 2.758 0 50 GFAA COC(=O)c1cccc(-c2nc(CN[C@H]3CNC(=O)CC34CCC4)cs2)c1 2325778688 KFDLIRFHFHBNMR-INIZCTEOSA-N 385.489 2.745 0 50 GFAA Cn1cnc2ccc(C(=O)Nc3cccc(CN4CCSCC4)c3)cc2c1=O 2325780514 OOHVNHLFZLDXAZ-UHFFFAOYSA-N 394.500 2.735 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1cnc(-c2ccccc2Cl)nc1 2325786142 FXUOVZXIXOVSJK-FSPWUOQZSA-N 397.866 2.563 0 50 GFAA Cn1cnc(-c2ccc(C(=O)N3CCC(c4ccccc4CN)CC3)cc2)n1 2325789211 DUDGCFFIXFRWMK-UHFFFAOYSA-N 375.476 2.961 0 50 GFAA CCC(=O)N1CC2(C[C@H](NC(=O)c3coc(C4CCCCC4)n3)c3nccn32)C1 2332237887 PXNWTBJXEDVTIR-HNNXBMFYSA-N 397.479 2.741 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cnn4ccn(C)c34)C2=O)cc1 2356138762 HUJISHGWSXWBNN-JOCHJYFZSA-N 391.475 2.783 0 50 GFAA O=C(c1ccc2c(c1)nc(O)n2[C@H]1CC[C@H](O)CC1)N1[C@H]2CCC[C@@H]1C[C@H](O)C2 2356161927 QBISRLVIDHFIKN-PFJGLKMASA-N 399.491 2.736 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1cccc(OC(C)=O)c1 957013 GEAPCOGOJCHKRT-KRWDZBQOSA-N 388.445 2.825 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)c2cc(C(C)C)c(C)cc2OCC)CC1 1069372 NVBPDQRIYJNIGD-UHFFFAOYSA-N 398.525 2.980 0 50 GFAA COc1cc(-c2nnn(CC(=O)Nc3c(C)cccc3C)n2)cc(OC)c1OC 2861333 BQFDLBUUHAEMGE-UHFFFAOYSA-N 397.435 2.621 0 50 GFAA CC(=O)N1N=C(c2cccc(NS(C)(=O)=O)c2)C[C@@H]1c1ccc(F)cc1 4036080 ISHCLLMTHIKKDD-GOSISDBHSA-N 375.425 2.895 0 50 GFAA CCOc1cc(CN2CCC3(CC[C@H](CNC(C)=O)O3)CC2)ccc1OC 12158284 PQMMSQYOKHETIK-GOSISDBHSA-N 376.497 2.744 0 50 GFAA O=C(NCC[C@@H]1CCCN2CCCC[C@H]12)c1cn(Cc2ccccc2F)nn1 12199533 JSPFWZNHAZBMQK-OXJNMPFZSA-N 385.487 2.850 0 50 GFAA c1ccc(CN(C[C@H]2CCCO2)c2nc3nonc3nc2NC2CCCC2)nc1 12306053 YRAYTZVUMNDFDQ-MRXNPFEDSA-N 395.467 2.948 0 50 GFAA COc1ccc(O[C@H](C)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1 12380853 YGJABHQLAFVODM-OAHLLOKOSA-N 384.432 2.574 0 50 GFAA COC(=O)c1ccc(CN2CCC(=O)N(CCOc3ccccc3)CC2)cc1 14879125 RNUVNMPADCARIN-UHFFFAOYSA-N 382.460 2.587 0 50 GFAA CCOC(=O)[C@]1(CCCc2ccccc2)CCCN(C(=O)CCn2cncn2)C1 14955063 AWDDGOXUFHLUHH-JOCHJYFZSA-N 398.507 2.863 0 50 GFAA CCCOc1ccc(/C=c2\sc3nc(=O)c(-c4ccccc4)nn3c2=O)cc1 16115156 LLZQIDQDWOWPLF-LGMDPLHJSA-N 391.452 2.515 0 50 GFAA Cc1ccc2nsnc2c1NC(=O)CN1CCN(Cc2ccccc2)CC1 19221684 SLYYENRCATUYOD-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA O=C(c1nc2sccn2c1CNCc1ccc2nsnc2c1)N1CCCC1 20995917 DKAXQERSTDPJBE-UHFFFAOYSA-N 398.517 2.926 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3cn(C)c4ccccc34)C2)CC1 22851382 ZBECNJKJKAAPIT-IBGZPJMESA-N 384.524 2.917 0 50 GFAA COc1ccc(-c2cc(=O)[nH]c(N3CCN(Cc4ccccc4)CC3)n2)cc1 65166640 OVKMKLALVCQIOU-UHFFFAOYSA-N 376.460 2.768 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4cccc(Cl)c4)CC3)ncn2)n1 67603905 BTQIJKRKQKNIAS-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA Cc1nonc1CN(C)C(=O)c1coc(COc2cccc3cnccc23)n1 67642058 HJQWXEXUYRLKOX-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@H]2CCCNC2=O)CCO3)s1 67886188 RDGMTGHIMJAXKC-HNNXBMFYSA-N 386.473 2.676 0 50 GFAA Cc1ccccc1NC(=O)Nc1ccnn1C1CCN(CC(=O)N(C)C)CC1 67935130 FJQLZQOAPNXLSY-UHFFFAOYSA-N 384.484 2.561 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3cc(F)cc(F)c3)CC2)C1 71415800 DJHVSUKCSGLGDO-INIZCTEOSA-N 377.479 2.920 0 50 GFAA C[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(Br)cc2)C1 72437355 AZCIKTOYIYCDQP-ZDUSSCGKSA-N 375.332 2.849 0 50 GFAA Cc1ccc2ncccc2c1CN1CC[C@H](N2CCOCC2)[C@H](CCC(=O)O)C1 91444775 BGZWLUJKLMOUSJ-GCJKJVERSA-N 397.519 2.931 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3cc(Cl)ccc3O)C[C@H]2C(=O)O)c1 91621493 PGABBFCMGFMGQM-JKSUJKDBSA-N 375.808 2.995 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)c2cccc(O)c2)CC1 95502394 WLUDZIZORFVHTJ-IBGZPJMESA-N 387.524 2.625 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cnn(Cc3ccccc3)c1)C2 95506232 FTGZNNSLMSJAOP-QGZVFWFLSA-N 377.444 2.921 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@H](CCC(=O)N(C)CCc3ccccn3)C2)cn1 95509658 XHCBNGPEYNINRT-GOSISDBHSA-N 395.507 2.514 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)CCn2cnc3ccccc32)C1 95530345 GCBDLWPDIMUJDG-QGZVFWFLSA-N 381.480 2.676 0 50 GFAA CNS(=O)(=O)c1cc(NC(=O)CN2CCCc3ccc(C)cc32)ccc1C 111261968 AHPJXQMURPTVDL-UHFFFAOYSA-N 387.505 2.603 0 50 GFAA Cn1cc(N2CC[C@H](NCC3(c4ccccc4Cl)CCOCC3)C2=O)cn1 111374026 YMLANHRQYUEHQP-SFHVURJKSA-N 388.899 2.517 0 50 GFAA COc1cc(NC2CCN(C(=O)c3ccc4[nH]nnc4c3)CC2)cc(OC)c1 124587365 DHNLZAPHIOLOOA-UHFFFAOYSA-N 381.436 2.692 0 50 GFAA Cn1nccc1C1CCN(C(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)CC1 153481881 CHWPWZXJWSEHJW-UHFFFAOYSA-N 398.435 2.828 0 50 GFAA CC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)cc1 169772840 HDCDSWSFIPGPNS-GFCCVEGCSA-N 395.394 2.652 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N[C@@H](C)CCc1ccccc1)CCCC3 169778273 BCBGLNMDABZTHC-INIZCTEOSA-N 392.503 2.980 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](Nc3ccc(CC(F)(F)F)cc3)C2=O)cn1 170642388 HNPLEAOYZRJSNM-CQSZACIVSA-N 379.338 2.939 0 50 GFAA Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)N2CCN(c3ncccn3)CC2)cc1 170644999 MEBINYKNDHTMPK-VQTJNVASSA-N 395.507 2.785 0 50 GFAA CCc1nsc(N2CCCN(CC(=O)NCc3ccc(Cl)s3)CC2)n1 174046802 AVWANOHXEMPYEJ-UHFFFAOYSA-N 399.973 2.644 0 50 GFAA CNC(=O)[C@H]1CN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)CCO1 184082432 FCRJYWDSDYFPIN-OAHLLOKOSA-N 390.896 2.663 0 50 GFAA COc1cc(-c2noc(Cn3cnc(C)c(C)c3=O)n2)ccc1OC(F)F 188220665 CQKJEZMFDSERDS-UHFFFAOYSA-N 378.335 2.568 0 50 GFAA CC(C)(O)CN(Cc1ccccc1)S(=O)(=O)CCc1ccc2c(c1)CCO2 193486983 GHDXTXHFEMRBCQ-UHFFFAOYSA-N 389.517 2.767 0 50 GFAA COC(=O)C[C@H](c1ccc(OC)cc1)c1c(O)n2cc(Cl)ccc2nc1=O 205954048 ICYOUTVQXFMTHK-CQSZACIVSA-N 388.807 2.757 0 50 GFAA COc1ccc(CNC(=O)[C@@H](C)N2CC(c3nc4ccccc4[nH]3)C2)cc1OC 225467135 KXGPSKLYWYLJJZ-CQSZACIVSA-N 394.475 2.684 0 50 GFAA O=S(=O)(Cc1cccc(Cl)c1)NC[C@@H](c1ccccc1)N1CCOCC1 225833694 ACNJGLFLJIHVHS-IBGZPJMESA-N 394.924 2.833 0 50 GFAA C[C@@H]1[C@@H](N2C(=O)[C@](NC(=O)c3ccco3)(C(F)(F)F)N=C2O)CCC[C@H]1C 245245578 DPNUGJSSHMLGNP-KALYDTEFSA-N 387.358 2.849 0 50 GFAA COc1cccc(NC(=O)CN2CCC[C@@H](Cc3nnc4ccccn34)C2)c1 253393729 CNMHDVPVQAWWHS-INIZCTEOSA-N 379.464 2.631 0 50 GFAA CCc1ccccc1N1C[C@@H](C(=O)Nc2cc(C3CCOCC3)[nH]n2)CC1=O 266295520 BTNCUMKUKDWCDD-INIZCTEOSA-N 382.464 2.858 0 50 GFAA COc1ccc(CC(=O)O[C@H](C(=O)Nc2cc(C)on2)c2ccccc2)cc1 328592346 UDBJOHBIMUFAFJ-FQEVSTJZSA-N 380.400 3.457 0 50 GFAA Ic1ccc2ncnc(N3CC([C@H]4CCOC4)C3)c2c1 366486585 YFMTUTUGBZWBDP-JTQLQIEISA-N 381.217 2.707 0 50 GFAA CNC(=O)c1ccc(NC(=O)Cc2c(F)ccc(Br)c2F)nc1 409967568 VAQGAIWKOCYBDI-UHFFFAOYSA-N 384.180 2.663 0 50 GFAA CCOC(=O)c1c(NC(=O)CN(C)[C@@H](C)c2ccco2)sc(C(N)=O)c1C 411191210 JAMRBRLITRTITM-NSHDSACASA-N 393.465 2.557 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2ccc(CCC(=O)O)cc2)c2cccc(F)c2O1 478267687 NTXYBEIVDHMCGN-LBPRGKRZSA-N 379.409 2.819 0 50 GFAA CC(C)N=c1cc(-c2ccc(C(=O)N(C)Cc3nccs3)cc2)nc(N)[nH]1 534574418 LJMYRQYULWMROR-UHFFFAOYSA-N 382.493 2.697 0 50 GFAA CC[C@H](NC(=O)c1cccc(-c2cnn(CC(=O)NC)c2)c1)c1nccs1 534593115 HZVRRRMYTIQMRK-INIZCTEOSA-N 383.477 2.634 0 50 GFAA COCCN(C)S(=O)(=O)NC(=O)c1cc(-c2ccccc2)ccc1Cl 757326698 YLHVVWVDSBUTFM-UHFFFAOYSA-N 382.869 2.560 0 50 GFAA Cc1cccc(OCC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)c1C 828057217 RZCQKOJHGBXMJY-UHFFFAOYSA-N 398.459 2.559 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)c2csc(-c3ncccn3)n2)c1 952967024 LPYRTWIOESUMTJ-UHFFFAOYSA-N 383.433 2.746 0 50 GFAA COc1ccc2c(c1)C[C@@H](NCCCNS(=O)(=O)c1ccc(C)cc1)CC2 952976512 RWMWUMQRSVDSNI-IBGZPJMESA-N 388.533 2.819 0 50 GFAA CN(C)Cc1ccc([C@H]2CCCN2C2CCN(C(=O)c3cnccn3)CC2)cc1 1506419331 ZEUMMBTYTHNDLI-JOCHJYFZSA-N 393.535 2.980 0 50 GFAA O=C(C1CCC1)N1CCC(N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)CC1 1529175014 ZXWSTYABYIEJEA-AUSIDOKSSA-N 393.531 2.861 0 50 GFAA COc1cc(-c2onc(N(C)C[C@@]3(C)CCN(C)C3)c2C(=O)O)ccc1F 1704303839 JQZMHWLAYDWQHB-IBGZPJMESA-N 377.416 2.966 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCCN(C(=O)CCc2ccc(F)cc2F)CC1 1772709697 RCMRRCRCNHISHM-UHFFFAOYSA-N 375.419 2.909 0 50 GFAA COc1cccc(-c2nccn2-c2cccc3c2nnn3C)c1O[C@@H](C)C(=O)O 1857689689 KCRMJMKMXCVZJZ-LBPRGKRZSA-N 393.403 2.682 0 50 GFAA CO[C@H]1C[C@@H](C(=O)NCc2cccnc2)CC[C@@H]1Nc1ncnc2ccsc12 1857691524 PDWSLYNLWSQELH-ZOBUZTSGSA-N 397.504 2.998 0 50 GFAA O=C(Nc1ccc2nnc(C3CC3)n2c1)[C@@H](c1ccccc1F)N1CCOCC1 1875265138 KCBFWJQCAZFRLH-LJQANCHMSA-N 395.438 2.758 0 50 GFAA CSC[C@@H](Cc1ccc(F)cc1F)NC(=O)[C@H](N)CCc1ccccn1 1875326999 VKUXBXNIHFWPAR-SJLPKXTDSA-N 379.476 2.710 0 50 GFAA O=C(CCc1ccc2[nH]ccc2c1)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 1875403683 YGKXBOOQUKXKBR-NIKGAXFTSA-N 386.883 2.906 0 50 GFAA COc1ccc(-n2cc([C@H](C)NC(=O)c3cnc4cnn(C)c4c3)cn2)cc1 1940197109 SGQDQZSSNKJTDL-ZDUSSCGKSA-N 376.420 2.654 0 50 GFAA Cn1cc(C2CCN(C(=O)[C@H]3CC(=O)N(c4cccc(Cl)c4)C3)CC2)cn1 2325734711 XVIJIINASXYZER-HNNXBMFYSA-N 386.883 2.833 0 50 GFAA O=C1COc2c(cccc2C(=O)N[C@@H]2Cc3ccccc3O[C@H]2C(F)(F)F)N1 2325758586 KLLVSGLIVHFWEZ-CXAGYDPISA-N 392.333 2.682 0 50 GFAA O=C(NCCc1ccc2c(c1)CCOC2)NCCN1CCc2sccc2C1 2325797450 ZTOVVXLIQIFRQH-UHFFFAOYSA-N 385.533 2.721 0 50 GFAA Cc1ocnc1CS(=O)(=O)N[C@H](C)c1nnc(-c2cccc(F)c2)s1 2325804099 VGYVOKHKSXQWAP-SECBINFHSA-N 382.442 2.821 0 50 GFAA Cn1cnc(C(=O)N2C[C@@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2[C@H]3Cc2ccccc2)c1 2356154572 ANCPJQOUICYCLM-ZFMNYDKASA-N 392.503 2.504 0 50 GFAA O=S(=O)(c1ccc(-c2cn3cc(Cl)ccc3n2)cc1)N1CCOCC1 906374 ROKCCBNODBBMKB-UHFFFAOYSA-N 377.853 2.676 0 50 GFAA CN(CC(=O)NCc1ccc(F)cc1)S(=O)(=O)c1ccc2ccccc2c1 1124745 OCKAQFYZOBNWGW-UHFFFAOYSA-N 386.448 2.916 0 50 GFAA CCc1ccc(NC(=O)CSc2nnnn2-c2ccc(C(=O)OC)cc2)cc1 1153832 SSSZCQACRUDIMX-UHFFFAOYSA-N 397.460 2.742 0 50 GFAA COC(=O)[C@@H]1C(=O)C[C@@H](c2ccc3c(c2)OCO3)[C@@H]1c1ccc2c(c1)OCO2 1319091 LGIWOAOMGYWGOB-QTJFZDIUSA-N 382.368 2.773 0 50 GFAA Cc1ccc(C(=O)COC(=O)CNC(=O)c2ccc(Br)o2)cc1C 1839027 XFUOLQYHAVUKKG-UHFFFAOYSA-N 394.221 2.815 0 50 GFAA CN(C)[C@H]1C[C@H]2C[C@@H](N(C)Cc3ccc(OCC(N)=O)c(Cl)c3)C[C@H]2C1 2356137854 CCEUOEBJVKHUTC-WNKDZCFJSA-N 379.932 2.755 0 50 GFAA CCN(CC)CCNC(=O)C[S@](=O)Cc1nc(-c2ccc(C)cc2)oc1C 4035724 FZEMBKBXIUMMGG-MHZLTWQESA-N 391.537 2.665 0 50 GFAA COc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc4c(c3)OCO4)n2)cc1 4820520 WJGWDJMKDKDKRX-UHFFFAOYSA-N 384.417 2.940 0 50 GFAA CS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(OCc3ccccc3)cc2)C1 4866327 YIHFHNGTUCXLEG-KRWDZBQOSA-N 388.489 2.876 0 50 GFAA Cc1ccccc1NC(=O)CC(=O)NCC1(N2CCOCC2)CCCCCC1 55035822 JBTSIKBEBHZNPS-UHFFFAOYSA-N 387.524 2.865 0 50 GFAA Cc1nc2cc(F)c(F)cc2n1CC(=O)N(C)[C@@H]1CCN(c2ccccc2)C1=O 225420075 KZQQJDLECUJGEH-GOSISDBHSA-N 398.413 2.887 0 50 GFAA O=C(CCC(=O)N1CCC[C@H]1c1nc(-c2cccnc2)no1)NC1CCCC1 55326392 JISYPUCJQRTEIG-INIZCTEOSA-N 383.452 2.634 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C3CCCCCC3)CC2)cc1 54991825 IVPOQXWRUMMORK-UHFFFAOYSA-N 379.526 2.674 0 50 GFAA endogenous,in-man CN(Cc1cn(CCC(N)=O)c2ccccc12)C[C@@H]1CC(=O)N(C(C)(C)C)C1 55369511 HQVDYKMRPVPMFY-INIZCTEOSA-N 384.524 2.596 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCN(CC=C(C)C)[C@H](CCO)C2)cc1 104491596 POIDVRWXZNQFTJ-HXUWFJFHSA-N 384.524 2.920 0 50 GFAA Cn1nc(C(=O)O)c2c1CCN(C(=O)C[C@H](c1ccccc1)c1ccco1)C2 67675670 UEEFQECIYWJYIT-OAHLLOKOSA-N 379.416 2.818 0 50 GFAA CCc1cn[nH]c1[C@@H]1CCCN(C(=O)c2cc(-c3c(C)nn(C)c3C)nn2C)C1 67692175 CCRLRYJCVHITGD-MRXNPFEDSA-N 395.511 2.743 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(N(C)CC3(CO)CC3)nc2)C1 67871816 DPFHBKKKPIWQDK-GOSISDBHSA-N 387.524 2.758 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NC3Cc4ccccc4C3)CCC2=O)cc1 23312069 KMWVULZKBUDYCH-HXUWFJFHSA-N 392.499 2.760 0 50 GFAA Cc1cccc(CN2CCc3nnc([C@H](C)NC(=O)c4ccco4)n3CC2)c1 20911360 OHGNPESXKXIDAV-INIZCTEOSA-N 379.464 2.729 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(CC(=O)Nc2cnn(C)c2)CCO3)cc1 67847784 JKHPVLZGSPNNMY-UHFFFAOYSA-N 392.459 2.934 0 50 GFAA O=S(=O)(N(c1ccc(Cl)cc1)S(=O)(=O)C(F)(F)F)C(F)(F)F 67800031 XXVDFSLIEDFCCG-UHFFFAOYSA-N 391.698 2.846 0 50 GFAA Cc1cccc(C)c1CN1CCN(Cc2ccccc2)[C@@H]2CS(=O)(=O)C[C@@H]21 72473579 DVSXUUFFHPOUBD-YADHBBJMSA-N 384.545 2.787 0 50 GFAA COC(=O)[C@H](NC(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccn(C)n1 485695752 MIRFARBAQXQXPM-OAHLLOKOSA-N 394.353 2.581 0 50 GFAA O=C1CC[C@H](C(=O)NC2CCN(C(=O)c3ccccc3O)CC2)c2ccccc21 333238942 ICKXTQGRRCSLEU-SFHVURJKSA-N 392.455 2.873 0 50 GFAA CCN1C(=O)[C@H]2CN(c3ccnc4cc(C(F)(F)F)ccc34)CCN2C1=O 372731498 WHVNMNMEEZYTGW-OAHLLOKOSA-N 378.354 2.726 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCO[C@H](c3ccc(Br)cc3)C2)cn1 237998307 IEBNHVAOHLWUES-HNNXBMFYSA-N 391.221 2.756 0 50 GFAA COc1ccc(Cn2cc(C(=O)N3CCC[C@@H]3c3nc(C(C)C)no3)nn2)cc1 72145059 YWDGHEUXSSNOMO-QGZVFWFLSA-N 396.451 2.819 0 50 GFAA Cc1cc(S(=O)(=O)NC2CCN(C(=O)OC(C)C)CC2)sc1Cl 242106289 WILWKVLZHCUYAK-UHFFFAOYSA-N 380.919 2.998 0 50 GFAA O=C(c1cccc(-c2cc(NCCO)ncn2)c1)N1CCC[C@H]1c1ccccc1 426641464 GRRSQXJCRFLZMQ-NRFANRHFSA-N 388.471 3.525 0 50 GFAA Cn1c(=O)c(CN2CCC3(CC2)Nc2ccccc2NC3=O)cc2ccccc21 82170861 XJMROEYYQUDRMB-UHFFFAOYSA-N 388.471 2.937 0 50 GFAA COc1ccccc1-n1cc(CNC(=O)N(C)Cc2c(C)nn(C)c2C)cn1 426444438 FEHVUJCJEGTZMV-UHFFFAOYSA-N 382.468 2.573 0 50 GFAA CC(=O)c1cccc(-c2cccc(C(=O)NC[C@@H]3CCCN(CCO)C3)c2)c1 426497124 GCLKKCWXFLFWMH-SFHVURJKSA-N 380.488 2.990 0 50 GFAA Cc1ncncc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91351227 MQRUNRCCNKBHKW-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA CN(C)CCCOc1ccc(C(=O)C(C)(CCC(=O)O)CCC(=O)O)cc1 96027632 VDRAZINUEQRZNU-UHFFFAOYSA-N 379.453 2.936 0 50 GFAA CCc1ccc(C(=O)O)cc1S(=O)(=O)N1CCN(Cc2cccs2)CC1 236970536 WZFHIYDOOVISDJ-UHFFFAOYSA-N 394.518 2.515 0 50 GFAA COc1ccc2c(C)c(C(=O)NC[C@@H](c3ccncc3)N3CCOCC3)oc2c1 91468393 BGVKKWSBZIRXOJ-IBGZPJMESA-N 395.459 2.948 0 50 GFAA CCn1nc(C)c(CN2CCN(Cc3cccc(OC)c3)[C@H](CCO)C2)c1C 96838498 GPQUUNSIFSVCAZ-HXUWFJFHSA-N 386.540 2.597 0 50 GFAA O=C(Nc1ccccc1N1CCOC1=O)N1CCC(Oc2ncccn2)CC1 96138319 ZAYFQOMDWSWQQB-UHFFFAOYSA-N 383.408 2.509 0 50 GFAA CNc1cc(C(=O)N2CCC(C(=O)N3CCc4ccccc4C3)CC2)ccn1 97813858 QTGLSZSUPSSQJV-UHFFFAOYSA-N 378.476 2.560 0 50 GFAA O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)N1CCN(C2CCCC2)C(=O)C1 95526593 VJWDZLKXRVGYND-LJQANCHMSA-N 387.480 2.863 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)[C@H]2C[C@@H]4C=C[C@H]2C4)CC3)cn1 95519892 PCOASULBRLUYMP-HBFSDRIKSA-N 394.519 2.728 0 50 GFAA CCC[C@H](NC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)c1nnn[nH]1 180136495 FPHXCMATWGWEAC-NSHDSACASA-N 380.239 2.963 0 50 GFAA Cc1ccc(C)c([C@H](C)NC(=O)CN2CCN(C3CCSCC3)CC2)c1 244601848 DSUHHQHVCUPORE-SFHVURJKSA-N 375.582 2.994 0 50 GFAA C[C@@H](O)CN(C1CCCCC1)S(=O)(=O)c1ccc(OCC(F)(F)F)nc1 182936346 YYTBTPLGGSIDMM-GFCCVEGCSA-N 396.431 2.727 0 50 GFAA COc1ccc(CNC(=O)[C@H]2CC(=O)N([C@H](C)c3ccccc3)C2)cc1C(=O)O 299748713 HYGYHYWPPUBTTB-PBHICJAKSA-N 396.443 2.619 0 50 GFAA Cc1noc([C@H]2CCCCN2C(=O)c2cccc(-c3ccc(=O)n(C)n3)c2)n1 534664719 FCQDLIHIOSXHMH-QGZVFWFLSA-N 379.420 2.506 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)N1CCN(CCOCCO)CC1 299784630 KEKZPILLYXZHJE-UHFFFAOYSA-N 385.464 2.637 0 50 GFAA CC(C)(C)c1cc(CN2CCn3nc(CNC(=O)C4CCCC4)cc3C2)n[nH]1 299793461 HDDXGUVZXPBXAL-UHFFFAOYSA-N 384.528 2.726 0 50 GFAA CC(C)C(=O)Nc1cccc(C(=O)N[C@H]2CCCN(C(=O)c3ccco3)C2)c1 827621891 XPHJSWRBUBCIFG-KRWDZBQOSA-N 383.448 2.909 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N=c2ccn(-c3cccc(C(F)(F)F)c3)[nH]2)C1 1875371201 SKKSGHLBUYRDFA-ZDUSSCGKSA-N 392.381 2.676 0 50 GFAA COc1ccc(CN2CCC[C@H]([C@@H](C)NC(=O)Cn3cc(Cl)cn3)C2)cc1 1875307064 JLGYNAQJNZLHNM-WBVHZDCISA-N 390.915 2.962 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)c1ccc(C)c3c1CCC3)CCO2 1875395834 NDPGCZICVLHPFY-UHFFFAOYSA-N 390.549 2.977 0 50 GFAA c1csc(CN2CCCN(Cc3cnc(NC[C@H]4CCCO4)nc3)CC2)c1 952960351 JFIOZGLATAENBV-GOSISDBHSA-N 387.553 2.837 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)NCC3(Cn4ccnc4C)CC3)CC2)cc1 952970669 SIDOWJANNXKTBB-UHFFFAOYSA-N 394.519 2.949 0 50 GFAA Cc1cc(CNC(=O)N2CC[C@H](C)[C@H](O)C2)ccc1I 408236120 NFFFYKJGXACQTH-IINYFYTJSA-N 388.249 2.512 0 50 GFAA Cc1cnc(C)c(-c2cc(F)c3c(c2)C[C@H](CNC(=O)[C@@H]2CCCCN2C)O3)n1 39551956 SGVSYOXJNKMLAO-MJGOQNOKSA-N 398.482 2.804 0 50 GFAA Cc1cnc(C(=O)N2CCC(O)(c3cccc(OC(F)(F)F)c3)CC2)cn1 170618644 GLMXTDHUFILTMW-UHFFFAOYSA-N 381.354 2.807 0 50 GFAA O=C1OCCN1c1ccc(OS(=O)(=O)c2c(F)c(F)cc(F)c2F)cc1 170616479 DYTXDGMSKPQAQW-UHFFFAOYSA-N 391.298 2.967 0 50 GFAA CN(Cc1ccccc1)[C@H]1CCN(Cn2cc(I)cn2)C1 743375623 JAGRYPMETIBKOO-INIZCTEOSA-N 396.276 2.652 0 50 GFAA Cc1ccc(N2CCC(C(=O)N3CCCN(c4nccs4)CC3)CC2)nc1 195102161 PUTXDDGJTCKNGQ-UHFFFAOYSA-N 385.537 2.802 0 50 GFAA Cc1c(NC(=O)Cn2c(C)cc(=O)c3ccccc32)c(N2CCCC2)nn1C 1529179556 CKOCOGAKXWRTHY-UHFFFAOYSA-N 379.464 2.591 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)COc2ccc3c(c2)OCO3)C[C@@H]1O 212405901 JWYACNDLMQAMKP-GJZGRUSLSA-N 375.446 2.541 0 50 GFAA CCCC(=O)c1cn(CC(=O)N(CCO)Cc2[nH]cnc2C)c2ccccc12 1704311924 FFWZGBUXLXJKAQ-UHFFFAOYSA-N 382.464 2.677 0 50 GFAA Cc1cc(C)n(C[C@H](C)NC(=O)CCc2nnc(CCc3ccccc3)o2)n1 11817707 KGPWBABTFHHXHZ-INIZCTEOSA-N 381.480 2.806 0 50 GFAA O=C(c1ccc(NCCn2cccn2)nc1)N1CCCN(C2CCCCC2)CC1 12076626 OCUZQXTYLFGNBI-UHFFFAOYSA-N 396.539 2.871 0 50 GFAA O=C1CC[C@H](C(=O)N2CCC(Cn3cccn3)CC2)CN1CC1CCCCC1 12429779 IDLIOPMVUYUDHM-FQEVSTJZSA-N 386.540 2.941 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)NCc3nc(C)cs3)o2)c1 19111191 NCNHQJLGZXBZTL-UHFFFAOYSA-N 386.477 2.877 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3ccc(OC)cc3F)C2)CC1 19228081 SZUWSVVAZOUXOT-KRWDZBQOSA-N 379.476 2.573 0 50 GFAA CCC(C)(C)NC(=O)c1ccc([C@@H]2CCCN2C(=O)CN2CCOC2=O)s1 19635424 VQBKOCHLHVPZSN-ZDUSSCGKSA-N 393.509 2.782 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C(=O)Cc2ccccc2)CC1 19787915 KMUWLCDICMKLLD-UHFFFAOYSA-N 384.476 2.599 0 50 GFAA Cc1ccc([C@@H]2NC(=O)N(CC(=O)Nc3ccccc3)C3=C2C(=O)OC3)cc1 169757945 XCWCGUHTSZVHPF-IBGZPJMESA-N 377.400 2.511 0 50 GFAA Cc1cnn(C)c1C(=O)N1CC2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1 1857530408 HSAOCANUXAHNGT-UHFFFAOYSA-N 390.846 2.509 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCC(C)(C)OC)C3)nc2c1 1857670654 DHOWSEVTPFGEAK-AWEZNQCLSA-N 375.469 2.984 0 50 GFAA CC(C)CCN1C[C@@H]2CC[C@H](C1)[C@H]2NS(=O)(=O)c1ccc2nc(O)oc2c1 1857687112 LHEMAHQGFLDJCP-ZSBFGKGUSA-N 393.509 2.568 0 50 GFAA COc1ccc(CNC(=O)C2CCN(c3nc(C)nc4cc[nH]c34)CC2)cc1 1857688316 CNMGGYILYYWUFK-UHFFFAOYSA-N 379.464 2.808 0 50 GFAA CC(C)=CCN1CCC2(CC1)CN(C(=O)CCC(F)(F)F)C[C@H]2C(=O)O 1857698968 CMTNORQXGZUSFY-AWEZNQCLSA-N 376.419 2.920 0 50 GFAA c1ccc([C@H]2COC[C@H]3CN(Cc4cn(-c5ccccc5)nn4)CCN23)cc1 1875240541 ATWIOBXFIRPZCI-FGZHOGPDSA-N 375.476 2.525 0 50 GFAA COc1cc(C)ccc1C(=O)N1CCC(n2nnc(C(=O)O)c2C(F)F)CC1 910295164 YHWUFMTZRGYBFA-UHFFFAOYSA-N 394.378 2.708 0 50 GFAA CN1C(=O)CCC[C@@H]1C(=O)N1CCC(c2nccc(-c3cccc(F)c3)n2)CC1 912773948 GMFIODUXMWIQJG-LJQANCHMSA-N 396.466 3.000 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)c2cc3cccnc3[nH]2)CCCCN1 2100533430 OTVPJVNPKWEFIW-GOSISDBHSA-N 397.523 2.550 0 50 GFAA O=C(NCc1cn(C2CCNCC2)nn1)c1cc(F)ccc1-c1ccccc1 2325756403 SEKSSQYPCIYANN-UHFFFAOYSA-N 379.439 2.939 0 50 GFAA O=C(C[C@@H]1CN(C(=O)C2=CCCC2)C2(CCC2)CO1)N1CCC[C@@H]1c1ncc[nH]1 2325785066 AAXKKCHMJPLLRO-QZTJIDSGSA-N 398.507 2.724 0 50 GFAA CN1CC[C@]2(CCN(C(=O)c3ccc4c(c3)nc(O)n4Cc3ccccc3)C2)C1 2325816020 DQLSFJVSKPIUSK-QHCPKHFHSA-N 390.487 2.958 0 50 GFAA O=C(Nc1cnn(-c2ccccc2Br)c1)c1ccc2n1CCNC2 2325856665 YTARYGKSPSQEGJ-UHFFFAOYSA-N 386.253 2.792 0 50 GFAA COC(=O)c1ccccc1NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 1206030 QZWWCUGUQMAVLG-UHFFFAOYSA-N 396.852 2.531 0 50 GFAA COc1ccccc1N(C(=O)C(Cl)(Cl)Cl)[C@H]1C=CS(=O)(=O)C1 1217560 IHHVWHFVTHZLMO-VIFPVBQESA-N 384.668 2.709 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356147412 VBJIMERBODCANH-OAQYLSRUSA-N 383.496 2.587 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)CCc2ccccc2Cl)C1=O 2356164691 CRZVJNFPJYKRKA-FQEVSTJZSA-N 378.900 2.903 0 50 GFAA O=C1N(Cc2ccccn2)CCC[C@]12CCCN2Cc1nc(C(F)(F)F)no1 2356170927 DUJMCQYAKJJDEC-KRWDZBQOSA-N 395.385 2.641 0 50 GFAA O=C(Nc1ccccc1)O[C@@H]1CS(=O)(=O)C[C@H]1OC(=O)Nc1ccccc1 4754773 ZBFBPBSFROGYCR-HZPDHXFCSA-N 390.417 2.649 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)cc1 247980333 IHIPNONWNDDBHH-LEWJYISDSA-N 377.488 2.912 0 50 GFAA COc1cc2c(cc1CN1C[C@H]3[C@@H](C1)OC(=O)N3CCc1ccccn1)CCC2 55099034 CKQWOXCTJAIKPB-RBBKRZOGSA-N 393.487 2.827 0 50 GFAA CN(C)c1cc(C(F)(F)F)nc(NC2CCN(C(=O)c3ccoc3)CC2)n1 248111118 KCFWLRMVWQUCKK-UHFFFAOYSA-N 383.374 2.871 0 50 GFAA Cc1nonc1C(=O)N1CCC[C@@H]1c1ccc(C(=O)NCc2ccoc2)s1 20138259 HFDPHAZOWIECHN-CYBMUJFWSA-N 386.433 2.940 0 50 GFAA COc1cccc(C(=O)N2CCn3nc(C(=O)Nc4ccccc4)cc3C2)c1O 65376209 XGRVYLWZBUXZNN-UHFFFAOYSA-N 392.415 2.506 0 50 GFAA N[C@@H](Cc1ccc(O)cc1)C(=O)NCc1cccnc1Oc1ccccc1F 67713964 PCUQSLBEHSZOGK-SFHVURJKSA-N 381.407 2.905 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3cnccc3N(C)C)CC2)cn1 252508261 XIMZYRJAMIFUED-INIZCTEOSA-N 382.512 2.715 0 50 GFAA CC(=O)N(C[C@H]1CCCN1S(=O)(=O)c1cccc2c1OC(C)(C)C2)C1CC1 328854977 XOCNSDOQHJCZBB-QGZVFWFLSA-N 392.521 2.564 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N(C)Cc1nc2ccsc2c(=O)[nH]1 121958487 KUMSPHGKXMLOQF-UHFFFAOYSA-N 381.461 2.691 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)F 123761770 HLUUQBKJUOVPKI-RYUDHWBXSA-N 386.376 2.501 0 50 GFAA O=C(NCc1nc(-c2ccc(Cl)cc2)no1)c1nc(=O)c2ccccc2[nH]1 365344269 XSMQJKHJGHVLGR-UHFFFAOYSA-N 381.779 2.557 0 50 GFAA CN(C)c1cc(C(=O)N2CCC([C@@H]3C[C@H](N)CCO3)CC2)nc2ccccc12 333246136 FTVXSYBNFKFQBE-IERDGZPVSA-N 382.508 2.659 0 50 GFAA COc1c(C)cc(C(=O)N[C@H]2CC(=O)N(C3Cc4ccccc4C3)C2)cc1C 72165952 UOYGEZXWACCWMD-IBGZPJMESA-N 378.472 2.810 0 50 GFAA Cc1ccccc1N1CCCN(c2cc(C3CC(N)C3)nc(N(C)C)n2)CC1 219501301 UAWVZFNQUQXTHJ-UHFFFAOYSA-N 380.540 2.772 0 50 GFAA O=C(Nc1c(F)cc(F)cc1-c1ccccc1)N[C@H]1COC[C@H]1n1ccnn1 495040128 LMXMACSTHAIRGT-DLBZAZTESA-N 385.374 2.985 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)c(Cl)c1=O)Nc1cc(F)cc(F)c1 72119193 VJFSFUVGGXTZMQ-UHFFFAOYSA-N 382.798 2.804 0 50 GFAA Cc1ccc2ncc(C(=O)N(C)[C@@H]3CCCN(Cc4ccccc4)C3)c(=O)n2c1 173705738 CEVREKQSJLTBQH-LJQANCHMSA-N 390.487 2.740 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C(=O)C(C)(C)NC(=O)Nc3ccccc3)C2)no1 174607047 OAULMCARYVIJQT-HNNXBMFYSA-N 385.468 2.759 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2Cc3ccccc3N(C)C[C@@H]2C)c1 177401246 BYIKNLFQXFWLCI-INIZCTEOSA-N 380.492 2.715 0 50 GFAA O=C(NCc1cc2n(n1)CCNC2)c1cccc(OCc2cccc(F)c2)c1 82162111 QTKQHYAORUPINY-UHFFFAOYSA-N 380.423 2.634 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)Nc2ccc(OCCN(C)C)cc2)[nH]n1 132899047 OZIBZNXPCKPIIC-UHFFFAOYSA-N 382.468 2.620 0 50 GFAA Cc1cc(C)n2c(CN3CCC(C(=O)NCc4ccccc4)CC3)cnc2n1 179749124 CFDXJAIRAGRYJH-UHFFFAOYSA-N 377.492 2.875 0 50 GFAA CCN(CC)[C@@H](CNC(=O)Nc1cc(C)ccc1-n1cnnn1)c1ccco1 96152758 MRRXSPZKJDSSQJ-KRWDZBQOSA-N 383.456 2.768 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)o1 95365619 WOGRCCDZPLBGID-UHFFFAOYSA-N 396.491 2.774 0 50 GFAA COc1nccnc1N1CCC2(CC1)CC(=O)N(Cc1ccc(F)c(F)c1)C2 92077708 LFDGZMHNOPJNMA-UHFFFAOYSA-N 388.418 2.783 0 50 GFAA CSc1nc(N)cc(N2CCC(c3nccn3Cc3ccncc3)CC2)n1 95519338 XRWVNKFCTOEHAJ-UHFFFAOYSA-N 381.509 2.805 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2C[C@H]3CN(CC4CCC4)C[C@@]3(C(=O)O)C2)c1 96136350 KPOGNQRFMKKPKE-FOIQADDNSA-N 376.884 2.907 0 50 GFAA CC[C@H](C)n1nccc1NC(=O)N1CCN(Cc2cccc(OC)c2)C(=O)C1 96179875 RGPFQVWIFIWMTA-HNNXBMFYSA-N 385.468 2.739 0 50 GFAA O=C(CCc1cccnc1)NC[C@@H]1CCCN(Cc2cccc3nonc23)C1 827822436 LLLZFCKIQMFSHI-KRWDZBQOSA-N 379.464 2.579 0 50 GFAA O=C(c1cccc2ncnc(O)c12)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 1875280448 KIVDKQTVFIIDIB-MRXNPFEDSA-N 394.475 2.590 0 50 GFAA O=C(NCc1ccnc(N2CCC[C@H](O)C2)c1)c1c[nH]nc1-c1ccccc1F 1875261705 SAGRZSHVTRJFEA-HNNXBMFYSA-N 395.438 2.502 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](C)c3cnn(C(C)C)c3)C2)c1C 1875397440 AIBZHQQPTAMKAS-SJLPKXTDSA-N 399.543 2.502 0 50 GFAA C[C@H](C(=O)N1CCC[C@@H]1c1cn(C)c2ccccc12)n1cnc2c(N)ncnc21 1875312927 KMPRBNFMNNUDNV-CXAGYDPISA-N 389.463 2.825 0 50 GFAA O=C([C@@H]1CCCO1)N1CCC(NCc2nc(-c3ccccc3Cl)no2)CC1 952969518 NWFGFBXEQBTFGF-INIZCTEOSA-N 390.871 2.650 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC2=NCCS2)cc1)C1CCC(F)CC1 888096751 LAICSEDLGMZPLE-UHFFFAOYSA-N 385.486 2.535 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CCc2c(nnn2C)C1 888093952 NWUGYKFPFYUYPZ-TWOQFEAHSA-N 383.496 2.670 0 50 GFAA CN(C)C(=O)c1ccc(S(=O)(=O)NC(=O)CC(C2CCC2)C2CCC2)cc1 888100204 LVUZEHAIHPQZJR-UHFFFAOYSA-N 392.521 2.800 0 50 GFAA CO[C@@H](C)C(=O)N(Cc1scnc1C)C[C@@H]1CCN(C(=O)CCC2CC2)C1 1775989602 QNWKNQARCJIZRA-DOTOQJQBSA-N 393.553 2.854 0 50 GFAA O=C1CCCN1C[C@@H](NS(=O)(=O)Cc1noc2ccccc12)c1ccccc1 185696531 ANFSNRQNUNDKPM-QGZVFWFLSA-N 399.472 2.611 0 50 GFAA C[C@@H]1CCc2ccccc2N1S(=O)(=O)NC(=O)[C@H]1CCC(=O)c2ccccc21 793141504 OEABNPSLQULDES-KDOFPFPSSA-N 398.484 2.949 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)[C@H]2CC3CCN2CC3)CC1 1800409880 LDELOLKBQLJNGL-LJQANCHMSA-N 391.943 2.656 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2cccc(I)c2)C1 5979867 FYLWKESJVOWILJ-LBPRGKRZSA-N 387.217 2.707 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN(C)Cc2nccs2)cc1OC 11839326 KPCKNVPZBCRJAA-KRWDZBQOSA-N 393.553 2.865 0 50 GFAA COCCN1C[C@H](C(=O)NCC2(c3ccc(OC)cc3)CCCC2)CCC1=O 11951474 ORSWSPJCAYAXHD-QGZVFWFLSA-N 388.508 2.508 0 50 GFAA COc1ccc(-n2cccn2)c(CN[C@H]2CC(=O)N(Cc3cccc(F)c3)C2)c1 12193462 CHPNACQQKSJABO-IBGZPJMESA-N 394.450 2.911 0 50 GFAA O=C(N[C@@H]1CCCN(c2ncccn2)C1)c1csc(Cc2ccccc2)n1 12433215 SYIRBFWZEUUBLU-MRXNPFEDSA-N 379.489 2.923 0 50 GFAA CCOc1cc(CN2CCC(CCC(=O)N3CCOCC3)CC2)ccc1O 12443801 RZDYEPXFYFNCBK-UHFFFAOYSA-N 376.497 2.642 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1ccc(F)cc1F 15062386 OOYVKFFUGUQHSR-GOSISDBHSA-N 384.390 2.544 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1CCC[C@]2(CCc3c(O)nc(C)nc32)C1 1857683501 HOVKAUDZLOQOSG-NRFANRHFSA-N 383.496 2.951 0 50 GFAA Cc1nn(-c2ccccc2)c2sc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](C)CN4C3)cc12 1857688654 VBZFVVFJOUOQKJ-LXZKKBNFSA-N 396.516 2.987 0 50 GFAA O=C(COc1ccc(-c2nccn2CC[C@H]2CCCOC2)cc1)N1CCOCC1 1857714365 ZTUFXILXSYKKRB-GOSISDBHSA-N 399.491 2.604 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2ccccc2-c2ncn[nH]2)C[C@@H]1c1ccc(F)cc1 216855336 FVWHWFRSFOPPJC-SJORKVTESA-N 380.379 2.551 0 50 GFAA CCNc1nc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cs1 130903326 GIQCVKRNYMBQAX-UHFFFAOYSA-N 396.875 2.966 0 50 GFAA Cc1c(C(=O)N2CCC(C)(N(C)C)CC2)nnn1-c1ccc2ncccc2c1 823653383 XWCUUMODXDDXOQ-UHFFFAOYSA-N 378.480 2.680 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](SCC(=O)Nc3cccc(F)c3)C2=O)cc1 805899 DSOYNAQGINVWNH-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA Cn1cc(C2CCN(C(=O)[C@@H]3CC(=O)N(c4cccc(Cl)c4)C3)CC2)cn1 2325734712 XVIJIINASXYZER-OAHLLOKOSA-N 386.883 2.833 0 50 GFAA Cn1ncc2ccc(NC(=O)NCc3ccccc3CN3CCC(O)CC3)cc21 2325782076 VAMRIUZPGHEBCU-UHFFFAOYSA-N 393.491 2.852 0 50 GFAA O=S(=O)(NCCCCc1ccncc1)c1sncc1Br 2325804183 YXYAOEBFQDLYMV-UHFFFAOYSA-N 376.301 2.602 0 50 GFAA Cc1cnc2n1CCC[C@@H]2C(=O)NCc1cnc2ccc(Br)cn12 2325806399 QNTRHAZPIFXKKZ-AWEZNQCLSA-N 388.269 2.796 0 50 GFAA CCOC(=O)c1ccc(NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc1 713413 LNYQUCBQBPRBPF-UHFFFAOYSA-N 385.811 2.809 0 50 GFAA CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3ccccc3Cl)cc2)CC1 805024 ITYBWUQBPXAQRW-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA COc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)cc1 2279223 JSADMOOEAJWDDR-MRXNPFEDSA-N 380.400 2.723 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)Nc1ccnn1Cc1cccnc1 2356137191 RTVLNDTXXFWBTJ-UHFFFAOYSA-N 389.419 2.733 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCN(C)C(=O)[C@@H]3C)cc2)c2sccc2n1 2356148855 WPZPNQMPRAKSMD-LBPRGKRZSA-N 380.473 2.969 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cnc(C)nc3O)C2=O)cc1 2356166034 UFMFAZQMKFNSSU-NRFANRHFSA-N 380.448 2.601 0 50 GFAA COCCc1nsc(NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)n1 225739492 BZMOUNZFQHNIAW-CYBMUJFWSA-N 390.465 2.867 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccccc3Cl)CC2)cc(-n2cccn2)n1 67604374 MVRJREXYYGPTEU-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA Clc1cccc(Cl)c1N1CCN(c2ccnc(N3CCOCC3)n2)CC1 466476429 XVTHNEVLQFZZDI-UHFFFAOYSA-N 394.306 2.947 0 50 GFAA O=c1c2c3c(sc2ncn1Cc1cccc(F)c1)C[C@@H](N1CCOCC1)CC3 23337554 FUGGWJNUCODBFK-INIZCTEOSA-N 399.491 2.835 0 50 GFAA CN1CCCC2(CC1)CCN(C(=O)CCNC(=O)c1ccc(F)cc1)CC2 67846689 CLGNHMZURZYISI-UHFFFAOYSA-N 375.488 2.670 0 50 GFAA C[C@]1(c2ccc3c(c2)OCCO3)NC(=O)N(CN2CCC[C@@H]3CCCC[C@H]32)C1=O 229973232 WOYYFQKPYWYZKQ-LBUQITIBSA-N 399.491 2.837 0 50 GFAA C[C@H](Cc1cc(C(=O)N2CCN(c3ncccn3)CC2)on1)c1ccccc1 12052988 WVKLMCTUWDPGLF-MRXNPFEDSA-N 377.448 2.773 0 50 GFAA C[C@H](CCNC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)[S@@](C)=O 477194387 PBMHFVGDZDCTHI-DFMVQKSTSA-N 391.459 2.740 0 50 GFAA CCN(CC)C(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H]2CCCN2C)cc1 363520185 OMZWPNSNXJFFDR-PMACEKPBSA-N 386.540 2.937 0 50 GFAA O=C(N[C@H]1CCc2n[nH]cc2C1)C1(S(=O)(=O)c2ccccc2)CCCCC1 377434167 MFFFFMLPWCVRGU-INIZCTEOSA-N 387.505 2.560 0 50 GFAA O=S(=O)(CCC1CCOCC1)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 333110591 DXDSSCZUBSPYIN-OAHLLOKOSA-N 399.475 2.814 0 50 GFAA COc1ccc2cc([C@@H]3CN(C(=O)CCc4n[nH]c(C)n4)CCO3)ccc2c1 71715376 GOMMQLVGWFOVBJ-IBGZPJMESA-N 380.448 2.808 0 50 GFAA Cc1sc2nc(Cc3noc([C@@H]4OC[C@@H]5COCC[C@@H]54)n3)nc(O)c2c1C 377774330 GVVWMEBNTZGNBA-ZIBATOQPSA-N 388.449 2.712 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)c2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2)CC1 378148922 KTEGLMCTYASSDQ-CXAGYDPISA-N 397.479 2.618 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC[C@@H](c3ccnn3CC(=O)O)C2)cc1 426370658 USWGOWOVTKRCMR-MRXNPFEDSA-N 395.463 2.542 0 50 GFAA CCCC[C@H](N)C(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91254750 CFUOOROBAOZWMY-SFHVURJKSA-N 393.478 2.823 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@@H](c3ccccc3F)N(C)C)CC2)cs1 95355844 HJUWEDUHYOLLDQ-GOSISDBHSA-N 376.501 2.538 0 50 GFAA CN(C)c1nc(N2CCC[C@H](c3nccn3Cc3cscn3)C2)ncc1F 95528662 JCPINCOLUWNFBY-ZDUSSCGKSA-N 387.488 2.767 0 50 GFAA Cc1cc(C)nc(N2CCN(C(=O)c3ccc4nc(C)c(C)nc4c3)CC2)n1 97610186 XVDRUZYZOMIWFN-UHFFFAOYSA-N 376.464 2.616 0 50 GFAA CCN(CCN1CCCC1)C(=O)c1coc(COc2ccc3c(c2)OCO3)n1 91679463 VYXUBZLNQOPIBA-UHFFFAOYSA-N 387.436 2.540 0 50 GFAA Cc1ccc2ncccc2c1CNC(=O)[C@H](c1cccnc1)N1CCOCC1 95502572 XFGFNAPZUHDGGC-NRFANRHFSA-N 376.460 2.628 0 50 GFAA CC[C@@H](C)N(Cc1ccncc1)C(=O)Nc1cc(OC)cc(-n2cnnn2)c1 96159632 RJTKUOPDEAJWPF-CQSZACIVSA-N 381.440 2.899 0 50 GFAA Cn1cc(CNC(=O)N2CCC(OC[C@@H]3CCCO3)CC2)c(-c2ccccc2)n1 182732854 OHQITJZVIYOTJO-FQEVSTJZSA-N 398.507 2.957 0 50 GFAA COc1cc(C(=O)N2CCCC[C@H]2CN)ccc1OCc1csc(C)n1 299738825 GZYGSLLWYRBPFA-INIZCTEOSA-N 375.494 2.993 0 50 GFAA Cn1c(SCc2cc(C(N)=O)oc2C(C)(C)C)nnc1[C@H]1CCCNC1 534637737 IYOWCKAVSAFBLD-NSHDSACASA-N 377.514 2.564 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)[C@H]1CCCCN1C(=O)c1ccccc1 670452205 ZCHRWOQGMYCTDH-HXUWFJFHSA-N 380.492 2.990 0 50 GFAA C[C@H](C(=O)N1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1)S(N)(=O)=O 1875283140 HNKUJTBIWXYKHU-SJKOYZFVSA-N 378.881 2.643 0 50 GFAA Cc1c([C@@H]2[C@@H](NC(=O)c3c(Cl)ccc4ccncc34)CC(=O)N2C)cnn1C 1875392514 GRFZBWYTWZUFHD-QFBILLFUSA-N 397.866 2.632 0 50 GFAA COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)/C=C/c1cnc(N(C)C)nc1 952969040 OYKUQJOYFOFWNJ-RCMYXZNBSA-N 382.464 2.983 0 50 GFAA O=C1C[C@H](CNCc2cc3cc4c(cc3nc2O)OCO4)CN1C1CCCC1 952978871 TUYZQVVPYAFKTQ-CYBMUJFWSA-N 383.448 2.550 0 50 GFAA O=C(NCc1cccc(N2CCOCC2)n1)c1cccc(OCC(F)(F)F)c1 274774763 JLLHRJBAMCASPG-UHFFFAOYSA-N 395.381 2.789 0 50 GFAA CN(CC(=O)OC(C)(C)C)C1CCN(C(=O)COc2ccccc2Cl)CC1 170613046 FVNYSXGJJDLAML-UHFFFAOYSA-N 396.915 2.983 0 50 GFAA CS[C@H]1CCC[C@@H]1N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 170690275 LQRLJCKJYVPJTI-PMACEKPBSA-N 390.597 2.860 0 50 GFAA CC1CCN(C(=O)C2CCN(C(=O)c3cc4ccccc4[nH]c3=O)CC2)CC1 194317517 LIMNMXLXZWLADC-UHFFFAOYSA-N 381.476 2.639 0 50 GFAA CC(=O)N1CCC(N(Cc2ccc(-n3ccnc3)nc2)Cc2cncs2)CC1 795582521 HWTAHZUETHHPSS-UHFFFAOYSA-N 396.520 2.737 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC[C@H](C)N(C)C)ccc1F 1704315545 JQKXQZVOYFBQPC-LBPRGKRZSA-N 378.448 2.625 0 50 GFAA CCOc1cc(/C=C2/C(=O)N(CC)C(=S)N2C)c(Br)cc1O 1116326 YTWIGMHOQGDDCD-WDZFZDKYSA-N 385.283 2.973 0 50 GFAA CCOC(=O)COc1ccc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)cc1 1132571 ACOWSSHJNVWSGO-WOJGMQOQSA-N 398.390 2.861 0 50 GFAA Cc1no[n+]([O-])c1COc1cccc(/C=C2\N=C(c3ccccc3)OC2=O)c1 1208777 KZZAASIXNBZYLY-BOPFTXTBSA-N 377.356 2.540 0 50 GFAA Nc1nc(Sc2cccs2)cc(N2CCCN(C(=O)C3CC3)CC2)n1 1772815243 MRDPLYQCXIXYIW-UHFFFAOYSA-N 375.523 2.720 0 50 GFAA CCCn1c(C)c(CC(=O)N[C@H](C)Cn2cncn2)c2c1CC(C)(C)CC2=O 11662129 RIEQMXLEFVXPNN-CQSZACIVSA-N 385.512 2.701 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCC[C@H](OC)C3)n[nH]2)c(Cl)c1 12302829 VBNZZOPOULNAJG-AWEZNQCLSA-N 379.844 2.902 0 50 GFAA CN(CC[C@H]1CCCCO1)C(=O)CCc1nnc(-c2ccc3c(c2)OCO3)o1 12385914 QBOVSYUMIFOAOK-OAHLLOKOSA-N 387.436 2.816 0 50 GFAA CCn1nc(C)c(CNC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)c1C 12711983 QHIGYGGEBQCRIY-UHFFFAOYSA-N 398.419 2.746 0 50 GFAA COc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3F)C2)c(OC)n1 15070246 LJZDQFRYRMRMKG-MRXNPFEDSA-N 387.455 2.975 0 50 GFAA O=C(NCc1ccccc1)c1coc(CN2CCN(Cc3ccccc3)CC2)n1 19223764 WKVDLWUVSSKRJS-UHFFFAOYSA-N 390.487 2.922 0 50 GFAA CCOc1cc(/C=C2/N=C(c3cccs3)OC2=O)ccc1OS(C)(=O)=O 2825224 OLNWBPZPKORFHQ-FMIVXFBMSA-N 393.442 2.830 0 50 GFAA CC[C@@]1(C(=O)NC2Cc3ccccc3C2)C[C@@H]2CC[C@H]1N2C(=O)c1cnccn1 1857697681 IDENZGNDKAFDCT-JXHRLWIKSA-N 390.487 2.534 0 50 GFAA N=c1[nH]c2cc(C(=O)N[C@@H]3CC(=O)N(c4cccc(Cl)c4)C3)ccc2s1 1857719148 FECLUOAAUZFTDT-GFCCVEGCSA-N 386.864 2.898 0 50 GFAA CCOc1ccc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](C(C)C)CN3C2)cc1OCC 1857737280 FOTKUYVPVFMGFY-FUHIMQAGSA-N 376.497 2.712 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1 1875243803 YDWKWEJXTRESKL-FXAWDEMLSA-N 391.899 2.516 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3cnn(C4CCOCC4)c3C)CCO2)c1 120408729 RYJXUDBSEHGDPH-FQEVSTJZSA-N 385.464 2.765 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCC[C@H]3C3CCOCC3)ccc2N1 329475605 NUELOBYPIORPRG-SFHVURJKSA-N 378.494 2.541 0 50 GFAA O=C(Nc1cccc(Cl)c1-n1cncn1)[C@@H]1CN(Cc2ccccc2)CCO1 124860903 OQXAMIZVGQOXTH-SFHVURJKSA-N 397.866 2.760 0 50 GFAA COc1cccc(F)c1CN1C[C@H]2COC[C@@H]1CN(C(=O)c1cccs1)C2 1704327888 JBKRFCYAHUQHBP-CABCVRRESA-N 390.480 2.869 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2100477159 KUNCCPSFWUNNJP-QFIPXVFZSA-N 389.459 2.755 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2cnn(-c3ccccc3C)c2)C1=O 2100482741 VUSUUWXXEOXJJY-JOCHJYFZSA-N 382.508 2.784 0 50 GFAA Cc1oc(-c2cnn(C)c2)nc1C(=O)N1CCCc2c1ccc1c2ncn1C 2325774715 MCMOQMCQACKFQF-UHFFFAOYSA-N 376.420 2.863 0 50 GFAA COC(=O)CC[C@H](OC(=O)c1cc(Br)c2occc2c1)C(=O)OC 2325779560 OGMYOVZWLIYJFU-LBPRGKRZSA-N 399.193 2.847 0 50 GFAA CN(c1ccccc1)c1ccc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cn1 2325785606 FYOHGOMSSCGNJL-PWIZWCRZSA-N 391.475 2.616 0 50 GFAA Cc1nn(-c2ccccc2)cc1CNS(=O)(=O)c1ccc2c(c1)CCCNC2 2325800653 AFAQNNHLQKPNEB-UHFFFAOYSA-N 396.516 2.695 0 50 GFAA O=S(=O)(NCc1cccc2c1CCNC2)c1cc(O)cc(C(F)(F)F)c1 2325865406 BBZMGUGXKAYHGN-UHFFFAOYSA-N 386.395 2.535 0 50 GFAA Cc1c(Br)ccc(S(=O)(=O)NC[C@@H]2CCCCCN2)c1F 2325874346 JJLCFAUFOZCXMI-NSHDSACASA-N 379.295 2.707 0 50 GFAA Cc1nc(-n2nc(-c3ccc(N(C)C)c(F)c3)nc2C23CC4C[C@H]2[C@H]3C4)n(C)n1 2325879597 AGWKMEFOCXNMIC-CNVRBKQXSA-N 393.470 2.874 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1)N1CCCC1 921564 ZZNDEKVTUYCBCT-UHFFFAOYSA-N 376.453 2.639 0 50 GFAA CC(C)[C@@H]1CC(=O)c2nc(NC(=O)c3ccc(S(C)(=O)=O)cc3)oc2C1 2356134091 XPWDOBWTENCLCL-GFCCVEGCSA-N 376.434 2.732 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3cccc4ncsc34)cn12 2356144356 TWSROQPVIMCCKF-MRXNPFEDSA-N 381.461 2.958 0 50 GFAA COc1cc(OC)cc([C@@H]2CC(c3ccccc3F)=NN2S(C)(=O)=O)c1 225498965 ALRMCARKAIPSKN-SFHVURJKSA-N 378.425 2.954 0 50 GFAA O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(OC(F)F)cn1 469866199 LVGNGNSZVVGMLQ-QGZVFWFLSA-N 391.418 2.704 0 50 GFAA O=C(CCNC(=O)c1ccccc1F)N[C@@H](Cn1ccnc1)c1ccccc1 55198640 VZHXXLURNJQDDT-IBGZPJMESA-N 380.423 2.700 0 50 GFAA CC1(CNc2nc3ccccc3nc2NS(=O)(=O)c2ccccc2)COC1 112695858 AXDRDWDJINXCCX-UHFFFAOYSA-N 384.461 2.879 0 50 GFAA O=C(Nc1ccccn1)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 107086860 YKGYWCBMHTVTLT-ZZCKCESHSA-N 377.400 2.795 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)Nc4ccccc4F)CC3)ncn2)n1 65363132 NJOBHXRWSQUTPC-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)COc3ccc(Cl)cc3)CC2)n1 67602097 CDJIFLWQCOUNAG-UHFFFAOYSA-N 389.887 2.598 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCC(CN4CCCC4=O)CC3)cn2)cn1 67805493 JESZCZAUPPGTSN-UHFFFAOYSA-N 394.475 2.627 0 50 GFAA COc1cc(-c2cccs2)cc2c1OCCN(CC(=O)Nc1cnn(C)c1)C2 67726112 ONTVLRIDSVSCCH-UHFFFAOYSA-N 398.488 2.990 0 50 GFAA O=C(C1CCCCC1)N1CC[C@@H](NS(=O)(=O)c2cnc3ccccc3c2)C1 252493917 NGJQMHONMCGWCM-QGZVFWFLSA-N 387.505 2.694 0 50 GFAA CCn1ncc(S(=O)(=O)Nc2cnn(Cc3cccc(Cl)c3)c2)c1C 2805041 KOEHZEOHUMZPTO-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA CCO[C@@H](C)c1noc(CN2CCCC[C@H]2c2ccc(C(=O)NC)n2C)n1 328623676 CBKPTMCBBFHTDV-ZFWWWQNUSA-N 375.473 2.592 0 50 GFAA O=S(=O)(N[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc2c(c1)CCO2 431880167 FTWZBVMGROIDOG-OAHLLOKOSA-N 378.881 2.832 0 50 GFAA Cc1ccc(F)c(-n2cc(O)c(C(=O)NC[C@@](C)(O)c3ccc(F)cc3)n2)c1 253418090 DIFUWSRWXYOOGP-HXUWFJFHSA-N 387.386 2.802 0 50 GFAA Cn1nc(C2CCC2)cc1NC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 158834638 XAENGIMWOAVXCG-UHFFFAOYSA-N 383.420 2.865 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 261858310 PKHISXPPSRZIQN-QMTHXVAHSA-N 385.247 2.531 0 50 GFAA Cn1c(=O)n(C)c2cc(N3CCCCC3)c(NC(=O)NCc3ccccn3)cc21 374473074 UPKZYBFLECABBB-UHFFFAOYSA-N 394.479 2.584 0 50 GFAA C[C@@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCN(c2cnccn2)CC1 159034704 FHKTZEGGNGXLMM-AWEZNQCLSA-N 384.871 2.987 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC[C@]2(CCC(=O)N(C3CC3)C2)C1 77489582 ZBMIUSZMFOLDOH-QFIPXVFZSA-N 384.524 2.615 0 50 GFAA Cc1c(NC(=O)c2cc3c(cc2F)NC(=O)CC3)c(=O)n(-c2ccccc2)n1C 130253256 GRJCVUPYOPIMIX-UHFFFAOYSA-N 394.406 2.761 0 50 GFAA CN(C)CCN1C[C@]2(CCCN(C(=O)CCc3ccccc3F)C2)CCC1=O 82099005 OXTSEVSNODTKPS-JOCHJYFZSA-N 389.515 2.551 0 50 GFAA O=C1CN(C(=O)c2ccc([C@@H]3CCCN3)s2)CCN1Cc1cccc(F)c1 20236184 LMPAHDZCWZGJGY-INIZCTEOSA-N 387.480 2.796 0 50 GFAA COc1ccc(C(C)(C)NC(=O)N2CCC[C@@H](CCC(N)=O)C2)cc1OC 426648184 SFVPQIKTJGGWSO-AWEZNQCLSA-N 377.485 2.626 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)NC1CCN(Cc2cccnc2)CC1 177645143 IXADWUYMYDUPBG-IBGZPJMESA-N 386.540 2.589 0 50 GFAA CN(C)[C@H]1CCN(C(=O)CSc2cn(C)c3ccccc23)C[C@H]1CCCO 91563296 XJECSXLVGHIOKN-AEFFLSMTSA-N 389.565 2.822 0 50 GFAA CCN(C)C[C@@H]1CN(C(=O)Cc2coc3cc(C)c(Cl)cc23)C[C@@H]1CO 91914739 KACLOXDWVPUJCS-HZPDHXFCSA-N 378.900 2.956 0 50 GFAA COCCN(Cc1cccnc1)C(=O)[C@H]1CCC(=O)N(CC2CCCCC2)C1 91713281 RYQKANPWCGQCKS-FQEVSTJZSA-N 387.524 2.876 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N[C@H](C)c3nc(CC(C)C)no3)c(=O)[nH]2)cc1 92004263 CYMFNBSZNSRSDX-CYBMUJFWSA-N 381.436 2.818 0 50 GFAA O=C(CCc1cccs1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95500419 DADZPWAXIINJQH-UHFFFAOYSA-N 398.532 2.716 0 50 GFAA Cc1cccn2cc(C(=O)N[C@H](c3ccc4c(c3)CCO4)[C@H]3C[C@@H](O)C3)nc12 244898838 ZCLRQLRRWOTEMG-FUHIMQAGSA-N 377.444 2.820 0 50 GFAA O=C(OCc1ccccc1)[C@@H]1[C@H]2C=C[C@@]3(CN(Cc4ccc(F)cc4)C(=O)[C@H]13)O2 247749718 RSGURPYXAJJYPG-UGTOYMOASA-N 393.414 2.851 0 50 GFAA CCOc1cc(NC2CCN(C(=O)c3ccn(C4CCCC4)n3)CC2)ncn1 183966289 RMKIJWLUEHXFSF-UHFFFAOYSA-N 384.484 2.904 0 50 GFAA C[C@H](CCc1ccccc1)NC(=O)C[C@H]1N=C(O)N(Cc2ccccc2)C1=O 252552133 UPLVZOKPZTVHHS-VQIMIIECSA-N 379.460 2.839 0 50 GFAA C[C@H](C(=O)N1CCN(C(=O)c2cccnc2)CC1)c1cn(C)c2ccccc12 185052905 ZSMBCBXQUMUOTG-INIZCTEOSA-N 376.460 2.661 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)C3CC3)C[C@@H]1N(C(=O)Cc1c[nH]c3ccccc13)CC2 534666973 FGNOGYSJOZEPQM-DHJUGAMNSA-N 395.503 2.775 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(C)Cc2cc(-c3cccnc3)no2)CC1 534590208 HIOVQDFVPGNFIK-UHFFFAOYSA-N 380.452 2.863 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)[C@@H]1CCCN(c2ccccn2)C1 377445496 REJHJHQAQWLNQZ-LJQANCHMSA-N 375.476 2.843 0 50 GFAA Cc1nn(Cc2nnc(SCC(=O)O)n2-c2ccccc2F)c(C)c1C 65372621 JHLJNIPCIWEVEO-UHFFFAOYSA-N 375.429 2.753 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N(C)CC)CC[C@H]1NC(=O)c1ccc(N(C)C)cc1 1940197131 UEUANSVTUDONCN-DFQSSKMNSA-N 389.540 2.925 0 50 GFAA CCCc1nc(C)c(CNC(=O)c2ccc(C(=O)N3CCOCC3)cc2)s1 823015170 JOPYZGQEYXUQEP-UHFFFAOYSA-N 387.505 2.806 0 50 GFAA C[C@@H](NC(=O)Cn1c(=O)oc2ccccc21)c1cnn(-c2ccc(F)cc2)c1 827861856 WOZQEJYFFKFXKX-CYBMUJFWSA-N 380.379 2.797 0 50 GFAA CN(C)[C@H](C(=O)N1CCC(C(=O)NCc2ccco2)CC1)c1cccc(F)c1 826609412 XGCPSPOIDWHILQ-IBGZPJMESA-N 387.455 2.576 0 50 GFAA CN(CC[C@@H](O)c1ccccc1)C(=O)NC1CCN(C(=O)C2CCCC2)CC1 584894172 NJEXPEYYZSPYAP-HXUWFJFHSA-N 387.524 2.933 0 50 GFAA O=C(O)CN(C(=O)[C@@H]1C[C@H]1c1csc(Br)c1)C1CCOCC1 952848891 AOENHKJDRKDQCT-NWDGAFQWSA-N 388.283 2.706 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H]2CC[C@H]([C@H]3CCCO3)O2)cc1Br 1875296718 LEDSGVAUCZSXLK-KFWWJZLASA-N 398.253 2.901 0 50 GFAA CCOc1ncccc1S(=O)(=O)NC(=O)c1ccc(C)c(OC(F)F)c1 1875327748 JJXMLIJTKDOGCR-UHFFFAOYSA-N 386.376 2.509 0 50 GFAA N=[S@]1(=O)CCC[C@@]2(CCCN2C(=O)NCc2ccc(N3CCCC3)nc2)C1 1875393093 GDPPYJINVSQJEV-PPHZAIPVSA-N 391.541 2.567 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2cnco2)cc1 1875401571 LLOFDTYFOQRVFV-RDJZCZTQSA-N 379.420 2.789 0 50 GFAA C[C@H]1CCN(c2ccc3nnc(Br)n3n2)C[C@H]1C(=O)OC(C)(C)C 882511690 CXIIJRNYTCQEAE-WDEREUQCSA-N 396.289 2.691 0 50 GFAA O=C(N1CCCC1)N1CC[C@@]2(O)CCN(Cc3cccc4ncccc34)C[C@H]2C1 1565526883 QIMASAUMONVVMO-CVDCTZTESA-N 394.519 2.709 0 50 GFAA C[C@@H](C(=O)c1c[nH]c2ncccc12)N1CCC(c2nnc3n2CCCC3)CC1 275011758 RNRNLRUNLIGJMB-AWEZNQCLSA-N 378.480 2.942 0 50 GFAA O=C(c1ccc(-c2noc(C(F)(F)F)n2)cc1)N1CC[C@](O)(C(F)(F)F)C1 169994840 WBUWIZJLWYDWSY-CYBMUJFWSA-N 395.259 2.895 0 50 GFAA Cc1cc2c(cc1C)O[C@H](C(=O)N[C@H](Cc1c[nH]c3ccccc13)C(=O)O)C2 170044533 XBPXMDYPJVIXSF-QUCCMNQESA-N 378.428 2.900 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ccc1C 170598314 JAJCZQXZAYSHGL-YWZLYKJASA-N 389.521 2.923 0 50 GFAA COC(=O)C1(NC(=O)c2cnn(Cc3ccccc3Cl)c2)CCSCC1 170591032 HVTGCLUBOFGCAW-UHFFFAOYSA-N 393.896 2.753 0 50 GFAA CC(=O)Nc1ccc(/C=C/C(=O)NC2CCC(O)(c3cccnc3)CC2)cc1 187323408 PECMVHHJSGTZJY-RMKNXTFCSA-N 379.460 3.000 0 50 GFAA CS(=O)(=O)c1ccc(CC(=O)N2CCC([C@@H](O)c3cccs3)CC2)cc1 1506424178 ZHSXRPBFDISKJB-LJQANCHMSA-N 393.530 2.666 0 50 GFAA C/C(Cl)=C/Cn1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 727706 JTRIZPKMIMTFEH-WQLSENKSSA-N 390.896 2.901 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(Cc3nn(C)c4cccc(Cl)c34)C[C@@H]12 1529101871 QBZMZMXSERTXBX-APWZRJJASA-N 376.888 2.598 0 50 GFAA CSCC(=O)N1C[C@@H]2CN(C(=O)c3ccc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772706508 QVQHGSFLQBZWGU-XMSQKQJNSA-N 397.544 2.911 0 50 GFAA O=C(c1cc(COc2ccccc2)[nH]n1)N1CCC(O)(c2ccccn2)CC1 11934580 MNMMKNSREIDCKP-UHFFFAOYSA-N 378.432 2.508 0 50 GFAA CSc1ncc(CN2CCC[C@H](CNC(=O)c3n[nH]c4ccccc34)C2)cn1 12305490 XFMBINYWLIDUGC-CQSZACIVSA-N 396.520 2.717 0 50 GFAA O=C(NCCCOc1cccnc1)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 14978927 PHPOHITZLZYCNS-GOSISDBHSA-N 399.466 2.587 0 50 GFAA O=C(CC[C@]1(Cc2ccccc2)CCC(=O)N1)NCc1ccc2c(c1)OCO2 15068610 PRDDCXAUXODFLG-JOCHJYFZSA-N 380.444 2.703 0 50 GFAA COc1ccc(N2CCN(C(=O)c3c(-c4ccccc4)n[nH]c3C)CC2)cn1 1857677091 WWGRMQJNINSXLU-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA Cc1cc(CC(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cc(C)n1 1857666766 SQIAGHCLVNRTSY-JOCHJYFZSA-N 379.460 2.517 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1ccc2c(c1)CCCO2 1857731363 QESGJONHWDAYAO-JAXLGGSGSA-N 378.472 2.956 0 50 GFAA COc1ccc(CN2C[C@@H](O)[C@]3(C2)[C@H](c2ccccc2)[C@H]3CO)c(OC)c1C 1857736764 UVLIXZYHLBHDHH-KTDPBYDISA-N 383.488 2.581 0 50 GFAA COCC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@@H]1c1cnc2ccccc2n1 225507337 UVMBEKZLBNIQLJ-GOSISDBHSA-N 390.399 2.683 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2CCN(CC)CC2)sc2c1CC[C@H](C)C2 19792109 SFTUPUGBURZIJK-AWEZNQCLSA-N 393.553 2.626 0 50 GFAA COc1ccc(CC2CCN(C(=O)[C@@H](Cc3ccccc3)NC(N)=O)CC2)cc1 363208662 WZBVSWCOAXERIR-OAQYLSRUSA-N 395.503 2.756 0 50 GFAA O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ccc(-n3cnnc3)cc2)CC1 363343741 YUCCBRJCVUHMMD-UHFFFAOYSA-N 393.422 2.897 0 50 GFAA COc1ccc(C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)c(OC(F)F)c1 364505535 XDHBNAWADKLVTE-AWEZNQCLSA-N 397.399 2.945 0 50 GFAA CCOc1ccc2nc(N[C@](NC(C)=O)(C(=O)OC)C(F)(F)F)sc2c1 9109420 KXWCCYHBXGCBIV-CQSZACIVSA-N 391.371 2.675 0 50 GFAA CCc1cc(C(=O)N[C@H]2C[C@H](NC(=O)[C@@H](CC)Cc3ccccc3)C2)c(C)nn1 2325794176 TXUBEDDDOFSBSP-IHPCNDPISA-N 394.519 2.993 0 50 GFAA O=C(O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@H]2CCCc3nn[nH]c32)CC1 910030926 ABCBGGYIGHLCBH-IRXDYDNUSA-N 382.464 2.722 0 50 GFAA CCOC(=O)c1ccc(NC(=S)N2CCC[C@@H]2C(=O)N2CCCC2)cc1 1069235 NQVRQVWAWQKZNA-MRXNPFEDSA-N 375.494 2.647 0 50 GFAA CC(=O)OCCNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1 5092940 RNZKOTBIIPFCJV-QGOAFFKASA-N 386.835 2.790 0 50 GFAA CCc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)c1 8132607 JVBBKDVCATYURH-UHFFFAOYSA-N 390.505 2.777 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)c2cn3ccccc3n2)C1)c1ccc(F)cc1 11935649 DUTKEVFTTVTUSR-OAHLLOKOSA-N 380.423 2.756 0 50 GFAA CCCN1CCCN(c2ccc(C(=O)NCC[C@@H]3CCCCN3C)cn2)CC1 11952257 SOQMIBLMTFINEK-FQEVSTJZSA-N 387.572 2.608 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@H]1CCCCCN1C 12440922 IHAZSAXPHDEAGB-HXUWFJFHSA-N 381.524 2.646 0 50 GFAA CCc1ccc(CN(C)C(=O)c2cn(C[C@H]3COc4ccccc4O3)nn2)cc1 12704137 PUAMUYZLMXPVNK-SFHVURJKSA-N 392.459 2.953 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 12706530 LTBLRXFWPHMDTK-FQEVSTJZSA-N 390.434 2.713 0 50 GFAA CC(C)c1noc(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)n1 12713140 VCOZXHZQNDAZON-CQSZACIVSA-N 390.871 2.901 0 50 GFAA CCOc1cccc(-c2nn(CC(=O)Nc3cnn(C)n3)c3ccccc23)c1 23541016 MUKCZCGREAOQLW-UHFFFAOYSA-N 376.420 2.869 0 50 GFAA O=C(CCn1c(-c2ccccc2)cc2ccccc21)N1CCN(CCO)CC1 40288491 RIOQTAJZLHCSJY-UHFFFAOYSA-N 377.488 2.835 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1cccc(F)c1F)NCCCC1CCCC1 55108609 LEOOBHXUEJMJHW-GOSISDBHSA-N 393.478 2.742 0 50 GFAA CCN(Cc1noc(CC(C)C)n1)C(=O)c1ccc(CSc2ncn[nH]2)o1 55393500 DOWJEUDFRMCSBQ-UHFFFAOYSA-N 390.469 2.934 0 50 GFAA CN(CC[C@H]1CCCCO1)S(=O)(=O)c1ccc(N2CCCCC2=O)cc1 62156767 ZUHXWWZFTMAFDU-QGZVFWFLSA-N 380.510 2.783 0 50 GFAA Cc1cc(C)n(-c2cc(NCCNC(=O)c3c(F)cccc3F)nc(C)n2)n1 65363872 TXDQKAVLDRKJKV-UHFFFAOYSA-N 386.406 2.708 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)Nc3ccc(F)c(Cl)c3)CC2)n1 67629630 LWLICMVNUBJTBZ-UHFFFAOYSA-N 392.866 2.998 0 50 GFAA CCc1n[nH]c2c1[C@H](c1ccc(OCCN3CCCC3)c(OC)c1)CC(=O)N2 67974814 CSTANZBKKHIWDH-HNNXBMFYSA-N 384.480 2.929 0 50 GFAA CCCc1cnc(C)nc1N1CCC(N2CCC[C@H](C(=O)NC3CC3)C2)CC1 71753724 UAUBWOUVYVSVIQ-SFHVURJKSA-N 385.556 2.697 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)CCn3nccc3C)CC2)OC1=O 77505708 TWXYGTPYVFBUIV-UHFFFAOYSA-N 376.501 2.975 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91562809 XLPPCQLKWBHGHB-QFIPXVFZSA-N 380.492 2.508 0 50 GFAA O=c1cc(CN2CCc3nc[nH]c3[C@H]2c2ccccn2)[nH]c2c(F)cccc12 92066771 LPHHEVVFNPIADL-OAQYLSRUSA-N 375.407 2.933 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1C 95506941 PLYVVRZJORFOJQ-UHFFFAOYSA-N 392.503 2.953 0 50 GFAA C[C@H](N)C(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 95518639 NMWWJTUCKJKHJZ-ZDUSSCGKSA-N 385.430 2.688 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)N1CCCC[C@@H]1CCN1CCOCC1 96151991 WTMIPYCPRNTJHZ-LJQANCHMSA-N 383.496 2.981 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c(CC(=O)NCC3(O)CCCCCC3)c2C)n1 118698517 JREMQLKIUZTOII-UHFFFAOYSA-N 385.512 2.640 0 50 GFAA COc1ccccc1N1CC[C@@H](C)N(C(=O)CN(C)C(=O)OC(C)(C)C)CC1 170597647 CVXOUBHVODZUJF-MRXNPFEDSA-N 391.512 2.989 0 50 GFAA Cc1nn(C)c(Cl)c1/C=C/C(=O)NCc1noc(-c2cccc(F)c2)n1 170600620 VPENHBWXDASWGF-VOTSOKGWSA-N 375.791 2.901 0 50 GFAA O=C1[C@H](N2CCCN(C3CC3)CC2)CCCN1c1ccc(OC(F)F)cc1 173407357 GYLDFWLTFWOVSN-GOSISDBHSA-N 379.451 2.954 0 50 GFAA CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@H]1CCCCC(=O)N1 193941134 JPIDYELZNGJECD-MRXNPFEDSA-N 385.430 2.654 0 50 GFAA CCOC(=O)N1CCC(NC(=O)c2cc(-n3cccn3)ccc2Cl)CC1 215779113 XBHGCKBCXPTTAU-UHFFFAOYSA-N 376.844 2.876 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1ccc(CO)cc1)c1cccc2ncccc12 218799605 GIRWWJONVOUGIT-NHCUHLMSSA-N 378.428 2.693 0 50 GFAA CC[C@@H](NC(=O)Cn1c(C)cc(=O)c2ccccc21)c1cn2cccnc2n1 221287358 HZEKZUFAEYNZMS-MRXNPFEDSA-N 375.432 2.620 0 50 GFAA COc1cc(OC)cc([C@H]2CC(c3ccccc3F)=NN2S(C)(=O)=O)c1 225498997 ALRMCARKAIPSKN-GOSISDBHSA-N 378.425 2.954 0 50 GFAA CC(C)C[C@@H]1C[C@@H](NC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)CCO1 230222771 JNPHRNZIVASKAZ-ZCNNSNEGSA-N 378.488 2.909 0 50 GFAA O=C(NCC[C@H]1COc2ccccc2O1)c1ccc(N[C@H]2CC[C@H](O)CC2)nc1 244678456 IDINUUSXMCKTQN-BZSNNMDCSA-N 397.475 2.757 0 50 GFAA CSc1ccc(CN2C[C@H]3CN(Cc4cccnc4)C[C@@]3(C(=O)O)C2)cc1 247859763 VVTROCJKQLYQMR-RXVVDRJESA-N 383.517 2.822 0 50 GFAA CCOc1cccc2[nH]cc(CCNC(=O)N3CCC[C@@H](CNC(C)=O)C3)c12 252498167 QVSHAOITNMJANA-INIZCTEOSA-N 386.496 2.667 0 50 GFAA COc1cc(OC)nc(NC(=O)NCc2ncc(C(F)(F)F)cc2Cl)n1 263640069 WAUYUJFMBRIRQC-UHFFFAOYSA-N 391.737 2.883 0 50 GFAA Cc1cccc(-c2nnnn2[C@@H]2C[C@H]2C)c1NC(=O)N1CCOCC(F)(F)C1 288757045 HOAYOIHGVZWNEX-TZMCWYRMSA-N 392.410 2.729 0 50 GFAA Cc1oc(CN(C)C(=O)CCN2C(=O)CCc3cc(F)ccc32)cc1C(=O)O 299748977 ISZHCRIVFOSTTJ-UHFFFAOYSA-N 388.395 2.753 0 50 GFAA Cc1cccc(C[C@@H](CNC(=O)[C@@H]2CC(=O)N(C)c3ccccc32)C(=O)O)c1 299749076 JDLDXBVQNZDHNO-FUHWJXTLSA-N 380.444 2.505 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCC[C@H]3CNCCC[C@H]32)c1)c1ccco1 373561130 HWAMHQKGQFSEJQ-QFBILLFUSA-N 397.475 2.901 0 50 GFAA COc1cccc2c1C[C@@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)C2 419334211 SPUBQMVLHASNBW-WMLDXEAASA-N 375.266 2.741 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2ccc3nc(O)oc3c2)N2CCOCC2)o1 426503537 OYNIWBXWKXJWRV-HNNXBMFYSA-N 386.408 2.630 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N1CCOc2ccc(CO)cc2C1 426615599 VLEKLXQNQMUMEL-UHFFFAOYSA-N 379.460 2.902 0 50 GFAA CC[C@H]1[C@H](CO)CCN1C(=O)Nc1ccc(Cl)c(F)c1N1CCOCC1 455426960 ZRGBQEWWLGPHTM-WFASDCNBSA-N 385.867 2.940 0 50 GFAA CC(=O)c1ccc(-c2cccc(C(=O)NCCS(=O)(=O)CC(C)C)c2)nc1 534586974 NKTLBYIXXORXBC-UHFFFAOYSA-N 388.489 2.752 0 50 GFAA CC[C@@H](OC)C(=O)Nc1c(I)cnn1-c1ccccc1 888096634 DEVDQSVSDUQIPN-GFCCVEGCSA-N 385.205 2.840 0 50 GFAA CCc1cc(N2CCN(C(=O)c3cccc(NC(=O)C(C)C)c3)CC2)ncn1 952971367 IVVAFLHBPVDWBW-UHFFFAOYSA-N 381.480 2.596 0 50 GFAA O=C(CCc1ccccc1)[C@@H]1CCCN(C(=O)Cn2[nH]c3ccccc3c2=O)C1 1506401059 HQOBNCGPGFBIHX-GOSISDBHSA-N 391.471 2.770 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1NC(=O)C1CC1 1529190303 HAXWFSXZDDJMII-NHCUHLMSSA-N 394.471 2.918 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCCn4cccn4)C3)nc2c1 1857737536 RKSCXMCKOMLQDD-MRXNPFEDSA-N 397.479 2.846 0 50 GFAA CCN(Cc1nc(C)no1)C(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1875251170 OSNBMDFGQZHTOV-CQSZACIVSA-N 384.440 2.569 0 50 GFAA Cc1cccc([C@@H](CNC(=O)[C@H]2CCCC23CCNCC3)N2CCOCC2)c1 1875277116 IUTCGYYBVDAXGL-NHCUHLMSSA-N 385.552 2.654 0 50 GFAA CCn1nc(C)c(C(=O)N2CC[C@H](N(C)C(=O)c3ccc(C(F)F)cc3)C2)n1 1875327940 QIUJEZKZUDUDEC-HNNXBMFYSA-N 391.422 2.531 0 50 GFAA Cc1ccc(-n2nc(C(=O)NS(C)(=O)=O)cc2-c2ccc(F)cc2)c(C)c1 1875391133 KCKPNGDQFUBLEH-UHFFFAOYSA-N 387.436 2.985 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)Cc1c[nH]c2cnccc12 1875401145 GWNOVGUYJBKYJG-APWZRJJASA-N 394.479 2.983 0 50 GFAA NC(=O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCCCC2)C2(CC2)C1 2325790183 WMUWYFSLLVLRMN-MRXNPFEDSA-N 398.507 2.965 0 50 GFAA Nc1cccc(NC(=O)c2cccc(S(=O)(=O)Nc3cccc(N)c3)c2)c1 786451 DQHMHFMMZHNKNP-UHFFFAOYSA-N 382.445 2.904 0 50 GFAA COCCn1cncc1CN1CCC[C@]12CCCN(c1ccc(C)cc1)C2=O 2356135259 WKUKMBBOKGDNKP-JOCHJYFZSA-N 382.508 3.000 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@H]1c1ccc(SC)cc1 4476995 LYAQGMNUNZHKRV-XLSPSMHOSA-N 394.489 2.575 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(Cc2nncn2-c2ccccc2)CC1 225530460 SJPXAEXJNQBAQZ-UHFFFAOYSA-N 375.476 2.970 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3ccc(-c4ccccc4Cl)o3)C[C@H]2O)CC1 20325448 ZJJCRQUAHUCQPE-WOJBJXKFSA-N 389.927 2.783 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](N(C)Cc1cnn(-c3ccccc3)c1)C2 67855283 SCVCGWIYWAEZGJ-KRWDZBQOSA-N 379.464 2.776 0 50 GFAA c1cnc(N2CCN(Cc3csc(-c4ccc5c(c4)OCO5)n3)CC2)nc1 20534534 MOICJIPELMWNCG-UHFFFAOYSA-N 381.461 2.651 0 50 GFAA C[C@@H]1[C@@H](NC2=NN/C(=C3\C=NC(C(=O)N4CCCC4)=C3)CS2)CCC[C@H]1C 253390427 KDDICYIKNRUZNB-PMYLAIGBSA-N 387.553 2.853 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N[C@@H]2CCCOC2)Cc2ccccc2C1 72138659 VTYJLNILFBVLFZ-JOCHJYFZSA-N 378.516 2.994 0 50 GFAA CN(Cc1ccsc1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71750213 FGBOLBIWSQMIQV-GOSISDBHSA-N 389.565 2.820 0 50 GFAA NC(=O)[C@@H]1CCC[C@@H](NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 172442303 YTZWMQNIYYKSGR-HUUCEWRRSA-N 395.438 2.576 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CCCC[C@H]1CN1CCCC1=O 365506336 HFAZJJVVXXCSGT-SFHVURJKSA-N 398.507 2.896 0 50 GFAA CCCc1c(NC(=O)Nc2ccn(CCN(C)C)n2)cnn1-c1cccc(C)c1 444901933 LJQUMXZHADDHTJ-UHFFFAOYSA-N 395.511 3.535 0 50 GFAA Cn1ccc2ccc(NC(=O)N3CCC[C@@H]3c3nc(C(=O)NC4CC4)no3)cc21 372831056 MGJLWADTUXEHKI-OAHLLOKOSA-N 394.435 2.823 0 50 GFAA O[C@@H](CN1CCC([C@@H]2CCCOC2)CC1)CN1CCC([C@H]2CCCOC2)CC1 373183584 RKKGQTDBZWKYCG-JKHIJQBDSA-N 394.600 2.625 0 50 GFAA CCN(Cc1nc2ccccc2c(=O)[nH]1)[C@H](C)C(=O)Nc1nc(C)c(C)s1 157837912 BLHWYFLZPWJZJI-GFCCVEGCSA-N 385.493 2.846 0 50 GFAA O=C(NCCc1cnc(C2CC2)nc1)[C@@H]1CCCCN1C(=O)c1cccs1 378270490 ROJBLVJPLVIVCH-INIZCTEOSA-N 384.505 2.769 0 50 GFAA CC(C)(C)OC(=O)NCc1ccc(C(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)o1 245878980 KCUDGYPPUJGTNY-FVQBIDKESA-N 376.453 2.992 0 50 GFAA Cc1cc(C)cc(CN2CCC[C@H](c3nnc(CN4CCOCC4)n3C)C2)c1 426383174 WFCHQHYGCSCNRT-FQEVSTJZSA-N 383.540 2.644 0 50 GFAA O=C(c1ccc(-c2c(O)ccc3ccccc23)cc1)N1CCN(CCO)CC1 426526009 HVCQZNLCBFBBMM-UHFFFAOYSA-N 376.456 2.963 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)N(C)Cc2ccccc2)n1 44900423 UJQZOJOAVZKNRE-UHFFFAOYSA-N 381.407 2.717 0 50 GFAA COc1ccc(C(C)(C)NC(=O)N2CCN(CCSC)CC2)cc1OC 426517821 JNYAULFCARPIJA-UHFFFAOYSA-N 381.542 2.629 0 50 GFAA CC1(C)COCCN1CCNC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 179217378 YTTMFHIKWKQPEJ-OAHLLOKOSA-N 381.904 2.614 0 50 GFAA Cn1c(CN2CCCCC2)nnc1[C@H]1CCCN(C(=O)c2cccc(F)c2)C1 426444699 VOVIQVRREVUVRK-KRWDZBQOSA-N 385.487 2.960 0 50 GFAA Cc1ccccc1OC1CCN(C(=O)Cn2cnc3ccccc3c2=O)CC1 91746977 YKDADPSYBSARGQ-UHFFFAOYSA-N 377.444 2.775 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@H]2NC(=O)c1cnc[nH]c1=O 92066694 BESGNHCGDAFIIB-MRXNPFEDSA-N 377.448 2.708 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)NCCc3noc([C@@H]4CCCO4)n3)cc2)o1 95503302 CJEYATXOXUWINB-AWEZNQCLSA-N 384.396 2.644 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95363200 QSNZDSYCOLJCCQ-OAHLLOKOSA-N 384.509 2.933 0 50 GFAA COc1ccccc1CN(Cc1cc(=O)c2cc(C(N)=O)ccc2[nH]1)C1CC1 91663324 OFGOGRHCZOVPHY-UHFFFAOYSA-N 377.444 2.800 0 50 GFAA COc1cccc(N2C[C@@H](C)N(C(=O)Cc3c[nH]c4ccccc34)CC2=O)c1 91713819 XNVNDOZORBISNK-OAHLLOKOSA-N 377.444 2.983 0 50 GFAA CC(=O)NCCC(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)CN(C1CC1)C2 95357997 VDODOUQMJRDTSD-HXUWFJFHSA-N 383.536 2.773 0 50 GFAA O=C1[C@H]2[C@H](C(=O)N1c1cnn(Cc3ccc(Cl)c(Cl)c3)c1)[C@H]1CC[C@H]2O1 239173797 ORQFGHOGKYZHFZ-KLHDSHLOSA-N 392.242 2.905 0 50 GFAA COc1cc(Cl)c(C)cc1NC(=O)N1CCN(CC2CC2)[C@H](CCO)C1 96132235 MMOFPIQEQXJEHI-OAHLLOKOSA-N 381.904 2.968 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccccc2N2CCCC2)[C@H]2C[C@@H](O)C2)cn1 244795653 RKWKIZXSRFLERQ-FVJLSDCUSA-N 381.476 2.932 0 50 GFAA COc1cncc([C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)[C@H]2C[C@@H](O)C2)c1 244719100 LWVWKSJSFMIMEF-PTSWNOGYSA-N 378.432 2.722 0 50 GFAA CN1CC[C@](C)(CN(C)C(=O)NCc2nc(-c3ccccc3Cl)no2)C1 534652342 KXGCSVIXLCMSKA-SFHVURJKSA-N 377.876 2.873 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)c3cc(C)on3)C[C@@H]1N(CCc1ccccc1)CC2 534651820 AOZHWBFFRSHLDG-KAGYGMCKSA-N 383.492 2.968 0 50 GFAA COCCn1cnc2sc3c(c2c1=O)CC[C@@H](NCCc1ccccc1)C3 299778874 OZWXCDHJFOZXDV-MRXNPFEDSA-N 383.517 2.794 0 50 GFAA CN1CCN(c2ccc(C(=O)N[C@H]3CCCN(Cc4cccs4)C3)cc2)CC1 823792761 QDICKGNUDOTORB-IBGZPJMESA-N 398.576 2.894 0 50 GFAA O=C(N[C@@H](Cn1cccn1)c1ccccc1)c1ccccc1N1CCOCC1 670440849 ZQZQLBZUHKCUJI-FQEVSTJZSA-N 376.460 2.891 0 50 GFAA COc1cccc(C(F)(F)CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)n1 952853104 IBLJZNQGTSGOLG-RRQGHBQHSA-N 377.366 2.959 0 50 GFAA O=C(c1n[nH]cc1C1CCC1)N1CCCN(C(=O)c2n[nH]cc2C2CCC2)CC1 1875300783 QGMLPBDPLZALAK-UHFFFAOYSA-N 396.495 2.656 0 50 GFAA CCN1CC[C@H](CN(CC)Cc2cccn2S(=O)(=O)c2ccccc2)C1 952984036 ZAWFEOXHOXTOCF-SFHVURJKSA-N 375.538 2.889 0 50 GFAA NC(=O)c1cnn2c1C[C@@H](CNCc1cccc(OCc3ccccc3)c1)CC2 275534254 MDMFUOPRLRKOFV-IBGZPJMESA-N 390.487 2.913 0 50 GFAA CCCc1noc(CCCC(=O)N2CCN(c3nccc(C(C)C)n3)CC2)n1 186503521 JQDOEDQTTDQTHW-UHFFFAOYSA-N 386.500 2.607 0 50 GFAA Cn1cc(-c2cncc(C(=O)N3CCO[C@@H](c4ccc(F)c(F)c4)C3)c2)cn1 731188034 SLWSCENSDRRQJM-LJQANCHMSA-N 384.386 2.974 0 50 GFAA C[C@@H]1CN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CCS(=O)(=O)C1 191880114 WZMWBUQRERWSGL-OAHLLOKOSA-N 395.484 2.804 0 50 GFAA CNc1nc(C(N)=O)c(NC(=O)c2ccccc2OC(F)(F)C(F)F)s1 1529133855 CVNHMQLIMJJDEP-UHFFFAOYSA-N 392.334 2.773 0 50 GFAA O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529099552 BNAAGWIZLWXNKS-BTGUBCGPSA-N 385.504 2.669 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3C[C@@H](C(=O)O)C4(CCOCC4)C3)n[nH]2)cc1 1800411250 IODUFPGFHMGNMN-INIZCTEOSA-N 383.448 2.593 0 50 GFAA O[C@H]1CCCN(c2ccnc(NCCN3CCC(c4ccccc4)CC3)n2)C1 1704298837 DZJGELGCCDFIKI-FQEVSTJZSA-N 381.524 2.729 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3ccc(OC)cc3OC)n2)c1 5400081 VVQFCFMDRCJKIN-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA COc1cccc(C(=O)N2CCN(c3ccc(Nc4ccccn4)nn3)CC2)c1 11697488 CTEJYTYGNKSTBR-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA CC(C)c1cc(CN2CCC[C@H](CNS(=O)(=O)Cc3ccccc3)C2)n[nH]1 11753579 GEOPVVVJQALHIP-GOSISDBHSA-N 390.553 2.865 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)C(=O)c2ccco2)C1 11773615 FYNRYLDWKNXUDE-KRWDZBQOSA-N 384.476 2.884 0 50 GFAA COc1ccc(CCCN2C(=O)O[C@@H]3CN(c4nc(C)cc(C)n4)C[C@@H]32)cc1 12072448 PLONXFZAMITYQJ-RBUKOAKNSA-N 382.464 2.744 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2ccc(Cl)c(F)c2)C1)N1CCOCC1 12476390 ZMKSEWFAFNPKEP-AWEZNQCLSA-N 382.863 2.970 0 50 GFAA NC(=O)C1CCN(C(=O)C[C@@H](c2ccccc2)c2ccc3c(c2)OCO3)CC1 12480379 SSQIBDZIGUCVHF-SFHVURJKSA-N 380.444 2.661 0 50 GFAA NC(=O)C1(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(-c3cccc(F)c3)cc2)CC1 12594397 IRUUQONYCDNCRS-GOSISDBHSA-N 395.434 2.688 0 50 GFAA C[C@H](NC(=O)COc1ccc(-c2ncccn2)cc1CN(C)C)c1nccs1 14982558 CHXMPFXEMGHQMW-AWEZNQCLSA-N 397.504 2.918 0 50 GFAA COc1ccc(OCc2cc(C(=O)NCc3c(C)n[nH]c3C)n[nH]2)c(Cl)c1 15065432 DRCVYUMUUYVJIW-UHFFFAOYSA-N 389.843 2.921 0 50 GFAA Cc1cccc(CN2CCN(Cc3cccn3-c3cccnc3)C[C@@H]2CCO)n1 19225855 RWQNQKZEKJELAJ-QFIPXVFZSA-N 391.519 2.645 0 50 GFAA CC(C)CCn1c(CN(C)CCc2cn[nH]c2)cnc1S(=O)(=O)C(C)C 19758993 LRUBKNFODZHGSZ-UHFFFAOYSA-N 381.546 2.509 0 50 GFAA CNC(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)Cc1ccc(Cl)cc1Cl)C2 1857531692 CPRHBKCTOAWEFB-PSOPSSQASA-N 394.258 2.898 0 50 GFAA Cc1[nH]c(=N)nc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1Cl 1857673365 QRFALBBBXOYSJC-LJQANCHMSA-N 386.887 2.708 0 50 GFAA CCn1cc(-c2nnc3n2C[C@]2(CCN(CCCc4ccccc4)C2)OC3)cn1 1857689779 LDPFLWGZVHOFMB-JOCHJYFZSA-N 392.507 2.769 0 50 GFAA O=C([C@@H]1CCn2nccc2C1)N1CCCN(c2nc3ccccc3s2)CC1 1857700260 PRDIMDIXYBPREG-OAHLLOKOSA-N 381.505 2.794 0 50 GFAA O=C(c1cnccn1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857719606 PXPXXJDAUANKNB-UHFFFAOYSA-N 387.443 2.759 0 50 GFAA O=C(Cc1ccc(O)cc1)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1875250323 OYBKCBURSTYBPJ-CMKODMSKSA-N 386.879 2.919 0 50 GFAA Cc1ccc(CC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2c(C)noc2C)cc1 247875619 OHBASCMQHWKQIR-MOPGFXCFSA-N 381.476 2.792 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CNC2CCOCC2)cc1 20785569 WOXNEAPNLCYWLM-QFIPXVFZSA-N 384.520 2.827 0 50 GFAA COc1ccc(S(=O)(=O)CCNC(O)=C2C=C(c3cccnc3)N=N2)cc1 2083733108 WKVDFZSWGUPZMJ-UHFFFAOYSA-N 386.433 2.688 0 50 GFAA C[C@H]1C(=O)Nc2cc(C(=O)O[C@@H](Cn3cncn3)c3ccccc3)ccc2N1C 2325745744 UMWLUCHMJYXFIN-LIRRHRJNSA-N 391.431 2.653 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)Sc1cnn2c1CNCC2 2325777152 IGDPECMUKVKWKR-HNNXBMFYSA-N 396.520 2.908 0 50 GFAA C[C@@H](C(=O)Nc1ccnc(N2CCN(C)CC2)c1)n1ccnc1-c1ccccc1 2325797796 USBWCXASHUIBJG-KRWDZBQOSA-N 390.491 2.897 0 50 GFAA CCN1CCCN(c2nc3ccccc3c(=NCc3ccccc3)[nH]2)CC1=O 2325866244 FLXSLYJHURSAIE-UHFFFAOYSA-N 375.476 2.722 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3cc(Br)sc3C2)CC1 2325882841 GVUMZZJKVPKTJX-UHFFFAOYSA-N 383.311 2.820 0 50 GFAA CCOc1ccc(N2C(=S)N(c3ccccc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 1077137 TUBWQPMBYMSHSZ-MSOLQXFVSA-N 388.514 2.862 0 50 GFAA CC(C)CN1C(=O)c2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2C1=O 1170812 LRQSSTOXSUQTSB-UHFFFAOYSA-N 380.400 2.567 0 50 GFAA C[C@@H]1C[C@@]2(C[C@@](C)(C(=O)CSc3nc4ccccc4s3)OC2=O)C(=O)O1 4197390 UBMQUKPOVZTBAS-KTTLUUMZSA-N 391.470 2.985 0 50 GFAA aggregator COC(=O)C1=C(CSc2nccn2C)NC(=O)N[C@H]1c1cc(C)ccc1C 4809630 RPYKLMVYMGADHU-INIZCTEOSA-N 386.477 2.610 0 50 GFAA Cc1cc(NC(=O)c2ccccc2F)cc(C)c1OCC(=O)N1CCOCC1 4841392 ACWPDNUUFNDQQA-UHFFFAOYSA-N 386.423 2.932 0 50 GFAA O=C(NCC[C@H](NC(=O)OCc1ccccc1)C(=O)O)OCc1ccccc1 4899657 NJJLJGVZPXYNGT-KRWDZBQOSA-N 386.404 2.683 0 50 GFAA in-vitro CCOC(=O)[C@]1(Cc2ccccc2C)CCCN(C(=O)c2cc(C(C)=O)n[nH]2)C1 11663874 UIOPCRVYUYLQBZ-QFIPXVFZSA-N 397.475 2.949 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@]1(O)CNCc1ccc(F)cc1 11997175 RVUKRQQPDLFDOG-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA COC[C@@H](C)NC(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 12443446 BWLPJUVMKXRUMZ-QGZVFWFLSA-N 383.492 2.890 0 50 GFAA CCCN1CCC(NC(=O)C2(N3C[C@H](C)O[C@H](C)C3)Cc3ccccc3C2)CC1 12718715 SSCGRJHBKSQDDN-KDURUIRLSA-N 399.579 2.624 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@@H](N(C)Cc1ccon1)CC2 14743615 PECVLXPISUUUHH-SFHVURJKSA-N 393.491 2.670 0 50 GFAA O=C1CCN(C(=O)c2cc3ccccc3oc2=O)CCN1Cc1ccccc1F 14969125 GWPRBMJLPRMSSB-UHFFFAOYSA-N 394.402 2.807 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccc(-n4cccn4)c3)C[C@@H]2CCO)o1 20599971 IBQWXWWXNJYKQW-NRFANRHFSA-N 380.492 2.843 0 50 GFAA Cc1ccc(CN2CCN(CC(=O)Nc3cccc4nsnc34)CC2)cc1 22752094 QWCAXIIHDGACMF-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)c2cccc(C(=O)NC[C@H]3CCCO3)c2)cc1 71754830 CPKGZIOQBUNUHX-GOSISDBHSA-N 388.489 2.729 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCc3c(nc(-c4cccnc4)nc3N(C)C)C2)c1 71758941 AXEYDJUDORKXEU-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccccc4C)CC3)nn2)n1 72441826 LXFJDMVGPPVASI-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N[C@H](C)C3CC3)c2=O)cc1 77518307 KDPGAPURILULNK-OAHLLOKOSA-N 392.459 2.624 0 50 GFAA C[C@H]1CCCCN1CC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91504576 NAYJHANAPLERCJ-IBGZPJMESA-N 398.551 2.687 0 50 GFAA O=C1CC[C@@H](c2nc(-c3ccc4nc[nH]c4c3)no2)CN1CCc1ccccn1 91586793 AYSQVWLFJADKKG-OAHLLOKOSA-N 388.431 2.957 0 50 GFAA COCCCN1CC2(CCN(Cc3nc4ccccc4nc3C)CC2)CC1=O 95362367 GGIRYUIPACEMHS-UHFFFAOYSA-N 382.508 2.789 0 50 GFAA O=C(NCCSc1ccc(Cl)cc1)[C@@H]1CC(=O)N(Cc2cccnc2)C1 95520235 SJFSERNSTHYBJW-OAHLLOKOSA-N 389.908 2.992 0 50 GFAA O=C(NCCSc1ccc(Cl)cc1)[C@H]1CC(=O)N(Cc2cccnc2)C1 95520236 SJFSERNSTHYBJW-HNNXBMFYSA-N 389.908 2.992 0 50 GFAA O=C(Nc1cccc(OCc2ccccc2)c1)N1C[C@H]2C[C@H](O)[C@H](O)C[C@H]2C1 95522925 KMNWEGQLZHLNNH-BTYSMDAFSA-N 382.460 2.861 0 50 GFAA CCN1CC2(CCN(Cc3nc(COC)no3)CC2)C[C@@H](c2ccccc2)C1=O 96152855 IFNLGUFKDWXYTP-SFHVURJKSA-N 398.507 2.834 0 50 GFAA COc1ccccc1Cc1nc(Cc2ccc3nc(C)[nH]c3c2)n(CCO)n1 96152923 SKHKKIORFCWFIU-UHFFFAOYSA-N 377.448 2.645 0 50 GFAA O=C(c1cccc(CN2CCS(=O)(=O)CC2)c1)N1CC2(CC2)c2ccccc21 172428058 SCSNXFJEXMMAQQ-UHFFFAOYSA-N 396.512 2.609 0 50 GFAA Cc1cccc2[nH]cc(CCNC(=O)NC3CCC(S(C)(=O)=O)CC3)c12 174707765 QFRNMKRYSVBXEB-UHFFFAOYSA-N 377.510 2.674 0 50 GFAA CCc1cc(N2CCC(NC(=O)N3CCC[C@H]3c3ccncc3)CC2)ncn1 175470945 SBLVEPIKXJQVMY-IBGZPJMESA-N 380.496 2.950 0 50 GFAA CCn1ccnc1CS(=O)(=O)Cc1nn(-c2ccc(F)cc2)c2c1CCC2 179807108 BBKBXGCSYXBHAG-UHFFFAOYSA-N 388.468 2.832 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)s1 189491907 IVJPLIUBYGKZII-ZDUSSCGKSA-N 394.522 2.522 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCc2nc(-c3cccnc3)[nH]c2C1 215403851 NNJXWKQXXIHXAY-UHFFFAOYSA-N 377.448 2.859 0 50 GFAA COc1ccc(CCNC(=O)[C@H](C)N2CC(c3nc4ccccc4[nH]3)C2)cc1 225482939 RTZSKLJJXGQHRA-HNNXBMFYSA-N 378.476 2.718 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@@H](C)[C@@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237481686 ISRIKHAUGJGJAT-SUMWQHHRSA-N 385.464 2.661 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)OCc1ccccc1Cl 239432998 XBUIVWSKYHUACM-JROKTQBJSA-N 385.847 2.826 0 50 GFAA O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)Nc1ccc(Cl)c(Cl)c1 239433039 XDBLINCRGNVXGY-NYZVLYBASA-N 384.215 2.673 0 50 GFAA O=S(=O)(c1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@H]32)cc1)N1CCOCC1 247340402 AJDYMPQWJUBBCZ-LELZANKISA-N 390.549 2.622 0 50 GFAA C[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)CC[S@]1=O 253424853 LEAIVVMXLVBJDW-HWRSSNJWSA-N 398.550 2.778 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cc(O)c3cccc(F)c3n2)[C@H]2C[C@H](O)C2)c1 253534867 MYOAYRIALDOUKP-BLWXERESSA-N 397.406 2.725 0 50 GFAA CC(=O)N1CCCN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CC1 266469848 UQHQUPMTMHQTBT-UHFFFAOYSA-N 399.451 2.612 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)cc1OC 268948288 RDTDHBPDGSFUHU-JXFKEZNVSA-N 399.443 2.956 0 50 GFAA COc1ccc(NC(=O)N2C[C@@H](OC)C[C@@H]2c2nc(C)no2)c2cccnc12 275220020 AHFVDOWDVXSFFZ-SWLSCSKDSA-N 383.408 2.929 0 50 GFAA Cc1cc(CS(=O)(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)no1 276416452 BULDRWGIIQZGBQ-GFCCVEGCSA-N 390.292 2.988 0 50 GFAA O=C(c1cccc2[nH]ccc12)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328616268 BNFGHRXDHAUKSR-IBGZPJMESA-N 377.448 2.772 0 50 GFAA CN1CCC(N(Cc2ccncc2)C(=O)NCc2nc3ccccc3[nH]2)CC1 426493066 VAUTYWGYKWNACT-UHFFFAOYSA-N 378.480 2.764 0 50 GFAA CN(C)CCOc1ccccc1-c1cccc(C(=O)NCc2cnn(C)c2)c1 426722413 IYJILDKHKNOLLZ-UHFFFAOYSA-N 378.476 2.958 0 50 GFAA CN(C)c1nc(N2CCN(C(=O)c3ccc(F)cc3)CC2)nc2ccccc12 450243632 LOTJQWUAAUQQAJ-UHFFFAOYSA-N 379.439 2.797 0 50 GFAA CCc1noc(C)c1C(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1 486391944 ZKUOEABZFBRZJX-MRXNPFEDSA-N 385.420 2.877 0 50 GFAA Cc1cc2nc(CCNC(=O)N3CCC[C@H](c4cc(O)ncn4)C3)[nH]c2cc1C 534647927 CLVNEBWSQKQDHB-HNNXBMFYSA-N 394.479 2.807 0 50 GFAA O=C(NC[C@H](c1cccnc1)N1CCCCC1)c1ccccc1N1CCOCC1 952965033 FHBHSQAAGRIHBR-JOCHJYFZSA-N 394.519 2.875 0 50 GFAA C[C@H](c1ccccn1)N(C)Cc1cnc(NS(=O)(=O)c2ccccc2)nc1 952984813 NJLXYOHZRXQBKO-OAHLLOKOSA-N 383.477 2.865 0 50 GFAA COc1cc2nc(N3CCC[C@H](OCc4ccccn4)C3)nc(N)c2cc1OC 1529161387 HCTBMXFYYNKFGT-HNNXBMFYSA-N 395.463 2.810 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@H]3C[C@H]4OCC[C@@H]34)cc2)c(=O)c2ccccc12 1565515528 HCXXJLSOYRJAAH-SLFFLAALSA-N 375.428 2.601 0 50 GFAA O=S(=O)(N[C@H]1CCOC[C@@H]1OCC1CC1)c1ccccc1C(F)(F)F 1565527482 MFXXCNWDTZICSS-KBPBESRZSA-N 379.400 2.568 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)[C@@H]2CCC[C@H](O)C2)CC1 1565528308 CFUCLIHEHRYLLY-AEFFLSMTSA-N 380.916 2.723 0 50 GFAA CCOc1ccc(C(=O)N2CC(=O)N[C@@H](Cc3ccccc3)C2)cc1OCC 1772709091 GTIAKEQTDHWZPD-SFHVURJKSA-N 382.460 2.667 0 50 GFAA CCCCO[C@H](C)C(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1C(F)F 1775991926 OZROYSVMLCTHCH-JHMPBIJASA-N 386.483 2.979 0 50 GFAA COCCn1cnnc1[C@@H](C)n1ccnc1-c1cc2cc(C)ccc2nc1O 1857686640 ANGDPZGZNWVIGL-CQSZACIVSA-N 378.436 2.960 0 50 GFAA O=C(Cc1cccs1)N1CCC[C@]2(C1)CN(c1nccs1)CC[C@H]2O 1857688046 QQZUYRIJGOMANP-QAPCUYQASA-N 377.535 2.627 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(c3nc4cc(C(=O)OC)ccc4n3C)CC2)O1 1857710821 RGGIYSYAJLTLFN-CVEARBPZSA-N 387.480 2.649 0 50 GFAA COc1cccc(CN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1OC 1857727261 OFTSPYLRMKUWSU-NOXFTYBFSA-N 394.471 2.978 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCc1cn2ccccc2n1 1857730245 NWLFWMJZKNLJDW-HNNXBMFYSA-N 390.447 2.793 0 50 GFAA Cc1nc([C@H](C)OC(=O)[C@H]2CC(=O)Nc3ccc(Br)cc32)no1 1875260198 QUUIJMZFEPNCKE-CPCISQLKSA-N 380.198 2.871 0 50 GFAA CN(C)[C@@H]1COC[C@H]1CNC(=O)Nc1ccc(-n2ncc3ccccc32)cc1 1875316414 OYBJXMRWHZRQEJ-OXQOHEQNSA-N 379.464 2.724 0 50 GFAA O=C(c1cccc(O)n1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100473505 NPNZPTQBJOCWDP-QFIPXVFZSA-N 379.460 2.627 0 50 GFAA O=C(CN1CC[C@@H](C(F)(F)CO)C1)N1CC=C(c2c[nH]c3ccccc23)CC1 2325809894 YEBKBOZMUPDRGS-MRXNPFEDSA-N 389.446 2.733 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)COCc3nc4ccccc4[nH]3)C1)CC2 2356153489 JDRUUVAIEVDROP-QFIPXVFZSA-N 391.475 2.685 0 50 GFAA O=C(O)c1c(-c2ccccc2)o[nH]c1=NC1CCN(Cc2ccncc2)CC1 2356159203 QQSOFLYDEXAMLN-UHFFFAOYSA-N 378.432 2.933 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC4(CC3)CNC(=O)O4)ncnc21 2356169832 IIFCYGQCGWDSAC-UHFFFAOYSA-N 386.500 2.904 0 50 GFAA CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 6706765 KJAOPTVHWNEYIV-UHFFFAOYSA-N 389.477 2.792 0 50 GFAA CC[C@@H](c1ccc(F)cc1F)N1CCN(c2ccc(C(=O)N(C)C)nn2)CC1 413171933 OAOLFAVJYMVBDO-SFHVURJKSA-N 389.450 2.730 0 50 GFAA Cn1nccc1-c1ccccc1OCCN(Cc1ccccc1)S(C)(=O)=O 225451705 SIBQILUGKITHPT-UHFFFAOYSA-N 385.489 2.928 0 50 GFAA COc1cccc2c1C[C@H](N[C@@H](C(N)=O)c1ccc(Br)cc1)C2 419333629 SPUBQMVLHASNBW-RHSMWYFYSA-N 375.266 2.741 0 50 GFAA Cn1nc2c(c1C(=O)N1CCC[C@@H](C(=O)c3ccc4c(c3)OCO4)C1)CCCC2 20599782 USFFLQFUJUHJPX-OAHLLOKOSA-N 395.459 2.763 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1CCC[C@@H](N(C)CCc2ccccc2)C1 72171304 OBXDAYGMLPIULG-HXUWFJFHSA-N 381.520 2.781 0 50 GFAA O=C(NCCn1ccc2ccc(Cl)cc21)[C@H](Cc1ccccc1)n1cnnn1 170625391 BEGCZDCTUQLOKX-IBGZPJMESA-N 394.866 2.881 0 50 GFAA Cn1nc(C(=O)N2CC[C@]3(CCCN(CCC4CCCCC4)C3)C2)ccc1=O 12704715 VUTPYZDUDIEUDD-QFIPXVFZSA-N 386.540 2.679 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc2ccccc2c1)NCc1ccccc1 11944632 MIGLHMQKVGULPI-JOCHJYFZSA-N 387.483 2.847 0 50 GFAA CN(C)CCNC(=O)CCC1CCN(Cc2nc3c(s2)CCCC3)CC1 11958577 ZLWXBXKXZQZOBT-UHFFFAOYSA-N 378.586 2.692 0 50 GFAA COC(=O)c1c(NC(=O)CN2CCN(Cc3ccco3)CC2)sc(C)c1C 20343188 JQDFEXMXWJUSST-UHFFFAOYSA-N 391.493 2.501 0 50 GFAA C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)O[C@H]3CCCCC3=O)cc2)C1 252457303 WVLXQYVLORCYKQ-KDOFPFPSSA-N 379.478 2.776 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)c2nnnn2C2CC2)cc1NC(=O)c1ccco1 252510166 ZCTGSTLXTGXAKZ-GFCCVEGCSA-N 380.408 2.653 0 50 GFAA Cc1csc(NC(=O)[C@@H]2CCCN(C(=O)N[C@@H]3[C@H]4CCO[C@H]4C3(C)C)C2)n1 252513914 AVINFTYNRVNRDH-KBUPBQIOSA-N 392.525 2.625 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)[C@H](C)n1cnnn1)C2 67695538 ACVFWDZMRNTTCA-ZDUSSCGKSA-N 399.476 2.701 0 50 GFAA CCN1C(=O)c2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@]3(C)C4(C)C)cc2S1(=O)=O 229864037 BEQTYKPGLOADGY-OWDMVUQNSA-N 390.505 2.796 0 50 GFAA Cc1sc2nc(CS[C@H](C)C(=O)NC[C@H](C)C[C@H](C)O)[nH]c(=O)c2c1C 230136009 NHNIXAFEQQHUOU-GBIKHYSHSA-N 397.566 2.746 0 50 GFAA O=C(c1c[nH]nc1[C@@H]1CCOC1)N1CCC(c2nc(-c3ccccc3)no2)CC1 364538808 FQAXFLGGBSLTJJ-MRXNPFEDSA-N 393.447 2.983 0 50 GFAA CCN1CCC(CC(=O)N2CCC3(CC2)CN(CCC(C)C)C(=O)O3)CC1 77504750 HKFUMLBIOFIHKW-UHFFFAOYSA-N 379.545 2.968 0 50 GFAA COc1ccc(NC(=O)CCN2CCC3(CC2)C[C@H]3C(=O)N(C)C2CC2)cc1 369508993 FXIRLCSPASUVKP-IBGZPJMESA-N 385.508 2.747 0 50 GFAA CN(CCN1CC2(CCN(C(=O)C3(C)CC3)CC2)OC1=O)C1CCCCC1 77470894 XOGAZXYBLZHHFS-UHFFFAOYSA-N 377.529 2.864 0 50 GFAA CC1(C)CN(C(=O)N[C@H]2CCO[C@]3(CCOC3)C2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 333113361 SPUUJVJIAZRCHJ-COPBIKPMSA-N 378.513 2.704 0 50 GFAA CN1C(=O)[C@@](CC(=O)N2CCC(CN)CC2)(Cc2ccccc2)c2ccccc21 71415701 BTDUNJXQEMIOHM-XMMPIXPASA-N 391.515 2.731 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)c1 72463458 ITHSHNWKGIUCRK-QFIPXVFZSA-N 387.568 2.685 0 50 GFAA CCn1c(=O)nc(O)c2c(C(=O)NCc3cc(C)cs3)cc(C3CC3)nc21 452744388 MCJRVNOPFMUANH-UHFFFAOYSA-N 384.461 2.694 0 50 GFAA O=C(Cc1ccc(Cl)cc1F)N1CCN(S(=O)(=O)c2ccccc2)CC1 71754947 JWIHZSFRJVRLIN-UHFFFAOYSA-N 396.871 2.555 0 50 GFAA Cc1ccccc1C(=O)NCc1nc2ccccc2n1CC(=O)N1CCCC1 40276150 DPCUUAANWGZSIA-UHFFFAOYSA-N 376.460 2.897 0 50 GFAA Cc1cc2cc(C(=O)N3CCCn4nc([C@H](O)CN(C)C)cc4C3)ccc2o1 221408895 URNBCLXLUJVYLE-LJQANCHMSA-N 382.464 2.579 0 50 GFAA O=C(N[C@@H]1CCCNC1)c1ccccc1SCC(=O)N1CCc2ccccc21 238033016 NRARTCGEJFTRHI-QGZVFWFLSA-N 395.528 2.850 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1cccc2ccnn12 82097654 COPYKVUTGCIJNF-UHFFFAOYSA-N 378.480 2.609 0 50 GFAA Nc1ncc(C(=O)N2CC[C@@H](Cc3cccc(CO)c3)C2)c(-c2ccccc2)n1 91950686 MVCCJXGSMOAWGH-KRWDZBQOSA-N 388.471 2.923 0 50 GFAA CN(C)Cc1nnc(C2CCN(Cc3cccc4nonc34)CC2)n1C1CC1 96148258 QLYGHCYFCCDTCA-UHFFFAOYSA-N 381.484 2.590 0 50 GFAA O=C(NCc1csc(-c2ncccn2)n1)c1cccc([C@H]2CCCNC2)c1 95384637 FIUNTNIVKDLCLR-INIZCTEOSA-N 379.489 2.997 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC1CCN(C(=O)c3ccccn3)CC1)C2 91847100 GBYCIFUFZYBXNR-INIZCTEOSA-N 381.476 2.536 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2CCOCC2)C3)c2c(C)noc2n1 95380633 IUAFHHZVKVLNEX-DOTOQJQBSA-N 384.480 2.555 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)Cc3cc(C)no3)C2)cc1 95509618 ACBJMHMBIPEGFJ-IBGZPJMESA-N 385.508 2.947 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1ccnnc1 96150446 IUCWLXIWRRHDPQ-LJQANCHMSA-N 382.508 2.902 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1C[C@H]2CC[C@@H]1CN(Cc1ccc(F)cc1)C2 95391527 CAUWTNMUASYOPJ-RBBKRZOGSA-N 382.479 2.984 0 50 GFAA CN(C)C(=O)N1CC[C@]2(O)CCN(c3ccnc4cc(Cl)ccc34)C[C@@H]2C1 95359851 RDEQFYKICURHSQ-JLTOFOAXSA-N 388.899 2.833 0 50 GFAA O=C(C[C@H]1N=C(O)N(c2cccc3ccccc23)C1=O)NCCc1ccco1 252572567 ZKIYGFFRHJQWIS-QGZVFWFLSA-N 377.400 2.811 0 50 GFAA COCCN1C[C@@H](CNC(=O)c2cc(C(F)(F)F)ccc2Cl)CC1=O 252494397 NULJMNPLVQFJQN-SNVBAGLBSA-N 378.778 2.584 0 50 GFAA CCN(CC)C(=O)c1cc(C(=O)Nc2ccc3c(C)cc(=O)oc3c2)n(C)n1 49967592 WZWJKJGNJCEYGD-UHFFFAOYSA-N 382.420 2.569 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@@H]2c2nccn2Cc2ccccc2)cccc1=O 952890613 FIELSDPQJKXGSV-IBGZPJMESA-N 376.460 2.853 0 50 GFAA O=C(N=c1ccn(-c2ncccc2Cl)[nH]1)N[C@@H]1CCO[C@H](c2ccncc2)C1 1875265763 ZHPYKQKISAHQAC-ZBFHGGJFSA-N 398.854 2.779 0 50 GFAA O=C(N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1)[C@@]1(F)CNCC12CCC2 1875292795 SVIHXEZFPTZIAQ-DYVFJYSZSA-N 397.376 2.511 0 50 GFAA COC(=O)C1=NO[C@]2(CCCN(C(=O)N[C@@H](C3CCCC3)C(F)(F)F)C2)C1 1875296463 YGJNGHIGGOVQSQ-XJKSGUPXSA-N 391.390 2.601 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1cccc(OC)c1C)C[C@H](C)O[C@@H]2C 1875316048 RXOQYUGQOOINCF-DZGCQCFKSA-N 387.480 2.799 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)C1=NO[C@@H](c2ccccc2)C1 1875389515 QYLFLQCJIMFJAO-TZIWHRDSSA-N 389.455 2.760 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1occc1COc1ccccc1 1875403483 VAGXVSPGZKYTQD-ATZDWAIDSA-N 381.432 2.625 0 50 GFAA COc1cc(C2(C(=O)N[C@@H]3C[C@@H](Cn4cccn4)C[C@H]3O)CCC2)ccc1C 1875402509 ICGSLKDDNDDYHM-BHIYHBOVSA-N 383.492 2.578 0 50 GFAA O=C([C@H]1CCCO1)N1CCC(NCc2nc(-c3ccccc3Cl)no2)CC1 952969522 NWFGFBXEQBTFGF-MRXNPFEDSA-N 390.871 2.650 0 50 GFAA Cc1cc(CNC(=O)CN2C(=O)CNC2=O)c2[nH]c(-c3ccccc3)c(C)c2c1 71639364 GRESPVCSOCURDP-UHFFFAOYSA-N 390.443 2.620 0 50 GFAA CCOc1ncccc1C(=O)NCC1CCN(C(=O)Cc2cccs2)CC1 952868205 FBKVCQHFMNGRRT-UHFFFAOYSA-N 387.505 2.753 0 50 GFAA C[C@@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccnn1CC1CC1)[C@H]1COc2ccccc21 888101625 KDDIXWHTSWVRLC-HAXDFEGKSA-N 396.491 2.987 0 50 GFAA CCCN1C[C@@H]2CC[C@H]1CN(Cc1ccccc1OCCN1CCOCC1)C2 1565507313 LQQWPYGIQCVMFL-IRLDBZIGSA-N 387.568 2.704 0 50 GFAA C[C@@H](Oc1cccc2ccccc12)C(=O)N1CC[C@H](c2cc(O)nc(O)n2)C1 898231117 HVZYCXFZESYJNA-HIFRSBDPSA-N 379.416 2.824 0 50 GFAA CCc1ccc(N2C[C@H](c3nc(Cc4cccc(C(N)=O)c4)no3)CC2=O)cc1 274008833 VXDXFLHIHQAQMS-QGZVFWFLSA-N 390.443 2.842 0 50 GFAA Cc1ccnc(-c2ccc(NC(=O)N3CCN(C)[C@@H](c4nccn4C)C3)cc2)n1 275521794 MHGCAZVYTXRBCZ-GOSISDBHSA-N 391.479 2.706 0 50 GFAA NC(=O)c1cnn2c1C[C@H](CNCc1cccc(OCc3ccccc3)c1)CC2 275534256 MDMFUOPRLRKOFV-LJQANCHMSA-N 390.487 2.913 0 50 GFAA CC(C)CCO[C@@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4ccc(O)cc4)n3C2)C1 170614663 SNJVWCBRYUCAEF-PKOBYXMFSA-N 398.507 2.877 0 50 GFAA COCCN(C)c1ccc(CN2CCN(c3ccncc3Cl)CC2)cn1 191408139 WRLZTTHMFVEERI-UHFFFAOYSA-N 375.904 2.535 0 50 GFAA C[C@@H](NC(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1nnnn1C1CC1 193018989 ZOYTWEWFNSLNBZ-SNVBAGLBSA-N 395.389 2.769 0 50 GFAA CCOc1ccc(N2C[C@H](C(=O)N3CCOCC4(CCCC4)C3)CC2=O)cc1 773061016 DOYFRKWZBBBIHK-QGZVFWFLSA-N 386.492 2.857 0 50 GFAA COc1cccc([C@@H]2CCN(Cc3cnc(N4CCOCC4)s3)C2)c1OC 1506412331 WYYCIEFVYKGUBM-OAHLLOKOSA-N 389.521 2.986 0 50 GFAA O=S(=O)(Cc1ccc(Cl)cc1F)NC1CCN(C[C@H]2CCCO2)CC1 1506417948 UIMUISKKYWEXBW-MRXNPFEDSA-N 390.908 2.542 0 50 GFAA O=S(=O)(c1ccc(-c2csc(-c3nc[nH]n3)n2)cc1)N1CCCCC1 1775977238 XGKNTTCCQCUCGK-UHFFFAOYSA-N 375.479 2.770 0 50 GFAA O=C(Nc1cccc2cccnc12)c1ccc(N2C(=O)CCS2(=O)=O)cc1 11998108 DXUSWXIWHHLJMF-UHFFFAOYSA-N 381.413 2.554 0 50 GFAA COc1ccc(C(=O)NCc2cnc(C)cn2)cc1OC1CCN(C(C)C)CC1 12092091 QYCUZRLMOVTECT-UHFFFAOYSA-N 398.507 2.975 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N2CCN(Cc3cccs3)CC2)n[nH]1 12300470 IWRLSHYFEIVIDV-UHFFFAOYSA-N 398.536 2.797 0 50 GFAA CC(C)c1cc(CNC(=O)[C@@H]2CCCN(C3CCN(C(C)C)CC3)C2)on1 12466025 QRGDZJUWGIPPBP-QGZVFWFLSA-N 376.545 2.999 0 50 GFAA COc1ccc(Cn2ccc3c(cnc4nc(-c5ccncc5)nn43)c2=O)cc1 13733492 HUASGQKVTFZLAQ-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA Cc1ccc2occ(CN3CCc4nnc([C@@H]5CCCO5)n4CC3)c(=O)c2c1 19839200 DKRSJSUEFWRJDD-SFHVURJKSA-N 380.448 2.603 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N4CCCN(C)CC4)C3)nc2c1 1857699171 QGIAKYNPCGHVGL-INIZCTEOSA-N 386.496 2.607 0 50 GFAA COc1cccc(F)c1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857730671 UKDWCPVSGDSMGB-CECAUBDESA-N 396.418 2.749 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NC[C@H](Cc1ccccc1)C(=O)O 236587898 WOGXYBGPCYOVSG-PZJWPPBQSA-N 394.471 2.582 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)Nc3ccccc3C(=O)O)C1)CC2 1704332520 ZDOGCBGQRGZCON-NRFANRHFSA-N 395.463 2.753 0 50 GFAA CCOc1ccc(N2C[C@H](C(=O)NC3CC(C)(C)NC(C)(C)C3)CC2=O)cc1 4535236 YNBSZGIKYGEORH-OAHLLOKOSA-N 387.524 2.864 0 50 GFAA O=C(c1cccc2ncnn12)N1CCCN(c2nc3ccccc3s2)CC1 2100539317 CFOMPGSQRJSXNS-UHFFFAOYSA-N 378.461 2.692 0 50 GFAA Cc1cccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC(C)CC3)n2)c1 1857797812 VCSDVJOSQJPXGC-QGZVFWFLSA-N 393.491 2.905 0 50 GFAA O=S(=O)(Nc1ccccc1)[C@@H]1CCCN(C2=NCCN2Cc2ccccc2)C1 2325841425 UJRDXKAOKFLCMW-HXUWFJFHSA-N 398.532 2.765 0 50 GFAA O=C1NC(=S)NC(=O)C1=Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 1188835 ZHBGRVSGFOCZFR-UHFFFAOYSA-N 392.415 2.593 0 50 GFAA C[C@H](Nc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1)c1ccccc1 1265653 JTKSXPSGYYQWQT-AWEZNQCLSA-N 375.432 2.645 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2ccccc2)C[C@H]1Nc1nccc(=N)[nH]1 2356147245 NXWYUGDWKKHYPG-RCCFBDPRSA-N 383.496 2.581 0 50 GFAA COCCNC(=O)CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 2961088 LSSOBVKJIPBZNC-UHFFFAOYSA-N 396.896 2.606 0 50 GFAA COc1ccc(Cc2nnc(NC(=O)c3cc(C)nc(O)c3)s2)cc1OC 2356170908 QJKRXQOJEMEWQL-UHFFFAOYSA-N 386.433 2.807 0 50 GFAA O=C(CNC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)OCc1ccccc1 4764370 ABBUEKAIKQURGG-LJQANCHMSA-N 396.443 2.647 0 50 GFAA O=C(NCCCn1ccnc1)/C(=C\c1cccs1)NC(=O)c1cccs1 4816022 LWFRGDLZRDIOAD-NTCAYCPXSA-N 386.502 2.984 0 50 GFAA Cc1c(C(=O)N2CCCC[C@@H]2CN2CCOCC2)cnn1-c1ccccc1F 110956414 PQFBXELXOZLTON-QGZVFWFLSA-N 386.471 2.647 0 50 GFAA O=c1c2c(-c3ccccc3)n3ncnc3nc2ccn1-c1ccc2c(c1)OCCO2 22607886 YKFVWXJMRYOZEY-UHFFFAOYSA-N 397.394 2.867 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)[C@@]2(C)CCCO2)CC1 67934045 WBEBJNDPZHNFJQ-HSZRJFAPSA-N 394.519 2.902 0 50 GFAA c1ccc(CN2CC[C@H](NCc3noc(-c4ccc5c(c4)OCO5)n3)C2)cc1 67688713 SNTXIFBWGBKRHN-KRWDZBQOSA-N 378.432 2.829 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)CN2CCCC2=O)CCO3)s1 67956136 XKZNTIYHQDAKTD-UHFFFAOYSA-N 386.473 2.773 0 50 GFAA Cc1ccccc1-c1noc(CNC(=O)c2ccc(CN3CCOCC3)cc2)n1 65364213 UFXOIBCDFXZQSL-UHFFFAOYSA-N 392.459 2.807 0 50 GFAA Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1CN(C)C[C@H](O)CO 72427299 UEQGLRPXGQIHCM-KRWDZBQOSA-N 387.430 2.911 0 50 GFAA O=C(Nc1ccc(F)c(F)c1)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2794528 MQOQSELPXUGBCF-UHFFFAOYSA-N 381.346 2.573 0 50 GFAA C[C@H](C(=O)NCCc1nc2c(s1)CCCC2)c1n[nH]c(=O)c2ccccc12 215213771 PMZWAZXYJQTTFP-LBPRGKRZSA-N 382.489 2.721 0 50 GFAA NC(=O)N1CCN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CC1 72478626 DECFXKLWXKRWLB-UHFFFAOYSA-N 392.463 2.508 0 50 GFAA CN1C(=O)C[C@H](C(=O)NCc2ccc(C(=O)O)cc2)[C@@H]1c1cccc(Cl)c1 237057288 NKZJLTSTHRJWTI-WMZOPIPTSA-N 386.835 2.874 0 50 GFAA O=C(NCc1ccccc1)c1cc(N2CCOC3(CCOCC3)CC2)ccn1 368676579 OGLBGWZVHIVVOU-UHFFFAOYSA-N 381.476 2.788 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)N[C@H](C(=O)O)c1ccccc1 71335317 MISCWZKSLHWPOJ-IBGZPJMESA-N 397.818 2.506 0 50 GFAA CC(C)(C)n1nccc1NC(=O)C(=O)N1CCC[C@H](c2ncc3n2CCCC3)C1 374436467 ULBPXXRUFMSSNT-HNNXBMFYSA-N 398.511 2.516 0 50 GFAA CNc1nc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2ccccc2)C3)cs1 72433459 DNNRFYIJRJVKKR-UHFFFAOYSA-N 384.505 2.840 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)N3CC[C@H](c4ccccc4C(=O)O)C3)c2n1 72146296 CTZYOSMQLJWIIA-HNNXBMFYSA-N 378.432 2.982 0 50 GFAA C[C@H](N[C@@H]1CCC[C@@H]2OCC[C@H]21)C(=O)NC1CCN(Cc2ccccc2)CC1 245794559 XVMHIKIYAUYQJF-MVWVFHAYSA-N 385.552 2.703 0 50 GFAA Cc1nc(O)cc(C2CCN(C(=O)CN3CC[C@@H](c4ccccc4)C3)CC2)n1 220142039 UDBAIRDLLRUBPE-LJQANCHMSA-N 380.492 2.686 0 50 GFAA Cc1c(NCC(C)(C)C)cccc1C(=O)N1CCC(CNS(C)(=O)=O)CC1 289250422 FUGRPUXTWIHCTH-UHFFFAOYSA-N 395.569 2.854 0 50 GFAA CCOc1ccc(C(=O)N2CCN(c3ccnc(N4CCCCC4)n3)CC2)cc1 82230333 JBNFTKZFMFDLLJ-UHFFFAOYSA-N 395.507 2.828 0 50 GFAA O=C(CN1CC[C@@](CO)(c2ccccc2)C1)Nc1ccc(N2CCCCC2)nc1 291357426 YMICUKYGXBOREY-HSZRJFAPSA-N 394.519 2.646 0 50 GFAA CCn1ccnc1C1CCN(C(=O)c2ccc(N3CCN(C)CC3)cc2)CC1 95531745 QUSBMTZLFVKZGB-UHFFFAOYSA-N 381.524 2.675 0 50 GFAA O=C(C[C@@H]1CCCS(=O)(=O)C1)N[C@@H](c1ccccc1)c1ccc2[nH]cnc2c1 292941941 BGHTYEKADXAVDB-BTYIYWSLSA-N 397.500 2.983 0 50 GFAA Cc1c(CC(=O)NCc2cc[nH]n2)c2c(n1Cc1ccccc1)CCCC2=O 95524337 AQNMTELEEIGGND-UHFFFAOYSA-N 376.460 2.946 0 50 GFAA CC(C)Nc1cc(N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)ncn1 95372716 UJIKHEJLLLMDFH-KRWDZBQOSA-N 387.528 2.685 0 50 GFAA CCOc1ccc(CN2CCC(c3nnc(CN4CCCC4)n3C)CC2)cn1 96142318 UFNPMYXJQLZRAR-UHFFFAOYSA-N 384.528 2.584 0 50 GFAA CC1(C(=O)N2CCC(CN3CCOCC3)CC2)CCN(Cc2ccccc2)CC1 184663998 DINKDKUZUOJICR-UHFFFAOYSA-N 399.579 2.860 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N[C@@H](Cn2cccn2)c2ccccc2)c1 607362967 OJVKSZLVTHVZBP-KRWDZBQOSA-N 387.461 2.620 0 50 GFAA O=C(N[C@]1(CO)CCOC1)c1csc(-c2ccc(Br)s2)n1 182837537 UUONUSZZZCBMMK-ZDUSSCGKSA-N 389.296 2.515 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)cc1 299748660 HVDMAHDPLVHWPV-XIRDDKMYSA-N 379.478 2.728 0 50 GFAA COCc1ccc(C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2CC(=O)O)o1 299745951 UGEWFWIFLRBTIM-HNNXBMFYSA-N 389.404 2.658 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(C)Cc2cnn(-c3ccccc3)c2)CC1 534660516 DXCKIPLYNWMIMG-UHFFFAOYSA-N 378.480 2.999 0 50 GFAA COc1cc(CNC(=O)N2CCCN(Cc3ccccc3F)CC2)ccc1O 368842603 DEYHCCAGKIYDKM-UHFFFAOYSA-N 387.455 2.957 0 50 GFAA CC1(C)C[C@@H](NC(=O)Cn2c(O)nc(=O)c3ccccc32)c2ccccc2O1 268431298 FLKVSKMRORUJLC-OAHLLOKOSA-N 379.416 2.521 0 50 GFAA CN(C)C1(CNS(=O)(=O)c2cc(C(=O)O)c(Cl)cc2F)CCCCC1 823653504 HEGBAEWGZCAJOX-UHFFFAOYSA-N 392.880 2.720 0 50 GFAA Cc1cccc(N2CCC(NC(=O)[C@@H]3CC(=O)N(Cc4ccncc4)C3)CC2)c1 670454184 JDUWMMUCMUWDKZ-LJQANCHMSA-N 392.503 2.524 0 50 GFAA O=C(NCCSc1cnn[nH]1)c1cc(-c2ccncc2)nc2ccccc12 670436144 HDSBENPAFYUFKZ-UHFFFAOYSA-N 376.445 2.937 0 50 GFAA COc1ccc2nc(CNC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)[nH]c2c1 670437795 IBPDWJDADUIUQR-LJQANCHMSA-N 392.459 2.883 0 50 GFAA O=C(O)[C@H](c1ccc(F)cc1Cl)N1CCC2(CCS(=O)(=O)CC2)C1 1875290850 FNZSDGRRSHNFET-AWEZNQCLSA-N 375.849 2.506 0 50 GFAA O=C(Nc1ncc(C[C@H]2COCCO2)s1)[C@@H]1C[C@H]1c1ccncc1Cl 1875295808 REDXTDFKNYFFFC-LEWSCRJBSA-N 379.869 2.892 0 50 GFAA O=C(N[C@H]1CCCN(c2nc3ccccc3[nH]2)C1)c1ccc(=NCC2CC2)[nH]c1 1875316243 DCFBFTRIWBZVBD-KRWDZBQOSA-N 390.491 2.601 0 50 GFAA C[C@H](COC(=O)NS(=O)(=O)NCc1ccc(F)cc1F)c1ccccc1 1875322696 BGCQVCDQOOBTGV-GFCCVEGCSA-N 384.404 2.829 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2c(C)cccc12)C(=O)N[C@H]1CN(C)C2(CCCC2)C1 1875309812 OTMKBAZWJOBRRA-UYAOXDASSA-N 396.535 2.657 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@]1(CN[C@H]1CCS(=O)(=O)C1)c1ccccc1 1875340048 JIKMSFJYLJWGJQ-FXAWDEMLSA-N 394.537 2.690 0 50 GFAA O=S(=O)(c1ccc(F)c(F)c1F)N1CCC[C@H](OCc2ccccn2)C1 952964794 DLFJOWXNKLLHBN-ZDUSSCGKSA-N 386.395 2.869 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CCc2nc[nH]c2[C@@H]1c1cccnc1 952972675 HLNXCTXLRRGFOZ-NRFANRHFSA-N 376.416 2.640 0 50 GFAA COc1cccc(C(=O)N2CCS(=O)(=O)c3ccccc3C2)c1OC(F)F 275046326 KRRCVEAVNWKUGB-UHFFFAOYSA-N 397.399 2.726 0 50 GFAA C[C@@H]1C[C@@H](O)CN1c1cnn(CCOc2ccc(Cl)cc2)c(=O)c1Cl 170088631 QPLRDDVAKQRSJZ-DGCLKSJQSA-N 384.263 2.589 0 50 GFAA O=C(NOC[C@@H]1CCOC1)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 188320642 NDCYIBMOJJLPAN-IAQYHMDHSA-N 387.263 2.682 0 50 GFAA CCc1nc(C2CCN(C(=O)[C@H](C)Cc3ccc(OC)c(OC)c3)CC2)n[nH]1 191499284 VLHCHJWMGKJGHH-CQSZACIVSA-N 386.496 2.969 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)NC(=O)Cc1ccc(C)cc1 764697020 ICOZSYJEHFQZPX-UHFFFAOYSA-N 397.880 2.721 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2CCc2cccc(O)c2)cc1 1506422459 RAJTXKPLAXAYPL-QGZVFWFLSA-N 388.489 2.667 0 50 GFAA COCCCn1c(CN(C)[C@H]2CCCc3ccccc32)cnc1S(C)(=O)=O 11936710 PIDXBECXLSIELJ-IBGZPJMESA-N 391.537 2.833 0 50 GFAA Cc1nc(CNC(=O)c2cn(C/C=C/c3ccccc3)nn2)nc2c1CCCC2 12709704 XUAVHPHAAKORQU-JXMROGBWSA-N 388.475 2.899 0 50 GFAA O=C(NCc1csc(-c2cccs2)n1)c1cn(C[C@@H]2CCCO2)nn1 14978842 WKTFDRBSJQSBRW-LBPRGKRZSA-N 375.479 2.572 0 50 GFAA O=C(CSc1ncn[nH]1)Nc1nnc(SCc2ccc(F)cc2)s1 18210712 FOQOSPWGQZMAQX-UHFFFAOYSA-N 382.471 2.818 0 50 GFAA COc1ccc(OC)c(NC(=O)CCN2CCN(Cc3ccccc3)CC2)c1 19366855 YECJEQZBUFOYFS-UHFFFAOYSA-N 383.492 2.850 0 50 GFAA Cc1nnc2sc(-c3ccc(CNS(=O)(=O)c4ccccc4)cc3)nn12 19945461 LSYCCFLSCOZBGH-UHFFFAOYSA-N 385.474 2.640 0 50 GFAA Cn1c(C(=O)NCCN2CCOCC2)ccc1-c1ccccc1Br 158924117 IJRKUFVGLAZHPW-UHFFFAOYSA-N 392.297 2.517 0 50 GFAA O=C(CCC1CCCC1)NC[C@H]1[C@H]2CN(C3CCOCC3)C[C@]23CC[C@H]1O3 1857710287 PATFAANNSFUGJL-GPQLQYNLSA-N 376.541 2.731 0 50 GFAA COc1ccc(CN2CC[C@H](N3CCCCCC3)[C@@H](O)C2)c(OC)c1OC 247821097 DBFCIUHQPFKTBY-ROUUACIJSA-N 378.513 2.524 0 50 GFAA CCCN(C(=O)c1conc1COC)C1CCN(C(=O)c2ccccc2)CC1 486070710 GFTPWTVTMSKOOF-UHFFFAOYSA-N 385.464 2.978 0 50 GFAA N[C@@H]1CCc2cc(C(=O)N3CCC(CCc4cccnc4)CC3)ccc2NC1=O 2325769188 SPANAZJUTKPROG-HXUWFJFHSA-N 392.503 2.779 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccccc2)o1 2325785717 KIZJGPWHPHDCPN-ATZDWAIDSA-N 381.432 2.625 0 50 GFAA CCc1nnc(N2C[C@@H](C)[C@@H](CNC(=O)C3(C)CC(F)(F)C3)C2)nc1CC 2325793919 LOMGWFGPRSCNAF-OLZOCXBDSA-N 381.471 2.620 0 50 GFAA COc1cc(CC2CN(C(=O)c3n[nH]cc3-c3ccncc3)C2)cc(OC)c1 2325798005 FWRIDIRVWBRCOK-UHFFFAOYSA-N 378.432 2.804 0 50 GFAA Cc1ccc(CNC(=O)[C@]23CCCC(=O)N2CCC3)c(OC[C@H]2CCOC2)c1 2325808412 XXENOPPDKNPYBN-HTAPYJJXSA-N 386.492 2.572 0 50 GFAA CCCc1[nH]nc2ccc(C(=O)NCCN3C(=O)COc4ccccc43)cc12 2325854696 QMPNSZFQZAWABV-UHFFFAOYSA-N 378.432 2.671 0 50 GFAA O=C(NC[C@H]1CCCO1)c1nc2nc(-c3ccccc3)cc(C(F)(F)F)n2n1 826513 ZQKWJJGAXDDVOV-GFCCVEGCSA-N 391.353 2.719 0 50 GFAA COc1ccccc1NC(=S)N[C@@H](NC(=O)N(C)C)C(Cl)(Cl)Cl 3130738 GGMNNTRYORIZAR-JTQLQIEISA-N 399.731 2.949 0 50 GFAA CCCC(=O)c1cn(CC(=O)NC[C@@H](O)c2cccc(O)n2)c2ccccc12 2356155376 DZXZOEWPJNPOOO-LJQANCHMSA-N 381.432 2.575 0 50 GFAA Cc1ccc(Cn2c(SCCC(C)C)nc3c2c(=O)n(C)c(=O)n3C)cc1 8658305 NAXBYLIPKREPOY-UHFFFAOYSA-N 386.521 2.929 0 50 GFAA O=C(NCc1ccccc1N1CCCCC1)N1CCCN(C(=O)C2CC2)CC1 134207845 QZJXASXQRRRUGE-UHFFFAOYSA-N 384.524 2.831 0 50 GFAA COCCc1noc(CN(C)C(=O)c2ccc(NC(=O)c3ccoc3C)cc2)n1 55255158 YXRAFZJNCIYLHJ-UHFFFAOYSA-N 398.419 2.684 0 50 GFAA Cc1cc(=O)[nH]c(-c2ccccc2CN2CCCN(C(=O)c3ccoc3)CC2)n1 23145113 ANYIEMSSWDXTRA-UHFFFAOYSA-N 392.459 2.686 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCCO2)ccc1N(C)S(=O)(=O)c1ccccc1 65363372 PHKGHCDTSOAVCI-KRWDZBQOSA-N 388.489 2.729 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 136507908 DQRKLJLCGIJAQU-OXJNMPFZSA-N 390.487 2.984 0 50 GFAA CC1=C(C(=O)NCc2coc(-c3ccccc3)n2)[C@@H](c2cccnc2)NC(=O)N1 67880066 RHAVHNDQBOMOHV-GOSISDBHSA-N 389.415 2.681 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](N(C)Cc1cc(-c3ccncc3)no1)C2 67885990 XMJYYBXODIOTAK-AWEZNQCLSA-N 381.436 2.641 0 50 GFAA CC(=O)c1ccc(C(=O)NC[C@@H]2CCCN(c3cccc(C(=O)O)n3)C2)s1 1506415674 BDSGDRWGUADDNG-ZDUSSCGKSA-N 387.461 2.690 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cc(C2CC2)no1 67713699 YACKPNUEIURXFZ-UHFFFAOYSA-N 377.448 2.951 0 50 GFAA CCOc1ccccc1CN1CCN(C2CCN(C(C)C)CC2)C[C@@H]1CCO 22926107 RBZDTXMMXVXLBT-QFIPXVFZSA-N 389.584 2.827 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCN(C)C(C)(C)C3)C2=O)cc1 67724958 JHLTWURCAFZKSG-QHCPKHFHSA-N 387.568 2.690 0 50 GFAA CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cc2)CC1 4099034 NOCJXYPHIIZEHN-UHFFFAOYSA-N 399.397 2.719 0 50 GFAA biogenic,in-man O=C(NCC(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1)c1ccc(F)c(F)c1 125941526 JOSGCVSQOOWGMC-LPHOPBHVSA-N 388.414 2.809 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C(=O)Cc2ccccc2F)CC1 328636526 OBEJTPWOHQWAII-LJQANCHMSA-N 384.455 2.588 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@H]1CCCN(Cc2csc([C@@H]3CCCO3)n2)C1 328606721 SPDDQZIVOIEYTQ-BBRMVZONSA-N 389.525 2.799 0 50 GFAA O=C(NCCc1ccc(Cl)nc1)[C@H]1CCCN(C(=O)Cc2ccccc2)C1 151204153 CYAWUZSRBDTZGB-SFHVURJKSA-N 385.895 2.875 0 50 GFAA COCc1noc(CN[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)n1 366426217 YJDOHVGNLPHONC-QFBILLFUSA-N 399.422 2.896 0 50 GFAA Cc1ccc2nc(CCC(=O)N3CCC(C(=O)N4CCCC4)CC3)[nH]c2c1C 77504474 BKCAHDDXYHKUNB-UHFFFAOYSA-N 382.508 2.973 0 50 GFAA CC(C)Cc1noc(CN(C)c2nc(-c3cccnc3)nc3c2cnn3C)n1 72410570 KLPMSTDAWJKZLH-UHFFFAOYSA-N 378.440 2.643 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)NCc2cc(Cl)ccc2Cl)CCC(=O)N1 219243477 XJAXVHLGQRAIGD-KRWDZBQOSA-N 387.263 2.903 0 50 GFAA O=C(C[C@@H]1CCCO1)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 238215555 GAAUVGANZHICQS-SWLSCSKDSA-N 395.253 2.611 0 50 GFAA CCN(C)C(=O)[C@@H](C)NC(=O)NCCc1cccc(OCc2ccccc2)c1 241316786 LUWSRRAAXALTQN-QGZVFWFLSA-N 383.492 2.974 0 50 GFAA O=C(N[C@H]1CCCN(c2cnccn2)C1)c1ccc(CSc2ncccn2)o1 221347126 WVDAKAXRQUIIGN-AWEZNQCLSA-N 396.476 2.551 0 50 GFAA O=C1CN(C(=O)CCn2ccc3ccc(OCc4ccccc4)cc32)CCN1 44889943 MGURBLXTUWEJMF-UHFFFAOYSA-N 377.444 2.569 0 50 GFAA O=C(NCCC1CCN(CC(F)(F)F)CC1)c1ccnc(-n2ccnc2)c1 176968387 HSUJPSACPIWJIK-UHFFFAOYSA-N 381.402 2.662 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2CCN([C@H]3CCNC3)CC2)cc1OCC 289343384 XDSYYVMZQIJQSA-INIZCTEOSA-N 395.931 2.647 0 50 GFAA COCCN1CC[C@@H](CNC(=O)N2CCC(c3ccccc3OC)CC2)C1 426515540 NZSUHOKVRYJLPW-KRWDZBQOSA-N 375.513 2.553 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3cccc(Oc4ccccc4)c3)C[C@H]2O)CC1 19607616 JGDFCENPTOYOGX-DHIUTWEWSA-N 381.520 2.662 0 50 GFAA Cn1nccc1[C@H](O)c1cc2n(n1)CCCN(c1nc3ccccc3s1)C2 223397400 DBOHMODPQLHAFD-GOSISDBHSA-N 380.477 2.718 0 50 GFAA Cc1ccc2c(CC(=O)N3CCC[C@@H](c4ccnn4CC(=O)O)C3)coc2c1 426380266 AJJSJPFSMVIQQS-OAHLLOKOSA-N 381.432 2.971 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1ccnc(OCC(F)F)c1 178996891 QPFOZYVLFJPLDN-UHFFFAOYSA-N 376.407 2.515 0 50 GFAA Cc1cc(O)nc(CCNC(=O)N2CCC[C@@H]2c2nc3cccc(C)c3[nH]2)n1 426507853 JUSNQERCQFFQHX-OAHLLOKOSA-N 380.452 2.765 0 50 GFAA O=C(NCC1(c2ccccc2)CCN(Cc2ccccc2)CC1)N1CC(O)C1 426491587 VKRQHBUOSYZRSS-UHFFFAOYSA-N 379.504 2.607 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)COc2ccc(F)cc2)CC1 95357195 QXBOFGKRIRJFNA-UHFFFAOYSA-N 388.487 2.759 0 50 GFAA Cc1cc2c(cc1NC(=O)N1CCNC(=O)[C@H]1c1cccc(F)c1)OCCO2 97679812 ZZFSAGBLZMAKNF-GOSISDBHSA-N 385.395 2.610 0 50 GFAA O=C(Cc1ccccc1)N=c1cc(-c2ccccc2)[nH]n1[C@@H]1CCS(=O)(=O)C1 334158647 ZEVHGATUNOZSAU-GOSISDBHSA-N 395.484 2.513 0 50 GFAA CC(C)(C)c1csc(NC(=O)CN2CCCN(C(=O)c3ccco3)CC2)n1 244718677 LOVQFATTXYQVQG-UHFFFAOYSA-N 390.509 2.820 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H](c2ccccn2)[C@H]2C[C@H](O)C2)c(Cl)cc1F 244794638 QQVPDVCCTCRARX-PRXAMGSTSA-N 384.860 2.973 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(=O)NCc1ccccc1 299125157 HLUOMMWUMNOPGJ-NVXWUHKLSA-N 399.516 2.564 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1cccc2cccnc12 827968273 LHKACGCEHWHOFG-UHFFFAOYSA-N 391.427 2.725 0 50 GFAA Cc1cccc2nc([C@H]3CCCN3C(=O)CCC(=O)Nc3nncs3)[nH]c12 828084683 CRWPWWVCOLHBBJ-CYBMUJFWSA-N 384.465 2.805 0 50 GFAA O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 1875256134 XKLKHEZZSAHLGF-YOEHRIQHSA-N 385.399 2.923 0 50 GFAA CC[C@]1(C)CCCN(C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)C1 1875350562 RTFXSUOHIASXGW-HXUWFJFHSA-N 381.436 2.741 0 50 GFAA O=S(=O)(Nc1cnn(-c2ccccc2F)c1)c1cccc2c1OCCCO2 1875330120 OUJMNSHVUNKFEZ-UHFFFAOYSA-N 389.408 2.974 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1n[nH]cc1C1CC1 1875402366 DSHCFBVTTOJHOF-NIKGAXFTSA-N 391.475 2.720 0 50 GFAA Cc1cc(N2CCN(C(=O)c3cc(Br)cn3C(C)C)CC2)n[nH]1 170603171 BUTFTASIMNDNSE-UHFFFAOYSA-N 380.290 2.825 0 50 GFAA CCc1ccc(CCNC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2C)cc1 1529113032 BADUQMYFKABXEJ-YADHBBJMSA-N 380.488 2.815 0 50 GFAA CC(=O)c1cn([C@H](C)C(=O)N2CCC3(CC2)CN(C)CCO3)c2ccccc12 1772814781 BHMRIECPGADBNY-MRXNPFEDSA-N 383.492 2.728 0 50 GFAA COCC(=O)N1C[C@@H]2CN(C3CCSCC3)C[C@]2(CCc2ccccc2)C1 1772704614 CXBLEBKHWDVUEL-SIKLNZKXSA-N 388.577 2.922 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)NCc1cccnc1Oc1ccc(F)cc1F 12448626 UUQCPLMABZKEKN-INIZCTEOSA-N 375.375 2.779 0 50 GFAA O=C1CC[C@@](CCC(=O)N(CCO)Cc2ccccc2)(Cc2ccc(F)cc2)N1 14883281 PMRXQFAHVSLDAU-HSZRJFAPSA-N 398.478 2.818 0 50 GFAA CC(C)CSc1nnc(CNC(=O)c2ccc(N3CCCC3=O)cc2)n1C 14989811 KOFOSMDTDHMFDY-UHFFFAOYSA-N 387.509 2.620 0 50 GFAA COc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccsc4)ccn3n2)cc1 169775847 MDNHPFOZQAUZFV-UHFFFAOYSA-N 394.456 2.663 0 50 GFAA CN(C)C(=O)c1ccc(N2CCC(c3cc(Cc4ccccc4)[nH]n3)CC2)nn1 1857683226 YNJJTNKANSQVEH-UHFFFAOYSA-N 390.491 2.876 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)OCCc1cc(-c3ncccn3)sc12 1857713965 ZNOWLBJHKNJNLJ-UHFFFAOYSA-N 393.534 2.809 0 50 GFAA Cc1ccccc1-c1cccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](CCO)CN3C2)c1 1857716105 WXWKZHSSAHPLBJ-ACRUOGEOSA-N 380.488 2.616 0 50 GFAA O=C(C1CCN(c2nc3ccc(Cl)cc3o2)CC1)N1C[C@@H]2CC[C@H]1CNC2 1857718299 SAOPOWNPVYALBO-CJNGLKHVSA-N 388.899 2.908 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)CCc2nc3ccccc3n2-c2ccccc2)CCO1 238062942 WGEZMGZPYJHSPW-KRWDZBQOSA-N 393.443 2.660 0 50 GFAA CCCOc1ccc(CNC(=O)N2CCO[C@@](C)(c3cnn(C)c3)C2)c(C)c1 241911243 UAVXAHPSJYNLNM-OAQYLSRUSA-N 386.496 2.975 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N2CCNC[C@@H]2c2cccc(Cl)c2)[nH]n1 261774534 FWJBNQVQUWVEKS-GOSISDBHSA-N 398.898 2.867 0 50 GFAA Cc1cccc(C)c1NC(=O)CN1CCN(Cc2ccc(C(=O)O)cc2)CC1 263560898 BSKFBWKUICJCDH-UHFFFAOYSA-N 381.476 2.758 0 50 GFAA FC(F)(F)c1cc(N2CCN(c3cnccn3)CC2)nc(-c2ccncc2)n1 266064274 GUDIIQJDABHHGQ-UHFFFAOYSA-N 387.369 2.674 0 50 GFAA COc1ccc2c(n1)N(C)CCN2C(=O)c1cnn(CC(C)C)c1C(F)F 906208042 BOMFDMBCWPCIMO-UHFFFAOYSA-N 379.411 2.977 0 50 GFAA C[C@H](NC(=O)c1csc(-c2cnn(C)c2)n1)c1ccc(N2CCNC2=O)cc1 843990883 MJNGCHWINBFFMZ-LBPRGKRZSA-N 396.476 2.564 0 50 GFAA CCOC(=O)c1nn(CC(C)C)c2c1CN(C(=O)CCc1ccccn1)CC2 14742904 UKMIUQWZSNQLKW-UHFFFAOYSA-N 384.480 2.628 0 50 GFAA Cc1cc(C)cc(-c2n[nH]c(=NC(=O)c3cc([C@H]4CCCN4)nn3C)s2)c1 2325799396 SMMSNQXDYFNHHR-CQSZACIVSA-N 382.493 2.654 0 50 GFAA C/C(Cl)=C/CSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 725558 DLMIPWXQBRRCMW-FLIBITNWSA-N 376.869 2.706 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)NCc2ccncc2)cc1 839785 LQDUMLQEHJTJJO-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA COCCNC(=O)c1ccccc1NC(=O)CSCc1ccc(OC)cc1 2853659 NTNWNGFRTUIXOF-UHFFFAOYSA-N 388.489 2.943 0 50 GFAA CC(C)c1ccc(N(CC(=O)Nc2ccccc2C(=O)O)S(C)(=O)=O)cc1 4701094 XXCLOSSVAQMOBI-UHFFFAOYSA-N 390.461 2.913 0 50 GFAA COCCN(C)Cc1ccc(OC[C@H](O)CN(C)C2CCCCC2)c(OC)c1 11844222 ZBLYNTVQTBSVGQ-HXUWFJFHSA-N 394.556 2.778 0 50 GFAA Cc1ccn(CC(=O)N2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3)C2)n1 12192619 QKOGLYZJZJUXNS-OAQYLSRUSA-N 388.462 2.984 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H](N3CCN(c4ccccc4OC)CC3)C2)o1 12307535 APFZUNNDMYLJMS-KRWDZBQOSA-N 399.491 2.724 0 50 GFAA CC(C)Cc1cc(CN2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)n[nH]1 15066361 YPUUIGJGJZVHJB-HXUWFJFHSA-N 376.545 2.896 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3cscn3)C2)cc1OC 15078792 KIWUNXOYBGDYJA-INIZCTEOSA-N 389.521 2.939 0 50 GFAA O=C(c1ccccc1)[C@@H]([C@@H](c1ccccc1)N1CCOCC1)N1CCOCC1 19364535 DILBRNVHMMLSJR-FGZHOGPDSA-N 380.488 2.644 0 50 GFAA O=C1NCCN1c1ccc(CN[C@H]2CCCN(C3Cc4ccccc4C3)C2)cc1 19840190 VKCYXQMCMSWJLQ-NRFANRHFSA-N 390.531 2.938 0 50 GFAA CN(C[C@H]1CCCCO1)C(=O)c1cccc(Nc2ncnc3c2cnn3C)c1 20999125 FFUKOTQPSZGZMH-MRXNPFEDSA-N 380.452 2.748 0 50 GFAA Cc1cccc(C(=O)N2C[C@H]3[C@@H](C2)OC(=O)N3CCc2cccc(Cl)c2)n1 67560317 DBEXFJKDMWQXSS-ZWKOTPCHSA-N 385.851 2.931 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)C(=O)CC(C)C)CCO3)n1 67679216 DBJRJRHFMAEROD-UHFFFAOYSA-N 383.448 2.802 0 50 GFAA O=C(c1ccc(-n2cnnn2)cc1O)N1CCC[C@H](CCc2ccccc2)C1 71498045 JHJWCTJSFQEAEF-QGZVFWFLSA-N 377.448 2.853 0 50 GFAA c1ccc(OCc2noc(Cn3c(N4CCOCC4)nc4ccccc43)n2)cc1 72168591 GGMBHUPQBATYEJ-UHFFFAOYSA-N 391.431 2.883 0 50 GFAA Cc1ccc(CNc2ncc(S(C)(=O)=O)c([C@@H]3CCCNC3)n2)c(F)c1F 72481409 QPYAWTRWEFCOQU-CYBMUJFWSA-N 396.463 2.546 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)c3ccc(O)c(Cl)c3)CC[C@H]21 77458247 FICMEHXICRODRP-GOEBONIOSA-N 380.872 2.535 0 50 GFAA CCCc1nc2ccccc2n1[C@H](C)C(=O)NCc1cc2n(n1)CCCNC2 82120134 SPZLGXCRGDAOCO-OAHLLOKOSA-N 380.496 2.556 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1 91547281 YFIUCMWXWNCYPC-LJQANCHMSA-N 388.483 2.778 0 50 GFAA CCCn1nccc1S(=O)(=O)N1CCC[C@@H](c2ccc(C(=O)O)cc2)C1 95368003 JBTPEVWUEZMMOR-MRXNPFEDSA-N 377.466 2.560 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95500492 ISWXYSCDYOSPSI-MRXNPFEDSA-N 376.464 2.558 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCC[C@@H](c2nccn2CC2CC2)C1 95516664 YYHXJTUVJHMICU-QGZVFWFLSA-N 376.464 2.894 0 50 GFAA COc1cc(C(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)ccn1 95518249 OEUGQPCZGQQGNK-UHFFFAOYSA-N 377.448 2.750 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)NCCCN1CCc2ccccc21 97099128 GOBHCDHTWZFHBB-KRWDZBQOSA-N 379.460 2.690 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)NCCc3cccc(O)c3)CC2)oc1C 111851813 OMQICTWRPODDNJ-UHFFFAOYSA-N 386.496 2.751 0 50 GFAA CCc1noc([C@H](C)N2CCN(C(=O)c3ccccc3OCC3CC3)CC2)n1 112036224 KXXBBGHUMXCFLL-HNNXBMFYSA-N 384.480 2.940 0 50 GFAA COCCn1ccc2c(NC(=O)[C@@H]3CCCN(c4ncccn4)C3)cccc21 170625147 VJXKNDAEITZLJG-MRXNPFEDSA-N 379.464 2.933 0 50 GFAA COc1ccnc(N2CCN([C@@H](C)c3nc(-c4ccccc4C)no3)CC2)n1 173883306 ZPHOLTODYQVEQD-HNNXBMFYSA-N 380.452 2.727 0 50 GFAA CCc1noc(-c2ccc(C)c(NC(=O)NC[C@@H]3CCCN3CCOC)c2)n1 177149621 FPOUWSBLEKCEAS-INIZCTEOSA-N 387.484 2.840 0 50 GFAA CC(C)(C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1F 183802060 HHHOPICRXCOZSU-UHFFFAOYSA-N 390.480 2.960 0 50 GFAA Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccn(CCS(C)(=O)=O)n2)s1 189849702 AJWHDTHVLJNUDC-UHFFFAOYSA-N 378.479 2.545 0 50 GFAA CC1(C)CN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)CC2(CCCC2)O1 189959914 OTXXHEXRXITEOG-KRWDZBQOSA-N 386.492 2.947 0 50 GFAA CCc1cc(=O)c2cc(NS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)ccc2[nH]1 194657940 VFPMJSNSZSPKEU-UHFFFAOYSA-N 399.472 2.593 0 50 GFAA COc1cccc(-n2cc([C@@H](C)NC(=O)CN(C)Cc3cccnc3)cn2)c1 219117850 TWSHYHOXFOSZTK-MRXNPFEDSA-N 379.464 2.585 0 50 GFAA COc1ccc(S(=O)(=O)Nc2nnc3cc(C)ccn23)c(Br)c1 225465077 BWYABYQLNKBJRC-UHFFFAOYSA-N 397.254 2.610 0 50 GFAA COc1ccc([C@H]2CC(c3cccc(O)c3OC)=NN2S(C)(=O)=O)cc1 225494673 FLOOAXCAXSYNBQ-MRXNPFEDSA-N 376.434 2.520 0 50 GFAA O=C(CN1CCC[C@H]1c1cccs1)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1 242389435 ZXGFPHWWYVMIKD-IRXDYDNUSA-N 396.578 2.843 0 50 GFAA COc1cncc([C@@H](NS(=O)(=O)c2cc(C)sc2C)[C@H]2C[C@@H](O)C2)c1 244899609 ZMSUUCHGFVXLKM-QEORTHHSSA-N 382.507 2.559 0 50 GFAA COCCn1cnc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2c1=O 253413279 UITZJUCDYOPCFF-UHFFFAOYSA-N 390.443 2.716 0 50 GFAA biogenic CCn1cc([C@H]2OCC[C@@H]2CNC(=O)/C=C/c2cnn(-c3ccccc3)c2)cn1 253429818 GQEWDQQWHZKCSX-LNRPMLKFSA-N 391.475 2.996 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2)C1=O)NCCc1c[nH]c2ccccc12 253535652 ANQBRUNQQCADNM-LJQANCHMSA-N 390.443 2.542 0 50 GFAA Cc1ccc(Oc2ccc(OCC(=O)N3CC[C@@H](N4CCNCC4)C3)cc2)cc1 261973443 BSHVWMMVSMNBLO-LJQANCHMSA-N 395.503 2.672 0 50 GFAA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)[C@@H]1CCCN(Cc2ccccc2)C1 263823969 RBVNNIJMWKZORB-ZWKOTPCHSA-N 383.458 2.899 0 50 GFAA CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc(N2CCOC2=O)cc1 264187973 PSMYZJMKSGMONQ-UHFFFAOYSA-N 382.342 2.674 0 50 GFAA O=C(Nc1cnn(CCN2CCOCC2)c1)c1ccc(Oc2ccccc2)nc1 264318089 PLRBVOCLSSPNHQ-UHFFFAOYSA-N 393.447 2.655 0 50 GFAA O=C(c1ccnc(Br)c1)N1CCN(c2ccc(Cl)cn2)CC1 268097463 DHDYKBBUKZCXPO-UHFFFAOYSA-N 381.661 2.855 0 50 GFAA O=C(CCCCCc1ccc(F)cc1)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 274989781 AYWCOVIMPQNKAK-UYAOXDASSA-N 397.512 2.781 0 50 GFAA COc1cccc([C@H](CNC(=O)c2cn(C)c(=O)c3ccccc23)N(C)C)c1 277091391 KOZRUKSVNVXQTM-FQEVSTJZSA-N 379.460 2.580 0 50 GFAA Cn1ccnc1N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)CC1 280033946 ADJBKHUOAULHGE-JKSUJKDBSA-N 394.397 2.771 0 50 GFAA COc1cccc(C(=O)NCC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 290656049 NSBAGZJQIQRUFH-KRWDZBQOSA-N 398.463 2.829 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)C1 290747354 OOWNFWWVLNYCHL-WOJBJXKFSA-N 386.540 2.599 0 50 GFAA Cc1c(NC(=O)N[C@@H]2CCCC[C@H]2S(C)(=O)=O)cnn1-c1ccccc1 292785838 VASHVSCYUJYQIW-NVXWUHKLSA-N 376.482 2.658 0 50 GFAA O=C(N[C@@H]1CCO[C@@H](c2cccnc2)C1)N[C@@H]1CCN(Cc2ccccc2)C1 297077161 OTKIIHFVMWTVSP-NJDAHSKKSA-N 380.492 2.875 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)COCc1ccccc1)CC2 299282679 WVYADIPNXKFDJZ-GOSISDBHSA-N 399.443 2.821 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H](c2cccc(Br)c2)N2CCCC2)C1 299742822 KSNHMXBOGXHBJH-HIFRSBDPSA-N 381.270 2.519 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC3(CCC(=O)N(C)CC3)CC2)cc1 299786136 SXFQMJMPWYYKMR-UHFFFAOYSA-N 386.496 2.693 0 50 GFAA CC1CCC(N2C[C@H](C(=O)N3[C@H]4C=C(c5ccnn5C)C[C@H]3CC4)CC2=O)CC1 328727554 DHPOKSBIBNDCNU-GDFXLJFKSA-N 396.535 2.994 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CC1 363211871 ZRUQPAGRYQJCJZ-SFHVURJKSA-N 399.495 2.861 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 363630273 PLBPGFOWQSLBHR-INIZCTEOSA-N 396.882 2.501 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCc2ccccc2[C@H]1C(N)=O)c1ccc(Cl)cc1 370787775 HMKTYDLNSRUHOS-QUCCMNQESA-N 399.878 2.519 0 50 GFAA O=C(c1cc(Br)cnc1OCC1CC1)N1CC([C@@H]2CCOC2)C1 376091074 IJUROHWXEISGGE-GFCCVEGCSA-N 381.270 2.741 0 50 GFAA NCCOc1ccc(F)cc1C(=O)NC[C@@H]1CCN(c2ccccc2F)C1 426627853 UYKNOKFDHAIABJ-AWEZNQCLSA-N 375.419 2.559 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3nnc(-c4cccc(Cl)c4)s3)C[C@@H]21 499180356 OZQQHCKLJLXJPA-KBPBESRZSA-N 393.900 2.795 0 50 GFAA Oc1cccc(N2CCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CC2)c1 551697104 YXMJZWABUBVPSH-HSZRJFAPSA-N 381.520 2.805 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCc2nc[nH]c2[C@@H]1c1ccccn1 827972605 VPVLIZYRQSBGRF-FQEVSTJZSA-N 377.448 2.781 0 50 GFAA O=C(CCCCCNC(=O)N1CC(=O)Nc2ccccc21)Nc1cccnc1 888088509 DAUIIZBHYDQZFN-UHFFFAOYSA-N 381.436 2.749 0 50 GFAA Cc1ccc2c(c1)CCCN2C(=O)CN1CCCN(Cc2cccnc2)CC1 1529174477 VTEFNOUSOSXZTQ-UHFFFAOYSA-N 378.520 2.877 0 50 GFAA CC(C)c1nnsc1CN1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565508382 ASSRMPTVJLXVSI-OCCSQVGLSA-N 377.539 2.741 0 50 GFAA CCOC(=O)N1CCC(N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)CC1 1616082265 TUYUAXQCCBMHPU-UWJYYQICSA-N 383.492 2.691 0 50 GFAA COc1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)C(=O)Nc3ccncc32)c1 1775962015 NUHRVTGCNZLTIS-JTQLQIEISA-N 381.841 2.527 0 50 GFAA CCCCC(=O)N1CCCCC[C@H](NC(=O)[C@]2(CC(C)C)CCNC2=O)C1 1775991136 HOBMZPFQQVUQCR-UWJYYQICSA-N 379.545 2.616 0 50 GFAA CCc1occc1C(=O)N[C@@]12CCC[C@H]1N(c1c(C)c(C)nc3ncnn13)CC2 1775991840 NIUKKBVLSAFFRH-DYESRHJHSA-N 394.479 2.828 0 50 GFAA CC[C@@]12COC(=O)N1CCN(Cc1c(-c3ccccc3)nc3ncccn13)C2 1857670900 IGXQKQFJXMPWIW-OAQYLSRUSA-N 377.448 2.813 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c1 1875242477 VFTWGTWLTORFLW-SFTDATJTSA-N 384.476 2.848 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CC2)C1)[C@@H]1CCCO1 1875332833 NLPYGAHBRGCBFK-IRXDYDNUSA-N 376.884 2.658 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)NCc2ccncc2OCC(F)F)cc1 1875373474 BYUMZVRSANFJPB-UHFFFAOYSA-N 375.375 2.804 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C)cc2O3)c2c1CCC2 1875394402 HWSQHIRHZYLEOU-SFHVURJKSA-N 381.476 2.708 0 50 GFAA O=C(c1cc[nH]n1)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100482309 PZWAQHXMUIFLQQ-NRFANRHFSA-N 376.460 2.988 0 50 GFAA Cc1cc(C)c2c(NC(=O)CCCc3nc(-c4ccncc4)no3)n[nH]c2n1 2100543304 OZZPXEGMRYSCFG-UHFFFAOYSA-N 377.408 2.981 0 50 GFAA Brc1cccc2c(NCc3cn(C[C@@H]4CCCN4)nn3)nccc12 2325783287 KSRVNGVZHXXPIN-LBPRGKRZSA-N 387.285 2.953 0 50 GFAA Cc1occc1C(=O)N1CCOC2(CCS(=O)(=NC(=O)CC(C)C)CC2)C1 2325785189 IWEZGOSDKUJTLB-UHFFFAOYSA-N 396.509 2.634 0 50 GFAA Cc1ccc([C@]23C[C@@H]2CN(C[C@H](O)Cn2cc(Br)cn2)C3)cc1 2325800461 JGVVDTUPXPSQGU-BPQIPLTHSA-N 376.298 2.588 0 50 GFAA O=C([C@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC([C@H]2CCOC2)CC1 2325809776 KSFVXGUAOJORPG-HKUYNNGSSA-N 381.480 2.562 0 50 GFAA Cc1ccc(C2(C(=O)NCc3cccc(NS(=O)(=O)C4CC4)c3)CC2)cn1 2325816701 ZGURQPVMYFDQEW-UHFFFAOYSA-N 385.489 2.642 0 50 GFAA NC(=O)[C@H](OC(=O)c1ccc2c(c1)CCOC2)c1cccc(Br)c1 2325870697 KTKLZQZQUTZCER-MRXNPFEDSA-N 390.233 2.905 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N1CCC[C@]2(CCc3c[nH]c(=N)nc32)C1 2356136139 IBNIPJXTGAECSX-FQEVSTJZSA-N 386.883 2.736 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(OC)cc2)C1 806781 HRNDXHNVXXYGMD-AWEZNQCLSA-N 382.416 2.864 0 50 GFAA CC1=C(C(=O)OC(C)C)[C@H](c2cc3c(cc2Br)OCO3)NC(=O)N1 1107810 GXBJJPFPDGOBSW-AWEZNQCLSA-N 397.225 2.757 0 50 GFAA O=C(O)c1ccc(CN2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1 2356166706 KJFLWYHZSBJWGQ-IPJJNNNSSA-N 386.492 2.645 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N3CCC(OC(F)(F)F)CC3)cn12 2356166952 PWDJNHHQQSHKEA-CQSZACIVSA-N 386.374 2.560 0 50 GFAA O=C(c1ccc(F)cc1)c1cn(Cc2cn(-c3ccc(Cl)cc3)nn2)nn1 225388971 SZBNHFZFSIIDSR-UHFFFAOYSA-N 382.786 2.931 0 50 GFAA C[C@](NC(=O)c1ccnc(SCC(F)(F)F)c1)(C(N)=O)c1ccccc1 112632860 HTDFSOYMRMWPLC-MRXNPFEDSA-N 383.395 2.867 0 50 GFAA COc1ccc([C@H]2CC(=O)Nc3cc4c(cc32)oc(=O)n4C)c(OC)c1OC 65407973 MWVYEOGHZOOBNU-LLVKDONJSA-N 384.388 2.631 0 50 GFAA Cc1cccc2nc(C(=O)N3CC[C@@H](c4ccc5c(c4)OCO5)[C@H](O)C3)c(F)n12 65405166 VTMUMGAOVYVFFD-LSDHHAIUSA-N 397.406 2.501 0 50 GFAA O=C(Cc1csc(-c2cccs2)n1)N1CCC(c2nc(O)n[nH]2)CC1 328592197 MDCHWTHZUPCAOO-UHFFFAOYSA-N 375.479 2.644 0 50 GFAA CN1CCC2(CC1)CCN(C(=O)C13C[C@@H]4C[C@H](C1)CC(n1cncn1)(C4)C3)C2 65526272 XZDUCQVRPDNQHW-OTXOEQGISA-N 383.540 2.518 0 50 GFAA CS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 124074212 FKMNPNKEQZZQML-SFHVURJKSA-N 387.505 2.876 0 50 GFAA O=C(CCOc1ccccc1-c1ccccc1)N1CCOC[C@H]1c1nc[nH]n1 253416770 WFBVSAJRHFDSLE-SFHVURJKSA-N 378.432 2.841 0 50 GFAA Cc1nn(C)cc1CNC(=O)c1coc(COc2cccc3cccnc23)n1 12708302 NOTBUOFQHBTXAH-UHFFFAOYSA-N 377.404 2.774 0 50 GFAA COc1ccc2cc([C@@H]3CN(C(=O)c4cccc(CO)n4)CCO3)ccc2c1 71759586 VLGVYTYEUIHGLQ-NRFANRHFSA-N 378.428 2.949 0 50 GFAA O=C(CN1CCC[C@@H]1c1nc(-c2ccccn2)no1)N1CCc2ccccc21 77388629 OHCUBJKGSCZJSN-GOSISDBHSA-N 375.432 2.858 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1 375688873 LLBDJWFYYXNLLO-VAMGGRTRSA-N 399.516 2.541 0 50 GFAA COc1cc2c(cc1-c1nccn1C[C@@H]1CCCN(S(C)(=O)=O)C1)CCC2 77321615 CHJJXNKZZMQICV-HNNXBMFYSA-N 389.521 2.719 0 50 GFAA CCNC(=O)c1cc(Cl)ccc1NC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1 173272506 LQSKWRJRKCIFMI-GFCCVEGCSA-N 398.854 2.943 0 50 GFAA Cc1cc2c(cc1C(=O)N1CC[C@H](Cc3cccc(C(N)=O)c3)C1)OCCO2 72158844 OFIAJHSFKDGMBY-MRXNPFEDSA-N 380.444 2.570 0 50 GFAA Cc1cccc(N2CCC(NC(=O)c3cc(=O)n(-c4ccccc4)[nH]3)CC2)c1 215247556 CXMUTDMXBMLWCT-UHFFFAOYSA-N 376.460 2.873 0 50 GFAA O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCC([C@H](O)Cc2ccccc2)CC1 77485733 PSZGEAOAVZSCJN-HXUWFJFHSA-N 376.460 2.928 0 50 GFAA Cc1cc(C)n(-c2ccccc2CNC(=O)c2ccc3c(c2)[nH]c(=O)n3C)n1 131977417 IXOFJZONSPPODV-UHFFFAOYSA-N 375.432 2.599 0 50 GFAA C[C@H](CC(=O)O)CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1 17079630 BZLMHLGLEYHFPS-AWEZNQCLSA-N 390.461 2.605 0 50 GFAA Cc1nc(CN2CCN(C(=O)Nc3ccccc3-n3cccn3)CC2)cs1 48150997 PAGKSLRASDDMHU-UHFFFAOYSA-N 382.493 2.987 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N(Cc1ccccn1)C[C@@H]1CCCO1 426510895 VPWRYKDZJFNCCE-IBGZPJMESA-N 379.464 2.663 0 50 GFAA C[C@H]1CN(Cc2ccccc2NC(=O)N2CCOCC(F)(F)C2)C[C@H](C)O1 289573891 HEWMUHYZZMJNKK-GJZGRUSLSA-N 383.439 2.795 0 50 GFAA Cn1ccnc1CN1CCN(C(=O)c2ccc(-c3ccccc3O)cc2)CC1 426490273 VSVZYSGBCQVQHB-UHFFFAOYSA-N 376.460 2.751 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ncn(Cc2ccc(C)cc2)n1 20606624 DPIUJAAGBCAIIK-SFHVURJKSA-N 380.404 2.933 0 50 GFAA CN(C)C[C@H]1CCN(C(=O)NCc2nc3cc(C(F)(F)F)ccc3n2C)C1 426475568 RZWQVZPXSRUCEK-GFCCVEGCSA-N 383.418 2.685 0 50 GFAA CCN(CCCc1ccccc1)c1cc([C@H]2CCOC2)nc(N2CC(O)C2)n1 426399182 IARMUOCYPAVPMH-SFHVURJKSA-N 382.508 2.621 0 50 GFAA CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCCN(C(=O)OCc2ccccc2)C1 21302979 DUJRIGHZAUCYQH-IBGZPJMESA-N 378.425 2.767 0 50 GFAA Cc1ccsc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95499477 IFUKYFLSHIMKEA-UHFFFAOYSA-N 384.505 2.706 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2cn3ccccc3n2)CC1 95376964 PXZCYFUYTJFROA-UHFFFAOYSA-N 380.496 2.502 0 50 GFAA CCn1c(Cn2ccnc2C)nnc1C1CCN(Cc2cccc(O)c2)CC1 96151400 TWVYBEWHDDEDOF-UHFFFAOYSA-N 380.496 2.936 0 50 GFAA COc1cc(CN2C[C@H]3CC[C@@H]2CN(Cc2ccccn2)C3)cc2c1OCO2 95382792 WFJILTFSOYPQNW-QFBILLFUSA-N 381.476 2.915 0 50 GFAA NC(=O)c1ccc([C@H]2CCCN2C(=O)COc2ncnc3ccccc23)s1 23251529 NPPSVWSMMTUGLW-CQSZACIVSA-N 382.445 2.533 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Nc1ccc(Cl)cc1Cl 239425678 UZTJJCITPDODGP-FDJUTITPSA-N 391.254 2.985 0 50 GFAA Cc1nc2ccc(C(=O)N3CCCO[C@@H](CN4CCCCC4)C3)cc2nc1C 95504581 WKRRQDZXXJVYEN-IBGZPJMESA-N 382.508 2.964 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)CO)CC2)c1ccc(C(F)(F)F)cc1 95504092 GKUHLOQQQBPELO-UHFFFAOYSA-N 378.350 2.835 0 50 GFAA CCN(C)c1ccnc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)n1 95504073 XQVOSLLAXPUGNH-SFHVURJKSA-N 377.496 2.957 0 50 GFAA O=C(O)CCN(CC1CCN(C2Cc3ccccc3C2)CC1)C[C@H]1CCCO1 95503931 PABKTUDBJJDULD-JOCHJYFZSA-N 386.536 2.822 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(O)c(OC)c1)CC2 95500101 MGFYZWURNUOPEG-UHFFFAOYSA-N 384.480 2.524 0 50 GFAA CCc1n[nH]c(-c2cccc(NC(=O)N3CCC[C@@]4(CC3)CNC(=O)O4)c2)n1 95508319 RBZHMNLWQFFGQC-LJQANCHMSA-N 384.440 2.531 0 50 GFAA CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C=Cc3ccc4cccnc4c3N1[C@H]2C(C)=O 245255097 FMMIIWJTGVIPNO-QVCIWZRWSA-N 389.455 2.808 0 50 GFAA CC1CCC(N2CCN(S(=O)(=O)c3ccc(C(F)(F)F)nc3)CC2)CC1 182006013 IBCZRAVQJHXVMC-UHFFFAOYSA-N 391.459 2.985 0 50 GFAA Nc1nc(CCC(=O)N[C@@H](c2cnc3ccccc3c2)[C@H]2C[C@@H](O)C2)cs1 252532852 FIKIINQCSWYJSE-ACWOFJMJSA-N 382.489 2.835 0 50 GFAA COC(=O)C1=C(C(=O)OC)[C@H]2C(=Cc3ccccc3)[C@H]1[C@]13O[C@@]21[C@H]1CC[C@H]3C1 257358447 UNLAFMWRBFJTDV-HAAQBONASA-N 378.424 2.910 0 50 GFAA COC(=O)CN(C)Cc1nc(N2CCC(OC)CC2)c2cc(Cl)ccc2n1 39388439 ZGSXLRFTAOTYAK-UHFFFAOYSA-N 392.887 2.503 0 50 GFAA CCCNC(=O)C1CCN(C(=O)C2(OCc3ccccc3)CCOCC2)CC1 269351486 NRAQBDNGTNNIQK-UHFFFAOYSA-N 388.508 2.517 0 50 GFAA CCn1nc2c(c1C(=O)N(C)Cc1nc(O)c3ccccc3n1)C[C@H](C)O[C@@H]2C 1875314076 GKQOITSVSJMINQ-QWHCGFSZSA-N 395.463 2.846 0 50 GFAA CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)[C@@H]1CCOCC12CCC2 1875323048 UQWLQUXSXSASJA-INIZCTEOSA-N 397.418 2.996 0 50 GFAA COc1nccnc1N1CCC[C@@H](CNC(=O)C2=Cc3ccccc3OC=C2)C1 952981877 IXVLGTYVYZPEQO-INIZCTEOSA-N 392.459 2.808 0 50 GFAA Cc1cccc2c1C(=O)N(C)[C@H](c1ccc(OCCN3CCOCC3)cc1)N2 888095844 HYLBKEVXCFLDJM-OAQYLSRUSA-N 381.476 2.902 0 50 GFAA COc1ccc(F)c(F)c1C(=O)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565529052 SBLHINMHPNSTRU-HIFRSBDPSA-N 380.435 2.689 0 50 GFAA CN(C)c1nccc([C@H]2CN(C(=O)Nc3ccccc3N3CCCC3)CCO2)n1 275330831 RDLFWOVMAXHYMD-LJQANCHMSA-N 396.495 2.748 0 50 GFAA CC[C@]1(C)NC(=O)N(NC(=O)[C@H](C)Sc2nc3ccccc3s2)C1=O 278629034 GIAXHKDCTLPHBD-FVMDXXJSSA-N 378.479 2.529 0 50 GFAA COc1ccc(CCN(Cc2ccccc2F)C(=O)[C@@H]2CCCN2C(N)=O)cc1 1506409663 ZBQQRWIUZPBGPU-FQEVSTJZSA-N 399.466 2.949 0 50 GFAA CCCN(Cc1ccncc1)C(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1ccccc1C 1529185442 MWBJKFBUOQHAJJ-RTWAWAEBSA-N 381.476 2.727 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)c3ccc(=O)n(C)c3)C[C@]2(CCc2ccccc2)C1 1772809901 GVBCYIMGUWNXSQ-QPPBQGQZSA-N 393.531 2.802 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNC(=O)c2ncoc2C)CC1 12448980 LYVUAJIYIYFNNK-UHFFFAOYSA-N 391.475 2.943 0 50 GFAA CCCCCCNc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc(C)c1 12532241 WQVJVZZMDDKGMG-UHFFFAOYSA-N 383.496 2.783 0 50 GFAA biogenic CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](N(C)Cc1ccon1)C2 14542543 GYWJOBCQYAFYFG-QGZVFWFLSA-N 385.512 2.897 0 50 GFAA CC[C@H](COC)Nc1ncnc2sc(C(=O)NCCOC(C)C)c(C)c12 15000859 ITIXQVDTRFDZML-CYBMUJFWSA-N 380.514 2.991 0 50 GFAA O=C(Cn1cc(C(=O)C(=O)N2CCCC2)c2ccccc21)NCc1ccccc1 16527133 NSSMEQZRBPCETP-UHFFFAOYSA-N 389.455 2.763 0 50 GFAA CC(C)c1ccc(Cl)c(S(=O)(=O)N[C@H]2C[C@H](Cn3cccn3)C[C@@H]2O)c1 1857531523 LZPQMGYRUJHUCQ-JQFCIGGWSA-N 397.928 2.778 0 50 GFAA COc1ccc(C(=O)NCc2cc(O)ncn2)cc1Oc1ccc(CN)cc1F 1857683288 UFXDNWYQDJYTLE-UHFFFAOYSA-N 398.394 2.511 0 50 GFAA CCOC(=O)c1ccc(N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)nc1 1857703963 XSZRRWQCGFAQOZ-OAQYLSRUSA-N 381.432 2.512 0 50 GFAA O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CC[C@H](CO)[C@H](O)C1 1857738401 GQEJUZLKYVVEQJ-QVKFZJNVSA-N 380.419 2.856 0 50 GFAA COc1cc(CN2CC[C@@H](Nc3ncc(Br)cn3)C2)cc(OC)c1 301565250 LYTFCWMYHPXZTH-CQSZACIVSA-N 393.285 2.943 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(=O)n(C)c3)n2C[C@@H]2CCOC2)[C@@H]2CCCC[C@H]12 910152605 GITXUZZJYBDXBS-UKBAYJJMSA-N 397.523 2.695 0 50 GFAA O=C(O[C@@H]1CCN2CCC[C@@H]2C1)c1cnn(-c2ccc(Br)cc2)n1 2325863055 SUNMOMGVUHKQLA-HUUCEWRRSA-N 391.269 2.813 0 50 GFAA CCCC[C@H](C)C(=O)N[C@H]1[C@@H]2CN(C(=O)c3cc(C(=O)C(F)(F)F)c[nH]3)C[C@@H]21 2325872073 GVDHNPXCFZHFMI-MUYACECFSA-N 399.413 2.773 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)C1 864098643 PBOBFUNTYXMKQX-JTQLQIEISA-N 385.317 2.967 0 50 GFAA O=C(O)c1cccc(NC(=S)NC(=O)c2cncc(Br)c2)c1 678560 QVMNNHHLCTUGLD-UHFFFAOYSA-N 380.223 2.669 0 50 GFAA O=C([C@@H]1CC(c2ccc(Cl)c(Cl)c2)=NO1)N1CCC2(CC1)OCCO2 1126243 VCFOJVZSNWAFNN-HNNXBMFYSA-N 385.247 2.852 0 50 GFAA CSc1nnc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)s1 2700568 FOQUIEBRKULDTJ-UHFFFAOYSA-N 398.535 2.605 0 50 GFAA O=C([C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12)N1CCC(F)(F)CC1 2356156798 RQVFHINEISXTRK-AFBRZQFHSA-N 375.419 2.576 0 50 GFAA O=C(NCc1cccnc1)C1CCN(C2CCN(Cc3ccoc3)CC2)CC1 20109849 IARPEDBUIWWSJY-UHFFFAOYSA-N 382.508 2.667 0 50 GFAA CN1CC[C@H](N(C)C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)C1 72135482 HOBXOGMQMVFUIL-QHCPKHFHSA-N 391.559 2.861 0 50 GFAA Cc1noc(-c2ccccc2C(=O)NCC2(N3CCOCC3)CCCCC2)n1 152316034 VISWIPSJSGOGBK-UHFFFAOYSA-N 384.480 2.810 0 50 GFAA C[C@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)[C@H]1CCOC1 237483059 RMMZKZLMLQWLII-JQWIXIFHSA-N 397.353 2.744 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C[C@H](C)c1ccccc1)CC2 72153143 HOXGIPWLDKIHBK-INIZCTEOSA-N 379.508 2.916 0 50 GFAA CCc1c[nH]c(SCC(=O)c2cc(C)n([C@@H]3CCS(=O)(=O)C3)c2C)n1 129014719 LLXWZZIHDUDRFE-CQSZACIVSA-N 381.523 2.725 0 50 GFAA Cc1cc(-n2cncn2)ccc1C(=O)N1CCC(C(=O)O)(c2ccccc2)CC1 237805413 ODPMEECYBWFLKO-UHFFFAOYSA-N 390.443 2.834 0 50 GFAA Cc1oc(-c2ccco2)nc1CC(=O)N1CCC(n2cc(C(=O)O)cn2)CC1 263284033 ZAYVPCAGQTYNIE-UHFFFAOYSA-N 384.392 2.544 0 50 GFAA CO[C@@H]1COCC[C@H]1NC(=O)c1ccccc1-c1nc(-c2ccccc2)no1 223688058 JRFWZUOVHXGRHB-QZTJIDSGSA-N 379.416 2.937 0 50 GFAA C[C@@H](NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccc2c(c1)OCO2 178109832 YQEMGFCJGGLYGQ-LLVKDONJSA-N 394.415 2.628 0 50 GFAA O=C(NCc1ccc(Cl)cc1)N1CCN(Cc2ccco2)[C@@H](CCO)C1 426529292 MIMLMXMVZAEPRR-KRWDZBQOSA-N 377.872 2.711 0 50 GFAA CCCCc1cc(=O)[nH]c(-c2ccc(CN3CCCN(C(C)=O)CC3)cc2)n1 48112433 OAJARSXZRMEKLT-UHFFFAOYSA-N 382.508 2.834 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)n1 95374000 NAJOVTPFCAIDBO-DFQSSKMNSA-N 386.446 2.884 0 50 GFAA CCn1ncc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c1C 91997823 ICIXQWAYDUEJPY-UHFFFAOYSA-N 395.507 2.651 0 50 GFAA Cc1cccnc1N1CCN(C(=O)C2(c3ccccc3)CCN(C)CC2)CC1 91665345 SRPZJZOAOWROSA-UHFFFAOYSA-N 378.520 2.702 0 50 GFAA CCOc1cc2c(cc1CN1CCN(C)[C@@]3(CCC(=O)N(C)CC3)C1)CCC2 230180996 KCDFFRLHVCWLKQ-HSZRJFAPSA-N 385.552 2.703 0 50 GFAA Cn1cc(N2CC[C@@H](NC(=O)c3ccc(C(F)(F)F)cc3Cl)C2=O)cn1 181874295 ZEQUUNYPBCMUCB-CYBMUJFWSA-N 386.761 2.628 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)CC1 182534072 DNZJZDTTXLMGHV-MJGOQNOKSA-N 386.540 2.790 0 50 GFAA C[C@@H](NC(=O)c1ccn(-c2ccc(F)cc2F)n1)c1ccc2c(c1)NC(=O)CO2 185082713 XMHXFXZERLMGJW-LLVKDONJSA-N 398.369 2.972 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 269024328 JJYBYAMOJHPLFQ-KRWDZBQOSA-N 399.896 2.750 0 50 GFAA CCOc1cc(C(=O)N2CCC(C(=O)O)CC2)ccc1OCc1cccnc1 269153315 SZIILZXFJOAQIQ-UHFFFAOYSA-N 384.432 2.996 0 50 GFAA CC[C@H](C)OCC(=O)N1CC2(CCN(C(=O)Cc3cccc4cccnc34)C2)C1 1875305910 MFHVAUNUQMYLLF-KRWDZBQOSA-N 395.503 2.653 0 50 GFAA Cn1ccc(C(=O)N[C@@H](CNc2cnc3cc(F)c(F)cc3n2)C(C)(C)C)n1 1875333711 JASGVBLSBLWMDF-INIZCTEOSA-N 388.422 2.898 0 50 GFAA C=CC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1noc2ccc(F)cc12 1875383472 WCCYOEBSKLPYJD-DYESRHJHSA-N 379.391 2.594 0 50 GFAA COc1cccc2c1OC[C@@H](NCc1ccc(OCC(=O)N3CCCC3)cc1)C2 952969554 JCIOGWMCLMSTPB-IBGZPJMESA-N 396.487 2.790 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1529120822 MRYJINMICHHIBT-DYESRHJHSA-N 379.460 2.834 0 50 GFAA O=C([C@H]1CCc2sc(N3CCOCC3)nc2C1)N1CCOc2ccccc2C1 1772809718 DGUAWWKETPMBMN-HNNXBMFYSA-N 399.516 2.506 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)c3n[nH]c4c3CCC4)CC2)cc1 11936511 USTRWTTZEAPNCX-UHFFFAOYSA-N 396.535 2.934 0 50 GFAA O=C(NCCCn1ccnc1)c1cccc(NS(=O)(=O)c2ccccc2)c1 13677215 PQEIWHYOJCEPAL-UHFFFAOYSA-N 384.461 2.504 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1cccs1)C2 14531944 JFMHANWIZNLSJO-CQSZACIVSA-N 390.578 2.801 0 50 GFAA O=C(NCCc1nnc(SC[C@H]2CCCO2)n1-c1ccccc1F)C1CC1 14995449 NOVRWHQVKGLMLU-CQSZACIVSA-N 390.484 2.746 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2coc(COc3ccccc3F)n2)C1 15065974 DRIMXBFXJWGBRY-ZDUSSCGKSA-N 376.384 2.808 0 50 GFAA OCCN1CCN(CCn2c(-c3ccccc3)cn3c4ccccc4nc23)CC1 19771488 DJDIYZSFQJPEBZ-UHFFFAOYSA-N 389.503 2.566 0 50 GFAA Cc1ccc(C(=O)N2C[C@H]3CCC[C@]3(c3nc(-c4cnccn4)no3)C2)c(O)c1 1857528355 OHZCDXVAOHWCSM-SZNDQCEHSA-N 391.431 2.735 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CC1)OCCc1cc(C(=O)O)sc12)n1cccn1 1857687203 QZBRQDTUJCUEFX-AWEZNQCLSA-N 389.477 2.685 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N3CCC4(CC3)CNC(=O)CCO4)ccc2c1 1857740849 PJSCWQLXUOSRGH-INIZCTEOSA-N 396.487 2.850 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCC[C@@H]3CNCCC[C@@H]32)c1)c1ccco1 373561128 HWAMHQKGQFSEJQ-APWZRJJASA-N 397.475 2.901 0 50 GFAA Cc1nsc(NC(=O)c2cc(S(=O)(=O)N3CCCC[C@H]3C)ccc2C)n1 266560621 MRPURMNQHVXURI-GFCCVEGCSA-N 394.522 2.970 0 50 GFAA CCOc1ccccc1NC(=O)Cn1cc(-c2ccc(OC)c(OC)c2)nn1 900490931 HBHPVHKBNSFZKZ-UHFFFAOYSA-N 382.420 3.000 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)COc3cccc(F)c3)C1)CC2 1704302594 AVSRYXQCBDQVSO-NRFANRHFSA-N 384.455 2.567 0 50 GFAA C[C@@H](c1ccc(Cl)cc1)N1C[C@@H](C(=O)Nc2nnc3n2CCCC3)CC1=O 2325780638 DKYBGFFOLFQCJM-JSGCOSHPSA-N 387.871 2.816 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cccc(-c2cnco2)c1 2325785682 IXNNEDUHLYDKKZ-CSMYWGQOSA-N 386.839 2.761 0 50 GFAA Cc1ncc(CCNC(=O)c2nc(C)n(-c3c(Cl)cccc3Cl)n2)[nH]1 2325802028 CDXTYRLEOFGQMS-UHFFFAOYSA-N 379.251 2.887 0 50 GFAA O=C(c1cc2cc(F)ccc2[nH]c1=O)N1CCC[C@@](CO)(c2ccccc2)C1 879887079 WKWCBQNDWZCRGX-JOCHJYFZSA-N 380.419 2.834 0 50 GFAA COC(=O)CN(c1cccc(Br)c1)S(=O)(=O)c1ccccc1 786486 OUIKUUMOLMTVIG-UHFFFAOYSA-N 384.251 2.817 0 50 GFAA CCOCCCNC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 2856829 BZXNJQRTMQJKNH-UHFFFAOYSA-N 390.505 2.977 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)NCc1cccnc1 6199402 RUBVWCBMNBMYLR-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA Cc1ccc(C(=O)N[C@H]2CCCc3nc(N4CCC(CO)CC4)ncc32)cc1 15073197 KIUDWHRXZYKFGY-IBGZPJMESA-N 380.492 2.801 0 50 GFAA CCN1CCN(c2ncc3c(n2)C[C@H](c2ccc(OC)cc2OC)CC3=O)CC1 20101823 TVFKRYISKHEBPF-HNNXBMFYSA-N 396.491 2.548 0 50 GFAA O=C1CC2(CCN(C(=O)[C@H]3CCCO3)CC2)CN1Cc1ccc(Cl)cc1 77387575 CZCMOPXWFXZSSF-QGZVFWFLSA-N 376.884 2.860 0 50 GFAA CC(C)Nc1ncc(CN2CCC(Oc3cccc(F)c3)(C(=O)O)CC2)cn1 82098338 ZKSGSGVAHVOXME-UHFFFAOYSA-N 388.443 2.934 0 50 GFAA CCn1ccnc1C1CCN(C(=O)CN2C[C@H](c3ccccc3)CC2=O)CC1 91677531 IJBBOFDWAALECS-LJQANCHMSA-N 380.492 2.625 0 50 GFAA O=C(CCCn1ccnc1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95372294 MYRLKKLVMQXCRZ-GHTZIAJQSA-N 378.520 2.754 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)N(C(=O)COc1ccccc1Cl)C2 95374900 QFTAXHIMFDRILZ-GOEBONIOSA-N 376.884 2.968 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCCN(c4ncccn4)CC3)cc2nc1C 95503755 PVTBRGIMHSPVOY-UHFFFAOYSA-N 377.452 2.781 0 50 GFAA COc1ccc([C@H](C)NC(=O)c2ccc(CN3CCN(C)CC3)o2)cc1F 97087823 LEPJYDQPBDIDLJ-AWEZNQCLSA-N 375.444 2.666 0 50 GFAA COc1ccccc1N1C(=O)C[C@H](SCC(=O)Nc2ccc(F)cc2)C1=O 100277596 AFEBEZGLZIQIHP-INIZCTEOSA-N 388.420 2.838 0 50 GFAA O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 109281985 WFAGKERWFPNXGR-CYBMUJFWSA-N 388.361 2.556 0 50 GFAA COCc1nc2n(n1)C[C@@H](NC(=O)c1ccc(CCC(F)(F)F)cc1)CC2 122557728 OUYGVPWNZQAVNA-AWEZNQCLSA-N 382.386 2.664 0 50 GFAA O=C(Cc1nc(CN2CC(=O)N[C@@H]3CCCC[C@@H]32)cs1)Nc1ccccc1 132072429 BTUAGZXZKQDNFW-SJORKVTESA-N 384.505 2.567 0 50 GFAA CC1(C(=O)N[C@@H]2CCCN(c3cccnn3)C2)CCN(Cc2ccccc2)CC1 157950582 YMXLLTPXQAJKIW-HXUWFJFHSA-N 393.535 2.864 0 50 GFAA O=C(CCCNC(=O)c1ccsc1)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 170602570 CFFRRLDQGGQIDR-BBRMVZONSA-N 392.443 2.858 0 50 GFAA O=C(Nc1ccn(Cc2ccccc2)n1)[C@@H]1CCCN1C(=O)c1ccccc1O 171113764 CAZBQHOBOQRYIM-SFHVURJKSA-N 390.443 2.880 0 50 GFAA CS(=O)(=O)c1ccc(-c2noc(Cc3cnn(-c4ccccc4)c3)n2)cc1 172053681 BSQZHDGHBPTNOO-UHFFFAOYSA-N 380.429 2.917 0 50 GFAA Cc1ccc2nc(COc3ccccc3C(=O)N3CC[C@@H](C(=O)O)C3)cn2c1 178269430 SZTHPSHMXWUJTP-OAHLLOKOSA-N 379.416 2.768 0 50 GFAA COc1cccc(CCNC(=O)CN2CCO[C@@]3(CCc4ccccc43)C2)c1 179097454 PGWSZWKAVSPXKV-QHCPKHFHSA-N 380.488 2.528 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1CC(=O)N(c2ccccc2)C1 195221621 HMTKHVBLAWQYJT-SFHVURJKSA-N 392.459 2.850 0 50 GFAA CNC[C@@H]1CCCN(C(=O)C2(S(=O)(=O)c3cc(C)ccc3C)CCCC2)C1 237215051 XCXHYSAUZTUGLK-SFHVURJKSA-N 392.565 2.848 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)N[C@H](CC(=O)O)c3cccs3)CC2=O)cc1 237730745 URSCFUGANVEQRC-HZPDHXFCSA-N 386.473 2.737 0 50 GFAA O=C(O)CN(C(=O)c1cc2cc(Br)ccc2o1)C1CCOCC1 238112425 LSFKKVIEYDZEOQ-UHFFFAOYSA-N 382.210 2.901 0 50 GFAA C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N[C@H]1CCSc3ccccc31)C2=O 241121825 JEDCPVROQNFRNF-IAMHBRQHSA-N 387.505 2.840 0 50 GFAA COc1ccccc1OCC(=O)N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252539910 ORGUJYWQTYAODR-JKSBSHDWSA-N 383.444 2.637 0 50 GFAA Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc2cn[nH]c2)c2ccccc21 263587849 LXSAHMRNLOBNHE-INIZCTEOSA-N 383.452 2.976 0 50 GFAA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)[C@H]1CCCN(Cc2ccccc2)C1 263823967 RBVNNIJMWKZORB-ROUUACIJSA-N 383.458 2.899 0 50 GFAA Cn1ccnc(N2CCC[C@@H](NCc3ccccc3OC3CCCC3)C2)c1=O 275664586 VFPXEZGOGLGKAQ-GOSISDBHSA-N 382.508 2.860 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@H](Cn3ccnn3)C2)ncn1 275707939 NYRQANWLMXJKPJ-ZWOKBUDYSA-N 385.516 2.600 0 50 GFAA O=C(Nc1cccc(N2CCC2=O)c1)C1CCN(C(=O)c2ccccc2)CC1 280409039 HEIWOGIILNAZRW-UHFFFAOYSA-N 377.444 2.914 0 50 GFAA Cc1ccccc1CN1CCC2(CC[C@H](CNC(=O)Cn3ccnc3)O2)CC1 299782048 FKXATPCJYACWTR-HXUWFJFHSA-N 382.508 2.522 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N1CCC(Cc2cccnc2)CC1 426581271 ORMHKXRQLWXHOE-GOSISDBHSA-N 379.460 2.997 0 50 GFAA O=C(NCCSc1cnn[nH]1)N1CCC[C@H](COc2cccc(F)c2)C1 426613675 SLOUXSXGOPDDNJ-ZDUSSCGKSA-N 379.461 2.537 0 50 GFAA O=C(NCCN1CCOCC1)c1ccc(-c2ccc3c(O)nccc3c2)cc1 534648683 FVOJUFNHPBXORP-UHFFFAOYSA-N 377.444 2.669 0 50 GFAA CN(C)C(=O)c1cccc(CNC(=O)N2CCC(Cc3cccnc3)CC2)c1 536134217 YZOSEFZSTUSJMV-UHFFFAOYSA-N 380.492 2.948 0 50 GFAA O=C1C[C@H](C(=O)N2CCC[C@@H]2c2nc(C(=O)O)cs2)c2ccc(F)cc2N1 828317500 DWXXGZALOLHLIA-SMDDNHRTSA-N 389.408 2.770 0 50 GFAA O=C(c1ccc(C(=O)N2CCC(c3cscn3)CC2)cc1)N1CCOCC1 888100402 JGSSMGMFXZVPPB-UHFFFAOYSA-N 385.489 2.635 0 50 GFAA Cn1cc([C@@H]2CSCCCN2S(=O)(=O)c2cccc3c2OCCC3)cn1 907776091 VNZZUHBWWOYUQZ-INIZCTEOSA-N 393.534 2.614 0 50 GFAA Cc1ccc(CN(C(=O)Cn2nc(C)c([C@H]3COCCN3C)c2C)C2CC2)o1 952892670 FXUNZXCXLIGKDS-LJQANCHMSA-N 386.496 2.596 0 50 GFAA O=C1CN(c2cc(C(=O)N3CCCCC3)ccn2)CCN1CCc1ccccc1 1529166942 BAHZXTNZMDRXSH-UHFFFAOYSA-N 392.503 2.599 0 50 GFAA COc1cc(OC)c(C(=O)N2CCC[C@@]3(CCc4cnc(C)nc43)C2)cc1OC 1704340286 FMSPAQCHKGUQFL-JOCHJYFZSA-N 397.475 2.931 0 50 GFAA CCCOc1cccc(CNC(=O)[C@H]2CC(=O)N(c3nnc(CC)s3)C2)c1 1857722919 PONUBZLBNMGSDZ-AWEZNQCLSA-N 388.493 2.559 0 50 GFAA CC(C)[C@H](C(=O)N1C[C@@H]2CCN(C(=O)C3(CN(C)C)CC3)[C@@H]2C1)c1ccccc1 1875336588 HTQVRCLSEJKUMX-HBMCJLEFSA-N 397.563 2.827 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCCC[C@H]2C(=O)OCc2ccccc2)CC1 1875365339 WLGNTUNIVUUARD-IBGZPJMESA-N 384.476 2.536 0 50 GFAA Cc1nc(C2CCN(C)CC2)c2n1CCN(C(=O)c1ccc3nc(O)oc3c1)C2 1875394330 FQTHEOWDXYCKNY-UHFFFAOYSA-N 395.463 2.504 0 50 GFAA COCCn1cc(CNC/C(C)=C/c2cccc(C(F)(F)F)c2)c(O)nc1=O 2325774141 DYPZSURGKRJBFN-MDWZMJQESA-N 397.397 2.807 0 50 GFAA CN(C)Cc1cccc(C(=O)N2CC[C@@H](n3cnc4ccccc4c3=O)C2)c1 2325781330 FEQXCDBDXOXMIR-GOSISDBHSA-N 376.460 2.545 0 50 GFAA COCC[C@H](NC(=O)N1C[C@H](O)C[C@@H](OC)C1)c1cccc(C(F)(F)F)c1 2325787159 GAKWRDHGSBJONG-OAGGEKHMSA-N 390.402 2.574 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N[C@@H]2COc3cc(F)c(Br)cc32)C1 2325888284 CNGQREYGBVSDPP-QMTHXVAHSA-N 397.244 2.563 0 50 GFAA O=C(NCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)O)c1ccncc1 2356141109 VRRRVEGJFQAROX-UHFFFAOYSA-N 386.795 2.930 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)c(OC)c1 821343 LVBLAYYFDQJFCO-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CCOC(=O)C(=Cc1ccc(S(=O)(=O)c2ccccc2)o1)C(=O)OCC 2546542 ZEJJFTLBUALWFR-UHFFFAOYSA-N 378.402 2.622 0 50 GFAA COc1ccc(S(=O)(=O)N(C[C@H](O)CC(C)(C)C)C2CCN(C)CC2)cc1 225828911 NURMGQSXMPDELK-QGZVFWFLSA-N 398.569 2.577 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1=O)Nc1ccc(Br)cc1 101321380 WEAKHMUNEQPWFR-GREKMHCPSA-N 391.265 2.809 0 50 GFAA CNC(=O)c1cccc(NC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)c1 115751391 VARZZWCJSXXELR-SFHVURJKSA-N 380.448 2.706 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)N1CCO[C@@H]([C@H]2CCCO2)C1 247279941 KGMBCNYVGZRICZ-KBAYOESNSA-N 379.888 2.508 0 50 GFAA Cc1cccc(NC(=O)CC(=O)NC[C@H](c2cccnc2)N2CCCC2)c1C 55309414 YGHNCURFAMYXDO-HXUWFJFHSA-N 380.492 2.980 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)c3c(F)cccc3Cl)nn2)n1 67603656 IHUYTRSMTMODIX-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA CN1CCc2ccc(NC(=O)NCc3ccccc3CN3CCC[C@H]3CO)cc21 248839658 PWAWGUHPUWRQQG-NRFANRHFSA-N 394.519 2.957 0 50 GFAA CC(=O)N[C@@H]1CCN(C(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)C1 67786524 WYWQCNXKRMRTOY-CYBMUJFWSA-N 397.353 2.623 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN(C)CC3(CO)CCC3)C2=O)cc1 67688807 ZFTXUZBUFZVHNG-HSZRJFAPSA-N 388.552 2.758 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccc(N(C)C)nc3)CC2)cn1 328654973 XXBLDNQQHPEBNO-KRWDZBQOSA-N 382.512 2.715 0 50 GFAA Cc1c(Cl)cccc1NC(=O)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 35598121 ORWHVIRTIRRWNG-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA O=C(NC1CCN(c2ccccn2)CC1)N1CCOC[C@@H]1c1ccc(F)cc1 457782563 ICZKUKGWRTZILB-LJQANCHMSA-N 384.455 2.973 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1 237732370 MMTHMLLIMQQASP-WOJBJXKFSA-N 394.471 2.546 0 50 GFAA O=C(Cn1cn[nH]c1=O)N[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 157256471 XGWIXDXSOUQJFO-UKRRQHHQSA-N 382.386 2.823 0 50 GFAA O=C(c1cc(OC(F)F)cc(OC(F)F)c1)N1CCC(n2ccnn2)CC1 378444229 LWLFQCBLBVMCRW-UHFFFAOYSA-N 388.321 2.958 0 50 GFAA O=c1[nH]nc(C2CCN(c3cnc4ccccc4n3)CC2)n1Cc1ccccc1 71750632 HASOUUCLJPRCMR-UHFFFAOYSA-N 386.459 2.947 0 50 GFAA CN(C1CCCCC1)S(=O)(=O)N1CCC[C@H]1c1nnc2n1CCCCC2 240871403 IKHUISYEUCAEKC-INIZCTEOSA-N 381.546 2.651 0 50 GFAA CC(C)(O)c1cn(C[C@H]2CCCN(C(=O)c3cnc4ccccc4c3)C2)nn1 48428202 FLNRHZZFUHGLER-HNNXBMFYSA-N 379.464 2.606 0 50 GFAA COc1cccc(N2CC[C@H](CNC(=O)N3CCOc4cc(O)ccc4C3)C2)c1 287534908 BUFJWQUZKGKLGZ-MRXNPFEDSA-N 397.475 2.831 0 50 GFAA O=C(Nc1cnn(Cc2ccccn2)c1)N1CCC(OC[C@@H]2CCCO2)CC1 177873287 QZYVLPPWTYSNSC-IBGZPJMESA-N 385.468 2.518 0 50 GFAA Cc1cc(C)c2c(CC(=O)NCc3nc(-c4cnccn4)n[nH]3)coc2c1C 426691150 GRHKPDUHSNFXMZ-UHFFFAOYSA-N 376.420 2.792 0 50 GFAA CCC[C@@H]1C=CCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 95528080 SANFIGBHTNKCQJ-MRXNPFEDSA-N 392.521 2.670 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCCn1nc(C)c(Cl)c1C)C2 95360349 HUYZYNAEWSTPHG-HNNXBMFYSA-N 377.872 2.920 0 50 GFAA CC(C)=CCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)CCC(=O)Nc1ccccc1)C2 95371888 CFAULNZSWYIIHW-PKOBYXMFSA-N 383.492 2.821 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1 95372224 PJZHESAIZIALAK-CYBMUJFWSA-N 391.401 2.858 0 50 GFAA Cn1ncc(NC(=O)c2ccc([C@H]3CCCN3CCCn3cccn3)s2)n1 23380014 RCXBSYGFBBVOJE-CQSZACIVSA-N 385.497 2.553 0 50 GFAA Cc1cc2c(NC(=O)N3CCN(Cc4ncccc4C)CC3)cccc2nn1 95496706 OZEKAENFPYDRRJ-UHFFFAOYSA-N 376.464 2.991 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1O)N1Cc2cnc(-c3ccccc3)nc2C1 91460850 AUESHHFSWASEFZ-UHFFFAOYSA-N 396.410 2.857 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)[C@H]3CC[C@@H](O)CC3)[C@@H]3C4CCN(CC4)[C@H]23)c1 248124682 HBSOGEVIQDQDLJ-ADZZIANESA-N 384.520 2.635 0 50 GFAA C[C@H](Oc1ccc2c(c1)OCO2)C(=O)NCc1ccc(N2CCCC2=O)cc1 299788344 RXQJBRRXVFEEFL-AWEZNQCLSA-N 382.416 2.626 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@@H]4CC(F)(F)[C@H]4C3)nn2C)cc1OC 1875298016 LWROFPIPSNAVNT-STQMWFEESA-N 377.391 2.832 0 50 GFAA Cc1nc2cccc(C(=O)N3CCn4c(C)nc(C5CCN(C)CC5)c4C3)c2[nH]1 1875394624 POKBZMTZKGATKE-UHFFFAOYSA-N 392.507 2.841 0 50 GFAA Cc1cccc([C@@H](CNC(=O)N2CCOCC[C@@H]2C2CC2)N2CCOCC2)c1 1875300359 AMSZJHZGXPCWPP-NHCUHLMSSA-N 387.524 2.579 0 50 GFAA O=S1(=O)CC[C@]2(C(F)(F)F)CN(Cc3csc([C@@H]4CCCO4)n3)C[C@@H]21 1875392803 UWJPLDFGVKAKPE-OBJOEFQTSA-N 396.456 2.546 0 50 GFAA C[C@H](NC(=O)Cn1c(Cc2ccc(F)cc2)noc1=O)c1ccc(F)cc1F 1875317764 CXMABYIFBIEHSK-NSHDSACASA-N 391.349 2.722 0 50 GFAA C[C@@H]1CCS[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H]1CCSC1 1875357792 XCIWUBQZFUAAGW-FIAHSWLMSA-N 390.574 2.780 0 50 GFAA Cc1ccn(-c2ccc(N3CCC(NC(=O)c4ccccc4C)CC3)nn2)n1 301210730 WMTOMOVMAPLCFN-UHFFFAOYSA-N 376.464 2.678 0 50 GFAA Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCC[C@@H]4C(=O)NC[C@@H]43)cc12 170609906 ARRRYDQWBYPUPZ-HOCLYGCPSA-N 380.473 2.746 0 50 GFAA Cc1c(C(=O)N(C)CC2(N(C)C)CCC2)nnn1-c1cccc2cccnc12 188064224 IDOPQZJDHIAHJF-UHFFFAOYSA-N 378.480 2.680 0 50 GFAA CC(C)NS(=O)(=O)c1cccc(C(=O)N[C@H]2CCCc3c(O)cccc32)c1 190233306 NLXRMIHTXCPTTJ-SFHVURJKSA-N 388.489 2.886 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCN(c2ccncc2C)CC1 1260772251 GXNDTRJHWUEYQM-UHFFFAOYSA-N 375.494 2.526 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)CC2)c(C)o1 1772706014 UQGANKQJJVVREJ-SFHVURJKSA-N 395.459 2.697 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)CCN1CCCCO1 11838424 HEHSDDQJDCJVHW-UHFFFAOYSA-N 391.531 2.956 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCCCc3ccncc3)CCC2=O)cc1 12307874 WKUWESRCSFMFHJ-FQEVSTJZSA-N 395.503 2.620 0 50 GFAA CC(C)=CCN1CC(=O)N(CC2CCOCC2)C[C@H](OCc2cccnc2)C1 14530422 KKXBNQHMAHBEMJ-OAQYLSRUSA-N 387.524 2.504 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)cc1 19313431 UMPSYXKQERCAFQ-HXUWFJFHSA-N 397.450 2.679 0 50 GFAA O=C(c1ccc(Br)o1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19893251 OYTMJMGKJHXVGJ-UHFFFAOYSA-N 393.237 2.729 0 50 GFAA COc1cccc(-c2cc3c(=O)n(CCNC(=O)c4ccccc4)ccn3n2)c1 169777095 YUENDQAPVACVEL-UHFFFAOYSA-N 388.427 2.602 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3C[C@@H]4CCOC[C@]4(C(=O)O)C3)cc2)c1 1857668799 ICRRWJGDBIYTNI-PGRDOPGGSA-N 381.428 2.926 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](Cc4nc(C)nn4CCCO)C3)nc2c1 1857674219 YLSNJYYKONPBLW-HNNXBMFYSA-N 385.468 2.578 0 50 GFAA COCCn1nc(Cc2ccc(OC)c(OC)c2)nc1-c1ccn2nccc2c1 1857674453 JAEJLHSOMRAGET-UHFFFAOYSA-N 393.447 2.847 0 50 GFAA O=C(NCCN1CCc2ccccc21)c1cc2c(s1)CCOC21CCNCC1 1857685566 YAFYEJQQXYISPB-UHFFFAOYSA-N 397.544 2.692 0 50 GFAA NCCc1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cc1 1857710433 XDTLPDCQJDQPFX-GOTSBHOMSA-N 393.531 2.866 0 50 GFAA CCc1nc(C)sc1CNC(=O)[C@@H]1CC(=O)N(c2nnc(C(C)C)s2)C1 1857720828 MPBBKVZHBFTEJA-LLVKDONJSA-N 393.538 2.658 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3c(F)cccc3Cl)C[C@]23CC[C@H]1O3)C1CC1 1857738789 YKSMMTWCWDTBAB-ASCUOWJESA-N 378.875 2.985 0 50 GFAA O[C@H]1CN(c2cc(-c3ccc4c(c3)OCO4)ccn2)C[C@H]1Cc1ccncc1 1875248376 NKGKFIPHTCFTIC-MOPGFXCFSA-N 375.428 2.912 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@H](c3ccccc3F)C2)n(-c2ccccc2)n1 237981345 CLTKLCFPEVPKBB-IBGZPJMESA-N 395.390 2.923 0 50 GFAA NC1(C(=O)N2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)CCOCC1 498234993 PVKZPYFGSWNXQD-INIZCTEOSA-N 390.528 2.796 0 50 GFAA COc1cccn2ncc(C(=O)N[C@@H](C)c3cccc(N4CCCC4=O)c3)c12 930781992 PGPYCNWBIZIUSC-AWEZNQCLSA-N 378.432 2.961 0 50 GFAA O=C1CC[C@H](N2CCC3(CCc4c(O)nc(-c5ccccc5)nc43)CC2)CCN1 2100556400 MIPKHFJYLPDDSM-KRWDZBQOSA-N 392.503 2.798 0 50 GFAA Cc1c(C(=O)N2CC[C@]3(C(=O)O)CCCC[C@H]23)nnn1Cc1ccc(F)cc1 2325784458 HQLVUAIYLGDOFK-OXJNMPFZSA-N 386.427 2.633 0 50 GFAA CCO[C@@H](C(=O)N1C[C@@H]2CN(Cc3nc4c(o3)CCCC4)C[C@]2(C)C1)C1CC1 2325793675 CZIIINYGUMLWND-SAWYMBPVSA-N 387.524 2.649 0 50 GFAA CCn1cnc(C(=O)N[C@]2(C)CCN(C(=O)c3c(C(F)(F)F)coc3C)C2)c1 2325794071 PQLKXWLMYWNHQS-QGZVFWFLSA-N 398.385 2.858 0 50 GFAA C[C@@H]1COCC[C@H]1C(=O)N1CCC(n2nnc(-c3ccc(Cl)cc3)n2)CC1 2325810753 BNCZTSRBHSAREG-CXAGYDPISA-N 389.887 2.830 0 50 GFAA O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1)NCc1cccnc1 829704 PEMBIADYENAFOD-UHFFFAOYSA-N 399.447 2.732 0 50 GFAA COC(=O)C1[C@H](c2ccccc2)C(C(=O)N2CCOCC2)[C@H]1c1ccccc1 897629 HFJKDTBIAOUSBU-HJLBWTBNSA-N 379.456 2.832 0 50 GFAA CCOC(=O)C1=NO[C@H](CNC(=O)c2c(-c3ccccc3Cl)noc2C)C1 1401569 XZYXUWGCCNEUHX-NSHDSACASA-N 391.811 2.741 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)c1C(=O)OC(C)C 6184388 STINFIHLUWESGO-GHMZBOCLSA-N 396.465 2.550 0 50 GFAA COc1ccc(Cl)cc1N([C@H](C)C(=O)N1CCC[C@H](C)C1)S(C)(=O)=O 10541642 PRYJNAMQTUHASP-QWHCGFSZSA-N 388.917 2.762 0 50 GFAA CCOC(=O)C[C@@H]1CCCCN1C(=O)c1cc(Cn2ccnc2C(C)C)[nH]n1 11664140 TXFFADJGWRCTBC-INIZCTEOSA-N 387.484 2.726 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(CC=C(C)C)CC1 11838541 RLOWXZVTUYGTCB-UHFFFAOYSA-N 376.497 2.881 0 50 GFAA O=C1C[C@@H](NS(=O)(=O)c2ccsc2)CN1Cc1cccc2ccccc12 12075680 BNCONBRNDBYRFB-MRXNPFEDSA-N 386.498 2.981 0 50 GFAA COc1ccccc1CNC(=O)c1cn(C(C)C)cc(C(=O)NC(C)(C)C)c1=O 12195098 LPNUIQCLNVTXKR-UHFFFAOYSA-N 399.491 2.896 0 50 GFAA CCOC(=O)N1CCN(C(=O)C[C@H](c2ccc(O)cc2)c2cccc(O)c2)CC1 12197650 LCBBLEKCEDBPBU-HXUWFJFHSA-N 398.459 2.921 0 50 GFAA CCN1C[C@@H](CN(C)Cc2nc(-c3cccc(OC)c3OC)oc2C)CC1=O 12372760 CMYRNEHOVRQDGX-OAHLLOKOSA-N 387.480 2.967 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCN1CCCCO1 12597668 ZGSKJBZSUAMUEP-FQEVSTJZSA-N 391.531 2.956 0 50 GFAA Cc1nc2c(C)cccc2cc1C(=O)N1CCC(n2cc([C@H](C)O)nn2)CC1 20167177 WYRQWJMDVFGCGR-HNNXBMFYSA-N 379.464 2.974 0 50 GFAA CN(Cc1n[nH]c(=O)[nH]1)C(=O)c1ccc([C@H]2CCCN2C2CCCC2)s1 20449654 OSQTXUINAOSTGP-CYBMUJFWSA-N 375.498 2.511 0 50 GFAA O=C1NCCCC[C@@H]1Nc1ccc(-c2nc(COc3ccccc3)no2)cn1 20542648 GBYJHXPKIXZIBX-INIZCTEOSA-N 379.420 2.791 0 50 GFAA CCN(C(=O)c1cc(COc2c(C)cccc2C)on1)[C@H]1CCS(=O)(=O)C1 67886663 ZJEVTVUNYLQWHP-HNNXBMFYSA-N 392.477 2.520 0 50 GFAA COc1ccc2cc([C@@H]3CN(c4cc(NCCO)ncn4)CCO3)ccc2c1 71762029 ULYRRIZENXUZCA-IBGZPJMESA-N 380.448 2.621 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC[C@@]3(C2)C(=O)N(C)c2ccccc23)c1C 72159347 QXIYKXRTIGVJDF-QFIPXVFZSA-N 379.460 2.985 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CCCn2cncn2)CCCN1Cc1ccc(F)cc1 72162043 SCVJMPMKKZYIFM-FQEVSTJZSA-N 387.503 2.957 0 50 GFAA Cc1cnc(C(=O)N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 72174057 GXAZYEMZZZSTKJ-CDHQVMDDSA-N 384.430 2.766 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)c4ccccc4Cl)CC3)ncn2)c1C 72437768 OWDAVHWZTMNNHK-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CCCn3ccnc3C)CC2)OC1=O 77375452 VXSXZSRXJNFTOX-MRXNPFEDSA-N 376.501 2.974 0 50 GFAA C[C@H](NC(=O)Cn1c(-c2ccco2)nn(-c2ccc(Cl)cc2)c1=O)C1CC1 77522510 UGQXFNXOKMFRJF-LBPRGKRZSA-N 386.839 2.862 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(C(=O)Cc1ccc(F)cc1Cl)CC2 91461243 IIRGKUNKUGUZFE-UHFFFAOYSA-N 376.863 2.751 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)N2CCCN(c3ncccn3)CC2)cc1 95507037 HWWARRZGUIBVPJ-UHFFFAOYSA-N 377.452 2.715 0 50 GFAA Cc1cccc(CN2CCC(c3nnc(Cn4ccnc4)n3C3CC3)CC2)n1 96151999 PKPHHLNFZWDPRS-UHFFFAOYSA-N 377.496 2.941 0 50 GFAA CCn1nc(CO)c2c1CCN(C(=O)Nc1snnc1-c1ccccc1)C2 96163383 ZNWUTRRTTXKRBA-UHFFFAOYSA-N 384.465 2.504 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)c1ccc(CN2CCCC2)o1 97635102 CHDJFSIMDACPSS-UHFFFAOYSA-N 375.856 2.689 0 50 GFAA COc1ccc(S(N)(=O)=O)cc1C(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1 122077453 VGMFZDCKCSQCSA-KRWDZBQOSA-N 388.489 2.608 0 50 GFAA O=C(Cn1cnc(NC(=O)[C@@H](c2ccccc2)C2CC2)n1)NCc1ccccc1 132728035 HOXKINBXKBXOMO-FQEVSTJZSA-N 389.459 2.727 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@H](c3ccccc3OC)C2)c1 170615169 BXWHLPCEAZGZMI-SFHVURJKSA-N 390.461 2.823 0 50 GFAA O=C(CCNc1nc(Cl)nc2[nH]cnc12)NCCn1ccc2ccccc21 170625686 NRJKMMITTZNTIX-UHFFFAOYSA-N 383.843 2.579 0 50 GFAA biogenic COc1cc([C@H](C)Nc2cnn(C)c(=O)c2Br)cc(OC)c1OC 170626281 WZBGBHBARBDAAJ-VIFPVBQESA-N 398.257 2.742 0 50 GFAA CN(C)c1cccc(COC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)c1 170640340 DKHVAUQMTGMFPZ-MRXNPFEDSA-N 396.443 2.620 0 50 GFAA O=C(c1ccc(OCc2ccccc2)nc1)N1CCCC[C@H]1CN1CCOCC1 171865268 WXPBTXCXZUFZRD-NRFANRHFSA-N 395.503 2.988 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCC(C(F)(F)F)CC3)ccc2N1 173906995 SGNQMYHFGWMIGB-UHFFFAOYSA-N 376.400 2.924 0 50 GFAA Cn1cc(N2CCC[C@H](NC(=O)NCCc3nc(C(C)(C)C)cs3)C2)cn1 176478741 FHPDLIRSVPXPGW-AWEZNQCLSA-N 390.557 2.685 0 50 GFAA CCN1CCN(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2ccccc21 177615435 KSWMVEUNHXAJQA-UHFFFAOYSA-N 385.489 2.952 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)c(C)o1 183065518 HEEBMVVRXWHUND-KRWDZBQOSA-N 398.912 2.902 0 50 GFAA CCC[C@]1(C(=O)OCC)CCCN1CC(=O)Nc1cccc(NC(C)=O)c1 225535995 WASMVOYZGJTSAS-HXUWFJFHSA-N 375.469 2.781 0 50 GFAA COc1ccc([C@H](NC(=O)Cc2ccc(O)c(Cl)c2)[C@H]2C[C@@H](O)C2)cn1 244811550 SGRCVAIVBLGSPJ-KSMMKXTCSA-N 376.840 2.620 0 50 GFAA COc1cccc(CN2C[C@@H]3OC(=O)N(Cc4ccc(OC)c(OC)c4)[C@@H]3C2)c1 247889183 MGOHISRQNHDNFT-NQIIRXRSSA-N 398.459 2.918 0 50 GFAA Cc1nc(N2CCOCC2)sc1-c1nnc(N2CCC(C)(C)CC2)n1C 252478580 APXRYDOJDNUZCP-UHFFFAOYSA-N 376.530 2.710 0 50 GFAA COCCN(C)c1ccc(CN[C@H](CN2CCCC2=O)c2ccccc2)cn1 252482760 DNFQILXJUIVHIV-HXUWFJFHSA-N 382.508 2.618 0 50 GFAA O=C(O)[C@H]1CC12CCN(C(=O)c1ccc3c(c1)[nH]c(=O)n3C1CCCC1)CC2 262429171 MEMSMJBFZCYJLE-OAHLLOKOSA-N 383.448 2.772 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccco2)c1 268184041 JJDUFOHBWMGPNS-GDBMZVCRSA-N 387.436 2.768 0 50 GFAA CCn1cc(-c2nn(C)cc2C(=O)NCC2([C@H](O)c3ccccc3)CC2)cn1 275349486 QKLYCOQMEHYLMW-LJQANCHMSA-N 379.464 2.547 0 50 GFAA C[C@H]1Oc2ccccc2N(CCC(=O)N(C)Cc2ccc(C(=O)O)cc2)C1=O 298425310 LWLJHEJLETVKLI-CQSZACIVSA-N 382.416 2.547 0 50 GFAA COc1ccc(CNC(=O)c2ccccc2OC[C@H]2CCCO2)cc1C(=O)O 299748483 HEFQKEJIYDIOOX-OAHLLOKOSA-N 385.416 2.881 0 50 GFAA C[C@@H](NC(=O)N1CCC2(CC1)CN(C)C(=O)O2)c1cnn(-c2ccccc2)c1 426490573 RTJRNEBKCNIXKM-OAHLLOKOSA-N 383.452 2.560 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCCN(C)CC3)csc2C1 426712644 MPQWLJFDVNHEFV-UHFFFAOYSA-N 388.537 2.689 0 50 GFAA CCc1cc(N2CCN(C(=O)c3cccc(-c4ccc(O)cn4)c3)CC2)ncn1 534649849 OSPYHSRPTBCIAT-UHFFFAOYSA-N 389.459 2.769 0 50 GFAA O=C([C@@H]1CCc2ccccc21)N1CCCN(S(=O)(=O)c2ccccc2)CC1 591155073 HWYCQYBCYYGIQS-HXUWFJFHSA-N 384.501 2.640 0 50 GFAA Cc1cc(C)c2nonc2c1S(=O)(=O)NCCCn1ccnc1C(C)C 670446912 HREYFRCPDVXIPN-UHFFFAOYSA-N 377.470 2.528 0 50 GFAA Cc1nnnn1/C(=C\c1cccc(F)c1)C(=O)OCc1cnc2ccccc2n1 726342902 CDFPYTIFWMTKHK-GRSHGNNSSA-N 390.378 2.805 0 50 GFAA Cc1csc([C@](O)(CC(=O)N2CCC(n3cccn3)CC2)C(F)(F)F)n1 746847907 OHIMSSDOYZLYED-OAHLLOKOSA-N 388.415 2.652 0 50 GFAA Cc1ccc(S[C@H](C)C(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)cc1 820621644 XRAOYLMUIQOYQL-QGZVFWFLSA-N 389.565 2.808 0 50 GFAA O=C(NCC1CCN(C(=O)[C@H]2CCCO2)CC1)C1=Cc2ccccc2OC=C1 827910519 PXRRZNAVLUWHDJ-HXUWFJFHSA-N 382.460 2.510 0 50 GFAA COC(=O)C[C@@H](c1ccccc1)c1c(O)n(CCc2cnc[nH]2)c(C)cc1=O 888090201 IQDXCJKQAUMJEV-KRWDZBQOSA-N 381.432 2.523 0 50 GFAA CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 888100114 LMNIVYREMDXOGS-ZFWWWQNUSA-N 392.512 2.863 0 50 GFAA Cc1ccc2nc(CCN3CCN(Cc4ccc5c(c4)OCO5)CC3)[nH]c2c1 1506398089 VDOUPISRZLRHBR-UHFFFAOYSA-N 378.476 2.960 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)CCc2c[nH]c3ccccc23)N1 1506398908 HRFBFWRZSRTGTN-SFHVURJKSA-N 376.460 2.803 0 50 GFAA CCC[C@]1(C(=O)O)CN(C(=O)C(C)(C)Oc2cccc(C)c2C)CC[C@@H]1O 1704344875 PTHYJADDHHMYAJ-UWJYYQICSA-N 377.481 2.925 0 50 GFAA COc1cc(-c2onc(N3CC[C@@H]4CC[C@H](C3)N4C)c2C(=O)O)ccc1F 1772705855 BFLQXWRTTNVJAU-QWHCGFSZSA-N 375.400 2.860 0 50 GFAA COc1cccc(-n2c(=O)nc(O)c3ccc(-c4cc(OC)ccc4O)nc32)c1 1857526292 WJXLVPDAHXLICN-UHFFFAOYSA-N 391.383 2.876 0 50 GFAA COc1cc(SC)c(OC)cc1CN1C[C@@H](O)[C@H](Cc2cc(C)no2)C1 1857720942 RHOVWBCUSBXUQK-CZUORRHYSA-N 378.494 2.758 0 50 GFAA C[C@@H](C(=O)NCC[S@@](=O)c1ccccc1F)n1ccc(C(F)(F)F)n1 1875269373 GMWNJWFFSWWGBM-UXMMLNGASA-N 377.363 2.526 0 50 GFAA NC(=O)CO[C@H]1CCN(C(=O)N[C@@H](CCc2ccc(F)cc2)c2ccccc2)C1 1875304272 FVTJZRZZDCPQQM-PMACEKPBSA-N 399.466 2.785 0 50 GFAA Cc1csc(N2CCC[C@@H](C(=O)N3C[C@H]4C[C@H]3C[C@]4(O)C(F)(F)F)C2)n1 1875392125 BXKSSDCHWDZOOW-NFFDBFGFSA-N 389.443 2.582 0 50 GFAA O=C(N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2c1ccccc1)N1CCC[C@@]12CCS(=O)(=O)C2 1875405575 JYEACAXWHYKGRM-YRIDSSQKSA-N 388.533 2.931 0 50 GFAA NCc1ccc(NC(=O)C[C@H]2Cn3nc(-c4ccccc4)cc3NC2=O)cc1F 2325859097 OAZZBXGNYMCDEZ-HNNXBMFYSA-N 393.422 2.745 0 50 GFAA C[C@@H](O)Cn1cc(-c2nc([C@H]3COc4ccccc43)nn2C2CCC2)ccc1=O 2325880167 XOVUMWAGLFFPGA-KDOFPFPSSA-N 392.459 2.737 0 50 GFAA COc1ccc(S(=O)(=O)NCCc2ccc(OC)c(OC)c2)cc1Cl 1078083 OKIQDYDAMYGUSL-UHFFFAOYSA-N 385.869 2.887 0 50 GFAA CC[C@@H](C)Nc1nc(OC)nc(N(C#N)CC(=O)N(c2ccccc2)C(C)C)n1 2922629 TYFJWPKOGHQGIN-OAHLLOKOSA-N 397.483 2.820 0 50 GFAA Cc1oc(C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1S(N)(=O)=O 133757468 OKLFSGDTGYYADZ-UHFFFAOYSA-N 385.445 2.646 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccoc1)NCC1(c2ccccc2)CCCC1 55225956 UQNYMPRDHZPNCH-HXUWFJFHSA-N 395.503 2.598 0 50 GFAA NCc1cn(CC2CCN(Cc3ccc([C@H]4CCCCO4)s3)CC2)nn1 23430873 AEOPRKZXOIGBHO-GOSISDBHSA-N 375.542 2.952 0 50 GFAA O=C(NCC[C@@H]1COc2ccccc2O1)c1ccc(N2CCSCC2)nc1 67473093 FGZWOMHIUUOCFM-MRXNPFEDSA-N 385.489 2.595 0 50 GFAA COCCN1CC(=O)N(C[C@@H]2CCCN(C)[C@H]2c2cccc(Cl)c2)C1=O 252535707 GQRLDGJQMFOVPI-YJBOKZPZSA-N 379.888 2.634 0 50 GFAA C[C@H](NC(=O)CN1CCC[C@H]1CN1CCC[C@H]1CO)c1ccc2c(c1)CCCC2 252674794 SNUYKGVHEPXUIG-TZYHBYERSA-N 399.579 2.664 0 50 GFAA O=C1c2ccccc2N[C@@H](c2ccccn2)N1NS(=O)(=O)c1ccccc1 1421362 NQMNTDNUBVEXTO-GOSISDBHSA-N 380.429 2.542 0 50 GFAA COc1ccc(N2C[C@H](C)N(C(=O)c3nc4ccc(F)cc4[nH]3)CC2=O)cc1 77320137 LGBCJTTUYHQNCS-LBPRGKRZSA-N 382.395 2.588 0 50 GFAA O=C(N1CCCC1)N1CCC[C@@H](C(=O)N2CCOc3ccc(Cl)cc32)C1 172685949 TWSAWXIXNBRJBW-CQSZACIVSA-N 377.872 2.993 0 50 GFAA C[C@@H](C(=O)Nc1ccc(N2CCCC2)c(F)c1)N1C(=O)NC2(CCCC2)C1=O 363375942 FMYSDUMOQALOPA-ZDUSSCGKSA-N 388.443 2.618 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@H]1C(=O)N(C)Cc1cc(C(C)C)no1 72479891 SLCJWCTWJOAFBV-IBGZPJMESA-N 376.545 2.953 0 50 GFAA CC(C)NC(=O)C1CCN(C2CCN(C(=O)/C=C/c3cccs3)CC2)CC1 13594010 AWNRVTKTIQMUHN-AATRIKPKSA-N 389.565 2.989 0 50 GFAA Cc1ccc2oc(CN3CCN[C@H](C(=O)NCc4cccnc4)C3)c(C)c2c1 72152044 RMNCZHFGVMFDHL-IBGZPJMESA-N 378.476 2.535 0 50 GFAA COc1ccc(-c2ccc(C)c(NC(=O)N[C@@H]3CCc4ncnn4C3)c2)cn1 284079887 SAWXKPXPKMIALD-MRXNPFEDSA-N 378.436 2.794 0 50 GFAA Clc1cccc(-c2noc(CCN3CCN(C4CCOCC4)CC3)n2)c1 175484310 GLHXUZFIWXXSRH-UHFFFAOYSA-N 376.888 2.729 0 50 GFAA Cc1cc(-c2ccc(C(=O)NC[C@H](O)CO)cc2)nc2cc3c(cc12)CCC3 426722716 VXYPJARWUJXRDR-IBGZPJMESA-N 376.456 2.782 0 50 GFAA COCCN(Cc1nc(C)no1)C[C@@H]1CCCN(C2Cc3ccccc3C2)C1 95516754 HOWDJGRIUPSELM-SFHVURJKSA-N 384.524 2.706 0 50 GFAA Nc1cccc(-c2cccc(C(=O)N3CCC[C@@H](CN4CCOCC4)C3)c2)n1 426387907 QHFFMFUOSUZHGP-KRWDZBQOSA-N 380.492 2.515 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)Nc2ccc3c(C)cc(=O)oc3c2)on1 96163635 HKBDYZOLSRQVQM-DYVFJYSZSA-N 383.404 2.777 0 50 GFAA COCCCn1cnnc1[C@H](C)NC(=O)Nc1ccc2nc(C)c(C)nc2c1 96150317 QZJZKWKFFNGLSB-AWEZNQCLSA-N 383.456 2.757 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)N[C@@H]2CCCN(c3cnccn3)C2)cc1 95525545 VMHHMBBQNRRFOY-QGZVFWFLSA-N 377.452 2.761 0 50 GFAA COc1cc(NC(=O)N2CCC(N3CCOCC3)CC2)c(OC)cc1Cl 95496908 YXHKTDFDKURRBB-UHFFFAOYSA-N 383.876 2.686 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3cccnc3OC)[C@@H]3C4CCN(CC4)[C@H]23)c1 95506633 VUJKHPYUUWTXBJ-NJDAHSKKSA-N 393.487 2.801 0 50 GFAA O=C(c1ccc(-c2cc[nH]n2)cc1)N(CCN1CCOCC1)Cc1ccco1 91876477 FPZIMZSZYRUGMD-UHFFFAOYSA-N 380.448 2.644 0 50 GFAA CN(C1Cc2ccccc2C1)S(=O)(=O)c1cccc(C(=O)NC2CCC2)c1 95381955 PJJDOXPARDHZML-UHFFFAOYSA-N 384.501 2.757 0 50 GFAA O=C(N[C@H]1C[C@H](c2nnc(CO)n2C2CC2)C1)c1csc(-c2ccccc2)n1 244734299 NCZAZWCZWOYGCY-HDJSIYSDSA-N 395.488 2.905 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1ccc3c(c1)CCO3)CC2 299744756 PRXUZQQUIPTRKT-QGZVFWFLSA-N 397.427 2.853 0 50 GFAA Cc1ccc(OC[C@H](C)NC(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1 534637005 RDBRUJLPTLJJEZ-KRWDZBQOSA-N 385.464 2.913 0 50 GFAA CC(C)n1cnnc1[C@H](C)NC(=O)c1c(OCc2ccccc2)c(=O)ccn1C 1940197215 ZQWVIHZWTINSKO-HNNXBMFYSA-N 395.463 2.628 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCC[C@H]2C[C@H](O)c2ccco2)c1 268184043 JJDUFOHBWMGPNS-HOCLYGCPSA-N 387.436 2.768 0 50 GFAA O=C(CCc1ccc2c(c1)OCCO2)N[C@@H](CO)c1cc(F)c(F)c(F)c1 1875255970 WAALGXBBNZFCRF-HNNXBMFYSA-N 381.350 2.658 0 50 GFAA C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccnn1CC1CC1)[C@H]1COc2ccccc21 888101627 KDDIXWHTSWVRLC-QMLHBMHXSA-N 396.491 2.987 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)Cc2cccc3ccc(OC)cc23)o1 1775959089 HGHQCKMRZNFLHO-CRAIPNDOSA-N 381.432 2.671 0 50 GFAA Cc1ccc(CN2C[C@@H](c3cncn3C)[C@H](CNC(=O)C3(C)CC3)C2)c(C)n1 1775962810 JDDNCQUGKVQMJM-RTBURBONSA-N 381.524 2.564 0 50 GFAA O=C(O)[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 221906853 BRKODXKTUZABBD-KWCYVHTRSA-N 375.812 2.817 0 50 GFAA Cn1c([C@H]2CCCN2Cc2cn(Cc3cccnc3)nn2)nc2c1CCCC2 275423453 DSMWAHUHPLPHKI-HXUWFJFHSA-N 377.496 2.671 0 50 GFAA CC[C@@H]1CN(C(=O)c2cc(NC(C)=O)ccc2F)[C@H](CC)CN1CC(C)(C)O 170606123 RIBVUFGMGYEQJI-IAGOWNOFSA-N 393.503 2.870 0 50 GFAA COc1ccccc1OCC(=O)N1CCC(NC(=O)c2cc(C)oc2C)CC1 171291614 KCRVSGJRJSNJCF-UHFFFAOYSA-N 386.448 2.705 0 50 GFAA CC[C@H](C(=O)Nc1cc(-n2cnnc2)ccc1OC)N1Cc2ccccc2C1=O 1506397371 MDEBMZXZWZUWHB-GOSISDBHSA-N 391.431 2.649 0 50 GFAA COc1cccc(-c2cc(CNC(=O)CSc3nnc(C)s3)on2)c1 1506407914 LEEDWTDAYRWLHU-UHFFFAOYSA-N 376.463 2.919 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@H](Cc2ccnc3ccccc23)[C@@H](O)C1 1615734029 CEJXFFYHZJJZPM-UWJYYQICSA-N 379.460 2.834 0 50 GFAA CC[C@@]12C[C@@H]1CN(C(=O)C1CCN(C(=O)c3cc(OC)cc(OC)c3)CC1)C2 1772819090 PNZAZYCMVKTKPZ-VGSWGCGISA-N 386.492 2.815 0 50 GFAA Cc1cnn(CCCN2C[C@@H]3CN(Cc4ccccc4)C[C@@]3(CCC(=O)O)C2)c1 1772809438 WOQZTCQNVMQKFF-FYYLOGMGSA-N 396.535 2.880 0 50 GFAA O=C(CC1=CCCC1)N1C[C@H]2CN(Cc3c(F)cccc3F)C[C@]2(CO)C1 1772819767 SIQBZHHYRRNFSI-IIBYNOLFSA-N 376.447 2.718 0 50 GFAA CC(C)CCn1c(CN(C)CC2CCOCC2)cnc1S(=O)(=O)C(C)C 11819296 KQJKXOHVXKJOQZ-UHFFFAOYSA-N 385.574 2.970 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)NCCCc2ccccn2)CCC1=O 12307432 AZKAEJHIRXJQKC-SFHVURJKSA-N 381.476 2.578 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N1CCN(Cc2ccccc2)CC1 12865427 BMWGXLKMAUQFOR-UHFFFAOYSA-N 386.517 2.828 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccccc4Cl)CC3)nn2)n1 13009164 NXOQEKFCUSCOQQ-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA C[C@@H](Cn1cccn1)C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1857722555 YCAJDIPKCPRDHS-HNNXBMFYSA-N 397.523 2.819 0 50 GFAA CO[C@H]1COC[C@H]1n1ccnc1-c1cc2ccc(C)cc2nc1N1CCOCC1 1857734431 JNKHUTJTNROVSA-UXHICEINSA-N 394.475 2.830 0 50 GFAA CCN=c1ncc(CN2CCC(C3CCN(Cc4cccnc4)CC3)CC2)c[nH]1 1875251494 OYELNPZCGLFRGE-UHFFFAOYSA-N 394.567 2.850 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC[C@@H](c2ccccc2)N(C)C)cc1Cl 130499125 KVLRJGQACPEMSX-KRWDZBQOSA-N 396.896 2.708 0 50 GFAA CN(C)CCN(C)[C@H]1CCCN(C2CCN(c3ccc(F)c(F)c3)CC2)C1 20601310 WUWXBWQFXQJWKC-IBGZPJMESA-N 380.527 2.891 0 50 GFAA Cc1cc(C)nc(-n2[nH]c(C(=O)N(C3CC3)[C@H](C)c3ccccc3)cc2=O)n1 900421275 FJFFLPCPGHBUBC-OAHLLOKOSA-N 377.448 2.938 0 50 GFAA Cn1ccc2c(NC(=O)NC3CCN(Cc4cscn4)CC3)cccc2c1=O 2325700770 VOKKMBWBYTXEIX-UHFFFAOYSA-N 397.504 2.781 0 50 GFAA C[C@@]1(CO)COCCN(C(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)C1 2325801060 UAVKMJMGOGHUQR-OAQYLSRUSA-N 389.398 2.667 0 50 GFAA CCN(C)Cc1cc(O[C@H]2CCN(C(=O)[C@@H]3CCCc4nc(C)[nH]c43)C2)ccn1 2325806418 SBISGPOZESQSOO-RBUKOAKNSA-N 397.523 2.665 0 50 GFAA C[C@@H]1Cc2c(Br)cccc2CN1C(=O)[C@@H]1CCn2cnnc2C1 2325811647 LUESUTOHVNXSOY-VXGBXAGGSA-N 375.270 2.576 0 50 GFAA Cc1cccc(CN2CCC[C@@H]2CNC(=O)c2ccc3ncn(C)c(=O)c3c2)c1 2325858443 NGCSAYNXARCUEQ-LJQANCHMSA-N 390.487 2.636 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3cc(C)ccc3C)CC2)c1 789072 WTMMHVLUFGXJFB-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA O=C(Nc1cccc(Cl)c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 991004 ATPSGMYGGVDVAN-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA CCc1ccc(NC(=O)CN(c2cc(C)ccc2OC)S(C)(=O)=O)cc1 1138194 WDXMUCXZZDSNTN-UHFFFAOYSA-N 376.478 2.971 0 50 GFAA Cc1cc(S(=O)(=O)NCC(C)C)ccc1OCC(=O)N1CCCCCC1 2868847 CMVRNPRRGQKLDO-UHFFFAOYSA-N 382.526 2.711 0 50 GFAA O=S(=O)(Cc1nnnn1-c1ccc(Br)cc1)c1ccc(F)cc1 6760638 LHOXSGXDQWSKEN-UHFFFAOYSA-N 397.229 2.538 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C[C@H]3CCOC(C)(C)C3)CC2)CC1 11949913 RKDNWBKGNJKMOU-FQEVSTJZSA-N 379.589 2.848 0 50 GFAA CC(C)CCn1cc(C(=O)NCc2cccnc2)c(=O)c(C(=O)NC(C)(C)C)c1 12247447 UMEWUTYFNZLBIJ-UHFFFAOYSA-N 398.507 2.748 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCc2[nH]nc(-c3ccccc3F)c2C1 12298294 HPMSWPFKNVMJJJ-UHFFFAOYSA-N 376.413 2.568 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@@H](NCc3ccc(OC)c(OC)c3)C2=O)cc1 18117081 AZBHJRZWKAGWJN-GOSISDBHSA-N 398.459 2.914 0 50 GFAA CCC(=O)c1ccc(OC[C@H](O)CN2CCN(c3ccccc3F)CC2)cc1 20406652 VZNAGXYFCCGBFQ-GOSISDBHSA-N 386.467 2.980 0 50 GFAA COC(=O)C1CCN(C2CCN(c3cccc(N4CCCC4=O)c3)CC2)CC1 23192110 JBWWUCZNIBWYSQ-UHFFFAOYSA-N 385.508 2.667 0 50 GFAA Cc1ccccc1CN1CCN(Cc2cccn2-c2ncccn2)C[C@@H]1CCO 23361174 PUYMCZJHVMXRAB-NRFANRHFSA-N 391.519 2.645 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1ccc(Cl)cc1)CC(=O)N2 35476277 VZEXKIIVFGYQGS-CYBMUJFWSA-N 379.811 2.746 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cccc(F)c3C)CC2)C1 67739396 MCYNVDXPQWFYJZ-LJQANCHMSA-N 391.531 2.573 0 50 GFAA Cc1ncccc1C(=O)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 67884252 JBVYDPYEIQOJAG-ZWKOTPCHSA-N 385.851 2.931 0 50 GFAA CNCCN(C)C(=O)CC[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71738499 IPBBADHUHUHOLU-HSZRJFAPSA-N 379.504 2.602 0 50 GFAA Cc1ccc(C(N)=O)c(N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n1 71745870 UTCYQUYFOQJUDX-LJQANCHMSA-N 398.482 2.892 0 50 GFAA Cc1c(Cl)c(C(=O)N2CCN(c3nc4ccccc4s3)CC2)nn1C 72477822 DDJVNIWFFBFZPW-UHFFFAOYSA-N 375.885 2.954 0 50 GFAA COc1cccc(N2C[C@H](Cc3ccccc3)N(Cc3c[nH]cn3)CC2=O)c1 82114576 OWTSQSROCQFPDY-FQEVSTJZSA-N 376.460 2.878 0 50 GFAA COCCN(Cc1ccccn1)C(=O)[C@@H]1CCC(=O)N(CC2CCCCC2)C1 91289350 MFQZIXYFSUMBAZ-LJQANCHMSA-N 387.524 2.876 0 50 GFAA O=C(c1cccc(-c2cccc(F)c2)c1)N1C[C@H](CO)[C@H](CN2CCOCC2)C1 91390858 HCIHIIZCHMCIRC-NHCUHLMSSA-N 398.478 2.505 0 50 GFAA Cn1c(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)nc2ccccc21 91872991 RQQNJAHRIQEBSW-UHFFFAOYSA-N 392.507 2.592 0 50 GFAA COCCN1CCC[C@@]2(CCN(c3nc4c(C)cccc4cc3CO)C2)C1=O 95367043 ALMMRWASIYDBAG-QFIPXVFZSA-N 383.492 2.501 0 50 GFAA CSCCc1nc([C@H](NC(C)=O)C(C)C)n(-c2ccccc2C(=O)O)n1 95504890 FNVSPDKQDQNLDB-MRXNPFEDSA-N 376.482 2.704 0 50 GFAA COc1ccc(CN(CCC2=CCCCC2)C(=O)CN2C(=O)CCNC2=O)cc1 95523070 SVVPDWVWVMDQGS-UHFFFAOYSA-N 399.491 2.856 0 50 GFAA Cc1nc(C)n(CCCNC(=O)Nc2cccc(C(=O)N3CCCCC3)c2)n1 95530180 DOOFPVOTCHCTCN-UHFFFAOYSA-N 384.484 2.733 0 50 GFAA COc1ccccc1NC(=O)[C@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1c(OC)cccc12 101959255 UDDBGPSXEQREKG-GUXCAODWSA-N 399.472 2.586 0 50 GFAA CSCc1cc(F)ccc1CNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1 124950297 LKWAAJBSRZVGJY-MJGOQNOKSA-N 387.480 2.920 0 50 GFAA CCc1nc(-c2ccc(C(=O)N[C@@H]3CCN(c4ncccc4F)C3)cc2)n[nH]1 129820804 OGHCYHKWRNWSDF-OAHLLOKOSA-N 380.427 2.577 0 50 GFAA COCCOc1ccc(CNC(=O)N2CCN(C3CCCCC3)CC2)cc1 136869660 KSJZMHRDSYNGGX-UHFFFAOYSA-N 375.513 2.872 0 50 GFAA CCOc1ccccc1CNC(=O)c1cc2c(N3CCCC3)nc(C)cn2n1 169768708 AJDAVLDFRFPCAF-UHFFFAOYSA-N 379.464 2.967 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 175649947 JIBKLMHUPURSBD-OXQOHEQNSA-N 383.540 2.932 0 50 GFAA O=C(Nc1sc2c(c1C(=O)N1CC[C@H](CO)C1)CCCC2)c1cccnc1 179678814 PZXYXEIZRAWOMB-ZDUSSCGKSA-N 385.489 2.729 0 50 GFAA COc1cc(F)c(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cc1F 182602412 GIIGCIZCRHFKSV-OAHLLOKOSA-N 376.359 2.922 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)Cc1n[nH]c2c1CCCC2 188933794 YFMBMRRRIRCXIJ-IBGZPJMESA-N 396.491 2.778 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)CCNC(=O)c2ccccc2F)C[C@@H]1O 212147699 NJLWIRRVOSRZGR-RDJZCZTQSA-N 390.480 2.693 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1cccc(F)c1)c1ccc(-n2ccnc2)cc1 223610924 DQRKJJRRKSBCBP-WOJBJXKFSA-N 381.407 2.978 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCC[C@@H]3CCC[C@H]32)c(Br)o1 230235452 KSUZZVWBRITFSP-DTWKUNHWSA-N 378.244 2.694 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)C1 237451531 IDEJKXWVEHUESO-LPHOPBHVSA-N 386.517 2.860 0 50 GFAA CN(C)Cc1cccc(C(=O)N[C@@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)c1 244773718 PFCVRKITMXVSOP-VWPQPMDRSA-N 380.488 2.925 0 50 GFAA CCCCc1nc(C)cc(N2CCOC[C@@H]2c2ncn(CC(F)(F)F)n2)n1 253418780 ZPQKRQFGYZDQSU-CYBMUJFWSA-N 384.406 2.859 0 50 GFAA CC1(C2CCN(C(=O)[C@@H]3CCCCN3C(=O)c3cccs3)CC2)OCCO1 268058228 ZCHFTSNIGXIFMB-INIZCTEOSA-N 392.521 2.744 0 50 GFAA O=C(O)C1CCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)CC1 268943631 MVMQDPRZHBRHNJ-UHFFFAOYSA-N 399.896 2.750 0 50 GFAA C[C@H]1CCN(C(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)CC12CCC2 271332969 LVKOVLIOJOMMNZ-HNNXBMFYSA-N 389.521 2.620 0 50 GFAA CC1(c2cccc(Cl)c2)CCN(C(=O)c2ccc(S(N)(=O)=O)nc2)CC1 280679618 WDYSLRXEQUCPJF-UHFFFAOYSA-N 393.896 2.576 0 50 GFAA Cc1nnc(Cc2ccc(NC(=O)N3CCC[C@H](Cn4ccnc4)C3)cc2)[nH]1 299787093 VFNYMCVDNYWWJS-QGZVFWFLSA-N 379.468 2.845 0 50 GFAA CCN1CCC[C@@H]1CN(C)C(=O)N[C@H](c1ccccc1OC)c1nccn1C 363592792 LDWIXMYFRNGWQT-VQIMIIECSA-N 385.512 2.644 0 50 GFAA O=C(NC[C@H](c1cccc(Cl)c1)N1CCOCC1)N1CC2(CCCOC2)C1 376731313 YLVYOSLJQAOTLR-GOSISDBHSA-N 393.915 2.535 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)Nc2cc(-c3cccc(F)c3)on2)C[C@H]1C(F)(F)F 417787420 FWJMSZPNZGRUIY-GHMZBOCLSA-N 387.289 3.208 0 50 GFAA CCn1ncc(CN(C)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c1C 426397652 WJDFYGNXWNSCNW-SFHVURJKSA-N 383.452 2.530 0 50 GFAA COc1ccc(CNC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)c(OC)c1 426477240 PZMVKYKLWJQRNW-IBGZPJMESA-N 385.464 2.990 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)c2cccc(-c3cncn3C)c2)CC1 426640387 LBLKSIWTICVWIF-UHFFFAOYSA-N 375.476 2.749 0 50 GFAA COCCn1cc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)nn1 907367825 COSOCFUMMRQKMN-MRXNPFEDSA-N 383.496 2.896 0 50 GFAA Cc1ccccc1-c1ncc(CN2CCN(c3ncccc3C(N)=O)CC2)s1 952990834 XHPMYXNCSUZQPY-UHFFFAOYSA-N 393.516 2.935 0 50 GFAA COc1ncccc1C(=O)N1CCCN(Cc2cccc(O)c2Cl)CC1 1529106182 MBZZQQFXKZEFHU-UHFFFAOYSA-N 375.856 2.797 0 50 GFAA CN(C)Cc1ccc([C@@H]2CCCN2c2nccc(N3CCC(O)CC3)n2)cc1 1529186104 VSJDVUQNVRGRTP-FQEVSTJZSA-N 381.524 2.841 0 50 GFAA Fc1cnc(N2CCC3(CC2)OCCc2ccsc23)nc1N1CCOCC1 1704336539 XNLNMVMJFHFWMK-UHFFFAOYSA-N 390.484 2.582 0 50 GFAA NCC(=O)N1C[C@H]2CN(C(=O)CCC3CCCC3)C[C@@]2(CCc2ccccc2)C1 1772701041 MDAZQHYEDXHXLE-QPPBQGQZSA-N 397.563 2.835 0 50 GFAA O=C(CCc1ccccn1)N[C@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@@H]1O 1857527365 UVFIXLCRAAQSRP-YYWHXJBOSA-N 390.487 2.834 0 50 GFAA O=C(c1cccc(OCCc2ccccc2)c1)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857669709 CBOOPFAGGFFANG-WMZHIEFXSA-N 395.455 2.871 0 50 GFAA CC[C@@]1(C(=O)N(C)Cc2ncc[nH]2)C[C@@H]2CC[C@H]1N2C(=O)Cc1ccsc1 1857671847 SXNLREPRFDMJBN-RZQQEMMASA-N 386.521 2.832 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1cc(C2CC2)[nH]n1 1857720976 SSCFSKAJKIZMBN-JTDSTZFVSA-N 386.883 2.885 0 50 GFAA CCS(=O)(=O)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1875240487 VGMVMUKVAKHXOX-RBUKOAKNSA-N 375.446 2.880 0 50 GFAA CCN(c1ccccc1C)S(=O)(=O)NC(=O)C[C@H]1COCc2ccccc21 1875293902 HCDSFQRSFVTUAZ-KRWDZBQOSA-N 388.489 2.886 0 50 GFAA COc1cc2c(cc1F)CC[C@@H]2NC(=O)[C@@H](c1ccccc1)n1nnnc1C 1875294452 SHTGLQUSIQOYJC-PKOBYXMFSA-N 381.411 2.522 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)c(F)c1 1875386467 RAXUJWPRFDUECP-SFHVURJKSA-N 388.826 2.901 0 50 GFAA FC(F)c1nnc2n1C[C@H](CN=c1cc(Cl)nc([C@H]3CCCO3)[nH]1)CC2 1875395082 KEFVQHZXVQMKLQ-VHSXEESVSA-N 384.818 2.607 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2cn[nH]c2)cc1 1875401305 IEBYUVHNQBFPSU-SJORKVTESA-N 378.436 2.524 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1cccc(-c2cc[nH]n2)c1 1875401312 IJSSMHQJVZQSQA-RDJZCZTQSA-N 378.436 2.524 0 50 GFAA CC(C)c1c(NC(=O)c2ccnc3c2CNCC3)c(=O)n(-c2ccccc2)n1C 2325778251 MBTAAVGDWPNPFQ-UHFFFAOYSA-N 391.475 2.592 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(Cc2cccc(O)c2Cl)CC[C@@H]1O 2356135306 YHBSNCRWOINNEC-ICSRJNTNSA-N 379.859 2.973 0 50 GFAA FC(F)(F)c1cc(N2CCc3nc(C4CC4)nn3CC2)nc(N2CCCC2)n1 2356139279 OSVQBMAEGNYLDX-UHFFFAOYSA-N 393.417 2.627 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 986246 UZVMRUKQFMWJNQ-UHFFFAOYSA-N 382.507 2.873 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc(SC)c2)cc1 1118229 WHHWVMQGPSWXFQ-UHFFFAOYSA-N 380.491 2.676 0 50 GFAA CC(=O)N1CCN(c2c(Cl)cccc2NS(=O)(=O)c2ccccc2)CC1 10010460 MLRPNHJYXRMERI-UHFFFAOYSA-N 393.896 2.809 0 50 GFAA Cc1occc1C(=O)N1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1 8303115 XDLLVRILKSBINY-UHFFFAOYSA-N 376.478 2.858 0 50 GFAA Cc1oc(C(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1S(=O)(=O)N(C)C 281171932 WHSPJOBIUDLHPH-UONOGXRCSA-N 382.869 2.778 0 50 GFAA O=C(CCc1nnc(C2(c3ccc(Cl)cc3)CCC2)o1)N[C@@H]1CCOC1=O 23153242 QMNILGBOVMAYBN-CQSZACIVSA-N 389.839 2.557 0 50 GFAA COc1ccc(NC(=O)CN2C[C@H](C)O[C@H](C)C2)cc1NC(=O)c1ccccc1 55413836 FYZJAXRWBOXZPA-IYBDPMFKSA-N 397.475 2.995 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CNCCN3CCCCC3)C2=O)cc1 67851403 OFPPFISPDJHSKU-QHCPKHFHSA-N 387.568 2.739 0 50 GFAA C[C@H]1c2nc(N)nc(-c3ccncc3)c2CN1C(=O)c1cn2ccsc2n1 65536672 QYRPZCHHTPAZKQ-JTQLQIEISA-N 377.433 2.547 0 50 GFAA CC(C)[C@@H]1CC[C@H](C)CCN1C(=O)C(=O)Nc1cc(S(C)(=O)=O)ccc1F 117527449 WXOYWOSCJYRYJY-GUYCJALGSA-N 398.500 2.841 0 50 GFAA Cc1nc(NC(=O)CC[C@@H]2NC(=O)N(CCc3ccccc3)C2=O)sc1C 170625630 YOHQYQPTCJTHCA-HNNXBMFYSA-N 386.477 2.642 0 50 GFAA CCNCc1ccccc1NC(=O)c1cc(S(=O)(=O)NCC)ccc1C 237089931 UTCXIHLKECNNKQ-UHFFFAOYSA-N 375.494 2.655 0 50 GFAA C[C@@H]1Cc2ccccc2N1CCNC(=O)[C@H]1CSCN1C(=O)C(C)(C)C 251796094 NRYHIONIPONFPW-RHSMWYFYSA-N 375.538 2.501 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CN(C[C@H](C)c2ccccc2)C(=O)O3)[nH]n1 72427242 RAECAGXSDWBWMG-HNNXBMFYSA-N 382.464 2.949 0 50 GFAA Cc1csc(CN2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)n1 71761347 NFYAJHMTKBEDMS-QGZVFWFLSA-N 376.570 2.750 0 50 GFAA CN(Cc1ccccc1)C1(C(=O)NCCc2cnccn2)Cc2ccccc2C1 39445708 IZHSSXFJCCZIEH-UHFFFAOYSA-N 386.499 2.805 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)N1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 71762525 QGAIRDQUNBKJLX-IBGZPJMESA-N 390.443 2.574 0 50 GFAA Cc1nc2cc(NC(=O)c3cnc(C(F)(F)F)nc3)ccc2n1[C@H](C)CO 456716365 OIYPKCMWGIOHKJ-SECBINFHSA-N 379.342 2.959 0 50 GFAA Cc1ccccc1-c1nnc(CN2CCN(C(=O)c3cccc(O)c3)CC2)o1 174668847 PSWJUEXLPLKDAL-UHFFFAOYSA-N 378.432 2.709 0 50 GFAA Cn1c(=O)cc(C(=O)N2CCO[C@H](Cc3cccc(F)c3)C2)c2ccccc21 71763506 ZOEVIQPZQKCPIV-QGZVFWFLSA-N 380.419 2.761 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](n2cc(C)cn2)C1 290927719 KIYYIMCVSYYIBT-MJGOQNOKSA-N 396.491 2.668 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NCCc1nc(C)c3c(n1)CCCC3)C2 95519160 FOKRTIROKNOUAX-MRXNPFEDSA-N 381.476 2.582 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(Cc2cccc(OC)c2)CC1 96167161 MJFKDIVQSPXINC-UHFFFAOYSA-N 380.496 2.931 0 50 GFAA C[C@@H]1CCCN(C(=O)c2ccc(NC(=O)NCCSc3ncn[nH]3)cc2)C1 97679898 VLBZTNOZZLIJOC-CYBMUJFWSA-N 388.497 2.591 0 50 GFAA CN(Cc1cc(-c2cccnc2)no1)C(=O)[C@@H]1CCN(c2ccccc2)C1=O 95498373 FITVPUFNAMQPMO-SFHVURJKSA-N 376.416 2.748 0 50 GFAA O=C1C[C@@H](c2nc(Cc3cccc(Cl)c3)nn2CCO)C2(CCCC2)O1 96164736 ZWKLANCJXKWRAN-HNNXBMFYSA-N 375.856 2.858 0 50 GFAA CCn1cc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 95382440 DEAWQMBXRCVNDG-PWIZWCRZSA-N 386.446 2.884 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3cnc(C)c(C)c3)C[C@H]2C(=O)O)c1OC 91849277 XJHJGKRHMQREMI-DLBZAZTESA-N 384.432 2.656 0 50 GFAA COC(=O)C[C@@H](c1cc2c(cc1O)OCO2)c1cc2ccccc2n(C)c1=O 253409580 MBHBZAZYNVFGJV-ZDUSSCGKSA-N 381.384 2.668 0 50 GFAA biogenic O=C1c2c(-c3nc(-c4ccsc4)no3)nnn2CCN1Cc1cccc(F)c1 263617389 NNASXYAHMOYUCH-UHFFFAOYSA-N 396.407 2.852 0 50 GFAA O=C(NCc1ccccn1)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263615457 CMRVCWUIBKXSEI-UHFFFAOYSA-N 387.439 2.933 0 50 GFAA O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)Nc1nc2ccccc2s1 32843332 AQZKODBLWDKBDP-ZLDLUXBVSA-N 376.507 2.961 0 50 GFAA biogenic C[C@@H](c1ccccn1)N(Cc1ccccc1)C(=O)CNC(=O)c1ncccc1O 1875254641 FBDSARPZSBHCGN-INIZCTEOSA-N 390.443 2.702 0 50 GFAA COc1cc(C(C)C)c(S(=O)(=O)NC(=O)CC2CCN(OC)CC2)cc1C 1875312953 LCKNQTAZBHOYPH-UHFFFAOYSA-N 398.525 2.595 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCC[C@@H](NC(=O)C(F)(F)F)[C@H]2C)cc1 1875373910 UHEVRJMTUNKLEV-IUODEOHRSA-N 397.397 2.507 0 50 GFAA O=S(=O)(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ccccc1C1CC1 1875398919 IZYNRKYOKUVOPN-JCURWCKSSA-N 395.912 2.532 0 50 GFAA COc1cc2nc(N3CCC[C@@H](Cc4cccnc4)C3)[nH]c(=N)c2cc1OC 1875341271 NDPGZYTZSLXSHD-HNNXBMFYSA-N 379.464 2.914 0 50 GFAA Cc1occ(C(F)(F)F)c1CC(=O)N1CC[C@@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401080 FCSKHBWYPISIJX-IINYFYTJSA-N 384.358 2.973 0 50 GFAA CCOc1ccc(S(=O)(=O)N(Cc2ccncc2)C[C@H]2CCCO2)cc1 952980403 KRYWSKRQAVNGRN-GOSISDBHSA-N 376.478 2.850 0 50 GFAA O=C(NCc1ccc(OC(F)F)cc1OC(F)F)c1noc2c1COCC2 888092858 LHWZWRUOELGDFJ-UHFFFAOYSA-N 390.289 2.880 0 50 GFAA CCCc1nc(C(=O)N2CCC([C@@H]3CCCN3C(=O)c3cn(C)cn3)CC2)co1 1775996700 FBYINNWBGINCHQ-SFHVURJKSA-N 399.495 2.518 0 50 GFAA CCN(CC(=O)O)C1CCN(S(=O)(=O)c2ccc(C(C)(C)C)s2)CC1 186754394 OXEJHVUKNJYOIB-UHFFFAOYSA-N 388.555 2.605 0 50 GFAA Cc1ccc2c(c1)CC[C@H](C(=O)N1CCOc3ccc(S(C)(=O)=O)cc31)O2 279805321 HFXPMSJFGCVRPP-LJQANCHMSA-N 387.457 2.518 0 50 GFAA CCOc1cccc(CN(CC)C(=O)[C@H]2OCC(=O)N[C@@H]2c2ccccc2)c1 1529192632 ZCLKZMPFXGOFBQ-RTWAWAEBSA-N 382.460 2.690 0 50 GFAA COc1ccc(CN2CCCN(C(=O)c3ccoc3)CC2)cc1Cn1cccn1 1775979502 WIQOPLDSRJOXAA-UHFFFAOYSA-N 394.475 2.881 0 50 GFAA Cc1nn(C)cc1CN(C)Cc1ccccc1OC[C@@H](O)CN1CCCCC1 12745636 SXCACJOFOVOVNS-NRFANRHFSA-N 386.540 2.586 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 13944735 DRQNZRLMMXYSAL-MRXNPFEDSA-N 396.878 2.924 0 50 GFAA CSc1cccc(NC(=O)N2C[C@@H]3COC[C@]3(C(=O)N3CCCCC3)C2)c1 1857691080 UHJSAXHJCMRFKW-FOIQADDNSA-N 389.521 2.901 0 50 GFAA Cc1c(F)cccc1CN1CCC2(CC1)CN(Cc1cc[nH]n1)C[C@H]2C(=O)O 1857707394 QNXHGWLBUWMXBI-SFHVURJKSA-N 386.471 2.656 0 50 GFAA c1ccc([C@H]2COC[C@H]3CN(c4cc(N5CCCCC5)ncn4)CCN23)cc1 1857713765 MUQGCBXJRAWAOY-WOJBJXKFSA-N 379.508 2.729 0 50 GFAA COc1ccc(-n2nc(-c3c[nH]nc3C)nc2[C@H]2CC[C@H](N)[C@@H](OC)C2)cc1 1857718959 BNAUURPBLYOTID-KKXDTOCCSA-N 382.468 2.584 0 50 GFAA COC(=O)c1cccc(CN2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1 1857728242 TWEZHSJFDLUFHQ-MZKRTTBSSA-N 392.455 2.748 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857732560 WACOUGNHNOIFIT-KNKQGSTJSA-N 380.419 2.669 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 236830336 SZJPSLQMJNLSKZ-VQTJNVASSA-N 378.428 2.763 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CC[C@@]2(C[C@H](O)c3ccccc3O2)C1 818410060 XZYGRDZQYNIXAO-BVZALQNUSA-N 392.455 2.527 0 50 GFAA C[C@]1(Cc2ccc(C(F)F)cc2)CCCN1CCN1CCS(=O)(=O)CC1 2325756515 BWNCNAUFXQSTJA-LJQANCHMSA-N 386.508 2.752 0 50 GFAA CCc1cccc2c(C(=O)COC(=O)c3ccn(CCn4cccn4)n3)c[nH]c12 2325874760 ZZZKMEMZOILARW-UHFFFAOYSA-N 391.431 2.863 0 50 GFAA CC(=O)c1cccc(NC(=O)COc2ccc(S(=O)(=O)NC(C)C)cc2)c1 1141609 HRZGFKURSYIFGM-UHFFFAOYSA-N 390.461 2.593 0 50 GFAA O=C(CNC(=O)c1ccco1)OCc1ccc(C(=O)Oc2ccccc2)cc1 2844227 IHWKLZURFOSVSE-UHFFFAOYSA-N 379.368 2.972 0 50 GFAA O=C(NCc1ccc(F)cc1)C1CCN(S(=O)(=O)c2cccs2)CC1 6305916 ARJUMHWLJFMDHA-UHFFFAOYSA-N 382.482 2.604 0 50 GFAA Cc1nc(NC(=N)Nc2ccc3c(c2)OCCO3)[nH]c(=O)c1Cc1ccccc1 9938523 CNFATLBVCCIBIH-UHFFFAOYSA-N 391.431 2.899 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCCC[C@H]3CO)no2)c(Cl)c1 12056038 WULWYDLBRUPZRG-LBPRGKRZSA-N 380.828 2.903 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@]2(CCCN(CC3CCCCC3)C2=O)C1 12072398 DMCXKXIZHADZPL-OAQYLSRUSA-N 378.513 2.751 0 50 GFAA CSc1nnc(CNC(=O)[C@@H]2CCOC(C)(C)C2)n1-c1ccc(F)cc1 12078028 IGONKDVEXKJREZ-GFCCVEGCSA-N 378.473 2.950 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccn2)cc1 12303048 LFUOKHWUDLHDMM-FQEVSTJZSA-N 389.459 2.748 0 50 GFAA O=C(c1ccc2c(c1)OCO2)[C@H]1CCCN(Cc2ccc(OCCO)cc2)C1 12387405 QUXHVHVLTPLHKG-SFHVURJKSA-N 383.444 2.881 0 50 GFAA CCOCCOc1cccc(C(=O)Nc2ccc(C(=O)NCCOC)cc2)c1 12404283 VHKDOFPYHZADMU-UHFFFAOYSA-N 386.448 2.730 0 50 GFAA O=C(C1CCOCC1)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2=O)C1 12572590 LQKVCOQTKNOKGF-QHCPKHFHSA-N 384.520 2.887 0 50 GFAA COc1ccc(C(=O)[C@H]2CCCN(C(=O)CSc3ncccn3)C2)cc1F 12576190 UWXAFSDJXQVHIS-AWEZNQCLSA-N 389.452 2.838 0 50 GFAA O=C(Cn1cncn1)N1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 12593457 JGKDALVQIUEULH-FQEVSTJZSA-N 376.460 2.728 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)C3CCC3)CC2)C1 12594861 BYHKGHQKCKVHFU-OAQYLSRUSA-N 397.563 2.848 0 50 GFAA CC(=O)c1ccc(N2CCN(CC(=O)Nc3ccc4nsnc4c3)CC2)cc1 13324524 DGSUNWAJGDMJGT-UHFFFAOYSA-N 395.488 2.655 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2)CN(Cc2ccc(CO)o2)CC1=O 14746536 STVKTRJAWPVYLF-NRFANRHFSA-N 386.492 2.658 0 50 GFAA COc1ccc(Br)cc1S(=O)(=O)N1CCN=C1c1ccccc1 15919317 QFKOSZBBPZSFLA-UHFFFAOYSA-N 395.278 2.909 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc4nonc4c3)C[C@@H]2CCO)cc1 19740699 HPQWKYDJWRPEIG-IBGZPJMESA-N 396.491 2.690 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNC3CCCCCC3)C2=O)c1OC 67725752 YILDLYNMXHTJBI-JOCHJYFZSA-N 390.524 2.870 0 50 GFAA CNS(=O)(=O)c1ccc(-c2nccn2C[C@@H]2OCCc3ccccc32)cc1 71497878 KZGLESTZHKZBGT-IBGZPJMESA-N 383.473 2.772 0 50 GFAA CCCSCC(=O)N1CCC2(CC1)CC(=O)N(Cc1c(C)noc1C)C2 95358167 APXDIENRMZOOHC-UHFFFAOYSA-N 379.526 2.776 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C(=O)Nc1ccc(C)cc1)CC2 95380794 JWEUSMWKDZFFIU-UHFFFAOYSA-N 394.479 2.653 0 50 GFAA Cc1cccc(S(=O)(=O)N2C[C@H]3CC[C@@H]2CN(Cc2c(C)noc2C)C3)c1 95391891 MCFQGLJQUXJTSS-ZWKOTPCHSA-N 389.521 2.885 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)cn1 95506540 HCBYIHKIFPIZIR-CQSZACIVSA-N 382.493 2.760 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCCC3)C2)cc1 96135774 IVGSNVDJSOEHNC-HNNXBMFYSA-N 381.498 2.598 0 50 GFAA Cc1ccc(C2(C(=O)N3CCCN(c4ccc(C)nn4)CC3)CCOCC2)cc1 110727289 XNRHAVYEJZGOKD-UHFFFAOYSA-N 394.519 2.881 0 50 GFAA Cn1ccnc1[C@@H](NC(=O)N1CCC(c2ccnn2C)CC1)c1cccc(F)c1 155673448 XUSAVHSFOIJKGF-IBGZPJMESA-N 396.470 2.971 0 50 GFAA CCO[C@@H]1C[C@@](NC(=O)/C=C/c2ccc(NC(C)=O)cc2)(C(=O)OC)C1(C)C 170602672 KJXCXIJMWIZGQE-MIPMUCIVSA-N 388.464 2.521 0 50 GFAA CCOC(=O)[C@](C)(CNC(=O)c1cnn(-c2ccccc2)n1)c1ccccc1 170605693 URVQJCOPQILAPE-OAQYLSRUSA-N 378.432 2.518 0 50 GFAA COCCn1ccc2c(NC(=O)[C@H]3CCCN(c4ncccn4)C3)cccc21 170625148 VJXKNDAEITZLJG-INIZCTEOSA-N 379.464 2.933 0 50 GFAA Cc1cc(C)c(CCNC(=O)Cn2c(=O)cnc3cc(F)c(F)cc32)c(C)c1 170630814 NKHVKBYOAYOBGD-UHFFFAOYSA-N 385.414 2.959 0 50 GFAA CS(=O)(=O)Cc1nc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)cs1 173782451 PYEZHNBVVACDKZ-AWEZNQCLSA-N 396.509 2.922 0 50 GFAA CC1(C)CN(CC(=O)NC2CCN(C(=O)c3ccco3)CC2)c2ccccc2O1 178579503 WWFDTYNGXGIGFN-UHFFFAOYSA-N 397.475 2.678 0 50 GFAA C[C@H](C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)n1cncn1 195410245 FGIWYWNTOGSMLH-MRXNPFEDSA-N 389.459 3.000 0 50 GFAA CCN1CCN(c2ccc(C(=O)N[C@H](C(=O)O)c3ccccc3)cc2F)CC1 236997306 KBLSURSIQNGUGK-IBGZPJMESA-N 385.439 2.523 0 50 GFAA O=S(=O)(c1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@@H]32)cc1)N1CCOCC1 247340395 AJDYMPQWJUBBCZ-KPACCLEDSA-N 390.549 2.622 0 50 GFAA C[C@H]1CN(CC2CCN(CC(=O)N[C@H](C)[C@@H]3C[C@H]4CC[C@H]3C4)CC2)C[C@@H](C)O1 251593516 FUZIDKSXUOOURP-RGRLZIOBSA-N 391.600 2.749 0 50 GFAA C[C@@H](Oc1ncccc1C(=O)NCCC(=O)N1CCCCCC1)C(F)(F)F 252480310 BZPJYWGGCLFNAY-CYBMUJFWSA-N 387.402 2.934 0 50 GFAA O=C(CN1CCC[C@H](c2nnc[nH]2)C1)Nc1ccccc1C(=O)c1ccccc1 253393786 WGXLQZXDNLUPBH-KRWDZBQOSA-N 389.459 2.854 0 50 GFAA COCCN1C(=O)C[C@@H](CNC/C(C)=C/c2ccccc2)[C@@H]1c1cnn(C)c1 275237525 FBQZHHYQWHAIAN-CRUOGIGISA-N 382.508 2.649 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccs2)cc1C(=O)O 299747199 CITYIHWEEQOJSU-CZUORRHYSA-N 376.434 2.526 0 50 GFAA O=C(O)CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)C1CCOCC1 299750010 MJVTXIDMEZMDCM-ZIAGYGMSSA-N 387.354 2.781 0 50 GFAA CC(=O)N1CCc2ccc(S(=O)(=O)N3CCc4cccc(F)c43)cc2CC1 328838353 NSFBQJWYXRLKQJ-UHFFFAOYSA-N 388.464 2.524 0 50 GFAA Cc1ccnc(C2CCN([C@@H](C)C(=O)Nc3ccc4c(c3)OCCO4)CC2)n1 363789377 FKDMRIQGWYEYCJ-HNNXBMFYSA-N 382.464 2.763 0 50 GFAA O=C(Cn1ccc(C(F)(F)F)n1)N1CCO[C@@H](c2ccc(F)cc2F)C1 375285155 AKMDGXWQALYWSL-CYBMUJFWSA-N 375.297 2.780 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)N2CC[C@]3(CCCOC3)C2)c1 375337225 LUHWGWKQUPBUQK-HXUWFJFHSA-N 394.537 2.668 0 50 GFAA O=C1N[C@H]2CN(CCc3ccc4ccccc4c3)CC[C@@H]2N1C1CCNCC1 420396365 DCDCNHCVWJUADE-VXKWHMMOSA-N 378.520 2.602 0 50 GFAA O=C(N[C@@H]1CCOC1)c1cccc(-c2cc(C(=O)N3CCCCC3)ccn2)c1 426419814 QFWMTOQAHTVOPF-LJQANCHMSA-N 379.460 2.893 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(C)c1CNC(=O)N1CCc2n[nH]c(C)c2C1 426421895 OBTALHMSXXPXEP-UHFFFAOYSA-N 382.443 2.928 0 50 GFAA Cc1noc(C)c1[C@H]1CCCN1C(=O)NCc1ccc2c(c1)n(C)c(=O)n2C 426546258 UWASQWYMGNFQRY-MRXNPFEDSA-N 383.452 2.529 0 50 GFAA COc1ccc([C@@H](C)N(C)C(=O)NCCCc2csc(N)n2)c(OC)c1 426685265 HZWJCQATQTYWRK-GFCCVEGCSA-N 378.498 3.078 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=S)Nc2ccc(C)cc2C)C1 795066512 GLLNVSXHJJJQMS-ZBFHGGJFSA-N 382.493 2.900 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCC([C@H](O)c2cccs2)CC1 952978568 APTRQPHNNMUOTI-SFHVURJKSA-N 380.535 2.870 0 50 GFAA NCc1cc(Oc2cccc(C(=O)N3C[C@@H](O)[C@H](F)C3)c2)nc(C(F)(F)F)c1 1384259579 ODGXXYXJORZPHE-ZIAGYGMSSA-N 399.344 2.506 0 50 GFAA CN(C)C[C@]12CN(C(=O)CCC3CCCC3)C[C@H]1CN(C(=O)C1CC=CC1)C2 1772706564 SYEADELUVHEOJC-NZQKXSOJSA-N 387.568 2.772 0 50 GFAA CCNC(=O)N1C[C@@H]2CN(Cc3cccnc3N)C[C@]2(CCc2ccccc2)C1 1772815606 PUJVFTUMQBIYRV-NZQKXSOJSA-N 393.535 2.760 0 50 GFAA Cc1nc2c([nH]1)CN(C(=O)[C@@H]1CCc3sc(-c4ccncc4)nc3C1)CC2 1772819541 OAPKGQQEVZBIRP-CQSZACIVSA-N 379.489 2.926 0 50 GFAA O=C(O)[C@@H]1COCCN(C(=O)c2cc(-c3ccccc3)nn2-c2ccccc2)C1 1775976966 CLWUNJYRELGHOU-KRWDZBQOSA-N 391.427 2.713 0 50 GFAA COc1cc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)ccc1F 1857670855 GMACXQQZBQHVCF-OAQYLSRUSA-N 384.407 2.724 0 50 GFAA COc1ccc(-c2nccn2C[C@H]2CC(=O)N(C3CC3)C2)cc1Cn1cccn1 1857678037 AEMCTPYWCHLMJZ-MRXNPFEDSA-N 391.475 2.814 0 50 GFAA CSCC(=O)N1C[C@H](C(=O)O)C2(CCN(CCCc3ccccc3)CC2)C1 1857684947 KZBGNTIMXDONSB-GOSISDBHSA-N 390.549 2.607 0 50 GFAA CCc1ccc(CN2CCC3(CC2)CC(=O)N(CCCCOC)CCO3)nc1 1857705749 UDVZNYRTFBSMJQ-UHFFFAOYSA-N 389.540 2.654 0 50 GFAA O=C(c1ccccc1OCc1ccccc1)N1C[C@@H]2[C@H](CO)[C@H]3CC[C@]2(C1)O3 1857728498 DITWTYKNXLEPPN-KLJZETAQSA-N 379.456 2.878 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4ccccc4F)[C@H]4CC[C@]3(C2)O4)c1 1875245187 OEAXAKRMSZFFFE-ODULNIPZSA-N 381.451 2.943 0 50 GFAA CCc1ccc([C@@H]2CCCCCN2C(=O)Cn2c(=O)c(=O)[nH]c3ccccc32)o1 1875259890 KAHVXZGAOIGRMO-SFHVURJKSA-N 395.459 2.989 0 50 GFAA Cc1ccc(Cn2nc(C)c(CCC(=O)N3C[C@@H]4CCC(=O)N[C@@H]4C3)c2C)cc1 1875295933 AUPCCDRLESGIHX-PZJWPPBQSA-N 394.519 2.526 0 50 GFAA COc1ccc(CN2CCC[C@@H]([C@H](C)NC(=O)Cn3cc(Cl)cn3)C2)cc1 1875307061 JLGYNAQJNZLHNM-DOTOQJQBSA-N 390.915 2.962 0 50 GFAA CCn1nc2c(c1C(=O)N1CCc3[nH]nc(C(F)(F)F)c3C1)C[C@H](C)O[C@@H]2C 1875314027 DLEBWJYXXRNTET-VHSXEESVSA-N 397.401 2.866 0 50 GFAA NS(=O)(=O)c1ccc(CCNc2nccn3nc(-c4ccccc4)cc23)cc1 1875324301 QWMDSDRORUQDFS-UHFFFAOYSA-N 393.472 2.698 0 50 GFAA O=C(O)c1ccccc1CCC(=O)N1CC[C@H](n2cc(-c3cncs3)nn2)C1 1875326346 HCTZAGPAKZEUAW-AWEZNQCLSA-N 397.460 2.506 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2cc(C)nc(-c3ccc(Cl)cc3)n2)[C@@H](C)C1 1875380888 DCUVAQKWSRSINL-AWEZNQCLSA-N 384.867 2.964 0 50 GFAA c1ccc(Sc2nc(=NC[C@@H]3CCCO3)nc(Sc3ccccn3)[nH]2)nc1 1875391092 XZBUFCASFGHLNB-ZDUSSCGKSA-N 398.517 2.977 0 50 GFAA O=C(N[C@H]1CNCC[C@H]1c1ccc(F)c(F)c1)N1CCCC2(CCNCC2)C1 2325756405 GGWBBSQYAKKNKD-LPHOPBHVSA-N 392.494 2.586 0 50 GFAA Cc1nnc([C@@H](C)N2CCC[C@](C)(CNC(=O)c3nccc4[nH]ccc34)C2)o1 2325812132 VJMZPIMTRFQTDW-ZUOKHONESA-N 382.468 2.847 0 50 GFAA O=C(CCn1cnc2sccc2c1=O)N1CC2(CCNCC2)c2ccccc21 2325823889 HQAFGLZPZRXPFZ-UHFFFAOYSA-N 394.500 2.516 0 50 GFAA Cn1ccnc1CN1CCC[C@@H]([C@@H]2CCCN(C(=O)CCCn3ccnc3)C2)C1 2325840121 QADLOVVJCGARHJ-WOJBJXKFSA-N 398.555 2.548 0 50 GFAA O=C(NCCOc1ccccc1)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356155360 DJFVGPRRMFHFQT-ICPLQIHGSA-N 391.471 2.514 0 50 GFAA CC[C@H]1CN(C(=O)c2cc3c(s2)CCOC32CCNCC2)CCN1C(C)C 2356159811 RDTLOXNBJRRIGT-INIZCTEOSA-N 391.581 2.844 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)c2n[nH]cc2I)cc1 680033 UCTWWAZRTZXOCK-UHFFFAOYSA-N 399.188 2.832 0 50 GFAA CCn1ncc(S(=O)(=O)Nc2ccn(Cc3ccc(Cl)cc3)n2)c1C 2804942 AVMUDHLCGQPGGH-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA Cc1ccc(CN(c2c(C)n(C)n(-c3ccccc3)c2=O)S(C)(=O)=O)cc1 6742917 PUBXNZRWPJANMJ-UHFFFAOYSA-N 385.489 2.759 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cc(COc2ccccc2SC)on1 12300605 WKTFTINEVBHLMZ-LBPRGKRZSA-N 382.507 2.819 0 50 GFAA CN(C[C@H](O)COc1ccccc1CNCc1nccn1C)C1CCCCC1 12316579 QQEQQOYMFALGTB-FQEVSTJZSA-N 386.540 2.714 0 50 GFAA CCc1n[nH]c(C(=O)N2CCC(n3nccc3NC(=O)C(C)(C)C)CC2)c1C 12432826 MJPNLLUZAYSXCJ-UHFFFAOYSA-N 386.500 2.939 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@@H](C(=O)NCc4ccccc4)C3)CC2)CC1 12756891 YMRPUTGTEUUTLI-LJQANCHMSA-N 383.536 2.806 0 50 GFAA CC1CCN(C2=NC(=O)[C@@H](CC(=O)Nc3cc(Cl)ccc3Cl)N2)CC1 20466891 DKUCAQBYVGZREZ-CQSZACIVSA-N 383.279 2.908 0 50 GFAA COc1ccccc1CC(=O)N1CCN(C(=O)c2cc3ccccc3n2C)CC1 20729149 VFPVKFINQYMTEJ-UHFFFAOYSA-N 391.471 2.714 0 50 GFAA COC[C@@H](c1ccccn1)N(C)C(=O)CCc1nc(-c2ccccc2OC)no1 55108617 VEWMUKJCEYCOGP-KRWDZBQOSA-N 396.447 2.919 0 50 GFAA NC(=O)CCn1cc(CNCCNC(=O)c2ccccc2Cl)c2ccccc21 55393568 KUBGLULRUVECBU-UHFFFAOYSA-N 398.894 2.690 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)c1 67620871 RROFJMPXRXWLLM-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA Cc1cc(NCc2cccnc2N(C)CCc2ccccn2)nc(N(C)C)n1 67642544 JGCHZFBGTRMUPW-UHFFFAOYSA-N 377.496 2.932 0 50 GFAA Cc1onc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1CO 71497933 GVWYUVZKLYCWIK-LJQANCHMSA-N 389.471 2.987 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(c3ncnc4[nH]cnc34)C2)cc1OC 72152283 HJWIOKSVLVNHFS-MRXNPFEDSA-N 396.495 2.513 0 50 GFAA Cc1cccc(-c2n[nH]cc2C(=O)N2CCc3c(nc(C)nc3N(C)C)C2)c1 72173750 WROGHPHTPNBKPX-UHFFFAOYSA-N 376.464 2.748 0 50 GFAA CCN1CCN(Cc2cccc(Oc3ccccc3)c2)[C@H]2CS(=O)(=O)C[C@H]21 77376083 DXIVMZBVNQUSMW-RTWAWAEBSA-N 386.517 2.782 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@]2(CCC(=O)N(Cc3ccncc3)C2)C1 91255113 RFKNRDCXBGXKLR-NRFANRHFSA-N 382.464 2.731 0 50 GFAA O=C(NCCSc1ncn[nH]1)c1cc(-c2ccncc2)nc2ccccc12 95357759 UGSHIYQFVQKVRM-UHFFFAOYSA-N 376.445 2.937 0 50 GFAA Cc1nn(CC(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)c(C)c1C 95363589 DAOMNLDHTXXQPR-AZUAARDMSA-N 380.492 2.572 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2ccccc2N(C)C)C1 95530902 UDGDXVXIBIQJQJ-SFHVURJKSA-N 383.540 2.921 0 50 GFAA CCc1nc(N2CCC(c3nnc(Cn4cccn4)n3CC)CC2)ncc1C 96166423 XJPPCTQITVJQSD-UHFFFAOYSA-N 380.500 2.588 0 50 GFAA O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1cnc2sccn2c1=O 121728215 JNCZFWYULSETTL-PWSUYJOCSA-N 395.362 2.941 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)NCCN2c3ccccc3C[C@@H]2C)ccc1F 121809260 PCGAINBHODWNKK-ZDUSSCGKSA-N 391.468 2.514 0 50 GFAA O=C1CCC(=O)N(c2ccc(C(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)N1 126304745 HZWQLQWXNUGHHW-KRWDZBQOSA-N 377.444 2.549 0 50 GFAA COc1ccc(NC(=O)CCc2nc(C3CCCC3)no2)cc1-n1nnnc1C 135451074 SQCFIXRJJZBQDL-UHFFFAOYSA-N 397.439 2.591 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CCNC2)cc1S(=O)(=O)Nc1cccc(Cl)c1 150689307 MNZOHVHQONUPJG-ZDUSSCGKSA-N 393.896 2.997 0 50 GFAA COc1ccnc(N2CCN([C@H]3CCCN(c4ccccc4F)C3=O)CC2)c1 156804516 GOLRNRRWBQDNAT-IBGZPJMESA-N 384.455 2.547 0 50 GFAA Cc1cccc(OCC(=O)N2CCC3(CC2)NC(=O)N(c2ccc(F)cc2)N3)c1 169764149 ZPVMJHOAKCGRLA-UHFFFAOYSA-N 398.438 2.566 0 50 GFAA CC1(C)COCCN1CCNS(=O)(=O)Cc1ccc(Cl)c(Cl)c1 171760586 JAFQRNPYTSZRFN-UHFFFAOYSA-N 381.325 2.524 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)c1cccc(OCC(F)(F)F)n1 172390378 UWAFRQMJHREECO-UHFFFAOYSA-N 393.365 2.732 0 50 GFAA COc1ccc(S(=O)(=O)N(CCO)[C@@H]2CCc3ccccc32)c(C)c1F 181695595 NQVHKNPCKRCXTK-MRXNPFEDSA-N 379.453 2.813 0 50 GFAA C[C@@H](NCc1ccc(Br)cc1N1CCOCC1)c1nccn1C 183355831 YVXUWFJIGSTGEU-CYBMUJFWSA-N 379.302 2.870 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CCCN(c4ccccc4)CC3)ccc2N1 194213289 ZROQMZNGTLGHLT-UHFFFAOYSA-N 399.516 2.862 0 50 GFAA CN1CCC2(CCC1=O)CCN(C(=O)c1ccc(SCCO)cc1)CC2 219534028 JPDLNIKQJBVGIG-UHFFFAOYSA-N 376.522 2.636 0 50 GFAA Cc1c(C(=O)NC[C@@H]2CCCNC2)nnn1-c1ccc(-c2ccccc2)cc1 237805202 WWBDRHBNZYIYMB-QGZVFWFLSA-N 375.476 2.972 0 50 GFAA COC(=O)C[C@H](c1cc(OC)c2c(c1)OCO2)c1oc2ccccc2c(=O)c1O 253399926 DLLBXQDCBXWOEV-CYBMUJFWSA-N 398.367 2.931 0 50 GFAA biogenic CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCCN(c3cccnn3)CC2)ncn1 275700887 NMUVZWAVWGEZBA-LAUBAEHRSA-N 397.527 2.599 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3ccc(-n4ncc5ccccc54)cc3)C[C@@H]21 284779352 LJSDEPXZPZUMTR-LEWJYISDSA-N 391.475 2.962 0 50 GFAA C[C@H]1CC[C@@H](C(=O)N[C@H]2CC(C)(C)C[C@](C)(CNC(=O)[C@H]3CC[C@@H](C)O3)C2)O1 333615443 XLMYPUIANFGQKC-ZNGWZVJISA-N 394.556 2.939 0 50 GFAA COc1ccc([C@H]2CCNC[C@@H]2NC(=O)N2CCOC3(CCCCC3)C2)cc1 333730372 VZNSLLARKNZYHZ-UXHICEINSA-N 387.524 2.885 0 50 GFAA O=C(Cn1ccc(C(F)(F)F)n1)N1CCO[C@H](c2ccc(F)cc2F)C1 375285156 AKMDGXWQALYWSL-ZDUSSCGKSA-N 375.297 2.780 0 50 GFAA COc1cc2nc(CN3CCC(c4c[nH]nc4C)CC3)nc(O)c2cc1OC 375349996 RPOUAXXMICIELT-UHFFFAOYSA-N 383.452 2.764 0 50 GFAA CC(C)N1CC[C@H](CNC(=O)N2CCN(Cc3ccc(F)c(F)c3)CC2)C1 426571664 SBJYFVLDJPAXEZ-QGZVFWFLSA-N 380.483 2.522 0 50 GFAA O=C(O)Cn1ccc([C@H]2CCCN(Cc3ccc(Cn4cccn4)cc3)C2)n1 426689833 HEVDMCFGEIIXBY-IBGZPJMESA-N 379.464 2.592 0 50 GFAA COC(=O)c1csc(S(=O)(=O)N(C)[C@@H](C)[C@@H]2Cc3ccccc3O2)c1 433486138 JXUPXOVEWQVEHO-NHYWBVRUSA-N 381.475 2.547 0 50 GFAA O=C(Nc1cccc(-c2ncco2)c1)N1CC[C@@H](Nc2ccc3nccn3n2)C1 434553945 ASFOBYILKZKEAN-MRXNPFEDSA-N 389.419 3.103 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2cn(C)nc2C(F)(F)F)c(C)c1C(=O)O 463433402 XCBMUFFZNYPIPK-UHFFFAOYSA-N 377.344 2.555 0 50 GFAA Cc1nc2ccc(CC(=O)N[C@H]3CCCN(Cc4cccc(O)c4)C3)cc2[nH]1 827849442 GSCPDDDVPSRDDN-SFHVURJKSA-N 378.476 2.900 0 50 GFAA CC[C@H]1c2cc(F)c(F)cc2CCN1C(=O)c1nnn([C@H]2CCNC2)c1C 888101953 RIURSXWLIADHBL-GUYCJALGSA-N 375.423 2.549 0 50 GFAA Cc1nc(C(=O)N2CCC(N3CCN(Cc4ccccc4)CC3)CC2)cs1 952969415 JHTVYXNYCVQSJM-UHFFFAOYSA-N 384.549 2.874 0 50 GFAA CC1(C)CC[C@H](CNC(=O)c2cccc(-n3[nH]nnc3=N)c2)c2ccccc21 1295123407 HSUFDUIHNLOCAD-OAHLLOKOSA-N 376.464 2.660 0 50 GFAA COc1ccc(F)cc1[C@@H](C(=O)O)N(C)Cc1nc(O)c2sccc2n1 1506395399 HODKBBNSDFUUSH-AWEZNQCLSA-N 377.397 2.802 0 50 GFAA Cc1c(NC(=O)CN2CCC(c3cc(Cc4ccccc4)[nH]n3)CC2)cnn1C 1506398156 HLAYGAWORARUOE-UHFFFAOYSA-N 392.507 2.861 0 50 GFAA Cc1noc([C@H]2CCCN2S(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n1 1506408865 MWXWTUCUGJLJTL-CYBMUJFWSA-N 393.494 2.972 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC(N3CCSCC3)CC2)c(Cl)cc1F 1506415388 NMBJRLSAZIKKFK-UHFFFAOYSA-N 392.949 2.989 0 50 GFAA O=C(CN1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccc1)C2)NCc1ccccc1 1565517150 GPTLFXHCSMRIET-FPOVZHCZSA-N 377.488 2.539 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(N4CCCC4)c(Cl)c3)C[C@@H]2O)n[nH]1 1704279981 BZJXTBVDWBJVKD-BEFAXECRSA-N 388.899 2.647 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCCC[C@H]1CCc1cccc(O)c1 1857685305 HMZXQNHJASBHCR-KRWDZBQOSA-N 385.464 2.844 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)O)C2(CCN(C(=O)C3CC=CC3)CC2)C1 1857686919 IARAPKNNNBBQHE-LJQANCHMSA-N 398.503 2.787 0 50 GFAA Cc1ccc(CN2CCOC3(CCN(c4ccnc(C)n4)CC3)CC2=O)cc1 1857689404 PCZIMMNSADOWKG-UHFFFAOYSA-N 380.492 2.882 0 50 GFAA COC(=O)c1cncc(N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)n1 1857700538 WCJRIOGMXQAPAH-SJLPKXTDSA-N 383.448 2.515 0 50 GFAA O=C(CCc1ccccc1Cl)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857715660 BTKDLHHUOWPSCQ-HGIWEUDGSA-N 385.891 2.868 0 50 GFAA Cc1nc2nc(C)c(NC(=O)[C@@H]3CCCc4c3[nH]c3ccccc43)c(=O)n2[nH]1 1875250911 BDISVPZYXSJJMN-CQSZACIVSA-N 376.420 2.574 0 50 GFAA Cc1cc(C)nc(-n2nc(C(=O)Nc3ncnc4[nH]c(C)c(C)c34)cc2C)n1 1875258906 CXWXEAXHBFENPA-UHFFFAOYSA-N 376.424 2.728 0 50 GFAA CN[C@H](Cc1ccccc1)C(=O)N1CCC2(CC1)C[C@H](N)c1ccccc1O2 1875276707 ROOBXCKYCKLHOK-VQTJNVASSA-N 379.504 2.661 0 50 GFAA CCOc1ccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)cc1 1875396854 GAVODONUICIDLM-GOSISDBHSA-N 397.523 2.562 0 50 GFAA Cn1cc(CNC(=O)N2CC[C@H](C3CC3)[C@@H]2c2nc(O)n[nH]2)c2ccccc21 1875402220 CIRKKDUYYSQKRY-NVXWUHKLSA-N 380.452 2.685 0 50 GFAA CC[C@@H](C)CC(=O)N1CCc2c(ncn2C)[C@@]12CCN(C(=O)Cc1ccco1)C2 2325776823 CKJRZMPXXSWKHW-ZHRRBRCNSA-N 398.507 2.504 0 50 GFAA Cc1ccn(C)c1C(=O)N1C[C@@H]2CN(C(=O)C[C@H]3CC[C@@H](C4CC4)O3)C[C@]2(C)C1 2325794695 NPTMGSUIPFQUNO-QPXQOZNCSA-N 399.535 2.602 0 50 GFAA CN1CCN(C(=O)NCc2cn3cccc(F)c3n2)C[C@@H]1Cc1ccccc1 2325857060 NRIALIKDHGAKOU-SFHVURJKSA-N 381.455 2.542 0 50 GFAA O=C(O)CCN1C(=O)c2ccc(NC(=O)CSCc3ccccc3)cc2C1=O 1075000 UTBHRZWDSSOXPW-UHFFFAOYSA-N 398.440 2.629 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CCc2nc(-c3ccccc3)nn2CC1 2356140471 KFRIDKIRGJIOPX-UHFFFAOYSA-N 386.459 2.839 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356161500 XWLJODDLJIKCQV-JOCHJYFZSA-N 394.475 2.542 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2Cc2ccc(OCC(N)=O)c(Cl)c2)C1=O 2356168584 JYFKEIVPKCGPOU-FQEVSTJZSA-N 393.915 2.570 0 50 GFAA O=C(Nc1cccc(OCC(F)F)n1)N[C@@H](CO)Cc1c[nH]c2ccccc12 133822888 WIRGZKXTWAVACE-CYBMUJFWSA-N 390.390 2.932 0 50 GFAA CC[C@@H](C(=O)N1CCN(c2ccccc2)CC1)n1cnc2ccccc2c1=O 9422104 UVQYGHVZDMYCTN-FQEVSTJZSA-N 376.460 2.696 0 50 GFAA COc1ccccc1[C@@H](C)N(C)C(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 55358393 KIRZHWNZOVDCQV-CQSZACIVSA-N 376.478 2.793 0 50 GFAA Cc1csc(NC(=O)C[C@@H]2NC(=O)N(Cc3ccccc3Cl)C2=O)n1 170625571 UUYYBRBUUIJPLI-LBPRGKRZSA-N 378.841 2.554 0 50 GFAA CC1CCN(C(=O)C2CCN([C@H](C)c3nc4ccccc4c(=O)[nH]3)CC2)CC1 172174512 MUDOTAFGCJXUHU-MRXNPFEDSA-N 382.508 2.955 0 50 GFAA CCOc1ccnc(N2CCN(Cc3ccc(-c4ccccn4)nc3)CC2)n1 425391917 FOAOLANBIVGMEG-UHFFFAOYSA-N 376.464 2.655 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N(C)Cc2cnc3ccccn23)[nH]n1 67894019 ZLTGLADZMKSOQD-UHFFFAOYSA-N 377.452 2.698 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)CC1 39489797 ZGYMLCPHDOXHEO-LJQANCHMSA-N 381.511 2.706 0 50 GFAA Cc1ccn([C@@H](C)C(=O)Nn2c(C)nc3sc4c(c3c2=O)CC[C@@H](C)C4)n1 2778075 NNVRSXKIALPPSB-PWSUYJOCSA-N 385.493 2.727 0 50 GFAA COc1ccc(C2=NO[C@H](C(=O)N3CCN(c4ccccc4OC)CC3)C2)cc1 4904157 JYDGFASODPDZDY-NRFANRHFSA-N 395.459 2.546 0 50 GFAA Cn1cc(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c(-c2ccoc2)n1 363754403 UCLYSYNPIACKAI-SFHVURJKSA-N 378.476 2.975 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(c3ccc(C(=O)O)cn3)C2)cc1OC 72430554 ZDQIOFPMYBXOQZ-SFHVURJKSA-N 399.491 2.940 0 50 GFAA O=C(Nc1ccc(NS(=O)(=O)NCc2ccccc2)cc1)c1cccnc1 72144268 UIOPUVFIKADKSB-UHFFFAOYSA-N 382.445 2.780 0 50 GFAA O=C([C@H]1COCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 72421319 BHTSIADYLHFGFK-OAQYLSRUSA-N 381.472 2.577 0 50 GFAA Cc1nc(N2CCOCC2)ncc1-c1cc(=O)[nH]c(Nc2ccc(Cl)cc2)n1 39383604 XZEKSYLGBHAKFX-UHFFFAOYSA-N 398.854 2.769 0 50 GFAA Cc1oc(C(=O)N2CCC[C@H]2[C@@H]2CCCc3ccccc32)cc1S(N)(=O)=O 370394720 LXDCLZBPJWYJRE-SJORKVTESA-N 388.489 2.960 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@H]3CCN(C(=O)C4CCCCC4)C3)[nH]n2)cc1 126934547 GIMLLFDCRKELTK-KRWDZBQOSA-N 396.491 2.996 0 50 GFAA CCCCN1C[C@@]2(CCCN(C(=O)c3cnc(SC)nc3)C2)CCC1=O 77391486 LVQJWACLKKBUIW-LJQANCHMSA-N 376.526 2.843 0 50 GFAA Cc1nc(Cn2cc(C(=O)N3c4ccccc4[C@]4(C)CCCC[C@H]34)nn2)no1 375925707 YDKSUIYAXMDEJP-PXNSSMCTSA-N 378.436 2.879 0 50 GFAA CSCC[C@@H](O)C(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 72432244 HINXJKZDKNJKRQ-CQSZACIVSA-N 377.428 2.629 0 50 GFAA Cc1ccccc1-c1nc(C(=O)N2C[C@@H](C)[C@H](C(=O)N3CCOCC3)C2)cs1 284566454 JXTVDMHKQCQTAI-NVXWUHKLSA-N 399.516 2.685 0 50 GFAA Cc1nc(CN2CCN(C(=O)c3cccc(-c4c(C)noc4C)c3)CC2)no1 426445634 PODJVUCJKFXTDT-UHFFFAOYSA-N 381.436 2.608 0 50 GFAA Cc1ccc(C)c(-n2nc(-c3ccncc3)nc2C[C@@H]2CN(C)CCN2C)c1 96153193 WJYXYLVGOFVFNY-LJQANCHMSA-N 376.508 2.734 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)c1cccc([C@@H]2CCCNC2)c1 95379697 BFTHZRGLTKKVEV-QGZVFWFLSA-N 385.895 2.967 0 50 GFAA CCCN1CCC[C@@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1=O 92002808 HQLWSTZUGLOCQH-QFIPXVFZSA-N 380.492 2.796 0 50 GFAA Cc1ccc(OCCCN(C)C(=O)[C@H]2CCCN(C(=O)N(C)C)C2)c(C)c1 95363917 DRMMHEOOOKUESZ-SFHVURJKSA-N 375.513 2.924 0 50 GFAA Cc1ccncc1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95358343 IOJMUUDXFKHZJJ-VLCRHTCISA-N 391.471 2.821 0 50 GFAA COCCN1C[C@@]2(CCCN(Cc3nnc(-c4ccccc4)o3)C2)CCC1=O 91780954 KOCYPBOWBAXBMQ-NRFANRHFSA-N 384.480 2.588 0 50 GFAA CC(C)(C)c1ccc(C(C)(C)C)c(NC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2O)c1 96149988 QUTHKUOKDMMOIL-HZPDHXFCSA-N 382.526 2.561 0 50 GFAA O=C(COc1ccc2ccccc2c1)N1C[C@H](CO)[C@H](CN2CCCCC2)C1 91933060 CUTSRVOKPGOADC-NHCUHLMSSA-N 382.504 2.771 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCc1c(C)noc1C 263586699 WZWNTSUHHBJKEQ-AZUAARDMSA-N 377.529 2.964 0 50 GFAA biogenic COc1ccc([C@H]2Cn3nnc(C(=O)NCc4ccc(C)cc4)c3CO2)cc1 263619011 WMMZQTNTJSBHGL-LJQANCHMSA-N 378.432 2.797 0 50 GFAA CCc1cc(-c2ccc(C(=O)NCCCn3ccccc3=O)cc2)nc(C)n1 534593365 URRRVYVNZWFESH-UHFFFAOYSA-N 376.460 2.996 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3cc(-c4ccc(F)cc4)no3)C2)n[nH]1 584885923 IVVVZCHVXJJXON-CQSZACIVSA-N 384.415 2.996 0 50 GFAA N[C@@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)[C@H]2COC[C@H]12 1875292857 VEGLWVOYGPDNQH-KFWWJZLASA-N 397.422 2.556 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(c4cncc5ccccc45)CC3)n[nH]c21 1875395482 YNSWPMGCLDICBZ-CABCVRRESA-N 391.475 2.943 0 50 GFAA CC(C)Cc1cc(C(=O)NC2CCC(NC(=O)C3SCCS3)CC2)no1 1875347133 IFWXWEUYPRJWQP-UHFFFAOYSA-N 397.566 2.836 0 50 GFAA COC(=O)[C@H]1CCCC[C@@]1(C)NCC(=O)NC(=O)Nc1cc(C)ccc1C 1875308933 JBQGNHSWHXGREP-FOIQADDNSA-N 375.469 2.663 0 50 GFAA Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)N[C@@H]1CC[C@H]2C[C@H]2CC1 1875328384 PAMAOZBFSXBYBM-ZSHCYNCHSA-N 379.526 2.508 0 50 GFAA Cc1ncsc1CCN(C)S(=O)(=O)c1ccc(-c2n[nH]c(C)c2C)o1 952985065 AWUIGYRDIHPAMK-UHFFFAOYSA-N 380.495 2.915 0 50 GFAA COc1cc(C)ccc1S(=O)(=O)N1CCC[C@H](OCc2ccccn2)C1 952977680 OPASRDLPSAYRHX-KRWDZBQOSA-N 376.478 2.769 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1cccc(F)c1)c1ccc(-n2ccnc2)cc1 1565529781 DQRKJJRRKSBCBP-PMACEKPBSA-N 381.407 2.978 0 50 GFAA Cn1cc(NC(=O)NC2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)cn1 185963222 VIXXXGBKKODNAK-UHFFFAOYSA-N 395.385 2.865 0 50 GFAA Cc1nnc(S)n1CCNC(=O)[C@@H]1C[C@@H]1c1ccccc1Br 170644556 SKPPOGJKLLWESJ-VXGBXAGGSA-N 381.299 2.558 0 50 GFAA Cc1nc2n(n1)C[C@H](NC(=O)Nc1cccc(NC(=O)c3ccccc3)c1)CC2 170751827 CVYJQQJNYMQUFC-GOSISDBHSA-N 390.447 2.975 0 50 GFAA CC(C)C(=O)N1CCC(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)CC1 187418348 SWFNDXQUXKOWQQ-UHFFFAOYSA-N 390.499 2.616 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 191051559 GDOAEKXKLXIJBG-AWEZNQCLSA-N 379.766 2.879 0 50 GFAA FC(F)(F)c1nnc(N2CCN([C@H]3CCN(c4ccccc4)C3)CC2)s1 1506399146 ZHEOMMJUOYBATN-AWEZNQCLSA-N 383.443 2.958 0 50 GFAA CN(Cc1cnn(-c2ccc(F)cc2)c1)C(=O)c1ccc2c(=O)n(C)cnc2c1 1506397151 ZRXPPXNVVAVEIO-UHFFFAOYSA-N 391.406 2.531 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529189803 YQUUXFDZKSSGRK-IFMALSPDSA-N 379.460 2.696 0 50 GFAA O=C(c1csc2ccccc12)N1C[C@H]2COC[C@@H](C1)CN2Cc1cnc[nH]1 1704311954 GWGGIGKRWXKRNR-ZBFHGGJFSA-N 382.489 2.597 0 50 GFAA Cc1nn(C)cc1CN(C)Cc1ccc(OC[C@@H](O)CN2CCCCC2)cc1 11717379 XALRFSKCLBLDEK-NRFANRHFSA-N 386.540 2.586 0 50 GFAA COCCN[C@@H]1CCc2c(sc3ncn(C4Cc5ccccc5C4)c(=O)c23)C1 12218580 RBLTUPLNUZAZPW-MRXNPFEDSA-N 395.528 2.891 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2)CCCN(S(=O)(=O)c2cccnc2)C1 12434503 BPXUFWHUDKJJSA-HXUWFJFHSA-N 388.489 2.658 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OCC)[C@H]1c1ccc(SC)cc1 13153473 LYAQGMNUNZHKRV-CLWJZODNSA-N 394.489 2.575 0 50 GFAA O=C1[C@H]2CCCN2C(=O)[C@@H]2C[C@H](NCc3sc4ccccc4c3Cl)CN12 14540211 CJVMEQKHKZMKLQ-YUTCNCBUSA-N 389.908 2.618 0 50 GFAA O=C1CCC(CCC(=O)N2CCO[C@H](Cc3cccc4ccccc34)C2)=NN1 14947992 VZRHIURFNBKBAY-LJQANCHMSA-N 379.460 2.656 0 50 GFAA O=C(c1ccc(Oc2ccccc2)cc1)[C@H]1CCCN(C(=O)Cn2cnnn2)C1 14980524 BTBHLYASMJGIPJ-KRWDZBQOSA-N 391.431 2.587 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)NC(C)C)C3)C2=O)c1 15080255 IFOQDNIYQVLUEQ-FQEVSTJZSA-N 377.460 2.767 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1cn(C(=O)OCc2ccccc2)cn1)C(=O)O 15721343 NKTFPUKOHGSCSS-HNNXBMFYSA-N 389.408 2.588 0 50 GFAA COc1cccc(C[C@@]2(CO)CCCN(C(=O)c3[nH]nc4c3CCCC4)C2)c1 19745225 CTXGBSNGNHGFJN-QFIPXVFZSA-N 383.492 2.755 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCN1CCOCC1)c1cc2ccccc2o1 19897335 HHWJROSOLRMNRF-UHFFFAOYSA-N 393.443 2.747 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CC[C@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778243 RIEGFISLAQJHOV-LBPRGKRZSA-N 386.362 2.571 0 50 GFAA CCn1ncc(C(=O)N2CCC3(CC2)OCCc2cc(C(=O)O)sc23)c1C 1857707657 XTGQYDYPMJRYMV-UHFFFAOYSA-N 389.477 2.675 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N(C)CCCN(C)C)C3)nc2c1 1857727460 SHKXVQSBDRVMFI-MRXNPFEDSA-N 388.512 2.853 0 50 GFAA COc1cccc(OCc2nc([C@H]3C[C@@H](N)[C@H](O)C3)n(-c3ccccc3F)n2)c1 1857736516 KFEYMYCXIWSVIO-BOFPYLFWSA-N 398.438 2.560 0 50 GFAA c1cc(N2CCN3[C@@H](C4CC4)COC[C@H]3C2)cc(-c2ccc3c(c2)OCO3)n1 1875245706 NCUJSEPMOGFXOH-UYAOXDASSA-N 379.460 2.777 0 50 GFAA O=C(C1CCN(c2cnccn2)CC1)N1CCC(Oc2ccc(F)cc2)CC1 115220849 JDHLHJQMXBVDEV-UHFFFAOYSA-N 384.455 2.902 0 50 GFAA CNC[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)c(Cl)c2)C1 237208998 WWNSAIQMFCKKGV-JTQLQIEISA-N 381.723 2.723 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@@H]2CC[C@H]1CN(c1cnc3ccccc3n1)C2 252018960 XEABCVYLPVQTEV-CVEARBPZSA-N 377.448 2.862 0 50 GFAA COc1ccc(C)cc1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 1704328974 QJDKKPZLXRQTQA-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA CC(=O)[C@@H]1C[C@H](C(=O)NS(=O)(=O)Cc2cc(F)ccc2Cl)C1(C)C 851168583 DLLHQEQHBJAZAF-QWHCGFSZSA-N 375.849 2.676 0 50 GFAA O=C(OCCc1ccc2c(c1)CCO2)[C@H]1CCCCN1C(=O)c1cccnc1 2325740420 RGJNRVYLPRFBPR-LJQANCHMSA-N 380.444 2.797 0 50 GFAA COc1ccc(NC(=O)CSc2nnc([C@H](O)c3ccccc3)n2C)cc1 1141060 GYCDPFBZJPHNGL-QGZVFWFLSA-N 384.461 2.636 0 50 GFAA COc1ccc2nc(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)sc2c1 1196527 SIASPUHPEIMAHC-UHFFFAOYSA-N 391.474 2.808 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)[C@H]3CCCC[C@H]3C(=O)O)sc2c1 2503178 SUINWZINFPLMBA-WDEREUQCSA-N 382.463 2.529 0 50 GFAA O=C(O)CN1CCC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1=O 2545947 WGBORFZFCVWACO-IBGZPJMESA-N 394.427 2.601 0 50 GFAA CCCCNS(=O)(=O)c1ccc(OCC(=O)Nc2ccccc2F)cc1 4840065 KDFVECRBQWGYHY-UHFFFAOYSA-N 380.441 2.922 0 50 GFAA O=C(O)c1cccc(OCc2nnnn2-c2ccc(Br)cc2)c1 6759068 YAFPDJOYMYMCTQ-UHFFFAOYSA-N 375.182 2.702 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c(OC)c1 7708626 WJAJNVRRRFGECR-UHFFFAOYSA-N 376.434 2.631 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)c3ccsc3)C2)cc1 12297981 QGFPGDJAJXTHSQ-AWEZNQCLSA-N 394.518 2.587 0 50 GFAA O=C(c1nc2sccn2c1CN1CCC[C@H]1CO)N1CCCCCCC1 12302203 BVWMIERNPJPNQC-HNNXBMFYSA-N 376.526 2.759 0 50 GFAA O=C(c1ccc(Oc2ccccc2)cc1)[C@@H]1CCCN(C(=O)Cn2cnnn2)C1 14980520 BTBHLYASMJGIPJ-QGZVFWFLSA-N 391.431 2.587 0 50 GFAA Cc1ccc(CN2CCc3nnc(CCNC(=O)c4ccco4)n3CC2)cc1C 19791480 CCASBZVTIIDJBU-UHFFFAOYSA-N 393.491 2.519 0 50 GFAA CCc1ccc(C(=O)Nc2ccccc2C(=O)NCCCN2CCOCC2)cc1 19897324 JFTPARZTLKZTLP-UHFFFAOYSA-N 395.503 2.953 0 50 GFAA COc1ccc(CCC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 20149573 IUWVTCOZIMYRAD-UHFFFAOYSA-N 382.460 2.701 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccc(OC)c(C)c3)[C@@H](CCO)C2)CC1 23372928 IPFMAMAKPUOSHG-QFIPXVFZSA-N 389.584 2.747 0 50 GFAA COc1cc(-c2nn3c(CN4CCCCC4)nnc3s2)cc(OC)c1OC 40285050 GOOGDMQMYZYXFW-UHFFFAOYSA-N 389.481 2.865 0 50 GFAA Cc1ccc(C(N)=O)c(N2CCC(n3cc(-c4cc(F)cc(F)c4)nn3)CC2)n1 55153223 JSWVARZAMPTSBK-UHFFFAOYSA-N 398.417 2.867 0 50 GFAA Cc1nc(C)c2c(n1)O[C@H](CN1CCc3[nH]nc(-c4ccccc4F)c3C1)C2 67817173 BMVGYBURIZDDJQ-AWEZNQCLSA-N 379.439 2.984 0 50 GFAA COCCOCC(=O)N1CCOc2c(O)cc(-c3ccc(C)s3)cc2C1 67878623 YILPRPRGZDSXDJ-UHFFFAOYSA-N 377.462 2.813 0 50 GFAA Cc1cnn(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)c1 72134735 ZXCXDJNMHLBREZ-LJQANCHMSA-N 386.471 2.616 0 50 GFAA COc1ccccc1CN1C[C@@H](c2nc(CC3CCN(C)CC3)no2)CCC1=O 91586623 GVPCZBHFJOPHOE-SFHVURJKSA-N 398.507 2.869 0 50 GFAA O=C(Nc1ccccc1F)c1cccc(S(=O)(=O)N[C@H]2CCCOC2)c1 95390816 TVEPAOYYIVQVQH-AWEZNQCLSA-N 378.425 2.535 0 50 GFAA Cc1cc(NC(=O)N2CCNC(=O)[C@H]2Cc2ccccc2)n(C2CCCC2)n1 96166873 DRAXXVRTZMJSNV-GOSISDBHSA-N 381.480 2.882 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](Nc3ccc(N(C)C)cc3)C2=O)cc1 101129385 QLFYKASLGYRDGE-GOSISDBHSA-N 381.432 2.673 0 50 GFAA C[C@@H]1C(=O)[C@H](C(=O)Nc2nc3ccccc3s2)C(=O)N1Cc1ccccc1 122035448 VTCDJGWJYSNJOQ-MLGOLLRUSA-N 379.441 2.851 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@@H](c1ccccc1)[C@H]1CCCO1 170680078 FIKKBHRRTJQLKI-MOPGFXCFSA-N 377.448 2.987 0 50 GFAA Cc1csc([C@H]2CN(C(=O)NCc3cccc(Cn4ccnc4)c3)CCO2)n1 194066787 XUKIBRAJVFZJQG-GOSISDBHSA-N 397.504 2.979 0 50 GFAA COC(=O)CC1(NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)CCCC1 225403818 MGVGKWXZGZOPPN-UHFFFAOYSA-N 387.263 2.715 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1C(=O)NCc1nc(-c2cccc(F)c2)no1 225612764 MTIXCCUXFODOCZ-UHFFFAOYSA-N 389.408 2.518 0 50 GFAA COc1ccccc1[C@@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)[C@@H]2C3CCN(CC3)[C@H]12 240662408 PKTQFPPHXQPTIX-DSMZAQLRSA-N 384.520 2.635 0 50 GFAA CC(=O)N1CCc2c(ncn(Cc3ccc(Br)cc3Cl)c2=O)C1 275472808 HVUXFZSLGWPVFS-UHFFFAOYSA-N 396.672 2.612 0 50 GFAA Cn1nnc2c1C[C@H](C(=O)N1CCN(Cc3ccccc3)c3ccccc31)CC2 291649234 GWGJTNAKJNDOBM-GOSISDBHSA-N 387.487 2.973 0 50 GFAA CCC(=O)NC[C@@H](C)Oc1ccc(CN2CCN(Cc3cccnc3)CC2)cc1 299793017 HTLMNZHCTJSUIB-LJQANCHMSA-N 396.535 2.693 0 50 GFAA COc1cccc(N2CCN(C(=O)c3nnn(CC4CCCC4)c3C)CC2)c1 329889003 ZPIQEYPWFPIECF-UHFFFAOYSA-N 383.496 2.748 0 50 GFAA O=C(c1c[nH]nc1[C@H]1CCOC1)N1CCC(c2nc(-c3ccccc3)no2)CC1 364538807 FQAXFLGGBSLTJJ-INIZCTEOSA-N 393.447 2.983 0 50 GFAA C[C@H]1CN(C(=O)CCC(C)(C)C(=O)N2C[C@H](C)OC(C)(C)C2)CC(C)(C)O1 408355211 QZOGXLUSRQICCQ-HOTGVXAUSA-N 382.545 2.845 0 50 GFAA COc1cccc(C(=O)NCc2ccc3c(c2)nc(C)n3C)c1OCCCN 426410511 MCANHKIHBLWDJL-UHFFFAOYSA-N 382.464 2.548 0 50 GFAA O=C1CN(C(=O)N[C@H]2COC3(CCCCC3)C2)CCN1CCc1ccccc1 426701648 QXHMLKUHDKNUBK-LJQANCHMSA-N 385.508 2.575 0 50 GFAA Cc1cccnc1C(F)(F)C(=O)N1CCC[C@H](CNC(=O)CC(F)(F)F)C1 804201809 HCJUWXUDPGRFAF-GFCCVEGCSA-N 393.356 2.789 0 50 GFAA O=C(Nc1nc(C(F)(F)F)c(I)s1)[C@@H]1CCCO1 864097619 ZIRWEWIQKARUOA-BYPYZUCNSA-N 392.140 2.884 0 50 GFAA Cn1cc(CN2CCC(CNC(=O)Cc3ccc(F)cc3Cl)CC2)cn1 1506414436 PUDXWHVCIBHQCG-UHFFFAOYSA-N 378.879 2.784 0 50 GFAA CN(C)Cc1ccc([C@H]2CCCN2c2ncc(F)c(N3CCOCC3)n2)cc1 1529098890 OGBKKMZNRGBPOQ-LJQANCHMSA-N 385.487 2.855 0 50 GFAA CC(C)Nc1ncc(CN2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)cn1 1529191453 YYSZYDFJKISIEO-WIYYLYMNSA-N 377.492 2.881 0 50 GFAA COc1ccccc1CN1CCCN(C(=O)COc2ccccc2OC)CC1 1772816052 FRKSASZPHCFOTA-UHFFFAOYSA-N 384.476 2.817 0 50 GFAA CC1(C)CNC(=O)C2(CCN(Cc3ccc(-c4ccccn4)cc3)CC2)NC1 1772819929 XXQAIISVIQMCIL-UHFFFAOYSA-N 378.520 2.829 0 50 GFAA O=C([C@H]1CCOC1)N1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 1775981850 XDLQTEMPPMOBPA-NSHDSACASA-N 377.794 2.829 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1C 1857675120 LIWGPTOIAOCCKC-QFIPXVFZSA-N 395.459 2.724 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)C1(CCN(C[C@H]3CCOC3)CC1)OCC2 1857699400 SVNVOOJKCLROAY-OAHLLOKOSA-N 390.549 2.931 0 50 GFAA O=C(Cc1ccc(O)c(Cl)c1)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857715796 ISKZIKYQIUZJCJ-FUHIMQAGSA-N 386.879 2.919 0 50 GFAA CN(C)CCCOc1ccc(CN2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)cc1 1857728199 RJOLEFARIQUNJA-WBADGQHESA-N 387.568 2.558 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)Nc3ccc4c(c3)OCO4)C1)CC2 1875245457 APEGKXNGNNIHIP-HXUWFJFHSA-N 382.420 2.731 0 50 GFAA Cc1cc(S(=O)(=O)N2C[C@H](C(C)(C)C)O[C@H](c3ccccc3)C2)n(C)n1 1875248913 XVQZHBSFVLKACZ-DLBZAZTESA-N 377.510 2.905 0 50 GFAA O=C1C[C@@H](c2ccccc2)S(=O)(=O)N1C[C@H]1OC(=O)C2(CCC2)C12CCC2 1875392095 RVUBXBIFMGFOAJ-JKSUJKDBSA-N 389.473 2.556 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2ccc(Cn3cccn3)cc2)C1=O 2100555125 MJGPYIGZRILTFA-QFIPXVFZSA-N 382.508 2.535 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)CC1)c1nn(Cc2ccccc2)c2ncccc12 2100556451 NWCZZZQKUCDKLU-IYBDPMFKSA-N 378.432 2.853 0 50 GFAA COc1ccc(CCNC(=O)Cn2cc(-c3ccc(C)cc3)nn2)cc1OC 2325776552 YCHUGVFEWLMZEW-UHFFFAOYSA-N 380.448 2.630 0 50 GFAA OCC1(CO)CCC(NCc2cc(Cl)ccc2OC[C@H]2CCCO2)CC1 2325805892 BSKUXPOUXZXHJP-GOSISDBHSA-N 383.916 2.901 0 50 GFAA O=C([C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42)N1CCC[C@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 2325826690 JSMMIBWSEBKMQS-QPNCCFFBSA-N 380.532 2.630 0 50 GFAA Cc1cc2c(cn1)CN(C(=O)[C@H]1C[C@H]3CCCN3[C@]13C(=O)Nc1ccccc13)C2 2356134612 UNGDCWAQNBEXFC-BOCKYXSRSA-N 388.471 2.564 0 50 GFAA COc1ccc(-c2onc(N[C@@H]3CCCOC34CCNCC4)c2C(=O)O)cc1 2356136427 UNJXTSVJFIESOO-OAHLLOKOSA-N 387.436 2.762 0 50 GFAA CCn1c(CNC(C)=O)nnc1SCC(=O)c1ccc(Br)cc1 1140871 PKDRJWQRDQYOPT-UHFFFAOYSA-N 397.298 2.672 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCCCC1)c1cccc(Br)c1 1173989 YJGCVGRZPALBKS-UHFFFAOYSA-N 389.315 2.618 0 50 GFAA Nc1nc(SCC(=O)NCc2ccccn2)nc2sc3c(c12)CCCC3 4139870 FRDFTSZKGIIFSF-UHFFFAOYSA-N 385.518 2.956 0 50 GFAA CCOC(=O)c1ccccc1N1C(=O)C[C@@H](Sc2ccccc2C(=O)O)C1=O 4263616 XBIPEYVODPDJRT-MRXNPFEDSA-N 399.424 2.986 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCCC2)cc1I 4826261 DFPMIMJYDHBNCK-UHFFFAOYSA-N 395.262 2.865 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cc(Cl)ccc2OC)cc1 4866147 JVBLZIOSHRASJY-LLVKDONJSA-N 398.868 2.663 0 50 GFAA O=C(C1CCN(S(=O)(=O)c2cccs2)CC1)N1CCc2ccccc21 6375382 NSPPTZFPBPPDSV-UHFFFAOYSA-N 376.503 2.738 0 50 GFAA CCNc1nc(NCC)nc(OCCNC(=O)Nc2ccc(Cl)cc2)n1 6745500 OVJPDTWVTYRQBV-UHFFFAOYSA-N 379.852 2.589 0 50 GFAA COc1ccccc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 10755553 NZBQVTCGYHVXEH-ZDUSSCGKSA-N 380.491 2.796 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2)c1C 11821415 BZDWMBUIYSEKGA-QGZVFWFLSA-N 384.480 2.598 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)NCCCc2ccccn2)CCC1=O 12307433 AZKAEJHIRXJQKC-GOSISDBHSA-N 381.476 2.578 0 50 GFAA COCCN1CCC(CN(C[C@@H]2CCCO2)C(=O)Cc2ccsc2)CC1 12718937 IKUWICYMJBLGBB-IBGZPJMESA-N 380.554 2.657 0 50 GFAA O=C1NCCN(Cc2ccc(-c3ccccc3)cc2)[C@H]1CC(=O)N1CCCC1 12752710 YMWBQMJVMGZJNB-NRFANRHFSA-N 377.488 2.667 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(-n3cccn3)c2)n1 14957778 ITIABPXFKKFYDC-LJQANCHMSA-N 375.432 2.819 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@H]2CCC(=O)N(Cc3ccc(OC)cc3)CC2)C1 14990485 NBRMQKUOBROMCV-MOPGFXCFSA-N 388.508 2.851 0 50 GFAA CN(C(=O)CSc1nc(O)cc(=O)n1-c1ccccc1F)c1ccccc1 16361344 NMGDRYAVBAHIJM-UHFFFAOYSA-N 385.420 2.832 0 50 GFAA C[C@H](c1ccco1)N(C)C(=O)Cn1ncc(N(C)Cc2ccccc2)cc1=O 20149199 XLGMTFCGGPPQTL-MRXNPFEDSA-N 380.448 2.692 0 50 GFAA CC(C)(O)c1cn(CC2CCN([C@H]3CCN(c4ccc(F)cc4)C3)CC2)nn1 20601441 VCHNMDYYZNRVGL-IBGZPJMESA-N 387.503 2.636 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3ccccn3)C[C@H]2CCO)o1 36385812 HEUMVCNLGNXQON-LJQANCHMSA-N 380.492 2.843 0 50 GFAA COc1cc2c(cc1CN1C[C@H]3[C@@H](C1)OC(=O)N3Cc1ccccn1)CCC2 55255781 BRWKXOJNXJDWDB-PZJWPPBQSA-N 379.460 2.784 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(C(=O)C3CCCC3)CC2)C1 71736478 JRFRNRKGBWNRCY-LJQANCHMSA-N 398.551 2.591 0 50 GFAA Cc1ccsc1-c1cc(C(=O)O)cc(S(=O)(=O)NC[C@H]2CCCO2)c1 71751836 NSDRWBURZQRKMR-CQSZACIVSA-N 381.475 2.879 0 50 GFAA CN(Cc1nc(-c2cccs2)no1)C(=O)c1ccc(CN2CCOCC2)cc1 72436811 DLIYYXDMXMMLOC-UHFFFAOYSA-N 398.488 2.903 0 50 GFAA CCC(=O)c1ccc(OCC(=O)N2CCN(c3ccc(C)cc3)C(=O)C2)cc1 82098019 NSCOMGPDVPSCIJ-UHFFFAOYSA-N 380.444 2.842 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(S(=O)(=O)C3CC3)CC2=O)cc1 91254425 ZFRDBEUUNPYHEY-IBGZPJMESA-N 384.501 2.747 0 50 GFAA COc1cccc(C(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)c1OC 92078430 NRPKUOUPDBLQQT-UHFFFAOYSA-N 381.432 2.743 0 50 GFAA COc1cccc(C(=O)N2CCC[C@@H](c3nccn3CCCN(C)C)C2)c1O 95391467 LAWVMWJBIRRLBO-MRXNPFEDSA-N 386.496 2.569 0 50 GFAA COc1cc(CN(C)C2CCSCC2)ccc1OC[C@H](O)CN1CCCC1 95504020 BUADFYDOYUCOPI-LJQANCHMSA-N 394.581 2.858 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)N1CCCC[C@H]1c1ccc(F)cc1 95518968 HDCGRHWAFQSWMY-IBGZPJMESA-N 384.455 2.736 0 50 GFAA Cn1cccc1C(=O)N1CCC(c2nnc(CN3CCCCCC3)n2C)CC1 96149108 ZRGQETFTUIMTQA-UHFFFAOYSA-N 384.528 2.549 0 50 GFAA CO[C@@H]1CCCOC12CCN(C(=O)COCc1nc3ccc(C)cc3[nH]1)CC2 97600904 AGZHDYABYDHDFQ-GOSISDBHSA-N 387.480 2.575 0 50 GFAA Cc1ccc([C@H](NC(=O)c2[nH]nc3c2CN(C)CC3)c2cccnc2)c(C)c1 97655593 WPQPQPYSZWRHDS-HXUWFJFHSA-N 375.476 2.929 0 50 GFAA O=C(Nc1ccc(-n2ncc3c(=O)[nH]cnc32)cc1)c1cnn(-c2ccccc2)c1 119837164 GERIDLVWBPCKQP-UHFFFAOYSA-N 397.398 2.547 0 50 GFAA C[C@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCC[C@H](CN2CCCCCC2)C1 155160839 HQQBAJRRFDSIRT-RTBURBONSA-N 398.551 2.948 0 50 GFAA N[C@@H]1CCCN(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)C1 157824910 DRTGVXNMAHHYAW-RQWLHQTBSA-N 387.487 2.956 0 50 GFAA CC1(C)CN(C(=O)c2cccnc2N2CCOCC2)CCN1Cc1ccccc1 170901766 XAWFUKVVKIFGDL-UHFFFAOYSA-N 394.519 2.655 0 50 GFAA CN1C(=O)CC[C@H](C(=O)NCCc2ccc3c(c2)OCCO3)[C@@H]1c1ccccc1 171985705 IKDPWPQBEGQURO-AVRDEDQJSA-N 394.471 2.726 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NC[C@@H](O)c1ccccc1 192770866 ZEJNRRSWNVLZRV-RBUKOAKNSA-N 382.460 2.540 0 50 GFAA O=C(NCC[C@@H]1CCCO1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 237944799 QXTUUXRLCJMILC-ZDUSSCGKSA-N 397.353 2.888 0 50 GFAA COc1cncc([C@H](NC(=O)CCc2nc3cc(F)ccc3[nH]2)[C@H]2C[C@@H](O)C2)c1 244874325 WZLHCCQNHVHKQW-PYDTXJQDSA-N 398.438 2.667 0 50 GFAA COc1ccc(CN2C(=O)O[C@H]3CN(Cc4cccc(C)n4)C[C@H]32)cc1OC 247886438 SVRSPWXEUPFOFW-XLIONFOSSA-N 383.448 2.612 0 50 GFAA COCc1nc(NCc2nc(-c3ccccc3F)no2)cc([C@H]2C[C@H](N)C2)n1 252568981 VSKPLKBWPPTSGJ-HAQNSBGRSA-N 384.415 2.629 0 50 GFAA C[C@H](Nc1nc(-c2cccnc2)nc2c1CCC2)c1cccc(S(N)(=O)=O)c1 263906430 HCYAICUAGWGPMQ-ZDUSSCGKSA-N 395.488 2.848 0 50 GFAA NC(=O)COc1cccc(NC(=O)[C@H]2CCCCN2Cc2ccc(F)cc2)c1 266968933 QWUVYJUUXDGXHW-LJQANCHMSA-N 385.439 2.683 0 50 GFAA Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccc(S(N)(=O)=O)o1 285825897 WNMGCYRWVBSXPL-UHFFFAOYSA-N 377.466 2.868 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCC4(c5ccc(F)cc5)CCOCC4)[C@@H]1[C@H]3C2 287235916 QVTATTUQASVVQN-OBNKQFAMSA-N 388.483 2.939 0 50 GFAA O=C(NCc1csc(Br)c1)[C@H]1CC[C@H](C(F)(F)F)NC1=O 298471269 PZSIHCBQKCPRQD-HTQZYQBOSA-N 385.205 2.584 0 50 GFAA C[C@H]1CCc2sc(C(=O)N3CCn4c(nnc4-c4cnn(C)c4)C3)cc2C1 370954977 HRZRUVPMCQUASZ-LBPRGKRZSA-N 382.493 2.521 0 50 GFAA O=S(=O)(c1ccc(Br)o1)N1CCO[C@]2(CCc3ccccc32)C1 408213867 IYSPPTMORKZELG-MRXNPFEDSA-N 398.278 2.905 0 50 GFAA Cc1sc2nc(CCNC(=O)N(C)Cc3nccs3)nc(O)c2c1C 426438996 RNKBHVMVWLUSES-UHFFFAOYSA-N 377.495 2.854 0 50 GFAA COc1cc(CN2CC[C@@H](Nc3ncncc3Br)C2)cc(OC)c1 481961243 YGQYRMXCXWATQR-CYBMUJFWSA-N 393.285 2.943 0 50 GFAA CCn1cc(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCCCCC2)cn1 670462518 XEKKHJRVEBOQNP-IBGZPJMESA-N 376.526 2.799 0 50 GFAA Cc1c(C(=O)NC[C@H]2CCCN(Cc3ccc(Cl)o3)C2)cnc2ccnn12 825566726 JCDKIMWMOABORD-CQSZACIVSA-N 387.871 2.926 0 50 GFAA O=C(OCCOCCO)[C@@H](NCC(F)(F)F)c1cc(Cl)cc(Cl)c1 888096772 LXZFQYKAENAFNU-LBPRGKRZSA-N 390.185 2.739 0 50 GFAA O=C(N[C@H]1CCN(c2cnnc(O)c2Cl)C1)c1cc(C(F)F)ccc1F 890992799 CRTDBBAOTMFLSQ-VIFPVBQESA-N 386.761 2.921 0 50 GFAA O=C1CNC(=O)c2ccc(C(=O)N3C[C@H]4CCCC[C@]43c3ccccc3)cc2N1 1347679929 JVUYHPINHXZXCD-HXOBKFHXSA-N 389.455 2.910 0 50 GFAA Cc1ccn2c(NC(=O)[C@@H]3CC(=O)N(c4ccc(C(C)C)cc4)C3)nnc2n1 1529186667 JRIAPLYJVLETEK-OAHLLOKOSA-N 378.436 2.548 0 50 GFAA Cc1nc(CCNC(=O)[C@@]2(Cc3ccccc3)C[C@H]3CC[C@@H]2N3)nc2c1CCC2 1704310539 ZZFNNNYGQRMQKM-ZHRMCQFGSA-N 390.531 2.686 0 50 GFAA CCN1CC[C@@H](NC(=O)c2c(NCCOC)noc2-c2ccc(Cl)cc2)C1 1704313928 SMZJYNSLGKKXPX-OAHLLOKOSA-N 392.887 2.877 0 50 GFAA CCN(C)S(=O)(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704336776 OULFNPSIPFTKGF-HXUWFJFHSA-N 386.521 2.620 0 50 GFAA COc1cc(-c2onc(N(C)CC3CCN(C)CC3)c2C(=O)O)ccc1F 1772700715 DQTPNFOEPGJPEM-UHFFFAOYSA-N 377.416 2.966 0 50 GFAA Cc1ccc(N2CCC(N3CCC4(CC3)NCC(C)(C)CNC4=O)CC2)cc1 1772815248 MVJOCIUZTDKYRP-UHFFFAOYSA-N 384.568 2.544 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(Cc3cc(=O)n4cc(Cl)ccc4n3)CC2)O1 1857699962 GIGRQOZCKWWRRK-SJORKVTESA-N 391.899 2.632 0 50 GFAA COCc1noc(CN2CCC(C3CCN(Cc4cc(C)no4)CC3)CC2)n1 1857715749 GFSGWSDXLRGGKQ-UHFFFAOYSA-N 389.500 2.637 0 50 GFAA C[C@H](O)c1cn(CC(=O)N[C@@H](CCc2ccccc2)c2cccc(F)c2)nn1 1875312961 LCQGGFGBSVBXOX-KXBFYZLASA-N 382.439 2.961 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)c1c[nH]nc1[C@@H]1CCCNC1)CC3 1875315217 LMWXWLVQQGWFBP-HUUCEWRRSA-N 377.492 2.954 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CCc3c(cc(F)cc3C(=O)OC)C2)cc1 1875370749 BWDDLRVXEBRWPC-UHFFFAOYSA-N 382.391 2.935 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C4CCCC4)cc2O3)nn1C 1875394634 PXLSFUCHSMQGEY-QGZVFWFLSA-N 399.495 2.531 0 50 GFAA Cc1ccc(C2(C(=O)N[C@@H]3C[C@@H](Cn4ccnc4)C[C@H]3O)CCOCC2)cc1C 1875402248 DBSKQPHWJJGNCD-HMXCVIKNSA-N 397.519 2.504 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)N3CCc4ccccc4CC3)CC2=O)s1 2100543697 XIKGUWVQKMHUKN-INIZCTEOSA-N 384.505 2.642 0 50 GFAA O=C([C@@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC[C@H](N2CCCC2)CC1 2325807662 KZDXGUFIXMNDIS-AZUAARDMSA-N 394.523 2.764 0 50 GFAA O=C(CCCOc1ccccc1)N1CCc2nc(-c3cccnc3)nn2CC1 2356135010 MHMBPAFQAPWCAD-UHFFFAOYSA-N 377.448 2.584 0 50 GFAA CC(=O)c1cccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1 2857675 CFDWEAMXVKQKAJ-NSHDSACASA-N 380.853 2.848 0 50 GFAA Cc1csc(NC(=O)CSc2nnc(-c3ccc4c(c3)OCO4)n2C)n1 9303995 MXBLNARGRIIPJH-UHFFFAOYSA-N 389.462 2.707 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cn(Cc2ccccc2Cl)nn1 12314476 VZLQUVWDEHUYCI-SFHVURJKSA-N 395.894 2.984 0 50 GFAA Cn1cc(CNCc2c(C(=O)N3CCCCCCC3)nc3sccn23)cn1 12431996 QVGBMTATDJPGCZ-UHFFFAOYSA-N 386.525 2.825 0 50 GFAA COc1ccc2cc(C(=O)[C@H]3CCCN(C(=O)CN4CCOC4=O)C3)ccc2c1 12458530 UMZLKQDNYXKLHM-SFHVURJKSA-N 396.443 2.722 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@@H](NCCOC(C)C)C2 14540525 ZVXLFFFDYKEPCI-QGZVFWFLSA-N 388.512 2.640 0 50 GFAA CN(C(=O)CCN1CCCCC1=O)[C@H]1CCCN(CCCc2ccccc2)C1 14969117 FDRQIDVQMPZQJB-NRFANRHFSA-N 385.552 2.945 0 50 GFAA CCCNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)ccc1OC 16648377 XAUAXUFJOLHMEH-UHFFFAOYSA-N 378.450 2.644 0 50 GFAA COc1cc(CNCCN2CCOCC2)cc(Cl)c1OCc1cccnc1 19200297 KQYPDPMMMFMJOQ-UHFFFAOYSA-N 391.899 2.744 0 50 GFAA Cc1cc(C)c(OC[C@H](O)CN2CCN(C(=O)c3ccccc3)CC2)c(C)c1 20481679 LVOFHPSRXLEMJE-OAQYLSRUSA-N 382.504 2.810 0 50 GFAA NCCc1cc(=O)[nH]c(-c2ccc(CN3CCC[C@@H](C(F)(F)F)C3)cc2)n1 39489982 DFKOXSIKDWDMKN-OAHLLOKOSA-N 380.414 2.712 0 50 GFAA COc1ccc2c(C)c(C(=O)Nc3c(C)nn(CC(=O)O)c3C)oc2c1OC 55120468 RRXGBQYUZLKJAY-UHFFFAOYSA-N 387.392 2.909 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CC[C@@H](c3ccc4c(c3)OCO4)[C@H](O)C2)c1C 65433930 QSFWUAUBVWWZHJ-JKSUJKDBSA-N 384.432 2.553 0 50 GFAA CN(Cc1cccc(C(=O)Nc2cn(C)nn2)c1)C[C@H]1Cc2ccccc2O1 67934592 QFBNCTXMDVZOIN-GOSISDBHSA-N 377.448 2.503 0 50 GFAA CCCc1nc(C(=O)N[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)cs1 72122467 VZSHWYUULDCWAL-HNNXBMFYSA-N 375.469 2.808 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)CN(CCC(C)C)C(=O)O3)c(O)c1 77504722 XEGRFSZJMYSRAG-UHFFFAOYSA-N 376.453 2.874 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)C2(Oc3ccc(Cl)cc3)CCNCC2)[nH]n1 77505140 JZKDXYACLJNVIZ-CYBMUJFWSA-N 376.888 2.620 0 50 GFAA O=C(c1ccc2nccnc2c1)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 91914543 VCNXMCXCKQCZBF-WMLDXEAASA-N 379.489 2.823 0 50 GFAA COCCN1CCC[C@]2(CCN(c3ccc(-c4ccc(F)cc4)nn3)C2)C1=O 95382438 KHZWPOAEJHALMV-OAQYLSRUSA-N 384.455 2.748 0 50 GFAA N[C@@H]1CCN(C(=O)c2ccc(OC3CCN(CCc4ccccc4)CC3)cc2)C1 95529679 RCEKYCXINYXKIS-OAQYLSRUSA-N 393.531 2.946 0 50 GFAA O=C1C[C@@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c1ccccc1 100366705 SIRNIAHSLIDDIC-TYOLEZHBSA-N 375.472 2.650 0 50 GFAA CNC(=O)[C@H]1CCCN(C(=O)c2nn(-c3ccccc3)cc2OCC(C)C)C1 110989064 UAHMGPYQMDIVSC-INIZCTEOSA-N 384.480 2.505 0 50 GFAA O=C(c1ccccc1)N1CCCN(C(=O)C2CCN(CC(F)(F)F)CC2)CC1 121945508 ZCELIMBHZNGTLA-UHFFFAOYSA-N 397.441 2.635 0 50 GFAA CC[C@@H](Cc1ccccc1Br)C(=O)NCc1nnc(S)n1C 134312599 QCHPNDDCYCITLB-JTQLQIEISA-N 383.315 2.751 0 50 GFAA Cc1cc(Br)cc2cc(C(=O)NCCCN3C(=O)CCC3=O)oc12 156186054 RNPFHMQELWYBKB-UHFFFAOYSA-N 393.237 2.773 0 50 GFAA Cn1cc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c(C(F)(F)F)n1 156298989 ZIHHGNNSEVUJGF-CQSZACIVSA-N 394.397 2.608 0 50 GFAA CS(=O)(=O)N1CCC(CNC(=O)Nc2cccnc2-c2ccccc2)CC1 179461150 MUDGZJFBEZHZGU-UHFFFAOYSA-N 388.493 2.542 0 50 GFAA CO[C@H]1C[C@H](c2nc(C)no2)N(C(=O)Nc2cnn(-c3ccccc3)c2C)C1 189454274 FPKODMQHGULBMK-DOTOQJQBSA-N 382.424 2.866 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NC3(C(=O)NCC4CC4)CCCC3)c2O1 192640156 KQVJGHLUFMLOOG-UHFFFAOYSA-N 392.521 2.517 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@@H](C)CC(O)C[C@@H]1C)c1ccc2c(c1)OCCCO2 230149045 PQESKIOZKOMVCP-WCJKSRRJSA-N 390.524 2.895 0 50 GFAA Cc1nn(-c2ccccn2)c(C)c1CC(=O)NC[C@H]1CCCN2CCCC[C@@H]12 230209280 BIYBBESDDGXOLM-QUCCMNQESA-N 381.524 2.807 0 50 GFAA biogenic O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C(=O)CCc2ccc(C(=O)O)cc2)C1 262680878 ZQXWMGONSLOXEW-SFHVURJKSA-N 399.422 2.879 0 50 GFAA COC(=O)c1cn(C[C@@H](c2ccco2)N2CCCCCC2)cc2c(=O)[nH]nc1-2 263587636 JKLUUPDXRMOWNE-INIZCTEOSA-N 384.436 2.673 0 50 GFAA CCOc1cccc(CN[C@H]2CNC(=O)c3cc(-c4cccc(OC)c4)nn32)c1 263617284 NBJAVYSHQPQUBL-OAQYLSRUSA-N 392.459 2.989 0 50 GFAA Cc1cccn2c(=O)cc(CN3CCC[C@@H]3c3nc4c(n3C)CCCC4)nc12 275898034 IFHQRQMDMNBBDF-LJQANCHMSA-N 377.492 2.952 0 50 GFAA Cc1nn(C)c(=O)c(-c2nc(CN3C[C@H](CO)c4ccccc43)cs2)c1C 292624132 IAIXTLSUEYTVIT-CQSZACIVSA-N 382.489 2.617 0 50 GFAA COc1ccc2c(c1)O[C@H](C)CN(CCC(=O)NCc1ccc3c(c1)OCO3)C2 299770780 RCXRBYYQNKLHKZ-OAHLLOKOSA-N 398.459 2.713 0 50 GFAA C[C@H]1CC[C@@H](C(=O)N[C@@H]2CC(C)(C)C[C@@](C)(CNC(=O)[C@H]3CC[C@@H](C)O3)C2)O1 333615442 XLMYPUIANFGQKC-SIABOQNXSA-N 394.556 2.939 0 50 GFAA O=C(NCCN1CCOCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1 378549038 DTFVAIDPKQLWAO-SFHVURJKSA-N 399.495 2.696 0 50 GFAA CN1C[C@H](NC(=O)c2ccc(-c3ncccc3C(F)(F)F)cc2)C[C@H]1CO 426652941 NEEMYNIVUNJQSQ-CABCVRRESA-N 379.382 2.562 0 50 GFAA O=c1c2c(-c3ccccc3Cl)csc2ncn1C[C@@H]1CCNC[C@H]1O 670455286 OBITUDUIPZZQJQ-XHDPSFHLSA-N 375.881 2.749 0 50 GFAA Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@H]2CCC[C@H](C(=O)O)C2)C1 888095921 FIBXZAOTTICNBT-JYJNAYRXSA-N 379.526 2.623 0 50 GFAA O=C(CN1CCC(c2nccc(-c3ccc(F)cc3)n2)CC1)NCC(F)F 952894243 XXHNIRFWXIGVJG-UHFFFAOYSA-N 378.398 2.843 0 50 GFAA CN(C[C@@H]1CCN(c2ccccc2)C1)C(=O)CCn1cnc2ccccc2c1=O 952962351 ASDXLIOVTGBSQD-SFHVURJKSA-N 390.487 2.772 0 50 GFAA O=C(NCC1CCN(C(=O)CCc2cn[nH]c2)CC1)c1ccc(F)cc1Cl 952966777 WYKHDOMMFVOUQS-UHFFFAOYSA-N 392.862 2.803 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCN(c2ccncc2)CC1 1506404767 AEOUKEVMNHPDKA-UHFFFAOYSA-N 395.912 2.953 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2c(F)cccc2OC)cc1OC 1529111978 DOQIARBNIHQVPR-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA CCSc1ncc(CN2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)cn1 1565509651 YJFMDBWRNIYDKC-YJBOKZPZSA-N 383.521 2.720 0 50 GFAA CCOCCn1cc(C(=O)N2CCCCC[C@H](NC(=O)C[C@H](C)CC)C2)cn1 1775990475 BFBVKKLSUCKOBZ-MJGOQNOKSA-N 392.544 2.857 0 50 GFAA O=C(c1ccncc1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857696929 RFANSWKCXHOHOS-JOCHJYFZSA-N 387.443 2.759 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)CC1 1857720091 DJOQFCRUMYXZTM-VQTJNVASSA-N 385.508 2.759 0 50 GFAA CCCCS(=O)(=O)N1CCC(NC(=O)c2cc3c(F)c(F)ccc3[nH]2)CC1 1875299879 YXHJACILZPZVKA-UHFFFAOYSA-N 399.463 2.770 0 50 GFAA CC(C)c1nnsc1C(=O)N(C)C1CC(NC(=O)c2cc3ccccn3c2)C1 1875303271 KCMLKNZEBQCBIL-UHFFFAOYSA-N 397.504 2.947 0 50 GFAA CC(C)n1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)Cc1c[nH]c2cnccc12 1875401146 GWNOVGUYJBKYJG-LPHOPBHVSA-N 394.479 2.983 0 50 GFAA O=S(=O)(Nc1ccccc1-c1nc(N2CCCC2)n[nH]1)c1cccs1 2325750381 VJTFVLLECFYTAJ-UHFFFAOYSA-N 375.479 2.934 0 50 GFAA C[C@H]1NCCn2c(C(=O)Nc3ccc(-c4n[nH]c5c4COCC5)cc3)ccc21 2325774959 KXFSJZCNRJPIBT-CYBMUJFWSA-N 377.448 2.867 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCCc3oc(Br)cc3C2)C1 2325889150 BOTRCQABEPHDLK-GFCCVEGCSA-N 381.270 2.742 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc(C)c1O 2356142111 FGAKYGGISXBEJD-JOCHJYFZSA-N 380.492 2.985 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(Cc2cc(=O)c3cc(F)ccc3[nH]2)CC[C@H]1O 2356157484 MWXOVCLNUFAGQO-TZIWHRDSSA-N 390.455 2.741 0 50 GFAA O=C(N1CCCCC1)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 1126068 QQNIDUJMHDFWDK-UHFFFAOYSA-N 387.505 2.752 0 50 GFAA Cc1n[nH]c(C)c1N1C(=O)c2cccc3c(N4CCOCC4)ccc(c23)C1=O 2970564 JBYCKDFHMYZNLQ-UHFFFAOYSA-N 376.416 2.817 0 50 GFAA CCN(CC)C[C@H](O)CN(c1cccc(C)c1)S(=O)(=O)c1ccccc1 2988317 JCSYGSKTMQRGLF-IBGZPJMESA-N 376.522 2.893 0 50 GFAA COc1cc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)cccc32)cc(OC)c1OC 4776120 XVORIIURXCETGO-IBGZPJMESA-N 391.807 2.779 0 50 GFAA CCOC(=O)c1c(C)c(C(=O)N2CCN(c3ccc(F)cc3)CC2)c(C)n1C 4909804 ASPVHUZEHPIOGR-UHFFFAOYSA-N 387.455 2.920 0 50 GFAA COc1ccccc1OCC(=O)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 11934241 RLAPADOTDQHEMU-KRWDZBQOSA-N 398.459 2.948 0 50 GFAA O=C1NCCN(Cc2ccccc2)[C@H]1CC(=O)N(Cc1ccccc1)CC1CC1 11934847 QPVWXXGMVKEXMC-QFIPXVFZSA-N 391.515 2.816 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CC[C@@H](N(C)C)C3)no2)c(Cl)c1 12752446 YLEGGPYKMNXKCJ-GFCCVEGCSA-N 379.844 2.692 0 50 GFAA CN(C)C(=O)c1nn(CC2CCCCC2)c2c1C[C@@H](NCc1ccon1)CC2 14538348 PYTDIMLGWOAXSR-INIZCTEOSA-N 385.512 2.800 0 50 GFAA Cc1n[nH]c(C)c1CCNC(=O)CCc1nnc(CCCc2ccccc2)o1 20235038 FRNSXGBCQYVMFI-UHFFFAOYSA-N 381.480 2.876 0 50 GFAA CCn1nc(NC(=O)Cn2nnc(-c3c(F)cccc3F)n2)c2ccccc21 20236211 DWTITSPNUVBTPE-UHFFFAOYSA-N 383.362 2.627 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)Cc3cnc4ccccn34)n2)cc1 20913247 PTWHYZUFJHLDAV-UHFFFAOYSA-N 377.404 2.803 0 50 GFAA O=C(Cc1cccnc1)N1CCC[C@H](N2CCN(c3ccccc3F)CC2)C1 55198542 ZTUBWVPSACWMSM-IBGZPJMESA-N 382.483 2.576 0 50 GFAA O=C1O[C@@H]2CN(Cc3cccc4c3OCO4)C[C@@H]2N1CCc1ccc(F)cc1 63846027 DJPDCXRSJRNJLV-PKOBYXMFSA-N 384.407 2.802 0 50 GFAA CO[C@@H](C(=O)Nc1ccnn1C1CCN(c2ncccn2)CC1)c1ccccc1 67784671 KQFMFPJVAAKHIF-LJQANCHMSA-N 392.463 2.841 0 50 GFAA O=C(O)[C@H]1C[C@@H](C(=O)N2CCCC2)CN(C(=O)CCCCc2ccccc2)C1 72147261 XATQJFCRGWGSET-MOPGFXCFSA-N 386.492 2.571 0 50 GFAA O=C(O)c1cccc(CC2CCN(S(=O)(=O)N3CCCCCC3)CC2)c1 72156369 CIYJATBPVGCJJC-UHFFFAOYSA-N 380.510 2.760 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC([C@@H](O)Cc2ccccc2)CC1 82087621 ATLVWRKPKZROOF-FQEVSTJZSA-N 379.460 2.980 0 50 GFAA COc1ccccc1-n1cc(C(=O)NC[C@H]2Cc3ccccc3CN2C)cn1 91662964 BHXCTGXNPMPOAB-LJQANCHMSA-N 376.460 2.667 0 50 GFAA CN(C[C@H]1CCCCO1)C(=O)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91746004 RDAJUIMYQUGJCF-GOWZHPGHSA-N 385.508 2.879 0 50 GFAA CCOc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)cc1 91986788 OVKIFDOABWSDKN-QFBILLFUSA-N 379.460 2.857 0 50 GFAA O=C(c1c[nH]c(=O)c(Cl)c1)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 95385215 RJYYPPVMVNWKOP-QXAKKESOSA-N 383.879 2.731 0 50 GFAA CCCN1CCc2nc[nH]c2C12CCN(C(=O)c1n[nH]c3ccccc13)CC2 95528905 IXMDPYLNNBGBEK-UHFFFAOYSA-N 378.480 2.686 0 50 GFAA Cn1c(CN2CCCC2)nnc1C1CCN(Cc2ccc3c(c2)OCO3)CC1 96141609 JQVLJKRGKAPHCT-UHFFFAOYSA-N 383.496 2.519 0 50 GFAA CCN(C(=O)Nc1ccc(Oc2cccnc2)cc1)[C@H]1CCS(=O)(=O)C1 96148938 UNWZWAYUYMUWMM-HNNXBMFYSA-N 375.450 2.915 0 50 GFAA CCc1noc([C@H](C)N2CCN(c3cc(C)nc(-c4ccncc4)n3)CC2)n1 112080494 NBUGRSFZTZOFRQ-HNNXBMFYSA-N 379.468 2.676 0 50 GFAA CS(=O)(=O)N[C@H]1CCN(C(=O)c2cc(-c3ccccc3)ccc2Cl)C1 116834856 OTKSDLQXHVUTCB-HNNXBMFYSA-N 378.881 2.771 0 50 GFAA COc1ccnc(N2CCN(C(=O)NCC(C)(C)Cc3ccccc3)CC2)n1 117411035 JLPYJCHCPRMEPA-UHFFFAOYSA-N 383.496 2.586 0 50 GFAA COc1ccccc1S(=O)(=O)NC1(c2ccc(F)cc2F)CCOCC1 121467018 UZIKRWMBHHLKPH-UHFFFAOYSA-N 383.416 2.958 0 50 GFAA CC[C@H](C)c1ccccc1OCC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 186647173 YBYIHXVYPNEJGI-IRXDYDNUSA-N 376.497 2.976 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N3CCn4nc([C@@H](O)C5CC5)cc4C3)cc2)n1 222810408 RZAAPQMMQOWYPZ-NRFANRHFSA-N 391.475 2.785 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@@H](C)[C@H]3CCOC3)cc2)c(C)c1CCC(=O)O 237481803 ISRIKHAUGJGJAT-GUYCJALGSA-N 385.464 2.661 0 50 GFAA CC(=O)N1c2ccccc2C(CN2CCN(c3ncccn3)CC2)=CC1(C)C 253495951 XFXRBFDBUOBXJJ-UHFFFAOYSA-N 377.492 2.827 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)CC1 278905918 RULZIOPBAGYSTE-INIZCTEOSA-N 398.511 2.673 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N(CC(=O)O)Cc1ccccc1 299740901 CBYLCPZOPJXTDE-HXUWFJFHSA-N 380.444 2.636 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC([C@@H](O)c3ccccn3)CC2)cc1 299793030 IRWUHXVCOUMBCA-LJQANCHMSA-N 382.464 2.809 0 50 GFAA O=C1CO[C@@H](COc2ccc(F)cc2)CN1C1CCN(CC2CCC2)CC1 299799435 SFSAZOCCGFLGBS-HXUWFJFHSA-N 376.472 2.696 0 50 GFAA CCOc1ccc(CN2CCN(c3ccc4nnc(C5CC5)n4n3)CC2)cc1 301143068 DBQDBQHETUUGNF-UHFFFAOYSA-N 378.480 2.723 0 50 GFAA COc1ccc2oc(CNC[C@@H]3CC(=O)N(C)[C@H]3c3cnn(C)c3C)cc2c1 328628565 NWMUWFWJGDFBRG-YCRPNKLZSA-N 382.464 2.793 0 50 GFAA Cc1cc(=N/C(O)=C2/N=NC3=C2CCCCC3)n([C@@H]2CCS(=O)(=O)C2)[nH]1 334159379 NCFOPCPPQGSQNZ-NOHARLLRSA-N 377.470 2.796 0 50 GFAA O=C(c1ccccc1)N1CC[C@@H](Cn2cnc3c(cnn3-c3ccccc3)c2=O)C1 374545046 VGYSFQQVSQCRAP-QGZVFWFLSA-N 399.454 2.745 0 50 GFAA Cc1cc(F)c(Br)cc1NC(=O)C(=O)N1CC[C@H]([C@@H]2CCOC2)C1 377001524 PXJAZVCUZMGHMR-NWDGAFQWSA-N 399.260 2.720 0 50 GFAA CN(C)c1nc(-c2cccc(CN3CCOCC3)c2)nn1Cc1ccccc1 426726701 FGPIWBYWXHWAQK-UHFFFAOYSA-N 377.492 2.892 0 50 GFAA Cn1nc(-c2ccccc2)c2c(NC(=O)C[C@H](O)Cc3ccccc3)[nH]nc21 486458302 HWWFTEZGVNELIN-MRXNPFEDSA-N 375.432 2.896 0 50 GFAA Cc1ccccc1[C@@H](C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1)N(C)C 823652601 JVCLOQQAWOVZHU-QFIPXVFZSA-N 395.503 2.671 0 50 GFAA Cc1cc(C(=O)NCC2CCN(Cc3ccnn3-c3ccccc3)CC2)no1 825307302 JEFKWCJUYBERCD-UHFFFAOYSA-N 379.464 2.811 0 50 GFAA O=C1CCNC(=O)N1c1cccc(NC(=O)C2(c3cccnc3)CCCC2)c1 885716270 VFQREFYFKTZJHG-UHFFFAOYSA-N 378.432 2.978 0 50 GFAA O=C(Cc1ccc(NC(=O)c2csc(-c3ncccn3)n2)cc1)NC1CC1 952969791 OUMZQTJIJMTWKA-UHFFFAOYSA-N 379.445 2.674 0 50 GFAA Cn1cc([C@@H]2[C@@H](CNC(=O)C3(C(C)(F)F)CC3)CC(=O)N2C(C)(C)C)cn1 1331196425 NGXVZFPHPULUCL-DOMZBBRYSA-N 382.455 2.660 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@H]2CC(=O)N(c3ccccc3Cl)C2)nc(O)n1 1506406788 OOEJLLRECZQQGM-ZDUSSCGKSA-N 388.855 2.569 0 50 GFAA COc1cc(C(=O)N(C)[C@@H]2C[C@@H]3C[C@H](N(C)C)C[C@@H]3C2)cc(OC)c1OC 1529101143 AMTNKXIDOKQGDS-MDBPOYHNSA-N 376.497 2.903 0 50 GFAA Cc1nc(CC(C)C)cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)C2CCC2)C3)n1 1565527031 LVNCOBRGOZTJNA-APWZRJJASA-N 384.524 2.847 0 50 GFAA CC(C)Cc1noc(CNC(=O)C[C@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857701622 RNQPCVGUSRQRHY-CQSZACIVSA-N 398.467 2.727 0 50 GFAA O=C1C[C@H]2N(Cc3cccc(OCc4ccccn4)c3)CC[C@]23OCCCN13 1857732751 FFQSLUBFNBTOCA-IRLDBZIGSA-N 379.460 2.584 0 50 GFAA N=c1[nH]c(=N)[nH]c(=N[C@H](Cc2ccc(F)cc2)c2cc(Cl)cc(Cl)c2)[nH]1 1875303283 KTJYYCJGJKIMIJ-CQSZACIVSA-N 393.253 2.960 0 50 GFAA CC(=O)N1C[C@@H]2CCC[C@H](NC(=O)c3cc(C(F)(F)F)nn3C3CC3)[C@H]2C1 1875311228 QVBACEYKSSYMSE-UBHSHLNASA-N 384.402 2.614 0 50 GFAA CN(C[C@H]1COc2ccccc2O1)c1ncnc2ccc(N3CCOCC3)cc12 1875332627 BJYYQDUEVTVSFN-KRWDZBQOSA-N 392.459 2.743 0 50 GFAA C=CC(=O)NCCC[C@@H]1[C@H](C)CCCN1C(=O)Cc1ccc2c(cnn2C)c1 1875386273 MCIXONNVEBNHKD-VQIMIIECSA-N 382.508 2.825 0 50 GFAA Cc1nc(C(C)C)[nH]c(=N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)c1Br 1875398819 FVDNOGWAHKALJP-BFHYXJOUSA-N 394.317 2.541 0 50 GFAA COc1cc(CN2C[C@H](CC(=O)NC3(C)CC3)OCC23CCC3)cc2nc[nH]c12 2325785316 PODDPYMMEWSXNT-INIZCTEOSA-N 398.507 2.754 0 50 GFAA CCN=c1ncc(CN2CCC[C@]23CCCN(c2ccc(C)cc2)C3=O)c[nH]1 2356136239 LYIABXDEJQNYFX-JOCHJYFZSA-N 379.508 2.800 0 50 GFAA CC(C)(C)c1ccc(C(=O)NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1 675522 PXVGHIKLKYYWIQ-UHFFFAOYSA-N 391.518 2.758 0 50 GFAA CCOC(=O)c1c(NC(=O)Cn2c(=O)oc3ccccc32)oc(C)c1C(C)=O 2867158 HAMMRZLIIDMURF-UHFFFAOYSA-N 386.360 2.514 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N(c1ccc(F)cc1)[C@@H]1C=CS(=O)(=O)C1 4035865 REVNDIPZASWKHG-OAHLLOKOSA-N 375.377 2.512 0 50 GFAA CCN(CC)CCCNC(=O)c1ccc(C(=O)NCCCN(CC)CC)cc1 4947855 XAOMXYJZAHWISV-UHFFFAOYSA-N 390.572 2.610 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)cc1 9045111 DQPCZSXYKYYNGR-AWEZNQCLSA-N 379.445 2.900 0 50 GFAA CC(C)CC(=O)N1CCC2(CC[C@H](CNC(=O)/C=C/c3ccccn3)O2)CC1 11966773 WIJRREBCXVGDTJ-OVKVCFKUSA-N 385.508 2.797 0 50 GFAA Cc1c(C(=O)NCc2ccccn2)sc2ncnc(NC[C@@H]3CCCO3)c12 11995366 GCQGOUBJILKAQI-AWEZNQCLSA-N 383.477 2.916 0 50 GFAA COC(=O)CCC(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 12030982 ZCZSTQJHMBGWSB-FQEVSTJZSA-N 380.435 2.733 0 50 GFAA CC(C)CCN1CCNC(=O)[C@@H]1CC(=O)NCc1ccccc1C(F)(F)F 12075441 ZCBLUEJZULCHDZ-INIZCTEOSA-N 385.430 2.558 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2ccc3nonc3c2)C1)c1n[nH]c2ccccc12 12317082 DTCYUHLQOZINCE-OAHLLOKOSA-N 390.447 2.741 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N(C)C[C@@H]4COCCO4)cc3o2)cc1 12585241 FPDJRBQNGVKYDE-GOSISDBHSA-N 396.443 2.915 0 50 GFAA COc1cc(OC)cc(C(=O)NC[C@H]2CCCN(Cc3nccs3)C2)c1 12589664 NXMALNRMDLHVJN-CQSZACIVSA-N 375.494 2.802 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nn(C)c2c1C[C@@H](N1CCSCC1)CC2 14537321 NIYZFAONIDRVSA-KRWDZBQOSA-N 384.549 2.598 0 50 GFAA Cc1ccc(CN(C)C[C@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)o1 14974067 JINNIIXOCOPERV-HXUWFJFHSA-N 378.419 2.852 0 50 GFAA COc1ccc(Cn2cc(C(=O)N(C)CC[C@H](O)c3ccccc3)nn2)cc1 14981016 OHSVGVVXXVDJSX-FQEVSTJZSA-N 380.448 2.531 0 50 GFAA O=C(NCc1cnc2ccccn12)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 15068197 SRNBTCUKIXKADY-KRWDZBQOSA-N 394.450 2.571 0 50 GFAA Fc1c(F)c(F)c(-[n+]2cn3c(n2)CO[C@H]2Cc4ccccc4[C@H]23)c(F)c1F 38347975 QYCVUBRNHFACFR-DYZYQPBXSA-N 380.296 2.900 0 50 GFAA COc1cccc(C(=O)N2CCN(Cc3ccc(-n4ccnc4)cc3)CC2)c1 72143842 VLIZJWZOIBAMPD-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA O=C([C@H]1Cc2ccccc2S1)N1CCN(c2ncnc3ccccc23)CC1 72428138 WPNVCAXNFFOJGM-LJQANCHMSA-N 376.485 2.995 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3ccnc(N4CCCCC4)n3)CC2)cc1 72437635 JBRQYGDZXZKLAD-UHFFFAOYSA-N 379.508 2.992 0 50 GFAA O=C1CCCN1CCC1CCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3N2)CC1 77299837 RMPXQMLPBDXTQP-SFHVURJKSA-N 375.900 2.928 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1 77454815 PNNJJKJPNUYUEU-KRWDZBQOSA-N 387.505 2.526 0 50 GFAA CC(=O)N1CCCn2nc(CNC(=O)c3cccc(C(F)(F)F)c3)cc2C1 82097690 HNFXBURRZNYTLN-UHFFFAOYSA-N 380.370 2.584 0 50 GFAA Cc1nc[nH]c1CSCCNC(=O)c1cnc(-c2cccs2)nc1O 91769804 IVSRUGDZIJHJKJ-UHFFFAOYSA-N 375.479 2.605 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 91951906 XYTWLIGXGULBAT-SFHVURJKSA-N 376.460 2.981 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)CCn3nnc4ccccc43)C2)cc1 95359263 IEYZPPXSSUHISF-KRWDZBQOSA-N 378.432 2.926 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(CCN3CCCC3=O)CC2)cc1F 95362331 XPXGRZCKUGMPJI-LJQANCHMSA-N 378.444 2.685 0 50 GFAA CCN1CCN(C[C@@H]2CN(c3ccc4cccc(Cl)c4n3)C[C@@H]2CO)CC1 95371120 ZLYWHQZPLFYDRH-QZTJIDSGSA-N 388.943 2.570 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(C(=O)[C@@H]1CCc3ccccc31)CC2 95383427 YAGLHVBIOMUNDH-HXUWFJFHSA-N 383.536 2.509 0 50 GFAA CC(C)c1nnsc1CN1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95501837 ASSRMPTVJLXVSI-GXTWGEPZSA-N 377.539 2.741 0 50 GFAA O=C(Nc1ccc(Oc2cccnc2)cc1)C1CCN(C(=O)[C@H]2CCCN2)CC1 95522284 SEDZIQIAEHVFJO-HXUWFJFHSA-N 394.475 2.803 0 50 GFAA CCN(C(=O)c1ccc(NC(=O)NC[C@H]2COCCO2)cc1)c1ccccc1 95526557 VAMYZGTUHXNORE-IBGZPJMESA-N 383.448 2.890 0 50 GFAA CC1(C)C[C@H](CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)CCO1 95527218 FSEFPTDMSFVOCU-MRXNPFEDSA-N 386.540 2.701 0 50 GFAA COc1cc2c(cc1C(=O)N1C[C@@H]3c4ccccc4OC[C@]3(CO)C1)CCC2 96149630 JFEBBZINZBSADQ-AUSIDOKSSA-N 379.456 2.795 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1cccc(I)c1)[C@H]1C=C[C@H]2CC1 100237369 VFDICGXUUGFPGQ-NUZBWSBOSA-N 379.197 2.993 0 50 GFAA O=C(c1ccc(Cl)cc1)N1CCCN(C(=O)c2cnn3c2CCCC3)CC1 127204455 NJCCQIILHPTWQE-UHFFFAOYSA-N 386.883 2.861 0 50 GFAA Cc1ccn(-c2ccccc2NC(=O)NCCc2nnc3n2CCCCC3)n1 151071627 FGBTUCRLBDUBCS-UHFFFAOYSA-N 379.468 2.863 0 50 GFAA C[C@@H](C(=O)NC[C@@](C)(O)C1CCCC1)n1c(S)nnc1-c1cccs1 170645162 GIGWDTAJFXDCRU-APPDUMDISA-N 380.539 2.914 0 50 GFAA O=C(Cn1cc(C2CC2)nn1)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 184001416 GTWSSQWURHTOOT-INIZCTEOSA-N 380.370 2.774 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)N1CCN(C2CC2)c2ccc(Cl)cc21 187363047 ASBLOQRRZLLUMI-UHFFFAOYSA-N 394.866 2.874 0 50 GFAA Cc1cc(-c2ncccc2NC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cs1 189212817 PUAJHERRXNOILW-ZDUSSCGKSA-N 394.522 2.522 0 50 GFAA CC(=O)N1CCN(Cc2cccc(NCc3cnc4nc(C)cc(C)n34)c2)CC1 189511441 BXJKSVPDGGFPOJ-UHFFFAOYSA-N 392.507 2.622 0 50 GFAA COCCOc1ccc(NC(=O)N2CCC(c3nc(N(C)C)no3)CC2)cc1 225739741 KVGBVOCQNKKCKB-UHFFFAOYSA-N 389.456 2.572 0 50 GFAA C[C@H]1CN(C[C@H]2CCCN2C(=O)c2cccc(Nc3ncccn3)c2)C[C@@H](C)O1 229653519 RVUYQVBEEYAATM-FUHIMQAGSA-N 395.507 2.934 0 50 GFAA C[C@H]1CN(S(=O)(=O)N[C@H]2CCSc3ccc(Cl)cc32)C[C@@H](C)O1 229723362 BFCQCNFFTWESFD-WDMOLILDSA-N 376.931 2.821 0 50 GFAA O=C(CNC(=O)c1ccccc1OC(F)F)NC[C@H](CO)CC1CCCCC1 252497650 QLZIXOPFNBUUOL-OAHLLOKOSA-N 398.450 2.713 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2 263615570 DBPVWPOZBDKVIC-QGZVFWFLSA-N 382.351 2.670 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@H]2CCCN2Cc2ccc(F)cc2)C1 266969673 LGIJGCNFWOUNKW-AZUAARDMSA-N 389.515 2.801 0 50 GFAA Cc1c(C(=O)N2CC3(CCCC3)c3cccc(F)c32)cnn1-c1ccc(=O)[nH]n1 278412874 FLHSSAWAJPWPFJ-UHFFFAOYSA-N 393.422 2.875 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C[C@H]21 284157177 QRGPMMVJCMCWCJ-IAGOWNOFSA-N 395.290 2.724 0 50 GFAA CON(C[C@@H]1CCC[C@@H](C)C1)C(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 290353464 JMTODSXCTFLSNB-VXGBXAGGSA-N 381.860 2.594 0 50 GFAA Cn1ncc(NC(=O)N2CCC([C@H]3OCCC[C@H]3N)CC2)c1-c1ccccc1 333270267 FZYXULWEQFNJBP-YLJYHZDGSA-N 383.496 2.837 0 50 GFAA CCn1c(O)nnc1C1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1 378145206 SDWKAHUMXMUYBM-UHFFFAOYSA-N 377.876 2.865 0 50 GFAA CNC(=O)COc1ccccc1-c1ccc(C(=O)N2CCC[C@@H](OC)C2)cc1 426705716 PAZNYQBOJAJUAR-GOSISDBHSA-N 382.460 2.729 0 50 GFAA CS(=O)(=O)c1cccnc1CNC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1 432360022 SWELBLVSYHVHEE-CQSZACIVSA-N 393.896 2.838 0 50 GFAA CC(=O)NCc1ccc(NC(=O)[C@@H]2CCc3nnc(-c4ccccc4)n3C2)cc1 449854785 HMGCCFOEYZRTIC-GOSISDBHSA-N 389.459 2.782 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)c2ccco2)C1)c1cnc(Nc2ccccc2)nc1 670455402 MOGFTNMUSYUWNP-KRWDZBQOSA-N 391.431 2.848 0 50 GFAA CN(C)c1ncc(/C=C/C(=O)N2CCC[C@@H]2c2nc3ccc(F)cc3[nH]2)cn1 826608027 GXXKMKDQXYDGSK-ZGRWHYIRSA-N 380.427 2.935 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1 855755398 HDWHKNIBYSYVHJ-LEWJYISDSA-N 378.472 2.727 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NC[C@@H]3CCCN(S(C)(=O)=O)C3)cc2)o1 952967067 YRJJDZIMPCFJRD-HNNXBMFYSA-N 376.478 2.656 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)CCc2c[nH]c3ccccc23)C1)C1CCOCC1 952990167 GUSLNOHSXJCKQA-QGZVFWFLSA-N 397.519 2.882 0 50 GFAA COc1coc(CN2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)cc1=O 1073371250 KYGPFGVPLYLHCH-APWZRJJASA-N 380.488 2.712 0 50 GFAA CNC(=O)c1ccnc(N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)c1 1704330097 WXGWQOWNYZYYAJ-UHFFFAOYSA-N 397.475 2.527 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3n[nH]c4c3CCC4)C1)CC2 1857671901 WBNXBOWMOSRYQJ-JOCHJYFZSA-N 395.507 2.812 0 50 GFAA CC[C@@H](C(=O)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1C(=O)Nc1ccccc1)n1cccn1 1857679251 QMUVQCOOJZBDKA-LJDSDSDDSA-N 393.491 2.988 0 50 GFAA O=C(O)[C@H]1CN(CCc2ccccc2)CC12CCN(Cc1ccncc1)CC2 1857692594 LTMVDOUZKFYPRG-OAQYLSRUSA-N 379.504 2.923 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCCCCO)C3)nc2c1 1857705990 FAIMADFGUXEXIW-OAHLLOKOSA-N 375.469 2.722 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1c[nH]nc1-c1cccc(F)c1)C[C@@H]2O 1857732915 MXFPAWZZQRCDLV-ADYITMSISA-N 393.462 2.785 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3oc(-c4ccccc4Cl)nc3c2)C(=O)N1 1857798234 WVAWQCROFPPIPF-CYBMUJFWSA-N 383.791 2.683 0 50 GFAA CC(=O)N1CCC[C@]2(CCc3c(N(C)Cc4ncc[nH]4)nc(C(C)(C)C)nc32)C1 1875244681 YZYNTPVECPPPAA-QFIPXVFZSA-N 396.539 2.960 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(F)c(C)c1)C[C@H](C)O[C@@H]2C 1875314752 QBZDHEIEPQURGE-UONOGXRCSA-N 375.444 2.929 0 50 GFAA COc1cc(OC)cc(S(=O)(=O)NC[C@@]2(c3ccccc3)CC2(F)F)c1 1875323096 WVFWBPSOAUYVMC-QGZVFWFLSA-N 383.416 2.959 0 50 GFAA Cc1cc(C(=O)N(C)C[C@H]2CCCN(C(=O)C3(C)CC3)C2)c2c(C)n[nH]c2n1 1875332385 ZRVZMVUSENUECQ-OAHLLOKOSA-N 383.496 2.685 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N(C)[C@@H]1C[C@@H]2C[C@H](N(C)C)C[C@@H]2C1 2100477587 BYDZOGQRLPBRMJ-QGFMHUBQSA-N 381.520 2.887 0 50 GFAA COCCCN1C(=O)[C@]2(CCN(C(=O)c3cc(O)ccc3C)C2)c2ccccc21 2100540259 GHWLPKCESNOMQF-QHCPKHFHSA-N 394.471 2.868 0 50 GFAA O=C1CC[C@@H](CCNC(=O)Nc2ccc(-c3cc(C(F)(F)F)n[nH]3)cc2)N1 2325782051 RLEXXQLPHJGLSC-LBPRGKRZSA-N 381.358 2.886 0 50 GFAA O=S1(=O)NC(CSCc2nc3ccccc3[nH]2)=Nc2cccc(F)c21 2325874706 XUTPXJFOMPMYHM-UHFFFAOYSA-N 376.438 2.957 0 50 GFAA O=C1OC[C@H]2CN(C(=O)c3cn(-c4ccccc4)nc3-c3ccc(F)cc3)C[C@@H]12 2356138987 ULEBCFOIIHPHLF-CRAIPNDOSA-N 391.402 2.923 0 50 GFAA NC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCC2 665921 AKMKGYGXXSQXDP-GFCCVEGCSA-N 383.473 2.717 0 50 GFAA O=C(c1ccccc1F)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 893215 VBDNSGOMTPQUKR-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA CC[C@H](C)NC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccccc1 2959759 NHBFDPJATOJYID-HNNXBMFYSA-N 376.478 2.805 0 50 GFAA O=C1C[C@@H](NC(=O)c2cc3c(s2)CCOC32CCNCC2)c2ccccc2N1 2356143415 GTCXVNKWEFNRBX-MRXNPFEDSA-N 397.500 2.713 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2ccc(OC)c(OC)c2OC)C1=O 2356149988 HCWRVJQHLABALO-OAQYLSRUSA-N 390.480 2.720 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)ccc1OC 10008771 NFEOSKKKUZAIAV-UHFFFAOYSA-N 399.266 2.618 0 50 GFAA O=C(OCc1ccccc1)[C@@H]1[C@@H]2C(=O)N(Cc3ccccc3)C[C@@]23C=C[C@H]1O3 100750228 VPPDEEZJOFBAPZ-AWWSKVOZSA-N 375.424 2.712 0 50 GFAA C[C@@](NC(=O)c1ccnc(SCC(F)(F)F)c1)(C(N)=O)c1ccccc1 112632861 HTDFSOYMRMWPLC-INIZCTEOSA-N 383.395 2.867 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)[C@@H]1c1ccccc1 171851955 YRNCZPMYJUSSIA-IRLDBZIGSA-N 393.487 2.651 0 50 GFAA CCNc1cc(N2CCN(C(=O)c3ccc(Br)o3)CC2)nc(C)n1 67614314 IWICMPLVKWNYOD-UHFFFAOYSA-N 394.273 2.535 0 50 GFAA Cn1nc(-c2ccccn2)c2c1NC(=O)C[C@H]2c1cc2ccc(F)cc2[nH]c1=O 67981715 CTJIKNZJPLSETH-ZDUSSCGKSA-N 389.390 2.937 0 50 GFAA Cc1c(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)cnn1C1CCCC1 120540152 CKBPUCIBMWQGRQ-SFHVURJKSA-N 375.494 2.822 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CCCN(C)CC3)nc2)C1 67850405 KSLXZZRNAYBSOS-LJQANCHMSA-N 386.540 2.691 0 50 GFAA CCn1c(NC(=O)c2nn(C)cc2I)nc2ccccc21 2764147 BOYJZUXVZPTTNZ-UHFFFAOYSA-N 395.204 2.647 0 50 GFAA COc1ccccc1NC(=S)NC(=O)c1c(Br)c(C)nn1C 2797433 XPFCKFWRFIJPMC-UHFFFAOYSA-N 383.271 2.626 0 50 GFAA O=C(O)c1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cc(C4CC4)n[nH]2)C3)cc1 218289949 PATVKDLOSWZXIJ-UHFFFAOYSA-N 377.404 2.574 0 50 GFAA CC(C)c1nn(C)c(N2CCOCC2)c1CNC[C@@H](O)c1ccc(Cl)cc1 236886880 UZWDEWYUDILDRD-GOSISDBHSA-N 392.931 2.857 0 50 GFAA C[C@H](C(=O)N[C@H]1CCCCC[C@@H]1CO)n1c(S)nnc1-c1cccs1 153915519 SFXIRZAYMYSRFM-UPJWGTAASA-N 380.539 2.914 0 50 GFAA C[C@H](C(=O)Nc1ccccc1OC(F)F)N1CCN(CC2CCOCC2)CC1 172425372 FDCDEHHEAGBPOS-OAHLLOKOSA-N 397.466 2.659 0 50 GFAA COc1cc2c(cc1OC)[C@H](C)N(S(=O)(=O)NCc1ccccc1)CC2 72164725 BKYJNVSSYDEMLG-AWEZNQCLSA-N 376.478 2.658 0 50 GFAA CN(C(=O)c1ccccc1SCC(=O)N1CCc2ccccc21)[C@@H]1CCNC1 179079334 YNKAIRIFDZYSFG-QGZVFWFLSA-N 395.528 2.802 0 50 GFAA CC(C)c1ncc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)cn1 91693865 IHGKGAICWRTDTA-UHFFFAOYSA-N 382.512 2.619 0 50 GFAA CCOc1ccc(CC(=O)N2CCC3(CC2)c2[nH]cnc2CCN3CC)cc1 95525090 RWDKAXNCQNIVOJ-UHFFFAOYSA-N 382.508 2.747 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(C(=O)CCN3CCCC3=O)CC2)C1 96139768 JTFMVICTLSKERQ-HXUWFJFHSA-N 383.536 2.727 0 50 GFAA CC(C)c1nc(CN2CCC3(CCN(Cc4ncc[nH]4)CC3)[C@@H](CO)C2)co1 97514446 SRRCNEBDZVXFDQ-QGZVFWFLSA-N 387.528 2.618 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)N2CCC[C@H](c3noc(C)n3)C2)c1 96138369 HQECSOIUMPNHTP-AWEZNQCLSA-N 387.440 2.683 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCCn1nc(C)c(Cl)c1C)C2 95360348 HUYZYNAEWSTPHG-OAHLLOKOSA-N 377.872 2.920 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)NCCCSc1nnc(C)s1 97137444 JFPNCYDYAGYXBZ-GFCCVEGCSA-N 392.506 2.580 0 50 GFAA CCc1nc2ccccc2n1C1CCN(CC(=O)Nc2cc(C)nn2C)CC1 180966925 NHHWIFMTFOXLFR-UHFFFAOYSA-N 380.496 2.916 0 50 GFAA CSc1nn2c(=O)cc(CN(C)[C@H](C)Cc3ncccc3C)nc2s1 244795040 QYNRWQCSUCUCSM-GFCCVEGCSA-N 375.523 2.639 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(C(=O)c2csc(-c3ccc(F)cc3)n2)C1 298607736 MBGZEQGCRANPSD-LBPRGKRZSA-N 382.482 2.846 0 50 GFAA C[C@@H]1Sc2ccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)O)cc2NC1=O 268941791 KGZUSBNZMWLPRH-MEDUHNTESA-N 382.441 2.771 0 50 GFAA CCOc1ccnc(N2CCC(CNC(=O)c3cncc(Cl)c3)CC2)n1 823399323 XVBZDGAIPNAJTI-UHFFFAOYSA-N 375.860 2.570 0 50 GFAA CCCNC(=O)N1CCC2(CC1)CN(Cc1ccc(F)cc1OC)CCO2 822927621 LCEMNQKXKOHQCF-UHFFFAOYSA-N 379.476 2.621 0 50 GFAA Cc1sc2nc(CCNC(=O)Cc3n[nH]c4ccccc34)nc(O)c2c1C 827857633 LGKUFKGFAJKXHS-UHFFFAOYSA-N 381.461 2.791 0 50 GFAA CSCCN1CCC(NC(=O)N2CCN(c3ccccc3)C[C@H]2C)CC1 584895579 BTDMDEDJFARKFU-QGZVFWFLSA-N 376.570 2.734 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@H](C)c3nncn3C(C)C)o2)c1C 670449195 JBZVBTOCTDGXAU-GFCCVEGCSA-N 379.442 2.763 0 50 GFAA C[C@H]1C[C@H](C(=O)NCc2cc3ccccc3n(C)c2=O)N1C(=O)OC(C)(C)C 1875284510 XLPHSPWXKFAQIS-SUMWQHHRSA-N 385.464 2.553 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)CN1CCC2(CC1)C[C@@H](N)c1ccccc1O2 1875284266 UKFXSZNZWNWELV-IFMALSPDSA-N 395.547 2.796 0 50 GFAA N=c1nc(N2CCC[C@H]2Cc2cccc(F)c2F)[nH]c(=Nc2ccccc2)[nH]1 1875332215 MVJQMVBYNVJDRB-HNNXBMFYSA-N 382.418 2.939 0 50 GFAA CC1CC(Cn2nc(-c3cccc(NC(C)(C)C)n3)nc2CCNC(N)=O)C1 1875324716 KFHGWZUISAIJJN-UHFFFAOYSA-N 385.516 2.807 0 50 GFAA CCCNC(=O)c1ccc(C)c(NC(=O)[C@H]2CC(=O)N(Cc3ccncc3)C2)c1 952976257 HYZNCIFTMYJQNI-SFHVURJKSA-N 394.475 2.517 0 50 GFAA COCC1(CNC(=O)C[C@H](C)CC(C)(C)C)CCN(C(=O)[C@H](C)OC)CC1 1775989084 CHEFZXVZPIUOCW-IRXDYDNUSA-N 384.561 2.855 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)Nc3ccc(C(F)(F)F)nc3)C2)n(C)n1 278261543 XIGNRJSXMHHKID-CYBMUJFWSA-N 382.390 2.933 0 50 GFAA COc1cccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)N(C)C)c1 192770741 HQDPAOAOCGHRMC-SFTDATJTSA-N 395.503 2.719 0 50 GFAA CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@]4(C3)NC(=O)NC4=O)o2)c1 195017475 KHMPTTPPTIVJEQ-OAQYLSRUSA-N 381.432 2.884 0 50 GFAA C[C@H](NC(=O)NCc1ccc(N(C)C(=O)c2ccncc2)cc1)c1cnn(C)c1 743620626 OQIRCEFVDDIGMC-HNNXBMFYSA-N 392.463 2.652 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)[C@@H](O)c3cccc(Cl)c3)CC2)c(C)o1 1529114590 QMMLHHDSKDGVQK-SFHVURJKSA-N 390.867 2.958 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)Cn1c(C2CC2)nc2ccccc21 1704331673 RUCIPGZIPSAARG-UHFFFAOYSA-N 380.496 2.536 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccccc1I 250080359 JHFKWZDIPKUACZ-RBJBARPLSA-N 383.185 2.753 0 50 GFAA CCNC(=O)N1C[C@H]2CN(Cc3cccnc3N)C[C@]2(CCc2ccccc2)C1 1772815605 PUJVFTUMQBIYRV-NFBKMPQASA-N 393.535 2.760 0 50 GFAA O=C(c1cn(CCCc2ccccc2)nn1)N1CCC[C@@H](CN2CCCC2)C1 11878552 IRVZWHQKBVHWMO-FQEVSTJZSA-N 381.524 2.859 0 50 GFAA C[C@]1(C2CCN(C(=O)c3ccco3)CC2)NC(=O)N(Cc2ccc(F)cc2)C1=O 12245628 YCIYUDBFRJRCCY-OAQYLSRUSA-N 399.422 2.782 0 50 GFAA Cc1ccc(OC[C@H]2C[C@@H](C(=O)N3CCCC3)CN(Cc3ccncc3)C2)cn1 14747338 LXCPGKDWNFZWKO-LEWJYISDSA-N 394.519 2.925 0 50 GFAA CCN(Cc1ccncc1)C(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1 15064685 GNZHPNCXLYDQDO-UHFFFAOYSA-N 380.404 2.775 0 50 GFAA OCC[C@H]1CN(Cc2cccc3nonc23)CCN1Cc1ccc(F)c(F)c1 19228678 AJBJTONRQUPXFN-INIZCTEOSA-N 388.418 2.570 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)c3cc(C4CC4)on3)CC2)[C@H]1O 19838578 FHPRSUOJAKARET-UXHICEINSA-N 381.476 2.703 0 50 GFAA O=C1C[C@H](c2ccccc2Cl)Cc2nc(NCCN3CCOCC3)ncc21 19899348 PLDABFKBIWGMQX-CQSZACIVSA-N 386.883 2.787 0 50 GFAA O=C(c1cccnc1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857711183 MAEMIUQOKOITIS-JOCHJYFZSA-N 387.443 2.759 0 50 GFAA CCCN1CC2(CCN(C(=O)c3ccc(C(C)=O)s3)CC2)OCCC1=O 1857711782 FGHICYDEXKTWQI-UHFFFAOYSA-N 378.494 2.584 0 50 GFAA c1ccc(-c2nccn2C[C@H]2CC3(CCNCC3)CO2)c(Cn2cccn2)c1 1857713645 AJECZLYSCLUENS-LJQANCHMSA-N 377.492 2.954 0 50 GFAA O=C(Nc1ccccc1F)N1CCc2nc(C(=O)N3C[C@H]4CC[C@H]3C4)cn2CC1 1875247432 LSWCYERKBOMPCL-GJZGRUSLSA-N 397.454 2.737 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)O)NC(=O)CCN1C(=O)CCc2ccccc21 237581962 DSCMNFAKJMLGAB-GOSISDBHSA-N 380.444 2.997 0 50 GFAA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OC)c3ccccc23)C1 1119206 RWSKQQUCTXWYDW-AWEZNQCLSA-N 377.462 2.812 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccccc2NC(=O)c2cccs2)CC1 6702723 GBFMWMQIBVBFRU-UHFFFAOYSA-N 387.461 2.915 0 50 GFAA O=C(CCc1cccnc1)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 15070556 FFDSBQNNELFCRA-UHFFFAOYSA-N 377.400 2.983 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2[C@@H](C)CCC[C@@H]2C)c1C(=O)OC(C)C 17080891 GAENXTZOLUPPIX-RYUDHWBXSA-N 395.525 2.922 0 50 GFAA COc1cccc(CN2CCN(Cc3cccc(C(C)=O)c3)C[C@@H]2CCO)c1 19731276 URBCBWWOALFQSB-QFIPXVFZSA-N 382.504 2.967 0 50 GFAA COc1ccc2c(c1)C[C@@H](c1nc(-c3c(C)ncc4c3CCNC4)no1)CO2 20256437 WCRZTAMKQFBCNZ-CQSZACIVSA-N 378.432 2.813 0 50 GFAA O=S(=O)(c1cccc2nsnc12)N1CCCN(Cc2cccs2)CC1 30383570 IAFBZBKJNQASLY-UHFFFAOYSA-N 394.547 2.649 0 50 GFAA CN(CCn1ccnc1)Cc1ccc(-c2nc(-c3cccnc3)cc(=O)[nH]2)cc1 48468433 LPGCHQRSYVRMAZ-UHFFFAOYSA-N 386.459 2.827 0 50 GFAA Cc1c(NCc2ccccn2)cccc1C(=O)N[C@@H](Cc1ccccc1)C(N)=O 55324925 HXPZORKXTUSQAW-NRFANRHFSA-N 388.471 2.829 0 50 GFAA Cc1nnnn1-c1cccc(C(=O)N2CCC(c3cc(C(C)C)n[nH]3)CC2)c1 67447034 CNFYUEFKZLEBQC-UHFFFAOYSA-N 379.468 2.837 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)[C@@H]2CCCCO2)CCO3)n1 67560743 JTHFYGYMHJWVJU-SFHVURJKSA-N 383.448 2.756 0 50 GFAA CN1C(=O)[C@@](CC(=O)Nc2ccc[nH]c2=O)(Cc2ccccc2)c2ccccc21 71771658 PYJGSMRZBSBWJW-HSZRJFAPSA-N 387.439 2.861 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@](C)(Cc3ccc4c(c3)OCO4)C2)c(=O)n1C 92046047 MEEQJXVDFAABGP-JOCHJYFZSA-N 382.460 2.907 0 50 GFAA O=C(c1cc2ncccn2n1)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 95523507 WJKVDEDEVMWPBH-IOMROCGXSA-N 391.450 2.571 0 50 GFAA COCCn1c(C)cc2cc(NC(=O)N(C)CC3(CO)CCOCC3)ccc21 96137456 BVKJBSZTJCFDFK-UHFFFAOYSA-N 389.496 2.849 0 50 GFAA O=C1CCCN1C[C@@H]1CCCN(c2ncnc3c2Cc2ccccc2OC3)C1 96148134 UPMMXUQYOZUDNA-INIZCTEOSA-N 378.476 2.799 0 50 GFAA O=C(c1cccc(Cl)c1F)N1C[C@H]2CN(CC3CCC3)C[C@@]2(C(=O)O)C1 96160300 ZYHZVXUIKBYXRD-BFUOFWGJSA-N 380.847 2.738 0 50 GFAA Cn1nc(-c2ccccc2S(=O)(=O)NC(C)(C)C)nc1N1CCCCC1 96166759 JFSYCIOGEDSONQ-UHFFFAOYSA-N 377.514 2.549 0 50 GFAA Cc1nc2c(NC(=O)N3CCC[C@@]4(C3)C(=O)Nc3ccccc34)cccn2n1 97785508 BDGYPRKMWUVRGQ-FQEVSTJZSA-N 376.420 2.556 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 109621829 GKUFIPPTHYHOSM-CYBMUJFWSA-N 396.281 2.821 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N[C@H]1CCc2[nH]ncc2C1 167475815 YBQCXLPEXAEQOG-INIZCTEOSA-N 376.416 2.814 0 50 GFAA Cc1ccc(NC(=O)Cn2c(-c3cnccn3)nc(C)c(C)c2=O)cc1Cl 169752706 ZFVHVJBPOSRUBL-UHFFFAOYSA-N 383.839 2.918 0 50 GFAA COCCN1CCCN(C(=O)c2ccc(-c3ccccc3Cl)o2)CC1=O 170605347 CAWSSZJBHZPYEQ-UHFFFAOYSA-N 376.840 2.921 0 50 GFAA CN([C@@H]1CCN(c2ccccc2)C1=O)S(=O)(=O)c1cccc2cnccc12 172029906 LTKQZBUQVQRAEO-GOSISDBHSA-N 381.457 2.661 0 50 GFAA O=C(NC[C@H]1CCN(c2ccccc2)C1)Nc1ccn(Cc2ccncc2)n1 172368209 IHZCSFMXTCSJLV-GOSISDBHSA-N 376.464 2.974 0 50 GFAA Cc1nsc(N2CCN(C(=O)CCc3ncc(-c4ccccc4)o3)CC2)n1 173083730 ASZAHVBMADCUFH-UHFFFAOYSA-N 383.477 2.783 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@H]3CCOc4ccc(F)cc43)CC2)n1 174815107 RPIQKIDHPZSPSX-AWEZNQCLSA-N 391.472 2.595 0 50 GFAA O=C(C[C@H]1C(=O)Nc2ccccc21)NCCc1ccc(OCC(F)(F)F)nc1 186417201 GLOPEFQETUXXEG-CQSZACIVSA-N 393.365 2.807 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@H]3CCOc4c(F)cccc43)CC2)n1 188322318 KQFQCWIDMYOKPY-AWEZNQCLSA-N 391.472 2.595 0 50 GFAA CC(=O)N1CC[C@@H](NC(=O)c2nn[nH]c2-c2ccccc2)c2ccc(F)cc2C1 194230120 UEGSQVPELRTVSM-GOSISDBHSA-N 393.422 2.834 0 50 GFAA CCCc1nc(C(=O)N2CCOC[C@]23CCOC3)nn1-c1ccccc1Cl 194403675 DJSPRUVUQXUIMG-LJQANCHMSA-N 390.871 2.505 0 50 GFAA CCCc1nnsc1C(=O)N[C@@H](c1cc(F)ccc1OC)[C@H]1C[C@@H](O)C1 244764130 PBVNTIPDEQCXQM-RSAASHCRSA-N 379.457 2.880 0 50 GFAA COc1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1OCc1csc(C)n1 299740741 BNYRJMIRPAKECK-ZDUSSCGKSA-N 376.434 2.586 0 50 GFAA C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCN(C2CCOCC2)C1=O 331502653 BGWVZCYKNLAFJO-SUMWQHHRSA-N 398.425 2.780 0 50 GFAA COc1ccc(NC(=O)Cc2ccc(OC(F)F)cc2)cc1-n1nnnc1C 363197697 RVDAKDNENCWOPY-UHFFFAOYSA-N 389.362 2.762 0 50 GFAA O=C(c1ccccc1)N1CCC(C(=O)N2CCC[C@@H](N3CCCCC3=O)C2)CC1 363266682 UTULLPXBPURNNA-HXUWFJFHSA-N 397.519 2.542 0 50 GFAA CC(=O)N(Cc1noc(C(C)C)n1)[C@H]1CCN(c2ccc(OC(F)F)cn2)C1 364295708 ADLUTMVUIZQXMQ-ZDUSSCGKSA-N 395.410 2.817 0 50 GFAA CCN(C(=O)c1ccc(C(F)(F)F)c(O)n1)[C@@H]1CCN(CC(F)(F)F)C1 912489132 YTKSVQDFIMMOOD-SECBINFHSA-N 385.308 2.905 0 50 GFAA Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1C(=O)Nc2c(F)cccc21 935867332 RPCYJWBYOGTALN-NQKGRLOXSA-N 382.439 2.922 0 50 GFAA CN1C(=O)N(C)C2(CCN(C(=O)C[C@@H](c3ccccc3)c3ccco3)CC2)C1=O 952965083 BQSVRFHWUXDASD-KRWDZBQOSA-N 395.459 2.687 0 50 GFAA Cc1noc(C)c1C(=O)NCC1CCN(C(=O)[C@@H]2CCc3ccccc32)CC1 952983604 VWQXQXZBBFQCMS-LJQANCHMSA-N 381.476 2.990 0 50 GFAA CCN(CCOc1ccccc1Cl)S(=O)(=O)c1ccc(C(=O)NC)cc1 1506421445 JPCPJOJXKPEEOP-UHFFFAOYSA-N 396.896 2.789 0 50 GFAA CN(Cc1cccc(OCCCN2CCOCC2)c1)[C@H]1C[C@H]2C[C@@H](O)C[C@H]2C1 1704278374 WCYRCBFNQSZESC-COPRSSIGSA-N 388.552 2.769 0 50 GFAA Cc1ccc(NC(=O)C[C@@H]2Cn3nc(-c4ccncc4)nc3NC2=O)cc1Cl 1848442406 GGXMOVHWZSQTKY-CYBMUJFWSA-N 396.838 2.899 0 50 GFAA Cc1cccc(CN2CCC3(CC2)CC(=O)N(C[C@H]2CCCCO2)CCO3)n1 1857694403 AMMJGKBFRNIRPB-HXUWFJFHSA-N 387.524 2.543 0 50 GFAA CC(=O)N1CCC(C2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)CC2)CC1 1857718048 LQJRMSPPJMUJHY-UHFFFAOYSA-N 381.480 2.582 0 50 GFAA O=C(NC1CCN(Cc2cccc(O)c2)CC1)[C@H]1CC[C@H](c2ccccc2)N1 1857734018 ABMXSWOFXWTBLT-FGZHOGPDSA-N 379.504 2.966 0 50 GFAA Cc1cc(C)n(-c2ccc(F)cc2CN2CCN3[C@@H](C4CC4)COC[C@H]3C2)n1 1875241814 IMTNLBMAFSELMJ-IFMALSPDSA-N 384.499 2.923 0 50 GFAA CNC(=O)Cc1ccc(-c2noc([C@@H](C)n3ccc(C(F)(F)F)n3)n2)cc1 1875269702 ZBHAWRANJDUYNF-SNVBAGLBSA-N 379.342 2.850 0 50 GFAA O=C(N[C@H]1CCCN(Cc2c(F)cccc2F)C1)C1CC2(C1)C[C@@H]2C(=O)O 1875277556 QLTQYTTVYNVJOV-YYQKHXEJSA-N 378.419 2.546 0 50 GFAA O=C(c1ccc(C2(F)COC2)cc1)N1CCN(C(=O)c2ccccc2F)CC1 1875278160 FQBFMVSJHGTFFX-UHFFFAOYSA-N 386.398 2.619 0 50 GFAA NC(=O)c1ncn2c(-c3ccccc3)cc(C(=O)N3CCc4ccccc4C3)nc12 1875350736 YSOYMEZVYNZNON-UHFFFAOYSA-N 397.438 2.694 0 50 GFAA COc1cccc2c(C(=O)N3CCC4(CC3)C[C@@H]4NC(=O)C3=CCCC3)cnn12 2325794103 QHJJCZQYDYZDAF-SFHVURJKSA-N 394.475 2.564 0 50 GFAA COc1ccc(Br)cc1C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 678745 BLRBWXYOMSLSJV-UHFFFAOYSA-N 389.205 2.936 0 50 GFAA COc1ccc(C)cc1NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 1015654 DVRIGNVMLGZYFY-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA O=C1N(CCO)CCC[C@]12CCCN2Cc1c[nH]nc1-c1ccc(Cl)cc1 2356137270 VSYDSSPIDDCDJZ-FQEVSTJZSA-N 388.899 2.679 0 50 GFAA Cc1c(Cl)cccc1S(=O)(=O)N1CCC[C@]12CCCN(C1CC1)C2=O 2356143746 VNXGLUPYMCBIBF-SFHVURJKSA-N 382.913 2.957 0 50 GFAA O=C(c1nn(Cc2ccccc2)c2ncccc12)N1[C@H]2CCC[C@@H]1C[C@H](O)C2 2356148104 HLZGADCCFZXGKE-PIIMJCKOSA-N 376.460 2.998 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccncc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 2356169240 XOIPWVSJRDRISL-CZUORRHYSA-N 390.365 2.964 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)[C@H]1CCCN1S(=O)(=O)c1ccccc1 4450929 ABQQBTUTPYVYQH-WRUMOOJNSA-N 388.533 2.925 0 50 GFAA COc1ccc(CN2CCN(c3nc(C)cnc3C)C[C@@H]2CCO)c(C)c1C 106974972 RLYWLZUVZGZXPJ-FQEVSTJZSA-N 384.524 2.792 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)[C@H]1COc2ccccc21 113037722 GNZMAAKSPSOATN-INIZCTEOSA-N 388.489 2.556 0 50 GFAA CN(C)Cc1cncc(Oc2ccc(CN3CCOCC3)c3cccnc23)n1 67785269 VXNGQXBBJNXUCV-UHFFFAOYSA-N 379.464 2.711 0 50 GFAA COc1c[nH]c(C(=O)N2CCC[C@H](c3[nH]ncc3-c3ccccc3)C2)cc1=O 67850119 CSLULWRZGBSARR-HNNXBMFYSA-N 378.432 2.793 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNCC3CCCCC3)C2=O)c1OC 67852254 IXXKYMLYKBEDEG-QFIPXVFZSA-N 390.524 2.727 0 50 GFAA COc1ccccc1-n1cc([C@H]2CC(=O)NCc3nc4sccn4c32)cn1 65396990 WLARIXNTTVVGEJ-CYBMUJFWSA-N 379.445 2.742 0 50 GFAA Cc1ccc2[nH]c(=O)cc(C(=O)N3CCC[C@H](Cn4cc(C5CC5)nn4)C3)c2c1 67868709 MNIONNIXNLBTKS-HNNXBMFYSA-N 391.475 2.858 0 50 GFAA COc1ncccc1N1C(=O)CN(Cc2cccc(Br)c2)C1=O 328595054 JOUFNGKOSCKVOH-UHFFFAOYSA-N 376.210 2.822 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2cnc3nc(C)cc(C)n23)n1C 328621430 ALHCDLMWXIXDLO-GOSISDBHSA-N 380.496 2.771 0 50 GFAA CN1CCC[C@@H](NC(=O)NC[C@H]2CCN(c3ccc(Br)cc3)C2)C1 252467407 IFFQSZNVSIMOPX-GDBMZVCRSA-N 395.345 2.669 0 50 GFAA CCOC(=O)c1cc(C(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)nn1C 6402129 CBLAWBSSDFXMCC-UHFFFAOYSA-N 397.479 2.971 0 50 GFAA CCc1cc(N2CCC(NS(=O)(=O)CC34CCC(CC3)C4)CC2)ncn1 329743985 QJRYQQLNDJXZKO-UHFFFAOYSA-N 378.542 2.508 0 50 GFAA O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2 332793296 BRZQQLPVXLDEGU-YCEFEEMOSA-N 375.513 2.567 0 50 GFAA CC1(C)CN(C(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 333113363 SPUUJVJIAZRCHJ-VKBFCKQYSA-N 378.513 2.704 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1cccs1)[C@@H](O)c1cccc(F)c1 363720331 GWBJPWYLRRSKPQ-BOFPYLFWSA-N 390.480 2.659 0 50 GFAA COc1ccccc1C(=O)NCC(=O)N1CC=C(c2ccc(Cl)nc2)CC1 363830274 WZRWJOUETAHYKC-UHFFFAOYSA-N 385.851 2.789 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(CNC(N)=O)cc1 155240258 RPZKXVQMKMLPRS-KRWDZBQOSA-N 380.492 2.592 0 50 GFAA CN(C[C@@H]1CCCN1c1cccnn1)C(=O)c1ccccc1Oc1cnn(C)c1 283292614 SZONWQMDUWQJAM-INIZCTEOSA-N 392.463 2.743 0 50 GFAA NC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CC1 237943084 YJZYINPMGUOKRB-QGZVFWFLSA-N 375.472 2.560 0 50 GFAA COc1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)ccc1O 39557736 GCXCTHVLHYMLQL-QGZVFWFLSA-N 392.446 2.748 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CCn3cccc3C2)nc2cccnc21 77319023 PAXSSQNPAHWNLP-MRXNPFEDSA-N 381.480 2.805 0 50 GFAA O=C(CCc1cccs1)Nc1ccc(S(=O)(=O)NC2CCOCC2)cc1 241213368 KOINQFQTUDPACH-UHFFFAOYSA-N 394.518 2.777 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)COc3ccc(C(C)C)c(C)c3)C2=O)n(C)n1 174994474 UPGMIFCZJHDEMJ-IBGZPJMESA-N 398.507 2.851 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)N1CCN(Cc2ccco2)CC1 426612534 GGOHLLFMGVZIDE-UHFFFAOYSA-N 383.492 2.855 0 50 GFAA COC[C@H]1[C@H]2OCC[C@H]2[C@H]1NS(=O)(=O)c1ccc(Cl)c(C)c1Cl 222825078 JEQCWKIAXMBGNQ-RZCHIYRCSA-N 380.293 2.630 0 50 GFAA CN(C)S(=O)(=O)n1ccnc1CN1CCC(C)(c2ccc(Cl)cc2)CC1 291536375 KVCJCCXBVVZFTQ-UHFFFAOYSA-N 396.944 2.745 0 50 GFAA CCCc1noc2nc(C3CC3)cc(C(=O)N3CCN([C@@H](CC)CO)CC3)c12 179415165 ZFAIDWKYXRHFTI-HNNXBMFYSA-N 386.496 2.581 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)[C@@H](O)c1cc(Cl)cc(Cl)c1 179761610 KTCAOPWHVMFVMR-INIZCTEOSA-N 377.231 2.924 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)CSc3nnc(C)s3)C[C@H]2N(C)C)cc1 95503528 NTLIKIAXFNYWIM-JKSUJKDBSA-N 376.551 2.803 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95506154 SEAISECFMMNMRU-KRWDZBQOSA-N 387.447 2.618 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N3CC[C@H](n4nc(C)cc4C)C3)c(=O)[nH]2)cc1 91410175 AOOAMXLSEHJRHS-KRWDZBQOSA-N 377.448 2.646 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)CC(C)C)C[C@@H]1N(C(=O)Cc1cccs1)CC2 534645996 KPWXOYYQGLJONQ-OXFYSEKESA-N 378.538 2.992 0 50 GFAA CC(=O)c1ccc(N2CCN(CC(=O)NCCc3ccc(F)cc3)CC2)cc1 55069878 MCQIWKIPRSLASG-UHFFFAOYSA-N 383.467 2.509 0 50 GFAA Cn1nccc1CCC(=O)NCC1CCN(Cc2ccc3ccccc3n2)CC1 827822449 PLNKRHFAAFFRHB-UHFFFAOYSA-N 391.519 2.929 0 50 GFAA Cc1nccn1-c1ccccc1CNC(=O)CN1CCOc2ccccc2C1 827836914 UKFBLGIUTPLVTD-UHFFFAOYSA-N 376.460 2.692 0 50 GFAA O=C(C1CCC1)N1CCC2(CC1)CN([C@H]1CCN(c3ccccc3)C1)CCO2 827921069 HCZGVCYFKXLGDK-NRFANRHFSA-N 383.536 2.759 0 50 GFAA COCCc1nsc(N2CC[C@@](c3nc(C4CC4)no3)(C(F)(F)F)C2)n1 952894897 RMIBSFXBQQCDFK-CQSZACIVSA-N 389.403 2.698 0 50 GFAA C[C@@H](OC(=O)[C@@H]1NC(=O)[C@H]2CC[C@H]21)c1nc(-c2cccc(C(F)(F)F)c2)no1 1875295304 FLMNIQLHGICQJK-WRSRJMLGSA-N 395.337 2.884 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)CC1)O2 1875394305 DFLSVXOHCRGQGW-KRWDZBQOSA-N 399.466 2.759 0 50 GFAA OC[C@@H]1CCN(c2ccc3nnc(-c4ccncc4)n3n2)C[C@@H]1c1ccccc1 1875307714 SESRGIXBZGCUER-RBUKOAKNSA-N 386.459 2.789 0 50 GFAA CCn1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)CCNc3ccccc3)CC1)O2 1875394874 ZMEDQTSWSGNJKU-KRWDZBQOSA-N 384.480 2.582 0 50 GFAA C[C@@H](C(=O)Nc1ccc(C(C)(C)C)cc1)n1cc(CNC(=O)C(F)(F)F)nn1 881013701 BAEUMPOYDJWWLI-NSHDSACASA-N 397.401 2.954 0 50 GFAA CO[C@H](C)C(=O)N1CCC2(CC1)C[C@H](NC(=O)c1ccc(C)cc1C)CCO2 1775997997 XXXRPOVYSWHINS-QZTJIDSGSA-N 388.508 2.608 0 50 GFAA Cc1cc(NC(=O)Cc2ccc(C(N)=O)cc2)cc(N2CCN(C(C)C)CC2)c1 276740265 DSVCXIDNUAMVMN-UHFFFAOYSA-N 394.519 2.806 0 50 GFAA Cn1c(S)nc2cc(C(=O)N(CC(F)F)C[C@H]3CCC=CO3)ccc2c1=O 170600579 GXUGOEPFKWIZLX-GFCCVEGCSA-N 395.431 2.622 0 50 GFAA CCn1cc([C@H]2CN(Cc3nc(-c4ccc(C)c(OC)c4)no3)CCO2)cn1 190819395 DUIIZFYYXLQILV-GOSISDBHSA-N 383.452 2.844 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)NC[C@@H](C)c1nncn1C 193178290 KJNAWESHODPYSV-LLVKDONJSA-N 389.456 2.832 0 50 GFAA O=C(NCc1cnc2ccccn12)[C@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12301005 NYLPKSQSYYZDTO-INIZCTEOSA-N 380.423 2.528 0 50 GFAA CCN(CC)C(=O)c1cn(C2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nn1 14983328 QLMOBQLYUABIJV-UHFFFAOYSA-N 398.511 2.556 0 50 GFAA Cc1cc(CNC(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)ncc1Br 1857531514 KHEOUAOIHFZPLU-ZJUUUORDSA-N 379.258 2.828 0 50 GFAA CC[C@@]1(C(=O)N2CCOCC2)C[C@@H]2CC[C@H]1N2Cc1ccc(F)cc1OC 1857672974 KSUHDRLKSKKYES-FBBABVLZSA-N 376.472 2.826 0 50 GFAA CCn1nc(CC(N)=O)nc1[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857738396 GISDFYWTGOCNQU-LLVKDONJSA-N 388.859 2.504 0 50 GFAA Cc1nc(N2CCc3nocc3C2)c2c(n1)[C@@]1(CCCN(C(=O)C3CC3)C1)CC2 1875249115 IPJUTWHWJQYEQJ-QFIPXVFZSA-N 393.491 2.552 0 50 GFAA NC(=O)COc1ccccc1C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 126510510 JHYGOSCNXRLAAU-CQSZACIVSA-N 387.867 2.603 0 50 GFAA O=S(=O)(N[C@H]1CCCN(c2ccccc2F)C1)c1cccc2c1OCCO2 134947358 QJAVXASZCDRNLL-AWEZNQCLSA-N 392.452 2.544 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC3(CCOC3=O)CC2)sc1Br 371856685 WHDOJJBNIXYOCS-UHFFFAOYSA-N 394.312 2.537 0 50 GFAA Cc1ccc(C(=O)NCC(=O)OCc2nnc(-c3ccc(F)cc3)o2)cc1C 2325704196 FVJBYWYZTFKJSJ-UHFFFAOYSA-N 383.379 2.966 0 50 GFAA CC[C@H]1CN(C)c2ccccc2CN1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 2325730292 NWXLJRXGVGFQNM-PMACEKPBSA-N 395.503 2.529 0 50 GFAA Cc1cc(N2CCN(C(=O)NCCc3cccc4cc[nH]c34)CC2)nc(C)n1 2325738522 SATUYMQKZVGXPL-UHFFFAOYSA-N 378.480 2.649 0 50 GFAA CCOC(=O)Cc1nc(-c2ccc([C@H](C)NS(C)(=O)=O)cc2)sc1C 2325789485 SMMRJLDFBJVPTQ-NSHDSACASA-N 382.507 2.834 0 50 GFAA COC(=O)c1cc(=NC(=O)N2CCC[C@@H](Cc3ccc(Cl)cc3)C2)[nH]n1C 2325818936 HGJKWZZXUYFLSD-AWEZNQCLSA-N 390.871 2.769 0 50 GFAA CCOC(=O)N1CCN(C(=O)COc2cc(C)c(Br)cc2C)CC1 2881107 KYZXLNDHMVJWDG-UHFFFAOYSA-N 399.285 2.745 0 50 GFAA CC(=O)N[C@H](NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl 4017711 XWORNBALBISVMB-SNVBAGLBSA-N 384.672 2.504 0 50 GFAA C[C@H](O)CN1CCN(C(=O)[C@H](C)Sc2nc3ccccc3s2)[C@H](C)C1 225427427 GBTOFXCRADURRN-RDBSUJKOSA-N 379.551 2.690 0 50 GFAA CCN1CCN(CC(=O)N2CCC[C@@H](CCc3ccc(F)cc3F)C2)CC1 20538144 ZTUNZOWNVYRTQI-KRWDZBQOSA-N 379.495 2.774 0 50 GFAA COc1cccc(CN2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c1 20274286 ZYBUCVGICQPZBT-UHFFFAOYSA-N 386.926 2.917 0 50 GFAA O=C(CCN1CCC[C@H](c2nc(-c3cccnc3)no2)C1)NCc1ccco1 65398200 YFAPACVJZMBWCN-INIZCTEOSA-N 381.436 2.611 0 50 GFAA COc1cc(NC(=O)c2cccnc2)c(OC)cc1NC(=O)c1cccnc1 23634231 PTVYTSXOPBZXER-UHFFFAOYSA-N 378.388 2.998 0 50 GFAA O=S(=O)(c1ccc(F)c(F)c1)N1CCN(C/C=C/c2ccccc2)CC1 20508763 OVFBCEVCWLMWDM-QPJJXVBHSA-N 378.444 2.985 0 50 GFAA COc1ccc(OCc2ccc(-c3nc4c5cnn(C)c5ncn4n3)o2)cc1 2802488 XFQMTNDSJAFLPI-UHFFFAOYSA-N 376.376 2.859 0 50 GFAA CN(Cc1ncc[nH]1)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71761498 GOFFBSYCOJJRTJ-QHCPKHFHSA-N 388.471 2.915 0 50 GFAA CCn1c([C@H]2OCC[C@H]2C)nn(Cc2cccc(C(=O)N3CCCCC3)c2)c1=O 328631591 KSIZKUGEUADENH-APWZRJJASA-N 398.507 2.837 0 50 GFAA Cn1c(CCC(=O)N2CC[C@H](Cc3ccc(C(=O)O)cc3)C2)nc2cccnc21 72410965 BXECFUJQJQXYSF-MRXNPFEDSA-N 392.459 2.690 0 50 GFAA CC(C)CCN1CC2(CCN(C(=O)CCN3C[C@@H]4CC[C@H]3C4)CC2)OC1=O 77505185 YTKJNVTZNJNHOX-MSOLQXFVSA-N 377.529 2.720 0 50 GFAA CC[C@]1(C)Oc2ccc(NC(=O)C(=O)N[C@H]3CCN(c4ccccc4)C3)cc2O1 443734626 RPTFSEHIJBPOAN-KSFYIVLOSA-N 395.459 2.918 0 50 GFAA C[C@@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@H](O)c1ccc(F)cc1 173610624 CRRVETGCYCYTDU-KUHUBIRLSA-N 383.427 2.904 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 173771068 VIIBQWLASQMVEQ-KPZWWZAWSA-N 378.467 2.913 0 50 GFAA Cc1nc2c(c(C)c1CCC(=O)N1CCC[C@H](C(F)(F)F)C1)c(=O)[nH]n2C 173783107 ZZDULYDADCDIJL-LBPRGKRZSA-N 384.402 2.612 0 50 GFAA Cc1nn(-c2ccc(C(=O)N(C)C[C@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237239814 IUZJLCKBOZSOIL-GOSISDBHSA-N 385.464 2.757 0 50 GFAA O=C([C@H]1Cc2ccccc2CN1)N1CCN(c2nc3ccccc3s2)CC1 72453907 IMANTWSGHVATHH-GOSISDBHSA-N 378.501 2.659 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCCN(C(=O)c2ccccc2S[C@@H](C)C(=O)O)C1 262393092 AQTUIKCYOIQPBK-GJZGRUSLSA-N 392.521 2.876 0 50 GFAA CCNC(=O)C[C@@H]1CCCCN1C(=O)C1CCN(Cc2csc(C)n2)CC1 375989817 JMPVHSJUWJVREO-SFHVURJKSA-N 392.569 2.571 0 50 GFAA COc1cc(OC)cc(C(=O)NCCNc2nc(C)cc(N3CCCCC3)n2)c1 82230467 HZABQZXXNSYGSH-UHFFFAOYSA-N 399.495 2.634 0 50 GFAA O=C(c1cc(=O)[nH]c2ccccc12)N1CCC2(CC1)Nc1ccccc1NC2=O 82167075 XOAGWOJFBHDLDQ-UHFFFAOYSA-N 388.427 2.567 0 50 GFAA CO[C@@H]1CC[C@@]2(OC)CCN(Cc3ccc(Sc4nncn4C)o3)[C@H]2C1 426401653 FCKSLIHBHPJQPS-QIIPPGSGSA-N 378.498 2.718 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@H]4CCCN4)csc3C2)nc1 426707153 GSQRHTYZCNDHAP-MRXNPFEDSA-N 384.549 2.746 0 50 GFAA CCn1ncc(C(=O)N2CCC(c3nccn3Cc3cccnc3)CC2)c1C 91745173 RRJBBELCUGTCTC-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA CN(C)[C@H](C(=O)NC1CCN(c2ccc(Cl)nn2)CC1)c1ccccc1F 91289503 JWXMMPHSENWMFV-SFHVURJKSA-N 391.878 2.657 0 50 GFAA CCC1CCN(C(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCCO3)cc2)CC1 91859221 IPTHENIBMXNVBD-GOSISDBHSA-N 394.537 2.796 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1)c1ccccc1 181316363 TVZUYRFDCXMZHY-GOSISDBHSA-N 389.459 2.608 0 50 GFAA CCOc1ccc(C(F)(F)F)cc1NC(=O)N1CCN([C@@H]2CCNC2)CC1 299756726 DXYRZRPCEWHHRI-CQSZACIVSA-N 386.418 2.616 0 50 GFAA CN(C)C(=O)CCc1ccccc1NC(=O)N1CCC[C@H](c2ccncn2)C1 299764142 UISVGSKKWYDPKO-KRWDZBQOSA-N 381.480 2.909 0 50 GFAA COc1cccc(-c2ccccc2NC(=O)N2CCN([C@H]3CCNC3)CC2)c1 299784177 LJJRLUHTYFHUKR-SFHVURJKSA-N 380.492 2.874 0 50 GFAA COc1ccc(CN(Cc2cccc(F)c2)C(=O)CCS(C)(=O)=O)cc1 824668724 BZQUPVCTCJMEDZ-UHFFFAOYSA-N 379.453 2.798 0 50 GFAA COc1cccc(C(=O)N2CCN(Cc3cnn(-c4cccc(F)c4)c3)CC2)c1 670446682 ACOMRMKEDXCNEG-UHFFFAOYSA-N 394.450 2.978 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)N2CCc3[nH]nc(C(F)(F)F)c3C2)c2ccccc21 1875264211 GDVIMLUHRCHHGT-LLVKDONJSA-N 394.353 2.683 0 50 GFAA Cc1ccc(OC2CCN(c3ccc(C(=O)N4CCOCC4)cn3)CC2)cc1 881991900 WYXVVSZIVBEUDW-UHFFFAOYSA-N 381.476 2.910 0 50 GFAA CCc1noc(C)c1-c1noc([C@H]2CCC(=O)N(C3CC3)[C@@H]2c2nccn2C)n1 888094182 CYVOZKRSWLBEEP-GUYCJALGSA-N 396.451 2.939 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccn2)C[C@@H]1O)C1(c2ccccc2)CCCC1 1565509810 CSQVLZDVGSEICY-SFTDATJTSA-N 379.504 2.645 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2ccc3ccc(Cl)cc3n2)C1 275757007 RFLTUKDGVHZXJG-OAHLLOKOSA-N 396.882 2.607 0 50 GFAA O=C(Nc1cccc2ocnc12)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 170610451 XZBGUPBXAGFIFN-LBPRGKRZSA-N 379.372 2.591 0 50 GFAA Cc1ncc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c(C(C)C)n1 188149922 WHLOUFZBZWHDHD-QFIPXVFZSA-N 382.508 2.617 0 50 GFAA CC[C@H]1C=CCN1C(=O)Cn1nnnc1C1(NCc2ccccc2)CCCCC1 1506419914 ZRROJPLHZSZOGP-IBGZPJMESA-N 394.523 2.799 0 50 GFAA CCn1ncc(CNS(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)c1C 1506417426 IJGIWAGCDVVCDX-UHFFFAOYSA-N 379.511 2.758 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)CCc3n[nH]c4c3CCCC4)C1)CC2 1704337864 FZTAWKBWBDGMHE-QFIPXVFZSA-N 379.508 2.826 0 50 GFAA Cc1ccsc1C(=O)N1CCCN(C(=O)Cc2cn3ccsc3n2)CC1 1772708513 DHISWNFNWLFWSZ-UHFFFAOYSA-N 388.518 2.683 0 50 GFAA COc1cccc(CN2C[C@@H]3CN(C(=O)Nc4ccccc4C)C[C@@]3(CO)C2)c1 1772816572 VTXKEJKZFYDPOF-AUSIDOKSSA-N 395.503 2.962 0 50 GFAA CN(CCCC1CCCC1)Cc1cnc(S(C)(=O)=O)n1C[C@@H]1CCCO1 11936030 GUGADLZVHBRRDL-SFHVURJKSA-N 383.558 2.868 0 50 GFAA Cc1c(C(=O)N[C@H](C)Cc2cccnc2)cnn1-c1nccc(-c2cccnc2)n1 12040898 WACPCBUOLICJBS-OAHLLOKOSA-N 399.458 2.789 0 50 GFAA Cc1nn(C)cc1CNCc1c(C(=O)N2CCCCC2)nc2c(C)cccn12 13637135 FYFBDERHNGTKSD-UHFFFAOYSA-N 380.496 2.601 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2C(=O)c2ccncc2F)s1)N1CCOCC1 19114212 DJROVYIAXQMNRA-HNNXBMFYSA-N 389.452 2.732 0 50 GFAA CO[C@@H]1CN(Cc2ccc(OC(F)F)cc2)CC(=O)N(Cc2cccnc2)C1 19145905 HCLHYFIKMCCAFA-GOSISDBHSA-N 391.418 2.542 0 50 GFAA O=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1ccc(F)cc1 169781052 BBZBQOQLUIHIOL-UHFFFAOYSA-N 394.381 2.871 0 50 GFAA Cc1ccc2oc(N3CCC(c4nc(C)nn4-c4ccnn4C)CC3)nc2n1 1857671261 CDOUECULRAAFTR-UHFFFAOYSA-N 378.440 2.538 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(Cc2cnc[nH]2)CC1)N1CCCC1 1857688476 LQZUOXUVLAUYOA-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA O=C([C@H]1CC[C@@H](O)[C@H](NC2Cc3ccccc3C2)C1)N1CCC(F)(F)CC1 1857693971 VHMKAVHHUMLNNN-QXAKKESOSA-N 378.463 2.531 0 50 GFAA COC1(C(=O)NC(C)C)CCN(C(=O)c2cnc(C)nc2-c2ccccc2)CC1 1857701093 PHPMFJNUBAFERX-UHFFFAOYSA-N 396.491 2.598 0 50 GFAA O=S(=O)(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1ccccc1 1857713014 RTRHJEXIPVJJAM-ZIFCJYIRSA-N 392.908 2.833 0 50 GFAA CC[C@@]1(C(=O)NCCc2cccnc2)C[C@@H]2CC[C@H]1N2Cc1ccnc(OC)c1 1857723350 BTMBULNJMJOJIY-MIZPHKNDSA-N 394.519 2.977 0 50 GFAA Cn1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)n[nH]2)c(C(F)(F)F)n1 820148880 FZTNNHMSMRUNRX-UHFFFAOYSA-N 398.776 2.850 0 50 GFAA CCc1cccc(C)c1N1C[C@@H](C(=O)N(C)[C@H]2C[C@H]3C[C@@H](O)C[C@H]3C2)CC1=O 2100539595 PEOQJAKSFDHMAH-LJDSDSDDSA-N 384.520 2.918 0 50 GFAA O=C(CCc1ccc2ccccc2n1)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785689 JDPAJZFZPOMVHK-VHKYSDTDSA-N 398.894 2.973 0 50 GFAA Cc1ccc(C(=O)Nc2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCCC1 1058190 ALXPYDHLXBGYHF-UHFFFAOYSA-N 388.445 2.761 0 50 GFAA COc1cc(-c2ccc(S(=O)(=O)NCc3ccccc3)cc2)c(=N)[nH]c1C 2356136076 FZPGOOGMWVJAGT-UHFFFAOYSA-N 383.473 2.957 0 50 GFAA Cc1ccc(C(=O)N[C@@]2(C(F)(F)F)N=C(c3ccccc3F)NC2=O)cc1 2863645 SZBQOQOLJQMUFK-KRWDZBQOSA-N 379.313 2.699 0 50 GFAA O=C(O)c1ccc(CN2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1 2356166707 KJFLWYHZSBJWGQ-WOIUINJBSA-N 386.492 2.645 0 50 GFAA CN1CCN(C)[C@@H](CNC(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)C1 108404529 AUAVVJMBHUFSQM-KRWDZBQOSA-N 378.480 2.597 0 50 GFAA C[C@@](O)(CNC(=O)[C@@H](C1CC1)N1CCCC1)c1ccccc1Br 225623109 YIUUSSPKVBATOI-SJLPKXTDSA-N 381.314 2.647 0 50 GFAA C[C@H]1CN(C(=O)CCNC(=O)c2ccc3ccccc3c2)CC2(CCOCC2)O1 225736864 KMKGZUMTKAJADS-KRWDZBQOSA-N 396.487 2.756 0 50 GFAA O=C(c1cc2ccccc2o1)N1CCN(C(=O)[C@H]2COc3ccccc3O2)CC1 9305336 BEUOLPAGIJCHIE-HXUWFJFHSA-N 392.411 2.557 0 50 GFAA biogenic CN(Cc1cccc2cnccc12)C(=O)[C@@H]1C[C@@H](NC(=O)CC2CCCC2)CN1 67472824 AZBHOWJGXDUEFC-CTNGQTDRSA-N 394.519 2.620 0 50 GFAA CN(Cc1cc(-c2ccncc2)no1)C1CCN(C(=O)c2ccccn2)CC1 67955103 UVHMJRHMEUHFQC-UHFFFAOYSA-N 377.448 2.868 0 50 GFAA O=C(CN1CC[C@H]2CCCC[C@H]2C1)N1CCN(C(=O)c2cccs2)CC1 252444166 HRCLUERWVYXEJP-SJORKVTESA-N 375.538 2.545 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2nc(O)cc(C(F)(F)F)n2)n1C 328630721 JQAQKYMWKHNLNJ-LBPRGKRZSA-N 397.401 2.626 0 50 GFAA CN(Cc1cn2c(n1)CCCC2)S(=O)(=O)c1sccc1Br 328618895 FDDRPGZMHMOUBE-UHFFFAOYSA-N 390.328 2.864 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)Nn3c(S)nc4ccccc4c3=O)o2)n1 2792281 CWGFNBVBICKDIE-UHFFFAOYSA-N 395.444 2.524 0 50 GFAA COc1cccc([C@@H]2C[C@H](O)CN2C(=O)NCc2ccc3c(c2)OCCCO3)c1 282117258 GBODIUOQNHDLKX-HKUYNNGSSA-N 398.459 2.874 0 50 GFAA CC1=NN(C(=O)c2ccc(Cn3nc(C)c(Cl)c3C)o2)[C@@](O)(C(F)F)C1 6526493 QCFQATGASYHWIW-INIZCTEOSA-N 386.786 2.970 0 50 GFAA Cc1ccc(O[C@H](C)C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cc1 6701741 TZAHBPOUNPTUMM-QGZVFWFLSA-N 381.476 2.789 0 50 GFAA CCOC(=O)c1coc(N2C[C@@H](c3ccccc3OC)[C@@H]3[C@H]2C2CCN3CC2)n1 72151150 AFXASWZZMNGNGX-PWIZWCRZSA-N 397.475 2.927 0 50 GFAA C[C@@H](NC(=O)CC1CCCCC1)C(=O)NC1CCN(Cc2ccccn2)CC1 153874479 NBENJIZEHDUKCO-QGZVFWFLSA-N 386.540 2.637 0 50 GFAA CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)c2cc(-n3cccc3)ccn2)nn1 366019853 YSEFRDVJDOCJLS-FUHWJXTLSA-N 394.479 2.605 0 50 GFAA CC[C@@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@H](N3CCCC3)C2)c1 127934795 NJARJGOTZTZYBS-XLIONFOSSA-N 386.540 2.985 0 50 GFAA C[C@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)[C@H]1CN 237654801 CKJOTKLGBKGPJD-JXFKEZNVSA-N 386.517 2.860 0 50 GFAA NCc1ccc(-c2noc([C@H]3CCCN3S(=O)(=O)c3cccs3)n2)cc1 261999378 LEGBGGMJOCOLBF-CQSZACIVSA-N 390.490 2.783 0 50 GFAA CCSCCC(=O)N1CCC[C@]2(CCC(=O)N(Cc3ccccn3)C2)C1 72406854 RKGKYHKBEJJUHX-FQEVSTJZSA-N 375.538 2.956 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)nc1)N1CCOC[C@H]1c1ccc(F)cc1 454466233 LUUALUPELSCYMQ-SFHVURJKSA-N 386.427 2.663 0 50 GFAA Cn1ncc2c(N3CCCN(C(=O)c4ccco4)CC3)nc(C(C)(C)C)nc21 72167114 VLUMABIZENBBSW-UHFFFAOYSA-N 382.468 2.606 0 50 GFAA Cc1noc(C)c1CO[C@@H]1COCC[C@H]1NC(=O)c1cc2sccc2[nH]1 222578096 VSWYCXKXHWLTMO-CZUORRHYSA-N 375.450 2.938 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)ccn1 291380842 SLJQODZHXJGCPR-JOCHJYFZSA-N 396.491 2.633 0 50 GFAA COc1cc(Cl)c(CN2C[C@H](N(C)C)C[C@H]2C(=O)O)c(Cl)c1OC 97655353 NGXXUDLUYNPKKI-SKDRFNHKSA-N 377.268 2.600 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC3(CCC(=O)N(C4CC4)C3)CC2)cc1C 91425381 MPGYTCBQWXXAIM-UHFFFAOYSA-N 376.522 2.859 0 50 GFAA Cc1cc(N2CCC(n3cc(CN4CC[C@H](O)C4)nn3)CC2)c2ccccc2n1 23542770 UHAMHZGCXMPSMK-IBGZPJMESA-N 392.507 2.543 0 50 GFAA CCC(CC)NC(=O)c1cccc(S(=O)(=O)NCCc2cscn2)c1 95383793 OMLJWYRHXVWKKQ-UHFFFAOYSA-N 381.523 2.583 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(C(=O)N3CCCC3)CC2)cc1Cl 95376335 KYZMZQMQSKVHCN-KRWDZBQOSA-N 380.872 2.809 0 50 GFAA O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)Nc1n[nH]c(C2CCCCC2)n1 252571491 YAZUYKINOCVCME-CQSZACIVSA-N 382.424 2.581 0 50 GFAA COC(=O)c1cn([C@@H]2C[C@@H](C(F)(F)F)Oc3ccccc32)cc2c(=O)[nH]nc1-2 263588869 ZJBIPBGXBCBAMV-OCCSQVGLSA-N 393.321 2.766 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NC2Cc3ccccc3C2)CN1Cc1cccc(Cl)c1 299769127 NECVHGSGDTWSID-RTWAWAEBSA-N 383.923 2.786 0 50 GFAA O=C(NCCc1nc(C2CC2)no1)N1CCC([C@H](O)c2cccs2)CC1 584891344 BOTDFLLWNKMYNH-INIZCTEOSA-N 376.482 2.706 0 50 GFAA COc1ccccc1N1C[C@H](NC(=O)N(C)C2Cc3ccccc3C2)CC1=O 584903664 GKCKSNWYCIVVJQ-QGZVFWFLSA-N 379.460 2.609 0 50 GFAA C[C@H](CC(=O)N1CC[C@H](C(F)(F)F)[C@H](CO)C1)NC(=O)Nc1ccccc1 1875256682 RUJYQNFALJJLKP-IPYPFGDCSA-N 387.402 2.606 0 50 GFAA COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)c2cc(C(F)(F)F)nn2C2CC2)C1 1875311007 JDJYEWCRMHXJIP-WDEREUQCSA-N 388.390 2.834 0 50 GFAA CCc1nc(=N[C@@H]2CCN(C(=O)c3cncnc3C(C)C)C[C@@H]2CC)s[nH]1 1875302145 BMSMXQICDKZPIZ-DZGCQCFKSA-N 388.541 2.789 0 50 GFAA Cc1occ(C(F)(F)F)c1CC(=O)N1CC[C@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401081 FCSKHBWYPISIJX-QMTHXVAHSA-N 384.358 2.973 0 50 GFAA Cc1cc2nc(C(=O)N3CCC[C@H]3c3nc(-c4ccncc4)no3)cc(C)n2n1 952968197 OYRZJLPPRQRWGG-INIZCTEOSA-N 389.419 2.768 0 50 GFAA Cn1nnc2c(C(=O)N[C@H](c3c(F)cc(F)cc3F)C(F)(F)F)ccnc21 888090916 IBTAMKRPWWYLPT-GFCCVEGCSA-N 389.259 2.814 0 50 GFAA Cc1ccc(-n2nnc(C(=O)Nc3ccc(F)cc3C(=O)N(C)C)c2C)cc1 170596820 ZATIHPSUFGEURS-UHFFFAOYSA-N 381.411 2.977 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)NCCN3CCc4ccccc43)o2)c1C 1506415664 ASCUTLDFOAKURK-UHFFFAOYSA-N 387.461 2.892 0 50 GFAA COc1ccc(CCNC(=O)CN2CCCOc3c(cccc3OC)C2)cc1 1506399938 RQDUNLKSICVMAJ-UHFFFAOYSA-N 384.476 2.647 0 50 GFAA CCc1ccccc1C(=O)N1C[C@@H]2CN(CCCn3cccc3)C[C@@]2(CO)C1 1772709792 NKEYOLDFKKSRPQ-REWPJTCUSA-N 381.520 2.507 0 50 GFAA CCCC(=O)N1C[C@@H]2CN(Cc3ccccc3-n3nc(C)cc3C)C[C@]2(CO)C1 1772709370 OZSYGOLMNNFZNH-NZQKXSOJSA-N 396.535 2.542 0 50 GFAA CC(C)c1nc(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)no1 11874028 DACIOYFJHNFNHX-CQSZACIVSA-N 390.871 2.901 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@@H]1CCCN(CCc2ccccc2)C1 12455765 GGGHOPMTJQJVRR-JOCHJYFZSA-N 393.531 2.704 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)CN2CCCC2=O)C1 12716831 UKRMGCZQVGQYKZ-CQSZACIVSA-N 382.382 2.749 0 50 GFAA COCCN(C)C(=O)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 12760056 OFJRNNPJYYXOMX-UHFFFAOYSA-N 394.519 2.954 0 50 GFAA Cc1cccc(C)c1C(=O)N1CCC(N2CCC[C@@H](C(=O)NC3CC3)C2)CC1 14978885 BUOVIOTZEPYDPC-GOSISDBHSA-N 383.536 2.899 0 50 GFAA C[C@@H]1CCCN(C(=O)[C@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)C1 15067024 DTCYGQKHTLNRBP-DGCLKSJQSA-N 375.494 2.885 0 50 GFAA CCn1c(SCC(=O)NC[C@H]2CCCO2)nnc1-c1c[nH]c2ccccc12 17730960 DKXXRPQMNVGOAQ-CYBMUJFWSA-N 385.493 2.834 0 50 GFAA C[C@@H](NC(=O)C1(N(C)Cc2ccccc2)Cc2ccccc2C1)c1ncn[nH]1 19836667 IHPPBXRJYCGURC-MRXNPFEDSA-N 375.476 2.652 0 50 GFAA CCNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)c1c(C)c(C)nn1C 1857678982 OWOGAQRXMNQYLT-YCRNBWNJSA-N 394.519 2.779 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(S(=O)(=O)C1CC1)C2)c1csc2ccccc12 1857683964 SXYWHOBOSOVYAK-MCBXIFIFSA-N 390.530 2.834 0 50 GFAA CCOC(=O)c1cccnc1N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857694892 ZEKJQTVFFOURAL-NRFANRHFSA-N 381.432 2.512 0 50 GFAA COC(=O)N1CCCC[C@H]1C(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857698299 KNJCNJJQSCLLAF-IBGZPJMESA-N 396.491 2.635 0 50 GFAA Cc1ccsc1CN1C[C@@H]2[C@H](CNC(=O)c3ccncc3)[C@H]3CC[C@]2(C1)O3 1857715036 YIPOWVXRQDEWRV-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3ccc(C(F)(F)F)cc3)C[C@H]2CO1 1857729382 YMWHXVKUNLQPDC-ULQDDVLXSA-N 381.398 2.966 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1CC[C@@]23OC[C@@H](C(C)C)N2C(=O)C[C@@H]13 1857733600 QKTXTLXZPGVBQR-GMBSWORKSA-N 378.856 2.547 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCc4nccs4)CC3=O)sc2c1 1857740240 JXELBRKFVYULKF-GFCCVEGCSA-N 386.502 2.773 0 50 GFAA Cc1c(C(=O)N2CC[C@H](N)C[C@H]2C)cnn1-c1cccc(Br)c1 237499568 JHEZJMHQFSVDED-RISCZKNCSA-N 377.286 2.895 0 50 GFAA CCOC(=O)c1nn(Cc2ccncc2)c2c1CN(Cc1cccc(O)c1)CC2 14533875 BSRXTHUXYRQPPQ-UHFFFAOYSA-N 392.459 2.767 0 50 GFAA CCOCCCC(=O)Nc1ccc(S(=O)(=O)Nc2nnc(CC)s2)cc1 798258125 RLCQOQIYBFUPKK-UHFFFAOYSA-N 398.510 2.657 0 50 GFAA CCOc1cc(CNC(=O)C2CCN(C(=O)N3CCCC3)CC2)ccc1OC 265032242 DWZASSLPALGHJK-UHFFFAOYSA-N 389.496 2.638 0 50 GFAA CC1(c2ccccc2)CN(C(=O)[C@H](Cc2cnc[nH]2)NC(=O)C2CCCCC2)C1 912823431 JMMFEWRKVNILTR-FQEVSTJZSA-N 394.519 2.817 0 50 GFAA CCOC(=O)Cc1nnc(NC(=O)[C@@H](CC)Sc2nc(C)cc(C)n2)s1 2601423 ITPCQOIMWDURQN-LLVKDONJSA-N 395.510 2.560 0 50 GFAA O=C1O[C@@H](CSc2ncc(Cc3ccccc3)c(O)n2)CC12CCOCC2 2325787965 DQHRLKPTDRXPLZ-MRXNPFEDSA-N 386.473 2.977 0 50 GFAA Cn1c(CC(=O)N2C[C@H](CCN)Cc3ccccc32)nnc1-c1ccccc1 2325795233 RVMGMCWMBUPBPQ-MRXNPFEDSA-N 375.476 2.579 0 50 GFAA C[C@@H](NC(=O)c1cnc(CN)nc1C(F)(F)F)c1cccc2cccnc12 2325856967 KJFWRIRFDOJMEQ-SNVBAGLBSA-N 375.354 2.993 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3oc(-c4ccccc4Cl)nc3c2)C(=O)N1 1857798235 WVAWQCROFPPIPF-ZDUSSCGKSA-N 383.791 2.683 0 50 GFAA COc1cccc(N(CC(=O)NC2CCCC2)S(=O)(=O)c2ccccc2)c1 821319 BIAWHVQCLVVESI-UHFFFAOYSA-N 388.489 2.949 0 50 GFAA Cc1c(NC(=S)NC(=O)CCc2ccccc2)c(=O)n(-c2ccccc2)n1C 1126149 SMKWLDBDXYWCPR-UHFFFAOYSA-N 394.500 2.930 0 50 GFAA COC(=O)C1=C(C)N=C2S[C@H](C)C(=O)N2[C@H]1c1ccc(OC)c(OC)c1 2254233 MMELZDSVMIBFNE-BMIGLBTASA-N 376.434 2.525 0 50 GFAA COc1cccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c1 2868977 UYCSXWHNIVJWTO-AWEZNQCLSA-N 392.452 2.874 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCCCCC1 2888889 WHWSRCAQSNPCNS-UHFFFAOYSA-N 380.510 2.643 0 50 GFAA CCCC[C@H](NC(=O)[C@@H](CCC)NC(=O)OCc1ccccc1)C(=O)OC 4764484 BNYZLPWEUVICEG-SJORKVTESA-N 378.469 2.930 0 50 GFAA Cc1cccc(C(=O)Nc2ccc3c(c2)nc(CCN2CCN(C)CC2)n3C)c1 22939880 FGAAJXLZAJEEKW-UHFFFAOYSA-N 391.519 2.924 0 50 GFAA OCC[C@H]1CN(Cc2cccc3nccnc23)CCN1Cc1ccc(F)c(F)c1 20500119 RGIHQPNXDXVYNX-SFHVURJKSA-N 398.457 2.977 0 50 GFAA CC(C)(C)C(=O)N1CCC(O)(CS(=O)(=O)Cc2ccc(Cl)cc2)CC1 6262525 BQPWKZINBIRUHT-UHFFFAOYSA-N 387.929 2.654 0 50 GFAA CC1CCN(C(=O)C2CCN([C@@H](C)c3nc4ccccc4c(=O)[nH]3)CC2)CC1 172174510 MUDOTAFGCJXUHU-INIZCTEOSA-N 382.508 2.955 0 50 GFAA COc1ccc(-c2noc(-c3ccc(N[C@H]4CCCCNC4=O)nc3)n2)cc1 39490358 YSUBNVIVXHXVQR-INIZCTEOSA-N 379.420 2.888 0 50 GFAA CN1CCC[C@H]1[C@@H]1CCCN1C(=O)NCC1CCN(CC(F)(F)F)CC1 364009120 ZPTRZXSZYKCPRS-HOTGVXAUSA-N 376.467 2.529 0 50 GFAA COc1ccc2cc([C@@H]3CN(Cc4cc5n(n4)CCNC5)CCO3)ccc2c1 72145076 LNLVOKGIPTWDQZ-QFIPXVFZSA-N 378.476 2.722 0 50 GFAA CC(C)n1nc(C(=O)N2CCN(c3cccc(O)c3)CC2)c2ccccc2c1=O 153088535 CJIMVCMAOQBDLL-UHFFFAOYSA-N 392.459 2.645 0 50 GFAA C[C@H](c1noc(C2(N3CCCCC3)Cc3ccccc3C2)n1)N1CCOCC1 72147787 VMZNXWFOFNCNKP-QGZVFWFLSA-N 382.508 2.943 0 50 GFAA O=C(Cc1csc(NC(=O)c2cccs2)n1)N[C@@H]1c2ccccc2C[C@@H]1O 131183386 FHVATDKXBKYHFH-WMLDXEAASA-N 399.497 2.774 0 50 GFAA O=C(N[C@@H]1CCNC[C@H]1O)c1cccc(-c2ccc(OC(F)(F)F)cc2)c1 77303333 HUGODTKIHGCEKX-IAGOWNOFSA-N 380.366 2.705 0 50 GFAA C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@H]1CCSc3ccccc31)C2=O 241121824 JEDCPVROQNFRNF-AFBRZQFHSA-N 387.505 2.840 0 50 GFAA C[C@H]1CN(S(=O)(=O)C2CCC(C(F)(F)F)CC2)C[C@]2(CCCOC2)O1 333458627 UANUYKYNPRMJCH-PPWQZUPISA-N 385.448 2.707 0 50 GFAA CCOc1cc(C)nc(N2CCN(C(=O)c3coc(-c4ccccc4)n3)CC2)n1 159168972 YPODISUXBDYUDU-UHFFFAOYSA-N 393.447 2.801 0 50 GFAA Cc1cccc(CN(C(=O)C[C@H]2C(=O)NCCN2Cc2ccoc2)C(C)C)c1 72169585 GFDOWADQFWZPIM-FQEVSTJZSA-N 383.492 2.716 0 50 GFAA O=C(NC[C@@H](Cc1ccccc1)C(=O)O)c1cc(N2CCCC2=O)ccc1F 238193542 NUTOOCRXPFQZPG-OAHLLOKOSA-N 384.407 2.626 0 50 GFAA O=C(CN1CCCCCC1=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 222699852 HCHUROQLZHDNNO-CWZMJNCASA-N 381.476 2.566 0 50 GFAA Cc1c([C@@H](C)NC(=O)N2CCc3c(cccc3N3CCOC3=O)C2)cnn1C 175656713 VOZKAGPPWPYJJX-CYBMUJFWSA-N 383.452 2.514 0 50 GFAA CCCN1CCCn2nc(CNS(=O)(=O)c3cc(C)ccc3C)cc2C1 82170668 VPCUQFKHJVPYMQ-UHFFFAOYSA-N 376.526 2.594 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2CCCC[C@H]2C)c1C(=O)OC(C)C 17077997 KIUYQOZYNHWHAJ-LLVKDONJSA-N 381.498 2.534 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)N1CCC2(CC1)CNC(=O)C2)c1ccncc1 426443438 SVFGHKIJMLHJHS-FQEVSTJZSA-N 378.476 2.791 0 50 GFAA C[C@@H](Cc1cnccn1)NC(=O)N1CCC(c2nc3ccccc3n2C)CC1 426484839 QSXAZCSCGISKKI-HNNXBMFYSA-N 378.480 2.884 0 50 GFAA O=C(Cc1c[nH]cn1)N1CCC(CCC(=O)N2CCc3ccccc3C2)CC1 95510850 LNAYTMUWWLSEAZ-UHFFFAOYSA-N 380.492 2.556 0 50 GFAA NC(=O)COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(CC2CCC2)C3)cc1Cl 95372885 PZUNXVPACHYIOJ-ZWKOTPCHSA-N 391.943 2.900 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Nc1cccc(Cl)c1Cl 239425819 VHQHLRDEWOJBSN-FBWMKEJHSA-N 391.254 2.985 0 50 GFAA COc1ccc(CN(C)C2CCSCC2)c(OC[C@@H](O)CN2CCCC2)c1 95525843 NVRIWTPWTWOBOB-IBGZPJMESA-N 394.581 2.858 0 50 GFAA Cc1cc(C(=O)N(C)C[C@H]2CCCN(CCc3ccc(F)cc3)C2)cc(=O)[nH]1 95528548 OEIYBYHZQYRVAI-GOSISDBHSA-N 385.483 2.849 0 50 GFAA Cn1c(O)nc(=O)c2cc(C(=O)N[C@H]3CCCc4sc(Cl)cc43)cnc21 293802265 XTKDRVYGPYVJIA-NSHDSACASA-N 390.852 2.556 0 50 GFAA Cc1cc(C(=O)N2CC[C@]3(CCCN(CCO)C3=O)C2)c(-c2ccccc2)o1 91664947 BISWBQFNLZVVSW-JOCHJYFZSA-N 382.460 2.702 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@@H](NCc2cc(F)cc(F)c2)CNC3=O)cc1 263618620 UQQILDAZXRLXMD-LJQANCHMSA-N 384.386 2.869 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N2CCN(c3ccc(C)cc3)CC2)c1 273220381 NNOCYNMEIPUZEF-UHFFFAOYSA-N 382.464 2.717 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3CCC(c4ccncn4)CC3)c2)nn1 299764180 XRVDYWRKBVWWFM-UHFFFAOYSA-N 375.432 2.962 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)Nc1ccccc1CN1CCOCC1 828075112 MDDMJNOQZGCGHA-UHFFFAOYSA-N 379.460 2.503 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2)c1ccc(-c2cc[nH]n2)cc1 670462641 SRYUHWUCGKNMTM-XFKLWTPLSA-N 389.463 2.541 0 50 GFAA C[C@@H](O)CN1CCN(C[C@@H](CN(C)Cc2ccccc2)c2ccccc2)CC1 864097583 XCCOOLFQKFXATP-ZJSXRUAMSA-N 381.564 2.901 0 50 GFAA CCOC(=O)[C@@H]1C[C@H]2C[C@@H]1C[C@H]2NC(=O)[C@H](N)c1ccccc1C(F)(F)F 1875292914 WPOPSKGMYVBYCR-DCXAKIHSSA-N 384.398 2.799 0 50 GFAA N[C@@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)n(-c3ccccc3)n2)C12CCOCC2 1875277851 KASREXQFQYTVFE-CABCVRRESA-N 394.397 2.517 0 50 GFAA Cc1ncc(C(F)(F)F)cc1C(=O)N=[S@@]1(=O)CCC[C@@]2(CCCN2)C1 1875393384 MAEFTDUCWAJMET-ODCWNRFASA-N 375.416 2.933 0 50 GFAA C=CC(=O)NC[C@@H](NC(=O)C(F)(F)c1cnccn1)c1ccc2ccccc2c1 1875386085 IQSGWHJWTFEFQE-QGZVFWFLSA-N 396.397 2.881 0 50 GFAA COc1ccc(NC(=O)c2ccc(N3CCOCC3)c(C)c2)cc1C(=O)N(C)C 952966055 GQUVRAGPHMJXQI-UHFFFAOYSA-N 397.475 2.794 0 50 GFAA C[C@@H]1Oc2ccccc2N(CC(=O)N[C@H](CCC(=O)O)c2ccccc2)C1=O 268899938 SGOIQINCQRITGG-GOEBONIOSA-N 382.416 2.523 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(F)ccc2NC(=O)[C@H]2C[C@H]2C)C1 165532769 VDFWEIAIOALKMS-NFAWXSAZSA-N 376.428 2.836 0 50 GFAA CC[C@@H](C(=O)OC)N(C)CC(=O)N1N=C(c2ccco2)C[C@H]1c1cccs1 170602760 FBZACFGNGIVXDE-GJZGRUSLSA-N 389.477 2.902 0 50 GFAA O=C(Nc1ccc(O[C@@H]2CCOC2)cc1)c1cnn(CCO)c1-c1ccccc1 170614643 RNDIVTJERPWNNJ-LJQANCHMSA-N 393.443 2.962 0 50 GFAA CCOc1ccc(NC(=O)N2CCC(CN3CCN(C)CC3)CC2)cc1OC 194541087 LBNZMCVTIORIFX-UHFFFAOYSA-N 390.528 2.585 0 50 GFAA CCCNc1ncc(CN2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)cn1 1529104044 KWZYQFSTIFBKSO-WIYYLYMNSA-N 377.492 2.882 0 50 GFAA Cc1nn2ncccc2c1C(=O)N1CCCN(c2nc3ccccc3s2)CC1 1775977342 FTTWDSKQZRZTRG-UHFFFAOYSA-N 392.488 3.000 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@@H](COc2ccccc2F)C1 1772804931 FDAUBOAICYAAQL-OAHLLOKOSA-N 389.427 2.582 0 50 GFAA COc1ccc(C(=O)N2CCN(c3ccc(Nc4cccnc4)nn3)CC2)cc1 11697633 YXARWXGDQSBSLZ-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(C(=O)c3ccncc3)CC2)O1)C1CCCCC1 12156310 XGHPKHDXCDMDSV-LJQANCHMSA-N 385.508 2.932 0 50 GFAA Cc1[nH]c2ccc(Cl)cc2c1CCNC(=O)c1cn(C[C@@H]2CCCO2)nn1 12701966 DLTWRJKNDVIIHL-AWEZNQCLSA-N 387.871 2.873 0 50 GFAA CCN(CC)C[C@H](O)COc1ccc(CN2CCC(COC)CC2)cc1OC 12712506 PYOJCSNPKOLBRG-FQEVSTJZSA-N 394.556 2.635 0 50 GFAA CC[C@@H](C(=O)NCc1cccnc1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712279 JDVFQMHAQQAULW-INIZCTEOSA-N 381.885 2.596 0 50 GFAA COc1ccc(CN2CCC[C@@H](n3cc(C(=O)N4CCCCC4)nn3)C2)cc1 15002472 XMQWFVRGXRIJOS-GOSISDBHSA-N 383.496 2.750 0 50 GFAA CCN(CC)c1ncccc1CNC(=O)CN1C[C@@H](c2ccccc2)CC1=O 19111181 GBGQKBPSJFVWHL-IBGZPJMESA-N 380.492 2.560 0 50 GFAA COC(=O)C[C@H](c1cccc(OC(F)F)c1)c1c(O)n2ccccc2nc1=O 205974103 VVMZNTZUOVERNI-CYBMUJFWSA-N 390.342 2.697 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N4CCCN(C)CC4)C3)nc2c1 1857699172 QGIAKYNPCGHVGL-MRXNPFEDSA-N 386.496 2.607 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCCCCO)C3)nc2c1 1857705989 FAIMADFGUXEXIW-HNNXBMFYSA-N 375.469 2.722 0 50 GFAA COCc1ccc(C(=O)NC[C@H]2[C@H]3CN(CCC(C)C)C[C@]34CC[C@H]2O4)o1 1857729749 RPGLGQSMXVCGEG-XKGFGPFHSA-N 376.497 2.681 0 50 GFAA CN(Cc1ncon1)C(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857731122 AFSYSTKVQLVOOY-LLVKDONJSA-N 375.816 2.739 0 50 GFAA CCC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@](CO)(c3ccccc3)C2)c1 225769025 XGFUFELVNCNYDK-JOCHJYFZSA-N 382.460 2.907 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N1CCC[C@H]2C(O)=NC[C@H]21 328695611 TWNUMXAEXCMHKN-JTNHKYCSSA-N 383.901 2.733 0 50 GFAA NC(=O)[C@@H](NC(=O)c1cc2c(s1)CCOC2)c1cccc(Br)c1 264004476 MABSICPZRBIWHN-AWEZNQCLSA-N 395.278 2.540 0 50 GFAA CCn1c(SCC(=O)NCCOc2ccccc2)nc2ccccc2c1=O 3000060 KSOYQNAPOKADDS-UHFFFAOYSA-N 383.473 2.704 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(Cc2cn(-c3ccccc3)nn2)CC1 2100473594 JFFCIABBRIKJEY-UHFFFAOYSA-N 376.464 2.551 0 50 GFAA CN(C[C@H]1CCc2ccccc21)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 2325761166 BZCLFQFRQSUQJX-CQSZACIVSA-N 399.472 2.606 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CCN[C@H](Cc4ccc(F)cc4)C3)cc2)n1C 2325774010 RCKUCGCVRMNODS-HXUWFJFHSA-N 393.466 2.586 0 50 GFAA C[C@@H]1CCn2ncc(C(=O)N[C@H](C(=O)O)c3ccc(F)c(Cl)c3F)c2C1 2325805632 YEBVNSBAQIOCSG-GLEZIHRCSA-N 383.782 2.953 0 50 GFAA CC1(C)SCCN(C(=O)[C@H]2CCn3c(cnc3-c3ccccc3)C2)[C@H]1CO 2325810886 MGQORYJJRQBNOA-WMZOPIPTSA-N 385.533 2.827 0 50 GFAA C[C@@H](NC(=O)C(=O)N(c1ccncc1)C1CCNCC1)c1cccc2cc[nH]c12 2325859393 XRRQJAAXKZCJGI-OAHLLOKOSA-N 391.475 2.525 0 50 GFAA O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1 664608 KWJITTXNVFJEAW-UHFFFAOYSA-N 376.331 2.762 0 50 GFAA COc1ccccc1O[C@@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 1103674 QNDSFIGEWQDEEJ-HNNXBMFYSA-N 381.432 2.899 0 50 GFAA COc1ccc(OC[C@@H](O)CN(C)C(=O)c2ccc(Br)cc2)cc1 1134994 MSEWZXYUFWEVKN-HNNXBMFYSA-N 394.265 2.970 0 50 GFAA CN(CC(=O)Nc1ccc(Br)cc1)S(=O)(=O)c1ccccc1 1141685 MFEYUUGGQHTYPA-UHFFFAOYSA-N 383.267 2.708 0 50 GFAA Cc1c(C(=O)O)sc2nc(SCC(=O)NC3CCCCC3)[nH]c(=O)c12 2700718 QLCVEAXOOMTVCI-UHFFFAOYSA-N 381.479 2.532 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C(=O)c2c[nH]nc2C2CCCCC2)C1 2356159602 IUAHEUKIJKZWBK-NRFANRHFSA-N 380.496 2.780 0 50 GFAA CO[C@@H]1CC[C@@H]2OCCN(C(=O)CCc3nc(-c4cccs4)no3)[C@H]2C1 246231387 FUYOKUITOMSSFF-RDBSUJKOSA-N 377.466 2.526 0 50 GFAA COc1ccccc1NC(=O)c1nnn(-c2cccc(Br)c2)c1N 8991622 GTXDOHYDBYBGCV-UHFFFAOYSA-N 388.225 2.873 0 50 GFAA COc1ccc(OC)c(-c2nc(CN3CCN(c4cnccn4)CC3)c(C)o2)c1 55414933 PQGXKTOVYXQNHX-UHFFFAOYSA-N 395.463 2.779 0 50 GFAA Cc1ccc(-c2nnc(-c3ccc(C(=O)NCCN4CCOCC4)cc3)o2)cc1 248084667 KNSWOZZFGQFITH-UHFFFAOYSA-N 392.459 2.774 0 50 GFAA COc1ccc(OC)c(NC(=O)c2cnc3sc4c(n3c2=O)CCCC4)c1 10327397 FTVDZOSKDLVKBW-UHFFFAOYSA-N 385.445 2.904 0 50 GFAA COc1ccccc1[C@H]([C@H](O)C(=O)c1c[nH]c2ccccc12)N1CCN(C)CC1 23119752 TVHUIRWEOFXBRT-GGAORHGYSA-N 393.487 2.709 0 50 GFAA COc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20568008 LURXBNYVSCGDQU-INIZCTEOSA-N 398.459 2.536 0 50 GFAA Cc1cc(N2CCCCC2)nc(NCCNC(=O)c2c(F)cccc2F)n1 67601859 AWDNKGJFIWIEIH-UHFFFAOYSA-N 375.423 2.895 0 50 GFAA CC(C)CCc1cc(NC(=O)CS(=O)(=O)CCCc2ccccc2)n(C)n1 252508880 XWSUDRNIWSUMPW-UHFFFAOYSA-N 391.537 2.995 0 50 GFAA O=S(=O)(Cc1ccc(F)cc1)N[C@@H]1CCOC[C@H]1OCc1ccccc1 219805412 SLMYPJSZPAHNAK-RTBURBONSA-N 379.453 2.619 0 50 GFAA COc1ccccc1C(=O)NCC(=O)N1CCC(COc2ccccc2)CC1 154847047 KHSKMJSGMQTLMQ-UHFFFAOYSA-N 382.460 2.743 0 50 GFAA CN(C)c1nc2c(c(=O)[nH]1)CCN(C(=O)[C@@H](c1ccccc1)C1CCCC1)C2 72153373 VPFVDLLYSSGIDG-IBGZPJMESA-N 380.492 2.695 0 50 GFAA COc1ccc(CN2CCN(Cc3ccccc3F)[C@H](CCO)C2)cc1OC 39362655 VAVWJRHRWPVVEP-LJQANCHMSA-N 388.483 2.912 0 50 GFAA O=C(Cc1ccccc1)N1CCC[C@H](C(=O)N2CCC(c3cnc[nH]3)CC2)C1 378077142 MMTYKDLPWILCKC-IBGZPJMESA-N 380.492 2.597 0 50 GFAA O=C(Cn1cn[nH]c1=O)N[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 157256013 XGWIXDXSOUQJFO-ZFWWWQNUSA-N 382.386 2.823 0 50 GFAA CN(C)CCC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 77538642 SCHMNDKFFPKZGG-UHFFFAOYSA-N 377.916 2.633 0 50 GFAA NC1(CNC(=O)NC2(c3ccc4c(c3)OCO4)CC2)C2CC3CC(C2)CC1C3 333494852 HCWNIJVFSJZGLK-UHFFFAOYSA-N 383.492 2.857 0 50 GFAA COc1ccc(C(=O)NC[C@@H](O)CN2CCc3ccccc3C2)c(OC(C)C)c1 242147500 WSHMLZVZDHWDNO-LJQANCHMSA-N 398.503 2.631 0 50 GFAA Cc1[nH]nc2ncc(C(=O)N3CCC([C@H]4C(=O)Nc5ccccc54)CC3)cc12 373984337 ZTPAJVZOEBUFRT-GOSISDBHSA-N 375.432 2.854 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)c1cc(N2CCCC2)ccn1 333770355 XSEXNBFLORUSHO-UHFFFAOYSA-N 394.475 2.531 0 50 GFAA c1ccc2[nH]c([C@@H]3CCCN(Cc4cnc(N5CCOCC5)nc4)C3)nc2c1 72425261 ZZBXBSNCVYFUJW-QGZVFWFLSA-N 378.480 2.569 0 50 GFAA CCOc1ccc(CN2CCN(c3ccc(OC)cc3)C(=O)[C@H]2C)cc1CO 72158754 MUBUFEJPHHMQDS-MRXNPFEDSA-N 384.476 2.824 0 50 GFAA O=S(=O)(Cc1cccc(Cl)c1)NCc1ccncc1OC[C@@H]1CCOC1 288727734 ZNBKDKIWTSRYHI-OAHLLOKOSA-N 396.896 2.770 0 50 GFAA Cc1cc(=N/C(O)=C2\N=NC3=C2CCCCC3)n([C@H]2CCS(=O)(=O)C2)[nH]1 334159381 NCFOPCPPQGSQNZ-PEFGECPRSA-N 377.470 2.796 0 50 GFAA COc1ccc(CCC(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccn2)C3=O)cc1 95507194 MZPHAEJZRQMITA-AZUAARDMSA-N 393.487 2.672 0 50 GFAA COc1ccc(/C=C/CN2C[C@H]3CC[C@@H]2CN(C(=O)c2cnccn2)C3)cc1 95386243 UGWIYBDDNQZFGL-CJIROOEOSA-N 378.476 2.735 0 50 GFAA Cc1cc(O)c2c(C)c(CC(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)c(=O)oc2c1 238937447 VLOGMKZYJPGCIT-HDJSIYSDSA-N 387.432 2.665 0 50 GFAA biogenic CCCN1CCCN(c2ccc(C(=O)NCC[C@H]3CCCCN3C)cn2)CC1 244816803 SOQMIBLMTFINEK-HXUWFJFHSA-N 387.572 2.608 0 50 GFAA COc1ccc(-c2noc([C@@H](C)NC(=O)N3CCSCC3)n2)cc1OC 534675012 TZCSHWLSMPCZKW-LLVKDONJSA-N 378.454 2.573 0 50 GFAA Cc1cnn(Cc2cc(C(=O)N3CCC([C@@H](O)c4ccccc4)CC3)no2)c1 163195067 LBQHOMYKPXUMFF-FQEVSTJZSA-N 380.448 2.814 0 50 GFAA NC[C@@H]1CCCC12CCN(C(=O)[C@H](Cc1ccccc1)N1CCCOC1=O)CC2 1875277777 FWIVFQHDMXHJHV-PMACEKPBSA-N 399.535 2.808 0 50 GFAA COc1ccc(CCC(=O)N=[S@](C)(=O)c2ccccn2)c(OC)c1OC 1875276181 AIDNYCPZVPFNDC-AREMUKBSSA-N 378.450 2.724 0 50 GFAA CCN1C[C@H](CN(C)S(=O)(=O)c2ccc(Cl)c(C)c2Cl)CC1=O 952973200 ROKSOUCVCHDUAB-NSHDSACASA-N 379.309 2.791 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@@H]2CCCN(Cc3noc(CC(C)C)n3)C2)o1 952861833 LDZZJIKCSOKPOO-HNNXBMFYSA-N 375.473 2.515 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)c3cc(C(C)C)nc(N)n3)cn2)c1 952962147 BUGFXKGKSZMFON-UHFFFAOYSA-N 380.452 2.649 0 50 GFAA CC(C)N1C[C@H](NC(=O)CCn2ccc3cc(Br)ccc32)CC1=O 952985958 DNDFRYOLTLDHKH-OAHLLOKOSA-N 392.297 2.919 0 50 GFAA COc1ccc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)cc1OCc1cccc(F)c1 1529180983 OPNNQPUDXVWJEB-ZWKOTPCHSA-N 389.423 2.681 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1C(F)(F)F 170596465 GQHKJTJZRFWSQH-CHWSQXEVSA-N 379.404 2.687 0 50 GFAA O=C1C[C@H](Cc2ccc(NC(=O)N3CCC(c4ccncc4)CC3)cc2)C(=O)N1 191908185 QUQRLDDSJZFZNU-SFHVURJKSA-N 392.459 2.698 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)N3CCN(c4ccccc4O)CC3)c2O1 192595545 BONHULUTYADBKO-UHFFFAOYSA-N 388.489 2.617 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@H](Cc4ccccn4)[C@@H](O)C3)CCCC2)cc1 1616081150 PYDGBOWLILCFPZ-UWJYYQICSA-N 380.488 2.964 0 50 GFAA O=C(c1csc2ccccc12)N1C[C@H]2CN(Cc3ccns3)C[C@]2(CO)C1 1772813129 WWAXWHVJFFRERU-JLTOFOAXSA-N 399.541 2.924 0 50 GFAA O=C(COc1ccc(F)cc1)N1CCCN(C(=O)c2cccn2C2CC2)CC1 1772705866 BQDXKVXQVLHHDZ-UHFFFAOYSA-N 385.439 2.716 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)c2cn(CCC3CCCCC3)nn2)C1 11663618 PZEFLGFSLQJYGD-QGZVFWFLSA-N 398.511 2.717 0 50 GFAA COCCN1CCC(CN(Cc2ccc3nonc3c2)C[C@@H]2CCCO2)CC1 11816313 XYTXZRWWPRZOCC-IBGZPJMESA-N 388.512 2.562 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3cc(C)on3)C2)c1 11873654 FYYWWWLSHDBVDF-MRXNPFEDSA-N 385.464 2.940 0 50 GFAA CCN(CC)CCC(=O)NC[C@H]1Cc2cc(-c3cnccn3)cc(Cl)c2O1 12055324 PNKOPBGSULRKRQ-MRXNPFEDSA-N 388.899 2.949 0 50 GFAA O=C(CCC1CCN(Cc2cccn2-c2ncccn2)CC1)NC[C@H]1CCCO1 12595075 SKHNTDCWMYGVSX-HXUWFJFHSA-N 397.523 2.555 0 50 GFAA CCc1cc(CNC(=O)CCc2nnc(CCc3ccccc3OC)o2)on1 12758811 HQINXYFCACEFRU-UHFFFAOYSA-N 384.436 2.663 0 50 GFAA CSCCNCc1ccccc1OC[C@@H](O)CN1CCc2ccccc2C1 15076078 LHYAZBKRVRFDKS-NRFANRHFSA-N 386.561 2.937 0 50 GFAA Cc1cccc(C)c1NC(=O)CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19235742 HTNPBMSGHBBZQF-UHFFFAOYSA-N 381.476 2.788 0 50 GFAA Cc1cncc(C(=O)N[C@@H]2CCC[C@H](NC(=O)c3n[nH]c4ccccc34)C2)c1 1857673772 XNJKZMOPZBQLPH-CVEARBPZSA-N 377.448 2.737 0 50 GFAA CCCC(=O)N1CCC2(CC1)OCCc1cc(C(=O)N[C@@H](C)COC)sc12 1857682542 NCCKBLLKYKVQOD-AWEZNQCLSA-N 394.537 2.703 0 50 GFAA O=C(CCC1CCCC1)N[C@@H]1CN(Cc2ccc(-n3ccnc3)cc2)CC[C@@H]1O 1857708364 PXKBFIRSECIWTB-YADHBBJMSA-N 396.535 2.894 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857713243 MTFYSCWNIDHBBP-LVCYWYKZSA-N 390.487 2.826 0 50 GFAA N=c1nc(O)c2c([nH]1)C1(CC2)CCN(C(=O)CCc2c[nH]c3ccccc23)CC1 1857723463 HFTAUWJUZFRTLU-UHFFFAOYSA-N 391.475 2.515 0 50 GFAA O=C1CCO[C@H]2CN(c3ncnc4ccsc34)C[C@@H]2N1Cc1ccccc1 1857731878 SDPYQTVWZCXVQT-IRXDYDNUSA-N 380.473 2.698 0 50 GFAA O=C(c1ccncc1Cl)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857733176 YLYVAHHMUGTCQE-QKLQHJQFSA-N 383.835 2.650 0 50 GFAA Cc1ccc(OCCc2nnc(NC(=O)CCCn3cncn3)s2)cc1C 1875246739 LVKUIHYUFBSMHW-UHFFFAOYSA-N 386.481 2.787 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@H](Cn2cccn2)C1)c1ccccc1 111076537 HPLZPNGKNHYOMC-SFHVURJKSA-N 390.443 2.677 0 50 GFAA CN(CCCC1CCCC1)C(=O)C[C@H]1C(=O)NCCN1CCc1ccccc1 12057561 UQHPIERXHPDDOD-NRFANRHFSA-N 385.552 2.848 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1N=c1[nH]nc(-c2ccccc2Cl)s1 2325785876 RPCCMLIZVOWEGO-KCPJHIHWSA-N 375.885 2.729 0 50 GFAA CN(C)Cc1ccc(CNC(=O)c2nc3ncc(Br)c-3c[nH]2)cc1 2325859721 IKHZKJFABCKCEG-UHFFFAOYSA-N 388.269 2.664 0 50 GFAA CCO[C@H]1CCN(C(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)C1 885352680 DHKYTMXARGZURF-SFHVURJKSA-N 377.444 2.945 0 50 GFAA O=C(O)COc1ccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1 911234492 KUKDBJVXTRPORR-QPJJXVBHSA-N 380.444 2.621 0 50 GFAA NC(=O)C1CCN(C(=O)c2cnn3c(C(F)F)cc(-c4ccccc4)nc23)CC1 648925 MXBVYEGAVFCQGC-UHFFFAOYSA-N 399.401 2.671 0 50 GFAA C[C@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)NCc1ccco1 894783 VJKPDVWFEWWILK-HNNXBMFYSA-N 391.427 2.967 0 50 GFAA Cc1ccc(C(=O)Nc2cccc(Cl)c2)cc1S(=O)(=O)N1CCOCC1 991281 BYIBRHXYYOIEKF-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA COc1ccc(NC(=O)CSc2nnnn2-c2ccccc2F)cc1OC 1004306 UZNOEKHWUHGMNR-UHFFFAOYSA-N 389.412 2.549 0 50 GFAA NS(=O)(=O)c1ccc(NC(=O)CSc2nc3ccccc3s2)cc1 2226752 QFMHYPLEYPJPGT-UHFFFAOYSA-N 379.488 2.675 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CCC(=O)N1C[C@H](C)O[C@@H](C)C1 2778450 AFZHWEXTWFUTEK-IUCAKERBSA-N 398.223 2.999 0 50 GFAA COc1ccccc1C[C@H](C)N1CCC(n2cc(C(=O)NCC(C)C)nn2)CC1 11840329 DDWODBWLGCCKTN-KRWDZBQOSA-N 399.539 2.941 0 50 GFAA CCOC(=O)C[C@H]1CCCCN1Cc1nc(-c2ccc(C(=O)OC)cc2)no1 11841339 HRBJIJYBUZGRHL-MRXNPFEDSA-N 387.436 2.831 0 50 GFAA COc1ccc(CN2CCC[C@@H](n3cc(C(=O)N4CCCC4)nn3)C2)cc1C 12330430 PHDNFCOHQQIUEU-GOSISDBHSA-N 383.496 2.668 0 50 GFAA COc1ncc(CN2CC[C@]3(CCCN(Cc4cccc(C)c4)C3=O)C2)cn1 12715718 UNNZIQHYSYMSOE-JOCHJYFZSA-N 380.492 2.808 0 50 GFAA O=C1C[C@H](NC2CCN(Cc3ccco3)CC2)CN1C1Cc2ccccc2C1 15076578 IYMBQODMKFBIEU-FQEVSTJZSA-N 379.504 2.602 0 50 GFAA Cc1c[nH]c(CN2CCc3c(c(C(=O)NC4CCCC4)nn3CC(C)C)C2)n1 19798851 KDHHIDXAUPAPAK-UHFFFAOYSA-N 384.528 2.801 0 50 GFAA CCOC(=O)C[C@@H]1COCCN1Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 20205035 KAQJBIQDFCBFEU-CQSZACIVSA-N 399.369 2.909 0 50 GFAA OCC1CCN([C@@H]2CCCN(C3CCN(CCc4ccccc4)CC3)C2)CC1 20534283 MNKHJOOYNKVLOH-XMMPIXPASA-N 385.596 2.862 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CN2CCNC(=O)C2)c(F)c1 55154650 JJJYGPKMMONFHS-UHFFFAOYSA-N 380.423 2.619 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CCN(C)C3CCCC3)[nH]c2C1 65490244 FCQVTBPLVJAEAI-HNNXBMFYSA-N 382.508 2.905 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)C(=O)NC(C)C)C2 67459580 GNHWFNKTDIPXGX-UHFFFAOYSA-N 388.489 2.978 0 50 GFAA CCOc1ccc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1 67602154 BHMUBJMAFHJZTR-UHFFFAOYSA-N 375.494 2.638 0 50 GFAA O=C(CCOc1ccccc1)Nc1ccnn1C1CCN(C(=O)C2CC2)CC1 67690744 DIMOXXSORTVZIC-UHFFFAOYSA-N 382.464 2.864 0 50 GFAA CC(C)n1cc(C(=O)NCc2cccnc2N(C)CCc2ccccn2)cn1 67983189 HIYLUJZPFXIKGX-UHFFFAOYSA-N 378.480 2.863 0 50 GFAA O=C(c1cnc[nH]c1=O)N1CCO[C@H](CC(c2ccccc2)c2ccccc2)C1 71415770 CJPNXFRMMNZUCI-LJQANCHMSA-N 389.455 2.833 0 50 GFAA CN1C(=O)[C@@](CCC(=O)NC(C)(C)CO)(Cc2ccccc2)c2ccccc21 71762302 HTLUWQCGUUVLON-QHCPKHFHSA-N 380.488 2.811 0 50 GFAA O=C(O)[C@H]1CC2(CCNCC2)CN1C(=O)C1(c2ccc(Cl)cc2)CCC1 72123830 WLSVOOBDQWHKSZ-MRXNPFEDSA-N 376.884 2.817 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(C(=O)c1ccccc1C(F)(F)F)C2 72410646 WPBVWGDXSLQKIX-UHFFFAOYSA-N 381.354 2.965 0 50 GFAA CN(CCCN1CC2(CCN([C@H]3CCOC3)CC2)OC1=O)C1CCCCC1 72425003 JLTLHNWHBWCODV-IBGZPJMESA-N 379.545 2.717 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(Cc2ccc3c(c2)OCO3)CC1 82087176 JHZSPVJGGARIOW-UHFFFAOYSA-N 385.416 2.922 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(C(=O)CCCc2ccccc2)C1 95358278 VBHNTTOOYRVVEE-IBGZPJMESA-N 392.507 2.789 0 50 GFAA C[C@@H]1CCCN1S(=O)(=O)c1cccc(C(=O)N(C)Cc2nccs2)c1 95372292 FKKLXWITAXDHLU-CYBMUJFWSA-N 379.507 2.588 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95510937 PUVXZNDDVGWWNR-LJQANCHMSA-N 378.480 2.628 0 50 GFAA O=C(NC[C@H]1CCS(=O)(=O)C1)Nc1ccc(OCc2cccs2)cc1 95520954 GQORNXNCXIFBLC-CYBMUJFWSA-N 380.491 2.883 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccc(I)cc1 100559740 BNGSBGUINYKDPI-TXFQPVFDSA-N 379.197 2.993 0 50 GFAA Cc1cc(S(=O)(=O)Nc2ccccc2C(N)=O)c(C)cc1Br 116709713 QHZMIOOIJOEBHB-UHFFFAOYSA-N 383.267 2.966 0 50 GFAA COC(=O)c1ccc(C(C)C)c(NC(=O)Cn2cnc3ccccc3c2=O)c1 170604794 XQUYDQYONGFLMY-UHFFFAOYSA-N 379.416 2.945 0 50 GFAA COc1ccc2nc(C(=O)N3CCCN(c4nc(C)ns4)CC3)ccc2c1 173355837 XDJSJKRGOKLGHK-UHFFFAOYSA-N 383.477 2.756 0 50 GFAA O=C(Nc1cccc(Oc2ccncc2)c1)C(=O)N1CCC[C@H](c2ccn[nH]2)C1 177293737 GCIROHRKILVROS-HNNXBMFYSA-N 391.431 2.942 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 184514318 CZHDTPDJTDGQQP-UHFFFAOYSA-N 375.432 2.518 0 50 GFAA O=C(N[C@@H]1CCCN(c2cnccn2)C1)c1ccc(CSc2ncccn2)o1 221347076 WVDAKAXRQUIIGN-CQSZACIVSA-N 396.476 2.551 0 50 GFAA O=C(CN1CCN([C@@H]2CC[C@@H]3SCCS[C@H]32)CC1)Nc1ccc(F)cc1 230119460 FUPLTKWTKGAMQE-AOIWGVFYSA-N 395.569 2.761 0 50 GFAA O=C(O)c1cnc(C(=O)Nc2ccc(C(=O)N3CCCCC3)c(Cl)c2)cn1 263248207 GQEJAJXOINWWIP-UHFFFAOYSA-N 388.811 2.707 0 50 GFAA CCS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C)c3ccccc3C2)c1 265385104 AAKPJACDHTVAJI-UHFFFAOYSA-N 376.453 2.712 0 50 GFAA O=C(Nc1cc2n(n1)CCCC2)N1CCN(c2ncnc3sccc23)CC1 287440615 TVKZNKKPKLGLKN-UHFFFAOYSA-N 383.481 2.578 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2cccc(-n3cc(Br)cn3)c2)C1 299743579 LLRNMUVJQXFMFM-INIZCTEOSA-N 378.226 2.572 0 50 GFAA COC(=O)[C@@]1(N(Cc2ccccc2)C(=O)c2cc(C(C)(C)C)nn2C)CCOC1 328589860 HHRVOAKLUMBNRX-JOCHJYFZSA-N 399.491 2.692 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@H](O)COCc2cccs2)n1C 328629626 IKPWLQGGXKCJTO-YJBOKZPZSA-N 391.537 2.551 0 50 GFAA Cc1cc(C)n2c(CNC[C@H]3CCc4nc(C(F)(F)F)cn4C3)cnc2n1 328655646 YPSYCRQYNWWONJ-CYBMUJFWSA-N 378.402 2.914 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)NC(=O)[C@H]1CCCCN1C(=O)c1ccccc1 363128466 QTHQYFHSRPYXFR-MGPUTAFESA-N 382.508 2.779 0 50 GFAA O=C(NCCc1ccc(OCC(F)(F)F)nc1)N1CC[C@]2(CCCOC2)C1 368496408 OIQZWTPQEPNSOT-QGZVFWFLSA-N 387.402 2.777 0 50 GFAA COc1cc(/C=C/C(=O)N[C@@H]2CCC(=O)NC23CCC3)cc(Cl)c1OC 374743945 MRKWGGVLJDVKQX-CSPWOOARSA-N 378.856 2.688 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@H]3CCN(C)C3)csc2C1 426496672 KQHKPVURBMBMJG-OAHLLOKOSA-N 388.537 2.593 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCCCN3CCCc4ccccc43)C2)n[nH]1 426566841 FMYWFNFUKVIIOL-SFHVURJKSA-N 382.512 2.845 0 50 GFAA CC(C)Cc1ncc(NC(=O)C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cn1 472597706 KCIUYMACXHTUFY-MRXNPFEDSA-N 399.470 2.538 0 50 GFAA Cc1nc(-c2cccc(C(=O)N[C@@H](C)c3nncn3C)c2)nc2c1CCCC2 534675345 SCXOWWPFTRYGAV-AWEZNQCLSA-N 376.464 2.950 0 50 GFAA Cc1nc(O)c2c(n1)CN(C(=O)NCCCSCc1ccc(F)cc1)C2 584886165 ZPSJMXIGAORHEI-UHFFFAOYSA-N 376.457 2.978 0 50 GFAA Cc1cccc(N2CCC(NC(=O)CN3CCOc4ccccc4C3)CC2)c1 670451377 OXVRPCSTLPNKOQ-UHFFFAOYSA-N 379.504 2.975 0 50 GFAA C[C@H](NC(=O)c1cnc2n1CCCC2)c1cc(F)ccc1N1CCC(O)CC1 750777514 SWYBNFSCIWQJGU-AWEZNQCLSA-N 386.471 2.811 0 50 GFAA COc1c(Cl)cc(C(=O)N2CC[C@@H]3OCc4cnnn4[C@@H]3C2)cc1Cl 1076048021 GZMIEDVTLOYEDX-KGLIPLIRSA-N 383.235 2.580 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2c(Cl)cnn2C)cc1 1565528545 WLYWLBGZHFWXNT-CVEARBPZSA-N 388.899 2.819 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC2(CO)CCCC2)ccc1F 1704331962 VPMLVILWCWJAIQ-UHFFFAOYSA-N 391.443 2.838 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)NCc3cccc(F)c3)C1)CC2 1704335757 FCIRZGZBXRXLJU-NRFANRHFSA-N 383.471 2.871 0 50 GFAA Cc1cc(=O)c(O)c(C2(CC(=O)NCCc3ccco3)CCSCC2)o1 1776111459 YSAHADPKVNFVBJ-UHFFFAOYSA-N 377.462 2.761 0 50 GFAA CO[C@H]1COC[C@@H]1n1ccnc1-c1ccccc1OCC(=O)N1CCC(C)CC1 1857668243 VKHUKUHVZXZEJC-ICSRJNTNSA-N 399.491 2.774 0 50 GFAA CCc1ccccc1CN1C[C@@H](C(=O)O)C2(CCN(Cc3cc[nH]n3)CC2)C1 1857685574 YHQITSJAHXLVMA-FQEVSTJZSA-N 382.508 2.771 0 50 GFAA O=C([C@H]1CC[C@@H](O)[C@H](Nc2ncnc3[nH]ccc23)C1)N1CCc2sccc2C1 1857693708 IVHRBWUHAZLGQP-APHBMKBZSA-N 397.504 2.546 0 50 GFAA NC(=O)C1(NC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CCCC1 1857713863 UYMAZFMVJUCILR-LBPRGKRZSA-N 390.871 2.612 0 50 GFAA COc1ccccc1Cc1nc([C@H]2C[C@@H](N)[C@H](O)C2)n(-c2ccccc2F)n1 1857721676 ATUDOZHSBJKJPL-YXJHDRRASA-N 382.439 2.571 0 50 GFAA COc1cc(OC)cc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c1 1857736940 RPWBYXUIRFFRGN-BBTUJRGHSA-N 382.460 2.648 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ccc4c(c3)CCCO4)C1)CC2 1875251000 JXPIPHPQSNYNAK-QFIPXVFZSA-N 379.460 2.936 0 50 GFAA CC(C)(C)OC(=O)C1(NC(=O)Nc2cc(F)c(F)cc2N2CCOCC2)CC1 1875296333 QVYYGOTUBYKMAP-UHFFFAOYSA-N 397.422 2.797 0 50 GFAA O=C(N[C@H]1COCCC1(F)F)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1875307882 VEOIYIUBTOCDFA-ZDUSSCGKSA-N 393.356 2.857 0 50 GFAA Cc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)nc1 1875310138 GCEGGRSHKLGLLM-RYUDHWBXSA-N 380.370 2.858 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)CC1 1875365067 QVHLURQRBHJMLX-LJQANCHMSA-N 386.492 2.685 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@@]2(Cc2ccccc2)C(=O)OCC)CC1 1875365458 ZQENHIKFWXSSKI-HSZRJFAPSA-N 398.503 2.578 0 50 GFAA C[C@H](Cn1cccn1)OC(=O)[C@H]1CC(=O)Nc2ccc(Br)cc21 2325750152 ZFANNUDTFCZNTL-MFKMUULPSA-N 378.226 2.703 0 50 GFAA Cc1nccn1-c1ccc(C(=O)N2CCN(C3Cc4ccccc4C3)CC2)cn1 2325792477 HVWCRGLPHZKISB-UHFFFAOYSA-N 387.487 2.501 0 50 GFAA O=C(O)c1cccc(-c2ccccc2CNC(=O)c2nnn(-c3ccccc3)n2)c1 2325852078 ROQLVWKDPKOOCC-UHFFFAOYSA-N 399.410 2.958 0 50 GFAA CC(C)c1ccccc1N1CCN(C(=O)[C@@H](N)Cc2n[nH]c3ccccc23)CC1 2325856410 OPCWMFGORSQWBD-IBGZPJMESA-N 391.519 2.905 0 50 GFAA Cc1[nH]nc(O)c1CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1[C@H]2CCC(C)C 2356134859 GEEMNJAGBJWFHW-GJYPPUQNSA-N 398.507 2.751 0 50 GFAA Nc1cccc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)n1 2356162264 FGCGWPBSSJSUAU-QFIPXVFZSA-N 378.476 2.504 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356162962 NEIUHLBEJRMSRZ-WHSLLNHNSA-N 392.446 2.866 0 50 GFAA O=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1Cl)NC1CC1 1065587 LAJQBAOIQZSVFE-UHFFFAOYSA-N 386.901 2.608 0 50 GFAA Cc1cc(I)cnc1NC(=S)NC(=O)c1ccco1 1109355 BMFYRIBHOTVRMN-UHFFFAOYSA-N 387.202 2.714 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2ccccc2Br)NC(=O)N1 1168297 HWXFJYJURNLLQO-IAQYHMDHSA-N 395.253 2.799 0 50 GFAA COc1cc(-c2onc(N3CCc4[nH]c(=N)sc4C3)c2C(=O)O)ccc1F 2356135579 KUVOCCLVWYLOHU-UHFFFAOYSA-N 390.396 2.619 0 50 GFAA Cc1ccc2nc(SCC(=O)N[C@@H]3COC[C@H]3Cc3ccncc3)[nH]c2c1 2356140054 RPDPJOWSZJRDCP-CRAIPNDOSA-N 382.489 2.732 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2ccccc2)[C@@](O)(C(F)(F)F)N1 4144302 AGBRNNFXUULIMS-JJRVBVJISA-N 382.313 2.930 0 50 GFAA CCOC(=O)Cc1csc(NC(=O)CSc2nc3ccccc3[nH]2)n1 4809585 AVPZJEUOLGFSPX-UHFFFAOYSA-N 376.463 2.856 0 50 GFAA CC(=O)c1cccc(NC(=O)c2cc(S(=O)(=O)N3CCCC3)cs2)c1 6680537 MFUSHRJZNXUOKN-UHFFFAOYSA-N 378.475 2.988 0 50 GFAA O=C(Nc1nnc(-c2ccccc2Cl)[nH]1)[C@@H]1CN(Cc2ccccc2)CCO1 133751374 UIWVLLCXFNSWMR-KRWDZBQOSA-N 397.866 2.965 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)C1 54104276 AFOURSBHZGYIQY-XHDPSFHLSA-N 399.274 2.900 0 50 GFAA CCN(C(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)o1)[C@H](C)c1cccnc1 115223924 JIEUNUAPQNTEPQ-CQSZACIVSA-N 391.493 2.991 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@H](C)c2cccc(OC)c2)n1CCOC 55254310 QSPPCKBXVMZWIQ-OAHLLOKOSA-N 395.525 2.525 0 50 GFAA CC(C)(O)C(=O)N1CCC(n2nccc2NC(=O)CCCc2ccccc2)CC1 67560227 PUCBTSJOOGMJAV-UHFFFAOYSA-N 398.507 2.779 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(Cl)c1CN[C@H]1CCS(=O)(=O)C1 119885911 VWUXURNLGDZRMS-ZDUSSCGKSA-N 388.320 2.823 0 50 GFAA CC(C)(CN1CCC[C@]2(CCN(C(=O)C3CCCCC3)C2)C1)N1CCOCC1 67758811 PARHUBPCCGSPAW-QHCPKHFHSA-N 391.600 2.992 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2cc(C3CCC3)nn2C)N2CCOCC2)o1 153609345 VEEBQOJPMWMRTF-QGZVFWFLSA-N 387.484 2.784 0 50 GFAA O=S(=O)(c1cc(Cl)cc2c1OCC2)N1C[C@@H](CO)[C@H](c2ccsc2)C1 328615722 YXHARBWHWOJXQX-ZFWWWQNUSA-N 399.921 2.733 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)c1cccc(N2CCNC2=O)c1 72475787 UGCLFXHQJQYSFT-UHFFFAOYSA-N 377.404 2.538 0 50 GFAA CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(C(=S)NC3CC3)CC2)cc1 7680660 OJLCCJPDECVDMR-AWEZNQCLSA-N 381.567 2.543 0 50 GFAA Cc1cc(S(N)(=O)=O)cc(NC(=O)c2ccn(-c3ccccc3F)n2)c1C 125157926 ZIBVICNZOUHVJM-UHFFFAOYSA-N 388.424 2.528 0 50 GFAA C[C@H]1[C@H](C)CCC[C@H]1NC1=NN/C(=C2\C=NC(C(=O)N3CCCC3)=C2)CS1 253390421 KDDICYIKNRUZNB-AOIIBOSVSA-N 387.553 2.853 0 50 GFAA C[C@H](C(=O)N(C)C1CCCCC1)[S@](=O)Cc1nc(O)cc(C(F)(F)F)n1 155291894 CBFQDWNDMKVRSA-SKVICXGVSA-N 393.431 2.629 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)CCc3cnn(C)c3)CC2)OC1=O 77285654 XZTOSQSOUXNHCF-UHFFFAOYSA-N 376.501 2.602 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@@H](c2ncc(C)s2)C2CC2)ccc1F 173485977 BAYPWIXYOPDVLE-OAHLLOKOSA-N 383.470 2.979 0 50 GFAA Cn1c(C(=O)N2CCc3c(nc(-c4ccccn4)[nH]c3=O)C2)cc2ccccc21 71746762 CGGKETITOAEGPF-UHFFFAOYSA-N 385.427 2.522 0 50 GFAA Cc1ccc(-n2cc(C)cn2)c(NC(=O)c2cc(N3CCOCC3)ccn2)c1 132534785 APACAOUQHUETCR-UHFFFAOYSA-N 377.448 2.973 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@@H]3CCN(C)C3)csc2C1 426496671 KQHKPVURBMBMJG-HNNXBMFYSA-N 388.537 2.593 0 50 GFAA CCC(=O)NCc1cc2n(n1)CCN(CC1=Cc3cc(Cl)ccc3OC1)C2 426433723 YTJMMYBHBCWZJY-UHFFFAOYSA-N 386.883 2.854 0 50 GFAA Cc1nn(-c2ccccc2)c(N)c1-c1ccc(C(=O)N2CCC(N)CC2)cc1 426431000 HIGVUYHQZHBAHY-UHFFFAOYSA-N 375.476 2.993 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@]3(CCC(=O)N(C4CC4)C3)C2)cc1C 91254590 SSDFZSQYRSEUEE-HXUWFJFHSA-N 376.522 2.859 0 50 GFAA CC(C)c1ccc(C(=O)O)cc1S(=O)(=O)N1CCC(N2CCCC2)CC1 236717264 XPENQMLTCXOCOT-UHFFFAOYSA-N 380.510 2.757 0 50 GFAA Cc1nc(Cn2cc(C(=O)N[C@H]3CCCc4sc(Cl)cc43)nn2)no1 292110101 NIMSRZCIKUHJKA-JTQLQIEISA-N 378.845 2.540 0 50 GFAA COCCN(Cc1ccccc1C)C(=O)Cn1cccc(C(F)(F)F)c1=O 95518138 RPFATYYOBQTTAC-UHFFFAOYSA-N 382.382 2.851 0 50 GFAA O=C(c1cc(=O)c2ccccc2[nH]1)N1CCn2nc(Cc3ccccc3)cc2C1 96161420 KQNOQWILAQWAOY-UHFFFAOYSA-N 384.439 2.971 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)[C@H]3CCCCN3Cc3nncn3C)c2)s1 95497064 RCCXRXUMECJWFK-MRXNPFEDSA-N 397.508 2.635 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(N(C)C)cc2)C1 95504154 GSKJBCSBKXXMLO-LJQANCHMSA-N 383.540 2.921 0 50 GFAA COC(=O)c1cn([C@@H](CN2CCCCC2)c2ccccc2)cc2c(=O)[nH]nc1-2 263587169 CYTOMGPVIUGLOQ-SFHVURJKSA-N 380.448 2.538 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@]2(CNC(=O)[C@H]3CCC=CO3)C[C@@]2(C(F)(F)F)C1 1875274463 AJQGEBYNRMYAQN-OAUYIBNBSA-N 390.402 2.985 0 50 GFAA COC(=O)[C@H]1CCC2(CCC2)N(C(=O)c2ncn3c2COc2ccccc2-3)C1 1875319117 ZLZLHYNZGFUKCQ-AWEZNQCLSA-N 381.432 2.713 0 50 GFAA CCn1ccc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2cc3ccccn3c2)n1 1875310415 OZEANOSGYQNGEN-QZTJIDSGSA-N 379.464 2.627 0 50 GFAA O=C(N[C@@H]1C[C@H]2CNC[C@@H]1C2)c1cc(-c2cccnc2)nc2onc(C3CC3)c12 1875302016 WSWYUKJIDKVAFW-YLQAJVPDSA-N 389.459 2.890 0 50 GFAA COCC(=O)Nc1cc(NC(=O)c2cc(=O)c3ccccc3o2)ccc1OC 952983371 PSROPJJXJLVHLV-UHFFFAOYSA-N 382.372 2.639 0 50 GFAA C[C@H](NC(=O)c1cc(Cl)cn1C)c1ccc(N2CCCS2(=O)=O)cc1 185845342 PPYDLASBSYYBPU-LBPRGKRZSA-N 381.885 2.709 0 50 GFAA Cc1nccn1C[C@H]1CCCN1S(=O)(=O)c1cccc2c1OC(C)(C)C2 192638549 UNXTXTUYURZCCG-MRXNPFEDSA-N 375.494 2.758 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)CCCOc2ccc(F)cc2F)C1 779849897 KRVZOJRUPVILDO-UKRRQHHQSA-N 381.379 2.804 0 50 GFAA COCCSc1nnc(NC(=O)[C@@H](C)Oc2ccc(F)cc2F)s1 1529159906 UNKQUDHABGCWSE-MRVPVSSYSA-N 375.422 2.961 0 50 GFAA COc1cc(OCc2ccccc2)ccc1CN1C[C@]2(C(=O)O)C[C@]2(C(=O)O)C1 1704324934 HPGAVYSYWWKLRS-SZPZYZBQSA-N 397.427 2.636 0 50 GFAA Cc1[nH]nc(CCC(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)c1C 1704302143 FHDOEHUJEDFPTB-DYESRHJHSA-N 378.476 2.881 0 50 GFAA CNC(=O)[C@@]12CCCN(C(=O)c3oc4cc(C)ccc4c3C)[C@H]1CN(C)CC2 1775981175 AQOMUBLDIRGQRW-PGRDOPGGSA-N 383.492 2.722 0 50 GFAA O=C(C1CCCCC1)N1CCCN(C(=O)[C@H](Cc2cnc[nH]2)n2cccc2)CC1 1772704039 BHNNQHPBXUNXLW-FQEVSTJZSA-N 397.523 2.636 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)N1CCCN(C(=O)C2CCOCC2)CC1 1775982501 QOEKTFQJMFJFFQ-UHFFFAOYSA-N 389.540 2.626 0 50 GFAA CC(C)[C@H]1Cc2c(sc3c2-c2n[nH]c(=S)n2-c2nnc(S)n2-3)CO1 5897302 MUGLCSNKZBMAQY-SSDOTTSWSA-N 378.508 2.938 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C2CCN(C(C)=O)CC2)C1 12093455 LZVKFWXRTAUGNX-HXUWFJFHSA-N 387.568 2.892 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@]1(O)CNC1C2CC3CC(C2)CC1C3 12718697 YKFSPNUEYXFHRO-MZMBHDIKSA-N 382.548 2.997 0 50 GFAA CCCc1sc(C(=O)NCCCN2CCOCC2)cc1Br 13327853 ATNSVRRQXLVNNX-UHFFFAOYSA-N 375.332 2.915 0 50 GFAA CCOc1ccc(CN2CCC(n3cc(C(=O)N(CC)CC)nn3)CC2)cc1 14980277 KMUZPSQSKQNMBU-UHFFFAOYSA-N 385.512 2.996 0 50 GFAA Cc1cc(C)n(CCCNC(=O)C[C@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857668204 SHRJBKWKWHKERG-QGZVFWFLSA-N 396.495 2.849 0 50 GFAA Cn1nc2c(c1C(=O)N1[C@H]3CC[C@@H]1[C@](Cc1ccccc1)(C(=O)O)C3)CCCC2 1857668224 VQFCLTTUOUUJJZ-XKDCRVNJSA-N 393.487 2.990 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCC(C)(C)OC)C3)nc2c1 1857670657 DHOWSEVTPFGEAK-CQSZACIVSA-N 375.469 2.984 0 50 GFAA Cc1noc(C)c1CCCNC(=O)[C@]12COC[C@H]1CN(Cc1cccs1)C2 1857682151 FJQQXWAEVJNRSL-OXQOHEQNSA-N 389.521 2.550 0 50 GFAA Cc1cnc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc1N(C)C 1857699949 FULRTRLBZJNMJZ-OAQYLSRUSA-N 380.496 2.708 0 50 GFAA O=C(CN1CCCCC1)NC[C@@H]1Cc2cc(-c3cncnc3)cc(Cl)c2O1 12167702 BJXPWMMKVFAGNT-KRWDZBQOSA-N 386.883 2.703 0 50 GFAA Cc1cc(OCC(=O)O)ccc1NC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 262910229 CQGCXPSITPGQIU-CVEARBPZSA-N 383.400 2.972 0 50 GFAA Cc1n[nH]c(C)c1C(=O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2100473217 GSSNZCFQXKNJGN-QFIPXVFZSA-N 380.492 2.866 0 50 GFAA COc1ccc(-n2nc(C)cc2NC(=O)CCc2c(C)nc(O)nc2C)cc1 2100542901 JQPYHAPGAYIBSG-UHFFFAOYSA-N 381.436 2.873 0 50 GFAA NC1(C(=O)N2CCN([C@H](COc3ccccc3)c3ccccc3)CC2)CCC1 2100555359 SFWRTVZRANTUGQ-OAQYLSRUSA-N 379.504 2.832 0 50 GFAA O=C(Cn1nnc(-c2ccccc2F)n1)Nc1ccccc1Br 683821 WJVDGHNETHSWOP-UHFFFAOYSA-N 376.189 2.880 0 50 GFAA CCC(=O)c1ccc(OCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 1124733 YDYDUOLVBKGPPY-UHFFFAOYSA-N 389.473 2.879 0 50 GFAA CCN(CC)C(=O)c1cccc(-c2cnc3c(N4CCC(O)CC4)nccn23)c1 2356137695 VUSBOXBYMPZZMX-UHFFFAOYSA-N 393.491 2.839 0 50 GFAA C[C@H](c1ccccc1)N1C(=O)c2ccc(C(=O)NC[C@H]3CCCO3)cc2C1=O 4842588 ANZANGGBAZBILH-RHSMWYFYSA-N 378.428 2.953 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(Cl)s3)CC2)cc1 8507406 USUWLFBDHDMJQZ-UHFFFAOYSA-N 384.910 2.857 0 50 GFAA C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 112439319 MGKFVHHPUKRHLZ-SJLPKXTDSA-N 399.495 2.694 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCc3cccc(F)c3)C2=O)c1 67895407 QEMCIRDRNUQBHN-NRFANRHFSA-N 390.430 2.617 0 50 GFAA CC(C)Cc1nc(CCN2C(=O)COc3ccccc32)n(-c2ccccn2)n1 65395507 OWALEIDISKNFRE-UHFFFAOYSA-N 377.448 2.829 0 50 GFAA COc1ccsc1S(=O)(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1 328619964 GOPGAWKOZHMQAP-SECBINFHSA-N 395.428 2.513 0 50 GFAA Cn1ncc2c1ncn1nc(Cn3nc(C(F)(F)F)c(Cl)c3C3CC3)nc21 2802554 UEIRECLIDXWDAC-UHFFFAOYSA-N 396.764 2.805 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccco1)c1cn(-c2ccccc2)nn1 155677757 UTLKHOUBOBALQZ-CRAIPNDOSA-N 393.447 2.732 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)N(C)Cc1cc(C(C)C)no1 72479890 SLCJWCTWJOAFBV-LJQANCHMSA-N 376.545 2.953 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)CC1 490128101 CVXGCLFEBVJEJK-NSHDSACASA-N 395.809 2.811 0 50 GFAA O=C(CCc1nnc2ccc(NCCc3ccccc3)nn12)N1CCCCC1 32095480 NOKPTGADULXWJD-UHFFFAOYSA-N 378.480 2.724 0 50 GFAA CC(C)c1nnc2sc(-c3sccc3S(=O)(=O)N3CCCC3)nn12 71750169 ZCNQPXISIUSKBD-UHFFFAOYSA-N 383.524 2.822 0 50 GFAA C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 377606521 NKENEEWLOHXORA-KPZWWZAWSA-N 387.461 2.652 0 50 GFAA CCc1nccn1CC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72133088 QZMZDWVWFYGYDH-VLCRHTCISA-N 382.483 2.673 0 50 GFAA COCCN(C)S(=O)(=O)c1cccc(C(=O)N[C@@H](C)C2=CCCCC2)c1 215187247 ODMKQYCYKKKOMR-HNNXBMFYSA-N 380.510 2.572 0 50 GFAA CN1CCN(c2ccc(NC(=O)C3CCN(CC(F)(F)F)CC3)cc2)CC1 241946764 UNTFEAMVVWHIOG-UHFFFAOYSA-N 384.446 2.651 0 50 GFAA COCCC[C@H]1CCCCN1C(=O)c1ccc(OC)c(N2CCOCC2)c1 91321862 LCLFXGXGUANGED-GOSISDBHSA-N 376.497 2.953 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1C[C@H](CO)[C@H](CN2CCCCCC2)C1 91427277 FDCHLUFCLJOHRG-QZTJIDSGSA-N 376.545 2.583 0 50 GFAA CCc1nc2cc(NC(=O)N3Cc4nc(C)n(C)c(=O)c4C3)ccc2n1CC 96153060 BITVUTXPSCFJJN-UHFFFAOYSA-N 380.452 2.568 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)CC(=O)N(C/C=C/c1ccccc1)C2 91643784 YWDIVIDYFRMQHU-RMKNXTFCSA-N 376.522 2.754 0 50 GFAA Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H]2CCCN2[C@H]3C(=O)c2ccc(F)cc2)cc1 245327754 QGOXTTHFVIUWDE-LWYYNNOASA-N 392.430 2.969 0 50 GFAA CC[C@@H]1CN(c2ccccc2)CCN1C(=O)NC1CCN(c2ncccn2)CC1 184430278 CEPDVJGXNXSAJV-LJQANCHMSA-N 394.523 2.756 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCCc1ccncc1 253496570 PWLZRISSGFSABW-UHFFFAOYSA-N 393.422 2.722 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4cccc(C)c4)c3CO2)cc1 263615318 BTITYEVYTCWKGF-IBGZPJMESA-N 378.432 2.797 0 50 GFAA COc1cc(C)c(S(=O)(=O)N[C@H]2CCCN(C(=O)C(C)C)C2)c(C)c1C 824539691 QVZAYZWXVJRJFE-INIZCTEOSA-N 382.526 2.546 0 50 GFAA Cc1cccc(OC2CN(C(=O)N[C@@H](C)c3ccc(S(C)(=O)=O)cc3)C2)c1 584886903 WVBAASZCUMHWAL-HNNXBMFYSA-N 388.489 2.932 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)NCc3ccc4c(c3)CCCO4)CC2)nc1 584894291 UBYQNDDMANYSHE-UHFFFAOYSA-N 381.476 2.908 0 50 GFAA CC(C)OC1(CNC(=O)C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)CCC1 874313892 REYLSEHVLMJHML-SFHVURJKSA-N 390.480 2.647 0 50 GFAA C=Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)cc1 1875374141 CCZWEIGOVLXHIL-AWEZNQCLSA-N 397.460 2.922 0 50 GFAA O=C(NC1CCN(CC2CCCC2)CC1)N[C@H](CO)Cc1ccc(F)cc1 271102476 LMWXLLFSXGTEAH-FQEVSTJZSA-N 377.504 2.683 0 50 GFAA CCOC(=O)[C@H](NC(=O)c1cncs1)c1ccc(OC)c(Br)c1 272631043 ZWJLMRFOBQSPCF-CYBMUJFWSA-N 399.266 2.948 0 50 GFAA C[C@H](CN1CCCCCC1)NC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 186017541 IQIYWQXOFADLTK-MRXNPFEDSA-N 394.541 2.613 0 50 GFAA O=S1(=O)CC[C@H](Cc2nnc(SCCCOCc3ccccc3)o2)C1 170594897 PGXMLYSGWRRYFX-OAHLLOKOSA-N 382.507 2.746 0 50 GFAA Cn1cc([C@@H]2CSCCN2CC(=O)NC2CCC(C(F)(F)F)CC2)cn1 170612049 LPGCALWZVHRQED-NRXISQOPSA-N 390.475 2.747 0 50 GFAA CO[C@H]1C[C@H](c2nc(C)no2)N(C(=O)NCc2cc(Cl)cc3c2OCC3)C1 190153401 VMIGAKUMBNMOOZ-LSDHHAIUSA-N 392.843 2.638 0 50 GFAA C[C@@H](C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1)n1cnc2ccccc21 195108113 CGDVBJVAIQOZOX-AWEZNQCLSA-N 393.447 2.706 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)C2=Cc3ccccc3OC=C2)N1 1506420069 SJRIQUPFSGLMDZ-IBGZPJMESA-N 375.428 2.679 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCCN(C(=O)c2ccoc2)CC1 1506396231 PXESOVRZUYAQHQ-KRWDZBQOSA-N 392.839 2.915 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CC[C@@H](CN(C)C)C2)ccc1F 1704330231 GOIXNMPMMWVAHJ-ZDUSSCGKSA-N 390.459 2.579 0 50 GFAA c1ccc(CC[C@@]23CNC[C@H]2CN(c2ccc(CN4CCOCC4)cn2)C3)cc1 1772712300 NKGUVJVUKXZVPY-UPVQGACJSA-N 392.547 2.572 0 50 GFAA Cc1ccsc1C(=O)N1CCC(N2CCC[C@H](C(=O)NC3CC3)C2)CC1 11815282 JHCJATVBFIACDT-HNNXBMFYSA-N 375.538 2.652 0 50 GFAA CC(=O)c1cc(CN2CCC[C@@H](CCC(=O)N3CCN(C)CC3)C2)cs1 12056294 ARUWSUZODCQKTN-KRWDZBQOSA-N 377.554 2.717 0 50 GFAA O=C(CC[C@]1(Cc2ccc3c(c2)OCO3)CCC(=O)N1)NCc1ccsc1 12210198 YJJGATNVZBRHIB-HXUWFJFHSA-N 386.473 2.765 0 50 GFAA COc1ccccc1O[C@H](C)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 12380857 WITKSDGUSUVLFN-OAHLLOKOSA-N 384.432 2.574 0 50 GFAA O=C(CCn1cncn1)N1CCc2onc(-c3ccc(C(F)(F)F)cc3)c2C1 12584792 ILNPRGKMJXKDMV-UHFFFAOYSA-N 391.353 2.927 0 50 GFAA O=C(CCN1CCCCCC1=O)N[C@H]1CCCN(CCCc2ccccc2)C1 12718671 DSDUPVPSJOANMD-NRFANRHFSA-N 385.552 2.993 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1CNC[C@H](C(=O)Nc2ccc3c(c2)CCC3)C1 14532404 NNBTXAUFICTXFZ-RBUKOAKNSA-N 395.478 2.795 0 50 GFAA Cc1ccc(OC[C@@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 19367366 JNRYJUTXVLWOMH-FQEVSTJZSA-N 398.503 2.590 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C(=O)c2ccc(F)cc2)CC1 19594969 MUKBNHNGTIYFPG-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)Cc4ccccc4C)nnc23)n1 169780322 YENDQKCGGJRSGR-UHFFFAOYSA-N 376.420 2.509 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2cccn2)C[C@@H]1O)c1ncc(C(F)(F)F)cc1Cl 1857531250 WOYSGGODGTXFOB-XDTLVQLUSA-N 388.777 2.520 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)cc1 1857676553 QIPCJKVFSBSXNA-DWLFOUALSA-N 399.512 2.688 0 50 GFAA COCC1(C(=O)N2CCC3(CCc4c(N5CCCC5)nc(C)nc43)CC2)CC1 1857685811 VHIGCPXZJHQKKR-UHFFFAOYSA-N 384.524 2.618 0 50 GFAA CCCN1CCOC2(CCN(C(=O)c3ccc4ncsc4c3)CC2)CC1=O 1857689067 DAQHUBZXRRLJPM-UHFFFAOYSA-N 387.505 2.930 0 50 GFAA O[C@]1(CN2CCC(c3ccccc3)CC2)CCCN(c2nnc3ccccn23)C1 1857725294 OSPCIICOSXZHOQ-QHCPKHFHSA-N 391.519 2.940 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H](c3nncn3C)C2)cc1C(F)(F)F 225523748 CWMIHUHRMOBXRE-LBPRGKRZSA-N 388.415 2.711 0 50 GFAA CC1(C)CN(C(=O)C(=O)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c2cccc(Cl)c21 121862240 IYADDGLDGDJHFV-LYRGGWFBSA-N 376.884 2.894 0 50 GFAA O=C(NCc1nc(-c2ccccc2)cs1)[C@H]1CC(=O)N(c2nccs2)C1 362850196 GVCMOOOVHMUIKS-ZDUSSCGKSA-N 384.486 2.936 0 50 GFAA CCn1cnc2c(NCc3ccc(C(=O)N4C[C@H](C)O[C@H](C)C4)cc3)ncnc21 264655345 JSEUFGUYYNVUAW-GASCZTMLSA-N 394.479 2.708 0 50 GFAA COc1ccc(NC(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 264951534 BSJBFZWUYMCDNM-UHFFFAOYSA-N 375.450 2.574 0 50 GFAA CCCN1C(=O)[C@]2(CCN(C(=O)Cc3ccc4c(c3)OCO4)C2)c2ccccc21 2100477895 HWDTUWGRGFWMMU-QHCPKHFHSA-N 392.455 2.885 0 50 GFAA O=C(NC[C@@H]1NCCc2ccccc21)c1nnn(-c2ccc(F)cc2)c1C1CC1 2325721707 ALVSGWGSSGONAC-IBGZPJMESA-N 391.450 2.901 0 50 GFAA Cn1c(=O)n(C)c2cc(N3CCCCC3)c(N[C@@H]3[C@H]4OC[C@H]5C[C@@H]3C[C@@H]54)cc21 2325763216 QAGIBPXJFPAMMH-AECBVSGNSA-N 382.508 2.703 0 50 GFAA C[C@H](NC(=O)c1cn(CC2CC(N)C2)nn1)C1(c2ccc(Cl)cc2)CCC1 2325793159 IZVAFYQKFHDHLK-CBCUQQMYSA-N 387.915 2.909 0 50 GFAA CCc1c(C(=O)N(C)CC(C)(C)CNC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)nnn1CC 2325794793 RNSIEKNPYGUZNW-OAGGEKHMSA-N 389.544 2.511 0 50 GFAA NC(=O)C[C@H](NC(=O)[C@H](N)Cc1cc2ccccc2o1)c1ccc(Cl)cc1 2325850718 FYCFYCHXICQMMS-SJORKVTESA-N 385.851 2.689 0 50 GFAA CCn1cc(CS(=O)(=O)Cc2nc(-c3c(F)cccc3F)cs2)nn1 899968376 CSJZUVWWICEEOC-UHFFFAOYSA-N 384.433 2.815 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)[C@@H](C)Cn1cc(Br)cn1)OCO2 2793112 PWFFEJXKAWOHMW-VIFPVBQESA-N 394.225 2.852 0 50 GFAA COc1ccc(CCNC(=O)CCC(=O)NCCc2ccc(OC)cc2)cc1 4891625 RLPDWIJCTLNKOF-UHFFFAOYSA-N 384.476 2.502 0 50 GFAA COCCn1c(SCc2cccc3ccccc23)nc2c1c(=O)[nH]c(=O)n2C 5356236 FSRQTCRHOITCON-UHFFFAOYSA-N 396.472 2.515 0 50 GFAA COCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(SC)cc1 6267580 RETCORIYJODLOK-UHFFFAOYSA-N 380.491 2.586 0 50 GFAA CCOc1ccc(CC(=O)Nc2cc(C)nn2-c2nc(C)c(CC)c(=O)[nH]2)cc1 7422155 CKDJOJYTXSGPRA-UHFFFAOYSA-N 395.463 2.715 0 50 GFAA Cc1ccsc1C(=O)N1CCC(N2CCC[C@@H](C(=O)NC3CC3)C2)CC1 11815284 JHCJATVBFIACDT-OAHLLOKOSA-N 375.538 2.652 0 50 GFAA COC(=O)[C@H](CCSC)NC(=O)c1cc(COc2ccc(C)c(C)c2)on1 12058045 CXSMZDDYVYRPRL-INIZCTEOSA-N 392.477 2.895 0 50 GFAA COc1ccc(-c2cnnc(N3CCN(Cc4cccc(F)c4)C(=O)C3)n2)cc1 12387581 UWAIRBMJULUSIR-UHFFFAOYSA-N 393.422 2.535 0 50 GFAA Cc1nc(N2CCCCCCC2)ncc1[C@@H](C)NC(=O)CCCn1cncn1 12466121 SIBGGMJSNXHLIV-MRXNPFEDSA-N 385.516 2.805 0 50 GFAA CN(C(=O)[C@@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1)C1CCOCC1 12584027 FPJNXANQKDMGBG-MRXNPFEDSA-N 378.900 2.759 0 50 GFAA CCCOc1ccccc1/C=c1\sc2nc(=O)c(-c3ccccc3)nn2c1=O 13618465 YSJVGLDTMWPBON-LGMDPLHJSA-N 391.452 2.515 0 50 GFAA O=S1(=O)C=C[C@@H](NC2CCN(c3cccc(-c4cscn4)c3)CC2)C1 23430324 LBUAWMHIVZUEQQ-MRXNPFEDSA-N 375.519 2.679 0 50 GFAA COc1ccc(S(=O)(=O)n2cc(CCC(=O)O)c3cc(OC)ccc32)cc1 39202807 YMPALHOKRBVHOJ-UHFFFAOYSA-N 389.429 2.913 0 50 GFAA in-man COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2F)CN1Cc1ccc(C)s1 42451683 UGMIVPLPFPNBGJ-GUYCJALGSA-N 376.453 2.742 0 50 GFAA O=C(c1cnn2cc(CCO)cnc12)N1CCC[C@@H](CCc2ccccc2)C1 71388546 UDSOARRFDUWXTP-SFHVURJKSA-N 378.476 2.749 0 50 GFAA C[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cn(Cc2ccccc2F)nn1 72146670 NLMRTLOXNMPOKG-INIZCTEOSA-N 393.466 2.642 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)CCc3cccc(F)c3)C2)CCC1=O 91848969 RSHBTSJWBBWLJY-NRFANRHFSA-N 376.472 2.636 0 50 GFAA CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cc(-c2cccs2)nn1C 95361627 WKXPWVRRQFXYFN-UHFFFAOYSA-N 379.445 2.657 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCN(c3ccc(Cl)cn3)CC2)c(C)c1 95368647 RRUKCMMJFXFZLM-GOSISDBHSA-N 375.856 3.000 0 50 GFAA CN(C)CCNC(=O)c1ccc(OC2CCN(CC3CC3)CC2)c(Cl)c1 95498677 JHRLEFHMYOLEDH-UHFFFAOYSA-N 379.932 2.885 0 50 GFAA CCN1CCN(Cc2c(C(=O)c3ccccc3)oc3ccccc23)C(=O)C1=O 95503350 PMFMDYXHGWVJSU-UHFFFAOYSA-N 376.412 2.855 0 50 GFAA CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3ccccc3)no2)C[C@H]1c1ccc(C)o1 95505839 SBKRPQXKLDRVCL-SJLPKXTDSA-N 379.416 2.987 0 50 GFAA C[C@@H](c1ccccc1)n1nccc1NC(=O)N1CCN(c2cnccn2)CC1 95505850 JVFHRUFIJPSPMR-INIZCTEOSA-N 377.452 2.637 0 50 GFAA Nc1nc(NC2CC2)cc(N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)n1 95526250 ROLGVAVCRCMGOK-MRXNPFEDSA-N 390.495 2.657 0 50 GFAA CCCN1C[C@@H](NC(=O)Nc2ccnn2Cc2ccccc2Cl)CC1=O 96166081 DPJSDRJQJFNSSF-AWEZNQCLSA-N 375.860 2.717 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c1 118799426 BGDQTSWHFRAXBF-OAHLLOKOSA-N 384.411 2.991 0 50 GFAA CCC1(CC)[C@@H](NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C[C@@H]1OC 133270488 MRXTWPOBAHMLPT-GJZGRUSLSA-N 375.494 2.546 0 50 GFAA CC[C@]1(C)CC2=C(CO1)S[C@@H]1N=NN(CC(=O)Nc3nccs3)C(=O)[C@@H]21 169680219 VQINPRLEKIENQI-HEHGZKQESA-N 393.494 2.823 0 50 GFAA COCCOCCOCCN(C)C(=O)c1sc(-c2cccs2)nc1C 170605658 RDUZJRZYNAYQOD-UHFFFAOYSA-N 384.523 2.932 0 50 GFAA O=C(Nc1ncc(Cc2cccc(F)c2)s1)N1CCC[C@H](OCCO)C1 172047962 MDKLULIUKMOMQG-HNNXBMFYSA-N 379.457 2.878 0 50 GFAA Cc1noc(-c2ccccc2C(=O)NC2CCN(Cc3ccncc3)CC2)n1 173137991 POVBHKFVZNXVRN-UHFFFAOYSA-N 377.448 2.834 0 50 GFAA CC(C)c1ccc(-n2cc(O)c(C(=O)N3CCN(C4CCOCC4)CC3)n2)cc1 174989119 IJSVWDFUXFJUOB-UHFFFAOYSA-N 398.507 2.638 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H]2C(=O)O)cnn1-c1ccc(Br)cc1 237749103 PEQDZBKWBBYYBS-CQSZACIVSA-N 378.226 2.632 0 50 GFAA O=C(CNC(=O)c1ccccc1OC(F)F)NC[C@@H](CO)CC1CCCCC1 252497649 QLZIXOPFNBUUOL-HNNXBMFYSA-N 398.450 2.713 0 50 GFAA CCOC(=O)/C=C1\C[C@@H]2[C@H]3[C@@H]4[C@H]5[C@H]([C@H]6O[C@H]6[C@H]5[C@@H]5/C(=C/C(=O)OCC)C[C@H]2[C@H]45)[C@H]13 257347055 PQZHGKNYSHTADS-VDIDUVDUSA-N 396.483 2.757 0 50 GFAA COC(=O)Nc1ccccc1C(=O)N(C)[C@H]1CCN(c2ccccc2F)C1=O 264912487 NPDCIWXKQVAAKY-KRWDZBQOSA-N 385.395 2.882 0 50 GFAA Cn1c(O)ncc(C(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)c1=O 290652477 NPUIATKULDJREZ-UHFFFAOYSA-N 382.247 2.813 0 50 GFAA CCCC(=O)N[C@@H]1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1 299589399 BQYVYKOMHRABFN-CVEARBPZSA-N 391.537 2.650 0 50 GFAA O=C1CSc2ccc(C(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2N1 299746321 WQLUFNBCRYNJQC-MRXNPFEDSA-N 395.440 2.638 0 50 GFAA CN1CCC[C@H](CNC(=O)N2CCc3ccnc(O)c3C2)[C@@H]1c1cccs1 372813419 FWGMMABANZRRTQ-CRAIPNDOSA-N 386.521 3.000 0 50 GFAA CN1CC2(CCN(C(=O)NCc3cc(Cl)ccc3Cl)CC2)OCC1=O 534646606 KPVMMISQCFJOSQ-UHFFFAOYSA-N 386.279 2.526 0 50 GFAA Cc1nn(C)c(C)c1[C@@H](C)NC(=O)c1cccc(-c2cncc(C(=O)O)n2)c1 534661114 BZJLCZIJELVPGZ-LLVKDONJSA-N 379.420 2.683 0 50 GFAA Cc1ccccc1C1(NC(=O)N(Cc2ccncc2)C[C@@H]2CCC(=O)N2)CC1 584888921 RWEKAYDPIMSFDT-SFHVURJKSA-N 378.476 2.870 0 50 GFAA C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H](C)N1Cc1cn(C[C@@H]2CCOC2)nn1 864097328 OYYKVDDDBVHWBN-TWMKSMIVSA-N 393.532 2.533 0 50 GFAA FC(F)O[C@H]1CCN(Cc2ccc(OCCN3CCOCC3)c(Cl)c2)C1 952845177 FOHDIFSSPFCHDS-HNNXBMFYSA-N 390.858 2.865 0 50 GFAA COc1ccc(-c2ccnc(C3CCN(C(=O)[C@]4(F)CCNC4)CC3)n2)cc1 952895058 RHNKCIJJCVHQJL-NRFANRHFSA-N 384.455 2.560 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)Nc1c[nH]nc1O)OCc1ccccc1 1306848463 MNQHUNRDAYBHMF-MRXNPFEDSA-N 380.404 2.592 0 50 GFAA O=C(c1cn(CC[C@H]2CCCCN2)nn1)N(Cc1ccccn1)Cc1ccco1 1506412924 FYSYVGZDXDSUKV-QGZVFWFLSA-N 394.479 2.641 0 50 GFAA Cc1ccc(C(=O)N2CCCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c(=O)n1C 1529147203 WCEYLYMXRDGLAS-ICSRJNTNSA-N 383.536 2.834 0 50 GFAA O=C(NCc1ccccc1)N1C[C@@H]2OC(=O)N(CCc3ccc(F)cc3)[C@@H]2C1 1565530587 SPZGDLWRTNKVPK-MOPGFXCFSA-N 383.423 2.783 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2C[C@H]3COC[C@@H](C2)C(=O)N3C)cc1 1704314486 SLSMFKXRZDZGBJ-UXHICEINSA-N 378.472 2.515 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(Cc3nc4ccccc4n3C)C1)CC2 1704330547 XTOOJUWIFHNNSX-JOCHJYFZSA-N 376.508 2.909 0 50 GFAA O=C(c1ccc[nH]1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857707570 DEOCAUYNLXFZQG-OAQYLSRUSA-N 375.432 2.693 0 50 GFAA Cc1cccnc1NCCNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857708127 GPNYPWUBDNIJGK-INIZCTEOSA-N 394.479 2.761 0 50 GFAA CCn1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccc(C)cc4)C[C@]34CC[C@H]2O4)cn1 1857712754 GHUMEPYRBYGIKZ-ZZLPTCMGSA-N 394.519 2.621 0 50 GFAA c1cc(N2CCSCC2)nnc1-c1cc2c(s1)C1(CCNCC1)OCC2 1875247847 QTKSKVHBLMCDID-UHFFFAOYSA-N 388.562 2.910 0 50 GFAA CCC[C@@H](C(=O)N[C@@H](Cc1cccc(OC)c1)c1ccccc1)S(N)(=O)=O 1875267836 YJNAXABCOQCLOZ-OALUTQOASA-N 390.505 2.552 0 50 GFAA Cc1ncsc1-c1ccc(CNC(=O)[C@H]2COCCN2CC(F)F)cc1 1875269771 LZCYNBAEBIFYMU-OAHLLOKOSA-N 381.448 2.701 0 50 GFAA Cn1cc(-c2cccc(C(=O)N3CC[C@@H](C4CC4)[C@@H]3c3nc(O)n[nH]3)c2)cn1 1875401094 FIOZORPRHMFFDT-DLBZAZTESA-N 378.436 2.524 0 50 GFAA O=S1(=O)CC[C@@H](N2CCN(C3=Nc4ccccc4Oc4ccccc43)CC2)C1 2325760026 LHNOPLBKGTXZQT-MRXNPFEDSA-N 397.500 2.675 0 50 GFAA C[C@H](NC(=O)c1cccc2ccn(Cc3ccccc3)c12)C1(O)CCNCC1 2325809068 BUOWNISJZZAYIW-KRWDZBQOSA-N 377.488 2.922 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 1158424 XKEVQNWHLULSCA-UHFFFAOYSA-N 390.480 2.851 0 50 GFAA Cc1ccc(-n2nnnc2SCC(=O)Nc2ccc3c(c2)OCO3)cc1C 1353546 HRQXDSGSJHPKIJ-UHFFFAOYSA-N 383.433 2.739 0 50 GFAA O=C(N[C@H](Cc1c[nH]cn1)C(=O)O)OCC1c2ccccc2-c2ccccc21 2560723 SIRPVCUJLVXZPW-LJQANCHMSA-N 377.400 2.944 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Cc2ccc(C(F)(F)F)cc2)C1=O 2356158904 DOXIKIJPPJCKKX-LJQANCHMSA-N 398.425 2.878 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)n1 6702903 OJWARJNACBHRSL-HNNXBMFYSA-N 379.869 2.835 0 50 GFAA Cc1noc(CCCC(=O)N2CC[C@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C2)n1 225445750 NZXVXANQTJDFDQ-LSDHHAIUSA-N 378.473 2.559 0 50 GFAA O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCc2ncnn2C1 112742463 UPVZBCBXCMSMRK-SFHVURJKSA-N 377.448 2.671 0 50 GFAA CCC(=O)NC1=NC2=NC(c3ccccc3)=C[C@@H](c3ccc(OC)cc3)N2N1 100486286 JCSJMXLBPAWZON-SFHVURJKSA-N 375.432 2.849 0 50 GFAA Cc1ccc([C@H]2COCCN2S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)o1 172036350 LCNOFOAPZRULHI-QGZVFWFLSA-N 390.461 2.625 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(C)c(F)c3)CC2)C1 67562338 MIUBQDRLUSYFQE-LJQANCHMSA-N 391.531 2.573 0 50 GFAA Cc1cc(C)c(NC(=O)CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)c(C)c1 119534432 PXAOVWQNSXHGCS-WCRBZPEASA-N 384.568 2.793 0 50 GFAA CCn1cc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 1460409 BGZONIBVLOVGMX-LSDHHAIUSA-N 388.468 2.571 0 50 GFAA CCOc1ccc(CN2CCN(c3ccc(OC)cc3)C(=O)[C@@H]2C)cc1CO 72158751 MUBUFEJPHHMQDS-INIZCTEOSA-N 384.476 2.824 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c3c2NC(=O)C[C@H]3c2ccc3c(c2)OCO3)n1 35373086 LPPIAKQQPWSUCR-AWEZNQCLSA-N 377.404 2.790 0 50 GFAA Cc1cnn(-c2ccc(S(=O)(=O)N[C@H](c3nc(C)no3)C(C)C)cc2F)c1 125321239 CHEISDYZOIDSGX-INIZCTEOSA-N 393.444 2.687 0 50 GFAA O=C(Nc1cccc(-c2nc[nH]n2)c1)c1ccc(S(=O)(=O)C(F)F)cc1 363174940 KTSNBZFCEMCAAU-UHFFFAOYSA-N 378.360 2.720 0 50 GFAA COc1ccc(CN2CCN(Cc3c(F)cc(OC)cc3F)CC2=O)cc1 72435856 XZOGXSAOCXUPIP-UHFFFAOYSA-N 376.403 2.826 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3CCC(c4ncc[nH]4)CC3)c2n1 72477248 PQYIFTSWQKGDKK-UHFFFAOYSA-N 378.358 2.799 0 50 GFAA COc1cc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)ccc1NC(N)=O 378144077 QKXSXYOVTPMMSZ-KRWDZBQOSA-N 396.447 2.819 0 50 GFAA CC(=O)N1CCC2(CC1)C[C@@H](C(=O)O)N(C(=O)c1ccc(Cl)cc1C)C2 72412308 RDOMLEJZBFXCFY-INIZCTEOSA-N 378.856 2.576 0 50 GFAA O=C(O)[C@@H]1CC12CCN(C(=O)c1ccc3c(c1)[nH]c(=O)n3C1CCCC1)CC2 262429167 MEMSMJBFZCYJLE-HNNXBMFYSA-N 383.448 2.772 0 50 GFAA CCOC1CC2(CCN(C(=O)[C@H]3CCCN3C(=O)OCC(F)(F)F)C2)C1 376461192 LMWXEZZAPOTHJA-MFOWVQHXSA-N 378.391 2.567 0 50 GFAA O=C(CCCc1ccccc1)N1CCN(c2ccnc(N3CCCC3)n2)CC1 82230636 QCLCDMJDKLWWKO-UHFFFAOYSA-N 379.508 2.748 0 50 GFAA CN(C)[C@H]1CN(C(=O)c2cccc(-c3c(O)ccc4ccccc34)c2)C[C@@H]1O 426381782 TVULSUBFKDPKDZ-FPOVZHCZSA-N 376.456 2.959 0 50 GFAA O=C(NCCF)C1CCN(C2CCN(CCCc3ccccc3)CC2)CC1 82121215 NVYOGTYDDPGXHF-UHFFFAOYSA-N 375.532 2.881 0 50 GFAA CCn1nc(CNC(=O)[C@@H](c2ccc3c(c2)OCO3)N(C)C)c2ccccc21 426432148 XSFKTYCKQFNPPP-HXUWFJFHSA-N 380.448 2.704 0 50 GFAA COc1ccc(C(=O)N[C@@H](C)c2ccccc2-n2cccn2)cc1OCCN 426536242 GUGYMRYQSDBXLD-HNNXBMFYSA-N 380.448 2.709 0 50 GFAA COc1ccc(N2C[C@H](C(=O)NCCc3ccc(C)o3)CC2=O)cc1Cl 91593744 IFLXIBNNRCWTRH-CYBMUJFWSA-N 376.840 2.962 0 50 GFAA CCN1CCN(C2(C(=O)NCc3ccc(C)s3)Cc3ccccc3C2)CC1 22852925 TVHUYCCGEKMFFN-UHFFFAOYSA-N 383.561 2.848 0 50 GFAA COc1ccc(-c2c(C)nn(C)c2NC(=O)NCc2n[nH]c3c2CCC3)cc1 95503073 MCEBOZVTWQRUBU-UHFFFAOYSA-N 380.452 2.938 0 50 GFAA COc1ccc(/C=C/CN2CC[C@@]3(O)CCN(C(=O)C4CCC4)C[C@H]3C2)cc1 95387444 WAHIXZMBTDHGBH-WWMDKCPZSA-N 384.520 2.794 0 50 GFAA COCCN(C)C[C@@H]1CN(c2cc(C)c3cc(SC)ccc3n2)C[C@@H]1CO 92037663 DRRVSFAKDATOTC-IAGOWNOFSA-N 389.565 2.888 0 50 GFAA CNc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)ccn1 95362309 VTMQWTHNTQCXEC-CEWLAPEOSA-N 380.467 2.965 0 50 GFAA CNC1CCN(C(=O)c2cc(Br)nn2-c2ccc(C)cc2)CC1 237135823 FRNQUYNFOWUESW-UHFFFAOYSA-N 377.286 2.767 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)CCC(=O)N(C)C1CCCCC1)C2 95518108 UCBBLWQFLAWMSE-MRXNPFEDSA-N 388.508 2.934 0 50 GFAA CC[C@@H]1CN(C(=O)Cc2cc(OC)c(OC)cc2C(C)=O)CCN1C(C)C 91876749 VOOAHTBEJBKBDT-QGZVFWFLSA-N 376.497 2.780 0 50 GFAA CC(C)(C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)c1ccccc1F 184020945 CMXCBIXMPWWRIS-UHFFFAOYSA-N 390.480 2.960 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)CO[C@H]2CCC[C@@H](C)C2)cc1OC 299741687 ADIJIUFUQBNASN-KBMXLJTQSA-N 379.453 2.931 0 50 GFAA O=C1NC(=O)[C@](CNC(=O)c2cc3cc(Cl)ccc3o2)(c2ccccc2)N1 299832671 KDEHHSHGVKUYEZ-IBGZPJMESA-N 383.791 2.551 0 50 GFAA O=C(CC[C@@]1(Cc2ccccc2)CCC(=O)N1)NC[C@H]1COc2ccccc2O1 299788394 SCRQRMMRQJALJV-MBSDFSHPSA-N 394.471 2.614 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CCCN2c2nc(C)c3ccccc3n2)C1 299784720 HLUUTIVYPMHBQQ-APWZRJJASA-N 396.491 2.709 0 50 GFAA Cc1cc2[nH]cc(C(=O)NC[C@H](c3ccccc3)N3CCCCCC3)c(=O)n2n1 825292083 PEVQOUIACCPUTE-LJQANCHMSA-N 393.491 2.678 0 50 GFAA O=C(NCCc1nc(-c2ccccn2)no1)[C@H]1CCCCN1Cc1ccccc1 670453399 MMQINACGXLXLGF-LJQANCHMSA-N 391.475 2.845 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N=[S@@]3(=O)CCC[C@@]4(CCCN4)C3)cnc21 1875393592 PXRAERWZYZUHAQ-UZTOHYMASA-N 389.525 2.612 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)NCc1cc2ccccc2o1 1875401814 SSFZRYFKVKNSPO-NVXWUHKLSA-N 381.436 2.950 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)C1(c2cccc(C(F)(F)F)c2)CC1 1875402650 JCCSWSXYCBVATC-IAOVAPTHSA-N 393.409 2.889 0 50 GFAA C[C@@H]1NC(=O)N(c2ccccc2NC(=O)c2cc(-c3ccsc3)[nH]n2)C1=O 952988143 NUOKOSQHHOYHNV-JTQLQIEISA-N 381.417 2.835 0 50 GFAA CCN1CCN(Cc2ccc(CNC(=O)c3ncoc3[C@H]3CCCO3)cc2)CC1 1339126636 PTXLWLAHRHXXBH-LJQANCHMSA-N 398.507 2.594 0 50 GFAA CCOC(=O)N1[C@@H](C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)CC[C@@H]1c1ccc(C)o1 222080053 ZGCILIIUXPJJDC-XMTFNYHQSA-N 389.496 2.945 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@@H]2CC[C@H]1CN(C(=O)c1ccncc1)C2 1565510541 IGCQMPSRJUOVJI-HOCLYGCPSA-N 387.915 2.768 0 50 GFAA O=C1O[C@H]2CN(CCc3c[nH]c4ccccc34)C[C@H]2N1CCc1ccccn1 1565526285 QVQAPYTZHHRGPW-RTWAWAEBSA-N 376.460 2.853 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(c2cncc(C(=O)N3CCOCC3)n2)C1 1506414704 RAFPRMFJERICLI-SFHVURJKSA-N 396.491 2.553 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3F)cc2CNCCNC(C)=O)cc1 12055109 KSCYVSNYYZJGSH-UHFFFAOYSA-N 382.439 2.913 0 50 GFAA COC(=O)CCC(=O)N(CC1CCN(C2CCCC2)CC1)C[C@@H]1CCCO1 12198890 IHXKMUFIQZHITK-IBGZPJMESA-N 380.529 2.602 0 50 GFAA Cc1c(CC(=O)NCc2cccnc2)c2c(n1C[C@H]1CCCO1)CCCC2=O 12449298 GMQZGAQQXGKTEG-QGZVFWFLSA-N 381.476 2.748 0 50 GFAA COc1ccc(Cn2cc(C(=O)NCCCn3ncc4ccccc43)nn2)cc1 12761485 WWRRLVPENYIMBW-UHFFFAOYSA-N 390.447 2.505 0 50 GFAA CC(C)CN1C[C@H](OCc2cccc(F)c2)CN(C(=O)C2(C)CC2)CC1=O 14532007 DQYUBVROLCJKHD-SFHVURJKSA-N 376.472 2.838 0 50 GFAA COc1ccc(CN2CCC3(CC2)C(=O)N(C)C(=O)N3CC(C)C)cc1OC 14533443 WKVPWGNHZVVTPB-UHFFFAOYSA-N 389.496 2.588 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NC1Cc3ccccc3C1)C2 14751334 SIKYSHQTBNLERT-SFHVURJKSA-N 378.520 2.661 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)CCSC)C3)C2=O)c1 14958857 NGGQDTLZDCZWMK-FQEVSTJZSA-N 394.512 2.929 0 50 GFAA Cc1nnc(NC(=O)c2ccc([C@H]3CCCN3CCCn3cccn3)s2)[nH]1 19866623 HFLACYKLOVKHRR-CQSZACIVSA-N 385.497 2.851 0 50 GFAA Cc1oc(C(=O)N[C@H]2C[C@H](Cn3cccn3)C[C@@H]2O)cc1COc1ccccc1 1857532730 NHFYWTZQIQHISY-VDGAXYAQSA-N 395.459 2.933 0 50 GFAA CC(C)NC(=O)N1CCC2(CC1)OCCc1sc(C(=O)N3CCCC3)cc12 1857682105 IAGBLBGWYBYEIG-UHFFFAOYSA-N 391.537 2.966 0 50 GFAA CCOC(=O)[C@H](CC(C)C)NC(=O)c1sc(-c2ncccn2)nc1CC 1857730172 ZNQLCABVDIXTTH-ZDUSSCGKSA-N 376.482 2.870 0 50 GFAA Cn1cc(C(=O)NCC2CCN(Cc3ccc(OCC4CC4)cc3)CC2)cn1 252511109 ZUEJCYLIQQHCSW-UHFFFAOYSA-N 382.508 2.851 0 50 GFAA Cc1cc(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 252527950 DUMMDWSZDNAXRD-WMZOPIPTSA-N 377.492 2.917 0 50 GFAA O=C(c1noc2c1CCc1ccccc1-2)N1CCC[C@H](c2nnc3n2CCC3)C1 932170219 DFSUTFGJAIRUEH-HNNXBMFYSA-N 389.459 2.998 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O)C1CCCCC1 3623097 BRMXWOOTFWLCNN-GOSISDBHSA-N 397.397 2.736 0 50 GFAA Cn1c(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)nc2ccccc21 20779092 ZBTIFJCTHDCBLM-FQEVSTJZSA-N 378.520 2.685 0 50 GFAA Cc1sc2nc(CN3CCCC3)nc(N3CCCn4[nH]c(=N)cc4C3)c2c1C 2325775402 BQHCWIBZLGHSSO-UHFFFAOYSA-N 397.552 2.923 0 50 GFAA Brc1ccn2c(CN3CCN(Cc4cscn4)CC3)cnc2c1 2325779197 NYQHIBXMZZVHKA-UHFFFAOYSA-N 392.326 2.871 0 50 GFAA Cc1nccc(CCC(=O)N[C@H](C)CN(C)C(=O)C/C=C/c2ccc(F)cc2)n1 2325793371 ROGMAGOCYZETFK-DWTRPJMMSA-N 398.482 2.923 0 50 GFAA Cc1c(C(=O)Nc2ccccc2)sc2ncn(CC(=O)N3CCCC3)c(=O)c12 957774 AMAVBSSNPNFOPB-UHFFFAOYSA-N 396.472 2.641 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2cc(Cl)c(OC)c(OC)c2)C1=O 2356135383 BPWSWFHWXOQYSU-HXUWFJFHSA-N 396.915 2.961 0 50 GFAA CCCCn1c(CN2CCC[C@@]23CCCN(CCO)C3=O)nc2ccccc21 2356149314 UPSKTFKINXDVGE-JOCHJYFZSA-N 384.524 2.786 0 50 GFAA COc1cnccc1-c1ccc(C(=O)NCc2cccnc2-n2cncn2)cc1 2356166095 OFKLMKKTAFXNMY-UHFFFAOYSA-N 386.415 2.663 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1ccc(OC)c(OC)c1 4032058 HYHIGYMSTSNQSY-KRWDZBQOSA-N 390.461 2.917 0 50 GFAA O=C1C[C@H](N2CCN(c3ccccc3F)CC2)C(=O)N1c1ccc(Cl)cc1 100517862 KYDCIKXOWRYGMX-SFHVURJKSA-N 387.842 2.933 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)/C=C/c3cccs3)C2)CC1 55060788 STUGXWHSIKXXRK-KXPUMZMLSA-N 377.510 2.526 0 50 GFAA COCCN(Cc1cnn(C)c1)C(=O)c1c(C)nn(-c2ccc(F)cc2)c1C 55134380 SVMHRCOANBUXLP-UHFFFAOYSA-N 385.443 2.651 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(C(=O)CSc2nnc(N)s2)C1 55414560 UMUDBYMUFVWMCT-CYBMUJFWSA-N 378.523 2.838 0 50 GFAA c1ccc(CN2CCN(CCN3CCN(Cc4ccccc4)CC3)CC2)cc1 22440735 MUSJGTFXLISAIS-UHFFFAOYSA-N 378.564 2.622 0 50 GFAA Cc1ccnc(OC2CCN(C(=O)C(=O)Nc3ccc4oc(C)nc4c3)CC2)c1 252536223 HXBVHTLRKVRKDB-UHFFFAOYSA-N 394.431 2.848 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)c1cc(CC(C)C)[nH]n1 409414168 OFLAYJUMVBZROV-PXNSSMCTSA-N 376.545 2.961 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CC(=O)N[C@H](C)[C@@H]1CCCO1 2780147 LOHRPVLZFPPFCC-APPZFPTMSA-N 384.196 2.657 0 50 GFAA CNC(=O)Cc1noc(CN2Cc3cc(OC)ccc3C[C@H]2C2CCCCC2)n1 360621408 OVAMDWWUNKKQFQ-IBGZPJMESA-N 398.507 2.874 0 50 GFAA CC1(C)C[C@H](NC(=O)Cn2nnc(-c3ccccc3)n2)c2ccc(F)cc2O1 484867820 RRZMAJTVQVUSMR-INIZCTEOSA-N 381.411 2.898 0 50 GFAA Cc1ccc(-c2noc(CCC(=O)N3CCC(c4nc[nH]n4)CC3)n2)cc1F 363319517 KMVGULLUNGPCTH-UHFFFAOYSA-N 384.415 2.641 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NCc3ccnc(OC4CCC4)c3)c2c1 241564199 OSEHODVKCYJKAY-UHFFFAOYSA-N 384.461 2.972 0 50 GFAA CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)N[C@@H]3CCN(c4ccccc4)C3)cc2O1 443734628 RPTFSEHIJBPOAN-ZHRRBRCNSA-N 395.459 2.918 0 50 GFAA O=C1CN(c2ccc(-c3ccccc3)nn2)CCN1Cc1ccc2c(c1)OCO2 32587141 FOAJIUWRYOJAPD-UHFFFAOYSA-N 388.427 2.721 0 50 GFAA CCCc1nn(-c2ccccc2)c(=O)n1CC(=O)N[C@@H](C)c1ncccc1C 77516181 POPSKBUZMUVQKC-INIZCTEOSA-N 379.464 2.567 0 50 GFAA Cc1ccccc1-c1nnc(CN2CCN(C(=O)c3ccccc3O)CC2)o1 174608108 ITPLROIEIROOLY-UHFFFAOYSA-N 378.432 2.709 0 50 GFAA O=C(NCc1ccc(CN2CCCC2=O)cc1)c1nn(-c2ccccc2)cc1O 175582303 BIIOZXLGFZCTLL-UHFFFAOYSA-N 390.443 2.630 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(c4ccc(C)c(C)c4)C(=O)[C@@H]3N3CCCN23)cc1 136731766 ZNHQAQNZJHWOBI-PWRODBHTSA-N 391.471 2.848 0 50 GFAA COc1ccccc1-c1ncc(CN=c2cc([C@@H]3CCOC3)nc(N)[nH]2)s1 426477178 IATNMHRTRQVOSZ-GFCCVEGCSA-N 383.477 2.729 0 50 GFAA CCn1nc(C)c([C@H](C)NC(=O)N(C)Cc2nc(-c3cccnc3)no2)c1C 426534133 XFJPTYPHZQNGIU-LBPRGKRZSA-N 383.456 2.867 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCC(Cc3nccn3C)CC2)[C@@H]1c1ccccc1 178621468 ZQPYSVKSYUJQOO-KNQAVFIVSA-N 394.519 2.811 0 50 GFAA O=C(c1ccc(NCc2cccnc2)nc1)N1CCC(Cn2cccn2)CC1 20877457 XHSKTDKXGBPIEJ-UHFFFAOYSA-N 376.464 2.838 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)/C(=C(/O)N[C@H]1CCS(=O)(=O)C1)S2 334158925 BKOZBLITUOKODU-HJKHNQFXSA-N 393.534 2.500 0 50 GFAA Cc1cccc(CNC(=O)Nc2cccc(OCC(=O)N3CCOCC3)c2)c1 96179758 IZRGYUDFBDFCJB-UHFFFAOYSA-N 383.448 2.554 0 50 GFAA COc1ncccc1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91416839 DCKNHWUHQWUMOH-UHFFFAOYSA-N 394.475 2.530 0 50 GFAA CCc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccc(F)cc2)cc1 239309395 HNVIFFAQTNUKSF-SLFFLAALSA-N 379.435 2.924 0 50 GFAA CCn1nc(C)c(CN2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)c1C 91680544 RMINNFOVJOORTC-UHFFFAOYSA-N 398.555 2.690 0 50 GFAA CCc1nnc(CN2CCC3(CC2)CC(=O)N(Cc2cc(F)cc(F)c2)C3)o1 95355772 BBSHECKSCJHTSK-UHFFFAOYSA-N 390.434 2.925 0 50 GFAA Cc1nn(C)cc1C(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95373878 BEMANPUIQPUARC-PWIZWCRZSA-N 386.446 2.709 0 50 GFAA CC(C)CCc1[nH]nc2c1CN(C(=O)CN1CCOc3ccccc3C1)CC2 23506141 TZPYTQHPLBTFER-UHFFFAOYSA-N 382.508 2.778 0 50 GFAA O=C(NCc1csc(Br)c1)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O 298471287 PZSIHCBQKCPRQD-YUMQZZPRSA-N 385.205 2.584 0 50 GFAA Cc1cccc2nc(CCN(C)C(=O)NC3CCN(C(=O)C(C)C)CC3)[nH]c12 534585978 WMKJFZSLFAKAEY-UHFFFAOYSA-N 385.512 2.702 0 50 GFAA CC[C@@H]1C(=O)NCCN1C(=O)c1ccc(-c2n[nH]c(-c3cccc(C)c3)n2)cc1 534665493 CJIKPPLFTWMQSO-GOSISDBHSA-N 389.459 2.798 0 50 GFAA CC(C)CNC(=O)[C@@H]1C[C@@H](O)[C@H](NC(=O)c2ccccc2-c2ccccc2)C1 1940194986 GURSLSUPGUBLPX-IOMROCGXSA-N 380.488 2.995 0 50 GFAA CCC(=O)N1CCN(c2cccc3c2C(=O)N(Cc2cccc(F)c2)C3=O)CC1 299777354 DNIKFAYTPFWFNB-UHFFFAOYSA-N 395.434 2.681 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2)CN(C(=O)CCCc2cnn[nH]2)C1 952891696 HIGMMSPKUGRAAZ-UHFFFAOYSA-N 378.480 2.924 0 50 GFAA Cn1cc([C@]2(C(=O)NCc3ccc(Oc4ccccc4)cn3)CCCO2)cn1 1875272218 DBBIWMRTEDVERV-NRFANRHFSA-N 378.432 2.930 0 50 GFAA COc1ccc(-c2ccncc2)cc1CN[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875399771 IUHKVBICQDEZAO-MAODMQOUSA-N 378.476 2.883 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@@H]2COc3c(cccc3OC)C2)CC1 886054751 BDJOTVIGWBPXBN-KRWDZBQOSA-N 384.480 2.804 0 50 GFAA O=S(=O)(c1cccc(F)c1)N1C[C@@H]2CC[C@H]1CN(Cc1cccnc1)C2 1565530831 XVRLVGUAEKZIDN-AEFFLSMTSA-N 375.469 2.506 0 50 GFAA CCCn1ncnc1[C@@H](C)NS(=O)(=O)c1ccc(-c2onc(C)c2C)o1 1506396178 PJPXZAHBKWSGMG-GFCCVEGCSA-N 379.442 2.592 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2cc(-c3ccncc3)no2)CC[C@@H]1O 1529198644 JGPUJVGLEXFQMS-FCHUYYIVSA-N 379.460 2.525 0 50 GFAA CCC(=O)c1ccc(OCC(=O)N2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)cc1 1704350476 AFKFWWXRDBSOND-UZLBHIALSA-N 386.448 2.671 0 50 GFAA COC(=O)c1cccc(C(=O)NC[C@@H]2Cc3cccc(-c4cncnc4)c3O2)c1 12079757 RCGDXSZSRNBVEA-SFHVURJKSA-N 389.411 2.664 0 50 GFAA Cc1cn2c3c(=O)n(CCC(C)C)c(=O)n(C)c3nc2n1Cc1ccccc1 12547153 DAJXZTQRRQZAAO-UHFFFAOYSA-N 379.464 2.552 0 50 GFAA O=C(CCN1CCCO1)N1CCC(CCC(=O)N2CCc3ccccc3C2)CC1 12707252 XJULUELLSCHQAR-UHFFFAOYSA-N 399.535 2.618 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCO[C@H](Cc2ccccc2Cl)C1 12836180 VLNJURBCICEKES-QGZVFWFLSA-N 378.900 2.903 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCc1cccc(C)n1)C2 14732924 BFKJGTYYEKULIU-KRWDZBQOSA-N 381.524 2.880 0 50 GFAA COCCn1c(C)cc(=O)c(C(=O)NCCc2ccccn2)c1CC1CCCC1 14880196 NCNDTLMOEYLXHE-UHFFFAOYSA-N 397.519 2.903 0 50 GFAA Nc1cc(=O)[nH]c(SCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n1 17903141 BKUUJSJGGHUASX-UHFFFAOYSA-N 378.763 2.755 0 50 GFAA Cc1cc(=O)c(O)c(C(C)(C)CC(=O)N[C@@H](Cc2ccccc2)c2nc[nH]n2)o1 1857526885 IFJOFDBYIQKSKN-HNNXBMFYSA-N 396.447 2.540 0 50 GFAA Cc1cccnc1CN1C(=O)C[C@H]2[C@@H]1CCN2C(=O)COc1cccc(Cl)c1 1857704501 UWEYFVWENCZVKE-OALUTQOASA-N 399.878 2.824 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4ccccn4)C[C@]34CC[C@H]2O4)c1F 1875250164 CKPAUJYWHQGZBD-KCXPTXFHSA-N 381.451 2.943 0 50 GFAA CNC[C@H]1CCCN1S(=O)(=O)c1c(Cl)cc(F)cc1Br 237279003 TWJNURNPMCKXFZ-SECBINFHSA-N 385.686 2.614 0 50 GFAA O=C(NCCN1CCc2sccc2C1)N1CCO[C@H](c2cccc(O)c2)C1 163981840 HLBQSMFVUSOTGJ-SFHVURJKSA-N 387.505 2.595 0 50 GFAA Cn1ncc2nc(C(F)F)c(C(=O)N[C@@H]3CCCC[C@]34CCCNC4)cc21 2325779205 OENATDZUFKEHNR-DNVCBOLYSA-N 377.439 2.948 0 50 GFAA C[C@H](NC(=O)[C@H]1Cc2ccc(Cl)cc2C(=O)O1)[C@@H](O)c1c(F)cccc1F 2325860441 IPCZQTSLBGQUJS-ABROLUODSA-N 395.789 2.938 0 50 GFAA CC[C@@H](C(=O)N[C@@H]1[C@H]2C[C@@H]1N(C(=O)c1nc(Cl)sc1C(C)C)C2)N(C)C 2325872616 GJZDGIINQAHSFO-ZDEQEGDKSA-N 398.960 2.589 0 50 GFAA CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)Cc1cc(=O)n(CC(C)C)[nH]1 934441934 KITWHAOCWZSMJF-LJQANCHMSA-N 391.487 2.732 0 50 GFAA CN(C(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)[C@H]1CCS(=O)(=O)C1 125004253 UIIUNVAIXUMHGR-SOUVJXGZSA-N 390.530 2.992 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356145705 IENOLDHGEQADKF-FQEVSTJZSA-N 388.947 2.972 0 50 GFAA CCOCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1[C@H]2Cc1cccc(OC)c1 2356152947 JHLJSAYVEIWJKK-LQWHRVPQSA-N 396.487 2.623 0 50 GFAA Cc1cc(C)cc(N(C(=O)c2ccc3c(c2)OCO3)[C@@H]2C=CS(=O)(=O)C2)c1 4101362 HIRFKHTURFWMBS-MRXNPFEDSA-N 385.441 2.990 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1C(=O)N1CCCCC1 6745549 RAIUMSYBDCNNLN-OAHLLOKOSA-N 380.510 2.742 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCC[C@H]3CO)ncn2)CC1 171884651 ZLXRWXKJNLYOEI-KRWDZBQOSA-N 383.496 2.527 0 50 GFAA COC1(c2nc(-c3ccccn3)no2)CCN(C(=O)Cc2ccc(O)cc2)CC1 225838987 FMCDEYYPEYXPPL-UHFFFAOYSA-N 394.431 2.544 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2)c(Cl)c1 1393152 XATGBEYWXHQVNU-UHFFFAOYSA-N 394.880 2.832 0 50 GFAA CCS(=O)(=O)N1CCC[C@H](C(=O)NC(c2ccccc2)c2ccccc2)C1 10302681 PCWXMULQBKVCLZ-IBGZPJMESA-N 386.517 2.954 0 50 GFAA COc1ccccc1-n1nc(C(C)C)nc1-c1ccc2[nH]c(=O)c(=O)[nH]c2c1 67605253 CBFCMTOHCVTNNX-UHFFFAOYSA-N 377.404 2.596 0 50 GFAA COC(=O)CCCS(=O)(=O)NCc1ccccc1OCc1ccccc1 311545583 UXEBXSOVOXPRGT-UHFFFAOYSA-N 377.462 2.638 0 50 GFAA Cn1c(=O)c2sccc2n2c(CN3CC[C@@H](Cc4ccc(F)cc4)C3)nnc12 121333225 NXBXTPQXYKVBFJ-AWEZNQCLSA-N 397.479 2.846 0 50 GFAA CNc1nc(CNC(=O)Nc2ccc(Oc3ccccc3C(N)=O)cc2)cs1 443956018 HYZJSIHCHYKAHG-UHFFFAOYSA-N 397.460 3.398 0 50 GFAA Cc1nc(CN2CCCN(C(=O)Nc3cccc4c3OCCO4)CC2)cs1 172150188 BENTYKBJXYQWDZ-UHFFFAOYSA-N 388.493 2.963 0 50 GFAA Cc1ccc(C(=O)NC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(Cc3ccccc3)c2)o1 328605788 PCYJIOBYZRSCFD-LAUBAEHRSA-N 392.459 2.782 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCNC[C@H]3C)cc2Br)no1 124904603 FGJNBDRXDNVGDU-LLVKDONJSA-N 394.269 2.758 0 50 GFAA Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@H]1CCc2nnnn2CC1 333679697 FAINMTKTTYDOPH-STQMWFEESA-N 377.518 2.669 0 50 GFAA O=C(NCc1nnc(-c2ccccc2)s1)c1ccnc(NC(=O)C2CC2)c1 367713246 RDRZFKHVDFZRAP-UHFFFAOYSA-N 379.445 2.879 0 50 GFAA CC(C)C(=O)N1CCC(NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)CC1 173369104 QYQNGOWHCOPKDP-UHFFFAOYSA-N 382.464 2.991 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(CCO)Cc2cccc(Cl)c2)cc1 241435135 NKXASSDRPYOYCT-UHFFFAOYSA-N 375.856 2.731 0 50 GFAA O=C(c1cccc(-c2ccc([C@@H](O)CN3CCOCC3)cc2)c1)N1CCCC1 426403857 XKYSKWAPIFOKAB-QFIPXVFZSA-N 380.488 2.955 0 50 GFAA O=C(Cn1nccc1[C@H]1CCCNC1)NCc1csc(-c2cccs2)n1 426740405 HQODJIYPWXVNRV-ZDUSSCGKSA-N 387.534 2.852 0 50 GFAA O=C(Nc1ccc2c(c1)S(=O)(=O)CC2)N1CCCN(Cc2ccccc2)CC1 178366263 QIGYQJXWIZDXCB-UHFFFAOYSA-N 399.516 2.756 0 50 GFAA Cc1cc(O)c2cccc(C(=O)N3CCC[C@H](C(=O)c4nccn4C)C3)c2n1 426489831 ACMNINBWYUSBHR-AWEZNQCLSA-N 378.432 2.717 0 50 GFAA O=C(CN1CCN(C(=O)Nc2ccc(-c3ccco3)cc2)CC1)N1CCCC1 96162950 CTDRZRWDHWWPMW-UHFFFAOYSA-N 382.464 2.719 0 50 GFAA COc1ccc(C(=O)NC2CC2)c(OC2CCN(C(=O)c3cc[nH]c3)CC2)c1 95499876 UFOPCOQEHYDMNY-UHFFFAOYSA-N 383.448 2.599 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Nc3ccc(Cl)cc3)[C@@H]3OC(C)(C)O[C@@H]3[C@H]2O1 239433192 XINPLTKQOKCZLO-SRTKAIALSA-N 383.828 2.675 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C(=O)c2cc(=O)cc(C)o2)cc1 95528845 COHVFLFNLRSYQJ-UHFFFAOYSA-N 398.503 2.984 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2cn(C)nc2C(F)(F)F)[C@@H](c2ccccc2)CO1 293629806 WSVVQRJHNPLPOT-WCQYABFASA-N 389.399 2.590 0 50 GFAA CN(Cc1ccno1)C(=O)c1cnc(COc2ccc(C(C)(C)C)cc2)[nH]c1=O 91548472 ZBFJFEAEFIDZFW-UHFFFAOYSA-N 396.447 2.907 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)NCc3nc(-c4ccccc4)cs3)nn2)CC1 244748697 OMPOMLUNIGVYHJ-GASCZTMLSA-N 382.493 2.774 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CCO1 299749068 JCLFXQKIXNXNRS-AWEZNQCLSA-N 396.321 2.818 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cccc(-n3cc(Br)cn3)c2)C1 299745263 XGOXQIZVAVKMPM-LBPRGKRZSA-N 378.226 2.572 0 50 GFAA CC(C)Cn1nc(CC(=O)NCC(=O)c2ccccc2)c2ccccc2c1=O 253414632 YAFXUQVPIQZSBU-UHFFFAOYSA-N 377.444 2.594 0 50 GFAA CCN(Cc1nc(C)no1)C(=O)N[C@H]1CCCN(Cc2ccc(F)cc2)C1 584902659 QOKBNIZDNYZVMK-KRWDZBQOSA-N 375.448 2.713 0 50 GFAA Cc1sc(CC(=O)N[C@@H]2CCCN3CCSC[C@@H]23)nc1-c1ccco1 928082969 YFRPUZZLEHPRTK-KGLIPLIRSA-N 377.535 2.950 0 50 GFAA N[C@H]1CCCCCC[C@@H]1C(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894172 MRYVULVLPAYMLK-OALUTQOASA-N 394.523 2.937 0 50 GFAA O=C(NC[C@@H]1C[C@H](CO)CO1)[C@@]1(Cc2ccccc2)CCc2ccccc2C1 1875299625 QAFDZURJQMMOTC-WNOPAQSVSA-N 379.500 2.918 0 50 GFAA CC(=O)N/C(=C/c1ccccc1)C(=O)N1CC[C@@H](CO)[C@H](c2ccccc2)C1 1875312485 FBBIQKHFCBBSCJ-MQXQUQPRSA-N 378.472 2.788 0 50 GFAA CN1CCC[C@]2(CCN(C(=O)Nc3cn(CC(F)(F)F)nc3C3CC3)C2)C1=O 1875319171 RGHISMVIQUTMQW-QGZVFWFLSA-N 399.417 2.799 0 50 GFAA CN(CCN(C)C(=O)c1csc(Cl)n1)C(=O)c1coc(C2CCC2)n1 1875328210 FQBGDGQXRIHDIO-UHFFFAOYSA-N 382.873 2.896 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1cccc(-n2ccnc2)c1 1875401339 JKVGVWOLFJRZMQ-QZTJIDSGSA-N 392.463 2.803 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cccc(CO)c1 1875402354 DLANBVIIKSFDFF-DUXKGJEZSA-N 391.471 2.612 0 50 GFAA C[C@@H](C(=O)N1CCN(CCc2ccccc2)C(=O)C1)n1cnc2ccccc21 952989672 UBOLFWUDPCWDSY-KRWDZBQOSA-N 376.460 2.511 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)c2cccc3c2OCCO3)C1)c1ccsc1 952982026 VWZXZHGAYKEBCV-AWEZNQCLSA-N 386.473 2.802 0 50 GFAA O=C([C@@H]1CC12CCS(=O)(=O)CC2)N1CCCc2cccc(OC(F)F)c21 274882260 DAGVZJYYUOCFRD-ZDUSSCGKSA-N 385.432 2.782 0 50 GFAA Cn1cc([C@@H]2C[S@@](=O)CCN2C(=O)c2ccc(CCC(F)(F)F)cc2)cn1 277839983 ZWWUHNXIHAFUHR-OQRWROFFSA-N 399.438 2.861 0 50 GFAA Cc1ccc(-n2nnc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)c2C)cc1 170602929 XSCRWJGAUTXWSM-HNNXBMFYSA-N 399.495 2.966 0 50 GFAA COc1ccc([C@@H](NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C(F)F)cc1F 170605720 VKANFAAWWXUFMP-XJKSGUPXSA-N 384.398 2.905 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1F 189991005 IRFIAHBEPRYJCE-UHFFFAOYSA-N 393.418 2.574 0 50 GFAA C[C@@H]1CN(C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)C[C@H]1CO 192216257 AXRXYJIXKFXTNC-WBVHZDCISA-N 388.489 2.753 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(c3nnc4ccccn34)CC2)cc1OC 1506415976 BWEDYWRSHDNCJB-LJQANCHMSA-N 396.447 2.752 0 50 GFAA COc1c(C)cc(C(=O)[C@@H]2CCCN(C(=O)Cn3nc(C)nc3C)C2)cc1C 11760988 SFNHSGULGCQFKJ-QGZVFWFLSA-N 384.480 2.642 0 50 GFAA O=C(COc1ccccc1Cl)N[C@H]1CC(=O)N(Cc2ccc(F)cc2)C1 12072768 MBTJKYUBGMHDII-HNNXBMFYSA-N 376.815 2.775 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)cc1 12411054 ROGKXTQQYHQGMR-UHFFFAOYSA-N 383.429 2.831 0 50 GFAA biogenic,in-vitro COc1cccc(CN[C@@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)c1 14733191 GWQKPVLHIRPUHX-QGZVFWFLSA-N 382.508 2.702 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1ccccc1F)CC2)C1CCCCC1 14981269 QWNIQXSATDRASK-UHFFFAOYSA-N 399.514 2.715 0 50 GFAA Cn1ccc2cc(C(=O)Nc3ccc4c(c3)C(=O)N3CCC[C@@H]3C(=O)N4)ccc21 206235010 RRNGLGZNZVUWDH-LJQANCHMSA-N 388.427 2.987 0 50 GFAA O=S(=O)(c1ccc2nc[nH]c2c1)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857681422 DPGNEIFUNFASJZ-DQLDELGASA-N 397.500 2.710 0 50 GFAA CCOC(=O)c1ccc(OCCCN2CCN3C(=O)OC[C@@]3(CC)C2)cc1 1857685599 ZGJPGWWJQNBQNW-HXUWFJFHSA-N 376.453 2.549 0 50 GFAA NC(=O)COc1ccc(CN2CCc3[nH]nc(-c4ccccc4)c3CC2)cc1 1857708880 RVGXKSSFKWMVKU-UHFFFAOYSA-N 376.460 2.542 0 50 GFAA Cc1cccnc1CN1CC2(CCN(C(=O)[C@H]3CC34CCC4)CC2)OCCC1=O 1857716564 DBMXIGCXYABKPB-GOSISDBHSA-N 397.519 2.690 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NC3(c4ccccc4Cl)CC3)CC2=O)s1 1857722824 PBBJZDWHPUTSOP-LLVKDONJSA-N 390.896 2.912 0 50 GFAA O=C(c1cn2ccsc2n1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1875249149 HKVFUGBFJFOEAJ-HXUWFJFHSA-N 395.488 2.889 0 50 GFAA COCC1CCN(C(=O)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)CC1 112437460 LUFRJTPTFPSQDM-ROUUACIJSA-N 389.540 2.864 0 50 GFAA CCc1cc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)/C=C/C(C)C)C3)no1 12056776 DPWYAJNYGFDGDG-VOTSOKGWSA-N 396.491 2.967 0 50 GFAA COc1ccccc1[C@H]1CNCCN1C(=O)c1sc(-c2cnn(C)c2)nc1C 261932607 JSBODZOCFUXTRD-MRXNPFEDSA-N 397.504 2.647 0 50 GFAA COc1ccc(C2=NO[C@H](CNC(=O)c3c[nH]nc3-c3ccncc3)C2)cc1F 801351172 JECONZIFTWTDBG-AWEZNQCLSA-N 395.394 2.542 0 50 GFAA C[C@@]1(O)CCOC2(CCN(S(=O)(=O)c3cc4ccccc4s3)CC2)C1 1704345115 VYTHOKHKFLEOPH-QGZVFWFLSA-N 381.519 2.986 0 50 GFAA Cc1nc2cc(C(=O)N3CCC[C@@H](NCCO)C3)ccc2n1-c1ccccc1 1263168678 UICIERMOVBQEMY-GOSISDBHSA-N 378.476 2.520 0 50 GFAA COc1cc2c(cc1OC)CN1C(=S)N(c3ccccc3OC)C(=O)[C@@H]1C2 4743807 OGUCPSSTNVXKLQ-HNNXBMFYSA-N 384.457 2.771 0 50 GFAA C[C@@H](NC(=O)c1cc(CN2CCN(C)CC2)on1)c1cccc(C(F)(F)F)c1 2325735675 XEYBIGWPNMUUMY-CYBMUJFWSA-N 396.413 2.932 0 50 GFAA CCOc1ccc(C(=O)N2Cc3c[nH]nc3[C@@H](c3n[nH]c(CC)n3)C2)cc1C 2325775908 AUWMJRIDUYGKNA-HNNXBMFYSA-N 380.452 2.585 0 50 GFAA COC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C(=O)N2CCC(C)CC2)C(C)C)c1C 2325883448 NLJZXOJYMSLPSM-QGZVFWFLSA-N 378.469 2.858 0 50 GFAA O=S(=O)(c1ccc(Cc2nc(-c3ccncc3)no2)cc1)N1CCCCC1 113739613 IGUQCKGAUJJEHM-UHFFFAOYSA-N 384.461 2.897 0 50 GFAA O=C(CSC1=NC(=O)[C@@H](c2ccccc2)C(=O)N1)Nc1ccccc1Cl 1186408 YHQPKNAPFIYFKL-UHFFFAOYSA-N 387.848 2.808 0 50 GFAA CCCCNC(=O)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1cccnc1 225726799 ZGRDMMNWVQSGHS-QGZVFWFLSA-N 376.501 2.592 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CCc4n[nH]cc4C3)nc2)C1 67649758 HGXMEPIBKRLXPK-QGZVFWFLSA-N 395.507 2.835 0 50 GFAA COc1c[nH]c(C(=O)N2CCC[C@@H](c3[nH]ncc3-c3ccccc3)C2)cc1=O 67850122 CSLULWRZGBSARR-OAHLLOKOSA-N 378.432 2.793 0 50 GFAA COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@H](C)Oc1ccccc1 427027372 BDSHTAXGUXSSEY-DJJJIMSYSA-N 384.407 2.975 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CS(=O)(=O)c3ccccc32)c2cnn(C(C)C)c2n1 172327682 WSNILRDXLICYML-MRXNPFEDSA-N 384.461 2.579 0 50 GFAA CCOC(=O)/C(=C\[C@@H]1OC(C)(C)O[C@H]1COCc1ccccc1)CC(=O)OC 212706376 YUXYPBBQAFUGSA-JAEPCABDSA-N 392.448 2.776 0 50 GFAA Cc1nc2sc3c(c2c(=O)n1NC(=O)c1nn(C)cc1Cl)CC[C@H](C)C3 2778285 SNDLMOZPKWOGTR-QMMMGPOBSA-N 391.884 2.662 0 50 GFAA O=C1CC[C@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@H]2N1CCCCO 72412147 UPFPYYUFSLZAMT-DLBZAZTESA-N 386.521 2.795 0 50 GFAA C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(-n4cncn4)c(F)c3)CC2)C1 173088590 SPCODQWBNCPKFF-OAHLLOKOSA-N 399.470 2.517 0 50 GFAA NC(=O)c1cc2c(nc1O)CCC[C@H]2NC(=O)c1cc2ccc(Cl)cc2[nH]1 364046040 WOTXRPILCAAFLO-CQSZACIVSA-N 384.823 2.828 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCCC[C@@H]1CCC(=O)O)c1c(F)cccc1F 236716868 AOCJPLSBBSONEI-CZUORRHYSA-N 382.407 2.778 0 50 GFAA Cc1ccc(CNC(=O)c2ccc3c(c2)CN(CCCn2ccnc2)C3=O)o1 72447990 IOVLMAKXWNSWMZ-UHFFFAOYSA-N 378.432 2.761 0 50 GFAA O=C(CCc1nnc[nH]1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 175872345 ZGHZZRBCYONRDK-UHFFFAOYSA-N 386.459 2.966 0 50 GFAA Cc1ccc(-c2ccc(C(=O)Nc3cc(S(N)(=O)=O)cc(C)c3C)cc2)nn1 1440616373 ITVYSPMWOIJVLF-UHFFFAOYSA-N 396.472 2.969 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Nc1ccccc1C(F)(F)F 239038797 DYHZTLSTMQNXRE-NRULLWLTSA-N 390.361 2.697 0 50 GFAA O=C(C[C@H]1CCCS(=O)(=O)C1)N[C@H](c1ccccc1)c1ccc2[nH]cnc2c1 292941947 BGHTYEKADXAVDB-QVKFZJNVSA-N 397.500 2.983 0 50 GFAA CCn1cnnc1CN1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 95524165 UHNOIXDJNUWQKB-UHFFFAOYSA-N 381.524 2.745 0 50 GFAA Cc1ccnn1CC(=O)N1CCC[C@H](CCC(=O)NCc2ccccc2F)C1 95528193 XLWLECLHIRNYEW-QGZVFWFLSA-N 386.471 2.666 0 50 GFAA O=C(CCn1nnc2ccccc21)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2 91441307 ZBSADDWHJLNBET-WOJBJXKFSA-N 389.503 2.944 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)nc(C)n1 91860537 CIJMOAKYZSYRTC-FXAWDEMLSA-N 376.504 2.797 0 50 GFAA CC(C)OCCCN1C(=O)c2ccccc2[C@H]1NCC(=O)NCc1ccccc1 334163588 YAAQGVCZXYTJDQ-QFIPXVFZSA-N 395.503 2.862 0 50 GFAA O=C1CC[C@@]2(CCCN(c3cnc4ccccc4n3)C2)CN1CCc1c[nH]cn1 91745746 WZHHREAUHKRMPC-JOCHJYFZSA-N 390.491 2.805 0 50 GFAA COCC(=O)NCc1cc2n(n1)CCCN(Cc1cccc(-c3ccco3)c1)C2 91594093 ZYRMXOGJHMMZOM-UHFFFAOYSA-N 394.475 2.812 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCc3c(c4ccccc4n3C)C2)cc1 244514568 ZOVFEIYZBBOUGH-INIZCTEOSA-N 397.500 2.973 0 50 GFAA Cc1noc([C@@H]2CN(C(=O)Nc3cn(C)nc3C3CCCCC3)CCN2C)n1 297398306 MIYWGIJBXXBSAF-INIZCTEOSA-N 387.488 2.680 0 50 GFAA O=C(N[C@@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1ccc(-c2ccccc2)nc1O 253534792 DFGGZMHRJYAELJ-CDXJDZJCSA-N 389.455 2.961 0 50 GFAA COc1ccc(CN(C[C@H]2CCCO2)C(=O)NCc2nc(C3CC3)no2)cc1 534669375 PGADRFLBICQSHA-QGZVFWFLSA-N 386.452 2.846 0 50 GFAA O=C(COc1ccc(NC(=O)C2(c3ccccc3F)CC2)cc1)N1CCOCC1 827968435 XCDWTDZSTMWINY-UHFFFAOYSA-N 398.434 2.734 0 50 GFAA O=C(NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2)c1ccc2scnc2c1 828168840 RRDKUBHLSXEBGV-NFAYLAGKSA-N 380.477 2.761 0 50 GFAA Cc1ccc(-c2ccno2)cc1S(=O)(=O)NCCCc1csc(N)n1 670461344 CLGWFGJOTLIWMI-UHFFFAOYSA-N 378.479 2.600 0 50 GFAA C=Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)cc1 1875374142 CCZWEIGOVLXHIL-CQSZACIVSA-N 397.460 2.922 0 50 GFAA CCN1CC[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2OC)C1 952976370 MXZYUVHQBRQQJP-NSHDSACASA-N 381.325 2.964 0 50 GFAA Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)NC[C@]1(C)CCOC2(CCC2)C1 894652150 GPBSOYSHNRVKDC-LJQANCHMSA-N 377.485 2.845 0 50 GFAA COCC1(C(=O)N[C@H](C)C2CCN(C(=O)Cc3ccccc3F)CC2)CCC1 1775992605 SSVOFBAJHGGGOB-MRXNPFEDSA-N 390.499 2.928 0 50 GFAA CC(C)c1nc2c(n1C)CCN(C(=O)Nc1cnn(Cc3ccccn3)c1)C2 186096160 ITCQBWXBIOZUEN-UHFFFAOYSA-N 379.468 2.774 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@@H]1CC12CCOCC2)c1ccc(Br)cc1 170066331 ZFCBUZYFESATAV-KBPBESRZSA-N 382.254 2.898 0 50 GFAA Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)N1CCOC2(CCOCC2)C1 278581812 ANAPDSUXXMVBSC-UHFFFAOYSA-N 392.406 2.779 0 50 GFAA CN1CCC[C@H](CCNC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704315856 PNFVXHBRJUBTQL-QGZVFWFLSA-N 398.507 2.640 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1ccc(-n2cnnc2)cc1 1704346980 DVASXLGZWMAMID-XMSQKQJNSA-N 399.454 2.803 0 50 GFAA CO[C@@H]1C[C@H](C(=O)N2CCN(Cc3ccc(C(C)(C)C)cc3)CC2)CC[C@@H]1O 1704355008 KJZXJBMQCOJBHF-HLAWJBBLSA-N 388.552 2.804 0 50 GFAA COc1ccc(Cc2nc([C@@H]3CCCN(C(=O)c4cn(C)cn4)CC3)n[nH]2)cc1 1772804177 IJHITDXOPGRUFI-MRXNPFEDSA-N 394.479 2.548 0 50 GFAA O=C([C@@H]1CCOC1)N1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 1775981849 XDLQTEMPPMOBPA-LLVKDONJSA-N 377.794 2.829 0 50 GFAA COCCN1CCC(CN(C[C@H]2CCCO2)C(=O)Cc2ccsc2)CC1 12718938 IKUWICYMJBLGBB-LJQANCHMSA-N 380.554 2.657 0 50 GFAA CC[C@H](C(=O)Nc1ccc(NC(C)=O)cc1)N(c1ccccc1)S(C)(=O)=O 13711485 LHCGUVQYZWULIY-GOSISDBHSA-N 389.477 2.828 0 50 GFAA O=C(CC[C@@]1(Cc2ccccc2)CCC(=O)N1)NCc1ccc2c(c1)OCO2 15068608 PRDDCXAUXODFLG-QFIPXVFZSA-N 380.444 2.703 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)N3CCN(Cc4ccccc4)CC3)CC2=O)cc1 19831093 ONYXMKGELJCDCS-FQEVSTJZSA-N 377.488 2.692 0 50 GFAA C[C@H]1Cc2ccccc2N1C(=O)CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19899641 WNIDJZPMTZKYGD-KRWDZBQOSA-N 393.487 2.511 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(Cc3ncc[nH]3)CC1)OCC2)N1CCCC1 1857682932 RMKAAKPMIZHEHB-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA NC(=O)[C@H]1CCCN(CCn2ccnc2-c2ccc3cc(Cl)ccc3n2)C1 1857691551 PVJPLEWVCPYQSL-HNNXBMFYSA-N 383.883 2.949 0 50 GFAA C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(CS(C)(=O)=O)cc2)C1 222135163 FCLZRQJWBSZGNS-OXJNMPFZSA-N 386.517 2.797 0 50 GFAA COc1ccccc1NC(=S)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19808556 PXLOQALQWLBLEB-UHFFFAOYSA-N 385.489 2.939 0 50 GFAA COc1ccc(CC(=O)N[C@H]2C[C@@H](C)N(C(=O)c3cc4cnccc4[nH]3)C2)cc1 2325806545 RQUIWISIESPYST-PBHICJAKSA-N 392.459 2.533 0 50 GFAA O=C(NC[C@H]1CCCO1)C1CCN(C(=O)c2ccc(Br)cc2)CC1 1144576 ODBKANJFTRQVLV-MRXNPFEDSA-N 395.297 2.597 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@H](NCc3ccc(OC)c(OC)c3)C2=O)cc1 2213829 AZBHJRZWKAGWJN-SFHVURJKSA-N 398.459 2.914 0 50 GFAA O=C(c1cc2c(s1)CCCC2)N1CCN(S(=O)(=O)c2ccccc2)CC1 2872875 OXJRKNSRXGPUGQ-UHFFFAOYSA-N 390.530 2.774 0 50 GFAA CS(=O)(=O)N(CC(=O)NCc1ccco1)c1ccc(Cl)cc1Cl 4434704 ASNKPOSEADVAHM-UHFFFAOYSA-N 377.249 2.669 0 50 GFAA CCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)OC 4764314 WGEUGAFHOWNSBM-IAGOWNOFSA-N 378.469 2.785 0 50 GFAA CCc1c(C)sc(NC(=O)c2c(Cl)cnn2C)c1C(=O)N1CCOCC1 6489815 WRNTXQLERGXSFD-UHFFFAOYSA-N 396.900 2.731 0 50 GFAA CCCN(Cc1cnc(S(=O)(=O)CC2CC2)n1C[C@H]1CCCO1)CC1CC1 11819901 GTMIGVBUHQWFLI-LJQANCHMSA-N 395.569 2.868 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(Cc4cnc(OC)nc4)C3)C2=O)c1 12090831 ATWJGDRKLAHZOM-QFIPXVFZSA-N 396.491 2.509 0 50 GFAA COC(=O)c1ccccc1NC(=O)CCSc1nnnn1-c1ccccc1C 12273994 RCAZRMWXPOTXTG-UHFFFAOYSA-N 397.460 2.878 0 50 GFAA COc1ccc(O[C@@H](C)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)cc1 12380852 YGJABHQLAFVODM-HNNXBMFYSA-N 384.432 2.574 0 50 GFAA O=C(NCc1ccc(-n2cncn2)cc1)[C@@H]1CCC(=O)N(CC2CCCCC2)C1 12442266 CCZGDGQNQODAQP-LJQANCHMSA-N 395.507 2.702 0 50 GFAA CC[C@H](C)[C@H](NC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1)C(=O)OC 12713754 QVOQXWYFXPKGMQ-NHYWBVRUSA-N 398.385 2.663 0 50 GFAA CCOc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)NC2CCCCCC2)cc1 12717195 LUJYZPMMUPIBNN-FQEVSTJZSA-N 387.524 2.615 0 50 GFAA CC(=O)c1ccc(NC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 20310862 NHIGFKVXWDGEHC-UHFFFAOYSA-N 381.432 2.968 0 50 GFAA NS(=O)(=O)c1ccc(Cn2cnc(-c3ccccc3)c2-c2ncc[nH]2)cc1 67654194 IPPKBNBDJKRZIT-UHFFFAOYSA-N 379.445 2.636 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCC4(CCO4)CC3)C2=O)cc1 67819151 IYYLLAITJJJRNH-QHCPKHFHSA-N 386.536 2.918 0 50 GFAA CC(C)CN(CC(C)C)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1 72152908 NBCMMOHGWXEXAZ-LJQANCHMSA-N 377.504 2.657 0 50 GFAA Cc1ccc(CN2CCN(C(=O)[C@@H](C)n3cnc4ccccc43)CC2=O)cc1 77503703 WHIYIBDFUFLCPC-QGZVFWFLSA-N 376.460 2.777 0 50 GFAA CN(Cc1ccccc1)C(=O)CCN1C[C@@H](C(=O)O)[C@H](c2ccc(F)cc2)C1 91604126 QDZSGTOANHYOLO-VQTJNVASSA-N 384.451 2.974 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)C[C@@H](N)c1ccc(OC)c(OC)c1)CC2 95372955 VOMKIYCGIJEZEP-LJQANCHMSA-N 384.476 2.730 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(Oc3ccccc3)o2)C[C@H]1NS(C)(=O)=O 95498803 WYMAIVASEPLMQV-JKSUJKDBSA-N 392.477 2.718 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccccc4Cl)nnc23)n1 169776030 ZZDSBWDPKJJGLS-UHFFFAOYSA-N 382.811 2.925 0 50 GFAA CCc1nsc(N2CCN(C(=O)NC[C@H](c3cccnc3)C(C)C)CC2)n1 175477862 NFMPXZAXXUYWJJ-INIZCTEOSA-N 388.541 2.767 0 50 GFAA O=C(NCCc1nnc(-c2ccccc2)o1)[C@H]1CCCCN1C(=O)c1ccco1 177664501 CLJYSMNJNSHPTK-MRXNPFEDSA-N 394.431 2.683 0 50 GFAA Cc1noc(C)c1CN1CCN(C(=O)c2cc(N(C)C)nc3ccccc23)CC1 183409383 RAXDBTCZIXTHSG-UHFFFAOYSA-N 393.491 2.864 0 50 GFAA CNC(=O)c1ccn([C@@H]2CCCN(Cc3nc(C(C)C)n4ccccc34)C2)n1 225423833 CJLQKDKKPMMJIZ-MRXNPFEDSA-N 380.496 2.851 0 50 GFAA COc1ccc(CC(=O)NC[C@@H](CO)Cc2ccccc2Br)cc1 225444425 FKIDHBAYSSGRSG-HNNXBMFYSA-N 392.293 2.968 0 50 GFAA O=C(COc1ccc(N2CCCC2=O)cc1)OCCCO[C@H]1CCCCO1 225842857 IGNVAVFKROYUQW-FQEVSTJZSA-N 377.437 2.669 0 50 GFAA Cc1cc(=O)c(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)nn1-c1ccccc1F 237834359 VMACGRPJWUFOTK-KMFMINBZSA-N 399.422 2.538 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCNC[C@@H]2c2cccc(Cl)c2)c1C 261636600 DFBZBLUJWCKTRH-MRXNPFEDSA-N 379.913 2.743 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CCN1 262956562 WCAJXJNGDWZMTD-KFNAQCHYSA-N 384.307 2.855 0 50 GFAA Cc1nc2c(cc1C(=O)N[C@H](C)c1ccc3c(c1)CC(=O)N3C)c(C)nn2C 263989718 HIZJEHIHJIYJNX-LLVKDONJSA-N 377.448 2.595 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)C1 270204930 FKRXTENGJCFADC-MRXNPFEDSA-N 379.464 2.734 0 50 GFAA O=C(CC[C@@]1(Cc2ccccc2)CCC(=O)N1)NC[C@@H]1COc2ccccc2O1 299788391 SCRQRMMRQJALJV-JPYJTQIMSA-N 394.471 2.614 0 50 GFAA CCn1cc([C@@H]2CS(=O)(=O)CCN2C(=O)c2ccc(C(C)C)s2)cn1 331645076 QBMUFALKNVWAMP-AWEZNQCLSA-N 381.523 2.700 0 50 GFAA CC1(C)[C@H](NC(=O)N2CCO[C@@]3(CCCOC3)C2)C[C@H]1OCc1ccccc1 332824285 HUFTXDOGFUTSAZ-KNKQGSTJSA-N 388.508 2.961 0 50 GFAA Cn1cnc(-c2ccc(C(=O)N[C@H]3CCN(c4ccc(F)cc4F)C3)cc2)n1 361682221 PGHCANWMTIDGHV-INIZCTEOSA-N 383.402 2.769 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC[C@H](c3ccnn3CC(=O)O)C2)cc1 426370652 USWGOWOVTKRCMR-INIZCTEOSA-N 395.463 2.542 0 50 GFAA CCc1nccc(CN2CCC[C@@H](c3nnc(CN4CCCCC4)n3C)C2)n1 426551047 HGDNDURYVFNHPY-QGZVFWFLSA-N 383.544 2.533 0 50 GFAA CCN1CC[C@@H](CNC(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)C1 426740550 NSSUEHDRMYOLNH-SFHVURJKSA-N 386.517 2.732 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)CN(C)C)C[C@@H]1N(Cc1cccc(Cl)c1)CC2 534632902 KOYMFLQOWFTMSA-WSTZPKSXSA-N 379.932 2.530 0 50 GFAA Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1cc2ncc(CCO)cn2n1 670453177 UVNYZDZUSCTTDP-KRWDZBQOSA-N 380.448 2.605 0 50 GFAA O=C(Nc1ccn(CCc2ccncc2)n1)[C@H]1CCO[C@H](c2ccccc2)O1 847413879 CNUVLJWKRXVFIN-NQIIRXRSSA-N 378.432 2.964 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2cccc(NC(=O)C(F)(F)F)c2)CC2(CCC2)O1 859204067 PQIXPGDEGRGXRZ-NSHDSACASA-N 392.399 2.520 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(C[C@@H]3CCc4ccccc4C3)C2)ccn1 886072108 RNBZODMIMFOBCU-WZONZLPQSA-N 379.504 2.976 0 50 GFAA NCc1cc(NC(=O)N[C@@H]2CCCN3CCSC[C@H]23)cc(C(F)(F)F)c1 926163453 XGPPFMLAGARUNA-HUUCEWRRSA-N 388.459 2.865 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)NCCc1csc(-c2ncccn2)n1 952872267 LPGVHHMHHYCVIK-SFHVURJKSA-N 393.516 2.706 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)Nc1ccc(Oc2nn[nH]n2)cc1 952979370 SLKHFKAARAILIW-UHFFFAOYSA-N 377.364 2.613 0 50 GFAA O=C1C[C@H](NC(=O)C2(N3CCCC3)CCCC2)CN1c1cccc(Cl)c1 952983835 WHNOJYDDJNBFIO-INIZCTEOSA-N 375.900 2.970 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)Nc2ccc3scnc3c2)o1 952984886 UDALIXRFKDHBMK-INIZCTEOSA-N 384.461 2.527 0 50 GFAA Cc1nc(O)[nH]c1C(=O)N[C@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 1450297503 XOPTXNJGFTUBAF-QAPCUYQASA-N 397.406 2.744 0 50 GFAA O=C(C1=Cc2ccccc2OC=C1)N1CCCN(Cc2nc(C3CC3)no2)CC1 1529198862 MHTFBUUVSIFYPK-UHFFFAOYSA-N 392.459 2.971 0 50 GFAA C[C@@]1(O)CCOC2(CCN(Cc3cc(F)cc(C(F)(F)F)c3)CC2)[C@H]1O 1704332043 WIKNVYNNGGRGDE-JKSUJKDBSA-N 377.378 2.711 0 50 GFAA Cc1onc(C(=O)N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)c1CO 1704340650 LASLFNGUUAGQMV-UHFFFAOYSA-N 381.432 2.661 0 50 GFAA COc1cc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)ccn1 1857687638 XMSWMUOQSCPOOW-NRFANRHFSA-N 380.448 2.583 0 50 GFAA Cc1nnc(CNC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)o1 1857697932 REWVJQMHWZQEDP-NSHDSACASA-N 375.816 2.705 0 50 GFAA CCCc1nnc(N2C[C@@H](C(=O)NCCc3cccc(Cl)c3)CC2=O)s1 1857701756 VJFKNEQGTMFYBY-ZDUSSCGKSA-N 392.912 2.856 0 50 GFAA Cc1ccc(CN2CCOC3(CCN(C(=O)c4cccnc4)CC3)CC2=O)cc1 1857702588 DHGQNZGTYKTSLV-UHFFFAOYSA-N 393.487 2.814 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cc[nH]n2)CC12CCN(C/C=C/c1ccccc1)CC2 1857707078 YKHIZRHDZJVSQJ-PDGUBNMISA-N 380.492 2.722 0 50 GFAA CCn1c(=O)c(=O)n(CC(=O)N2c3ccccc3[C@@H](C)[C@@H]2C)c2ccccc21 1875281054 NIWQHKNNQLQASE-GJZGRUSLSA-N 377.444 2.722 0 50 GFAA COc1ccc([C@H](C)N)cc1C(=O)N1CCO[C@@H](COc2ccc(F)cc2)C1 1875315806 ILSZELMRCNMDJF-KBXCAEBGSA-N 388.439 2.774 0 50 GFAA COC(=O)c1ccc(-c2nc(Cn3ccccc3=O)no2)cc1C(F)(F)F 1875328537 XLEKUNGIBHDNIO-UHFFFAOYSA-N 379.294 2.752 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)Cc1c[nH]c2cnccc12 1875401148 GWNOVGUYJBKYJG-VQIMIIECSA-N 394.479 2.983 0 50 GFAA O=C1CCCc2cc(C(=O)N3CCOC[C@H]3Cc3ccc(O)cc3)ccc2N1 2325797007 QMTXWKLSIOJEBF-GOSISDBHSA-N 380.444 2.751 0 50 GFAA O=C(c1cc2cnccc2[nH]1)N1CC[C@H](CN=c2[nH]c3c(F)cccc3o2)C1 2325812105 MKFDIKAYAIOIAG-GFCCVEGCSA-N 379.395 2.839 0 50 GFAA O=C(CCC(=O)c1cccs1)NCCCNC(=O)c1cccc2c1OCC2 2325826359 ZSYFWWZMCIOIFC-UHFFFAOYSA-N 386.473 2.582 0 50 GFAA O=C(c1ccc(O)nn1)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356135948 ZPNCJSBCQYTXTE-JOCHJYFZSA-N 387.443 2.759 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356145706 IENOLDHGEQADKF-HXUWFJFHSA-N 388.947 2.972 0 50 GFAA COc1ccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 1158358 VZWMXVUMIAZCHY-UHFFFAOYSA-N 392.452 2.874 0 50 GFAA COc1ccc(CCNC(=O)CCCC(=O)NCCc2ccc(OC)cc2)cc1 4894403 CCJVJBKZYRKUCM-UHFFFAOYSA-N 398.503 2.892 0 50 GFAA O=C(Nc1ccncc1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 4973395 AXBNIXKDWLXOEY-UHFFFAOYSA-N 379.869 2.774 0 50 GFAA Cc1cccnc1NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 6702858 XYSMDPYWIRTFEY-HNNXBMFYSA-N 379.869 2.835 0 50 GFAA O=S(=O)(CC1CC1)c1ncc(CN2CCCCCC2)n1C[C@H]1CCCO1 11818898 PRUIBQXUQHSCTC-GOSISDBHSA-N 381.542 2.622 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)NCCC3=CCCCC3)c2)C1=O 12002692 KVWXLLRFDSZXNP-AWEZNQCLSA-N 376.478 2.619 0 50 GFAA O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1cccc(Br)c1 13688708 JDMPTMXEWXNHEO-ZIAGYGMSSA-N 377.238 2.729 0 50 GFAA O=C(NCCc1ccncc1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 15065741 FQNKAEMYSGRKCX-UHFFFAOYSA-N 393.487 2.834 0 50 GFAA CCc1ccccc1N1C[C@H](c2nnc(NC(=O)[C@@H]3CCCO3)s2)CC1=O 16626074 NUGYZFQAWNKKRT-HIFRSBDPSA-N 386.477 2.739 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2Cc2cc[nH]c(=O)c2)s1)N1CCCOCC1 23543331 ZJWWSHOGXFTSQY-INIZCTEOSA-N 387.505 2.636 0 50 GFAA CCCn1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)c(C)n1 39388005 JMSZVSHGPHLWNS-LJQANCHMSA-N 392.494 2.949 0 50 GFAA CC(=O)N[C@@H]1C[C@H](Cc2ccccc2)O[C@H](Cn2c(=O)oc3ccccc32)C1 65419936 ZZNXARABHCRGIW-QYZOEREBSA-N 380.444 2.890 0 50 GFAA CN(Cc1ncc[nH]1)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71761497 GOFFBSYCOJJRTJ-HSZRJFAPSA-N 388.471 2.915 0 50 GFAA O=C1CCC2(CCN(C3CSCCSC3)CC2)CN1CCc1c[nH]cn1 91475621 XNLUTXVNOFEJAF-UHFFFAOYSA-N 394.610 2.505 0 50 GFAA O=C(COc1ccc(Cl)cc1Cl)N1CCC(O)(CN2CCCC2)CC1 91769411 XZVBIYUMAXAMJA-UHFFFAOYSA-N 387.307 2.822 0 50 GFAA CC(=O)c1ccc(CN2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)cc1 95361471 YCXYWIBXKZMUOQ-LJQANCHMSA-N 378.480 2.642 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C(=O)Nc1cccc(C)c1)CC2 95370740 UELJEUHUEKUIJK-UHFFFAOYSA-N 394.479 2.653 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)c2cccc(O)c2)CC1 95502393 WLUDZIZORFVHTJ-LJQANCHMSA-N 387.524 2.625 0 50 GFAA COc1ccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c(F)c1 95502760 WGGSXSBCHLHAHL-UHFFFAOYSA-N 398.482 2.843 0 50 GFAA CN(C)c1nc(N2CCC(c3nccn3Cc3ccccn3)CC2)ncc1F 95511358 GMSUIEINSBCPBE-UHFFFAOYSA-N 381.459 2.706 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCC[C@@H](c4nnc(CO)n4C)C3)cc2s1 95530840 ACOAHPXXENBJTQ-GFCCVEGCSA-N 386.481 2.637 0 50 GFAA CC(C)(C)[C@@H](NC(=O)c1nn(Cc2ccc(F)cc2)c2ccccc12)C(N)=O 96024540 ZSSGCSINPVBLQD-SFHVURJKSA-N 382.439 2.854 0 50 GFAA in-vitro O=c1c2ccccc2ncn1Cc1nc([C@@H]2CCOC2)nn1Cc1ccccc1 96179787 KZVSAVNAGQEPES-QGZVFWFLSA-N 387.443 2.589 0 50 GFAA CC(C)(C)c1ncc(NC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)cn1 118812721 MUGRTBAMNCZMBA-SFHVURJKSA-N 383.496 2.657 0 50 GFAA O=C1NC(=O)[C@@H](Cc2ccc(OC(=O)CCCc3c[nH]c4ccccc34)cc2)N1 155156864 SWEOSIFSPDGCNW-LJQANCHMSA-N 391.427 2.847 0 50 GFAA O=C(c1cc(F)cc(F)c1)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169749847 LXFFJELCRVTYPH-UHFFFAOYSA-N 384.386 2.859 0 50 GFAA COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CC(=O)N1CCC(Cc2ccccc2)CC1 170604702 MTJZANLJPICYSM-URVUXULASA-N 384.520 2.741 0 50 GFAA C[C@@H]1CCC[C@@H](C)N(C(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)C1 176614658 IRUQYTGFTPWFHL-CHWSQXEVSA-N 381.436 2.739 0 50 GFAA CCCOc1ccc(C(=O)N2CCN(C[C@@H]3CCOC3)CC2)cc1OCC 178094649 KNLPYRRKMVPZDZ-KRWDZBQOSA-N 376.497 2.668 0 50 GFAA CC1(Cn2cc(C(=O)Nc3nc(-c4ccc(F)c(F)c4)cs3)nn2)COC1 183715065 DHNKJMKFOXDFBF-UHFFFAOYSA-N 391.403 2.969 0 50 GFAA COc1cc(CNC[C@H]2CCO[C@@H]2C(C)(C)C)cc(Cl)c1OCC(N)=O 189237977 ZAAITMOVXXJTMG-ACJLOTCBSA-N 384.904 2.754 0 50 GFAA C[C@@H](C1CC1)n1cc(NC(=O)N2CCN(CC(=O)Nc3ccccc3)CC2)cn1 189784610 IPTMIJVIVBQHOY-INIZCTEOSA-N 396.495 2.642 0 50 GFAA COc1ccc([C@@H](NC(=O)CSc2nnc(N)s2)c2ccncc2)cc1 216007635 KWCXFEHEZBMDNW-OAHLLOKOSA-N 387.490 2.522 0 50 GFAA C[C@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCN(CC(=O)O)CC1 237398217 BMLRGWOTGQKEGK-LLVKDONJSA-N 384.358 2.519 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NCCNC1CC1)c1ccc(Cl)cc1 237867331 JBEAIKPIANFEHD-LJQANCHMSA-N 385.895 2.549 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)N3CCC[C@H]3C(=O)O)cc2)cc1 262508410 AOYHVMRDIYZAQU-SFHVURJKSA-N 387.457 2.658 0 50 GFAA O=C(O)CC[C@@H]1CCCN(C(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C1 262850887 BOCLKGPDJMCAJL-HNNXBMFYSA-N 397.475 2.840 0 50 GFAA Cc1oc(CNC(=O)[C@H]2CCCN2c2ncnc3sccc23)cc1C(=O)O 262902301 BPETVBPCOOJHRK-CQSZACIVSA-N 386.433 2.576 0 50 GFAA COC(=O)c1cn(CCC(=O)Nc2cccc3ccccc23)cc2c(=O)[nH]nc1-2 263587727 KOJYDPQFLKQOGU-UHFFFAOYSA-N 390.399 2.645 0 50 GFAA CS(=O)(=O)N(Cc1cn2c(n1)CCCC2)Cc1ncc(Cl)cc1Cl 328620900 HJTRGLHMZMNMRA-UHFFFAOYSA-N 389.308 2.883 0 50 GFAA COCCOC1CCN(c2cc(N[C@H]3CCCO[C@H]3C(C)C)ncn2)CC1 328631395 KMUXQVOFYJWQJB-PXNSSMCTSA-N 378.517 2.724 0 50 GFAA N[C@@H]1CCO[C@H]1C1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 333836468 UIXSXBYCYZDKFT-WTGUMLROSA-N 391.487 2.584 0 50 GFAA CCCn1c(CO)nnc1S[C@H]1CCN([C@@H]2CCCc3ccccc32)C1=O 375114848 RTNIWMFOMUUCQP-SJORKVTESA-N 386.521 2.951 0 50 GFAA Cc1ccc2nc(O)c(CN3CCC[C@H](c4ccnn4CC(=O)O)C3)cc2c1 426368272 KDBYGDSECSSVJC-HNNXBMFYSA-N 380.448 2.910 0 50 GFAA CCCN(CCO)C(=O)c1csc2c1CCN(Cc1c(C)noc1C)C2 426473492 JCKIOSLIWPZPEY-UHFFFAOYSA-N 377.510 2.756 0 50 GFAA CCCc1cnc(C)nc1-c1ccc(C(=O)N[C@H]2CN(C)C[C@@H]2OCC)cc1 426615472 MBEHOECVNPWCFF-PMACEKPBSA-N 382.508 2.853 0 50 GFAA CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)Nc1cc2c(O)ncnc2cc1F 439142677 QDBUZAAVWYVLNW-GTNSWQLSSA-N 385.399 2.968 0 50 GFAA CCOCCCn1c(Cc2ccccn2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C 460688750 DLIISTKNZIWILW-MSOLQXFVSA-N 386.544 2.609 0 50 GFAA Cc1nn(C[C@H](NC(=O)OCc2ccccc2)C(=O)O)c(C)c1Br 725346584 IVLZGEYCQQKATP-ZDUSSCGKSA-N 396.241 2.642 0 50 GFAA Cc1nccn1-c1ccccc1CNC(=O)c1ccccc1N1CCOCC1 751372598 VADUSNFXKKIYQM-UHFFFAOYSA-N 376.460 2.947 0 50 GFAA O=C([C@H](c1ccccc1)C1CCCC1)N1CCC(N2CCN(CCO)CC2)CC1 952981338 WBKVYCSVDFPYMS-HSZRJFAPSA-N 399.579 2.561 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N[C@H]2CCCc3sccc32)cc2c1CCC2 1338096325 MKVFWCUFNYGOBA-HNNXBMFYSA-N 376.503 2.692 0 50 GFAA O=C1CNC(=O)c2ccc(C(=O)N3C[C@H]4CCCC[C@@]43c3ccccc3)cc2N1 1347679937 JVUYHPINHXZXCD-UZUQRXQVSA-N 389.455 2.910 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@@H](C(=O)O)c3ccccc3)o2)c1C 1506400320 DISDNYOQPRADLV-OAHLLOKOSA-N 376.390 2.656 0 50 GFAA O=C1NCCN(Cc2ccccc2OCCCCn2ccnc2)C12CCCC2 1506415129 LTSWCAWYPNBDGW-UHFFFAOYSA-N 382.508 2.987 0 50 GFAA Cc1csc(SCC(=O)N2CCN(CCOc3ccccc3)CC2)n1 1506426866 TZJKFEZSUDSZBB-UHFFFAOYSA-N 377.535 2.767 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C[C@@H]2CCC(=O)N(C)C2)CC1 1800414649 VNTIQJGLGOUBPJ-QGZVFWFLSA-N 379.932 2.513 0 50 GFAA CC(C)n1cnnc1CN(C)C(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857667581 DUXYSLVTPBSEGH-OAHLLOKOSA-N 397.483 2.660 0 50 GFAA CCc1nc(CN2C[C@@H]3[C@H](CNC(=O)CC(C)C)[C@H]4CC[C@]3(C2)O4)cs1 1857711555 GHZHKRRFRMERGZ-TVKQPGBESA-N 377.554 2.847 0 50 GFAA Cc1oc(C)c(S(=O)(=O)N2CCCC2)c1C(=O)NCc1ccc(F)cc1 1857800378 SSDUFUNATDCGFS-UHFFFAOYSA-N 380.441 2.750 0 50 GFAA O=C1C[C@@H](c2noc(C3CCN(c4cnccn4)CC3)n2)CN1c1ccccc1 1875291037 LZQIEIONFSMYMU-MRXNPFEDSA-N 390.447 2.764 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@H](CCC(=O)OC(C)(C)C)C2)CC1 1875365829 MYORTNZADLFTLX-MRXNPFEDSA-N 378.513 2.772 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1Cc1ccc(-c2ccccn2)nc1 1875398802 FOVKVBLNAYYRMG-LPHOPBHVSA-N 376.464 2.951 0 50 GFAA C[C@H]1CN(C2CC2)CCN1C(=O)C1CCN(C(=O)c2cccc(Cl)c2)CC1 2100473718 WQBNOYNMTVGKRU-HNNXBMFYSA-N 389.927 2.887 0 50 GFAA NC(=O)c1c(NC(=O)Cc2ccc(N3CCOC3=O)cc2)sc2c1CCCC2 2325742666 XQJUQWZAJSVGQA-UHFFFAOYSA-N 399.472 2.864 0 50 GFAA CN1CCN(c2cccc(C(=O)N(C)Cc3cccc4ncccc34)n2)CC1 2325757494 FLRJHOAMGQSADU-UHFFFAOYSA-N 375.476 2.654 0 50 GFAA CN(C(=O)Cc1cccc2c1CCNC2)[C@@H](c1ccc(F)cc1)c1ncc[nH]1 2325795935 GNABTTNBXDIEMC-NRFANRHFSA-N 378.451 2.985 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2cc(=O)n(C)c3ccccc23)C1=O 2356155513 GFLOWTBBMRKRQZ-JOCHJYFZSA-N 381.476 2.544 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC[C@H](c4nnc5ccccn45)C3)cc2)n1 2356166167 WFZSKNNUSVMKEX-KRWDZBQOSA-N 399.458 2.788 0 50 GFAA CS(=O)(=O)N1CCN(c2ccccc2NC(=O)c2cccc(Cl)c2)CC1 624246 ITABTOLGIIVVIL-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1Cl 2846307 HCUZXYKYJAQJKJ-GFCCVEGCSA-N 382.869 2.963 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCO[C@H](c2cccnc2)C1 2356151240 YQEWUPSJAWDAQY-KRWDZBQOSA-N 399.516 2.508 0 50 GFAA O=C(CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)OCc1ccccc1 4764356 ABBUEKAIKQURGG-IBGZPJMESA-N 396.443 2.647 0 50 GFAA CN(Cc1ccccc1)Cc1cccc(C(=O)N[C@@H]2CCc3ncnn3C2)c1 172002389 SPALWSWBKCRXLC-HXUWFJFHSA-N 375.476 2.655 0 50 GFAA Cc1ccc([C@H]2C=C(c3ccccc3)N=C3N=C(N4C(=O)CCC4=O)NN32)cc1 100434510 WBUQEPJWSLOSEB-GOSISDBHSA-N 385.427 2.772 0 50 GFAA O=C1NCCN(Cc2cccc(C(F)(F)F)c2)[C@@H]1CC(=O)N1CCCCCC1 55269684 ZRJRZULMKNRWIB-QGZVFWFLSA-N 397.441 2.799 0 50 GFAA CCOC(=O)N1CCN(Cc2nc(-c3ccc(C(=O)OC)cc3)oc2C)CC1 20351575 UEXBPQIYIDAGHC-UHFFFAOYSA-N 387.436 2.711 0 50 GFAA CCN(Cc1noc(C)n1)C(=O)C1(Oc2ccc(Cl)cc2)CCNCC1 65384005 OOTRRDCHBRZLJJ-UHFFFAOYSA-N 378.860 2.581 0 50 GFAA CCOc1ccc2oc(=O)cc(CN3CCN(C(=O)c4ccco4)CC3)c2c1 20446832 ABDSUZAIKFTNTG-UHFFFAOYSA-N 382.416 2.743 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@@H](CCn2cncn2)c2ccccc2)CC1 1506420166 WPILOJSOVUSTCM-NRFANRHFSA-N 390.491 2.699 0 50 GFAA CN1CCC[C@H](CNS(=O)(=O)CCC2CCOCC2)[C@@H]1c1cccs1 330305388 QPOOLSYIYJCYQB-SJLPKXTDSA-N 386.583 2.867 0 50 GFAA Cc1cnn(Cc2cc(C(=O)Nc3cccc(N4CCCCC4=O)c3)no2)c1 119172008 YCYYUIQONKWQST-UHFFFAOYSA-N 379.420 2.997 0 50 GFAA Cc1cccc(C[C@@H](C)NC(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)n1 12320102 QEBXZDWERAOIDM-CQSZACIVSA-N 394.431 2.849 0 50 GFAA O=C(Nc1cc(Br)ccc1N1CCOCC1)N1CCC[C@H]1CCO 429124914 XGCCFSUNWFMWTN-AWEZNQCLSA-N 398.301 2.664 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(c3noc(-c4ccccc4)n3)CC2)C1 71745335 PFNNEGXKPKZWKP-QGZVFWFLSA-N 395.507 2.696 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2CN2CCOCC2)cc1-c1ccccn1 122857806 MNKCPOMTOLYKGR-SFHVURJKSA-N 381.476 2.694 0 50 GFAA CCOc1ccc(-c2ccnc(N3CCC(CNC(C)=O)CC3)n2)cc1C(=O)O 77555364 QIBODEGGXGSHOB-UHFFFAOYSA-N 398.463 2.593 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccccc4Cl)CC3)ncn2)n1 72436900 SHIRTGSVTCBNRN-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA CCn1c(NC(=O)c2ccc(OC)c(N3CCNC3=O)c2)nc2ccccc21 173031223 HFZAEGOILRIBLS-UHFFFAOYSA-N 379.420 2.847 0 50 GFAA CC(C)[C@@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363421883 FCVYAKQJKZJYKS-GCJKJVERSA-N 384.476 2.673 0 50 GFAA Cc1ccc(NCc2cnc3cnccn23)cc1S(=O)(=O)N1CCCCC1 286151877 VXRYTZOBNJLMJN-UHFFFAOYSA-N 385.493 2.824 0 50 GFAA CCC(=O)Nc1cc(CNC(=O)c2onc3c2CCCC3)cc(C(=O)OC)c1 426485559 CHPIQMPCISDMED-UHFFFAOYSA-N 385.420 2.619 0 50 GFAA COCc1cc(CNC(=O)N2CCC[C@H](Cc3nc4ccccc4[nH]3)C2)[nH]n1 426489307 CIDJRDVSLSUGHX-CQSZACIVSA-N 382.468 2.597 0 50 GFAA O=C(NCCC1CCN(Cc2ccccc2)CC1)c1cnc(C2CC2)[nH]c1=O 91603081 LDHRROSVGLVGLP-UHFFFAOYSA-N 380.492 2.679 0 50 GFAA CN(C)c1ccc(CC(=O)N2C[C@H]3CC[C@@H]2CN(Cc2cccnc2)C3)cc1 95367059 DMQZNJGZTMFJHD-RBBKRZOGSA-N 378.520 2.813 0 50 GFAA O=C(COc1ccc(F)cc1F)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 91351094 OFXQASROJFSPER-FQEVSTJZSA-N 378.419 2.595 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)CCc1ccc(F)cc1)CC2 91655866 JRCPOPRSSBWGKI-UHFFFAOYSA-N 376.472 2.636 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3C[C@@H](C)[C@](O)(C4CCC4)C3)c2n1 92098099 ASGSCYRKFQDJDG-QGHHPUGFSA-N 382.386 2.680 0 50 GFAA O=C1CC[C@@]2(CCCN(c3ncnc4c3CCC4)C2)CN1Cc1ccccn1 91906321 YCHCYPIXXVIUJG-JOCHJYFZSA-N 377.492 2.770 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@@H](C)O)C3)CC2)ccc1Cl 92061512 RJTHRZJSQFSESV-OAHLLOKOSA-N 378.900 2.874 0 50 GFAA Cc1ccc(-c2nnn(C)n2)cc1NC(=O)NC[C@H]1OCCc2ccccc21 96138610 WRHPGJMJNMGWTM-GOSISDBHSA-N 378.436 2.621 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)[C@H]1CCCN(C2CCC2)C1 181681369 ONXPFXXHNZWQNQ-VCOUNFBDSA-N 397.563 2.989 0 50 GFAA O=C(Nc1ccc2c3c(cccc13)CC2)N1CCC[C@H](n2cc(CO)nn2)C1 296286826 IQYLLGJEGVDODU-KRWDZBQOSA-N 377.448 2.891 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)CCO1 299752613 UTUSSHLZFYBDQD-UFYCRDLUSA-N 381.428 2.681 0 50 GFAA COC(=O)[C@@H]1CC[C@@H]2[C@]34CC[C@@]5(O)CC(=O)CC[C@@]5([C@@H](OC)O3)[C@@H]4CC[C@]21C 253596734 VLMLLACKDSNIAO-CULGBLOPSA-N 392.492 2.608 0 50 GFAA COCCn1ccc2c(OCC(=O)Nc3c4c(nn3C)CSC4)cccc21 263587775 LCFAQOACYQFYQJ-UHFFFAOYSA-N 386.477 2.786 0 50 GFAA CN(C)c1cc(C(=O)N2CCNC(=O)[C@H]2c2cccc(F)c2)c2ccccc2n1 1940195470 FVOWEIQRDHQIQM-HXUWFJFHSA-N 392.434 2.753 0 50 GFAA CCN(CC)CCN1C(=O)CC[C@@H]1CCNCc1cc2c(cc1Cl)OCO2 299762714 XBNBRFRQOBYIMF-MRXNPFEDSA-N 395.931 2.881 0 50 GFAA COC(=O)c1ccc(OC)c(NC(=O)N(CCO)Cc2ccc(C)s2)c1 299795557 LOEKUODWVQDIDH-UHFFFAOYSA-N 378.450 2.878 0 50 GFAA COc1ccc(C)nc1-c1cccc(C(=O)NCCCN2CCC[C@@H](O)C2)c1 299762850 CBBIENIQUZTOOD-LJQANCHMSA-N 383.492 2.642 0 50 GFAA O=C1C[C@@H](CNS(=O)(=O)c2ccccc2C(F)(F)F)CN1C1CCCC1 670435743 AXTOWSMYTVYTAD-LBPRGKRZSA-N 390.427 2.775 0 50 GFAA COc1ccc(CCN(C[C@@H]2CCCO2)C(=O)NC2(C(=O)O)CCCC2)cc1 670474319 LEBZGZGXDQMMSR-SFHVURJKSA-N 390.480 2.826 0 50 GFAA CNC(=O)Cn1cc(C(=O)NCCOc2ccccc2Cl)c2ccccc21 1875390356 VODJUSJQNKHLLC-UHFFFAOYSA-N 385.851 2.850 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N=c2ccn(-c3cccc(C(F)(F)F)c3)[nH]2)C1 1875371200 SKKSGHLBUYRDFA-CYBMUJFWSA-N 392.381 2.676 0 50 GFAA C[C@@H](NC(=O)CN1CCOc2ccccc2C1)c1ccc2c(c1)OCCCO2 952969876 BUTGMXOAIHSAKI-MRXNPFEDSA-N 382.460 2.920 0 50 GFAA Cc1ncsc1CN(C)C[C@H]1CCN(C(=O)Cc2cccc(C(=O)O)c2)C1 887557516 RMYBQHSMAXTHQQ-MRXNPFEDSA-N 387.505 2.673 0 50 GFAA O[C@H]1CN(Cc2cccn2-c2cccnc2)CC[C@@H]1c1ccc2c(c1)OCO2 1565512985 SSPXOQJSONEFEV-UXHICEINSA-N 377.444 2.951 0 50 GFAA O=C(Nc1ccc(-n2ccnn2)cc1)N1CCC[C@@H](Oc2ncccc2F)C1 278812275 HLNVWDLANXKXEW-MRXNPFEDSA-N 382.399 2.877 0 50 GFAA Cc1cc(-c2ncccc2NC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cs1 189212838 PUAJHERRXNOILW-CYBMUJFWSA-N 394.522 2.522 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@@H](C)Cn3cccn3)CC1)OCC2 1704338108 KYRZIYIPZDOOAK-INIZCTEOSA-N 399.491 2.627 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3cc(N(C)C)ncn3)CC1)OCC2 1704305007 PXGQYDGGZARBIP-UHFFFAOYSA-N 384.480 2.628 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cncnc4)C[C@H]2CN(Cc2cc[nH]n2)C3)cc1 1772814024 FSOFNJICPYFMQK-JTHBVZDNSA-N 388.519 2.767 0 50 GFAA Cc1ccn(CCC(=O)N2CCCN(Cc3ccc4ncccc4c3)CC2)n1 1772811606 WUSYYGKUCNTZDU-UHFFFAOYSA-N 377.492 2.864 0 50 GFAA COC(=O)c1c(OCc2ccncc2)cc(=O)n2c1CCN(CCC(C)C)CC2 11788547 SEUORJDNAPVGNX-UHFFFAOYSA-N 399.491 2.513 0 50 GFAA O=C1NCCN(C2CCCC2)[C@@H]1CC(=O)N(Cc1ccccc1)CC1CCC1 12207479 SAIDIXYKPIWABV-OAQYLSRUSA-N 383.536 2.948 0 50 GFAA COc1ccc2c(c1)O[C@@H](C)CN(CCC(=O)NCCCc1ccncc1)C2 12247057 ONXWMFIFQNIVBO-KRWDZBQOSA-N 383.492 2.812 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)[C@@H]2COc3ccccc3C2)CC1)C1CC1 12298640 NOOCXZMXYMKZCW-KRWDZBQOSA-N 394.475 2.646 0 50 GFAA COc1ccc(O[C@@H](C)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 12380908 BIFBBJRUACACOW-HNNXBMFYSA-N 384.432 2.574 0 50 GFAA CCN(CC)CC(=O)N(C)CC1CCN(CCc2ccccc2OC)CC1 12579804 KQYYCFCEZZDNNH-UHFFFAOYSA-N 375.557 2.750 0 50 GFAA O=C(CCc1ccccc1)Nc1ccnn1C1CCN(C(=O)[C@@H]2CCCO2)CC1 14956721 IHVMBQGYGXYARC-IBGZPJMESA-N 396.491 2.797 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1cc(S(=O)(=O)N2CCCC2)cs1 16624812 ICAVXJRBBFITFT-UHFFFAOYSA-N 394.474 2.556 0 50 GFAA CSc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(=O)N1CCCC1 16661464 SSQPAJCVDDTFQM-UHFFFAOYSA-N 377.491 2.840 0 50 GFAA COc1ccc(C(=O)CCc2nc(-c3c(C)ncc4c3CCNC4)no2)cc1 19340580 GKRHTUFFHCRKAY-UHFFFAOYSA-N 378.432 2.910 0 50 GFAA COc1ccc([C@@H]2CC(c3cccs3)=NN2C(=O)CN2CCOCC2)cc1 19913074 GJOXRZITFFSROX-SFHVURJKSA-N 385.489 2.767 0 50 GFAA O=c1c2cnc(N3CCOCC3)nc2ccn1-c1ccc(Cl)c(Cl)c1 19974166 NMONJXJTMSTFLQ-UHFFFAOYSA-N 377.231 2.924 0 50 GFAA Cc1nc(-c2cn([C@@H]3CCCN(C(=O)c4ccc(Cl)s4)C3)nn2)no1 169777894 DOBMXWYRBVRHOP-SNVBAGLBSA-N 378.845 2.829 0 50 GFAA CNC(=O)Cc1nc(Cc2ccc3nc(C)[nH]c3c2)n(CCc2ccccc2)n1 1857677019 VKCYIUJEUUHOER-UHFFFAOYSA-N 388.475 2.585 0 50 GFAA O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857680775 ORJYEDWYXSPQRZ-KRWDZBQOSA-N 392.503 2.795 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NCCCc3ccccc3Cl)CC2=O)s1 1857716042 TZAKKAYIHAXSJR-ZDUSSCGKSA-N 392.912 2.856 0 50 GFAA CCc1cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)on1 1857738324 CBDNTVCRTWHTMG-GPQLQYNLSA-N 381.476 2.646 0 50 GFAA Cc1ccnc([C@H](C)NC(=O)c2cn3c(n2)CCN(C2CCSCC2)CC3)c1 1875251199 QZRCJXBZCNNOHC-INIZCTEOSA-N 399.564 2.831 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1ccc(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1 249993580 MEXOGPOPICBMII-YPSWNZPLSA-N 390.439 2.678 0 50 GFAA O=c1[nH]c(-c2ccc(CN3CCC[C@@H]3Cn3ccnc3)cc2)nc2c1CCC2 23379815 KUEMVMACLJPBKB-GOSISDBHSA-N 375.476 2.787 0 50 GFAA Cn1ccnc1[C@H](NC(=O)N1CCC(c2ccnn2C)CC1)c1cccc(F)c1 155673300 XUSAVHSFOIJKGF-LJQANCHMSA-N 396.470 2.971 0 50 GFAA C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)[C@H]1CN 156631700 HGCRYQGRVRAIPS-HIFRSBDPSA-N 378.519 2.780 0 50 GFAA CN(C)CCC1(C(=O)N2CCc3ccc(S(C)(=O)=O)cc3CC2)CCCC1 2325805588 UTTWNGFSSAPXPE-UHFFFAOYSA-N 392.565 2.529 0 50 GFAA O=C(NC[C@@H](NC(=O)[C@H]1CCCCS1)c1ccccc1)[C@@H](O)C1CCCC1 2325860460 IXKKADMKSPHYAH-QRVBRYPASA-N 390.549 2.797 0 50 GFAA COc1ccccc1NC(=O)CS[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O 1051799 KSNYJTZJEZUTDQ-INIZCTEOSA-N 388.420 2.838 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3F)CC2)cc1Cl 1077919 IKPGTBMMXPKHNE-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA O=C(c1ccc2ccccn12)N1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 2356138631 PIXCHVRMMYQMGP-WMLDXEAASA-N 380.473 2.659 0 50 GFAA COCCNC(=O)CN(c1cc(C)ccc1C)S(=O)(=O)c1ccc(C)cc1 2966737 OFEFWLRFFBKHFH-UHFFFAOYSA-N 390.505 2.570 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)[C@@H]2C3CCC(CC3)[C@@H]2C(=O)O)CC1 6715184 SLONXHAASRIKPK-MPIRFRCKSA-N 386.492 2.871 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCO[C@@H](c3cccc(O)c3)C2)[C@H]1c1ccccc1 247253391 YMJNARBXMPBTHD-TUNNFDKTSA-N 394.471 2.902 0 50 GFAA CCc1ccccc1NC(=O)c1cccc(NC(=O)[C@H]2CCCN2C(N)=O)c1 55326125 QPQSEJJQIFVKFS-GOSISDBHSA-N 380.448 2.983 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2=O)C1 14965112 QZTHXBWCEATEAF-FQEVSTJZSA-N 378.538 2.672 0 50 GFAA CC(C)(CN1CCCC1)NC(=O)c1cc(CN2CCc3ccccc3C2)on1 67847248 RVDSZJBVZWEUJY-UHFFFAOYSA-N 382.508 2.837 0 50 GFAA Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(c2cncc(-n3cccn3)n2)C1 328947237 KDWNMVOLSVNQOC-LBPRGKRZSA-N 377.374 2.799 0 50 GFAA COc1ccc([C@H](CNCc2cnc(C(C)(C)C)nc2)N2CCOCC2)cc1 253416740 OMUIBCRLEHWOPL-FQEVSTJZSA-N 384.524 2.946 0 50 GFAA CCCN1CCN(Cc2c(Cl)cccc2Cl)[C@H]2CS(=O)(=O)C[C@H]21 72473615 GVEXEEAYGSHQLW-CVEARBPZSA-N 377.337 2.687 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NC3CCCCCC3)n2)cc1OC 44901502 YKUCSXVWJDPTNR-UHFFFAOYSA-N 385.464 2.767 0 50 GFAA Cc1cc2oc(=O)cc(C)c2cc1NC(=O)N1CCC[C@@]2(CN(C)C(=O)O2)C1 97717200 HFWHBPDHCPPCDM-HXUWFJFHSA-N 385.420 2.858 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ncoc1C 95517444 OTDZSOOLYDKABF-GOSISDBHSA-N 397.519 2.951 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CCC2(CC1)Nc1ccccc1NC2=O 91694977 BMBKBBGIROLYCB-UHFFFAOYSA-N 393.443 2.773 0 50 GFAA CC[C@H]1CN(C(=O)Cc2cc(OC)c(OC)cc2C(C)=O)CCN1C(C)C 91876750 VOOAHTBEJBKBDT-KRWDZBQOSA-N 376.497 2.780 0 50 GFAA CCCn1nccc1NC(=O)N(CC)CCS(=O)(=O)c1ccc(C)cc1 96131795 UXBJYKFOYHWIEZ-UHFFFAOYSA-N 378.498 2.929 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3ccc[nH]3)C2)c(OC)c1 95504592 AAFQVVIBDGLTCY-INIZCTEOSA-N 399.491 2.981 0 50 GFAA Cc1ccc2nc(SCC(=O)N[C@H]3COC[C@H]3Cc3cc(C)no3)[nH]c2c1 95356558 NTYFALYMTNHKND-DYVFJYSZSA-N 386.477 2.634 0 50 GFAA O=C(NC[C@]1(CCO)CCOC1)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 182478896 JBMODNNYCMSNNQ-KRWDZBQOSA-N 398.385 2.802 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@@H]1C=Cc3cc(Cl)ccc3N1[C@H]2C(=O)c1cccs1 245256586 RRKMLLGXBGFJBG-ARLBYUKCSA-N 384.844 2.757 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(C(=O)O)[C@H]3CC[C@]21C 254381481 RIUISGYIXPQHGQ-CUZFGDDOSA-N 392.492 2.669 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1-c1cccc(C(=O)N[C@H]2CCNC2=O)c1 534676088 DJTVHFUMBGHTKI-FQEVSTJZSA-N 388.471 2.834 0 50 GFAA CC[C@H](OC)c1nc(CC(N)=O)nn1-c1cc(C)c2ccc(SC)cc2n1 1940197223 AIVRDKJYCRGBEP-HNNXBMFYSA-N 385.493 2.971 0 50 GFAA Brc1ccc2c(=N[C@H]3CCCN(Cc4ccccc4)C3)nc[nH]n12 1875264646 RKMFRASHIWESII-HNNXBMFYSA-N 386.297 2.990 0 50 GFAA O=C(Cn1ccc(O)nc1=O)Nc1ccc(F)cc1OCC1CCCCC1 1875298385 ZBKYOXJHZJRWCO-UHFFFAOYSA-N 375.400 2.686 0 50 GFAA Cc1sc(O)nc1C(=O)N[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1 1875269446 LXSOVMOFOFRWMC-GFCCVEGCSA-N 388.493 2.904 0 50 GFAA Cc1c[nH]c2ccc(NC(=O)NCc3cccnc3N3CCN(C)CC3)cc12 1875268650 YYMOUFLFKDKESY-UHFFFAOYSA-N 378.480 2.945 0 50 GFAA Cc1nc(C)c(-c2nnc(NC(=O)CCn3cnc4ccccc4c3=O)o2)s1 49449446 YJYQUTFOMXWKLA-UHFFFAOYSA-N 396.432 2.549 0 50 GFAA COCC[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H]1N2c1cc(-c2ccccn2)nc(C)n1 1775991551 KYWCRQRRURTLFE-HIBPSGHXSA-N 395.507 2.746 0 50 GFAA CCc1c(NC(=O)N2CCN(CC)[C@@]3(CCOC3)C2)cnn1-c1ccccc1 1775961795 ARINQDGSMQGKFY-NRFANRHFSA-N 383.496 2.763 0 50 GFAA CCOCCN1C(=O)N[C@H]2c3ccccc3O[C@@]13CCN(CC(F)(F)F)C[C@@H]23 1776006009 RJEYRLQCAGWETA-QILLFSRXSA-N 399.413 2.762 0 50 GFAA Cc1ccc(OCCCC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)cc1C 276194807 CIBKQNUWCOGDBP-SFHVURJKSA-N 397.523 2.568 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(-c4csc(C)n4)cc3)C(=O)[C@@H]2C1 278177759 VEWSIUZLBNCCIN-BBRMVZONSA-N 385.445 2.839 0 50 GFAA O=C(c1cnc(-c2ncccn2)s1)N1CCC(O)(Cc2cccc(F)c2)CC1 187415331 AHLBNLKSHIKBPW-UHFFFAOYSA-N 398.463 2.949 0 50 GFAA CN(C(=O)c1ccc(Br)nc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 746528541 CGMFLGUYZYCJAK-GFCCVEGCSA-N 384.274 2.926 0 50 GFAA CCc1c(C)nn(CC(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)c1C 1704353158 BAOKPDXRCQMXHW-XMSQKQJNSA-N 392.503 2.984 0 50 GFAA Cc1nc(CCNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)sc1C 11932812 DMCXLNKPSFYGRW-INIZCTEOSA-N 389.496 2.997 0 50 GFAA CC(C)N1CCC2(CC[C@H](CNC(=O)CCc3ccc4c(c3)OCO4)O2)CC1 12004641 MFQOQDDWMVAFTG-GOSISDBHSA-N 388.508 2.886 0 50 GFAA COC(=O)c1cccc(CN2CCN(C(=O)c3sccc3C)CCC2=O)c1 12037122 JULBTQXTOAPMHO-UHFFFAOYSA-N 386.473 2.718 0 50 GFAA COc1ccc(CCN2C(=O)CC[C@H]2CCNCc2cccnc2)cc1OC 12151907 IJDZWNYPYLARFI-IBGZPJMESA-N 383.492 2.812 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12707497 LQGLFKFNKYGLGU-GOSISDBHSA-N 387.499 2.555 0 50 GFAA CCOC(=O)c1nn(CC(C)C)c2c1CN(C(=O)c1[nH]nc3c1CCCC3)CC2 14745038 DULLAGPHPCGNHS-UHFFFAOYSA-N 399.495 2.516 0 50 GFAA Cc1nn(C)cc1CN1CC(=O)N(CC(C)C)C[C@@H](OCc2ccccc2)C1 14750446 UIXOTGPQQJZCAF-NRFANRHFSA-N 384.524 2.614 0 50 GFAA Cc1c(C(=O)NCCC(C)C)sc2ncnc(NCCN3CCOCC3)c12 14990758 ZGVDZXDXTLYJKN-UHFFFAOYSA-N 391.541 2.520 0 50 GFAA COc1cccc(-c2nccn2C2CCOCC2)c1OCCN1CCOCC1 1857695253 BBTKWILOZYABBT-UHFFFAOYSA-N 387.480 2.621 0 50 GFAA Cc1cc(C)n(-c2ccccc2CN2CC[C@H](O)[C@](CC3CC3)(C(=O)O)C2)n1 1875246243 CELVTOUEGRMDPJ-RBBKRZOGSA-N 383.492 2.927 0 50 GFAA O=S(=O)(c1ccc(OC[C@@H]2CCOC2)c(F)c1)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1 328868115 XGCZOEWCDMTCPX-RCMKLKEOSA-N 395.496 2.908 0 50 GFAA CCOC(=O)c1cnc2ccc(Br)cc2c1NCCOCCO 5958584 NADLLQLSRIUFLW-UHFFFAOYSA-N 383.242 2.595 0 50 GFAA Cc1cnc(CNC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)s1 156560544 RKRCDSLDCJUJGR-CYBMUJFWSA-N 393.896 2.649 0 50 GFAA CS(=O)(=O)c1nc(C(=O)N2Cc3cccc(Cl)c3C2)c2ccccn12 377111686 MMJBKXOYESCPJI-UHFFFAOYSA-N 375.837 2.547 0 50 GFAA CCC(CC)CN[C@H]1CCS(=O)(=O)C2(CC(CNC(=O)C3CC=CC3)C2)C1 2332237811 MQJXRDWEVHDUBO-BIXGBWIQSA-N 396.597 2.821 0 50 GFAA COc1ccc(NC(=O)CSc2nnc([C@@H](O)c3ccccc3)n2C)cc1 1141061 GYCDPFBZJPHNGL-KRWDZBQOSA-N 384.461 2.636 0 50 GFAA O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1[C@@H]1CCS(=O)(=O)C1 1165044 YXJUYPXPAGMOFH-OPYOOOJUSA-N 391.898 2.867 0 50 GFAA COc1ccc(C(=O)Nc2nc3ccc(S(=O)(=O)N(C)C)cc3s2)cc1 2694829 LWUNPPOHLIKYFP-UHFFFAOYSA-N 391.474 2.808 0 50 GFAA Cc1ccc(C(=O)Nc2c(F)cccc2F)cc1S(=O)(=O)N1CCOCC1 6697770 SNYQFJUZZJNERN-UHFFFAOYSA-N 396.415 2.546 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)CC1 6701824 YIBVIXTWDYABMC-UHFFFAOYSA-N 385.420 2.755 0 50 GFAA COc1ccccc1-c1cc(=O)[nH]c(N2CCN(c3ccc(F)cc3)CC2)n1 9614646 KSTPSCGATUUTFY-UHFFFAOYSA-N 380.423 2.911 0 50 GFAA CCOC(=O)C1(CCc2ccccc2)CCN(C(=O)[C@H](C)n2cncn2)CC1 11839999 DTFUSQQWYVLZEC-KRWDZBQOSA-N 384.480 2.644 0 50 GFAA COC(=O)c1ccc(CN2CCN(C(=O)/C=C/c3cccs3)CCC2=O)cc1 12037004 FZCBWEPFRSNYDY-CMDGGOBGSA-N 398.484 2.809 0 50 GFAA Cc1cc(C)n2nc(C(=O)N[C@H]3CCCN(CCc4ccccc4)C3)cc2n1 12713296 YTVQVDUDKKSDHK-IBGZPJMESA-N 377.492 2.783 0 50 GFAA Cc1cn2cc(CNC(=O)c3ccc(CN4CCC[C@H](C)C4)[nH]c3=O)nc2s1 14985164 GYLMGSPBZMBKRD-ZDUSSCGKSA-N 399.520 2.554 0 50 GFAA O=C(Cc1ccncc1)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 19836679 RGCAMYWFOPVFLQ-JOCHJYFZSA-N 381.451 2.805 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)CCc3cccnc3)CC2)[C@H]1O 20515871 NBJMGFCKHMDUGG-YADHBBJMSA-N 379.504 2.552 0 50 GFAA Cc1c(CN2CCN(Cc3ccccc3)CC2)c(=O)n(-c2ccccc2)n1C 23281492 JQSWGVGYBWKJOH-UHFFFAOYSA-N 376.504 2.802 0 50 GFAA O=S(=O)(c1ccc(Br)cc1)N1CCN(Cc2ccco2)CC1 35800902 PHWVFBMAYVHVPQ-UHFFFAOYSA-N 385.283 2.549 0 50 GFAA Cc1nc(CNC(=O)C[C@@H]2C(O)=NCCN2Cc2cccs2)sc1C 39532885 PKTPFDCZPCQMCL-CQSZACIVSA-N 378.523 2.669 0 50 GFAA O=C(CN1CCN(c2ccc(F)cc2)CC1)NCCc1ccc(Cl)cc1 55060370 LEQASQIQYAHUPF-UHFFFAOYSA-N 375.875 2.960 0 50 GFAA Cc1cc(C(=O)N(Cc2cccnc2)C[C@@H]2CCC(=O)N2)c2cc(F)ccc2n1 55575897 ICYZSEQKEDZYLN-KRWDZBQOSA-N 392.434 2.998 0 50 GFAA CC[C@H]1C=CCN1C(=O)c1coc(CN2CCN(Cc3ccccc3)CC2)n1 67457804 SDEDBSUVRPXYTA-IBGZPJMESA-N 380.492 2.783 0 50 GFAA CS(=O)(=O)N(CCCC(=O)N1CCCC1)c1cccc(C(F)(F)F)c1 67621829 JGFOEDGTVPBDRR-UHFFFAOYSA-N 378.416 2.874 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)CCC(F)(F)F)C2 71708040 LMHDKLZSTFUJEU-UHFFFAOYSA-N 379.386 2.832 0 50 GFAA Cc1cccc(CCNC(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)c1 71771704 LGPPIFPZKUFEKF-NRFANRHFSA-N 397.563 2.767 0 50 GFAA CNc1ncc(C(=O)N2CCC[C@@H](C(=O)c3cc(C)c(OC)c(C)c3)C2)cn1 72166831 PZCQYPXGMJTOJF-OAHLLOKOSA-N 382.464 2.879 0 50 GFAA Cc1ccc(CNS(=O)(=O)c2ccc3c(c2)CN(C(=O)C(C)(C)C)CC3)o1 77486232 XTORHSGSCIZYFW-UHFFFAOYSA-N 390.505 2.997 0 50 GFAA COc1ccccc1[C@@H]1CN(C(=O)Cc2ccc(F)cc2F)C[C@H]1C(=O)O 91745557 JSWPHCUULDXWOC-JKSUJKDBSA-N 375.371 2.843 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)CCc2[nH]nc3c2CCCC3)C[C@H]1c1ccc(F)cc1 91871902 QKLABPVKJNWNFT-DLBZAZTESA-N 385.439 2.687 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCC[C@H](c4nccn4CC(N)=O)C3)oc2c1 95503529 KEPAHFJNBONXMS-HNNXBMFYSA-N 380.448 2.751 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCC[C@H](c2nccn2CC2CC2)C1 95516663 YYHXJTUVJHMICU-KRWDZBQOSA-N 376.464 2.894 0 50 GFAA Cc1nnc(CN2CCC(CCC(=O)Nc3ccc4c(c3)OCCO4)CC2)o1 95528255 ZJYCVJSUVUVAPC-UHFFFAOYSA-N 386.452 2.780 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)[nH]n2)s1 102404441 YGGPHSBQQAXFBO-KBPBESRZSA-N 380.473 2.868 0 50 GFAA C[C@H](C[C@H](O)c1ccco1)NC(=O)c1cccc(NC(=O)CCn2ccnc2)c1 124106216 FVPXGRYXNVLIIZ-QAPCUYQASA-N 396.447 2.747 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@H]2CN(C2=NC=N[C@@H]3c4cc(Cl)ccc4N[C@H]23)C1 148638825 TYFADLFYBVKNDX-ICCDWZQGSA-N 393.878 2.897 0 50 GFAA Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)N1CCC[C@H](N)C1 158151254 JTBPDLMCRHTDDB-INIZCTEOSA-N 391.313 2.874 0 50 GFAA CS(=O)(=O)c1ccc(-c2noc(CCc3nnc(-c4ccccc4)o3)n2)cc1 171803250 JFJJQNBMBAJXAB-UHFFFAOYSA-N 396.428 2.975 0 50 GFAA Cc1ccc(-c2cc(C(=O)NCCCN3C(=O)COc4ccccc43)[nH]n2)o1 172668526 LBIXNOWHCWTPGY-UHFFFAOYSA-N 380.404 2.524 0 50 GFAA CC[C@@H](C(=O)N1CCC(NC(=O)Nc2cccn(C)c2=O)CC1)c1ccccc1 173525975 WKCVBJLVAQHLFJ-GOSISDBHSA-N 396.491 2.692 0 50 GFAA O=C(CCc1ccccc1)N1CCCN(C(=O)[C@@H]2COc3ccccc32)CC1 176265630 NTFPMYZCRLAQNU-HXUWFJFHSA-N 378.472 2.856 0 50 GFAA CCN1CCN(C(=O)CCc2nc(-c3ccc(C)c(F)c3)no2)C(C)(C)C1=O 188081909 KSTQAFUESZAPGK-UHFFFAOYSA-N 388.443 2.586 0 50 GFAA O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CCC(c2ccncc2)CC1 190587283 OLMHBNYTXHVNLZ-NHCUHLMSSA-N 386.540 2.739 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 191051575 GDOAEKXKLXIJBG-CQSZACIVSA-N 379.766 2.879 0 50 GFAA CN(C)c1ccnc(C(=O)N2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)c1 195496461 AXCPGVXHYMTVRB-ZDUSSCGKSA-N 387.871 2.687 0 50 GFAA CCCc1cc(C(=O)N2CCn3nc([C@@H](O)Cc4ccccc4)cc3C2)no1 221429137 PRMYQMDYNIPVFZ-FQEVSTJZSA-N 380.448 2.756 0 50 GFAA Cc1ccc(-n2ncc(C(=O)N3CCO[C@H](CC(=O)O)C3)c2C(F)(F)F)cc1 237842854 NPDKGKLSGWEJFU-CYBMUJFWSA-N 397.353 2.515 0 50 GFAA O=C(NCCc1ccc(F)cc1)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244715986 LGICHEAYSJHZJE-IYARVYRRSA-N 397.450 2.917 0 50 GFAA CC[C@@H](NS(=O)(=O)c1ccc(NC(C)=O)c2ccccc12)[C@H]1C[C@H](O)C1 252519050 AVDSAIAWNYFOBQ-CKEIUWERSA-N 376.478 2.626 0 50 GFAA CC(C)[C@@H](CNC(=O)NCc1ccc(S(N)(=O)=O)s1)Cc1ccccc1 252572631 ZOSNGAJPPLJEHT-OAHLLOKOSA-N 395.550 2.710 0 50 GFAA Cn1ccc(NC(=O)[C@H](Cc2cn(C)c3ccccc23)NC(=O)OC(C)(C)C)n1 263587607 IXJACCKGPQQZJT-INIZCTEOSA-N 397.479 2.986 0 50 GFAA Cn1cc(CN2CCCN(C(=O)Nc3ccc(C(F)(F)F)nc3)CC2)cn1 270784836 YWEYIXYPSRROOP-UHFFFAOYSA-N 382.390 2.574 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1ccc3c(c1)CCO3)CC2 299744755 PRXUZQQUIPTRKT-KRWDZBQOSA-N 397.427 2.853 0 50 GFAA O=C([C@@H]1CC(Cc2ccc3c(c2)OCO3)=NO1)N1CCC[C@@H]1c1nccs1 299778707 NDNOURHHAHQBOJ-PBHICJAKSA-N 385.445 2.923 0 50 GFAA CN1C[C@@]2(CCN(C(=O)Nc3cccc(NC(=O)C4CCCC4)c3)C2)OC1=O 299801893 YWNJCIGNDNIJNO-HXUWFJFHSA-N 386.452 2.874 0 50 GFAA CN(C)c1nc(O)cc(CN(C)[C@H]2CCN(Cc3cc4ccccc4o3)C2)n1 328642121 QVYZSPUPIDETPC-KRWDZBQOSA-N 381.480 2.701 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCCC[C@@H]2c2n[nH]c(C(C)C)n2)c1C 329544389 FYWCXRVLYZVWPY-CQSZACIVSA-N 377.514 2.912 0 50 GFAA COc1cccc(N2CCC[C@@H](NC(=O)c3ccccc3CN(C)C)C2=O)c1 365964119 DZEGSZFFXQWZLP-HXUWFJFHSA-N 381.476 2.682 0 50 GFAA O=C(OC[C@H]1CCCCN1C(=O)NCCc1cnccn1)N1CCCCCC1 370666559 VWIMUMFKDVRQPB-GOSISDBHSA-N 389.500 2.596 0 50 GFAA Cn1ccnc1[C@@H]1CCCN(C(=O)Nc2cccc([C@@]3(C)COC(=O)N3)c2)C1 881105824 KAWMKAOTLUFNLR-JLTOFOAXSA-N 383.452 2.787 0 50 GFAA Cc1cc(C(C)(C)C(=O)NC[C@@H](O)c2ccnn2C)ccc1Br 886248089 HYTYVWAFWPGWAD-OAHLLOKOSA-N 380.286 2.618 0 50 GFAA CCOC(=O)c1nc(NS(=O)(=O)c2ccc(C)o2)sc1Br 888096917 RZRRNXSLLSVVER-UHFFFAOYSA-N 395.256 2.785 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)c2cccc(Cn3cccn3)c2)n1 952966210 FCZBRFLOKXNOLS-GOSISDBHSA-N 395.463 2.871 0 50 GFAA CC(C)c1cc(C(=O)N2CCCN(C(=O)Cc3n[nH]c4ccccc34)CC2)on1 1529111497 ZKVLFNLNHHLVKR-UHFFFAOYSA-N 395.463 2.592 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc(-c3ccc(O)cc3)[nH]n2)C[C@@H]1c1ccccc1 1565529942 NTQXAGYKIVHHPF-SJORKVTESA-N 377.400 2.723 0 50 GFAA CCC[C@@H](NC(C)=O)C(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704303305 GSCKPAUQSMPKTA-LJQANCHMSA-N 383.492 2.863 0 50 GFAA Cc1ccc(C(=O)N[C@H]2C[C@@H](Cn3cccn3)C[C@@H]2O)cc1Oc1ccncc1 1857527118 CFVMNVORDXEARR-UXPWSPDFSA-N 392.459 2.948 0 50 GFAA CCn1c(O)nc(N2CC[C@@H](NCc3c(Cl)ccc4cccnc34)C2)cc1=O 1857531085 BOAPNBFVGNTANM-CQSZACIVSA-N 399.882 2.539 0 50 GFAA O[C@H](CN1CCOCC1)C1CCN(c2ccnc3cc(Cl)ccc23)CC1 1857706650 YCHSMKXEMIJSFS-HXUWFJFHSA-N 375.900 2.798 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3cnccn3)C[C@]23CC[C@H]1O3)c1ccccc1Cl 1857719312 JOQWNFLSKHFEDO-DKYLXPRQSA-N 384.867 2.544 0 50 GFAA CCOc1ncccc1C(=O)N1CCC([C@H](O)CN(C)Cc2ccccc2)CC1 1857729647 FZASLXPVVRVPLC-OAQYLSRUSA-N 397.519 2.825 0 50 GFAA Cc1cccc(N2CCN(c3cc(N4CCC(C)(O)CC4)ncn3)C[C@H]2C)c1 1875267458 NGZJBDPRINSKKF-GOSISDBHSA-N 381.524 2.851 0 50 GFAA CC1(C)CC[C@H](N2CCC3(CCc4c(O)nc(N5CCOCC5)nc43)CC2)C1 2100556242 JPQFIDYCWBUQPY-INIZCTEOSA-N 386.540 2.877 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)O)CN(Cc1cnc(-c3ncccn3)s1)C2 2325780271 UODATLLPOKISRH-INIZCTEOSA-N 382.445 2.793 0 50 GFAA O=C(O)[C@@H](C[C@@H]1CCSC1)NCc1nc(C(F)(F)F)n2c1CCCC2 2325789691 GBPRJVGUWJFHQO-WDEREUQCSA-N 377.432 2.924 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356161501 XWLJODDLJIKCQV-QFIPXVFZSA-N 394.475 2.542 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C(=O)c3ccccc3C2=O)sc2c1CCC2 846895 PWSLAQGKQAHEPI-UHFFFAOYSA-N 398.440 2.648 0 50 GFAA Cc1nc(CCNC(=O)c2cc3c(s2)C2(CCNCC2)OCC3)sc1C 2356135711 PUMNBPNUIBHZMJ-UHFFFAOYSA-N 391.562 2.945 0 50 GFAA Cc1cccc(OCC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356142584 YSIFMOGEKWUTGM-QFIPXVFZSA-N 380.492 2.736 0 50 GFAA CCCCn1c(CN2CCC[C@]23CCCN(CCO)C3=O)nc2ccccc21 2356149315 UPSKTFKINXDVGE-QFIPXVFZSA-N 384.524 2.786 0 50 GFAA CC(=O)Nc1ccc(NC(=S)N[C@H](NC(C)=O)C(Cl)(Cl)Cl)cc1 3130804 SJLXJVPUWXTQJU-NSHDSACASA-N 397.715 2.764 0 50 GFAA CC(C)c1noc(CNC[C@]2(O)CCCN(CCC3CCCCC3)C2=O)n1 67821167 ADJSJAOVQOMXKV-HXUWFJFHSA-N 378.517 2.607 0 50 GFAA CC[C@@H]1CN(C(=O)CN2CCC[C@H]2[C@H]2CCCN2Cc2ccccc2)CCO1 251859388 SPLJZHGLYWNQBJ-VSKRKVRLSA-N 385.552 2.753 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)c1 20206662 QGXYRTJWBBYSEV-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA CC1(C)C[C@]2(N=C(O)N(CC(=O)Nc3ccc4c(c3)CCC4)C2=O)C(C)(C)O1 330056393 VUKSFQZYFMQAEW-OAQYLSRUSA-N 385.464 2.586 0 50 GFAA COc1ccc(S(=O)(=O)N2CCO[C@H]3CCCC[C@H]32)cc1Br 230059619 VXWYQHUUQIJULQ-HIFRSBDPSA-N 390.299 2.790 0 50 GFAA CSc1ccccc1CN1CCC[C@@](O)(CNC(=O)N2CCCC2)CC1 72137050 IEDSZPGWOMDJHR-FQEVSTJZSA-N 377.554 2.931 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)N2CCCc3c(C(N)=O)cccc32)n1 124137792 LUKOETQGHJGXKB-UHFFFAOYSA-N 390.443 2.881 0 50 GFAA CN(C)c1ccc(CC(=O)N2CCOC[C@@H]2CC(=O)NCC2=CCCCC2)cc1 72145189 FTTKKOIGJHNDCD-NRFANRHFSA-N 399.535 2.529 0 50 GFAA O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@@]2(CN=C(O)C2)C1 329886925 WUKKSOFYBMADRS-ZPLDDDHQSA-N 399.535 2.773 0 50 GFAA Cc1cc([C@@H](NC(=O)C(=O)Nc2cnc3c(c2)COCC3)C2CC2)ccc1F 368461982 MUIFZWCMLBGRDB-IBGZPJMESA-N 383.423 2.808 0 50 GFAA O=C(O)C[C@@H]1COCCN1Cc1cn(-c2ccccc2)nc1-c1ccncc1 72157831 IWUHEWAXUOZRAB-LJQANCHMSA-N 378.432 2.610 0 50 GFAA CN(Cc1cn(C)nc1C(F)(F)F)c1nnc(-c2ccc(Cl)nc2)n1C 283185054 OFUXEDQXQNTAES-UHFFFAOYSA-N 385.781 2.919 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3cc(C)[nH]n3)n[nH]2)c(Cl)c1 15065262 UVUWZKJSJBBLFK-UHFFFAOYSA-N 389.843 2.954 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc(F)c(C)c3)[C@H]3CS(=O)(=O)C[C@H]32)o1 72423731 XFRGKILMOWQUNM-VQTJNVASSA-N 392.496 2.519 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 378505235 BVFHONGJIDVWJB-VGOFRKELSA-N 379.504 2.963 0 50 GFAA CCN1CCN(Cc2ccccc2CNC(=O)[C@@H]2Cc3cc(F)ccc3O2)CC1 129041426 CXMDJBFQQXQKMP-QFIPXVFZSA-N 397.494 2.583 0 50 GFAA CNC(=O)CN(C)C(=O)c1ccc2c(c1)n(CC1CC1)c(=O)n2C1CCCCC1 77374961 RDORGLCNKRMCOM-UHFFFAOYSA-N 398.507 2.536 0 50 GFAA c1ccc(-c2nc(CCn3ccnc3-c3cc4n(n3)CCCNC4)no2)cc1 72408638 VCBLUGUYAQBSRM-UHFFFAOYSA-N 375.436 2.533 0 50 GFAA CC1=CCN(C(=O)[C@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1 77427786 BGQBHWDLPNFANQ-JCUDRXCFSA-N 392.499 2.764 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CCCN(C(=O)c3cc(C)c[nH]3)C2)CC1 72162519 QDGGTNYZSHYOJV-GOSISDBHSA-N 382.508 2.759 0 50 GFAA Cc1nc2nc3ccn(C[C@@H]4CCCO4)c(=O)c3c(-c3ccc(F)cc3)n2n1 40398563 MXYDWUNNDMIPJC-HNNXBMFYSA-N 379.395 2.733 0 50 GFAA CC(C)c1c(C(=O)N2CC[C@H](C(=O)O)C2)cnn1-c1ccc(C(F)(F)F)cn1 178258902 FGNMIIHSGYNHOD-NSHDSACASA-N 396.369 2.956 0 50 GFAA O=C(CN1CCOCC12CCC2)NC[C@@H](c1ccccc1Cl)N1CCCC1 178487938 RYRGGNCRESPGAW-IBGZPJMESA-N 391.943 2.848 0 50 GFAA O=C1N(Cc2cc(-c3ccccn3)no2)c2ccccc2NC12CCNCC2 82133953 FSRYKUCMLFSJLX-UHFFFAOYSA-N 375.432 2.818 0 50 GFAA Cc1cnc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)nc1N(C)C 95522981 IYQTTZRANKYWDH-SFHVURJKSA-N 377.496 2.875 0 50 GFAA CCCn1ncc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)CC)c1C 91873400 NLGKYHWDXYHXMN-UHFFFAOYSA-N 384.528 2.611 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)N[C@H](CC(=O)O)c3cccs3)CC2=O)cc1 237727691 URSCFUGANVEQRC-JKSUJKDBSA-N 386.473 2.737 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)c2cncnc2C)C1 95509622 RQOFDMQLPRNJPK-SFHVURJKSA-N 382.508 2.820 0 50 GFAA COc1cccc2c1OC[C@H](CNC1CCN(C(=O)c3cccnc3)CC1)C2 95508215 NNYZAPGUEFMHPQ-INIZCTEOSA-N 381.476 2.536 0 50 GFAA CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCC[C@H](CC(=O)O)OC 95644643 UBKBNBIEPZZFBF-NKLMEKKNSA-N 386.529 2.892 0 50 GFAA in-vitro CN(C)c1ccc(CC(=O)N[C@@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)cc1 244734875 NNHUYRGDBHLMMV-NOXFTYBFSA-N 380.488 2.858 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1sc(C)nc1C)CC2 299271462 NHILTUFWJMZDSU-AWEZNQCLSA-N 390.461 2.991 0 50 GFAA COCC(=O)N1CCc2c(N[C@@H](C(=O)NC3CC3)c3ccc(F)cc3)cccc21 184470992 HZGVUTRHHWCWFC-OAQYLSRUSA-N 397.450 2.793 0 50 GFAA COC(=O)c1ccc(NC(=O)c2ncn(-c3ccc(OC(F)F)cc3)n2)cc1 261490677 WEVHLMCBCUCNOU-UHFFFAOYSA-N 388.330 2.908 0 50 GFAA CCSCCNC(=O)c1cccc(-c2ccc(CS(C)(=O)=O)cn2)c1 534667823 XCIRVDYICBXXDC-UHFFFAOYSA-N 378.519 2.776 0 50 GFAA CCn1cc(C(=O)NC[C@H]2CCCN(Cc3ccc(NC(C)=O)cc3)C2)cn1 823602199 XQKDSKYEHNKHFM-GOSISDBHSA-N 383.496 2.503 0 50 GFAA Cc1ccccc1N1CC[C@H](CNC(=O)c2cccc(N3CCNC3=O)c2)C1 670466652 VZGZOFVIZJRYBO-QGZVFWFLSA-N 378.476 2.781 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2F)CN(C(=O)[C@@H]2C[C@]23CCNC3)C1 952892720 BWYOFYWDILBMGR-AOMKIAJQSA-N 382.483 2.922 0 50 GFAA O=C(NC[C@@H]1C[C@H](CO)CO1)[C@]1(Cc2ccccc2)CCc2ccccc2C1 1875299624 QAFDZURJQMMOTC-UCFCWBNQSA-N 379.500 2.918 0 50 GFAA CCCn1cc(CNC(=O)[C@H](N)Cc2cccc(Oc3ccccc3)c2)nn1 1875315473 WHQCTSFUZXPRJB-HXUWFJFHSA-N 379.464 2.667 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)N2CC3(CCCCC3)C[C@H]2C(=O)OC)c1 1875370211 GFARSJGLOMKTTR-INIZCTEOSA-N 386.448 2.855 0 50 GFAA NC(=O)c1coc(C(=O)COC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)c1 1875337557 YBIOHOWSSUUTQY-UHFFFAOYSA-N 389.367 2.962 0 50 GFAA O=C(NC[C@H]1CCCN(c2cc(C3CC3)ncn2)C1)c1ccc2c(c1)OCCO2 952991324 XBXBYRBKWGUUGO-OAHLLOKOSA-N 394.475 2.772 0 50 GFAA CC(=O)N1CC[C@H](NC(=O)c2cccc(-n3cccn3)n2)c2ccc(F)cc2C1 185521860 AQFDVYZQGOWRAN-SFHVURJKSA-N 393.422 2.630 0 50 GFAA CSCC[C@H](C(=O)Nc1cccc(O)c1)n1c(O)nc2ccccc2c1=O 888090250 NPNHAKABJWBSRF-MRXNPFEDSA-N 385.445 2.741 0 50 GFAA Cc1cc(C(=O)N(C)Cc2ccccc2N2CCOCC2)nc(C(F)(F)F)n1 186290153 SCMLGZCDDKZFEL-UHFFFAOYSA-N 394.397 2.913 0 50 GFAA Cn1cc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)c2ccccc2c1=O 277101260 PADDBBUGRLRIQX-HXUWFJFHSA-N 389.455 2.632 0 50 GFAA COc1ccccc1[C@@H](c1nccn1C)N1C(=O)CN(Cc2ccccc2)C1=O 170613722 OHCQFZNMUAKYQQ-FQEVSTJZSA-N 390.443 2.983 0 50 GFAA CN(C)c1ncn(-c2cccc(NC(=O)c3ccn(-c4ccc(F)cc4)n3)c2)n1 170601484 VXCNSNGFOHYDSQ-UHFFFAOYSA-N 391.410 2.910 0 50 GFAA O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CC[C@H](N2CCCC2)C1 171454867 GQUMEEPPDYFBRF-INIZCTEOSA-N 385.489 2.778 0 50 GFAA CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1cnn(C(C)(C)C)c1 189046168 DVQVZKZYEDJALH-NRFANRHFSA-N 385.512 2.739 0 50 GFAA Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)COCCNC(=O)c1ccccc1 752332245 NOXHGOJCFPYSMX-KRWDZBQOSA-N 398.459 2.620 0 50 GFAA CCc1nn(C)c(CC)c1CC(=O)N(CC)S(=O)(=O)c1ccc(C)cc1 192194937 JLNXGKSCZOOEKM-UHFFFAOYSA-N 377.510 2.633 0 50 GFAA COc1cc2nc(N3C[C@@H](O)[C@H](Cc4cc(C)no4)C3)cc(C)c2cc1OC 1704325787 RLQXLBCQAKOGMW-RDTXWAMCSA-N 383.448 2.897 0 50 GFAA CCCc1cnc(N2CCCN(C(=O)c3ccc(-n4ccnc4)cc3)CC2)nc1 1772809840 FSMJAYLSPSKANW-UHFFFAOYSA-N 390.491 2.967 0 50 GFAA O=C(CSc1nc(-c2ccccc2)cc(=O)[nH]1)Nc1ccc2c(c1)OCCO2 5154823 UVNGXGLJCMEMRH-UHFFFAOYSA-N 395.440 2.939 0 50 GFAA O=C(c1cccnc1)N1CCC(Oc2ccccc2C(=O)N2CCCO2)CC1 11766951 KYOOROMLXAHWLG-UHFFFAOYSA-N 381.432 2.543 0 50 GFAA Cc1ccc(C(=O)N2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)cc1C 12202350 TXXDABPKUKNLMP-SFHVURJKSA-N 396.491 2.952 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@@]1(O)CNC1Cc2ccccc2C1 14977884 KBKQNAHDAHDOLN-JOCHJYFZSA-N 386.442 2.575 0 50 GFAA O=C(NC[C@@H]1CCC[C@H](NC(=O)C2CCOCC2)C1)c1ccc2[nH]ccc2c1 1857685877 YQDSJDVEPJMXGQ-BEFAXECRSA-N 383.492 2.999 0 50 GFAA CCOc1ccc2[nH]c(=O)c(-c3nccn3CC(C)(C)N3CCOCC3)cc2c1 1857687888 KHXFJDZUZMDIRG-UHFFFAOYSA-N 396.491 2.901 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)NCCCOC3CCCCC3)CC2=O)s1 1857711715 DGNIPZIKJZSQKR-AWEZNQCLSA-N 394.541 2.870 0 50 GFAA CC(C)n1cc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)cn1 1857713998 HBKWDYKNAFEWPR-OAQYLSRUSA-N 381.480 2.957 0 50 GFAA CN(C)c1nccc(NC(=O)c2cn(-c3ccc(Br)cc3)cn2)n1 121291817 IYKWETSCVDQNIQ-UHFFFAOYSA-N 387.241 2.743 0 50 GFAA CO[C@@H](C)C(=O)Nc1cccc(NC(=O)CC2(N3CCOCC3)CCCC2)c1 265529048 OYUAUDBREIRIQX-INIZCTEOSA-N 389.496 2.634 0 50 GFAA CCCCCN1C(=O)[C@@]2(CCN(C(=O)c3ccc(=O)n(C)c3)C2)c2ccccc21 2100547364 HRADEPWNPOZENN-HSZRJFAPSA-N 393.487 2.706 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@@H](Cc2cccc(Cl)c2F)C(=O)O)s1 2325875725 AJUAJEHVOFUTOR-ZDUSSCGKSA-N 398.843 2.602 0 50 GFAA C=CC(=O)N(C)CCC(=O)N1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 2325901780 XNYWLXZVFZUZFK-IBGZPJMESA-N 389.883 2.649 0 50 GFAA COCc1ccccc1/C=C(\C)CN[C@@H]1C[C@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 2332239207 OFHMTSGNQCOOQI-QZZKSPOXSA-N 399.491 2.560 0 50 GFAA CC(C)CSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccc(Cl)cc1 626310 ZGZUSPXYJSBTCP-UHFFFAOYSA-N 378.885 2.873 0 50 GFAA CN(C)C(=O)[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1 1544567 HINJNZFCMLSBCI-PKOBYXMFSA-N 399.878 2.612 0 50 GFAA in-vitro C[C@@H]1C[C@@H](CNc2ncnc3ccc(I)cc23)[C@@H](C)O1 413526814 CRIJGJRTLLMLJF-MXWKQRLJSA-N 383.233 3.460 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2[nH]c(CC)nc2C)C[C@@H]1CCO 107100230 SLDHKSVEPHPATE-IBGZPJMESA-N 386.540 2.748 0 50 GFAA CCCCn1c(CN(C)CCOc2ccccc2)cnc1S(=O)(=O)CC 20877732 CRHCQNIHBNACPH-UHFFFAOYSA-N 379.526 2.988 0 50 GFAA CCOC(=O)c1ccc(NC(=O)c2c(O)c3cccc4c3n(c2=O)CC4)cc1 100621293 YSZBLRKPKLAGOI-UHFFFAOYSA-N 378.384 2.692 0 50 GFAA biogenic CC(=O)[C@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CC2CCCCC2)C1 55072404 IPZJDHDFWNSBDF-KRWDZBQOSA-N 381.542 2.668 0 50 GFAA CN1CCCN(c2ccc(CNC(=O)[C@H]3CCCc4ccccc43)cn2)CC1 248116747 IWJKDZGAUHKBOC-NRFANRHFSA-N 378.520 2.960 0 50 GFAA O=C(c1cncs1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCCc1ccc(F)cc1 67872683 NRTBHVBIAXGOFK-LSDHHAIUSA-N 375.425 2.560 0 50 GFAA CCOc1ccccc1NC(=O)CC(=O)NC[C@@H](c1cccs1)N(C)C 65453178 CSJRYXXXJCUMGU-HNNXBMFYSA-N 375.494 2.895 0 50 GFAA CCNC(=O)CN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67675184 NJXJWUUNTNWCAW-UHFFFAOYSA-N 383.473 2.999 0 50 GFAA CCS(=O)(=O)Nc1ccc(NC(=O)NC2CCN(CC3CC3)CC2)cc1C 172317156 MNYKXJUMXRITBB-UHFFFAOYSA-N 394.541 2.753 0 50 GFAA Cc1ccc(NC(=O)c2ccc(NC(C)C)nc2)cc1C(=O)N1CCOCC1 427774697 DJZOVXDWXCLPTQ-UHFFFAOYSA-N 382.464 2.935 0 50 GFAA Cn1cc(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c2ccccc2c1=O 428907628 SALAHTYGYUHRDV-UHFFFAOYSA-N 399.450 2.679 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@H]1C(=O)N(C)Cc1cccnc1Cl 72417946 PNYDDUWNIOZTLC-KRWDZBQOSA-N 378.948 2.890 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N[C@H]1CCC[C@H]1Cc1ccc(F)cc1 72433145 CFYJCSQBBZJHJZ-UWJYYQICSA-N 384.499 2.976 0 50 GFAA Cc1ccc(CNC(=O)CCc2nc3cccnc3[nH]2)c(O[C@@H]2CCOC2)c1 156856450 HKNWJIKQAJFRGD-MRXNPFEDSA-N 380.448 2.683 0 50 GFAA NS(=O)(=O)c1ccc(-n2ccnc2-c2cnc(-c3cccs3)nc2)cc1 71419407 ZSDYTTKWENDMHX-UHFFFAOYSA-N 383.458 2.705 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O)cc1Br 14185870 PNSOUUDWOZLJPF-UHFFFAOYSA-N 386.223 2.957 0 50 GFAA Cn1ncc(CS(=O)(=O)CC(=O)Nc2ccccc2Cl)c1C(F)(F)F 130359222 GMNPALMCWGVHBX-UHFFFAOYSA-N 395.790 2.646 0 50 GFAA CC(C)[C@H](CNC(=O)N1CCC(N(C)c2ccccc2)CC1)N1CCOCC1 175693047 ZBGBGZXMFRYGQO-NRFANRHFSA-N 388.556 2.654 0 50 GFAA O=C(Cn1ccc([C@H]2CCCNC2)n1)N1CCC(Oc2ccccc2F)CC1 426405143 MSBFJPGASUSRNA-INIZCTEOSA-N 386.471 2.559 0 50 GFAA O=C(NCCN1CCc2ccccc21)Nc1ccc(CN2CCOCC2)cc1 96137881 ZDHRGFFKHIZAKR-UHFFFAOYSA-N 380.492 2.703 0 50 GFAA CCNc1ncc(CN2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)cn1 92020401 AGYSGPDJLKCBCB-QFIPXVFZSA-N 394.523 2.708 0 50 GFAA CN1CCc2nc[nH]c2C12CCN(Cc1c[nH]nc1-c1cccc(F)c1)CC2 95507651 GRKHVRFKERFGCR-UHFFFAOYSA-N 380.471 2.918 0 50 GFAA Cc1ccn(CCC(=O)N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)n1 95356651 NCJXJBVFJVGYHY-LJQANCHMSA-N 378.480 2.628 0 50 GFAA CC(=O)NCc1ccc(N2CCC(c3nccn3Cc3ccccn3)CC2)nc1 95510693 BBVGTUXOLWDPJE-UHFFFAOYSA-N 390.491 2.742 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@@]2(CCC(=O)N(Cc3ccncc3)C2)C1 91255117 RFKNRDCXBGXKLR-OAQYLSRUSA-N 382.464 2.731 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)CN1C(=O)COc2ccccc21 95529262 UJASOSCMPBWKAV-UHFFFAOYSA-N 377.400 2.726 0 50 GFAA Cc1cc([C@@H](C)NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)c(C)o1 163060102 DLLFDVCDGGUTLU-CYBMUJFWSA-N 390.465 2.643 0 50 GFAA Cc1ccc([C@H](CNC(=O)Cc2ccc3c(c2)NC(=O)C3)N2CCCC2)cc1 182324775 SFUVPXXPHAKRPL-NRFANRHFSA-N 377.488 2.985 0 50 GFAA Cc1nn(-c2ccccc2)cc1NC(=O)NC1CCN(c2ncccn2)CC1 183675922 UFYCFOFPFXFRMQ-UHFFFAOYSA-N 377.452 2.761 0 50 GFAA CCOc1cc(S(=O)(=O)Nc2ccccc2C(N)=O)ccc1Br 252485798 HEQMQYJYEIRMHG-UHFFFAOYSA-N 399.266 2.748 0 50 GFAA Nc1n[nH]c2ccc(-c3ccc(C(=O)NCCN4CCCCC4=O)cc3)cc12 534660300 JFYKVPHOZGWIDJ-UHFFFAOYSA-N 377.448 2.554 0 50 GFAA Cc1ncccc1OC1(C(=O)NCCc2c[nH]c3ccccc23)CCNCC1 67642129 MIRFDAPVCOEGNS-UHFFFAOYSA-N 378.476 2.731 0 50 GFAA CCCOCCN1CCN(C(=O)[C@H]2C[C@@H](c3ccccc3)N3CCC[C@H]23)CC1 299780744 BBXNHHFWIQZCQX-BDTNDASRSA-N 385.552 2.783 0 50 GFAA CCOc1cc(C(=O)N[C@H]2C[C@H](OCC)C23CCC3)ccc1OCC(=O)O 268939141 IRPYGNMPBMJQTN-IRXDYDNUSA-N 377.437 2.626 0 50 GFAA COC[C@@H](NS(=O)(=O)c1cncc(C(F)(F)F)c1)c1ccc(F)cc1 1875317264 SUXFOXHYXSPJPY-CQSZACIVSA-N 378.347 2.906 0 50 GFAA CCc1nc(=N[C@H]2CCN(C(=O)c3cncnc3C(C)C)C[C@H]2CC)s[nH]1 1875302146 BMSMXQICDKZPIZ-HIFRSBDPSA-N 388.541 2.789 0 50 GFAA Cc1c(C(=O)NC2(c3ccccc3C(F)(F)F)CC2)nnn1[C@@H]1CCNC1 888102063 XFZGUVSBGKILNJ-GFCCVEGCSA-N 379.386 2.559 0 50 GFAA CCC(F)(F)C(C)(C)CS(=O)(=O)N1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 888100111 LMNIVYREMDXOGS-DZGCQCFKSA-N 392.512 2.863 0 50 GFAA CCC[C@@]1(C)C(=O)NCCN1C(=O)c1cnc(-c2ccc3c(c2)CCO3)s1 189866349 ANLBLAXHKOXZIG-FQEVSTJZSA-N 385.489 2.876 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2ccc(C)s2)cc1OC 1529111438 YHTFLCVHJOTYRX-SJLPKXTDSA-N 377.462 2.648 0 50 GFAA O=C(c1cccc2c3c([nH]c12)CCCC3)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1704347287 AKXCLYMZNPILRC-JLTOFOAXSA-N 376.460 2.512 0 50 GFAA O=C(NC1(Cc2ccccc2)CC1)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772818974 DDKMQTPHJZXPQZ-KRWDZBQOSA-N 397.544 2.976 0 50 GFAA C[C@@H](C(=O)N(C)CC1CCN(CCc2cccc(F)c2)CC1)N1CCCC1=O 12057627 MKQHSSUOUCKVDV-KRWDZBQOSA-N 389.515 2.550 0 50 GFAA O=C(c1coc(COc2cccc(F)c2)n1)N1CCN(c2ccccn2)CC1 12430198 MQXYLXKXUPQDFW-UHFFFAOYSA-N 382.395 2.750 0 50 GFAA CCN1CCN(C(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2C)CC1 13682531 PYMHJYNDGXTEHP-UHFFFAOYSA-N 387.505 2.574 0 50 GFAA Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@@H](NCc1ccccn1)C2 14540570 DPSMAXUEQDNFSA-QGZVFWFLSA-N 393.466 2.531 0 50 GFAA CCCCn1c(CN2CC[C@H](COC)C2)cnc1S(=O)(=O)CC1CCC1 15071628 UWGHPSOCTDQZFZ-KRWDZBQOSA-N 383.558 2.725 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2cc(OC)c(OC)c(OC)c2)C(=O)O)cc1 16676235 KPAQYWSZGOPYON-DHDCSXOGSA-N 387.388 2.577 0 50 GFAA Cn1cc(CCNC2CCN(c3ccc(C(=O)NC4CCCC4)cc3)CC2)cn1 19143527 RHJRGOHXETZMMB-UHFFFAOYSA-N 395.551 2.894 0 50 GFAA COCCNC(=O)c1cccc(OC2CCN(Cc3nccs3)CC2)c1 19594778 ZMBZCZQYHVNVGB-UHFFFAOYSA-N 375.494 2.563 0 50 GFAA COCc1nnc([C@]23CC[C@H]2CCN3C(=O)Cc2cc(C(F)(F)F)ccn2)o1 1857533084 CLAIEMISURGNOU-GTNSWQLSSA-N 396.369 2.710 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cnn(-c4ccccn4)c3C)CC2)O1 1857673798 YSGRULRTTHXVLJ-SJORKVTESA-N 384.480 2.500 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2ccc3nc(C(F)(F)F)[nH]c3c2)CC[C@@H]1O 1857725137 KDGUUEYYUYIYHJ-YOEHRIQHSA-N 385.386 2.567 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 119276883 OGNMQBDOWJUBCX-HNNXBMFYSA-N 375.375 2.604 0 50 GFAA O=C1NC(=O)[C@@](Cc2ccccc2F)(C2CCN(Cc3ccc(F)cc3)CC2)N1 12203267 QVZXLIPXFJUHAW-JOCHJYFZSA-N 399.441 2.998 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCN(C(=O)c3c(C4CC4)cnn3C)C2)nc1C 2325793271 NPDHOJBUPDBBSC-NVXWUHKLSA-N 395.507 2.590 0 50 GFAA CCOC1CC2(C1)C[C@H]2NC(=O)c1c(F)ccc(S(=O)(=O)CC2CC2)c1F 874807786 YLFUILBUJTUTFW-WXYZLBAPSA-N 399.459 2.836 0 50 GFAA CCOC(=O)C1=C(N)Oc2c(c(C)nn2-c2ccccc2)[C@@H]1c1ccncc1 634331 NDLHOGBISUPLRK-KRWDZBQOSA-N 376.416 2.833 0 50 GFAA CCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1OC 640385 DTCFUEYDSJVIAQ-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA COc1cccc([C@H]2C(C(=O)Nc3cccnc3)=C(C)Nc3ncnn32)c1OC 956295 VBSNOBXAJBHSRQ-KRWDZBQOSA-N 392.419 2.618 0 50 GFAA COc1cc([C@H]2NC(=S)NC(C)=C2C(=O)OC(C)(C)C)cc(OC)c1OC 2480343 KSQSGWVOVJVZBR-OAHLLOKOSA-N 394.493 2.847 0 50 GFAA CCn1c(SCC(=O)NCC(C)C)nnc1-c1cc(C(F)(F)F)nn1C 2793609 UPANXACMWZKLJK-UHFFFAOYSA-N 390.435 2.582 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)Cc2ccccc2)c1 4342391 CQXFFQUYJSHCKP-UHFFFAOYSA-N 376.478 2.907 0 50 GFAA O=C(CS(=O)(=O)c1ccccc1)Nc1nnc(CCc2ccccc2)s1 4740572 PXVSDAJCWIKGJP-UHFFFAOYSA-N 387.486 2.736 0 50 GFAA CC(=O)Nc1cccc(-c2nnc(SCC(=O)Nc3nccs3)o2)c1 4943133 JGCBTMWXKIKPLN-UHFFFAOYSA-N 375.435 2.882 0 50 GFAA COc1ccc(S(=O)(=O)NCc2cccs2)cc1C(=O)N1CCCCC1 6746886 KYETXDXDQSZQLY-UHFFFAOYSA-N 394.518 2.861 0 50 GFAA Cc1ccccc1CNC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 7977229 CJWLZFBKEDKEAC-UHFFFAOYSA-N 378.519 2.774 0 50 GFAA O=C(c1cc(COc2ccccc2)[nH]n1)N1CCCN(Cc2cccnc2)CC1 11936047 SXHASKFDBYQCIQ-UHFFFAOYSA-N 391.475 2.732 0 50 GFAA CC(C)CCCN1CC[C@H](N2CCN(C(=O)c3ccco3)CC2)CCC1=O 12040888 LXVDYTZRRPMTKU-GOSISDBHSA-N 375.513 2.855 0 50 GFAA C[C@@H](C(=O)N1CCC(CCC(=O)N(C)Cc2ccccc2)CC1)n1cncn1 12052619 ZBGGEKBMEDMTMC-KRWDZBQOSA-N 383.496 2.517 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2ccco2)c(=O)c(C(=O)N2CCC[C@H](C)C2)c1 12056785 BVKAHJQRYSGWPD-INIZCTEOSA-N 399.491 2.899 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2cccc(F)c2)c(=O)c(C(=O)NC(C)C)c1 12452369 NWZZATWFLCEVML-UHFFFAOYSA-N 387.455 2.712 0 50 GFAA COc1ccc(C(=O)NC2CC2)c(OC2CCN(C3CCN(C)CC3)CC2)c1 12578444 ZIMVPSPKLPPMLY-UHFFFAOYSA-N 387.524 2.525 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1CCCc1ccccc1 12712892 NFBMNTOVKYCHAV-FQEVSTJZSA-N 376.464 2.698 0 50 GFAA COCc1nnc(NC(=O)C2CCN(C(=O)c3ccccc3Cl)CC2)s1 12863547 UFMPDFHXXITKOS-UHFFFAOYSA-N 394.884 2.829 0 50 GFAA CCOC(=O)c1cccc(NC(=O)NCCN2CCN(c3ccccc3)CC2)c1 16622138 VHOJYLACDCRQKH-UHFFFAOYSA-N 396.491 2.807 0 50 GFAA Nc1nc(SCC(=O)N2CCc3ccccc3C2)[nH]c(=O)c1-c1ccccc1 18193089 PIURIESIGBSEOO-UHFFFAOYSA-N 392.484 2.696 0 50 GFAA Cc1ccc2[nH]cc(CN3CCC(n4cc(CN5CCOCC5)nn4)CC3)c2c1 19745306 IRXUQUSSQGYTNG-UHFFFAOYSA-N 394.523 2.737 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3ccc4ccccc4n3)CC2=O)cc1 20209745 OLHLUGAURGYCIY-UHFFFAOYSA-N 375.428 2.728 0 50 GFAA COc1ccc(CN2CCN(C3CCCCC3)[C@@H](CCO)C2)c(OC)c1OC 22919188 IFPJLLWMGFTDGS-IBGZPJMESA-N 392.540 2.914 0 50 GFAA COc1ccc(C)cc1-n1ccc2c(cnc3nc(C(F)(F)F)nn32)c1=O 38783841 PRTHFTVGLLXWHR-UHFFFAOYSA-N 375.310 2.764 0 50 GFAA CCc1ccccc1NC(=O)c1cccc(NC(=O)[C@@H]2CCCN2C(N)=O)c1 55326122 QPQSEJJQIFVKFS-SFHVURJKSA-N 380.448 2.983 0 50 GFAA COCCn1cnnc1CCNC(=O)c1cccc(NCc2cccs2)c1 65397691 MEJQTSCEGRVTSS-UHFFFAOYSA-N 385.493 2.571 0 50 GFAA Cc1cc(N2CCN(C(=O)Cc3ccc(F)cc3)CC2)nc(N2CCCCC2)n1 67612970 IEWRDFHHKJDRIP-UHFFFAOYSA-N 397.498 2.806 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(NCCc3c[nH]cn3)nc2)C1 67677691 UOZWIYYMXOKPGZ-KRWDZBQOSA-N 383.496 2.927 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)C1(C(N)=O)CC1)C2 67740502 QSPKNUHHWOVMDU-UHFFFAOYSA-N 386.473 2.719 0 50 GFAA CC1=C(C(=O)N2CCc3c([nH]c4ccccc34)C2)[C@@H](c2cccnc2)NC(=O)N1 67851228 MXGWCYSLGIRUCM-HXUWFJFHSA-N 387.443 2.776 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@H](CCc3ccc(F)c(F)c3)C2)n1 71751989 AKQXFJXLFDOUCE-MRXNPFEDSA-N 375.419 2.701 0 50 GFAA O=C(NCCNc1cc(N2CCOCC2)ncn1)Nc1ccc2ccccc2c1 72115730 PZDKXEVFZXEERD-UHFFFAOYSA-N 392.463 2.700 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2S(=O)(=O)C1CC1 77554820 ALJKLCVOOPTOFD-LPHOPBHVSA-N 398.484 2.644 0 50 GFAA O=C(OC1CCCC1)c1ccc(NC(=O)N2CCC3(CC2)C[C@@H](O)CO3)cc1 95500253 FIMMUVPXGDSYLZ-QGZVFWFLSA-N 388.464 2.934 0 50 GFAA CN(C)c1nc(N2CCC(c3nccn3Cc3ccncc3)CC2)ncc1F 95504753 ZTQHCWBFROYSAK-UHFFFAOYSA-N 381.459 2.706 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)N[C@H](C)Cn4cncn4)cc3o2)c1 95513331 WPVZJTAABKMXAM-CYBMUJFWSA-N 377.404 2.913 0 50 GFAA O=C(CCc1ccsc1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95524153 NDLXMXNIEHEOLU-UHFFFAOYSA-N 398.532 2.716 0 50 GFAA CN(C)C(=O)N1CCC(CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1 95527623 UWFJERIUWSCINW-HXUWFJFHSA-N 386.540 2.551 0 50 GFAA COCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)c(Cl)c1 96439026 DUOUOFSAHMBMOP-UHFFFAOYSA-N 398.868 2.526 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)[C@H](c3ccccc3)N(C)C)CC2)oc1C 111154569 AELOKXFJHAHXML-NRFANRHFSA-N 384.524 2.923 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1cnn(-c2ccccc2C)c1 112162005 AVAVEHGMYZVUPN-UHFFFAOYSA-N 398.488 2.992 0 50 GFAA Cc1cnc(NCCCN2CCN(c3ncccn3)CC2)c(Br)c1 170603396 PZVSHPIITDXISU-UHFFFAOYSA-N 391.317 2.567 0 50 GFAA COC(=O)c1nc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)sc1C(C)C 170625135 GATPTTGDMCOZHB-GFCCVEGCSA-N 389.481 2.698 0 50 GFAA CCc1nc([C@H](C)NCc2nnc3n(C)c(=O)c4cc(C)ccc4n23)cs1 184721502 PRBHVAGYTNSQGO-LBPRGKRZSA-N 382.493 2.759 0 50 GFAA CNc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)ccn1 222454948 QSZIAQBJGMRMLQ-UZLBHIALSA-N 376.504 2.827 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)[C@@H](c2ccccc2)C1 237222785 LBGPLUCVSGFXQV-QGZVFWFLSA-N 394.880 2.716 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@H](Cc3ccccc3)C(=O)O)cc2)C[C@@H](C)O1 237628718 SBLKRDVGJWVIPQ-LLGFUMIMSA-N 396.487 2.722 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 237734139 LBJXQBBHSBTJND-OAHLLOKOSA-N 382.445 2.504 0 50 GFAA CC(C)[C@H](NC(=O)c1cccs1)C(=O)Nc1ccc2c(c1F)CCNC2 261650709 DFAYTYHMCQJLSP-KRWDZBQOSA-N 375.469 2.926 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)C(=O)O 262674774 QSYZGOBOPSCKPM-TZMCWYRMSA-N 376.482 2.523 0 50 GFAA COCCn1cc(CNc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cn1 286093336 SWEHIEWVDBSDAM-UHFFFAOYSA-N 392.525 2.625 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@@H]1Sc2ccccc2NC1=O)c1cccs1 299742026 ARZAVMYCRNZMNR-FZMZJTMJSA-N 376.459 2.883 0 50 GFAA Cc1nc(C)c(CNC(=O)Nc2ccc(C(=O)NC[C@@H]3CCCO3)cc2)s1 299774894 JVJIBDKDEGQNSB-INIZCTEOSA-N 388.493 2.990 0 50 GFAA Cc1cc(C(=O)N2CCN(C(=O)C3CC3)C2)c2cc(Br)ccc2n1 333581411 NYEKLHJGURBQMN-UHFFFAOYSA-N 388.265 2.958 0 50 GFAA CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)NC(C)(C)C(C)(C)O)CC1 363923289 OQURMDBYFZNZNE-UHFFFAOYSA-N 394.491 2.555 0 50 GFAA CCCc1nnc(SCC(=O)N2C[C@H]3CCCC[C@@]32c2ccccc2)n1N 365866094 LEMINWZXOFTFFD-OXQOHEQNSA-N 385.537 2.964 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@@H]3CCCO3)csc2C1 426621548 DECQUBDTMRARNB-AWEZNQCLSA-N 375.494 2.820 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@@H]3CCOC3)csc2C1 426739769 MSBDHJNWCYVUOO-AWEZNQCLSA-N 375.494 2.678 0 50 GFAA O=C(NC[C@@H]1CCN(C2CCCCC2)C1)N1CCN(c2ccccc2)C(=O)C1 584896029 HKXLFEHJGJRUPX-SFHVURJKSA-N 384.524 2.699 0 50 GFAA Cc1cc(-c2ccc(S(=O)(=O)NCCN3CCCc4ccccc43)o2)on1 670445454 GJQZTKGKPGXMQX-UHFFFAOYSA-N 387.461 2.974 0 50 GFAA O=C(Nc1ccn(CCc2ccncc2)n1)c1cc(N2CCOC2=O)ccc1F 741550079 ASJJNDZJNXIPPZ-UHFFFAOYSA-N 395.394 2.869 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)Nc1cccc(C(=O)N(C)C)c1C 824801334 LZOXNGIJFZMYBF-HNNXBMFYSA-N 381.432 2.770 0 50 GFAA O=C1CCC2(CCN1)CCN(S(=O)(=O)c1cc3ccccc3s1)CC2 828305202 BIXQMLLWEYGZKZ-UHFFFAOYSA-N 378.519 2.972 0 50 GFAA O=C1CC[C@@H](CN(Cc2cccnc2)C2CCN(c3ccc(F)cc3)CC2)N1 952861918 LVMOGLDHGFXQLV-IBGZPJMESA-N 382.483 2.970 0 50 GFAA Cc1cc(C)nc(CCNS(=O)(=O)c2cc(-c3ccno3)sc2C)n1 1506418056 UULPBOKQWHDTAP-UHFFFAOYSA-N 378.479 2.639 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1C[C@@H]2CN(C(=O)C3CCC3)C[C@]2(CO)C1 1772818598 VFMBLGHBHKQMBL-MGPUTAFESA-N 391.899 2.733 0 50 GFAA Cc1c(CN2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cnn1C 1857683327 VQXSIARJPFCRGL-JOCHJYFZSA-N 390.491 2.766 0 50 GFAA Cc1nc(CN2CCN(c3nc(C(C)C)cc(C(F)(F)F)n3)CC2)cn1C 1857687105 KTTSFMPYWCLNEP-UHFFFAOYSA-N 382.434 2.983 0 50 GFAA Cc1ncsc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccc(F)cc1 1857689363 OFMCXIIUNCVCJE-SFUIVIKGSA-N 389.496 2.651 0 50 GFAA Cc1nc2c(c(=NC(C)C)[nH]1)CCC21CCN(C(=O)CCc2ccncc2)CC1 1857703669 VQYYAEJXPPRLMM-UHFFFAOYSA-N 393.535 2.861 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857718066 MHECLWTWHPHAIY-VGSWGCGISA-N 381.476 2.585 0 50 GFAA COc1ccc(Cl)cc1NC(=O)N1C[C@@H]2[C@H](CN(C)C)[C@H]3CC[C@]2(C1)O3 1857727335 OTRYLWKDNSAZHB-XWESNNAXSA-N 379.888 2.922 0 50 GFAA CC(C)c1ccc(S(=O)(=O)N2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)cc1 1857737742 ARWXVALBQUAZMF-MTQWCTHYSA-N 378.538 2.540 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@H](N=c2ccn3ncc(Br)c3[nH]2)C1 1857781117 MDPPTHYJSQTQSQ-NSHDSACASA-N 396.289 2.725 0 50 GFAA COc1ccc(-n2[nH]c(=NC(=O)N3CC[C@@H](Oc4ccncc4)C3)cc2C)cc1 1875256359 VFIWPMFSEJHROF-LJQANCHMSA-N 393.447 2.691 0 50 GFAA CCc1nc(CNC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)no1 1875298204 RHASGRPJWJJBGS-UHFFFAOYSA-N 383.374 2.579 0 50 GFAA COc1ccc2c(c1)CCC[C@H](NC(=O)Cc1cnn(-c3ccccc3)n1)C2 1875331256 AVECCNIWKSXTBK-SFHVURJKSA-N 376.460 2.882 0 50 GFAA CN(CCN(C)C(=O)[C@]1(C)C[C@H]2CC[C@H]1C2)C(=O)c1cccc2nc(O)oc12 1875332883 PETMBUCRWUTIRS-DGCWBMGLSA-N 385.464 2.890 0 50 GFAA C=CC(=O)NC[C@H](NC(=O)C(F)(F)c1cnccn1)c1ccc2ccccc2c1 1875386084 IQSGWHJWTFEFQE-KRWDZBQOSA-N 396.397 2.881 0 50 GFAA O=S(=O)(N[C@]12C[C@H]1[C@@H]1CC[C@H](C2)N1)c1cccnc1Oc1ccc(F)cc1 1875396379 DUZUJSKJRRBVAV-FVQSIRDASA-N 389.452 2.574 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)NCc2cccnc2)cc1 839781 VXSRCVQPESTDOC-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)N(C)C)c2ccc(Cl)cc2)cc1 980224 XBSRIYZKWALJCY-UHFFFAOYSA-N 382.869 2.632 0 50 GFAA CC[C@@H](C)NC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccccc1 2959758 NHBFDPJATOJYID-OAHLLOKOSA-N 376.478 2.805 0 50 GFAA COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC[C@H]2CCCO2)cc1Cl 4986971 GRYJWVHRWRGSAA-MLGOLLRUSA-N 380.828 2.699 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN[C@@H](c2cccnc2)C(F)(F)F)cc1 65495836 YCGBYSOKRLDZSX-KRWDZBQOSA-N 380.370 2.896 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)[C@H]1CCCN1C(=O)C1CCCCC1 55228627 FQGGLMFAVOQFCZ-GOSISDBHSA-N 387.528 2.971 0 50 GFAA Cc1ccccc1-c1ncc(CN2CCn3nc(C(=O)NC4CC4)cc3C2)cn1 65526366 APVICTCHFMUCLP-UHFFFAOYSA-N 388.475 2.557 0 50 GFAA C[C@H](CN(C)C(=O)C(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)C(=O)O 422754724 GCMGHYOISDPUTP-OAHLLOKOSA-N 386.423 2.534 0 50 GFAA CCN(CCO)C(=O)[C@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 67909703 JXPWVAUUPAPZLW-SFHVURJKSA-N 394.519 2.690 0 50 GFAA COc1ccc(OC)c(CN(CC(=O)N2CCO[C@@H]3CCCC[C@H]32)C2CC2)c1 230133536 JBBVKFAQDVDLCO-TZIWHRDSSA-N 388.508 2.838 0 50 GFAA COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)CN1Cc1nc(-c2ccco2)no1 67783671 CVLIJIKQLDCZJM-INIZCTEOSA-N 378.388 2.911 0 50 GFAA O=S(=O)(NC[C@@H]1CCn2ccnc2C1)c1ccc(F)c(C(F)(F)F)c1 328631684 RHMAPXXLSZSAIS-SNVBAGLBSA-N 377.363 2.582 0 50 GFAA Cc1nn(Cc2ccc(-c3nc4c5cnn(C)c5ncn4n3)o2)c(C)c1Cl 2800262 ADHYQYORLDYWNI-UHFFFAOYSA-N 382.815 2.786 0 50 GFAA Cn1ncc(Cl)c1C(=O)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72121067 DQNQFKSOXYWTAE-HNNXBMFYSA-N 382.851 2.758 0 50 GFAA CCCCN1CCN([C@H](C(=O)N2CCCCCC2)c2ccccc2)C(=O)C1=O 77354186 RIKACBCYPQXTAR-IBGZPJMESA-N 385.508 2.601 0 50 GFAA COc1cc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)cc(OC)c1 39557660 DBQQJKHDWOLBSO-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA C[C@@H]1[C@H](N2CCOCC2)CCN1C(=O)c1ccc(OCc2ccccc2)nc1 365640391 CQZFHWDXSQLXGW-YLJYHZDGSA-N 381.476 2.596 0 50 GFAA O=C(NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)c1ccc(O)nc1 363452446 HIAYTJBGKYHXDX-UHFFFAOYSA-N 378.432 2.837 0 50 GFAA C[C@@H](NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H]1C[C@H]2CC[C@H]1C2 239306112 GLBFXFWCXUATLV-XJIUQZFPSA-N 384.929 2.901 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)N3C[C@@H](n4cccn4)Cc4ccccc43)cn21 333172249 NZHBTWWHFBMRAF-RDJZCZTQSA-N 397.504 2.970 0 50 GFAA C[C@H](OC(=O)CNC(=O)c1ccc(Cl)cc1)C(=O)N[C@H]1CCCC[C@H]1C 239667480 BQJXBYONTMNTDU-WWGRRREGSA-N 380.872 2.696 0 50 GFAA COc1ccc(-n2cc([C@@H](C)NS(=O)(=O)NCc3ccccc3)cn2)cc1 71419137 GFQFAFFMRWVTPO-OAHLLOKOSA-N 386.477 2.566 0 50 GFAA CN1C(=O)[C@](CCC(=O)NC2CCNCC2)(Cc2ccccc2)c2ccccc21 71751374 VUEYJENQZBEZQM-XMMPIXPASA-N 391.515 2.792 0 50 GFAA CC(C)c1noc(CN2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)n1 91755281 JZGUZKDBPRPKDC-INIZCTEOSA-N 376.501 2.577 0 50 GFAA COc1ccc(Cl)cc1-n1nc(CC(N)=O)nc1[C@H](O)C1CCCCC1 96180747 PZXGIHXUAAHNJQ-QGZVFWFLSA-N 378.860 2.571 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1 92097427 DZPLNJYCYKOOBF-INIZCTEOSA-N 393.915 2.702 0 50 GFAA CN1CCCN(C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)CC1 95503632 GBCADQYXKBDPLK-UHFFFAOYSA-N 380.492 2.829 0 50 GFAA O[C@@H]1CN(CCCC(F)(F)F)CC[C@H]1N1CCN(CCc2ccccc2)CC1 23358000 SRFGJZBWKKIDBD-WOJBJXKFSA-N 399.501 2.624 0 50 GFAA O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc(OCC(F)F)nc1 180945467 KPQDESLYJIGNGU-AWEZNQCLSA-N 375.375 2.540 0 50 GFAA Cc1ncsc1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 92098747 WULPEOKOTTXQAP-UHFFFAOYSA-N 384.505 2.892 0 50 GFAA O[C@H](COc1ccc(F)cc1)CN1CCC[C@H](c2nnc3n2CCCCC3)C1 298206220 IZJAJWGPJZEVHC-WMZOPIPTSA-N 388.487 2.763 0 50 GFAA O=C(O)CN(C(=O)c1cc2c(OC(F)(F)F)cccc2[nH]1)C1CCOCC1 299748162 GGZWJGMVBGSGHW-UHFFFAOYSA-N 386.326 2.772 0 50 GFAA COCCc1noc([C@H]2CCCN(Cc3cc(OC)ccc3-n3cccn3)C2)n1 824462362 LSUMEBAKFUKNNV-INIZCTEOSA-N 397.479 2.832 0 50 GFAA C[C@H]1CN(C(=O)N[C@H](C)c2ncc(-c3ccc(F)cc3)o2)CCS(=O)(=O)C1 1875301139 BGYVCNGPSVCJFA-QWHCGFSZSA-N 395.456 2.618 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N=[S@]3(=O)CCC[C@]4(CCCN4)C3)cnc21 1875393593 PXRAERWZYZUHAQ-WINIVTDRSA-N 389.525 2.612 0 50 GFAA Cc1cc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)cc2sc(N)nc12 952967713 CVONEQWIJOPOAU-UHFFFAOYSA-N 375.475 2.772 0 50 GFAA CN1CCC2(CC1)CN(C(=O)c1ccc3c(O)ncnc3c1)Cc1ccccc12 881075003 MFEBWDRSCWSKNU-UHFFFAOYSA-N 388.471 2.955 0 50 GFAA CCc1cc(C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)c2sc(C)cc2OC)no1 1775990940 IMROXILVXHMFTC-QWHCGFSZSA-N 389.477 2.745 0 50 GFAA CO[C@H](CNC(=O)N1CCC(C)(C)S(=O)(=O)CC1)c1ccc(Cl)cc1 278212404 KLDJCEGWGUFGBK-OAHLLOKOSA-N 388.917 2.636 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2noc3c2CCCC3)cc1 170623455 GRBGRJZDIBUIPP-HNNXBMFYSA-N 387.461 2.716 0 50 GFAA NC(=O)[C@@H]1CC(C(=O)OC[C@@H]2CCCc3ccccc32)=NN1c1ccccc1 170621437 XZSRAIHDFOVYBK-JXFKEZNVSA-N 377.444 2.770 0 50 GFAA O=C(c1cccnc1)N1CCC(N[C@H](CCn2cncn2)c2ccccc2)CC1 1506408357 XRPYGXQNTDNPBL-OAQYLSRUSA-N 390.491 2.699 0 50 GFAA COc1cccc(-c2ncc(CN3CCC4(CC3)CNC(=O)CCO4)s2)c1 1704309245 LOZIZMAQPRUVQM-UHFFFAOYSA-N 387.505 2.690 0 50 GFAA CC(C)CN1C[C@@H]2CN(CCS(C)(=O)=O)C[C@@]2(CCc2ccccc2)C1 1772806229 ABHJRBQEFJVQJU-SFTDATJTSA-N 378.582 2.554 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)Nc3ccc(N4CCOCC4)cc3)CC2=O)cc1 5659183 VYMRBPUVDOEGQC-QGZVFWFLSA-N 379.460 2.823 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)N(C)[C@@H]3CCOC3)CC2)CC1 11879971 RDWZIEQZTIOTSX-HSZRJFAPSA-N 399.579 2.919 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNC3(c4ccccc4)CC3)C2=O)c1 12198088 GSYGBRSITWAHDY-QHCPKHFHSA-N 380.488 2.828 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)C1)NC1CC1 12702840 FUHMKRAJUWOKEB-SFHVURJKSA-N 380.492 2.842 0 50 GFAA CC[C@@H](C)CN1CCc2nnc(CCNC(=O)c3ccc(C)cc3C)n2CC1 14878838 IFKOVUNNMDCMDF-MRXNPFEDSA-N 383.540 2.772 0 50 GFAA COC(=O)CCCNC(=O)c1cn(C(c2ccccc2)c2ccccc2)nn1 15065339 WQGKNCBRYFTGED-UHFFFAOYSA-N 378.432 2.599 0 50 GFAA CC[C@@]1(C(=O)NCc2cccs2)C[C@@H]2CC[C@H]1N2C(=O)Cn1ccc(C)n1 1857666756 FJIVNGUEVUTPOR-XAUMDUMWSA-N 386.521 2.729 0 50 GFAA N=c1ccc(C(=O)N2CCC3(CC2)OCCc2cc(OCC4CC4)ccc23)c[nH]1 1857683158 WXJYYOQQZLVTKF-UHFFFAOYSA-N 393.487 2.987 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCCCNc1cccnc1 1857709087 DNSNHLKLBFWKEI-INIZCTEOSA-N 394.479 2.843 0 50 GFAA Cc1cc(C)n(C2CN(C(=O)[C@H]3CC(=O)N(c4nc5ccccc5s4)C3)C2)n1 1857719647 SALBQCGLNJZXOG-AWEZNQCLSA-N 395.488 2.546 0 50 GFAA CCCOc1ccccc1CNC(=O)[C@H]1CC(=O)N(c2nnc(CC)s2)C1 1857727955 GYKNQHFIONGAIH-AWEZNQCLSA-N 388.493 2.559 0 50 GFAA CCn1ccnc1CNC(=O)C[C@@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857729309 DDGQHNTVSSEYOY-HNNXBMFYSA-N 397.479 2.976 0 50 GFAA Cn1cccc(CN2CCC(C3CCN(Cc4cnsc4)CC3)CC2)c1=O 1857730841 ZOVWVLBCYPZMDL-UHFFFAOYSA-N 386.565 2.966 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)[C@@H](O)C[C@@]12O 118912559 PVAMXWLZJKTXFW-DMSISKSVSA-N 390.520 2.575 0 50 GFAA biogenic,in-vitro O=C(c1cn(C2CCN(Cc3cc4ccccc4[nH]3)CC2)nn1)N1CCCC1 12036450 QUFYETDARAVTBZ-UHFFFAOYSA-N 378.480 2.833 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CC[C@@H](CN)C2)[C@H]1c1ccccc1OC 252656394 DABVYYFAZJAKIN-DJPFJPOOSA-N 387.524 2.582 0 50 GFAA O=C(Cn1c(Cc2ccc(F)cc2)noc1=O)N1CCSc2ccccc21 1875391555 BLDLTLBUQZLNEH-UHFFFAOYSA-N 385.420 2.705 0 50 GFAA C[C@H](CC(=O)N[C@H](CO)[C@H](O)c1cccnc1)c1ccc(Br)cc1 913565488 KKZBOJTZVAOCEM-XHBKTUGNSA-N 393.281 2.548 0 50 GFAA CN(C(=O)c1cc(C(F)(F)F)cnc1O)[C@H]1CCN(Cc2ccccc2)C1=O 822363819 DQJWPEHBPUWLFA-HNNXBMFYSA-N 393.365 2.679 0 50 GFAA C[C@@H](C[C@@H](C)O)NC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)ccc1F 831995629 JANSWPOMHOALPJ-NWDGAFQWSA-N 398.431 2.655 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C 328593348 XBRMXZBXHYPKKQ-XHSDSOJGSA-N 382.501 2.966 0 50 GFAA CCc1csc(CNC(=O)[C@H]2CC[C@@H](Nc3ccnc(C)n3)[C@H](OC)C2)n1 2100483301 KFGWLQXKYNUDQJ-NUEKZKHPSA-N 389.525 2.716 0 50 GFAA O=C(NCCn1cccn1)c1cc(C2CC2)nc2c1cnn2Cc1ccccc1 2325717485 DALKAVABUBIEHK-UHFFFAOYSA-N 386.459 2.984 0 50 GFAA CN(C)C(=O)Cc1ccc(C(=O)O[C@@H]2CCCN(c3ccccc3F)C2=O)cc1 2325789106 PDCHOZHXAJXSTK-LJQANCHMSA-N 398.434 2.809 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccnc(Oc2ccccc2F)c1 2325798937 KFZAFZXAOGKPGT-BMGDILEWSA-N 396.422 2.779 0 50 GFAA Cc1ccc(CNC(=O)[C@@]23CCCC(=O)N2CCC3)c(OC[C@@H]2CCOC2)c1 2325808415 XXENOPPDKNPYBN-VGSWGCGISA-N 386.492 2.572 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccnnc1)C(=O)N[C@H]1CCc2ccccc21 2325810643 VUKQKHGQHKEEQK-ZWKOTPCHSA-N 382.464 2.716 0 50 GFAA NCc1cc(NC(=O)N[C@H]2CCCN3CCSC[C@@H]23)cc(C(F)(F)F)c1 926163452 XGPPFMLAGARUNA-GJZGRUSLSA-N 388.459 2.865 0 50 GFAA CC[C@H]1SC2=NC(C)=C(C(=O)OC)[C@H](c3ccc(OC)c(OC)c3)N2C1=O 2251776 FOSGWPWSCKRQPY-ZBFHGGJFSA-N 390.461 2.916 0 50 GFAA COc1cccc2cc(C(=O)N3CCN(c4ccccc4F)CC3)c(=O)oc12 3624418 LWLZLENLRHXOCY-UHFFFAOYSA-N 382.391 2.903 0 50 GFAA O=C(O)CCCS(=O)(=O)c1nc(-c2cccs2)cc(C(F)(F)F)n1 3655124 JXGROMBXKMNTNI-UHFFFAOYSA-N 380.369 2.862 0 50 GFAA O=c1[nH]c2ccccc2cc1CN(C[C@H]1CCCO1)S(=O)(=O)c1ccccc1 9448536 FYVXLOVFZXHFLJ-GOSISDBHSA-N 398.484 2.898 0 50 GFAA Cc1cc(-c2nnc(CCC(=O)N(C)[C@H](C)c3ccc4c(c3)OCCO4)o2)no1 11838716 JYUGKMNBMUGWFX-CYBMUJFWSA-N 398.419 2.956 0 50 GFAA COC(=O)[C@@H](NC(=O)CCN1Cc2cc(Cl)ccc2O[C@H](C)C1)C(C)C 12281711 YZGWBPYFGYIWID-ACJLOTCBSA-N 382.888 2.627 0 50 GFAA CCOc1ccccc1N1CCN(CC(=O)Nc2cccc3nsnc23)CC1 13324566 HSIGARNWGYHESD-UHFFFAOYSA-N 397.504 2.851 0 50 GFAA CCc1cc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)[C@H](C)CC)C3)n(C)n1 14882558 IJYJOUZGMPCFIA-CQSZACIVSA-N 397.523 2.547 0 50 GFAA COc1cc(OC)c(/C=C2/NC(=O)N(Cc3ccc(F)cc3)C2=O)c(OC)c1 15013169 TYEAXHYSPRYXDS-MHWRWJLKSA-N 386.379 2.944 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)Cc3cccnc3)C2)cc1OC 15074893 DVGOOLURWYHKOH-FQEVSTJZSA-N 397.519 2.807 0 50 GFAA Cc1cc(NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)no1 16607207 GTZYTJYJAYNAEL-UHFFFAOYSA-N 383.857 2.676 0 50 GFAA OCC[C@@H]1CN(Cc2cccn2-c2cccnc2)CCN1CCc1ccccc1 20206484 UHWOEHCIQOUCFD-HSZRJFAPSA-N 390.531 2.984 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(OCc3ccccc3)cc2)CN1C(C)C 23363103 OMINFRWLKHVVNF-IRLDBZIGSA-N 381.520 2.953 0 50 GFAA O=C(NCc1ccccc1)C1CCN(S(=O)(=O)Cc2ccccc2F)CC1 24612634 FYECXKZUDBAHFL-UHFFFAOYSA-N 390.480 2.684 0 50 GFAA COc1cccc(-n2cc([C@H](C)NC(=O)c3cccc(NCC(=O)O)c3)cn2)c1 55359358 MYYROSBPKYZNFX-AWEZNQCLSA-N 394.431 2.868 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)C1 59739995 ZATGTJXEZYGKPU-INIZCTEOSA-N 375.488 2.759 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3c2c(-c2cccnc2)nn3C)cc2c1OCO2 65462131 RXAKJSFSDHRWBN-CYBMUJFWSA-N 378.388 2.694 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N1CCc2[nH]nc(-c3ccccc3F)c2C1 67679048 SMCFCEUQZKNUSR-UHFFFAOYSA-N 380.423 2.730 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)c2[nH]cnc2C)CCO3)n1 67785439 NEPZUTGPSQSZIL-UHFFFAOYSA-N 379.420 2.532 0 50 GFAA Cc1n[nH]c(C)c1[C@H](NC(=O)c1ccccc1OC(F)(F)C(F)F)C(=O)O 67934634 BXAWGFWVQGABAI-LBPRGKRZSA-N 389.305 2.819 0 50 GFAA O=C(CCc1ccccc1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71415680 ZLKMVBILIDOABE-NRFANRHFSA-N 397.563 2.945 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2cc(=O)n(-c3ccccc3)[nH]2)[C@@H](C)C1 77425264 GBXKBTLRVZVTSA-KRWDZBQOSA-N 376.460 2.825 0 50 GFAA CC(=O)NCCC(=O)Nc1nn(CC(F)(F)F)c2cc(OC(C)C)ccc12 77524414 PUSNQYHWVAOJPA-UHFFFAOYSA-N 386.374 2.851 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(-c3ccccc3)cc2)C[C@H]1NS(C)(=O)=O 82098621 TVSHMNRILXDBBL-VQTJNVASSA-N 386.517 2.999 0 50 GFAA COc1cc(C(=O)N2CCC[C@H](c3nccn3Cc3ccncc3)C2)ccn1 91746147 CRNWUNMQEGWWTM-SFHVURJKSA-N 377.448 2.750 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)Cn2cnc3ccccc3c2=O)CC1 91894075 RJQLLJKLDYWSNY-UHFFFAOYSA-N 377.444 2.561 0 50 GFAA Cc1cc(N)n(-c2ccc(-c3noc(CCc4c(C)nn(C)c4C)n3)cc2)n1 95357527 JHFQZWLMBGZFGG-UHFFFAOYSA-N 377.452 2.948 0 50 GFAA O=C(Cc1cccnc1)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95388592 RSEGQIULVHUMNV-UHFFFAOYSA-N 399.441 2.944 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N(Cc1cocn1)Cc1cocn1 95507964 FGUSCORCDPYVKJ-UHFFFAOYSA-N 378.388 2.515 0 50 GFAA Cc1ccc(-c2ccccc2NC(=O)NCCS(=O)(=O)N2CCCC2)o1 95528432 QWXLUZMJKCTIHD-UHFFFAOYSA-N 377.466 2.802 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)C(=O)Nc1ccccc1CC(=O)N(C)C 97514431 XVVPDDAHUUJULQ-LJQANCHMSA-N 385.464 2.610 0 50 GFAA COc1cc(/C=C/CN2CCN(Cc3cccc(C)n3)[C@H](CCO)C2)ccc1O 105279918 BRQHIQWRUYTWLY-KOXUSJRISA-N 397.519 2.686 0 50 GFAA C[C@H](CNC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)N1CCOCC1 111452895 VYTSRTPNBXBQNA-OAHLLOKOSA-N 388.487 2.917 0 50 GFAA COc1cccc(-c2cc(NC(=O)C3CCN(c4cnccn4)CC3)n(C)n2)c1 119300388 ZAKZKMNGRXIZMK-UHFFFAOYSA-N 392.463 2.741 0 50 GFAA COc1ccccc1CN(C[C@H]1CCCO1)C(=O)c1cccc2[nH]c(=O)oc12 120024785 FRYJTRPMEIHGDB-OAHLLOKOSA-N 382.416 2.951 0 50 GFAA CCOc1cc(Cl)ccc1CNC(=O)N1CCC(c2nncn2C)CC1 121035812 NUSALWXGYDXPAP-UHFFFAOYSA-N 377.876 2.956 0 50 GFAA COc1ccc(N([C@H](C)C2CC2)S(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1 122049068 OBYLQYIALJCOPY-GFCCVEGCSA-N 387.461 2.859 0 50 GFAA O=C(Nc1ccc(Cc2nnn[nH]2)cc1)C1CCN(c2ccc(Cl)cn2)CC1 135546504 BAVSYNBYLOCRSG-UHFFFAOYSA-N 397.870 2.694 0 50 GFAA NC(=O)c1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cc(Cl)ccc2Cl)co1 170595203 QSIWTQZVZFHVQE-CYBMUJFWSA-N 396.230 2.929 0 50 GFAA CCNC(=O)c1ccc(C)c(NC(=O)c2ccc3c(c2)NC(=O)CCN3C)c1 174641209 UOFYMUKPRQIJAD-UHFFFAOYSA-N 380.448 2.775 0 50 GFAA CN(C)C(=O)N1CCC(c2nc(-c3ccc(N4CCOC4=O)cc3)no2)CC1 225591906 PCPFUDUGEGLIIT-UHFFFAOYSA-N 385.424 2.554 0 50 GFAA C[C@@H](N)[C@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 237370248 WIPWSYJONCRBLI-APWZRJJASA-N 386.517 2.860 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N[C@H]1CCc2cn[nH]c2C1 240894791 IPXNEONMNQDNNP-INIZCTEOSA-N 376.416 2.814 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NCc3ccnc(OCC(F)F)c3)c2c1 242302417 YSKWSIPSCQCEBB-UHFFFAOYSA-N 394.403 2.684 0 50 GFAA COc1ccc([C@@H](NC(=O)Cc2cc(F)c(F)c(F)c2)[C@H]2C[C@@H](O)C2)cn1 244840377 UMFKTQQUUFNJHK-QHRIQVFBSA-N 380.366 2.678 0 50 GFAA O=C(O)C[C@@H]1CSCCN1C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 262610685 BCDBXBAOMGQJAB-QGZVFWFLSA-N 384.457 2.716 0 50 GFAA O=C(c1csc(-c2cnn(-c3ccccc3)c2)n1)N1CC[C@H]2CC[C@@H](C1)N2 262656023 WWHXDKPWBGEJDB-CVEARBPZSA-N 379.489 2.962 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)NCC3(N4CCCCC4)CCOCC3)cn2)n1 264641380 FEYHOTGMMFEGPW-UHFFFAOYSA-N 397.523 2.649 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)c3oc4ccccc4c3CN(C)C)C2)n(C)n1 278471746 UNCKZBUZRZKNMS-INIZCTEOSA-N 395.507 2.935 0 50 GFAA CN(C[C@@H]1CCc2nccn2C1)S(=O)(=O)c1ccc(Br)s1 328644961 ZNRPEWJIBWZCHU-JTQLQIEISA-N 390.328 2.590 0 50 GFAA O=C(Nc1cnc(-c2ccccc2)nc1)N1CCC[C@]2(CCS(=O)(=O)C2)C1 333791753 DKSLQGCACGQFAU-IBGZPJMESA-N 386.477 2.576 0 50 GFAA CNC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 374402011 LPXSTZAIOUUOED-VSRDTVRMSA-N 392.503 2.998 0 50 GFAA Cc1cc(NC(=O)N2CCO[C@]3(CCCOC3)C2)nn1-c1cccc(Cl)c1 376584978 AMVGJICERHYFAT-LJQANCHMSA-N 390.871 3.247 0 50 GFAA Cc1cnc(CNC(=O)c2cccc(-c3nc(N(C)C)nc(C)c3C)c2)cn1 426403485 LRZCOZLJGIAYNZ-UHFFFAOYSA-N 376.464 2.855 0 50 GFAA CC(C)n1cnnc1[C@H](C)NC(=O)N1CCN(C/C=C/c2ccccc2)CC1 426431091 QNJDOQMJMQLFED-HKMNZKMDSA-N 382.512 2.961 0 50 GFAA CC(C)C(=O)N1CCCC[C@H]1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 474832987 QWLXSONCNNDBTI-IBGZPJMESA-N 390.499 2.759 0 50 GFAA CCCc1ncc(C(=O)NS(=O)(=O)c2cnc3ccc(F)cc3c2)s1 764248760 PMSOXKKESWAHOG-UHFFFAOYSA-N 379.438 2.902 0 50 GFAA Cn1ncc(CNC(=O)N[C@@H]2CCCCc3cc(Br)ccc32)n1 852337152 YDZAVQCEHOPCCX-OAHLLOKOSA-N 378.274 2.845 0 50 GFAA Cc1ccc([C@@H](CN2CCOCC2)NC(=O)Cc2sc(S)nc2C)cc1 858085383 IZYVVNULKCPCLM-MRXNPFEDSA-N 391.562 2.781 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)C1 864098644 PBOBFUNTYXMKQX-SNVBAGLBSA-N 385.317 2.967 0 50 GFAA COc1ccnc(CN2CCC[C@@H](CNC(=O)Cc3cccs3)C2)c1OC 952869874 OCISWZCJRIKFDU-HNNXBMFYSA-N 389.521 2.731 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)NCCCNc3cccnc3)o2)c1C 1506400907 XSAJAJYSPHTEIM-UHFFFAOYSA-N 376.438 2.727 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 1506403532 PZVXULOMXHXTLT-QGZVFWFLSA-N 389.459 2.778 0 50 GFAA CCCn1cnnc1[C@H](C)NS(=O)(=O)c1cc(-c2ccno2)sc1C 1506404858 JIUPSNBBCZPUTC-JTQLQIEISA-N 381.483 2.753 0 50 GFAA COc1ccc(CN2CCC([C@@H](O)CO)CC2)cc1OCc1ccccc1F 1772708623 FWEBASZUMFTGRE-FQEVSTJZSA-N 389.467 2.979 0 50 GFAA O=C(NC1CC1)c1cc2c(s1)C1(CCN(C[C@@H]3CCCNC3)CC1)OCC2 1857688352 FFZAPRIOCPYSJD-OAHLLOKOSA-N 389.565 2.504 0 50 GFAA Cc1nccnc1N1CC[C@@H](O)[C@]2(CCCN(C(=O)/C=C/c3ccccc3)C2)C1 1857705790 VXBIYPFHLCBQOD-FMIHWUGLSA-N 392.503 2.678 0 50 GFAA Cc1cccc(CC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857731045 IRPHIFKHRWNPAF-VIZSFHNOSA-N 376.456 2.839 0 50 GFAA CN(C)C(=O)C[C@H](NC(=O)[C@@H]1CNC[C@H](c2ccccc2)C1)c1ccccc1 1875277005 VXLSQTAVALWQIE-HKBOAZHASA-N 379.504 2.716 0 50 GFAA O=C(N[C@H]1CCCN(c2cc(C(F)(F)F)cc(CO)n2)C1)c1ccccc1 1875287088 UYVPSMZSZARLJK-HNNXBMFYSA-N 379.382 2.992 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2cc(O)c3ccccc3c2)N(c2cc(C)ncn2)C1 1875392058 FYYXGFVUFHAKDN-ROUUACIJSA-N 392.459 2.668 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2cnco2)cc1 1875401572 LLOFDTYFOQRVFV-WBVHZDCISA-N 379.420 2.789 0 50 GFAA Cc1ccnc(Oc2ccc(C(=O)N[C@@H]3C[C@@H](Cn4cccn4)C[C@H]3O)cc2)c1 2325786002 XUYHFSGQSADKJP-NSISKUIASA-N 392.459 2.948 0 50 GFAA Cn1nc([C@H]2CCCN2)cc1C(=O)Nc1cnc(Cc2ccc(F)cc2)nc1 2325799452 ZNGCVNKJGWJEFU-MRXNPFEDSA-N 380.427 2.617 0 50 GFAA CCCc1ccc(C(=O)N2CC[C@@H](CNC(=O)[C@H]3CCCC(=O)N3)[C@@H](C)C2)cc1 2325826435 BDOAHIBLSKJEDV-FFZOFVMBSA-N 399.535 2.522 0 50 GFAA COc1cccc(CC(=O)N(CC(=O)O)Cc2cccc(Br)c2)n1 2325869984 FAPDYBAQHGYOFZ-UHFFFAOYSA-N 393.237 2.509 0 50 GFAA Cc1sc2nc(CN3CCOCC3)nc(N[C@@H]3CCN[C@@H]4CC[C@@H]43)c2c1C 2332239224 CWQXOJRNRLMNLK-ARFHVFGLSA-N 387.553 2.693 0 50 GFAA COc1cccc(CCC(=O)N2CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C2)c1 2356170305 HZJTUQPHPGZYSB-WIYYLYMNSA-N 377.481 2.728 0 50 GFAA O=C1c2ccccc2C(=O)N1c1ccc(S(=O)(=O)Nc2nccs2)cc1 623043 ZFHAWZASDIKRQC-UHFFFAOYSA-N 385.426 2.745 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2ccc(Br)cc2)NC(=O)N1 706382 QKMKMANBZFNUGU-DZGCQCFKSA-N 395.253 2.799 0 50 GFAA biogenic CN(C)C(=O)CN(c1cccc(Br)c1)S(=O)(=O)c1ccccc1 817035 GYJPTVIYUPCUBP-UHFFFAOYSA-N 397.294 2.733 0 50 GFAA Cc1nnc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCCC3)c2)s1 1116078 JDMVUIVEPBCPAL-UHFFFAOYSA-N 394.522 2.972 0 50 GFAA Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccc(O)cc3)cc2)n1 1174024 ZNJKOKZLPNVQBZ-UHFFFAOYSA-N 398.444 2.852 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)N[C@@](O)(C(F)(F)F)[C@@H]1C(=O)c1ccccc1 4144313 MTWSQTLPVMNEGM-MPGHIAIKSA-N 394.349 2.799 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc2c1=O)N1CCC(Cc2ccccc2)CC1 6909260 CKSRBIAURCYXMT-UHFFFAOYSA-N 391.471 2.561 0 50 GFAA CCC(CC)NC(=O)C1CCN(C(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)CC1 11093112 CZFDVRYXQXRUGQ-QGZVFWFLSA-N 385.508 2.583 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(Cc4ccccn4)C3)[nH]n2)cc1 11663341 OHPAUBFIHCFNTK-GOSISDBHSA-N 391.475 2.875 0 50 GFAA COCCN1CCC(CN(Cc2ccc3nonc3c2)C[C@H]2CCCO2)CC1 11816314 XYTXZRWWPRZOCC-LJQANCHMSA-N 388.512 2.562 0 50 GFAA COCC(=O)NC[C@@H]1CCC2(CCN(Cc3ccc4cccnc4c3)CC2)O1 11982414 PZUHPKCMXZYQIY-IBGZPJMESA-N 383.492 2.511 0 50 GFAA CCCCn1c(CN2CCC(OC)CC2)cnc1S(=O)(=O)CC1CCC1 12301163 JQLMBVBZYMFMEG-UHFFFAOYSA-N 383.558 2.868 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCC([C@H](O)c2ccccn2)CC1 12449300 WLNDMROHLJTMAA-NRFANRHFSA-N 391.475 2.502 0 50 GFAA O=C(CC1c2ccccc2CCc2ccccc21)NCCN1CCC[C@H](O)C1 15065694 GLIRTJXBKJNVFX-FQEVSTJZSA-N 378.516 2.880 0 50 GFAA O[C@@H]1CN(Cc2ccc(-c3ccc(Cl)cc3)o2)CC[C@H]1N1CCOCC1 19221382 GSOZRCXXGVQTHG-RTBURBONSA-N 376.884 2.867 0 50 GFAA Cc1ccc(-n2nc(-c3ccccc3)nc2CCN(C)S(C)(=O)=O)cc1C 65404913 NLAQUKFSARZGNC-UHFFFAOYSA-N 384.505 2.985 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCCN(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71774539 GKDDARSCFVLVSH-IBGZPJMESA-N 385.487 2.879 0 50 GFAA CCc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)on1 91594688 JDXRQNIZAVKUJD-UHFFFAOYSA-N 382.464 2.677 0 50 GFAA Cn1c(=O)c(CN2CC[C@@]3(CCCN(CC4CC4)C3=O)C2)cc2ccccc21 91808619 KWBDPAZKVOMFJW-QHCPKHFHSA-N 379.504 2.763 0 50 GFAA O=C(CC(F)(F)F)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95356354 SSJUSENYCUEXDD-MORSLUCNSA-N 382.382 2.756 0 50 GFAA COc1nnc(CN2CCC[C@@H](c3nccn3Cc3cscn3)C2)s1 95366418 CZAINNOOEOGAME-GFCCVEGCSA-N 376.511 2.628 0 50 GFAA Cc1n[nH]c(SCC(=O)N2CCC[C@](C)(Cc3ccc4c(c3)OCO4)C2)n1 95496878 AJJMJDFUJYZKBI-LJQANCHMSA-N 388.493 2.805 0 50 GFAA Cc1ccc(C(=O)N2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)s1 96141191 KHIRFOGZDFSYHF-UHFFFAOYSA-N 384.509 2.758 0 50 GFAA CCNC(=O)c1ccc(NC(=O)NCCCn2nnc3ccccc32)c(C)c1 96164059 KDRYXCXKMOWBIW-UHFFFAOYSA-N 380.452 2.701 0 50 GFAA Nc1ncnc2ccc(-c3ccc(S(=O)(=O)N4CCSCC4)cc3)cc12 96179685 BWQQQZYGTCZXGA-UHFFFAOYSA-N 386.502 2.617 0 50 GFAA Cc1ccnc(N2CCC(n3cc(CO[C@@H]4C[C@@H]5CC[C@H](C4)N5)nn3)CC2)c1 102823492 SWLUCBPYENKVEM-YRWFTTLQSA-N 382.512 2.623 0 50 GFAA CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N1CCC(c2ccn[nH]2)CC1 125070320 PQFPODRHMQMUSD-SFHVURJKSA-N 390.434 2.849 0 50 GFAA CCn1cnnc1C1CCN(CC(=O)N(Cc2ccc(OC)cc2)C2CC2)CC1 155422650 XOJHWBLVZZHJAC-UHFFFAOYSA-N 397.523 2.677 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N1CCNC(=O)C1(C)C 171778630 LKWJKFUMCHHPGI-UHFFFAOYSA-N 377.441 2.520 0 50 GFAA O=C(c1csc(-c2cnccn2)n1)N1CCC(O)(Cc2cccc(F)c2)CC1 184053550 IKJLOCLHNZAPKN-UHFFFAOYSA-N 398.463 2.949 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2cc(Br)ccc2F)CC1 186631587 BRMWHOGQGVCFFS-UHFFFAOYSA-N 387.249 2.599 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)COc2ccc(Cl)cc2Cl)CC1 186655531 WKNALYLQLXOVJT-CYBMUJFWSA-N 389.279 2.770 0 50 GFAA Cc1ccn2cc(CNC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)nc2c1 217061347 BNCOCYYDARGRIT-LJQANCHMSA-N 376.460 2.954 0 50 GFAA Cc1nc2ccc(C(=O)N3CCC[C@@H]3CN3C[C@H](C)O[C@@H](C)C3)cc2nc1C 227797472 PZAQTQHTCZQYLY-YZVOILCLSA-N 382.508 2.960 0 50 GFAA CCn1nccc1N1CCC[C@@H](NC(=O)CCc2ccc(Cl)s2)C1=O 241466041 NUCCXWPOSZQRGU-CYBMUJFWSA-N 380.901 2.862 0 50 GFAA CCn1ccc(CN(C)C(=O)[C@H](Cc2ccccc2)NC(=O)c2cccnc2)c1 252492261 MGVOKHFVBUWWBC-NRFANRHFSA-N 390.487 2.903 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2[C@@H](O)C[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254487962 FLMSQRUGSHIKCT-UPBZFLHXSA-N 390.520 2.575 0 50 GFAA O=C(O)c1ccc(CN2CCN(c3ccc(Br)cn3)CC2)cc1 263577813 RXGOLFLCVSXQQQ-UHFFFAOYSA-N 376.254 2.865 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C1 266299298 IPMUVSZWDKPTJM-KRWDZBQOSA-N 382.508 2.679 0 50 GFAA CN(C)C(=O)c1ccc(CN[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)[nH]1 267627673 MVOCDSWJZXOJFX-AWEZNQCLSA-N 396.413 2.984 0 50 GFAA C[C@H]1CN(Cc2ccc3c(c2)CN(Cc2ccc(CO)o2)CCO3)C[C@@H](C)O1 299770554 SAOKFXFGOPXCIE-CALCHBBNSA-N 386.492 2.776 0 50 GFAA Cn1cncc1[C@@H]1C[C@H](NS(=O)(=O)/C=C/c2ccccc2Cl)CCO1 328625922 LDJKOPWESWEDBH-JNPBOXOQSA-N 381.885 2.884 0 50 GFAA CN1CCN(CC2(C)CCN(C(=O)NCc3ccc(F)cc3F)CC2)CC1 364006127 YQJDERAVQVZVON-UHFFFAOYSA-N 380.483 2.524 0 50 GFAA Cc1cnc(C2CCN(C(=O)N[C@H]3CCCN(c4cnn(C)c4)C3)CC2)s1 373032740 CUJZUHSMLVIKHB-INIZCTEOSA-N 388.541 2.743 0 50 GFAA CO[C@@]1(C)CCCN(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)C1 417481691 OZBBTAGUQLIIHM-SFHVURJKSA-N 383.514 2.796 0 50 GFAA O=C(CCSc1ccc2c(c1)OCCO2)N1CCC(c2ncon2)CC1 426489593 IEQIHQXMJAOGGX-UHFFFAOYSA-N 375.450 2.729 0 50 GFAA O=C(NS(=O)(=O)c1cccc(F)c1F)c1ccc(F)c(Br)c1 775006894 YBESGEUKNGYVIZ-UHFFFAOYSA-N 394.168 2.985 0 50 GFAA c1cncc(Cc2nnc3n2CCN(Cc2ccc(-c4cc[nH]n4)s2)CC3)c1 829073492 JQEQBMIRTJAVLF-UHFFFAOYSA-N 391.504 2.774 0 50 GFAA COc1cccc(C(F)(F)CNC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)n1 952853105 IBLJZNQGTSGOLG-XOKHGSTOSA-N 377.366 2.959 0 50 GFAA O=C(O)c1ccccc1S(=O)(=O)N1CCC([C@H](O)c2cccs2)CC1 1506422983 TVVZYKMTIAXSSW-INIZCTEOSA-N 381.475 2.581 0 50 GFAA O=C(Nc1cc2nc(O)[nH]c2cc1N1CCCC1)c1scc2c1OCCO2 1506426333 GGXNZDMCPNGKLY-UHFFFAOYSA-N 386.433 2.954 0 50 GFAA OC1CCN([C@H]2CCN(Cc3cccc4c3oc3ccccc34)C[C@@H]2O)CC1 1565513114 QRZPLYGJIJECIF-SFTDATJTSA-N 380.488 2.978 0 50 GFAA COc1ccc(NC2(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)CCCC2)cc1 1704300433 VSYXAICICIRPJP-NQIIRXRSSA-N 395.503 2.877 0 50 GFAA O=C(Nc1c(-c2ccccc2)cnc2ncnn12)[C@H]1CC(=O)N(C2CCCC2)C1 1851809735 RERUQNZJUUXBSC-HNNXBMFYSA-N 390.447 2.521 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3C[C@@H](C(=O)O)C4(CCOCC4)C3)o2)cc1 1857690727 QJOVODFCHYNTEW-INIZCTEOSA-N 385.416 2.909 0 50 GFAA CC(C)(C)NC(=O)c1cc2c(s1)C1(CCN(C3CCNCC3)CC1)OCC2 1857704144 FVANVNHUGZMKOX-UHFFFAOYSA-N 391.581 2.892 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](C)C=C[C@H]2CN(C(=O)Cc3ccc(OC)c(OC)c3)C[C@H]21 1857713396 HFQNBNKNRRGYEC-JKXYVKTPSA-N 387.476 2.706 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)n1 1857714864 PSQXYOVMPVUSOS-HKUYNNGSSA-N 388.899 2.752 0 50 GFAA CCSCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(C)s3)C[C@]23CC[C@H]1O3 1857714891 RCQHZHZAMLEKDI-DODZYUBVSA-N 380.579 2.905 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(F)c(OC)c3)C[C@]23CC[C@H]1O3 1857721421 ODUFSKDNQPGTMP-LTVCHDBBSA-N 376.472 2.730 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)CC3CC(C)(C)NC(C)(C)C3)C[C@]23CC[C@H]1O3 1857726815 DKXXVSFQEULRPX-KCXPTXFHSA-N 377.573 2.501 0 50 GFAA O=C(CCc1ccccc1F)NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3 1875246022 XMFCDDAQNHXSBT-XNSSQMBPSA-N 395.478 2.954 0 50 GFAA Cc1cc(C[C@@H]2CN(c3cccc(-c4ccc5c(c4)OCO5)n3)C[C@H]2O)on1 1875246625 DCQJLXFZHMJESE-CRAIPNDOSA-N 379.416 2.814 0 50 GFAA CCn1nc(C(=O)N(CCN(C)C)Cc2ccncc2)c2c1[C@H](C)O[C@H](C)C2 1875301574 NIYSPYFILFEGCM-CVEARBPZSA-N 385.512 2.524 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CC2)C1)[C@H]1CCCO1 1875332831 NLPYGAHBRGCBFK-DLBZAZTESA-N 376.884 2.658 0 50 GFAA Cn1ccnc1C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940195542 WPZYCNSNCRWUSE-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA COc1cc(CC(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)cc(OC)c1 2325766415 JLXSLXCUWIFZLD-UHFFFAOYSA-N 378.432 2.588 0 50 GFAA Cc1cnn(C2CCN(S(=O)(=O)c3nnc(-c4ccccc4)s3)CC2)c1 2325803389 DEGLPPOFPZYJPB-UHFFFAOYSA-N 389.506 2.736 0 50 GFAA CN1CCC(C(=O)N2CCC3(CC2)C[C@](C)(O)CCO3)(c2ccccc2)CC1 2356145100 APCDSQIJYNCWPD-OAQYLSRUSA-N 386.536 2.573 0 50 GFAA CC(C)Sc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(Cl)cc1 634894 XPGLYJHLTQRIPH-UHFFFAOYSA-N 378.885 2.636 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1cnn(Cc2cccc3ccccc23)c1 2804621 CRZYVMDEEHFTKN-UHFFFAOYSA-N 381.461 2.927 0 50 GFAA COc1ccc(CN(C(=O)c2ccccc2F)[C@@H]2CCS(=O)(=O)C2)cc1 4182972 ARWQIUKZZYTWGF-OAHLLOKOSA-N 377.437 2.664 0 50 GFAA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)C1 10463211 CQDRMLWGEWHVDI-LLVKDONJSA-N 381.372 2.549 0 50 GFAA COc1cccc(CC2=NO[C@@H](C(=O)NCc3ccc(-n4cccn4)cc3)C2)c1 11840265 YKMHVSYQIGDRQX-OAQYLSRUSA-N 390.443 2.885 0 50 GFAA C[C@H](C(=O)N1CCN(c2cccc(Cl)c2)CC1)n1cnc2ccccc2c1=O 16021098 LNERNDYXBKGBTC-OAHLLOKOSA-N 396.878 2.960 0 50 GFAA Cc1c(Br)c(C(=O)Nc2cccc(CN3CCOCC3)c2)nn1C 19850408 FYCFPMNEBNWCOQ-UHFFFAOYSA-N 393.285 2.576 0 50 GFAA CCN1CCC[C@@H]1CN(Cc1cnn(CC)c1)CC1CCN(CCOC)CC1 20784618 FDENXPXCOQMATK-JOCHJYFZSA-N 391.604 2.548 0 50 GFAA COC1CCN(c2ccc(C(=O)N3CCCC[C@@H]3CCn3cccn3)cn2)CC1 20993647 VCDSBPUAVFZYJF-LJQANCHMSA-N 397.523 2.978 0 50 GFAA CCOc1cc(CN2CCN(Cc3cccc(C)n3)[C@@H](CCO)C2)ccc1OC 23374977 TVGQABIMUORSDG-NRFANRHFSA-N 399.535 2.866 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCO2)cccc1C(=O)NCc1cn2cccc(C)c2n1 23620007 NSXIQRAQLBAXMP-IBGZPJMESA-N 392.459 2.999 0 50 GFAA C[C@H]1Cc2cc(Br)cc3c(=O)c(C(=O)NC[C@H]4CCCO4)cn1c23 33089175 YUWZOTCGDOVTOW-GXFFZTMASA-N 391.265 2.790 0 50 GFAA Nc1ccc(-c2ccc(C(=O)NCC[C@@H]3COc4ccccc4O3)cn2)cn1 67689037 WIWDXHGGBHXJJH-MRXNPFEDSA-N 376.416 2.686 0 50 GFAA Cc1cc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)n(CCN(C)C)n1 67722844 JARDZOVUEYRWLK-SFHVURJKSA-N 376.888 2.620 0 50 GFAA CNS(=O)(=O)c1ccc(CN2CCCN(CC3CC3)[C@H](C(C)C)C2)cc1 71754046 LKPREYZAJMUJIL-FQEVSTJZSA-N 379.570 2.537 0 50 GFAA COc1ccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1 71762462 CXOVHHUAHCDGSL-LJQANCHMSA-N 399.535 2.634 0 50 GFAA CCCc1nc(N[C@@H](c2ccccc2)c2nnc(N)s2)c2cnn(C)c2n1 72153814 FSYMWHXAWNBUDU-AWEZNQCLSA-N 380.481 2.951 0 50 GFAA CCSc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCNC)C2)s1 77353490 SAMRERKYBBSCCS-UONOGXRCSA-N 381.567 2.533 0 50 GFAA Cc1nn(CC(=O)N2CC[C@H]2c2ccccc2)c(=O)n1CCc1ccccc1 77485663 OWUQFOPZFLCCHL-FQEVSTJZSA-N 376.460 2.570 0 50 GFAA Cc1nc2ccc(S(=O)(=O)N[C@H]3CCOC4(CCOCC4)C3)cc2s1 82125225 BSAJTNLLQDTTDY-ZDUSSCGKSA-N 382.507 2.611 0 50 GFAA COc1ccc2nc(CNC(=O)c3cnc(-c4cccs4)nc3O)[nH]c2c1 91350898 SVZLRSDKFSEZLL-UHFFFAOYSA-N 381.417 2.726 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1CCC2(CC1)Nc1ccccc1NC2=O 91871678 DUEWNNZYSXIXOU-UHFFFAOYSA-N 387.443 2.911 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)N1CC[C@@H](Cc2cccc(CO)c2)C1 91997230 DJPJYPSETIHDGC-SFHVURJKSA-N 378.472 2.616 0 50 GFAA O=C(NC[C@H](c1cccnc1)N1CCCCC1)c1cnc(-c2ccncc2)nc1 95354050 ZDQMQPKPTFPLCZ-HXUWFJFHSA-N 388.475 2.891 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ncccc3O)CC2)CN1CCc1ccccc1 95381992 PRFBNFUEVAILAW-UHFFFAOYSA-N 393.487 2.875 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95513092 OXVTUZSYEIENKR-CQSZACIVSA-N 384.871 2.733 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95521131 YTNPXXCSACPLRK-FQEVSTJZSA-N 376.460 2.839 0 50 GFAA CN(C[C@@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1)S(C)(=O)=O 95528818 RPZCZTHTAMQLMG-HNNXBMFYSA-N 378.460 2.851 0 50 GFAA Cn1ncc2c(N3CCN(Cc4csc(-c5cccs5)n4)CC3)ncnc21 142365610 LCQPZZXOAWTFQV-UHFFFAOYSA-N 397.533 2.871 0 50 GFAA Cc1noc(-c2ccn3c(CNC(=O)c4cc(Cl)ccc4F)nnc3c2)n1 169776246 RXJPOJIAKJJMQF-UHFFFAOYSA-N 386.774 2.810 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)cc1 174879455 PAPDVQNCOYOAEN-VQTJNVASSA-N 387.501 2.960 0 50 GFAA COc1ccc(CN2CCC(CNC(=O)NCC3CCOCC3)CC2)cc1 195485694 KPHYQZQPZOQJOI-UHFFFAOYSA-N 375.513 2.633 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1cscn1)C1(c2ccccc2F)CC1 219443174 KYWRTTCYRUOQIF-IAGOWNOFSA-N 376.453 2.804 0 50 GFAA O=S(=O)(CCC1Cc2ccccc2C1)N1CCN(c2cccc(O)c2)CC1 225658753 GEEDMIJOFMESQR-UHFFFAOYSA-N 386.517 2.649 0 50 GFAA COCCN1C[C@@H](CN2CCN(c3cc(Cl)ccc3Cl)CC2)CC1=O 299782829 GKYFMQCRYDMWDT-CQSZACIVSA-N 386.323 2.610 0 50 GFAA C[C@H]1Oc2ccccc2[C@H]1NC(=O)Nc1cccc2c1CCN2S(C)(=O)=O 377606530 NKENEEWLOHXORA-XIKOKIGWSA-N 387.461 2.652 0 50 GFAA Cc1cc(C)nc(-n2cc(C(=O)N3c4ccccc4C[C@@H]3CN)c(C(C)C)n2)n1 422626506 KFULHNOYIKIIGY-QGZVFWFLSA-N 390.491 2.933 0 50 GFAA Cc1cc2[nH]cc(C(=O)NCc3nc4cc(C(C)(C)C)ccc4o3)c(=O)n2n1 534579011 OXJCTPXJQCASHN-UHFFFAOYSA-N 379.420 2.700 0 50 GFAA CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@@H](O)c1ccc(Cl)cc1 772704480 KYJYPLLNCANXTE-RBUKOAKNSA-N 399.878 2.718 0 50 GFAA O=C(O)C1CC2(C1)C[C@@H](NS(=O)(=O)/C=C/c1ccc(F)cc1)CCS2 899948215 FJJFXPMTWSPWPV-UEPMXYLTSA-N 385.482 2.845 0 50 GFAA Cn1ncc(CN2CC[C@@](c3nc(-c4cccc(F)c4)no3)(C(F)(F)F)C2)n1 952891478 DYTJYFUUXBCCQA-MRXNPFEDSA-N 396.348 2.710 0 50 GFAA CN1CCCC[C@H]1C(=O)NCC1CCN(CCCOCc2ccccc2)CC1 952979074 MQHCZTMZQLLQKM-QFIPXVFZSA-N 387.568 2.906 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1C[C@H]2CC[C@@H](C1)N(CC1CCC1)C2 1073400086 WCTGYJMGKQVHBQ-OALUTQOASA-N 379.504 2.724 0 50 GFAA Cc1nccn1CCc1nnc(N2CCOC[C@H](C3CCC3)C2)n1CC1CC1 1345827009 INPJLNKZRFSSGI-LJQANCHMSA-N 384.528 2.689 0 50 GFAA CCNC(=O)c1cc(NC(=O)[C@@H](N)Cc2ccc(OC)cc2)ccc1Cl 1506418573 RPOBBCBRHHBTJU-KRWDZBQOSA-N 375.856 2.607 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2ccnc2)C[C@@H]1O)c1occc1COc1ccccc1 1857527350 PSPIDIODXNRRDF-MNEFBYGVSA-N 381.432 2.625 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccccc3)C[C@]23CC[C@H]1O3)c1cc(C2CC2)no1 1857720982 SYZDDWSFWHKFNE-XNSSQMBPSA-N 393.487 2.961 0 50 GFAA O=C(c1cc2ccccc2cn1)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857722807 OKJPOVMFCCEONT-GMAHTHKFSA-N 394.446 2.802 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)CCc4ccc(Cl)cc4)[C@@H]2CC(=O)N13 1857726557 XAQAKXBQFKZMNO-QKLQHJQFSA-N 376.884 2.857 0 50 GFAA O=C(O)[C@]1(CC2CC2)CN(Cc2cnn(-c3ccc(Cl)cc3)c2)CC[C@@H]1O 1875246463 IIZPAVDQXTVJNZ-AZUAARDMSA-N 389.883 2.963 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(C(=O)c3ccccc3Cl)C[C@]23CC[C@H]1O3 1875246873 DCPOBEFTNQXVOX-DKYLXPRQSA-N 376.884 2.876 0 50 GFAA O=C1NCC[C@H](NC(=O)N2CCC[C@@H](c3cccc(O)c3F)C2)c2cc[nH]c21 1875301160 BRPWBEUNVQMHIE-DOMZBBRYSA-N 386.427 2.623 0 50 GFAA Cn1ncc(C(=O)NC[C@H](CO)c2ccc(F)cc2F)c1Cc1ccccc1 1875358369 TUXZVZXLHVDYCP-OAHLLOKOSA-N 385.414 2.795 0 50 GFAA COCc1nnc([C@]23CC[C@H]2CCN3C(=O)c2cc(-c3cccc(O)c3)on2)o1 1875404567 MYDPAGCIJQWZMS-RBZFPXEDSA-N 396.403 2.728 0 50 GFAA CCc1nnc([C@]23CC[C@H]2CCN3C(=O)c2ccnc(-c3ccccn3)n2)o1 1875404901 ZZKIQGHKLWGHRT-RBZFPXEDSA-N 376.420 2.635 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCCCn2cccn2)C[C@H]1NC1CCCC1 2100480676 ORFFGCCCOBCRSF-DFQSSKMNSA-N 376.545 2.886 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CC[C@@H]3SCCS[C@H]32)c(Cl)c1 2325779870 MDDHWOAZHYAGHY-RDBSUJKOSA-N 391.967 2.853 0 50 GFAA CC[C@@H](C(N)=O)N1CC[C@]2(CCN(C(=O)c3coc4cc(C)c(C)cc34)C2)C1 2325793775 HMLYZMRKYPXKGA-AVRDEDQJSA-N 383.492 2.852 0 50 GFAA O=C(Nc1ccc2nc(Cc3ccc(F)cc3)[nH]c2c1)c1ncn2c1CNCC2 2325857548 FZCLTHVAFNGPGI-UHFFFAOYSA-N 390.422 2.845 0 50 GFAA O=C(NCc1nnc(C2CC2)n1-c1ccccc1)c1cc(F)cc2c1CNCC2 2325858687 XHLDREIONZFVPN-UHFFFAOYSA-N 391.450 2.860 0 50 GFAA COc1ccc(CN2CCC[C@@]23CCCN(C(C)C)C3=O)cc1Cn1cncn1 2356139481 YOHAEJRQTOXBES-QFIPXVFZSA-N 397.523 2.700 0 50 GFAA CCc1ccc(NC(=O)CSc2nnnn2-c2ccc(C(=O)O)cc2)cc1 778709 RRTPGJBHMFDRKL-UHFFFAOYSA-N 383.433 2.654 0 50 GFAA CC(=O)N(C(C)=O)c1cccc(C(=O)c2cccc(N(C(C)=O)C(C)=O)c2)c1 1233579 OJJPXSWPXDLHFZ-UHFFFAOYSA-N 380.400 2.716 0 50 GFAA CCN(CC(=O)Nc1ccccc1Cl)S(=O)(=O)c1ccc(OC)cc1 4837791 NVGKGKVLFUWKJU-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA CC(=O)N1CCN(c2ccccc2NC(=O)COc2ccc(C)c(C)c2)CC1 4933418 NPICLQNVTATWHA-UHFFFAOYSA-N 381.476 2.989 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@@H]2CC(=O)N(c3ccccc3C)C2)CC1 7450919 KKNNPYLQNUFCDM-GOSISDBHSA-N 393.487 2.705 0 50 GFAA Cc1ccc(CNC[C@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)s1 55109175 WWBPXRHHBQEQDK-LJQANCHMSA-N 380.460 2.978 0 50 GFAA COc1ccc(Nc2nc(N3CCO[C@H](C)C3)cc(N3CCO[C@H](C)C3)n2)cc1 225387465 NTYFMQFJNOWBIE-HZPDHXFCSA-N 399.495 2.679 0 50 GFAA CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(F)nc3)n2)cc1 118761521 ZFOWQLIUAMZQJZ-UHFFFAOYSA-N 392.437 2.968 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3cccs3)CC2)cc1 8507392 YHQWMASYDAECSY-UHFFFAOYSA-N 378.519 2.774 0 50 GFAA CCNC(=O)[C@H](C)N1C(=O)C2(CCN(C[C@H](C)CC)CC2)Nc2ccccc21 55119619 DZJZLEQTEHVITB-SJORKVTESA-N 386.540 2.850 0 50 GFAA Cc1ccc(-c2cn3c(C(=O)N(CCO)Cc4nccn4C)csc3n2)cc1 67894512 OODHFDCNNRWRJO-UHFFFAOYSA-N 395.488 2.739 0 50 GFAA Cc1nc(NC(=O)C[C@@H]2NC(=O)N(Cc3ccccc3Cl)C2=O)sc1C 170625570 NRJLOMFLFIFLNL-ZDUSSCGKSA-N 392.868 2.863 0 50 GFAA Cc1cc(C)n(-c2cc(NCCNC(=O)c3c(F)cccc3Cl)ncn2)n1 67604116 QWBZQTOYLQUVNH-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA COc1ccc(OC)c(NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c1 20367244 QPKMXQWWAWHXKR-UHFFFAOYSA-N 383.492 2.769 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCc3cccc(F)c3)C2=O)c1 67895409 QEMCIRDRNUQBHN-OAQYLSRUSA-N 390.430 2.617 0 50 GFAA COC(=O)c1cc(C(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)n(C)n1 67773877 LBALXDUVNKILSH-HNNXBMFYSA-N 398.246 2.727 0 50 GFAA CCCN1CC[C@@H](CNC(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1 252458485 KXLGBVOKFDRBQU-JKSUJKDBSA-N 380.483 2.822 0 50 GFAA CCN(CCc1nc2ccc(C)cc2[nH]1)C(=O)c1nc2ccccc2[nH]c1=O 67654758 GRRRSIFXPALXKQ-UHFFFAOYSA-N 375.432 2.813 0 50 GFAA COc1ccccc1-n1cc(CN2CC[C@@H](N3CCCCCC3)[C@H](O)C2)cn1 11753524 XRUZVWGCGFXSES-TZIWHRDSSA-N 384.524 2.692 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1CCCn2nc([C@H](O)C3CCC3)cc2C1 219914863 LAPQRWDIEPRBGJ-OAQYLSRUSA-N 391.475 2.948 0 50 GFAA COCCCN1C[C@]2(CCCN(Cc3c(C)nc4ccccn34)C2)CCC1=O 77520859 IMHCGBBCVPOETE-JOCHJYFZSA-N 384.524 2.884 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H](c3nnc(CN4CCCCC4)n3C)C2)cn1 72427802 KDDUISSDMUOVQI-SFHVURJKSA-N 382.512 2.524 0 50 GFAA Cc1ccccc1N1CCN(C(=O)c2ccc(-c3nnn(C)n3)cc2)[C@H](C)C1 77536608 CJVRAGUXVVBAQY-MRXNPFEDSA-N 376.464 2.536 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3cccnc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 71762920 ISMXSKPPXWLTFV-MDNUFGMLSA-N 377.488 2.722 0 50 GFAA CN1C(=O)[C@@](CCC(=O)NCCC(=O)O)(Cc2ccccc2)c2ccccc21 71422239 QERAALPNGAQVTE-QFIPXVFZSA-N 380.444 2.515 0 50 GFAA Nc1cc(-c2ccc(C(=O)N3CCCC[C@H]3CCn3ccnc3)cc2)ncn1 426420384 RGBAUCQFQBUXFL-SFHVURJKSA-N 376.464 3.007 0 50 GFAA CCn1nc(CC(C)C)cc1C(=O)NC1CCN(C(=O)c2ccncc2)CC1 91860454 USWZXOHNJDIAFA-UHFFFAOYSA-N 383.496 2.531 0 50 GFAA Cn1c(CN2CCCCC2)nnc1C1CCN(C(=O)c2ccc(F)cc2)CC1 96140283 BYZATWIETZASKB-UHFFFAOYSA-N 385.487 2.960 0 50 GFAA O=C(c1ccccc1-n1cnnc1)N1CCC(c2nnc3n2CCCCC3)CC1 426405444 DFYMOGIIDJFWSM-UHFFFAOYSA-N 391.479 2.605 0 50 GFAA COc1cc(CN(C)C2CCSCC2)ccc1OC[C@@H](O)CN1CCCC1 95504021 BUADFYDOYUCOPI-IBGZPJMESA-N 394.581 2.858 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95504783 UIGKBIAUPUMUHX-KRWDZBQOSA-N 390.491 2.948 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)CCn3ccnc3)csc2C1 426566894 MJSCRZRWNDYRGC-UHFFFAOYSA-N 399.520 2.880 0 50 GFAA CC(C)Cc1ccc(CN2C[C@H](CO)[C@H](CN3CCCN(C)CC3)C2)s1 91770750 SVUMLKWLTGATBS-RTBURBONSA-N 379.614 2.624 0 50 GFAA CNC(=O)CN1CCCC[C@@H]1C(=O)Nc1cccc(-c2cccc(OC)c2)c1 95517332 VXSJZHJNNUFPIC-HXUWFJFHSA-N 381.476 2.901 0 50 GFAA Cc1ccncc1C(=O)N1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1940193556 VBDALNYUJYDVNX-SIKLNZKXSA-N 382.460 2.691 0 50 GFAA CCNC(=O)c1ccc(C)c(NC(=O)c2ccc(N3CCN(C)CC3)cc2)c1 823128456 SRXBUEQHLNEDDD-UHFFFAOYSA-N 380.492 2.749 0 50 GFAA COc1ccc2[nH]c(CNC(=O)c3ccc(C)c(N4CCNC4=O)c3)cc2c1 824758480 HNDZUKUHFAQLSM-UHFFFAOYSA-N 378.432 2.945 0 50 GFAA CCc1c(C(=O)N=[S@@]2(=O)CCC[C@@]3(CCCN3)C2)cnn1-c1ccccc1 1875393339 KTDMZVAADZWJFF-CCLHPLFOSA-N 386.521 2.959 0 50 GFAA Cc1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccncc3)C2)ccc1N1CCCC1=O 952987759 LFMBBQINCYELBP-QGZVFWFLSA-N 392.459 2.504 0 50 GFAA CC(C)(NC(=O)[C@H]1CCS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 885850865 ODRGDKHWWYFCAM-HNNXBMFYSA-N 387.457 2.728 0 50 GFAA Cc1cc(-c2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)c3c(C)noc3n2)c(C)o1 186838913 UQKBXNCCTCWRNL-GFCCVEGCSA-N 398.463 2.547 0 50 GFAA CC(C)(C)OC(=O)NC[C@H]1CN(CCCc2nc3ccccc3o2)CCO1 170599752 TWBGMOCTQATWSV-HNNXBMFYSA-N 375.469 2.986 0 50 GFAA Cc1cc(S(=O)(=O)NC(=O)c2cc(-c3ccccc3)[nH]n2)c(F)cc1F 754794655 CCXXWVTUISFSPH-UHFFFAOYSA-N 377.372 2.782 0 50 GFAA Cc1cnc(C2CCN(C(=O)NCc3ccc(-n4cncn4)nc3)CC2)s1 763199307 ROKFIJOSZLVKAO-UHFFFAOYSA-N 383.481 2.516 0 50 GFAA CCCn1cc(C(=O)Nc2nc(Cc3nnc(NC)s3)cs2)c(C)n1 1506425677 QOFXBUQYOFDUAF-UHFFFAOYSA-N 377.499 2.794 0 50 GFAA CC(C)Sc1nnc(NC(=O)C2CCN(C(=O)c3ccccn3)CC2)s1 1506399998 LFZMZQVCENCIJW-UHFFFAOYSA-N 391.522 2.925 0 50 GFAA COCCc1nc(CNS(=O)(=O)c2cc(C(C)(C)C)cc(C)c2C)no1 1506423425 IKHOJWOJMQSEDH-UHFFFAOYSA-N 381.498 2.651 0 50 GFAA COCCSc1nnc(NC(=O)[C@H](C)Oc2ccc(F)cc2F)s1 1529159908 UNKQUDHABGCWSE-QMMMGPOBSA-N 375.422 2.961 0 50 GFAA COc1cc(-c2onc(N3CCN(CC4CC4)CC3)c2C(=O)O)ccc1F 1704316608 XJBQJKILAFIJNG-UHFFFAOYSA-N 375.400 2.720 0 50 GFAA C=CC(=O)N[C@H](NC(=S)Nc1ccccc1OC)C(Cl)(Cl)Cl 5570274 GLQGTXVETZXEKV-LLVKDONJSA-N 382.700 2.980 0 50 GFAA O=C(c1cc(COc2ccccc2)[nH]n1)N1CCC(N2CCSCC2)CC1 11820287 RHBHCFKYSKXDOC-UHFFFAOYSA-N 386.521 2.642 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1ccc(F)c(F)c1 12111954 WXCAWYLQLFMXGR-GOSISDBHSA-N 384.390 2.544 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)NCc2ccccc2-c2ccccc2)nn1 12204530 YRTXXLVHUFCJKJ-UHFFFAOYSA-N 391.475 2.744 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C2CSCCSC2)CC1 12372826 CMLVPYQADPGLOC-SFHVURJKSA-N 399.670 2.928 0 50 GFAA O=C1NCCN(C(=O)c2ccc3nc(C4CC4)oc3c2)[C@@H]1Cc1ccccc1 12597205 IRZATKGWNQJZEP-GOSISDBHSA-N 375.428 2.889 0 50 GFAA Cc1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)CSc2nncn2C)cc1C 14973314 AERZTMHEYOHEOL-KRWDZBQOSA-N 396.520 2.904 0 50 GFAA CC(C)Cn1cc(C(=O)NC(C)C)c(=O)c(C(=O)N(C)Cc2ccccc2)c1 15070665 IHYDWAUKRDKMPB-UHFFFAOYSA-N 383.492 2.915 0 50 GFAA O=C(CCC(=O)N1CCC[C@@H]1c1ccc(F)cc1)N1CCC2(CC1)OCCO2 19228890 MZAJRFTZWPKYLZ-GOSISDBHSA-N 390.455 2.635 0 50 GFAA O=C(N1CC[C@H](n2cc(-c3nc(C4CC4)no3)nn2)C1)C1(c2ccccc2)CC1 169778661 FCTRPWHPRRZYJI-INIZCTEOSA-N 390.447 2.711 0 50 GFAA CNC(=O)Cc1nc(CCCc2nc3ccccc3s2)n(CC(F)(F)F)n1 1857674390 GDJDJQWCWBUZJA-UHFFFAOYSA-N 397.426 2.914 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1-n1ccnc1-c1ccc2c(c1)CCO2 1857691387 JCISHRILETVFLP-KRWDZBQOSA-N 398.488 2.647 0 50 GFAA CCN1CC[C@@H]2C[C@@H](N3CCOCC3)CC[C@@]2(C(=O)NCc2ccccc2C)C1 1857702964 KHRFDGOQLYHAEI-AOHZBQACSA-N 399.579 2.824 0 50 GFAA Cc1ccoc1C(=O)NC[C@H]1[C@H]2CN(Cc3c(C)noc3C)C[C@]23CC[C@H]1O3 1857712563 DEMOMEUQMBMTTP-NWUWZPLHSA-N 385.464 2.602 0 50 GFAA COc1nc2c(cc1CN1CCc3[nH]nc(C4CC4)c3CC1)C(=O)N(C(C)C)C2 1857713819 PCQBTGFESJYBEH-UHFFFAOYSA-N 395.507 2.656 0 50 GFAA COc1cc(CN2CCCCO2)ccc1OC[C@@H](O)CN1CCCCCC1 11953787 UVLMTSIBHBDIAR-IBGZPJMESA-N 378.513 2.838 0 50 GFAA Cc1c(C(=O)N(C)[C@@H]2CCSC2)nnn1-c1cccc(Br)c1 163454367 FBHCRMNKHHBWHG-CYBMUJFWSA-N 381.299 2.916 0 50 GFAA CC(=O)N[C@H](CC(=O)N1C[C@]2(C)CN(C)C[C@]2(C)C1)c1ccc(Cl)cc1 823754870 IBCTXPKRIKCZNH-RLLQIKCJSA-N 377.916 2.708 0 50 GFAA COc1cc(OC)c([C@H]2CC(=O)Oc3c2c(=O)[nH]c2ccccc32)cc1OC 4387089 BGLIMMMKADBZHG-CYBMUJFWSA-N 381.384 2.995 0 50 GFAA Cc1cc(-c2nc(-c3ccccc3)nn2[C@H]2CCS(=O)(=O)C2)nn1C(F)F 2100544999 NOMZCWCLBWOZSQ-ZDUSSCGKSA-N 393.419 2.872 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](N3CCN(Cc4ccccc4)CC3)C2=O)cc1 22972207 BFGBMJMTVMCUTJ-NRFANRHFSA-N 393.487 2.535 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)c2ccc(F)cc2)cc1 824147 NVOHRJRUWAWSGQ-UHFFFAOYSA-N 376.453 2.952 0 50 GFAA CCOC(=O)c1ccc(NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 1149982 CIWKQBWRHOCXOD-AWEZNQCLSA-N 390.461 2.657 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(c2ccc(F)cc2)CC1 4731984 SKECCASNAMENPB-OAHLLOKOSA-N 385.414 2.667 0 50 GFAA Cc1nc([C@H](C)NC(=O)Cn2cc(NC(=O)COc3ccccc3)cn2)cs1 12040859 PICSMTKRSIGOPE-ZDUSSCGKSA-N 399.476 2.543 0 50 GFAA O=C(Cn1nnnc1CN1CCCCCC1)N(Cc1ccccc1)CC1CCC1 12073079 CMHFSLAOQBPXJN-UHFFFAOYSA-N 396.539 2.878 0 50 GFAA CC(C)n1cc(C(=O)NCc2cccs2)c(=O)c(C(=O)NC(C)(C)C)c1 12571510 LUMPBSHYIZYGJN-UHFFFAOYSA-N 375.494 2.949 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4cnc(C)cn4)C3)C2)c1 12745683 HOSDDSJDXGUTCN-JOCHJYFZSA-N 380.492 2.922 0 50 GFAA O=C(c1cn[nH]c1)N1CC(=O)N(C2CCCCC2)C[C@@H](OCc2ccccc2)C1 14741914 CLAQXFXZZIJFOW-FQEVSTJZSA-N 396.491 2.612 0 50 GFAA Cc1cc(O)n2nc(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)nc2n1 19867799 AWPXRVXSJPVQCR-UHFFFAOYSA-N 376.298 2.798 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccccn3)n1)CCN(C(=O)NC(C)C)C2 20418700 ASBHALMPHLPURF-UHFFFAOYSA-N 378.436 2.978 0 50 GFAA C[C@H](c1ncnc(Cl)c1F)[C@](O)(Cn1cncn1)c1ccc(F)cc1F 21298447 BQDLXFABVRRDFU-JDNHERCYSA-N 383.761 2.830 0 50 GFAA in-vitro O=c1c(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)coc2ccccc12 22586808 QDQWIJOWIULVSE-UHFFFAOYSA-N 378.428 2.840 0 50 GFAA COc1cc(CN2CCN(C(=O)NC3CCCCC3)CC2)cc(OC)c1OC 57530800 FKIOBSQNOKKTKC-UHFFFAOYSA-N 391.512 2.872 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccc(C)c(C)c3)CC2)cc(-n2ccnc2)n1 67602204 XJPLNCVNXVZXQW-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CCc1noc([C@@H](C)NC(=O)c2cc(Cn3c(C)nc4ccccc43)[nH]n2)n1 67833431 SDEQHAPXEKGIJM-LLVKDONJSA-N 379.424 2.553 0 50 GFAA CC(C)[C@H]1CN(C(=O)CN2CCCCC2)CCC(=O)N1Cc1ccc(F)cc1 71765143 UHLNPFWCEKCEPC-HXUWFJFHSA-N 389.515 2.897 0 50 GFAA CCc1ccccc1CN1CCC(c2nnc(CN3CCOCC3)n2C)CC1 77287669 ZKOXZADEYWORHH-UHFFFAOYSA-N 383.540 2.589 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NS(=O)(=O)c2cn(C)cn2)cc1 91547919 SMWYTBKGOULYRK-QGZVFWFLSA-N 399.520 2.906 0 50 GFAA CCN1CCCC[C@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91694294 VSSHIAFCGUCHJE-FQEVSTJZSA-N 398.551 2.687 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)N1CCN(c3cc(C)nc(C)c3)CC1)C2 95352762 PGALPGCKNXBGKL-GOSISDBHSA-N 381.476 2.607 0 50 GFAA Cc1cc(C)nc(CNC2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)n1 95365588 XIGJKGKJFLOSHS-UHFFFAOYSA-N 381.528 2.551 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)N1CCC(OCc3cccnc3)CC1)C2 95390782 TYMFSDLPAIHBCU-SFHVURJKSA-N 382.460 2.849 0 50 GFAA O=C(c1cc[nH]n1)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1 95511591 LJGRBYZAWCVSPW-IBGZPJMESA-N 387.572 2.992 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@H]2CC[C@@H]1CN(c1cnc3ccccc3n1)C2 95520713 XEABCVYLPVQTEV-JKSUJKDBSA-N 377.448 2.862 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@H]2CCO)cc1 104502758 BBDLPJSUXWPYTQ-OAQYLSRUSA-N 386.540 2.932 0 50 GFAA C[C@@]1(C(=O)NCCN2CCc3sccc3C2)CCCN1C(=O)c1ccccc1 116734154 DBTBUOQSUFVOHD-QFIPXVFZSA-N 397.544 2.917 0 50 GFAA O=C(CN1CCC(CN2CCCCC2=O)CC1)Nc1nc2ccccc2s1 118852388 BUTLEBHZECQWOP-UHFFFAOYSA-N 386.521 2.959 0 50 GFAA CC1(C)C(=O)Nc2ccc(S(=O)(=O)N3CC[C@H](Nc4ccccc4)C3)cc21 119146803 LEPTUNGWTOIVSC-HNNXBMFYSA-N 385.489 2.791 0 50 GFAA Cc1n[nH]c(C)c1[C@H](C)C(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C 131620208 MZSUULJSIPXYCR-LBPRGKRZSA-N 392.525 2.523 0 50 GFAA Cc1c(NC(=O)[C@H]2OCCc3ccccc32)cccc1C(=O)N1CCOCC1 137915995 IYTCETGBIZQHGR-FQEVSTJZSA-N 380.444 2.720 0 50 GFAA CC[C@]1(c2ccc(NCc3ccc(-n4cncn4)cc3)cc2)CCC(=O)NC1=O 159039351 DWFIGZMDSMVBGI-JOCHJYFZSA-N 389.459 2.964 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cnccc2C(F)(F)F)C[C@H]1C(=O)O 169725742 QEGKIMMJBHXNJO-LBPRGKRZSA-N 375.347 2.611 0 50 GFAA Cc1nc(-c2c3n(c(=O)n(Cc4cccc(Cl)c4)c2=O)CCCCC3)no1 169763982 MMGMAZKMRYAOBY-UHFFFAOYSA-N 386.839 2.797 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4cccc(Cl)c4)c2=O)CCCC3)no1 169764030 MWALFRMNMNIBOX-UHFFFAOYSA-N 386.839 2.660 0 50 GFAA O=C(NCc1nc2cc(F)ccc2[nH]1)[C@@H]1CCCN(C(=O)c2ccccc2)C1 176709780 CBIYXLPRHXEEMR-OAHLLOKOSA-N 380.423 2.871 0 50 GFAA Cc1cc(=O)n(CC(=O)N2CCCC[C@@H]2c2nc3cc(F)ccc3[nH]2)nc1C 218955546 QMHIBYWGXHBBGI-QGZVFWFLSA-N 383.427 2.629 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N(C)C[C@@H]2Cc3ccccc3CN2C)c1C 222540103 JVOCSFWVWIINOS-FQEVSTJZSA-N 382.508 2.608 0 50 GFAA O=C(O)CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1CC(=O)Nc2ccccc21 238121795 LAOOGIOQZBYKGN-CQSZACIVSA-N 388.370 2.894 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3OC(=O)N(CCc4ccccn4)[C@@H]3C1)CCC2 247920959 CKQWOXCTJAIKPB-IRLDBZIGSA-N 393.487 2.827 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1C[C@H](c2ccsc2)[C@@H](CO)C1 249192006 AJSIIEFHJDYLHN-DGCLKSJQSA-N 392.424 2.559 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)NCc1nc(C2CCCCC2)no1 252485146 GNZWBOOQDXVDRU-UHFFFAOYSA-N 377.466 2.598 0 50 GFAA COC(=O)c1cn(C[C@H](c2ccco2)N2CCCCCC2)cc2c(=O)[nH]nc1-2 263587637 JKLUUPDXRMOWNE-MRXNPFEDSA-N 384.436 2.673 0 50 GFAA CS(=O)(=O)c1ccc(NCC(=O)N2CCC(Cc3ccccc3)CC2)cc1 264131224 SMWCCBCOAAJDEX-UHFFFAOYSA-N 386.517 2.983 0 50 GFAA COCCn1c(C)cc(=O)c(C(=O)NCc2cccnc2)c1CC1CCCC1 299770329 PYQBRVAETXNQNC-UHFFFAOYSA-N 383.492 2.861 0 50 GFAA Cn1cc(-c2nn(C)cc2C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cn1 363986613 OVVFRSPUCQTMEO-KRWDZBQOSA-N 381.436 2.631 0 50 GFAA CCOc1cc(C(=O)N2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)ccc1C 368997064 AAZDQWHQVNBIGK-OAHLLOKOSA-N 384.436 2.646 0 50 GFAA CNc1ncc(C(=O)N(CCO)Cc2ccc(Br)s2)s1 792526261 OVZJISDCYOYONJ-UHFFFAOYSA-N 376.301 2.644 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC(OCc2cccnc2)CC1 828182278 IVOUDICSIPATRU-UHFFFAOYSA-N 381.476 2.740 0 50 GFAA CC1(C)CCc2cc(CC(=O)NCCn3cnc4ccccc4c3=O)ccc2O1 888105536 NJNSNXSTFCSRJE-UHFFFAOYSA-N 391.471 2.859 0 50 GFAA O=C(Nc1cn[nH]c1)[C@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1 894889047 VQNATZHZRKOOGO-JTQLQIEISA-N 376.342 2.837 0 50 GFAA FC(F)(F)[C@@]1(c2nc(-c3cccnc3)no2)CCN(Cc2cnns2)C1 952893525 UKUKPPNWVYWWFD-AWEZNQCLSA-N 382.371 2.689 0 50 GFAA CCc1nc(CN2CCC[C@@H](CNC(=O)c3ccc4scnc4c3)C2)no1 1506408731 WLOWUILVWWLXHA-ZDUSSCGKSA-N 385.493 2.884 0 50 GFAA COc1ccc(-c2onc(NC[C@@H]3CC4(CCNCC4)CO3)c2C(=O)O)cc1 1704336489 WXGMVXHMXYDGSB-HNNXBMFYSA-N 387.436 2.619 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3c(O)cccc3O)CC1)OCC2 1704340697 LUHVDOKVNCCXPU-UHFFFAOYSA-N 399.443 2.819 0 50 GFAA O=C(Cn1c2ccccc2c2cc(Cl)ccc21)N1C[C@@H]2[C@@H](C1)C2(CO)CO 1772709975 TYVOUPVEIZNBRO-IAGOWNOFSA-N 384.863 2.507 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)NCc3csc(-c4ccccc4)n3)CC2=O)s1 1857700340 UHBVCSFZSCFPMQ-ZDUSSCGKSA-N 399.501 2.639 0 50 GFAA Oc1nc(C2CC2)nc2c1CC[C@@]21CCCN(c2cc(-n3cccn3)ncn2)C1 1857701784 WAGXAKGYNYQBTH-OAQYLSRUSA-N 389.463 2.520 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C3Cc4ccccc4C3)C[C@]23CC[C@H]1O3)c1ccco1 1857710125 ISVBABIHWZOLLC-DZCCDHAISA-N 378.472 2.656 0 50 GFAA CCNC(=O)c1cccc(NC(=O)COc2cnn(Cc3ccc(F)cc3)c2)c1 1875312436 CEXKTRIGTGJUEE-UHFFFAOYSA-N 396.422 2.838 0 50 GFAA CC1(C(=O)NC[C@]23CCC[C@H]2CN(c2ccc4nnnn4n2)C3)CCCCCC1 1875312545 OCPFTJAWSHOYGO-KKSFZXQISA-N 397.527 2.603 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCc3ncccc3Br)nn(C)c21 1875403926 LPEVQJWOZLXFEL-ZJUUUORDSA-N 379.258 2.530 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785919 UMHKKRIXBHYTFR-MJXNMMHHSA-N 386.883 2.906 0 50 GFAA Cn1ccnc1[C@@H]1CNCCN1CCNC(=O)c1cccc2cc(Cl)ccc12 2325786492 QCXQMSBBSNDGDL-IBGZPJMESA-N 397.910 2.603 0 50 GFAA Brc1ccc2cc(CNCCN3CCn4nccc4C3)oc2c1 2325856107 BDWQIMLALRMJPV-UHFFFAOYSA-N 375.270 2.997 0 50 GFAA CCc1cccc2c(C(=O)COC(=O)c3cc(-c4cnn(C)c4)[nH]n3)c[nH]c12 2325874621 URDBBTYBLJQUSS-UHFFFAOYSA-N 377.404 2.894 0 50 GFAA O=C(c1cccc(-c2cnc3c(N4CCOCC4)nccn23)c1)N1CCCCC1 2356159282 UEKUXZAIVCDCIW-UHFFFAOYSA-N 391.475 2.859 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356169469 CBOWSIYPHCZONA-WHSLLNHNSA-N 392.446 2.866 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCc2nc(-c3ccccc3)nn2CC1 2356134067 WJZNKEWIZXXEPR-UHFFFAOYSA-N 389.459 2.623 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3C)CC2)cc1OC 6699084 PFPATBFBFVPISK-UHFFFAOYSA-N 376.478 2.523 0 50 GFAA CCCN1C(=O)[C@@H](Cc2nc3ccccc3c(=O)n2CCCO)c2ccccc21 6755188 FJPNDICDILVVGJ-SFHVURJKSA-N 391.471 2.862 0 50 GFAA CCCc1ccc(CN2CCn3nc(CN4[C@H]5CC[C@@H]4C[C@H](O)C5)cc3C2)o1 102659855 VRHBEMWKRCIEIJ-RUYXUALKSA-N 384.524 2.932 0 50 GFAA CCN1CCN(C2(C(=O)N[C@H]3CCc4ccccc43)Cc3ccccc3C2)CC1 23359130 TTXDVGPKARZYGP-QHCPKHFHSA-N 389.543 2.965 0 50 GFAA COCc1ccc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)o1 72165055 PIPPSIJWTMAGNY-CEWLAPEOSA-N 382.460 2.834 0 50 GFAA CCc1ncc(CN2CCCn3nc(C(=O)Nc4ccccc4)cc3C2)cn1 65417827 GVPLTQPYRZVUTC-UHFFFAOYSA-N 376.464 2.894 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)cc1C 67613163 NOVXLWQKFDPYGJ-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cn1cc([C@H]2CCN(C(=O)Nc3cc(Cl)ccc3N3CCOCC3)C2)cn1 172143358 QSVNUADWWPOOOU-AWEZNQCLSA-N 389.887 2.932 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cnn(Cc3ccc(F)cc3Cl)c2)cn1 2804555 DOPIDIHUTSLCDQ-UHFFFAOYSA-N 383.836 2.741 0 50 GFAA COc1ccc(NC(=O)[C@H]2Cc3ccccc3CN2)cc1N1CCCCC1=O 153803199 KIQNQRMRPRSTBJ-GOSISDBHSA-N 379.460 2.865 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)c3ccnc(OC)c3)CC2)OC1=O 77459715 OTSZIPVQWFJRFR-UHFFFAOYSA-N 375.469 2.953 0 50 GFAA Cc1cc(OCC(=O)O)ccc1NC(=O)[C@@H](NC(=O)Cc1ccccc1)C(C)C 262943297 HYRKGJJQTYMURV-NRFANRHFSA-N 398.459 2.780 0 50 GFAA Cc1cccc(NC2CCN(C(=O)c3cc(N4CCOCC4)ccn3)CC2)c1 131242118 HCLQLZBDLSJWNF-UHFFFAOYSA-N 380.492 2.943 0 50 GFAA Cc1oc(-c2ccsc2)nc1CC(=O)N(CCC(=O)O)C[C@H]1CCCO1 237668978 DODWYUJHUUPROX-CQSZACIVSA-N 378.450 2.736 0 50 GFAA O=C(c1ccc(-c2ccccc2)cc1)[C@H]1CCCN(Cc2c[nH]c(=O)[nH]c2=O)C1 71439951 ILEOKZYYGBHKGP-IBGZPJMESA-N 389.455 2.825 0 50 GFAA CN(CC1(N2CCCCC2)CCCCC1)C(=O)[C@@H]1Cc2ccccc2C(=O)N1 72425263 WXLSMJBVRLUPHB-FQEVSTJZSA-N 383.536 2.988 0 50 GFAA NC(=O)c1cccnc1N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 72154371 OXVDLPZNXFEYNM-OAQYLSRUSA-N 386.446 2.951 0 50 GFAA Cc1ccc2[nH]c(=O)cc(C(=O)N[C@@H]3CC(=O)N(CC4CCCCC4)C3)c2c1 72131822 DNDKHPRCBWNKBV-MRXNPFEDSA-N 381.476 2.748 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1cccs1 238185892 SQDMSXZWHCWHDY-LLVKDONJSA-N 380.857 2.738 0 50 GFAA Cc1c(C(=O)O)cnn1C1CCN(C(=O)c2ccn(-c3ccc(F)cc3)n2)CC1 263210238 OVSBCWAXKGYEET-UHFFFAOYSA-N 397.410 2.692 0 50 GFAA NS(=O)(=O)c1ccc2c(c1)N(Cc1cc(Cl)c3c(c1)OCCO3)CCC2 174681234 GMMZHFNCLQIAIE-UHFFFAOYSA-N 394.880 2.711 0 50 GFAA Cc1cc(C)n(Cc2ccc(N3CCC(CO)(CN4CCCC4)CC3)nc2)n1 220328931 NBYZORRIPCDYDX-UHFFFAOYSA-N 383.540 2.618 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@H]4CCCNC4)csc3C2)nc1 426373547 AAESTIMHCJBDPT-KRWDZBQOSA-N 398.576 2.993 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)N[C@@H]2CC(=O)Nc3ccccc32)CC1 426701694 UJGREKQDLYACEC-GOSISDBHSA-N 379.464 2.695 0 50 GFAA Cc1ccc(CN(CCO)C(=O)NCC2(N3CCOCC3)CCCCC2)s1 426478052 RSAVZCNKFYPFAM-UHFFFAOYSA-N 395.569 2.596 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1cccc(F)c1)C1(N2CCCC2)CCCC1 223882006 HKSCTZRAQQNIJU-RTBURBONSA-N 376.472 2.887 0 50 GFAA C[C@@H](NC(=O)NC1(CN2CCCC2)CCCCC1)[C@@H](O)c1ccc(O)cc1 426719776 BVGZUENHHSBGJH-VQIMIIECSA-N 375.513 2.912 0 50 GFAA Cc1cc(C(=O)N2CCC(CCC(=O)NCc3cccnc3)CC2)c(C)n1C 95520744 WOYJVMXYJGIYFL-UHFFFAOYSA-N 382.508 2.986 0 50 GFAA C[C@@H]1CN(C(=O)c2cc(-c3ccsc3)n[nH]2)CC[C@@]1(O)C1CCOCC1 91435080 IHTFTNNCCPCGPM-YJYMSZOUSA-N 375.494 2.778 0 50 GFAA O=C(CN1CCCC1)N1CCC2(CC1)CC(=O)N(C/C=C/c1ccccc1)C2 95376837 UICTWWMTQGCRQW-RMKNXTFCSA-N 381.520 2.637 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CC[C@H](Cc3ccc(CO)cc3)C2)CC1 91391313 HYJSCTPILZBYAM-HXUWFJFHSA-N 379.504 2.743 0 50 GFAA O=C(NCc1ccc(F)cc1)C1CCN(C(=O)c2noc3c2CCCC3)CC1 299053623 MEHFJACMQBDKPZ-UHFFFAOYSA-N 385.439 2.861 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@H]1CCCN(c2ncccn2)C1)c1nnc2ccccn12 252478261 AHCWPALHGZFMDU-DLBZAZTESA-N 393.495 2.639 0 50 GFAA CCCO[C@@H]1CCCN(C(=O)NC2CCN(Cc3cccc(O)c3)CC2)C1 534579767 DYIWZKDDZBRURT-HXUWFJFHSA-N 375.513 2.957 0 50 GFAA CN(C[C@@H]1Cc2ccccc2O1)C(=O)c1ccc2nnc(-c3cccn3C)n2c1 1940196650 XXQMHVJZHMVXLC-KRWDZBQOSA-N 387.443 2.811 0 50 GFAA Cc1nnc(N2CCn3nc(CNC(=O)C4CCC4)cc3C2)c2ccccc12 299757543 JHMIYDCHGYKUBS-UHFFFAOYSA-N 376.464 2.571 0 50 GFAA Cc1cccc(C)c1OC[C@H](C)NC(=O)N1CCC[C@H](CS(C)(=O)=O)C1 299153824 QXJHATPUAVURBD-IRXDYDNUSA-N 382.526 2.537 0 50 GFAA Cc1cc2nc(CN(C)C(=O)N[C@H]3CCCN(C(=O)C(C)C)C3)[nH]c2cc1C 584894977 UCYSBQZIBQVDSK-INIZCTEOSA-N 385.512 2.968 0 50 GFAA Cc1cc(NC(=O)NC[C@@H]2CN(C)C(=O)O2)n(-c2cccc(C(F)(F)F)c2)n1 1875268606 XIQZFSNQUQPGRA-CYBMUJFWSA-N 397.357 2.772 0 50 GFAA Cc1ccccc1NCCC(=O)N1C[C@H]2C[C@H]1[C@@H]2c1ocnc1C(=O)N(C)C 1875394571 NNXLWDVWEYLVQK-UWWQBHOKSA-N 382.464 2.501 0 50 GFAA CCn1ccc(C(=O)N2CC[C@@](C)(NC(=O)c3cccc(N4CCCC4)c3)C2)n1 1875310135 GARHFPXRTWQONR-JOCHJYFZSA-N 395.507 2.538 0 50 GFAA C[C@H](C(=O)NCC1(O)C2CC3CC(C2)CC1C3)c1nnc(O)c2ccccc12 952987564 KAPFMXQUMXEQSI-LFBDXYOISA-N 381.476 2.742 0 50 GFAA O=C(C[C@H]1CCNC[C@@H]1F)Nc1nccn1Cc1ccc(Br)cc1 888101818 PFDBIXJKERLJDM-HIFRSBDPSA-N 395.276 2.970 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3ccc([C@@H](C)CC(N)=O)cc3)cn2)C[C@@H](C)O1 888928583 WPQLPQHVXBVUPC-HRCADAONSA-N 396.491 2.926 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)CC1 186653434 HOWFKHRARQQKFK-GFCCVEGCSA-N 387.249 2.599 0 50 GFAA C[C@H](O)c1ccc(CNC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 186707323 KUTYCBUVYIBGPK-FDDCHVKYSA-N 397.519 2.518 0 50 GFAA O=C(CNC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)Nc1cccnc1 170622979 FBBZQSGEDMZYEH-UHFFFAOYSA-N 391.309 2.519 0 50 GFAA CCN(C(=O)CN1CCO[C@H](c2cnn(CC)c2)C1)c1nc2ccccc2s1 190829219 LESKZLRBAJDVCY-KRWDZBQOSA-N 399.520 2.939 0 50 GFAA O=C(N[C@H]1COC[C@H]1Cc1ccnc2ccccc12)c1cnc(C2CC2)nc1O 1704299364 OPHKXEULRHUJNZ-BEFAXECRSA-N 390.443 2.595 0 50 GFAA Nc1ncc2c(n1)[C@]1(CCCN(Cc3cc(O)c4cccc(F)c4n3)C1)CC2 1704297791 XDYLXORUFHNPHZ-OAQYLSRUSA-N 379.439 2.932 0 50 GFAA COc1ccc(Br)cc1S(=O)(=O)n1nnc2cc(C)ccc21 1775967706 ZKAVUTPYNXXDKC-UHFFFAOYSA-N 382.239 2.748 0 50 GFAA COCCn1nc(-c2ccc(F)c(F)c2)nc1[C@@H]1CCCN(CC(=O)O)CC1 1772814802 BUMJGPKFSBTJFP-CYBMUJFWSA-N 394.422 2.524 0 50 GFAA O=C(NCCc1ccccn1)[C@H]1CC12CCN(Cc1ccc3c(c1)CCO3)CC2 12159772 PMGHVOXPERFDNE-OAQYLSRUSA-N 391.515 2.978 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](N(C)Cc1ccco1)C2 14753064 XXOPKBHXJLQAKS-HNNXBMFYSA-N 388.537 2.674 0 50 GFAA Cc1nnc(NC(=O)c2ccc([C@@H]3CCCN3CCCn3cccn3)s2)[nH]1 19866619 HFLACYKLOVKHRR-AWEZNQCLSA-N 385.497 2.851 0 50 GFAA COC(=O)C1[C@@H](c2ccccc2)C(C(=O)N2CCN(C)CC2)[C@@H]1c1ccccc1 19893300 HZUPVYCEFDDLAF-PHZLKFDYSA-N 392.499 2.747 0 50 GFAA O=C(CCn1ccn2nc3c(c2c1=O)CCCC3)NCc1ccc(Cl)cc1 169760135 ZYOANJGHKHCXHK-UHFFFAOYSA-N 384.867 2.735 0 50 GFAA COc1ccc(N2CCN(S(=O)(=O)Cc3ccc(Cl)cc3F)CC2)cn1 1857681610 GZKYPSNLXHWPGE-UHFFFAOYSA-N 399.875 2.535 0 50 GFAA O=C(CCc1ccccc1Cl)N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@@H]1CCOC1)C2 1857702569 OESFBXSBWFJEHL-YZLZLFLDSA-N 390.911 2.662 0 50 GFAA COc1ccc(C(=O)N2C[C@H](c3ccc(C)cc3)[C@@H](NC(=O)C3CC3)C2)cc1O 220135105 GZEBMSWZAGLBSE-MOPGFXCFSA-N 394.471 2.844 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)COc2ccc(F)cc2Cl)CC1 378313016 JDBVYHOWEUUHTH-UHFFFAOYSA-N 382.823 2.581 0 50 GFAA COc1ccccc1CC(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 1704299093 NOZUGKYBICTTBW-QFIPXVFZSA-N 380.492 2.600 0 50 GFAA O=C1CCOC2(CCN(Cc3ccccn3)CC2)CN1CCOc1ccccc1 1704325057 GWUWJVVONQFXTN-UHFFFAOYSA-N 395.503 2.744 0 50 GFAA O=C(O)[C@H](CNC(=O)[C@H]1CCc2nc[nH]c2C1)Cc1cccc2ccccc12 909269396 ZSUKNEMCKNFVCW-IRXDYDNUSA-N 377.444 2.728 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CC[C@@]2(C[C@@H](O)c3ccccc3O2)C1 818410067 XZYGRDZQYNIXAO-ZDWFVDTJSA-N 392.455 2.527 0 50 GFAA CC(C)(C)c1noc(-c2ccccc2C(=O)N2CCN[C@H](c3cn[nH]c3)C2)n1 828184117 FSQWMXVUHVRLLB-INIZCTEOSA-N 380.452 2.544 0 50 GFAA C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 854666813 GXKKHBXJEPAKSW-JSOTWZDUSA-N 386.492 2.703 0 50 GFAA C[C@@H](NC(=O)N1CC(O)(c2cccc(Br)c2)C1)c1cncc(F)c1 856883811 ODEJQYBBTVMJRT-LLVKDONJSA-N 394.244 2.957 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)c1ccccc1OCC(=O)N1CCOCC1 4782799 JHINYVSLZVIKGN-UHFFFAOYSA-N 398.503 2.623 0 50 GFAA CN1CCC(N(Cc2ccccc2F)C(=O)[C@H]2CC(=O)Nc3ncccc32)CC1 2325771249 NESQKHSJFOFKFS-SFHVURJKSA-N 396.466 2.770 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)cc1Cl 622199 XPOFNNOBKZEKFF-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA COc1ccc(N(CC(=O)Nc2cc(C)cc(C)c2)S(C)(=O)=O)cc1OC 797651 DDCOJHOSQAJWML-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(OC)cc2OC)cc1 862583 DTCPWQYFLARWMP-LJQANCHMSA-N 397.431 2.979 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 2356143033 RMQNCIVSYJSNGG-OAQYLSRUSA-N 375.432 2.664 0 50 GFAA CCc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4OC)CC3)C2=O)cc1 4331656 MZUDWGHGMSUUKE-HXUWFJFHSA-N 393.487 2.712 0 50 GFAA CCCCCOc1ccc(C(=O)NCCC(=O)NCCCC(=O)OCC)cc1 4764722 AEMKNBBUHHYCPF-UHFFFAOYSA-N 392.496 2.835 0 50 GFAA CCOc1ccc(-c2noc(CCC(=O)NCc3cccnc3)n2)cc1OC 4857288 NRYFBNCZCJUSKV-UHFFFAOYSA-N 382.420 2.788 0 50 GFAA CN(C)CCN1C[C@@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)CC1=O 173751821 LXKKDMIBLSSOPD-INIZCTEOSA-N 391.475 2.579 0 50 GFAA Cc1cc(C)nc(-n2cc(C(=O)N3c4ccccc4C[C@H]3CN)c(C(C)C)n2)n1 422626505 KFULHNOYIKIIGY-KRWDZBQOSA-N 390.491 2.933 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1CCc2nc(NS(C)(=O)=O)sc2C1 331891273 OGEZVIOYYPXWJN-UHFFFAOYSA-N 383.495 2.738 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(Cc3csc(C4CCCC4)n3)C2=O)nn1 328611644 MFAOQAFWMIOAPE-OAHLLOKOSA-N 388.497 2.841 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccccc4F)CC3)nc(C)n2)n1 35597275 LCXHFJKFEWEQDP-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA COC(=O)C1CCC2(CC1)NC(=O)N(c1cc(-c3ccccc3)ns1)C2=O 253430131 JOIXKRRNGBCDJF-UHFFFAOYSA-N 385.445 2.968 0 50 GFAA O=C(N[C@H]1CCc2[nH]ncc2C1)N(CCO)Cc1ccc(Cl)c(Cl)c1 153366856 QKBCOTNISOGMJW-ZDUSSCGKSA-N 383.279 2.778 0 50 GFAA CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 154285488 UAEUWDAPLZJGIW-OTWHNJEPSA-N 385.508 2.925 0 50 GFAA CCc1noc2ncc(C(=O)N[C@H]3CCN(c4ccc(Cl)cc4)C3=O)cc12 154584448 OWZOKCLZIIGDTN-INIZCTEOSA-N 384.823 2.974 0 50 GFAA COc1cccc(CN2CCCN(C3CCCC3)CC2)c1O[C@@H](C)C(=O)O 77407453 ZKBIMVQFRXQGLI-INIZCTEOSA-N 376.497 2.997 0 50 GFAA CN1C(=O)[C@](CC(=O)NCC2(CO)CCC2)(Cc2ccccc2)c2ccccc21 71753232 UPPVCFSTYRUISF-DEOSSOPVSA-N 392.499 2.812 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC(=O)c3cnn(C4CCOCC4)c3C)cn2)n1 159200812 QSUGKUFLBYYMBB-UHFFFAOYSA-N 394.479 2.671 0 50 GFAA C[C@@H]1CN(Cc2c(Cl)cccc2N2CCCC2)C[C@H]1C(=O)N1CCOCC1 495787110 CPJAJOBGDMRWFU-IAGOWNOFSA-N 391.943 2.867 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@@H]3CCOc4ccc(F)cc43)CC2)n1 174815098 RPIQKIDHPZSPSX-CQSZACIVSA-N 391.472 2.595 0 50 GFAA CC(C)[C@H](CNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1)Cc1ccccc1 240407385 FLWJJAQKJOWVJK-KRWDZBQOSA-N 395.546 2.883 0 50 GFAA O=C(O)c1cc(-c2ccccc2F)cc(S(=O)(=O)NC[C@@H]2CCCO2)c1 71749387 NOPMCMMNBITNNZ-AWEZNQCLSA-N 379.409 2.648 0 50 GFAA COc1ccc2c(c1F)CC[C@@H]2NC1CCN(S(=O)(=O)CC(C)C)CC1 290196464 GIPHJTYNIOEWSD-KRWDZBQOSA-N 384.517 2.861 0 50 GFAA COc1cccc(CCNC(=O)N(Cc2cccnc2)C2CCN(C)CC2)c1 426409315 LRBBNIZSPAWBJX-UHFFFAOYSA-N 382.508 2.939 0 50 GFAA NC(=O)c1cncc(N2CC[C@@]3(CCCN(CCCc4ccccc4)C3)C2)n1 426571674 VJLUCVGTBBBESJ-JOCHJYFZSA-N 379.508 2.501 0 50 GFAA Cc1ccc(N2C[C@H](C)N(C(=O)c3ccccc3-c3nc[nH]n3)CC2=O)cc1 82106527 ARMCOSUHNITSLN-HNNXBMFYSA-N 375.432 2.658 0 50 GFAA CC(C)(C)c1ccc(OC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)cc1 239173608 OHACCAFHDGWNAZ-BUJXUYPKSA-N 379.456 2.943 0 50 GFAA O=C1C[C@H](c2nc(Cc3cccc(Cl)c3)nn2CCO)C2(CCCC2)O1 96164737 ZWKLANCJXKWRAN-OAHLLOKOSA-N 375.856 2.858 0 50 GFAA CCn1nccc1C(=O)N1CCCC[C@H]1C(=O)Nc1ccc(-n2cccn2)cc1 95505414 IWLJQJUJSKSDDG-SFHVURJKSA-N 392.463 2.722 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)NCc1cnc(-c2ccccc2)s1 91966126 KNRAZZZJFHNXJP-UHFFFAOYSA-N 376.441 2.836 0 50 GFAA CC(C)[C@@H](NC(=O)Cn1cnc2sccc2c1=O)c1nc2ccccc2n1C 252489950 KFWZYLKSELANSN-QGZVFWFLSA-N 395.488 2.858 0 50 GFAA CCN(C(=O)c1cccc(-c2cnn3ccccc23)c1)[C@H]1CCS(=O)(=O)C1 534646461 ZBZXWVJBIGDQSX-KRWDZBQOSA-N 383.473 2.651 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263615387 CCTLPPSQOPLORT-LJQANCHMSA-N 380.444 2.517 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1C(=O)NCCc1nnc(-c2ccccc2)n1C 1447524181 MKXPVTHTWUXMLQ-UHFFFAOYSA-N 378.358 2.505 0 50 GFAA Cc1cnn(C[C@@H]2CN(C(=O)Nc3nc(C)c(C(F)(F)F)s3)CCO2)c1 952845204 JCLYFJJVGSUJIM-NSHDSACASA-N 389.403 2.908 0 50 GFAA Cc1ccc(CC(=O)N(CC(=O)O)Cc2cccc(Br)c2)cn1 1875327688 GNOXYQMENYWCBD-UHFFFAOYSA-N 377.238 2.808 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H]2CC3(CCN(C)CC3)Oc3ccccc32)CC1 1875371657 INSWHETZACZBOW-IBGZPJMESA-N 397.519 2.515 0 50 GFAA Cc1ncc(C(F)(F)F)cc1C(=O)N=[S@@]1(=O)CCC[C@]2(CCCN2)C1 1875393385 MAEFTDUCWAJMET-SGANQWHYSA-N 375.416 2.933 0 50 GFAA N=[S@@]1(=O)CCC[C@]2(CCCN2C(=O)c2ccnn2CCC(F)(F)F)C1 1875395612 GWHLALSZTAOAJX-DLUDVSRJSA-N 378.420 2.651 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCCOc3ncccc3C(F)(F)F)nn(C)c21 1875403237 SRUADIIWUIMYHE-MNOVXSKESA-N 398.385 2.665 0 50 GFAA CC(C)CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc3ccccn3c2=O)C1 43641402 IRLZDFOZZMAWSU-HKUYNNGSSA-N 382.508 2.667 0 50 GFAA CO[C@@H]1CCN(c2nnc(-c3n[nH]c4c3CCCC4)n2Cc2cccs2)C1 1331055311 ZQADQZIYURZIQO-CYBMUJFWSA-N 384.509 2.882 0 50 GFAA O=C(c1ccc(CO)cc1)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565529359 WWVWMUNILZNNHS-GCJKJVERSA-N 376.500 2.883 0 50 GFAA CC(C)n1ncc2c1C[C@H](NC(=O)C[C@H]1CN(Cc3ccccc3)CCO1)CC2 170681770 RPFOQQWSAGILFI-RTWAWAEBSA-N 396.535 2.729 0 50 GFAA CO[C@@]1(C)CCCN(C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)CC1 280460555 AKJMUSJVECPQHX-IBGZPJMESA-N 395.525 2.859 0 50 GFAA CN(CC1(O)CCOCC1)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21 188105770 WRCKXJPXZAEZHU-MRXNPFEDSA-N 384.423 2.848 0 50 GFAA N[C@H](CNS(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C1CC1 193315335 RXPSLRNJCAQYAH-SNVBAGLBSA-N 388.114 2.772 0 50 GFAA CC(C)[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2c[nH]c3cccc(F)c23)CC1 195198929 PRTGUDUIDFSFSV-ZDUSSCGKSA-N 395.500 2.868 0 50 GFAA COc1ccccc1-c1ncc(CN2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)s1 1529153233 AEZVBEQEWPPADF-RDTXWAMCSA-N 384.505 2.886 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)CC(F)(F)F)CC1 11844416 APHXMARTBQKJNF-OAHLLOKOSA-N 377.451 2.558 0 50 GFAA CCOc1ccccc1NC(=O)c1cccc(N2C(=O)[C@@H](C)CS2(=O)=O)c1 12003945 LHUCPTKNZZOPBE-ZDUSSCGKSA-N 388.445 2.650 0 50 GFAA CSc1ccccc1C(=O)N1CCC[C@@H](CCC(=O)N2CCOCC2)C1 12713846 YQEOMLZJEDBYPZ-INIZCTEOSA-N 376.522 2.900 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(Cc1ccc(O)cc1)CC2 14535577 GVDZTWMTOPMTKO-UHFFFAOYSA-N 394.475 2.606 0 50 GFAA COCCn1nc(C)nc1C[C@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857682515 RIEWOJXNWYQBQI-OAHLLOKOSA-N 385.468 2.842 0 50 GFAA COCC(=O)NC[C@H]1[C@H]2CN(C3CC(C)(C)CC(C)(C)C3)C[C@]23CC[C@H]1O3 1857717531 XMRNVWJYCBAVNL-KCXPTXFHSA-N 378.557 2.833 0 50 GFAA N[C@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@@H]1CCCN(c3nc4cc(Cl)ccc4o3)C1)C2 1857727284 PADDOYIGRSOVFX-KYZVSKTDSA-N 388.899 2.893 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)nn1C 1857729715 ITVYQZIGNWAQLR-OAQYLSRUSA-N 383.496 2.642 0 50 GFAA COCCCN1CC2(CCN(c3ccnc4ccccc34)CC2)OCCC1=O 1857738063 PZYOSYCDFMKJTK-UHFFFAOYSA-N 383.492 2.859 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCCc3c[nH]c4ccccc34)cn12 1875243724 UOSBYHBKYKJMTQ-LJQANCHMSA-N 377.448 2.873 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCN4CCCC4)C3)nc2c1 1875246110 YYPKYHPWHIHADN-MRXNPFEDSA-N 386.496 2.655 0 50 GFAA CC(C)c1nnc([C@@H]2CN(S(=O)(=O)C[C@@H](C)c3ccccc3)CCO2)o1 328626326 LOFROOKBNOLEMB-ZBFHGGJFSA-N 379.482 2.700 0 50 GFAA O=C(NCc1csc(-c2ccccc2)n1)[C@H]1CC(=O)N(c2nccs2)C1 362850031 FZGVGTYSLGWFLP-ZDUSSCGKSA-N 384.486 2.936 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N(Cc2ccccc2)C[C@H](O)c2ccccc2)C1 806972700 HMCQDHMZXRYDMW-SFTDATJTSA-N 395.503 2.943 0 50 GFAA N[C@H]1CC[C@H](c2nc(C3CCOCC3)nn2-c2ccc3c(c2)OCCO3)CC1 2100483373 OVVXSSUZHKVOAO-WKILWMFISA-N 384.480 2.917 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)c1ccc3nnc(-c4cccn4C)n3c1)C2 2100541265 YJICAWMBCWUYQE-UHFFFAOYSA-N 387.443 2.942 0 50 GFAA FC(F)(F)CN1CCN(c2ccc(NCc3cc4n(n3)CCOC4)cc2)CC1 2325784151 DJCMGEKEYCYICE-UHFFFAOYSA-N 395.429 2.710 0 50 GFAA CCc1ncnc(N[C@]2(C)CCN(C(=O)c3cn(C)nc3-c3ccco3)C2)c1F 2325793614 ANGCZMCVOVNSOB-HXUWFJFHSA-N 398.442 2.888 0 50 GFAA CN1CC2(CCN(S(=O)(=O)c3c(Cl)cc(F)cc3Cl)CC2)OC1=O 2325818081 YWKLRKQRKLIILC-UHFFFAOYSA-N 397.255 2.738 0 50 GFAA Cn1c([C@@H]2NC(=O)c3ccccc32)nnc1N1C[C@@H](F)[C@@H](Cc2ccccc2)C1 2325885892 DSMDVEKXMLBOKD-KFKAGJAMSA-N 391.450 2.665 0 50 GFAA COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 621853 IAKHMKGGTNLKSZ-INIZCTEOSA-N 399.443 2.872 0 50 GFAA biogenic,fda CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(O)c(OC)c1 626885 SDMZMDLTNSKXGE-UHFFFAOYSA-N 375.421 2.762 0 50 GFAA COc1cccc(NC(=S)NC(=O)c2cc(OC)c(OC)c(OC)c2)c1 881772 LFNWSIALMFOBJM-UHFFFAOYSA-N 376.434 2.848 0 50 GFAA COc1ccc(NC(=S)NC(=O)c2cncc(Br)c2)c(OC)c1 977586 LJVVPSDJQQKVBU-UHFFFAOYSA-N 396.266 2.988 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)NCCOc2ccccc2Cl)cc1 2190685 DKAQVPZRQCCPFB-UHFFFAOYSA-N 394.880 2.824 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccc(C)cc3)[C@@H](C)C2)cc1OC 6714330 MJGCELOFYUWBNL-INIZCTEOSA-N 390.505 2.912 0 50 GFAA O=C(CN1CCC(O)CC1)N1CC[C@]2(CCCN(CCC3CCCCC3)C2)C1 11814907 RHUSMQWKELXDFP-QHCPKHFHSA-N 391.600 2.728 0 50 GFAA O=S(=O)(NC[C@@H]1CCCN(Cc2ccccn2)C1)c1cccc2cccnc12 12304188 ZHPWSPWRDGJAJW-KRWDZBQOSA-N 396.516 2.820 0 50 GFAA COc1cccc(-c2c3c(=O)n(Cc4ccncc4)ccc3nc3ncnn23)c1 40398271 LEHPRGIIPGQWFK-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)NCc2cccc(F)c2)n1 44890154 DKWDABOCJRZIGH-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl)NC1CCCCC1 55368646 XMORVUMWTQKZEZ-QGZVFWFLSA-N 381.879 2.619 0 50 GFAA Cc1cccc(CN2CCN(C(=O)NCc3cn4c(C)cccc4n3)CC2)c1 69479172 NWPUHEZGQFCPSM-UHFFFAOYSA-N 377.492 2.979 0 50 GFAA O=C(c1c[nH]c(=O)[nH]1)N1CCc2[nH]nc(C(c3ccccc3)c3ccccc3)c2C1 71551947 VWKPFBUZTJWONW-UHFFFAOYSA-N 399.454 2.805 0 50 GFAA CC(C)N(Cc1ccc(F)cc1)C(=O)C[C@H]1C(=O)NCCN1Cc1ccoc1 72125620 BSYFXBUCVVIAPD-IBGZPJMESA-N 387.455 2.546 0 50 GFAA O=C(CCCc1cn[nH]c1)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72168553 BOEWEZLAQGTRQV-LJQANCHMSA-N 376.460 2.803 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CCN(C)C(C)(C)C2)nc2cccnc21 77485535 YBMLEUMJAPZXDE-MRXNPFEDSA-N 387.528 2.514 0 50 GFAA Cc1cnccc1N1CCCN([C@@H]2c3ccccc3C3(CCNCC3)[C@H]2O)CC1 82039465 JFAQDVMOBQJYPD-PKTZIBPZSA-N 392.547 2.639 0 50 GFAA Cc1nc2cc(C(=O)N3CCC4(CC3)c3nc[nH]c3CCN4C)ccc2s1 91519187 ACMNUYPDJIXCQG-UHFFFAOYSA-N 381.505 2.947 0 50 GFAA CCc1nccn1CCN1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 95496889 WNRVJBYCDYXKMN-UHFFFAOYSA-N 395.551 2.788 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)c2c[nH]c3ccc(F)cc3c2=O)C1 95511709 FJQFILMQULNGFH-AWEZNQCLSA-N 398.438 2.530 0 50 GFAA Cc1ccn2cc(CN3C[C@@H]4CC[C@H](C3)N(Cc3cscn3)C4=O)nc2c1 95521851 ZLLSTFYEAURRHW-MAUKXSAKSA-N 381.505 2.722 0 50 GFAA Cc1ccc(CN2CCC(CN(C)C(=O)Cn3nc4ccccc4n3)CC2)o1 95529955 NKMBPSNJHHNKRH-UHFFFAOYSA-N 381.480 2.703 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCC(c4nccn4CC(N)=O)CC3)cc2)o1 96140612 ALXPIMWLMISNAA-UHFFFAOYSA-N 392.459 2.957 0 50 GFAA Cc1ccc2cc(C(=O)N(Cc3ccncc3)C[C@@H]3CCC(=O)N3)n(C)c2c1 97324036 HBOQGRUZAUBOJW-SFHVURJKSA-N 376.460 2.803 0 50 GFAA Cc1nc(CN2CCCN(C(=O)NC3CC(C)(C)NC(C)(C)C3)CC2)cs1 116416164 DRZXILVXAJXHHF-UHFFFAOYSA-N 393.601 2.978 0 50 GFAA C[C@H](Oc1ccc(F)c(F)c1)C(=O)N(C)C[C@H]1CCCN1c1cccnn1 118742947 HIXFTTBDRPNGFS-UONOGXRCSA-N 376.407 2.650 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cc(C(C)(C)C)n[nH]2)cc1 119704538 MBKACEURBXIWAB-UHFFFAOYSA-N 378.498 2.990 0 50 GFAA O=C(C[C@@H]1CCCN1C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1 124153595 RYYPHLUEWXDKJY-INIZCTEOSA-N 376.412 2.547 0 50 GFAA CCn1cc(CN2CCCN(c3ccnc(Cc4ccccc4)n3)CC2)cn1 166456499 IUGBAQOYOUJMMN-UHFFFAOYSA-N 376.508 2.996 0 50 GFAA CN(Cc1cccc(Cl)c1)C(=O)[C@H]1Cc2ccccc2CN1S(C)(=O)=O 169913149 VOPBJROREAJGIT-GOSISDBHSA-N 392.908 2.685 0 50 GFAA COc1ccc(CNS(=O)(=O)c2ccc(Br)c(OC)c2)cc1 170623921 HAGLORKFHSJRMT-UHFFFAOYSA-N 386.267 2.945 0 50 GFAA Cc1oc(C)c(C(=O)NCCn2c(S)nnc2C2CC2)c1Br 170636093 WPIBDOVEPPWCNO-UHFFFAOYSA-N 385.287 2.847 0 50 GFAA CCCC(=O)N1CCC[C@H](C(=O)NC2(c3ccc(F)cc3)CCOCC2)C1 170950542 VLMGORXKEDOKNX-INIZCTEOSA-N 376.472 2.986 0 50 GFAA CC[C@@H]1CN(CC(=O)NC2CCN(C(=O)c3ccco3)CC2)c2ccccc2O1 173611886 BPUKNKQFUJRZMF-QGZVFWFLSA-N 397.475 2.678 0 50 GFAA Cn1cnc(-c2cccc(NC(=O)NCC3(N4CCOCC4)CCCCC3)c2)n1 181828389 RGHGFGOHDKODSO-UHFFFAOYSA-N 398.511 2.639 0 50 GFAA C[C@@H](Oc1ccc(F)cc1Br)C(=O)NC1(c2nnc[nH]2)CCC1 188759304 XUDUXCYMJYRZPX-SECBINFHSA-N 383.221 2.669 0 50 GFAA CCc1nc(C2CCN(C[C@H](O)COc3cc(C)ccc3Cl)CC2)n[nH]1 190658886 CAVPOXFJTKUOED-HNNXBMFYSA-N 378.904 2.948 0 50 GFAA CCCc1nc(C(=O)NC2(c3nnc[nH]3)CCC2)nn1-c1ccccc1Cl 194290486 XABARIGSUZGZTF-UHFFFAOYSA-N 385.859 2.801 0 50 GFAA Cc1nccn1CCCN(C)C(=O)[C@@H]1Cc2cc(Br)ccc2O1 194506817 BQZPVLCJGNJVLX-INIZCTEOSA-N 378.270 2.806 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)CCc3cccnc3)C[C@@H]2NC(=O)C2CC2)cc1 222489056 AKQOBVQWZNKUGM-RTWAWAEBSA-N 377.488 2.843 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@@H](c3cc(OC)cc(OC)c3)C2)cc1 225498075 ZQUFNENEXXKCAW-LJQANCHMSA-N 390.461 2.823 0 50 GFAA COc1ccc(C(=O)N[C@@H](CO)Cc2ccccc2)cc1-n1nc(C)cc1C 230215326 MWKWXSKCNOMRSL-LJQANCHMSA-N 379.460 2.831 0 50 GFAA CCC[C@@H](NC(=O)c1ccc(C(=O)O)cc1)C(=O)N1CCc2sccc2C1 236883893 UIAPKTPJRICGOW-MRXNPFEDSA-N 386.473 2.930 0 50 GFAA CCN1CCC[C@@H]1Cn1c(=O)n(C[C@H]2CCCCO2)c2cc(C(=O)O)ccc21 249701573 YOIJEDREJXBJAM-IAGOWNOFSA-N 387.480 2.555 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 266656542 BIFLMRMSSTVVRH-QGZVFWFLSA-N 387.480 2.570 0 50 GFAA Cc1nc(C)n(C[C@@H]2CCCN(S(=O)(=O)c3cnc4ccsc4c3)C2)n1 267611386 HQCKEAFWFMPHFZ-CQSZACIVSA-N 391.522 2.606 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(c1nccn3cnnc13)CC2 275841094 VZYGBFBXLQMSOD-INIZCTEOSA-N 382.493 2.593 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(NC[C@@H](c2cnn(C)c2)N(C)C)ncn1 328656174 ZBSBWGQCMVECCR-UWVAXJGDSA-N 387.532 2.540 0 50 GFAA C[C@H](NC(=O)N1CC[C@H](N2CCCC2)[C@@H]1C)C(=O)N1c2ccccc2C[C@@H]1C 334095076 QZKQXNHZZGAMMC-DWRORGKVSA-N 384.524 2.621 0 50 GFAA CN1C(=O)COc2cc(NC(=O)NCc3ccc4c(c3)OCCCO4)ccc21 534634333 QNMSJCBTTLUVDZ-UHFFFAOYSA-N 383.404 2.525 0 50 GFAA O=C(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1coc(C2CCOCC2)n1 767987826 FOYHEKVMXVRZBV-QGZVFWFLSA-N 384.354 2.749 0 50 GFAA O=C(CCc1ccc(OC(F)(F)F)cc1)N1CC[C@H](c2cc(O)nc(O)n2)C1 828400544 NMYNFZLYUGSMPN-LBPRGKRZSA-N 397.353 2.735 0 50 GFAA O=C(Nc1ccc(N2CCc3sccc3C2)nc1)[C@@H]1CCc2nncn2CC1 878115155 XVWKAIWHJJUEMD-CQSZACIVSA-N 394.504 2.889 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N(Cc1ccncc1)C[C@@H]1CCCO1 952972352 JPMPCHWKLJPQPI-IBGZPJMESA-N 391.471 2.913 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCc3noc([C@@H]4CCCO4)n3)cc2)n1 952973347 CLNMFBKIGWWYPX-KRWDZBQOSA-N 381.436 2.713 0 50 GFAA CNC(=O)[C@@H]1CN(C[C@@H]2CCCO[C@H]2c2ccc(C(F)(F)F)cc2)CCO1 953030360 QKLINOTVEGQIAW-XIRDDKMYSA-N 386.414 2.620 0 50 GFAA O=C1CCCN1CCN1C[C@H]2CN(CC3CC3)C[C@]2(CCc2ccccc2)C1 1772809240 PZVFKQWABYPPAK-UPVQGACJSA-N 381.564 2.885 0 50 GFAA CC[C@]12C[C@H]1CN(C(=O)C1CCN(C(=O)c3cc(OC)cc(OC)c3)CC1)C2 1772819087 PNZAZYCMVKTKPZ-HTAPYJJXSA-N 386.492 2.815 0 50 GFAA Cc1ccc2nc(O)c(-c3nccn3-c3cnn(CCCC(N)=O)c3)cc2c1 1857683211 GAXBOTMELBHDLK-UHFFFAOYSA-N 376.420 2.564 0 50 GFAA CN(C)c1ccc(C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)cn1 1857700570 FALRYWCJNZZDBF-UHFFFAOYSA-N 375.476 2.789 0 50 GFAA Cn1nc(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c2ccccc21 1857734890 XBTRNMYSYVURFZ-IIBYNOLFSA-N 386.455 2.797 0 50 GFAA COc1c(C(=O)O)cc(-c2nn3cnnc3c3ccccc23)c(OC)c1OC 1875245382 XNHMKVGFYFZOOL-UHFFFAOYSA-N 380.360 2.669 0 50 GFAA C[C@@H]1CC[C@H](CN)N(C(=O)c2cnc3sc(Cc4ccccc4)cn3c2=O)C1 1875278033 URPYJTUQSINECQ-GDBMZVCRSA-N 396.516 2.546 0 50 GFAA CN(C)Cc1cccc(C(=O)N2CC[C@H](n3cnc4ccccc4c3=O)C2)c1 2325781331 FEQXCDBDXOXMIR-SFHVURJKSA-N 376.460 2.545 0 50 GFAA O=C(NC1CCCCC1)[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)NCC3)C1 2325842597 BTBKKXFXALLFGK-INIZCTEOSA-N 391.537 2.504 0 50 GFAA COc1cccc(C(=O)N2CCC(C(=O)Nc3nc(C)n(C(C)C)n3)CC2)c1 2356152385 GYXMGZXSLNMWJU-UHFFFAOYSA-N 385.468 2.667 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c(C)cc1C 1171426 BQFWMZODTQSMBA-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA O=C(O)/C(=C\c1ccco1)NC(=O)c1ccccc1I 1201094 XLIDALDLTLYEAF-XYOKQWHBSA-N 383.141 2.740 0 50 GFAA Cc1ccccc1NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1 1230664 MWZFQAFROALEAK-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA O=C(c1cc(Br)ccc1Cl)N1CCN(c2ncccn2)CC1 2627203 XWDWUCRKPAUOGV-UHFFFAOYSA-N 381.661 2.855 0 50 GFAA O=C(Nc1cccc(Cl)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 3021530 BKHKUTVSYBRYMQ-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA Cc1cnc(NC(=O)c2ccc3c(c2)C(=O)N(Cc2cccnc2)C3=O)s1 4759334 KMLHFKDCYSRERB-UHFFFAOYSA-N 378.413 2.895 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSC2=N[C@@H](c3ccccc3)CC(=O)N2)cc1 5495526 WNXCOMXENCYUNJ-QGZVFWFLSA-N 396.472 2.934 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)c2cc(C(C)C)c(OC)cc2C)CC1 6703327 KSURNEFPJZJTKT-UHFFFAOYSA-N 384.498 2.590 0 50 GFAA CCN(CC)CCNC(=O)c1cnn(-c2nccc(-c3cccs3)n2)c1C 12510824 NDYBTYKUHUAKMB-UHFFFAOYSA-N 384.509 2.771 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2F)CCCN(C(=O)CCC(=O)OC)C1 14980950 UBPDQKUDWKASJH-FQEVSTJZSA-N 397.418 2.632 0 50 GFAA COc1ccccc1N1CCN(c2ncccc2CNC(=O)c2ccoc2)CC1 19112505 ZWPUSBCXCLBAQV-UHFFFAOYSA-N 392.459 2.940 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1ccccc1 27640268 LYXKJZCRLQWIIN-WHLLEBBVSA-N 388.460 2.750 0 50 GFAA in-vitro O=C(NC1CCN(Cc2ccccc2)CC1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 32095570 XHXRQSMUABFFEO-SFHVURJKSA-N 395.478 2.959 0 50 GFAA Cc1nnc2ccc(N3CCC[C@H](C(=O)NCc4ccccc4Cl)C3)nn12 32105828 VOWWLQHBNHLWBP-HNNXBMFYSA-N 384.871 2.619 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CC(=O)N(c3ccccc3)C2)cc1Cl 62091932 WSAVXSPOHZEIER-CYBMUJFWSA-N 394.880 2.680 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@@H](c2cccnc2)N2CCCC2)s1 63871145 FLVRUMPWFXPRGR-OAHLLOKOSA-N 377.539 2.677 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CCC[C@H](c4ccn[nH]4)C3)cc2n1 67786804 PEKNAIKVILZFAQ-NSHDSACASA-N 378.358 2.799 0 50 GFAA O=C(O)c1ccnc(-c2ccnc(N3CCC(Nc4ccccn4)CC3)n2)c1 72440720 HWZABYSVXJCJCO-UHFFFAOYSA-N 376.420 2.713 0 50 GFAA O=C(C1CCC1)N1CCCn2nc(CNc3cnc4ccccc4n3)cc2C1 82147067 WGVZRYVCIKVVFD-UHFFFAOYSA-N 376.464 2.971 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)N1CCC(OCc2ccccn2)CC1 95509118 XIQQTZXAJDVNPC-UHFFFAOYSA-N 378.436 2.875 0 50 GFAA O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)N1CCN(C2CCCC2)C(=O)C1 95526592 VJWDZLKXRVGYND-IBGZPJMESA-N 387.480 2.863 0 50 GFAA COCCCn1cnnc1[C@H](C)Nc1ncnc2c1Cc1ccccc1OC2 97756329 UNQJBVHWCWZEQO-AWEZNQCLSA-N 380.452 2.761 0 50 GFAA COc1ccsc1S(=O)(=O)N1C[C@@H](n2ccnc2)Cc2ccccc21 121739962 GRLJKKQANJXGAV-AWEZNQCLSA-N 375.475 2.946 0 50 GFAA CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2)c1ccc(F)cc1F 127329745 AYDZHGJXRPINGJ-SFHVURJKSA-N 394.443 2.926 0 50 GFAA CC(C)C1CCC(NS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)CC1 153028131 XQXJHEAXZFPIAV-UHFFFAOYSA-N 394.537 2.652 0 50 GFAA CN1c2cc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2C(=O)N2CCCCC[C@@H]21 169766079 HDVOOBQIFZJEEI-LJQANCHMSA-N 392.459 2.830 0 50 GFAA O=C(c1ccccc1F)N1CCC[C@@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169777764 CJCISKSQJOJDHL-CYBMUJFWSA-N 382.399 2.822 0 50 GFAA COc1ccc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)cc1-n1nnnc1C 179783066 KRIYWZVQGOAZAZ-INIZCTEOSA-N 387.827 2.695 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cn1)N1CCO[C@H](CCc2ccccc2)C1 194926179 QEBYIHPIUMXJFJ-HXUWFJFHSA-N 396.491 2.784 0 50 GFAA Cn1nc(-c2ccccc2)cc1C(=O)N1CCCN(C(=O)c2ccco2)CC1 215671154 GWBMKCVERYYWBC-UHFFFAOYSA-N 378.432 2.668 0 50 GFAA C[C@H](Cn1cncn1)NC(=O)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 225454923 RRKSTEYBIQGHCN-CYBMUJFWSA-N 399.838 2.867 0 50 GFAA C[C@@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)[C@@H]1CN 237445031 CKJOTKLGBKGPJD-OXQOHEQNSA-N 386.517 2.860 0 50 GFAA Cc1cc(CNC(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)nc(N(C)C)n1 241590529 PFOFCTYMJNXDSE-GFCCVEGCSA-N 399.430 2.601 0 50 GFAA O=C(OCc1ccccc1)N1CCCN(c2cc([C@H]3C[C@@H](O)C3)ncn2)CC1 244594159 DHMILOZGXWPRHY-HDICACEKSA-N 382.464 2.564 0 50 GFAA O=C(CC[C@@H]1NC(=O)N(c2ccccc2)C1=O)NCCc1c[nH]c2ccccc12 253404019 HPDGXJPAANCGOI-IBGZPJMESA-N 390.443 2.732 0 50 GFAA biogenic CCCCN(C)C[C@H](C)NC(=O)c1nnn(-c2cccc3ncccc23)c1C 253420328 WHBVIBXPNRZSQN-HNNXBMFYSA-N 380.496 2.974 0 50 GFAA O=C(N[C@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1ccc(-c2ccccc2)nc1O 253534793 DFGGZMHRJYAELJ-PLMTUMEDSA-N 389.455 2.961 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2[C@@H](O)C[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254487960 FLMSQRUGSHIKCT-QOADKBLOSA-N 390.520 2.575 0 50 GFAA O=C1Nc2ccccc2C[C@@H]1CCC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 268959629 XGYOKSGNVWCOIR-LPHOPBHVSA-N 378.428 2.616 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1ncccc1O)CC2 275846934 YCOUDNYFSHBEMF-KRWDZBQOSA-N 385.489 2.892 0 50 GFAA Cn1nccc1C1=CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)CC1 287575351 FLXBRFCPIHKMPE-KRWDZBQOSA-N 397.454 2.554 0 50 GFAA O=C(Cc1nc2ncccn2n1)N1CCC[C@@]2(CCCCc3ccccc32)C1 363949407 MCUMHVDHZSPXBB-QFIPXVFZSA-N 375.476 2.954 0 50 GFAA C[C@H]1C[C@H](NC(=O)NCc2cnn3ccccc23)c2ccsc2S1(=O)=O 365688019 IMSKNERRHIVFCX-FZMZJTMJSA-N 390.490 2.502 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)N1CCN(c2ccncc2)CC1 426370485 MQHLMDJYRCEQFB-UHFFFAOYSA-N 380.492 2.662 0 50 GFAA O=c1ccc(-c2nc(-c3ccc4c(c3)OCO4)no2)nn1-c1ccccc1F 498382022 JCUVIOLKDIRKRL-UHFFFAOYSA-N 378.319 2.817 0 50 GFAA CC(=O)N1CCCN(C(=O)c2cccc(-c3ccc4[nH]nc(N)c4c3)c2)CC1 534653052 ADFOETJIXYDKQD-UHFFFAOYSA-N 377.448 2.507 0 50 GFAA O=C(NCCc1noc(C2CCC2)n1)N1CCCN(Cc2cccs2)CC1 584894055 DFMJGLUWQQITTI-UHFFFAOYSA-N 389.525 2.859 0 50 GFAA CCCN1CCC[C@H](NS(=O)(=O)c2cc(-c3ccno3)ccc2OC)C1 670469272 LWAWKCFIANADPL-HNNXBMFYSA-N 379.482 2.503 0 50 GFAA CCCOc1c(CN2CCC[C@H](CN(C)S(C)(=O)=O)C2)cccc1OCC 809688256 FWXKFZMCNNFWQO-QGZVFWFLSA-N 398.569 2.978 0 50 GFAA C[C@H](NS(=O)(=O)c1ccsc1C(=O)O)c1ccccc1-n1cccn1 822273979 QONLNMIFDHEAEX-NSHDSACASA-N 377.447 2.672 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)c1nnn([C@H]2CCNC2)c1C 888102058 WPVCVIOKQSGQAK-YQVWRLOYSA-N 383.496 2.549 0 50 GFAA CCN1CCC(NC(=O)c2cn(Cc3cccc(F)c3)nn2)(C(F)(F)F)CC1 891209662 QQBRERPOFCZFDB-UHFFFAOYSA-N 399.392 2.612 0 50 GFAA Cc1ccc(-n2nc(C)cc2NC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)cc1 1317841927 SLHWTIJHVQJDLZ-CYBMUJFWSA-N 380.370 2.838 0 50 GFAA O=C([C@@H](c1cccnc1)N1CCOCC1)N1CCOc2ccc(Cl)cc2C1 1506403178 SCTRSVRJUCIPED-LJQANCHMSA-N 387.867 2.530 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@@H]4CC[C@H]3CN(C(=O)C3CCC3)C4)CC2)cc1 1565513517 IDYQKZXBJCREPE-APWZRJJASA-N 382.504 2.976 0 50 GFAA COc1ccc(-c2nc(CN3C[C@@H](O)[C@H](Cc4cc(C)no4)C3)c(C)o2)cc1 1704297091 HBIZVWKFYVVOKH-OXQOHEQNSA-N 383.448 2.990 0 50 GFAA CN1CCC2(CC1)CN(c1noc(-c3ccccc3)c1C(=O)O)CCCN2C 1704312201 NPYLMLNCVIUELA-UHFFFAOYSA-N 384.480 2.646 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N(C)CC2(CO)CCC2)ccc1F 1704336924 MPTKPPNXFVFDCF-UHFFFAOYSA-N 391.443 2.790 0 50 GFAA O=C(NCc1cccc2[nH]ccc12)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1775983929 WBXVWTVBSFUFIQ-AWEZNQCLSA-N 396.516 2.882 0 50 GFAA OCCCn1nc(COc2cccc(Cl)c2)nc1[C@@H]1CCn2nccc2C1 1857678110 BJQRSUPXEIWSTL-CQSZACIVSA-N 387.871 2.819 0 50 GFAA COc1ccccc1CN1CCC2(CC1)CN(C(=O)CC(C)C)C[C@H]2C(=O)O 1857692124 PRFJYYZOXGMAFZ-SFHVURJKSA-N 388.508 2.867 0 50 GFAA O=C(c1ccccn1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857701189 FYPMUYRLLJXICO-QFIPXVFZSA-N 387.443 2.759 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC2(CC1)C[C@@H](O)C[C@H](c1ccccc1)O2 1857701723 ZGNWJTFGWCERDL-PKOBYXMFSA-N 392.459 2.617 0 50 GFAA CCOCCn1nc(Cc2ccccc2OC)nc1[C@H]1CC[C@@H](OC)[C@H](N)C1 1857715517 VKGUGGRPVBWDTL-YQVWRLOYSA-N 388.512 2.524 0 50 GFAA C[C@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 1875260388 LSQPEEAFZFSDQN-WMLDXEAASA-N 378.428 2.742 0 50 GFAA CS(=O)(=O)N1[C@H]2CC[C@H]1CC(NC(=O)c1cc(C3CC3)nc3ccccc13)C2 1875297536 VRFGBSAISJULFO-HOTGVXAUSA-N 399.516 2.797 0 50 GFAA Cc1nc(CCNC(=O)N2CCN(c3cc(Cl)ccc3O)CC2)cs1 1875306096 RZRBIZPGGHVDIX-UHFFFAOYSA-N 380.901 2.885 0 50 GFAA COc1ccccc1C(=O)NC[C@H]1CCCN1C(=O)C1CCN(CC2CC2)CC1 1875328352 MZBYZMOXDSPTDP-LJQANCHMSA-N 399.535 2.538 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cc(C(C)(C)C)on3)CC2)c2n1CCN(C)C2 1875394407 HYSGIEQEJOIBGB-UHFFFAOYSA-N 385.512 2.942 0 50 GFAA CCc1nc2ccccc2c(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)c1C 2325785700 JKAVMXKMBCSOCX-CWFSZBLJSA-N 378.476 2.872 0 50 GFAA Cn1cc(-c2ccc3c(n2)N(C(=O)N[C@@H]2CCCn4nccc42)CCC3)cn1 2325798324 MNSDFXYTSLOISU-QGZVFWFLSA-N 377.452 2.676 0 50 GFAA Cn1nc(C(=O)O)c2c1CCN(C(=O)c1cc(Oc3ccccc3)ccc1O)C2 2325853266 JZZVMOUJUAZADB-UHFFFAOYSA-N 393.399 2.815 0 50 GFAA COc1c(F)cccc1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356135667 ODXDFCWFCYSDFT-OAQYLSRUSA-N 384.455 2.811 0 50 GFAA CC(=O)Nc1sc(NC(=O)c2nnc3nc(C)ccn23)nc1-c1ccccc1 2356152103 ABQRNSVGAABLOU-UHFFFAOYSA-N 393.432 2.767 0 50 GFAA CN(CC(=O)Nc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc2ccccc2c1 814545 DKCRJJIUPFLMOU-UHFFFAOYSA-N 398.440 2.828 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O)N1CCOCC1 1124713 QGUACGCZQAGMBG-UHFFFAOYSA-N 383.835 2.576 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCc4cnc(C)nc43)C2)c(C(=O)O)c1OC 2356143152 WNXNHCGASFKEQQ-JOCHJYFZSA-N 397.475 2.980 0 50 GFAA COC(=O)COc1ccc(S(=O)(=O)Nc2cccc(C(C)=O)c2)cc1C 2857627 BZGTVUKTBPPSGJ-UHFFFAOYSA-N 377.418 2.550 0 50 GFAA O=C(O[C@@H](NC(=O)N1CCOCC1)C(Cl)(Cl)Cl)c1ccccc1 4831813 NAAMEVUCUQRNJA-GFCCVEGCSA-N 381.643 2.582 0 50 GFAA CCCS(=O)(=O)N1CCC[C@H](C(=O)Nc2nnc(-c3ccccc3)s2)C1 6746075 ITZMRJQPCXMHMU-AWEZNQCLSA-N 394.522 2.595 0 50 GFAA CCc1nnc(NC(=O)CSc2nnnn2-c2ccc(C)c(Cl)c2)s1 8995596 NAVAKYDHRHDHGB-UHFFFAOYSA-N 395.901 2.769 0 50 GFAA Nc1c(C(=O)NCCc2ccccc2)nnn1-c1cccc(Br)c1 9481443 NKXYWRFCQQRRHQ-UHFFFAOYSA-N 386.253 2.585 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C(=O)/C=C/c3ccncc3)CC2)[C@H]1O 20860600 SCXDVPXUYFQCAB-SCDNRKHISA-N 377.488 2.632 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)NCCC(=O)NCc1ccccc1 252484142 FPWXOYKJCXTWRZ-UHFFFAOYSA-N 396.369 2.937 0 50 GFAA COc1ccc(CN2CC[C@H](NC(=O)Cc3c[nH]c4c(C)cccc34)C2=O)cc1 172849528 KWYZKBSUNBNGIG-FQEVSTJZSA-N 391.471 2.945 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CCC(=O)N1C[C@@H](C)O[C@H](C)C1 2778449 AFZHWEXTWFUTEK-RKDXNWHRSA-N 398.223 2.999 0 50 GFAA Cc1ccnc(N2CCN(C(=O)c3ccc(C[C@@H]4CCCNC4)cc3)CC2)c1 72172590 VCJQKDHZDFAIPD-FQEVSTJZSA-N 378.520 2.895 0 50 GFAA CC(C)(N)C(=O)N1CCC[C@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 72150886 GIVBMTMKDJFECV-KRWDZBQOSA-N 398.473 2.556 0 50 GFAA Cc1ccc(F)c(OC2(C(=O)O)CCN(C(=O)Cc3cscn3)CC2)c1 72427371 IKRQZATXKRMVBK-UHFFFAOYSA-N 378.425 2.658 0 50 GFAA CCOC(=O)[C@H]1CCCCN1C(=O)CN1CCC[C@H]1Cc1ccc(F)cc1 239367335 AIINKCQZJISZLU-RBUKOAKNSA-N 376.472 2.777 0 50 GFAA CCOC(=O)c1nn(CCOC)c2c1CN(Cc1c[nH]c3ccccc13)CC2 14541766 GOVIOLBTVBXHHW-UHFFFAOYSA-N 382.464 2.746 0 50 GFAA CCOc1cccc(CN(CCO)[C@@H]2CCN(c3ccccc3OC)C2=O)c1 452052196 ZIENBUAQRDBMQP-HXUWFJFHSA-N 384.476 2.694 0 50 GFAA COc1ccccc1NC(=O)C1CCN(Cc2cc(C)nc(N(C)C)n2)CC1 242302255 YQVWRRBXIBCIIQ-UHFFFAOYSA-N 383.496 2.710 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 226566145 FFFCLQNIVMMTCY-VQHPVUNQSA-N 385.851 2.868 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 290762559 VLIVVICYULOEIR-LLVKDONJSA-N 380.330 2.813 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4O)n[nH]3)CC2=O)cc1 82108286 WGJWRGJBNNJLIZ-UHFFFAOYSA-N 376.416 2.580 0 50 GFAA Cc1nc2c(c(N3CCN(C[C@@H]4CCCO4)CC3)n1)Cc1ccccc1OC2 95502200 CFGAOAVWXZAUAY-SFHVURJKSA-N 380.492 2.569 0 50 GFAA COc1cccc(-c2ccc(NC(=O)[C@@H]3CCCN(C(=O)CCO)C3)cc2)c1 95525380 MWTXWCZAFZKGJZ-GOSISDBHSA-N 382.460 2.922 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)N[C@H](C)Cc3ccccn3)s2)n1 23399456 IWSNKCVBOGOHKN-GFCCVEGCSA-N 385.497 2.742 0 50 GFAA Cn1c(CCNC(=O)C2CCN(C(=O)C3CCCC3)CC2)nc2ccccc21 92036818 IRCDCBSHSQOLHI-UHFFFAOYSA-N 382.508 2.661 0 50 GFAA CC(=O)C[C@H]1COCCN1C(=O)c1cccc(OCc2cn3ccccc3n2)c1 183865237 MBKPSCJWWAGOST-IBGZPJMESA-N 393.443 2.733 0 50 GFAA Cc1ccc(C(=O)NCCN2CCC[C@H](CO)C2)cc1NC(=O)C1CCCC1 828711252 VJTOSOCDMMLZOR-KRWDZBQOSA-N 387.524 2.558 0 50 GFAA Cc1ccc(N2C[C@H](NC(=O)N3CC(Oc4cccc(C)c4)C3)CC2=O)cc1 584895945 MFIMXQUEIUDPHP-QGZVFWFLSA-N 379.460 2.882 0 50 GFAA O=S(=O)(c1ccnn1CCc1ccccc1)N1CCCc2cccc(O)c21 1875268293 JCWCLMNCPVLFKW-UHFFFAOYSA-N 383.473 2.973 0 50 GFAA C[C@@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cc(C(F)(F)F)n(C)n1 1875276061 IUVRIJAJIRIFJW-JTQLQIEISA-N 379.342 2.850 0 50 GFAA O=C(O)CCc1cn(-c2ccccc2C(=O)N2Cc3cc(F)c(F)cc3C2)nn1 1875325159 SCBNNMNWUPLELJ-UHFFFAOYSA-N 398.369 2.719 0 50 GFAA CC(C)[C@@H]1C(=O)N(C)CCN1S(=O)(=O)c1cccc2cccc(Cl)c12 952979334 NPWANPBLXPQQME-QGZVFWFLSA-N 380.897 2.981 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(c3nnc4n3CCCCC4)CC2)C2(CCCC2)O1 952963083 FLYIJWFFPWZCPX-INIZCTEOSA-N 386.496 2.586 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C2)n1 952984079 ZNAUUMDIRONGKT-CQSZACIVSA-N 397.454 2.806 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(CCO[C@@H]3CCCC[C@@H]3C)C2)ccn1 886072082 NTPADHSHVRPWRP-ZLGUVYLKSA-N 375.513 2.766 0 50 GFAA Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)N(C)Cc1cc2ccccc2[nH]1 1340092799 INHLYDDVZDOZEB-UHFFFAOYSA-N 391.475 2.951 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2csc(-c3ccccc3F)n2)CC1 186641249 YLXCIKXWSVBASC-UHFFFAOYSA-N 391.468 2.960 0 50 GFAA CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccn(Cc3ccccc3)n2)c1 1322158127 VNAGMUKWHHEPIM-UHFFFAOYSA-N 398.488 2.623 0 50 GFAA O=C(c1ccccc1-c1nn[nH]n1)N1CCC(N2CCc3ccccc3C2)CC1 1186999280 LACYGNDGPWPQFA-UHFFFAOYSA-N 388.475 2.530 0 50 GFAA O=C1CCN(Cc2cncnc2)CCN1Cc1ccc(C(F)(F)F)c(F)c1 1506399285 LPAVGZQYJFFLOK-UHFFFAOYSA-N 382.361 2.869 0 50 GFAA CN(C)Cc1ccc(CSCCNC2CCN(C(=O)C3CCC3)CC2)o1 1506399239 LIMYBNYMERQJKZ-UHFFFAOYSA-N 379.570 2.955 0 50 GFAA O=C(CCC(=O)N1CCCN(Cc2ccncc2)CC1)Nc1cccc(F)c1 1506420116 UXAFSCDEMDYEMX-UHFFFAOYSA-N 384.455 2.674 0 50 GFAA COc1cc(NC(=O)CN2CCCN(c3ccncc3C)CC2)cc(OC)c1 1529179586 CXDGXTHVRTUNFK-UHFFFAOYSA-N 384.480 2.558 0 50 GFAA O=C(CN1Cc2ccccc2C1)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529104530 PVQBLMBJWZYGTK-NFBKMPQASA-N 387.483 2.924 0 50 GFAA O=C(c1cccnc1)[C@H]1CCCN(C(=O)c2cn(CC3CCCCC3)nn2)C1 11874528 QLSMJZHKASBRPB-SFHVURJKSA-N 381.480 2.989 0 50 GFAA O=C(COC[C@H]1CCCCO1)NCc1cccnc1N1CCc2ccccc2C1 12439361 YXAJCNQYJWUIRH-OAQYLSRUSA-N 395.503 2.846 0 50 GFAA COc1cccc(CC[C@@H]2CCCN(C(=O)Cc3cnc4ncnn4c3)C2)c1 12761412 SAHITDCYVSGOQO-KRWDZBQOSA-N 379.464 2.547 0 50 GFAA Cn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCC1CCCCC1)C2 14732299 CKKSZHNZCCRVRN-MRXNPFEDSA-N 376.570 2.636 0 50 GFAA Cc1nc(CN2CCN(Cc3nc(CCc4ccccc4)no3)CC2)cs1 19731220 RUIHHWJORRYXRM-UHFFFAOYSA-N 383.521 2.938 0 50 GFAA O=C(Cc1cccc(F)c1)NCc1nnc2ccc(-c3ccc(F)cc3)nn12 169778506 YIZCTXIDFPAQFK-UHFFFAOYSA-N 379.370 2.928 0 50 GFAA CC(C)[C@H]1NC(=O)c2ccccc2N(CC(=O)Nc2ccc3cc[nH]c3c2)C1=O 206257419 CXGCLEVBCVPIJV-HXUWFJFHSA-N 390.443 2.908 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)[C@H](O)C2CCCCC2)CC1 1857688394 HFMMXKBAHGBDSF-QGZVFWFLSA-N 393.505 2.778 0 50 GFAA Cc1ccc(CN2CC[C@@H](O)[C@]3(CCCN(C(=O)COC(C)C)C3)C2)s1 1857693491 ZBWRCLTWSVIUSG-UYAOXDASSA-N 380.554 2.657 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3cccnc3O)C1)CC2 1857711525 FANSTYLQYOLVIS-NRFANRHFSA-N 382.464 2.701 0 50 GFAA O=C(CCCn1cccn1)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857711585 HYZHSAQWRAMKHH-UNMCSNQZSA-N 382.508 2.728 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCC(C)(C)O)C3)nc2c1 1857732637 YXNGOSQDJXBZJL-AWEZNQCLSA-N 375.469 2.720 0 50 GFAA CS(=O)(=O)Cc1noc(NC(=O)N[C@@H](c2cccc(F)c2)C2CCCC2)n1 119979644 AHUBFHJUJCMZHY-OAHLLOKOSA-N 396.444 2.806 0 50 GFAA Fc1ccc([C@H]2CN(c3nccc(N[C@H]4CCCOC4)n3)CCO2)c(Cl)c1 333189736 VMALJHYSFBIERA-WMLDXEAASA-N 392.862 3.438 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237660784 HNGTUADNKKRLNZ-MRXNPFEDSA-N 378.226 2.572 0 50 GFAA CN1[C@H](c2ccccc2F)[C@H](CNCc2nc3ccc(F)cc3[nH]2)C[C@@H]1CO 248027867 KAGIQIWZTXEMMZ-KUUHDYPXSA-N 386.446 2.985 0 50 GFAA Cc1c(C)c(C)c(CNC(=O)c2cnn(-c3ccc(=O)[nH]n3)c2C)c(C)c1C 151369921 BHYHKJOQXSHOEI-UHFFFAOYSA-N 379.464 2.736 0 50 GFAA CCCn1cc(CN2CCCN(c3ncc(Br)cn3)CC2)cn1 264552800 YWQBBASAKADXOY-UHFFFAOYSA-N 379.306 2.558 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3cnc(-c4ccncc4)nc3)C1)CC2 1704299767 SIMNGHOGJLMMQN-JOCHJYFZSA-N 386.459 2.757 0 50 GFAA O=C(O)C[C@@H](CNS(=O)(=O)c1ccc(Br)cc1)c1ccccc1 4654004 ZMXUOCDIQZRGHI-ZDUSSCGKSA-N 398.278 2.986 0 50 GFAA C[C@H](CNC(=O)C[C@H]1CN(CC2C3(CC3)C23CC3)C2(CCC2)CO1)c1cnc[nH]1 2325785291 OLLLIFDFSATKKZ-SJORKVTESA-N 398.551 2.833 0 50 GFAA O=C(c1cc2ncc(Br)cc2o1)N1CCN(c2ccncc2)CC1 2325857970 WCYVQLVNSNQLFO-UHFFFAOYSA-N 387.237 2.948 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N2CC[C@](O)(c3cccc(C(F)(F)F)c3)C2)C1 2325889522 VBWZUBVQCOBWNJ-IFXJQAMLSA-N 396.409 2.550 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1 1144491 SUORHWKPPRZIKP-UHFFFAOYSA-N 395.868 2.558 0 50 GFAA Cc1c(CC(=O)NCCC(=O)O)c(=O)oc2cc3oc4c(c3cc12)CCCC4 2102349 AEVSEJRAHLUEDG-UHFFFAOYSA-N 383.400 2.860 0 50 GFAA biogenic O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)Nc1ccc2c(c1)OCCO2 5388480 DBJRGPAECVHVNY-UHFFFAOYSA-N 397.818 2.974 0 50 GFAA CC(=O)OC[C@@H]1O[C@@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12 11847478 AVMIIKLVEDAPFQ-QXDIGNSFSA-N 382.453 2.795 0 50 GFAA biogenic CC(C)C(=O)NC[C@H]1CCC2(CCN(Cc3ccc4nsnc4c3)CC2)O1 11964478 CTLOVLIYYFDYHC-MRXNPFEDSA-N 388.537 2.977 0 50 GFAA O=C1CC[C@@H]2CN(Cc3cccnc3)CC[C@@H]2N1Cc1ccc2c(c1)OCO2 12030090 ZDFQXLDCYBVDHI-MOPGFXCFSA-N 379.460 2.823 0 50 GFAA Cc1ccccc1CCN1CCC[C@H](CN(C)C(=O)CCN2CCCC2=O)C1 12581735 BCHAFLMNZAWOJI-HXUWFJFHSA-N 385.552 2.720 0 50 GFAA Cc1c(C(=O)N[C@H](C)Cc2ccccn2)cnn1-c1nccc(-c2cccnc2)n1 14991344 KNQUVVUEFWBSGA-OAHLLOKOSA-N 399.458 2.789 0 50 GFAA O[C@H](COc1ccccc1-c1cccc(-c2cc[nH]n2)c1)CN1CCOCC1 23312245 WDOUCRRHAIVHGG-IBGZPJMESA-N 379.460 2.816 0 50 GFAA O=c1c2nnc3c(-c4ccc(Cl)cc4)cnn3c2ccn1C[C@@H]1CCCO1 40395869 OPKDQFFRDUVZLT-AWEZNQCLSA-N 381.823 2.939 0 50 GFAA Cc1nn(C)cc1-c1ccn(CC(=O)Nc2ccnn2Cc2cccs2)n1 48482757 CJCZMKDUWJUELD-UHFFFAOYSA-N 381.465 2.537 0 50 GFAA O[C@@]1(CN2CCC(c3nnc4n3CCCCC4)CC2)CCCN2CCCC[C@@H]21 63884533 OZSZUCOMGSFJMH-DENIHFKCSA-N 387.572 2.563 0 50 GFAA Nc1cc(N2CCC(Cc3ccccc3C(F)(F)F)(C(=O)O)CC2)ncn1 71749700 FIOQXXQAFPDMDA-UHFFFAOYSA-N 380.370 2.992 0 50 GFAA Cc1ncc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 71754389 IOIAGGJMZRGRAD-IBGZPJMESA-N 384.455 2.823 0 50 GFAA O=C([C@H](Cc1c[nH]cn1)n1cccc1)N1CCC2(CC1)C(=O)Nc1ccccc12 72143057 JEBDKZMSXHVILC-IBGZPJMESA-N 389.459 2.508 0 50 GFAA COc1c(F)ccc(C(=O)N[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c1F 72161876 GSXNTZXLOZUMPC-AWEZNQCLSA-N 392.377 2.686 0 50 GFAA O=S(=O)(NCc1ccccc1)N1CCC[C@H](Cc2nc3ccccc3[nH]2)C1 72169549 SRSGAJMWBJWTQR-QGZVFWFLSA-N 384.505 2.852 0 50 GFAA CC(C)Oc1cccc2c1c(NC(=O)Cn1cnnn1)nn2-c1ccc(F)cc1 72457144 YBLORXAGTIFHDR-UHFFFAOYSA-N 395.398 2.577 0 50 GFAA CC(=O)N[C@@H](C(=O)Nc1nn(C)c2cccc(Oc3cccnc3)c12)C(C)C 77378231 LJFGFXORYDHPKM-GOSISDBHSA-N 381.436 2.860 0 50 GFAA O=c1c2c3c(sc2ncn1CCN1CC[C@@H](c2ccccc2)C1)CNCC3 77424755 VTQTXYDKMHRHRK-MRXNPFEDSA-N 380.517 2.593 0 50 GFAA CCN1C[C@]2(CCCN(C(=O)c3cc(=O)[nH]c4cc(F)ccc34)C2)CCC1=O 82098563 QGOQMVKVKQQCFR-NRFANRHFSA-N 385.439 2.532 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)Nc1ccc(-c2nnn(C)n2)cc1 96153506 XPSIASMEDGADOO-UHFFFAOYSA-N 380.456 2.533 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)Cc1c(C)[nH]c2ccc(F)cc12 97823628 JXZDXIWCMMMBDB-UHFFFAOYSA-N 375.473 2.986 0 50 GFAA CC(=O)N[C@@H]1CCCN(CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)C1 125187874 AWSKBLABGGAHEE-QGZVFWFLSA-N 397.523 2.709 0 50 GFAA O=C1COc2cc(C(=O)NCC3CCN(Cc4cccs4)CC3)ccc2N1 145789784 BITDZTCJKCQRQL-UHFFFAOYSA-N 385.489 2.721 0 50 GFAA C[C@@H](CCN1CCN(C)CC1)NC(=O)C1(c2ccc(Br)cc2)CC1 170598022 GIXNPQJZPCEZLB-HNNXBMFYSA-N 394.357 2.623 0 50 GFAA CC(C)(C)OC(=O)NC[C@@H]1CN(CCCc2nc3ccccc3o2)CCO1 170599751 TWBGMOCTQATWSV-OAHLLOKOSA-N 375.469 2.986 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@@H](c3cccc(F)c3)N(C)C)CC2)cs1 219910018 LMKCSDCCFXVYDB-GOSISDBHSA-N 376.501 2.538 0 50 GFAA CCOc1ccccc1CN1CCCn2nc([C@@H](O)c3ccnn3C)cc2C1 221286036 VFOSRBVQOVOPBH-OAQYLSRUSA-N 381.480 2.503 0 50 GFAA NS(=O)(=O)c1ccc2c(c1)N(Cc1c(F)cccc1OC(F)(F)F)CC2 225806913 ISQOBUWYKDCOEB-UHFFFAOYSA-N 390.358 2.934 0 50 GFAA CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccc(Br)s2)C[C@H]1O 252511230 FGQOMLJJLCROOQ-NXEZZACHSA-N 382.345 2.928 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2Cl)C1=O)NC[C@H]1C[C@H]2C=C[C@H]1C2 252572452 ZJDGJCKOONIMED-YOKBYHGQSA-N 387.867 2.683 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 262448050 VXGLIGHAQZCKTI-QGZVFWFLSA-N 399.834 2.521 0 50 GFAA Cc1ccccc1-c1cc2c(=O)n(C[C@@H](O)c3ccc4c(c3)OCO4)ccn2n1 263616911 LDLLDVNMGVCZBT-LJQANCHMSA-N 389.411 2.934 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCCc4cccs4)c3CO2)cc1 263618594 UOBDKJMQPGGBOR-KRWDZBQOSA-N 384.461 2.592 0 50 GFAA C[C@H]1CN(C(=O)CCC(=O)N2CC(=O)Nc3ccccc32)c2ccccc2O1 264731328 JAPGWVNBYBADRI-AWEZNQCLSA-N 379.416 2.566 0 50 GFAA O=S1(=O)CCC[C@@H](Cc2nc(-c3cc(OC(F)F)ccc3F)no2)C1 293259180 GPMPZLFOHPEGSQ-VIFPVBQESA-N 376.356 2.844 0 50 GFAA O=S(=O)(C[C@H]1CCCC1(F)F)N1CCCC[C@H]1c1nnc2n1CCCC2 333479978 XSOZVXUXWDWIRG-KGLIPLIRSA-N 388.484 2.907 0 50 GFAA O=C(Cn1ncc2ccccc21)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1 368745525 GBKXQBWVAWIOCG-GFCCVEGCSA-N 377.370 2.630 0 50 GFAA Cc1c(-c2cccc(C(=O)NC[C@H]3CNCCO3)c2)c(O)nc2ccccc12 584887763 PHKGXAYEYYYMNN-QGZVFWFLSA-N 377.444 2.634 0 50 GFAA Cc1cccc(N2CCC(NC(=O)[C@@H](c3cccnc3)N3CCOCC3)CC2)c1 670463605 NGTAKTUOSNTPOR-JOCHJYFZSA-N 394.519 2.549 0 50 GFAA COc1ccc(F)c(CN2CCC[C@H](CNC(=O)c3cc4ncccn4n3)C2)c1 824629405 RERURHZIGWJGDX-OAHLLOKOSA-N 397.454 2.519 0 50 GFAA COC1(OC)CCOC[C@H]1NC(=O)c1csc(-c2c(F)cccc2F)n1 912851055 JRKAGMKHMDFHFQ-CYBMUJFWSA-N 384.404 2.596 0 50 GFAA COc1cc(S(=O)(=O)N2CCC[C@H](C(=O)c3ccccn3)C2)c(C)cc1C 952991550 ZVXVJMGKXNBMCQ-INIZCTEOSA-N 388.489 2.991 0 50 GFAA O=c1cc(CN2CCC[C@H]2c2nc(-c3ccncc3)no2)nc2sccn12 1529100445 SSBQIJRPQNPXLL-AWEZNQCLSA-N 380.433 2.538 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCOC[C@@H]2OCC(=O)O)sc1-c1ccccc1 1565527298 LFYVJURUZIYPSX-GJZGRUSLSA-N 375.446 2.712 0 50 GFAA CN1C[C@@H]2C[C@H](N(C)Cc3nc(N)c4c5c(sc4n3)CCCC5)C[C@@H]2CC1=O 1704341620 XZEJNFMVWQZDRX-HZSPNIEDSA-N 399.564 2.841 0 50 GFAA CCc1ccc(-c2nccn2-c2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)nc1 1857666826 GFVARGAYGBDCDO-MRXNPFEDSA-N 385.493 2.670 0 50 GFAA CCCCc1nc(CN2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c(Cl)[nH]1 1857723595 MSXVOCRILFLGSS-KHYOSLBOSA-N 380.920 2.963 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)NCc3ccc4cc[nH]c4c3)CC2=O)s1 1857734169 MGCAYRIZKPCAGI-CQSZACIVSA-N 383.477 2.812 0 50 GFAA CC(C)Cc1nc([C@H]2CC[C@@H](O)[C@H](N)C2)n(-c2ncccc2C(F)(F)F)n1 1857735468 PBNFMDDXFSMYLA-IACUBPJLSA-N 383.418 2.835 0 50 GFAA Cc1nc(N2CCC3(CC2)CN(C/C=C/c2ccccc2)C(=O)CCO3)no1 1857735944 DNMMZOQHWCCTCW-VMPITWQZSA-N 382.464 2.679 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)cc1C 1875241735 ZPNXNJPWEXCBSM-SVFBPWRDSA-N 386.517 2.796 0 50 GFAA O=S(=O)(c1ccc2nc(O)[nH]c2c1)N1C[C@H](C2CC2)O[C@H](c2ccccc2)C1 1875246198 AIWZCLBVZKFCLS-RBUKOAKNSA-N 399.472 2.809 0 50 GFAA CCc1cccc(N2C[C@H](C(=O)N(C)[C@@H](CO)c3cccc(F)c3)CC2=O)c1 1875257337 FRDCMNBXZQKMTA-XLIONFOSSA-N 384.451 2.933 0 50 GFAA O=C(NS(=O)(=O)N1CCc2ccccc21)c1ccc(SC(F)(F)F)o1 1875289411 POLZVGSJDYOZNJ-UHFFFAOYSA-N 392.380 2.929 0 50 GFAA Cc1c(Br)ccc(NC(=O)N2CCc3c(O)nc(O)nc3C2)c1F 1875306520 JBCVURUDMWPCDV-UHFFFAOYSA-N 397.204 2.688 0 50 GFAA CCCC(CCC)C(=O)N1[C@H]2CC[C@H]1CC(N=c1cc[nH]c(C(=O)OC)n1)C2 1875334135 ADKKWRMIVNWWOC-IRXDYDNUSA-N 388.512 2.835 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCCC[C@H]3[C@H](C)NC(=O)c3cocn3)n[nH]2)o1 1875342115 YFQSJCTVNJNEFA-GUYCJALGSA-N 397.435 2.779 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N2CCC[C@@]23CCC[S@@](=N)(=O)C3)n1 1875396231 ZMXDZFUHWPTZQP-HWRSSNJWSA-N 376.404 2.619 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2ccccn2)nc1 1875401123 GDMCERFSWFYGIQ-CRAIPNDOSA-N 390.447 2.591 0 50 GFAA Cc1c(Br)ccc(S(=O)(=O)NC[C@H]2CCCCCN2)c1F 2325874345 JJLCFAUFOZCXMI-LLVKDONJSA-N 379.295 2.707 0 50 GFAA CC[C@@H](CC(=O)N1CC2(C[C@@H](NC(=O)c3ncoc3C)c3nccn32)C1)C(C)C 2332238092 YOPVIMUBQXDRBC-JKSUJKDBSA-N 399.495 2.664 0 50 GFAA CCCC(=O)c1cn(CC(=O)NC[C@H](O)c2cccc(O)n2)c2ccccc12 2356155375 DZXZOEWPJNPOOO-IBGZPJMESA-N 381.432 2.575 0 50 GFAA CCCn1c(SCC(=O)N2CCOCC2)nnc1-c1ccc(Cl)cc1 664293 AZIYROLRIJMCSY-UHFFFAOYSA-N 380.901 2.959 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)NC[C@@H]2CCCO2)cc1 839812 DPZUXUPZHGIPHO-IBGZPJMESA-N 388.489 2.562 0 50 GFAA COc1ccc(OC)c(NC(=O)CCN2CCN(c3ccccc3OC)CC2)c1 895181 RUHQTGPGWDDYBK-UHFFFAOYSA-N 399.491 2.863 0 50 GFAA COC(=O)c1c(NC(=O)COc2ccccc2)sc2c1[C@H](C(=O)OC)CC2 1744134 ZFCDARHBQUEBBZ-GFCCVEGCSA-N 389.429 2.755 0 50 GFAA Cc1ccc(N2C[C@H](N=c3[nH]oc(-c4ccccc4)c3C(=O)O)CC2=O)cc1 2356155518 GJUBWXXDOFUBBW-OAHLLOKOSA-N 377.400 2.988 0 50 GFAA O=C(CS(=O)(=O)c1ccccc1)c1ccc(S(=O)(=O)c2ccccc2)o1 4543059 SLUBWCREKAIMCA-UHFFFAOYSA-N 390.438 2.769 0 50 GFAA O=C(O)C1CCC(CNS(=O)(=O)c2ccc(Br)cc2)CC1 4668538 OEXAASQOHMSUSV-UHFFFAOYSA-N 376.272 2.618 0 50 GFAA CC(C)n1cc(CN[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)cn1 55060456 RGHWFGXLJCUAEN-GOSISDBHSA-N 384.528 2.894 0 50 GFAA O=C(NC1CCCCC1)[C@@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 100637004 NQFNXZYBAQVKDT-FFZBTMFNSA-N 392.499 2.854 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CN2CCC[C@H](C(=O)c3ccccn3)C2)cc1 65405840 YZUKRGFBQPPHNI-KRWDZBQOSA-N 394.475 2.598 0 50 GFAA CN(c1cccc(C(=O)N2CCOCC2)c1)S(=O)(=O)c1ccc(Cl)cc1 67338939 KBLCRQAANTUYPF-UHFFFAOYSA-N 394.880 2.638 0 50 GFAA Cc1noc(-c2ccnc(N3CC[C@@H](c4ccc5c(c4)OCO5)[C@H](O)C3)c2)n1 67446625 FQLJAYPCKSIDDG-JKSUJKDBSA-N 380.404 2.524 0 50 GFAA CCN1CCN(C(=O)c2cnn(-c3nccc(-c4ccccc4F)n3)c2C)CC1 64083860 YPEJCFCDNUCXTF-UHFFFAOYSA-N 394.454 2.555 0 50 GFAA COC(=O)c1cc(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)n(C)n1 67773879 LBALXDUVNKILSH-OAHLLOKOSA-N 398.246 2.727 0 50 GFAA C1CC[C@H](c2nnc(N3CCOC[C@@H](C4CCC4)C3)n2C[C@H]2CCCO2)OC1 428192475 QYINATAYQHFNOK-IPMKNSEASA-N 390.528 2.952 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(c3ncnc4sccc34)CC2)C1)N1CCCC1 71764106 XJIXCPSCHWHJTG-MRXNPFEDSA-N 399.564 2.995 0 50 GFAA Cc1cc(C)n(CCCN(C)c2nc(-c3ccncc3)nc3c2cnn3C)n1 72139055 KGAHUXUXZWIYPV-UHFFFAOYSA-N 376.468 2.765 0 50 GFAA Cc1cccc2[nH]c(CN(C)C(=O)[C@H]3CCCN(C4CCN(C)CC4)C3)nc12 71753014 FJMGNPBNYJHIGU-KRWDZBQOSA-N 383.540 2.636 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CCN([C@H](C(N)=O)c3ccccc3)CC2)c(C)c1 125109252 CJVOSWWGTAGIDT-NRFANRHFSA-N 394.519 2.666 0 50 GFAA CN1CCC[C@H](CNC(=O)NCCc2nccn2C)[C@H]1c1cccc(Cl)c1 154382201 RSWZEBYISJFEJH-VQIMIIECSA-N 389.931 2.998 0 50 GFAA CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1 155292466 FAFKKKSKWFCBIM-OTWHNJEPSA-N 394.475 2.947 0 50 GFAA O=C(O)C1(n2cnc3ccccc32)CCN(Cc2cccc3nonc23)CC1 77436972 XVZAIZLBEFXMKI-UHFFFAOYSA-N 377.404 2.648 0 50 GFAA Cc1ncc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@H](C(C)C)C2)c(=O)[nH]1 71439347 LLWJZCZPVJSIJC-IBGZPJMESA-N 386.471 2.590 0 50 GFAA CC(C)[C@H](NC1CCOCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1 157339527 MKHLAIUUCFBGOZ-NRFANRHFSA-N 391.531 2.700 0 50 GFAA O=C(c1cc(-c2ccncc2)n[nH]1)N1CCC([C@H](O)Cc2ccccc2)CC1 77505946 MMKHQEOSENPRDU-OAQYLSRUSA-N 376.460 2.928 0 50 GFAA CC(C)NC(=O)CCN1CCC[C@]2(CCC(=O)N(CCc3ccccc3)C2)C1 77516330 HHFGPYLLPDMTKC-QHCPKHFHSA-N 385.552 2.848 0 50 GFAA Cc1ccc2nc(CCNC(=O)[C@H](C)c3n[nH]c(=O)c4ccccc34)[nH]c2c1 215628792 PDMNFAKBSCBBIM-CYBMUJFWSA-N 375.432 2.570 0 50 GFAA COc1ccccc1N1CCC(NC(=O)NC[C@H]2CCCn3ccnc32)CC1 378226798 NWQZOVRSGMTSNP-MRXNPFEDSA-N 383.496 2.737 0 50 GFAA NCCCC(=O)N1CCC[C@@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 72161699 ZBXOVIBEVGOTQQ-GOSISDBHSA-N 398.473 2.557 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)cc1 174879415 PAPDVQNCOYOAEN-UXHICEINSA-N 387.501 2.960 0 50 GFAA O=C(NC1CCN(CC(F)(F)F)CC1)[C@@H]1CCCN1Cc1ccc(F)cc1 176132669 XVRGUCYXNKNHKF-KRWDZBQOSA-N 387.421 2.933 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NCCN3CCC[C@@H](C(N)=O)C3)cc2)cc1F 426398005 CZMICMKQECYPNA-LJQANCHMSA-N 383.467 2.728 0 50 GFAA Cc1ccc(CN2CCCn3nc(CNC(=O)N(C)C)cc3C2)c(F)c1F 82087865 KLCDEXVNOPBFQR-UHFFFAOYSA-N 377.439 2.647 0 50 GFAA Cc1ccc(CN2CCN(C(=O)c3cnc(C4CC4)nc3C)CC2=O)cc1C 82170946 LGACJUSPZQNMBA-UHFFFAOYSA-N 378.476 2.764 0 50 GFAA CCCCNC(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 95512512 WLOBCUDGMQQBSM-UHFFFAOYSA-N 388.917 2.673 0 50 GFAA Cc1ccc(-c2nc(-c3ncoc3C(C)C)n([C@H]3CCS(=O)(=O)C3)n2)o1 96140669 KQYCMVGDKQINAY-LBPRGKRZSA-N 376.438 2.985 0 50 GFAA CCc1nc(C)cc(N2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)n1 96149317 GIGSYRRZBWOHGE-UHFFFAOYSA-N 392.511 2.903 0 50 GFAA O=C(NCCc1csc(-c2cnccn2)n1)c1c[nH]nc1-c1ccccc1 92077744 XLKKHFMKUCYXKB-UHFFFAOYSA-N 376.445 2.963 0 50 GFAA CCc1c(C)nn(CCNC(=O)Nc2ccc3c(c2)N(C)C(=O)[C@H](C)O3)c1C 95521378 QPXMKUQITCSTGW-AWEZNQCLSA-N 385.468 2.628 0 50 GFAA Cc1cc2oc(=O)cc(C)c2cc1NC(=O)NCc1noc([C@H]2CCCO2)n1 97772866 QLKMAVPPVNFDFZ-CQSZACIVSA-N 384.392 2.966 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91747000 ZKDUPLQVFPWEFQ-UHFFFAOYSA-N 396.491 2.774 0 50 GFAA O=c1cc(CN2CCN(C3Cc4ccccc4C3)CC2)[nH]c2c(F)cccc12 91757309 CEFKXVSNHYMWJO-UHFFFAOYSA-N 377.463 2.952 0 50 GFAA CN(CCn1ccc2ccccc21)C(=O)[C@@H]1CC(=O)N(Cc2ccncc2)C1 97568973 FGULVTJKQVUXKU-LJQANCHMSA-N 376.460 2.543 0 50 GFAA CSc1nccc(N2CCC(NCc3nc(C)c4c(n3)CCCC4)CC2)n1 95366684 GHWGLCOWZYIOOV-UHFFFAOYSA-N 384.553 2.934 0 50 GFAA CC(C)n1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)cn1 91997208 QZAROUQUPKAQBV-UHFFFAOYSA-N 395.507 2.904 0 50 GFAA Cc1cccc(-n2cc(CN3CCC(c4nnc(CN(C)C)n4C)CC3)cn2)c1 96138405 KFDMYZXYIBDUOB-UHFFFAOYSA-N 393.539 2.750 0 50 GFAA Cc1ccc(-c2ccnc(N3CCC(NCc4noc(C)n4)CC3)n2)c(C)n1 96153589 QKQZYHGRQZICBX-UHFFFAOYSA-N 379.468 2.605 0 50 GFAA CCn1ccnc1C1CCN(C(=O)c2ccc(CSc3ncn[nH]3)o2)CC1 95521722 AGIYAXCMCXKKPY-UHFFFAOYSA-N 386.481 2.926 0 50 GFAA CN(CCO)C(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 95507024 JKFUSJVTECAADY-UHFFFAOYSA-N 382.504 2.837 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(Cc4c(C)noc4C)C3)CCC2=O)cn1 91779267 MHJUCGJUQGTWSB-NRFANRHFSA-N 383.496 2.795 0 50 GFAA COCc1nc(NCc2nn(C)c3cccc(Cl)c23)cc([C@H]2C[C@H](N)C2)n1 244718850 LSAZFIJKGKJDJC-HAQNSBGRSA-N 386.887 2.980 0 50 GFAA C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O)CC[C@@]43COS(=O)(=O)O)[C@H]1CCC2=O 253614973 OFAHVPXLWWIVAF-CBXRHLNTSA-N 384.494 2.679 0 50 GFAA O=C(NCc1cnc(N2CCOCC2)c(F)c1)c1cnc(-c2ccncc2)s1 183709535 MQTBHGSZZBWAQL-UHFFFAOYSA-N 399.451 2.506 0 50 GFAA O=C1Nc2ccccc2S[C@H]1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 299748710 HXQQINASEQHVOX-RDJZCZTQSA-N 382.441 2.528 0 50 GFAA O=C(CCc1ccccn1)N1CCC[C@@H](N2CCN(c3ccc(F)cc3)CC2)C1 55227629 YUHBVLMJSBYFBB-JOCHJYFZSA-N 396.510 2.967 0 50 GFAA Nc1ncc(C(=O)NCc2nncn2C2CCCCC2)c(-c2ccccc2)n1 827587546 RBYNLJPJOTUXSM-UHFFFAOYSA-N 377.452 2.753 0 50 GFAA O=C(c1sc(N2CCCC2)nc1Cl)N1CC[C@@](CO)(C2CCOCC2)C1 1875297009 ZAGXZKAABOPIHI-GOSISDBHSA-N 399.944 2.648 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N(Cc2scnc2C)C[C@H]2CCNC2)n1 876818736 YEMXSLVUCJGLGN-LBPRGKRZSA-N 399.442 2.821 0 50 GFAA CC(=O)Nc1ccc2c(c1)CN(S(=O)(=O)c1ccc(OC(F)F)cc1)CC2 1875333016 VCJRGRQOKDHUOY-UHFFFAOYSA-N 396.415 2.993 0 50 GFAA COc1cc(SC)c(OC)cc1CN1CCC[C@@H](CN2CCN(C)CC2)C1 952982232 PHCRVARWKAJUSN-KRWDZBQOSA-N 393.597 2.885 0 50 GFAA COCCc1noc([C@H]2CCCCN2Cc2cc3c(cc2OC)OCCO3)n1 952986010 VZIMCBPNGQBUBG-OAHLLOKOSA-N 389.452 2.766 0 50 GFAA COc1cccc(C(=O)N2CC[C@H]3[C@@H](CCCN3C(=O)c3cc(C)nn3C)C2)c1 43619489 IRTSCUVVDYHLCW-HKUYNNGSSA-N 396.491 2.504 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Br)N1C[C@@H](CO)[C@@H](CCO)C1 1347591278 STOFSUOYZWFDED-UWVGGRQHSA-N 396.203 2.531 0 50 GFAA CN(C)c1cccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)c1 1565517140 DYDDXWMXSVOVLZ-UZLBHIALSA-N 378.476 2.524 0 50 GFAA CC(C)NS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCCc3c(O)cccc32)c1 190233288 NLXRMIHTXCPTTJ-GOSISDBHSA-N 388.489 2.886 0 50 GFAA Cc1nccn1-c1ccc(-c2noc(-c3cncc(N4CCOCC4)c3)n2)cn1 761921500 BLGORVGCTQFHQO-UHFFFAOYSA-N 389.419 2.524 0 50 GFAA Cc1ncoc1C(=O)N1C[C@@H]2OC(=O)N(CCc3cccc(Cl)c3)[C@@H]2C1 213355448 ORXKXDROUGEVQL-CABCVRRESA-N 375.812 2.524 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(S(=O)(=O)c3cc(-c4cc[nH]n4)oc3C)C[C@@H]21 1704330006 FKSMTWKNUQQDPM-QWQRMKEZSA-N 379.482 2.540 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(Cc3cc(=O)n4cc(Cl)ccc4n3)C1)CC2 1704324701 DFCBHYAEZHDEFS-OAQYLSRUSA-N 395.894 2.926 0 50 GFAA CC(C)Cc1nc([C@H](C)n2cnc3ccccc3c2=O)n(-c2ccnn2C)n1 1772814910 UQQMSZUZTFKORF-AWEZNQCLSA-N 377.452 2.519 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCc2nccn2C)Cc2ccccc2C1 11820323 JUKWFEJMSZTKCV-UHFFFAOYSA-N 388.515 2.748 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCC(OCc2cccnc2)CC1 12448248 MNYSLXCRMBSFTK-UHFFFAOYSA-N 395.438 2.682 0 50 GFAA C[C@@H](Cn1cncn1)Nc1ccc(-c2nc(Cc3ccc(F)cc3)no2)cn1 14950873 FLULGLMMTIHUFI-ZDUSSCGKSA-N 379.399 2.954 0 50 GFAA COc1ccc(NC(=O)c2ccc3c(c2)N(C)[C@@H]2CCCN2C3=O)cc1OC 169765786 YOHDEIMDQFZFRZ-IBGZPJMESA-N 381.432 2.968 0 50 GFAA CCn1ccc(C(=O)N[C@H]2CCCN(c3ccc(Br)cc3)C2=O)n1 1857530171 TWALQBHSAXTSBB-HNNXBMFYSA-N 391.269 2.591 0 50 GFAA Cc1nc(N2CCCC2)c2c(n1)C1(CC2)CCN(Cc2cn(C)nc2C)CC1 1857689341 NTYZYRFOOYLMIH-UHFFFAOYSA-N 380.540 2.907 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N(C)Cc4cc[nH]n4)C3)nc2c1 1857707948 BCMHKFKPTOQKNX-AWEZNQCLSA-N 383.452 2.825 0 50 GFAA O=C(CCc1cccc(O)c1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857715147 DPRUHYSXVRFGES-MZKRTTBSSA-N 392.455 2.626 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)N3CCC4(CCCCO4)CC3)CC2=O)s1 1857715403 PUEFAWGVBHGMFE-AWEZNQCLSA-N 392.525 2.576 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)cs1 1857735912 DCQBFWKGQPTAAS-HXUWFJFHSA-N 384.505 2.874 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCCc4ncc[nH]4)C3)nc2c1 1857740044 FNTCACUUGRTGQK-OAHLLOKOSA-N 397.479 2.915 0 50 GFAA Cn1nccc1[C@@H](CO)NC(=O)c1ccc(Br)c(C(F)(F)F)c1 458149082 HAJYUZXAXUVADS-LLVKDONJSA-N 392.175 2.665 0 50 GFAA O=C(CN1CCc2c(Cl)cccc2C1)N1CCC(C(=O)N2CCCC2)CC1 133773005 LLMMCRUUXHCQNM-UHFFFAOYSA-N 389.927 2.559 0 50 GFAA COc1c(O)cc2c(c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2 4212843 JRRUSQGIRBEMRN-HNNXBMFYSA-N 385.416 2.569 0 50 GFAA biogenic,in-vitro CC(C)CN(CCc1ccc(F)cc1)C(=O)Cn1nc(O)c2ccccc2c1=O 2325728771 SCQDXNMZMYFBMJ-UHFFFAOYSA-N 397.450 2.969 0 50 GFAA Cc1c(CNS(=O)(=O)c2ccn([C@H]3CC3(F)F)n2)noc1-c1ccccc1 2325812349 RGKRPKOVWLRAAK-AWEZNQCLSA-N 394.403 2.905 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)CC1 2325883982 PIQAGJZHWXCZHR-FUHWJXTLSA-N 397.302 2.835 0 50 GFAA CC(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 789888 NLXKPLDMKPUZHU-UHFFFAOYSA-N 387.461 2.682 0 50 GFAA CC[C@@H](Sc1nc(=O)cc(N)n1-c1ccccc1)C(=O)Nc1cc(C)on1 917844 NXMZHCYVZKVFML-CYBMUJFWSA-N 385.449 2.621 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(OC)c1OC 1109081 MHUNXAFMWDNINZ-UHFFFAOYSA-N 375.377 2.760 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCO2)N1CCN(c2cccc(Cl)c2)CC1 1115113 CCLCKBHJLKPYHI-UHFFFAOYSA-N 394.880 2.622 0 50 GFAA aggregator CCOC(=O)C1CCN(Cc2nc(-c3ccc(OC)c(OC)c3)no2)CC1 4195619 NWKNFOTVKJIAEQ-UHFFFAOYSA-N 375.425 2.529 0 50 GFAA COc1cc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)c(OC)cc1Cl 4302743 SNQPVKNWPGVTNX-UHFFFAOYSA-N 390.933 2.945 0 50 GFAA O=C(c1ccc(N2CCCCS2(=O)=O)cc1)N1CCN(c2ccccc2)CC1 5381134 ZTGYTZRFGKYJBO-UHFFFAOYSA-N 399.516 2.579 0 50 GFAA CC1=NN(C(=O)c2c(Cl)c(C(F)(F)F)nn2C)[C@](O)(C(F)(F)F)C1 6394421 UOSCQYCGWRMLKX-SECBINFHSA-N 378.660 2.565 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3C[C@H]2CN3Cc2ccc3c(c2)OCCO3)c(C)c1 12099516 XPXPMLWXMMGMIR-LPHOPBHVSA-N 380.444 2.765 0 50 GFAA O=C(c1cn([C@@H]2CCCN(Cc3ccc(F)cc3F)C2)nn1)N1CCCC1 12452726 CGVWWXQJHFODHK-MRXNPFEDSA-N 375.423 2.629 0 50 GFAA CCN(c1ccc(C(=O)Nc2ccc(OC)c(OC)c2)cc1)S(C)(=O)=O 13678195 FVJQXFNNLQDDDS-UHFFFAOYSA-N 378.450 2.742 0 50 GFAA CCc1cc(C(=O)NCc2c(C)ncc3c2CCN(C(=O)[C@@H](C)CC)C3)n(C)n1 14882559 IJYJOUZGMPCFIA-AWEZNQCLSA-N 397.523 2.547 0 50 GFAA COCCn1c(=O)c(CNC[C@@H]2COc3ccccc3O2)cc2cc(C)ccc21 15070968 URMOQSPXTXWNGF-LJQANCHMSA-N 394.471 2.886 0 50 GFAA COc1ccc(OC)c(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)c1 16649466 WDQBCXMWJIHLGH-UHFFFAOYSA-N 376.796 2.721 0 50 GFAA CCOC(=O)N1CCN(C[C@@H](O)COc2ccc(C)cc2C(C)(C)C)CC1 19867721 UFIHALQUDZXCST-QGZVFWFLSA-N 378.513 2.806 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](NCc2cccnc2)CN1Cc1cccc(Cl)c1 19938987 WVIZYODVHCWTAL-UXHICEINSA-N 386.927 2.992 0 50 GFAA COc1nccnc1N1CCC2(CC1)c1ccccc1[C@@H](N1CCCC1)[C@@H]2O 20200967 AYMQGKOSNVHAIP-MOPGFXCFSA-N 380.492 2.535 0 50 GFAA COc1ccc(CN2CCN(CC(C)(C)C)[C@@H](CCO)C2)c(OC)c1OC 20206831 DMHGUYGQBPSKBX-KRWDZBQOSA-N 380.529 2.627 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NCc2ccc(F)cc2)CN1Cc1ccc(Cl)cc1 32590327 WJVINTPGBWOKPT-OALUTQOASA-N 375.875 2.958 0 50 GFAA COC(=O)C[C@@H]1CC(=O)[C@@H]2C(=O)c3c(OC)ccc(Br)c3[C@@H]2C1 55529252 KIBDKRPJUGKECL-KOSWAMCASA-N 381.222 2.896 0 50 GFAA Cc1ccc2nc(-c3cc4n(n3)CCCN(C(=O)[C@@H]3CCCO3)C4)[nH]c2c1C 67742110 QIXXKBRVJMYQEP-SFHVURJKSA-N 379.464 2.955 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCCN(C)C)CCC(=O)N1Cc1ccc(F)cc1 71745795 ARXFALRSSFLGSJ-LJQANCHMSA-N 377.504 2.753 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)n[nH]1 71759578 YIWWMSBSLPSDMD-HXUWFJFHSA-N 395.551 2.711 0 50 GFAA O=C1CC2(CCN(C(=O)c3cc(C4CC4)n[nH]3)CC2)CN1Cc1ccccc1 72476248 CIIOKEQMNOQLHB-UHFFFAOYSA-N 378.476 2.942 0 50 GFAA CC(=O)N[C@@H]1CN(C(=O)c2c(C)nc3ccccn23)C[C@H]1c1ccc(C)cc1 77427014 MCWXUFYEFFIPGD-RBUKOAKNSA-N 376.460 2.695 0 50 GFAA CC(C)O[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91468485 NRAOHLBJIYYNOH-GOSISDBHSA-N 387.524 2.669 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccc4ncsc4c3)C2)CCC1=O 92107398 ZPYAGHCHIHUBNA-FQEVSTJZSA-N 387.505 2.788 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)c2c(C)nc3cc(C)ccn23)C1 95496587 XWRRYHPUILECCT-KRWDZBQOSA-N 381.480 2.814 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](N)C2)c2c(n1Cc1ccccc1F)CCCC2=O 95526414 WCIALKSWIQFSDS-INIZCTEOSA-N 383.467 2.605 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)c2ccc(CSC)o2)CC1 96138999 WNRCSXXKELUUNU-UHFFFAOYSA-N 391.541 2.835 0 50 GFAA COc1ccccc1-n1nc(CC2CCN(C)CC2)nc1-c1cnc(C)nc1 96141100 APQONLIISCPKBB-UHFFFAOYSA-N 378.480 2.926 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C(=O)N1CCCC[C@H]1C 112927724 CAONSSPEGISJCD-AOIWGVFYSA-N 385.508 2.587 0 50 GFAA O=C(c1ccccc1NCC(=O)N1CCCc2ccccc21)N1CCOCC1 124772792 VFKZPWNSKHUKRI-UHFFFAOYSA-N 379.460 2.550 0 50 GFAA O=C(CCc1nc(C2CCCC2)no1)N1CCC([C@@H](O)C(F)(F)F)CC1 131541127 LVQAIJXVIDVZRF-OAHLLOKOSA-N 375.391 2.822 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(c4ccc(C)cc4)C(=O)[C@@H]3N3CCCN23)cc1 136190275 VIWZXRJBDUVHCE-XUVXKRRUSA-N 377.444 2.539 0 50 GFAA Fc1cc2nc(-c3cnc(N4CCOCC4)nc3)[nH]c2cc1Br 154994157 LHKDFWFKOFLFSJ-UHFFFAOYSA-N 378.205 2.758 0 50 GFAA COC(=O)c1ncsc1S(=O)(=O)N[C@@H]1C[C@@H]2CCCc3cccc1c32 161965104 RHPMRRLJDGHEIL-WCQYABFASA-N 378.475 2.773 0 50 GFAA Cc1nsc(N2CCCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)CC2)n1 173350868 GEUJGXBKPMWAOW-SFHVURJKSA-N 385.537 2.550 0 50 GFAA CC(C)c1nn(C)c2sc(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)cc12 173352013 ZRTYTCMADFQZMC-SNVBAGLBSA-N 388.415 2.651 0 50 GFAA Cc1nccn1C[C@H](C)CNC(=O)[C@@H]1Cc2cc(Br)ccc2O1 194140939 YJWPDJBGXURLKJ-BZNIZROVSA-N 378.270 2.710 0 50 GFAA Cc1ccc(-c2ccc(CCC(=O)N[C@@H]3CCOC[C@H]3OCC(=O)O)o2)cc1 222229557 ZQPXKSZHOMEKRM-IEBWSBKVSA-N 387.432 2.563 0 50 GFAA O=C1CC[C@@H]2CN(c3nnc(-c4ccccc4)s3)CC[C@@H]2N1CCCCO 222519727 UPFPYYUFSLZAMT-SJORKVTESA-N 386.521 2.795 0 50 GFAA O=C(O)CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc2c(c1)OCC(=O)N2 263500748 SUWVPTKSNMINOP-AWEZNQCLSA-N 383.404 2.615 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 269024330 JJYBYAMOJHPLFQ-QGZVFWFLSA-N 399.896 2.750 0 50 GFAA CC(=O)NC[C@@H]1CCn2ncc(C(=O)Nc3cccc(C(F)(F)F)c3)c2C1 276747330 BUTMUEDOMUNWAY-GFCCVEGCSA-N 380.370 2.853 0 50 GFAA O=C([C@@H]1CCN(c2ccccc2Cl)C1)N1CCCN(c2cccnn2)CC1 290206443 IHMOKPDFSRPPBP-MRXNPFEDSA-N 385.899 2.695 0 50 GFAA CN(C[C@@H]1CCc2nccn2C1)S(=O)(=O)c1ccc2c(c1)C(C)(C)C(O)=N2 328630676 QDSKQBFSYNDXQU-ZDUSSCGKSA-N 388.493 2.645 0 50 GFAA O=C(c1sccc1S(=O)(=O)C(F)F)N1CCCN(C2CCCC2)CC1 363238965 MWTMCQNMKQWUBY-UHFFFAOYSA-N 392.493 2.835 0 50 GFAA CC(C)n1nnnc1-c1ccc(NC(=O)N[C@@H]2CCCc3nn(C)cc32)cc1F 367219945 PIHIZLJPZHMGGF-MRXNPFEDSA-N 398.446 2.993 0 50 GFAA COCCN1C(=O)C[C@H](CNCc2cc3ccccc3o2)[C@H]1c1cnn(C)c1C 424196130 ZDURMWUTAACGMV-VGSWGCGISA-N 396.491 2.801 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N2CCC[C@@H]2Cn2cccn2)cc1 534647826 JKJDRRSVHGSPIA-QGZVFWFLSA-N 380.452 2.656 0 50 GFAA CC[C@@H](NC(=O)N(C)Cc1cnn(-c2cccc(OC)c2)c1)c1nc(C)no1 584889507 KAQIGNJRVZOPIK-QGZVFWFLSA-N 384.440 2.865 0 50 GFAA CCc1ccc(NC(=O)c2nnc(COC(=O)c3ncccc3N)s2)cc1 780075434 YVAQICPZNAPUIM-UHFFFAOYSA-N 383.433 2.687 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCC[C@@H](c3nnc4ccccn34)C2)o1 825647623 ARPPREQQFLWPEY-CQSZACIVSA-N 395.492 2.982 0 50 GFAA Cc1cc2cc(NC(=O)C3CCN([C@H]4CCS(=O)(=O)C4)CC3)ccc2o1 827758417 ZXPKPBWAZDFGAJ-KRWDZBQOSA-N 376.478 2.579 0 50 GFAA O=C(N1CCOC[C@@H]1Cc1c[nH]c2ccccc12)C(F)(F)C1(O)CCCC1 952845484 CJFQQBHCLRBHKK-HNNXBMFYSA-N 378.419 2.878 0 50 GFAA CN(CCCOc1cccc(Cl)c1)S(=O)(=O)c1cc(C(N)=O)cs1 952985489 DXHIEAAQFKZYGU-UHFFFAOYSA-N 388.898 2.590 0 50 GFAA Cc1nn(C)c(C)c1CN(C1CC1)S(=O)(=O)c1cc(-c2cc[nH]n2)oc1C 952986536 FDRSLISARIJVBE-UHFFFAOYSA-N 389.481 2.682 0 50 GFAA Cc1cc2n(n1)CCN(S(=O)(=O)c1ccc(-c3c(C)noc3C)s1)C2 1506416876 MYJFNKFOPJTLKJ-UHFFFAOYSA-N 378.479 2.729 0 50 GFAA Cc1ccc(C(=O)N2CCCN(Cc3cccs3)CC2)cc1N1CCNC1=O 1506427634 YDALZAZEGDYWGC-UHFFFAOYSA-N 398.532 2.934 0 50 GFAA CC(C)[C@@H](C(=O)Nc1c2c(nn1C)CSC2)n1cnc2ccccc2c1=O 1529152007 ISGCKBCVNFZQJL-INIZCTEOSA-N 383.477 2.713 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1CC[C@](C)(O)[C@H](Cc2ccccc2)C1 1565509264 AJBXAIARCFLDPK-GCJKJVERSA-N 383.492 2.574 0 50 GFAA COCC1(CNC(=O)c2c(N3CCOCC3)noc2-c2ccccc2)CCC1 1704330853 LCUWVOSKCDLYMI-UHFFFAOYSA-N 385.464 2.725 0 50 GFAA O=C(c1ccnc(NC2CCN(C(=O)N3CCCC3)CC2)c1)N1CCCCC1 1704337828 GWMFAHHYZBTJDK-UHFFFAOYSA-N 385.512 2.800 0 50 GFAA CCc1nccn1CCC(=O)N1CCC2(CC1)OCCc1cc(OC)ccc12 1704340862 NUDGIQJGQMOYGE-UHFFFAOYSA-N 383.492 2.935 0 50 GFAA COc1ccc(-c2onc(N3CCC[C@@H](c4n[nH]c(C)n4)C3)c2C(=O)O)cc1 1772705833 AISFMDKQIQPFIR-CYBMUJFWSA-N 383.408 2.859 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cccc(OCc3ccccn3)c2)CC12CCOCC2 1775978021 OJFZVOXJWZGPAQ-FQEVSTJZSA-N 382.460 2.974 0 50 GFAA Cn1nc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)cc1C1CC1 1857673299 RSLNDFGRTBJDKX-JOCHJYFZSA-N 393.491 2.791 0 50 GFAA CC(C)N1C[C@H](C(=O)N2CCc3c(-c4ccccc4)nn(C)c3CC2)CCC1=O 1857673507 UOVZBOVOXKJMFI-GOSISDBHSA-N 394.519 2.661 0 50 GFAA CC1(C)CC(N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)CC(C)(C)N1 1857719182 GGMCUIBRLMTYHL-PMACEKPBSA-N 385.552 2.798 0 50 GFAA CC(C)(CO)CC(=O)N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857741245 KKFVCDZKBPZRHJ-NRFANRHFSA-N 375.513 2.695 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](CN)C2)sc2nc(Cc3ccccc3)nc(N)c12 1875311859 CORLDABMVLPXPP-OAHLLOKOSA-N 395.532 2.984 0 50 GFAA Cc1cc(NC(=O)N(Cc2ccccc2)C[C@@]2(O)CN3CCC2CC3)sn1 1875340027 IQWYMVLQJZHRRN-FQEVSTJZSA-N 386.521 2.942 0 50 GFAA Cc1ccccc1OCCN1CCN(C(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)CC1 1875394715 TYLNTALWLJSHJX-SJORKVTESA-N 398.507 2.577 0 50 GFAA CC(C)(CN)CC1CN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C1 2325813117 MUFZKSPBTSOLCY-GOSISDBHSA-N 379.495 2.977 0 50 GFAA CN1CCN(C(=O)c2cccc(-n3nccc3-c3ccccc3)c2)[C@H](CCO)C1 2325855605 HUBDDWXVJZIBCY-OAQYLSRUSA-N 390.487 2.678 0 50 GFAA O=C(NCC1=Nc2ccccc2S(=O)(=O)N1)c1cc2c(Cl)cccc2[nH]1 2325878675 YASVFTODJUXGLJ-UHFFFAOYSA-N 388.836 2.573 0 50 GFAA O=C(Nc1ccccc1Cl)c1ccc(S(=O)(=O)N2CCOCC2)cc1 902472 CUFNCAFZRKZKTC-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA CCN(CC)C(=S)S[C@H]1CC(=O)N(c2ccc(NC(C)=O)cc2)C1=O 1148760 OBTSMJKKLRPEJE-AWEZNQCLSA-N 379.507 2.637 0 50 GFAA O=C(C1CCN(Cc2ccccn2)CC1)N1CCN(c2ccccc2F)CC1 4600540 CFJJCUBLFZTETA-UHFFFAOYSA-N 382.483 2.782 0 50 GFAA CCOc1ccc(OCC)c(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c1 4809331 PLEKOYUYTRQDMN-UHFFFAOYSA-N 392.433 2.730 0 50 GFAA O=C(C(=O)N1CCC[C@H](N2CCN(c3ccc(F)cc3)CC2)C1)c1ccccc1 55182457 IRQJJAZSGOSZGF-NRFANRHFSA-N 395.478 2.822 0 50 GFAA C[C@H](CCn1cccn1)NC(=O)C1(Oc2ccc(Cl)cc2)CCNCC1 77538536 ZCDMDSFPGZQRHW-OAHLLOKOSA-N 376.888 2.633 0 50 GFAA Cc1nc(C2CCNCC2)cc(N2CCc3[nH]cnc3[C@@H]2c2cccnc2)n1 67821517 OAEBWFFSGCPSSC-NRFANRHFSA-N 375.480 2.522 0 50 GFAA C[C@H](O)Cc1cn(C2CCN(CC(C)(C)CN3CCCCCC3)CC2)nn1 63855627 AOJIKDPSJISXKV-SFHVURJKSA-N 377.577 2.741 0 50 GFAA Cc1nn(CCCNC(=O)c2noc3c2C[C@@H](C)CC3)cc1Br 2804404 GLLJQDGSPIZNFT-JTQLQIEISA-N 381.274 2.887 0 50 GFAA Cn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)Cc2cc(Cl)ccc2F)cn1 328631648 REQYFAXKPQKBOR-JKSUJKDBSA-N 387.864 2.552 0 50 GFAA COc1ccc(N2CCN(Cc3n[nH]c4cc(OC)ccc34)[C@@H](C)C2=O)cc1 72156202 IRSWABJQONMPSZ-AWEZNQCLSA-N 380.448 2.817 0 50 GFAA CCOC(=O)[C@@H](Oc1ccccc1OC)[C@H](O)c1ccc(OC)c(OC)c1 196166502 WXFAFGNQMYMUDX-MOPGFXCFSA-N 376.405 2.757 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(C(=O)c2ccccc2Cl)C1 95379520 ZBROELYWHIKAAJ-AWEZNQCLSA-N 384.871 2.733 0 50 GFAA CC(C)C(=O)N1CCn2nc(CNC(=O)c3cc4cccc(F)c4o3)cc2C1 426387216 FVQBLHJOHHIQKM-UHFFFAOYSA-N 384.411 2.697 0 50 GFAA Cc1ccccc1-c1noc([C@H]2CCC(=O)N(CCCN3CCCC3=O)C2)n1 91475370 HUXRJFLYPGLBSO-INIZCTEOSA-N 382.464 2.764 0 50 GFAA Nc1ccc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)cn1 95360362 KLLWFLFSMOSBNM-UHFFFAOYSA-N 392.503 2.751 0 50 GFAA COc1ccc2c(c1)CCC[C@@H](NC(=O)Cc1cnn(-c3ccccc3)n1)C2 1875331255 AVECCNIWKSXTBK-GOSISDBHSA-N 376.460 2.882 0 50 GFAA O=C(c1ccccn1)N1CCC(C(=O)N2CCO[C@H](c3ccccc3)C2)CC1 952983157 OFZLJLQXJSFPIG-FQEVSTJZSA-N 379.460 2.534 0 50 GFAA O=C(c1ccc(NC[C@@H]2CCN(c3ccccc3F)C2)nc1)N1CCOCC1 882388762 UFVIUVRYEAZLER-INIZCTEOSA-N 384.455 2.632 0 50 GFAA Cc1ccc(CNC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCCC4)cc1 169778342 AEEAHEHVGAHUFL-UHFFFAOYSA-N 378.476 2.858 0 50 GFAA CCNC(=O)Cn1cc(-c2csc(-c3ccc(OCC)c(OC)c3)n2)nn1 887369050 FSODGBQLTNOGLQ-UHFFFAOYSA-N 387.465 2.612 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1 186970272 JZZVSSDRLOLJKR-OAHLLOKOSA-N 375.454 2.566 0 50 GFAA CCOc1ccc2c(c1)[C@@H](NCc1c(C)nn(C)c1N1CCOCC1)CCO2 187545503 KURCEZBLTXZONE-IBGZPJMESA-N 386.496 2.577 0 50 GFAA Cc1noc2ncnc(N(C)C[C@@H](O)COc3ccccc3C(F)(F)F)c12 193390367 ZZKDEPBIUHVWMM-LLVKDONJSA-N 382.342 2.821 0 50 GFAA O=C(c1cncc(F)c1)N1CCCN(C(=O)c2c[nH]nc2C2CCCCC2)CC1 1529120570 DBLMGHKTKRHWTJ-UHFFFAOYSA-N 399.470 2.980 0 50 GFAA Nc1ncc2c(n1)[C@@]1(CCCN(C(=O)CCc3c[nH]c4ccccc34)C1)CC2 1704350788 OPULGJWPYSILLK-QFIPXVFZSA-N 375.476 2.979 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H]2CCCN(C)C2)ccc1F 1704309614 YVCUDKGSKVQWNA-ZDUSSCGKSA-N 390.459 2.627 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)[C@H]1C[C@@H]1c1ccccc1 1616158047 ZHIOHQAMBLFABA-UXHICEINSA-N 380.444 2.666 0 50 GFAA Cc1nc(CN2C[C@@H]3CN(C(=O)C4CCC4)C[C@@]3(CCc3ccccc3)C2)n[nH]1 1772708418 BGVIIWLSJLGYEM-NFBKMPQASA-N 393.535 2.806 0 50 GFAA COc1ccc(NC(=O)[C@H](C)Sc2nnnn2-c2ccccc2OC)cc1 11692796 RKPHUFQRBZAYBH-LBPRGKRZSA-N 385.449 2.799 0 50 GFAA CCOC(=O)N1CCC(N2C(=O)CC[C@@H]2CCNCc2ccccc2F)CC1 11784094 DCQFTVNEDAXZBC-QGZVFWFLSA-N 391.487 2.917 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)c3cnc(C)cn3)C2)cc1 12478069 ZNFAEFHPWYGUBV-IBGZPJMESA-N 382.508 2.820 0 50 GFAA Cc1ccc(Cl)c(O[C@H](C)C(=O)N2CCN(C(=O)c3ccco3)CC2)c1 13329743 MZWJEVFQNCULJN-CQSZACIVSA-N 376.840 2.993 0 50 GFAA CN(C)CCN(C)C(=O)c1cccc(OC2CCN([C@H]3CCSC3)CC2)c1 14979268 XQPDMEBWCYCNIT-SFHVURJKSA-N 391.581 2.669 0 50 GFAA O[C@H](COc1cccc(CN2CCc3[nH]ncc3C2)c1)CN1CCCCCC1 15065625 KGDUMMXTFFBKGJ-FQEVSTJZSA-N 384.524 2.584 0 50 GFAA Cc1ccnc(NS(=O)(=O)c2csc(C(=O)Nc3cc(C)on3)c2)c1 16650741 POZDUVICJBEUCC-UHFFFAOYSA-N 378.435 2.801 0 50 GFAA CC(=O)N[C@@H](CC(C)C)C(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857672418 CFBNSAQPQJEUMZ-FQEVSTJZSA-N 382.508 2.565 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)[C@H]2CCCNCC2)CC1 1857718671 NSXSASUIDFGTLC-HNNXBMFYSA-N 386.540 2.676 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4nn(C)c5cccc(Cl)c45)[C@@H]2CC(=O)N13 1857732255 IZYXFBWKRSDGTM-QKLQHJQFSA-N 388.899 2.784 0 50 GFAA CS(=O)(=O)N1CCC(N(Cc2cc(F)c(F)cc2F)CC(F)F)CC1 225791792 DDABDTFKPHZMKM-UHFFFAOYSA-N 386.386 2.595 0 50 GFAA O=C(O)CN(C(=O)c1cc(Cl)ccc1Br)C1CCOCC1 238107808 YVIQUUCFLXBVTO-UHFFFAOYSA-N 376.634 2.808 0 50 GFAA Cn1c(C(=O)NC2CCC(C(=O)O)CC2)cc2cc(Br)cnc21 909156897 ZMLITNWSZJTUOJ-UHFFFAOYSA-N 380.242 2.709 0 50 GFAA Cc1nc(C(=O)Nc2cnn(C3CCN(C)CC3)c2)nn1-c1ccccc1Cl 2325760316 ICLLHOFWFBZKIH-UHFFFAOYSA-N 399.886 2.945 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H]3C[C@H](C(C)(C)C)NC3=O)CCCC2)cc1OC 2325784226 KUGIBJVYZFLPSG-CRAIPNDOSA-N 388.508 2.935 0 50 GFAA N[C@@H](CC(=O)N1CCCn2nc(CO)cc2C1)c1ccc(-c2ccccc2)cc1 2325792317 UJGZDYQRWFMWLO-QFIPXVFZSA-N 390.487 2.865 0 50 GFAA CC(C)NC(=O)Nc1ccc(NC(=O)C[C@@H](O)c2ccccc2C(=O)O)cc1 2325850627 DAFKFDATASQHAD-QGZVFWFLSA-N 385.420 2.977 0 50 GFAA CSc1nnc(CNC(=O)c2[nH]nc3c2CCCC3)n1-c1ccccc1C 12030415 ZLVIMKYFXGDHPW-UHFFFAOYSA-N 382.493 2.830 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2ccco2)c(=O)c(C(=O)N2CCC[C@@H](C)C2)c1 12056783 BVKAHJQRYSGWPD-MRXNPFEDSA-N 399.491 2.899 0 50 GFAA O=S(=O)(c1cccnc1)N1CCc2onc(-c3ccc(F)c(F)c3)c2C1 12305020 GKMFPUDTQITOAY-UHFFFAOYSA-N 377.372 2.762 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSC1CCCCC1)c1ccc(F)cc1 16248288 LSKXMLQRQXRRGJ-UHFFFAOYSA-N 388.530 2.774 0 50 GFAA O=C(O)Cn1ccc(NC(=O)OC(c2ccccc2)c2ccccc2)nc1=O 16696939 VPWKJWIKZUONJA-UHFFFAOYSA-N 379.372 2.666 0 50 GFAA in-vitro O=C(NC1CC1)c1cn(C2CCN(Cc3cccc4ncccc34)CC2)nn1 19335882 JPZUHPIPHVRILN-UHFFFAOYSA-N 376.464 2.556 0 50 GFAA COc1cccc(NC(=O)[C@@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)c1 19814833 ZTIOYFSUSSAYQB-AWEZNQCLSA-N 395.444 2.600 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc4c(c3)OCCO4)C[C@@H]2CCO)c1 20912492 PBVVYKOKRQMYKM-FQEVSTJZSA-N 398.503 2.535 0 50 GFAA COc1ccc(-c2nn3c(N4CCN(C)CC4)cc(C)nc3c2C)cc1OC 23118836 VAJDBDFRIKTTRC-UHFFFAOYSA-N 381.480 2.782 0 50 GFAA Cc1ccc(OCCN(C)C(=O)c2ccc(Cn3nnnc3C)cc2)c(C)c1 55271931 DOEUMEPABYHFNG-UHFFFAOYSA-N 379.464 2.798 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCc3ccsc3)C2=O)c1 67472666 OWWPGILGJJFSBL-LJQANCHMSA-N 378.469 2.539 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)n1 67613313 IAHJWQPNRWCKHC-UHFFFAOYSA-N 387.434 2.626 0 50 GFAA O=C(C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1)N1CCOCC1 67895568 GQLHIBJXDJPIJV-UHFFFAOYSA-N 392.503 2.708 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CN(C)Cc3cccs3)C2=O)c1 67982154 HWAUURASZBATLR-HXUWFJFHSA-N 392.496 2.881 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)N2CCC(O)(c3ccc(C)cn3)CC2)c1C 67982429 BANKUGICLGEGED-UHFFFAOYSA-N 385.464 2.635 0 50 GFAA O=C(CCCn1ccnc1)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72157974 IDGAXXSMJMIMKW-LJQANCHMSA-N 376.460 2.734 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC[C@@]2(CCC(=O)N(C3CC3)C2)C1 77489586 ZBMIUSZMFOLDOH-JOCHJYFZSA-N 384.524 2.615 0 50 GFAA CC(C)(C)CN1C[C@]23C=C[C@H](O2)[C@@H](C(=O)N2CCc4ccc(F)cc4C2)[C@@H]3C1=O 77505891 PYEMTYMZCINUMD-LVBDUCALSA-N 398.478 2.539 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccc(F)cc3)C2)CN1CCc1c[nH]cn1 91304148 FTKWWFITKHTTRI-OAQYLSRUSA-N 384.455 2.636 0 50 GFAA CCSCCC(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91575285 TXZYMOZZYTWZQJ-UHFFFAOYSA-N 375.538 2.956 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1noc(C3CCCC3)n1)CC2 91676914 ZPHSMXQELFQEMV-UHFFFAOYSA-N 390.528 2.968 0 50 GFAA CN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1cccc(N3Cc4ccccc4C3)c1)C2 95375035 FFDCRAFAXCTFHL-PZJWPPBQSA-N 375.472 2.900 0 50 GFAA CCc1cc(N2CCN(c3ncnc4c3Cc3ccccc3OC4)CC2)ncn1 95521341 LCPKEAMSWGCILM-UHFFFAOYSA-N 388.475 2.639 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Oc1cccc2cccnc12 104295004 JNZQRBWGCFZPOE-HXXCKNJQSA-N 388.423 2.583 0 50 GFAA C=CC(=O)Nc1cc(NC(=O)CNC(=O)c2ccc(F)cc2F)ccc1F 126309033 PBBQJPBCRMVOMK-UHFFFAOYSA-N 377.322 2.597 0 50 GFAA Cc1c(NC(=O)[C@@H](C)N2CCc3ccccc32)cccc1C(=O)N1CCOCC1 141023202 IPNNJFQOYBXNKT-QGZVFWFLSA-N 393.487 2.857 0 50 GFAA COc1cc(NC(=O)c2ccc3c(c2)N(C)[C@H]2CCCN2C3=O)cc(OC)c1 169765948 QFOQTRLUYFWGPL-LJQANCHMSA-N 381.432 2.968 0 50 GFAA CCCN1CCC(CNC(=O)N2CCn3c(nnc3-c3ccccc3)C2)CC1 174520566 IOFXLOLYONNWFA-UHFFFAOYSA-N 382.512 2.592 0 50 GFAA Cc1cc(C(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 176103218 KVNFSXHLVLXGCQ-GOSISDBHSA-N 377.492 2.871 0 50 GFAA C[C@H](NC(=O)c1ccnc(-n2ccnc2)c1)C1CCN(CC(F)(F)F)CC1 189675768 TVKYPIKLSOFTNT-ZDUSSCGKSA-N 381.402 2.660 0 50 GFAA CCN1CCCN(C(=O)N[C@@H](C)c2noc(-c3ccc(Cl)cc3)n2)CC1=O 189874329 DYNINBVTFMILEV-LBPRGKRZSA-N 391.859 2.715 0 50 GFAA C[C@H](N)[C@H](C)C(=O)NCCSCCOc1cccc(Br)c1 192048397 RMKGWJGTDUWMHD-RYUDHWBXSA-N 375.332 2.661 0 50 GFAA Cc1nc2c(s1)CCC[C@@H]2NS(=O)(=O)c1cccc(C(=O)N(C)C)c1 215345833 GMYMKZCEKRGGEN-AWEZNQCLSA-N 379.507 2.509 0 50 GFAA CSc1ccc2c(c1)CCN(C(=O)CC[C@]1(CCC(=O)O)CCC(=O)N1)C2 219423922 HYHNIWIVKPBCGZ-FQEVSTJZSA-N 390.505 2.587 0 50 GFAA CN1C(=O)N(CCS(=O)(=O)c2ccc(Cl)cc2)C(=O)C12CCCCC2 225501057 PVVWYMLQQXLWOG-UHFFFAOYSA-N 384.885 2.711 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCCCC[C@H]1CO)n1c(S)nnc1-c1cccs1 252516368 SFXIRZAYMYSRFM-FRRDWIJNSA-N 380.539 2.914 0 50 GFAA O=C(CSCc1ccccn1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 275712306 SJIUJTMWGOXMBW-GOSISDBHSA-N 398.532 2.990 0 50 GFAA CCN1CCO[C@@H](CNC(=O)N[C@H](C)c2cn(C)nc2C)[C@@H]1c1ccccc1 286760675 IDBKNDJSKBAKKH-XPGWFJOJSA-N 385.512 2.551 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4c(-c5cnn(C)c5)nc5ccccn45)[C@@H]1[C@H]3C2 288979462 DMHIXAMXFNWOGQ-XFJQVIQYSA-N 392.463 2.622 0 50 GFAA COc1ccc2c(c1F)CC[C@H]2NC1CCN(S(=O)(=O)CC(C)C)CC1 290196468 GIPHJTYNIOEWSD-QGZVFWFLSA-N 384.517 2.861 0 50 GFAA CCn1c(=O)c(O)nc2cc(C(=O)N3CCC[C@H](c4ccncc4)C3)ccc21 328592073 VSDLVSKEKJCWGE-INIZCTEOSA-N 378.432 2.537 0 50 GFAA Cn1cc(C(=O)N2CCCC[C@@H]2c2nnc(-c3ccccc3F)o2)ccc1=O 328603103 DSLJUTUMBSBCDB-MRXNPFEDSA-N 382.395 2.942 0 50 GFAA C[C@@H]1CCCN(C(=O)C2CCN(C(=O)N[C@@H]3CCN(c4ccccc4)C3)CC2)C1 363392382 HGLYOWFXRQGLAR-UYAOXDASSA-N 398.551 2.945 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 364212992 NMDWOVYZTOSRNR-QGZVFWFLSA-N 396.882 2.999 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)C(C)(C)C)C(C)C)[C@H]1Oc1ccccc1 409948579 BSSGKOHVPZVPCR-WJFTUGDTSA-N 390.524 2.915 0 50 GFAA CC(C)N1C[C@@]2(CCCN(C(=O)NCc3nccn3C(C)C)C2)CCC1=O 534644089 KLTQPWZGCBMLAC-FQEVSTJZSA-N 375.517 2.787 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)C(=O)NCCc1noc(C2CCC2)n1 584889409 CRYHHSVTNUEVQU-UHFFFAOYSA-N 380.452 2.907 0 50 GFAA O=C(NC[C@@]1(O)CCCNC1)c1cccc(-c2ccc(-c3ccno3)cc2)c1 584903262 AFWPUSXDOUPWSK-JOCHJYFZSA-N 377.444 2.853 0 50 GFAA COc1ccc(Cn2nc(C)nc2[C@@H]2CC(=O)N(Cc3cccnc3)C2)cc1 670453956 RJEBKEIXFGSIMU-GOSISDBHSA-N 377.448 2.555 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)c2ccco2)C1)c1cnc(Nc2ccccc2)nc1 670455403 MOGFTNMUSYUWNP-QGZVFWFLSA-N 391.431 2.848 0 50 GFAA O=C(C1CC1)N1CCC[C@@H](CNS(=O)(=O)Cc2ccc(Cl)cc2F)C1 670456200 AYWIDAGNGMAGFP-LBPRGKRZSA-N 388.892 2.547 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)Cc2ccc(OC(F)(F)F)cc2)C1 779858314 ZVPAUABARAYUDF-ZIAGYGMSSA-N 385.342 2.808 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)C[C@@H]3NC(=O)c4ccccc43)cc2)CC1 823765050 QZKZEWGHJZRSLZ-FQEVSTJZSA-N 379.460 2.973 0 50 GFAA C[C@@H](NC(=O)N1CCC[C@@](O)(CC(=O)N(C)C)C1)[C@@H]1CCCc2ccccc21 888093863 ZYWSUPUYOJJZEF-TVTNDZMWSA-N 387.524 2.510 0 50 GFAA COCCCN1CC[C@H](CNCc2ccccc2OCCCn2ccnc2)C1 952982200 JWSDAYFWHRWHHZ-HXUWFJFHSA-N 386.540 2.800 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(C(=O)c3cnc(C)nc3-c3ccccc3)CCN21 1616082567 LOOIZFVJQUOHLP-MOPGFXCFSA-N 380.492 2.777 0 50 GFAA O=C([C@@H](c1cccnc1)N1CCCC1)N1CCC(Cc2ccc(O)nc2)CC1 1772809406 ALEXQILAEMNDKK-OAQYLSRUSA-N 380.492 2.800 0 50 GFAA Cc1cc(F)ccc1C(=O)N1C[C@@H](c2cncn2C)[C@H](CNC(=O)C2(C)CC2)C1 1775962770 DXTLSYUDZITWAH-CRAIPNDOSA-N 398.482 2.640 0 50 GFAA O=C(CCc1ccccc1)N1CCC[C@]2(C1)CN(c1ccncc1)CC[C@H]2O 1857682718 MBCACEJZJBRSRT-FYYLOGMGSA-N 379.504 2.894 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2Cc2ccc3c(c2)CCO3)cn1 1857685354 SDHSRTFZABNRGK-GOTSBHOMSA-N 396.535 2.783 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCCCNc1cccnc1 1857709088 DNSNHLKLBFWKEI-MRXNPFEDSA-N 394.479 2.843 0 50 GFAA CC[C@@]1(C(=O)NCCCn2ccnc2)C[C@@H]2CC[C@H]1N2C(=O)c1ccsc1 1857711772 LRTBCPVMRAGXSL-SQGPQFPESA-N 386.521 2.924 0 50 GFAA O=C1CC2(CCC(C(=O)Nc3cccc(Cn4ccccc4=O)c3)CC2)CN1 1875300960 XSPDQWCLYKEEFW-UHFFFAOYSA-N 379.460 2.532 0 50 GFAA Cc1cc(NC(=O)[C@@H](N)Cc2cccc(Cl)c2F)ccc1C(=O)N(C)C 1875312984 FIAJQVPMYGOCTM-INIZCTEOSA-N 377.847 2.998 0 50 GFAA CS(=O)(=O)NC(=O)c1cn(Cc2ccccc2Cl)nc1-c1ccccc1 1875390574 QXZRFWSBPOBVMI-UHFFFAOYSA-N 389.864 2.941 0 50 GFAA Cc1ccc(CC(=O)N[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875402557 HEJUXSROXACPEL-PWIZWCRZSA-N 379.460 2.950 0 50 GFAA COCCCn1c(-c2cnc(C)[nH]2)nnc1N1CCc2ccc(F)c(F)c2C1 2325769413 SAMAQOPRHNASLB-UHFFFAOYSA-N 388.422 2.854 0 50 GFAA O=C(NCCCCCCNC(=O)[C@H]1CC1(F)F)c1coc(C(F)(F)F)n1 2325871949 AXLNCSVWTDNAHP-SECBINFHSA-N 383.317 2.755 0 50 GFAA O=C1NCc2c1cccc2C(=O)N1CCCC[C@@H]1C(=O)OCc1ccccc1 2325885795 XKJQBILMTJAARC-LJQANCHMSA-N 378.428 2.668 0 50 GFAA CCOC(=O)[C@@]1(NC(=S)N(CC)CC)Sc2cc(C)ccc2NC1=O 1192806 BICLEBNYIWFZJS-KRWDZBQOSA-N 381.523 2.515 0 50 GFAA COc1cc(CNCCSC)ccc1OC[C@@H](O)CN1CCCCCC1 11842586 HZVXPOCVBWBRDZ-SFHVURJKSA-N 382.570 2.764 0 50 GFAA CC(C)CCNC(=O)c1cn(CC(C)C)cc(C(=O)NCc2ccccn2)c1=O 11913337 KANFNYQSSLSZQA-UHFFFAOYSA-N 398.507 2.605 0 50 GFAA C[C@@H](NC(=O)c1ccco1)c1nnc2n1CCN(CCCc1ccccc1)CC2 12281081 MKXXLKLGXUNNIO-QGZVFWFLSA-N 393.491 2.853 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2CCC[C@@H](Nc3ccc(F)cc3)C2)CC1 12589200 MIYNQECKERZJSD-GOSISDBHSA-N 376.476 2.622 0 50 GFAA O=c1c2c3c(sc2ncn1Cc1ccccc1)C[C@H](N1CCOCC1)CC3 14964417 FJMHGCZWJBBNDW-MRXNPFEDSA-N 381.501 2.696 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cs2)no1 16649296 UGHGJNDRVDQJPX-GHMZBOCLSA-N 383.495 2.963 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3ccccc3F)CC2)c(OC)c1OC 19552795 YFAREUPXSHTBLX-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA O=c1cc(Cc2cccc(F)c2)nc(-c2cccc(CN3CCOCC3)c2)[nH]1 19741818 FYAVGEPCWGRJAW-UHFFFAOYSA-N 379.435 2.999 0 50 GFAA CCn1ncc(NC(=O)c2ccc([C@H]3CCCN3C(=O)CSC)s2)n1 19794354 PAASIUIIOKKINT-LLVKDONJSA-N 379.511 2.638 0 50 GFAA CCOC(=O)N1CCN(C[C@H](O)COc2ccc(OC)cc2C(C)(C)C)CC1 19809551 UTLRJQAYMIBHKS-INIZCTEOSA-N 394.512 2.507 0 50 GFAA COc1c(Cl)cc(Cl)cc1CNCCc1ccc(S(N)(=O)=O)cc1 19872256 LIKRUJRMODFVBT-UHFFFAOYSA-N 389.304 2.982 0 50 GFAA COc1ccc(OC)c(N2C(=O)C[C@H](Sc3ccccc3C(=O)O)C2=O)c1 19880941 FNDNZUCZCNTWLQ-INIZCTEOSA-N 387.413 2.826 0 50 GFAA COC[C@@H]1CCCN(Cc2cnc(S(=O)(=O)C(C)C)n2CCC(C)C)C1 20450379 XAVIXUQZTBXCQO-QGZVFWFLSA-N 385.574 2.970 0 50 GFAA O=C(c1cn(CCN2CCCCC2)nn1)N1CCCC[C@@H]1CCc1ccccn1 20453772 AZAIRCJVHUDLMJ-HXUWFJFHSA-N 396.539 2.787 0 50 GFAA COc1cc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)ccc1F 71479676 MBTBRPCXXGJZBN-QGZVFWFLSA-N 389.515 2.789 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1)N1CC=CC1 71589647 GJEAYZZLDJPXLA-OAQYLSRUSA-N 379.548 2.729 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c1 72115687 AUXBFCXZYWPWNK-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c(C)c1 72115985 ZUQNOXYZBFYOPT-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=C(N[C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1)c1cccc2cccnc12 72140056 ARTNSXDGCQMDAA-GOSISDBHSA-N 377.419 2.947 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCOc2ccc(CO)cc2C1 77488800 GYSBKOMTGQHRJV-UHFFFAOYSA-N 379.416 2.583 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)CCn3nnc4ccccc43)C2)cc1 95359264 IEYZPPXSSUHISF-QGZVFWFLSA-N 378.432 2.926 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95392390 NUOXNRQPCCJGPU-KRWDZBQOSA-N 377.448 2.750 0 50 GFAA O=C(NC[C@@H](c1ccccn1)N1CCOCC1)Nc1ccc2ncsc2c1 95501118 KIFRGXIXVSSKNJ-KRWDZBQOSA-N 383.477 2.886 0 50 GFAA COCCC(=O)N1CCC(Oc2ccc(C(=O)N3CCC[C@H](C)C3)cc2)CC1 95516937 ANKDOMOKJXOSAE-KRWDZBQOSA-N 388.508 2.965 0 50 GFAA COc1ccc(NC(=O)N[C@H](C)CCc2ccco2)cc1NS(C)(=O)=O 96133298 ATOJXDGSYZQMKO-GFCCVEGCSA-N 381.454 2.803 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)N(C)CCCc2nccn2C)cc1Cl 97742665 HVUHVQBKODMBPA-UHFFFAOYSA-N 377.876 2.872 0 50 GFAA CCOc1ccccc1[C@H](CC)NS(=O)(=O)c1ccc2c(c1)C(=O)NCC2 116337637 FIEVGGXQQRLGDL-SFHVURJKSA-N 388.489 2.801 0 50 GFAA O=C1CCc2cc(C(=O)Nc3cc(F)cc(N4CCOCC4)c3)c(F)cc2N1 136487388 PHXWMRUMIPNOII-UHFFFAOYSA-N 387.386 2.938 0 50 GFAA CCc1c(C(=O)N2CCC[C@H](N)C2)cnn1-c1ccc(Br)cc1 158212453 OIXGJUWDKWULNH-ZDUSSCGKSA-N 377.286 2.761 0 50 GFAA O=C1c2c(-c3nc(-c4ccsc4)no3)nnn2CCN1Cc1ccccc1F 169765698 UXWKZKYNCMYKMK-UHFFFAOYSA-N 396.407 2.852 0 50 GFAA O=C1[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)N1CCS(=O)(=O)c1ccc(Cl)cc1 170592491 UJOARQYFMKELOE-KCXAZCMYSA-N 396.896 2.709 0 50 GFAA Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@H]3CC(=O)N(C(C)(C)C)C3)n2)n1 174515304 RQIYGKSINZYHQJ-ZDUSSCGKSA-N 389.887 2.667 0 50 GFAA O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@H](Oc2cccnc2)C1 179748637 FRGMXIQVKULNSO-FQEVSTJZSA-N 381.480 2.556 0 50 GFAA COc1cccc2c1CCN(C(=O)C[C@H]1CN(Cc3ccccc3)CCO1)C2 182748386 MDWBFKVFGHPLDS-FQEVSTJZSA-N 380.488 2.871 0 50 GFAA CC(C)Cc1ccc(CN2CCn3nc([C@H](O)c4ccnn4C)cc3C2)s1 219820664 CVGZEZPUBUKJJF-FQEVSTJZSA-N 385.537 2.974 0 50 GFAA Cn1c(C(=O)NCc2cccc(N3CCOCC3)n2)c(Cl)c2ccccc21 274780003 KCYOWGXAGZHAGW-UHFFFAOYSA-N 384.867 2.993 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[S@@](=O)C[C@H](C)C3)cc2F)n1 297640766 IJPGVXMQPYKFGG-MZHQLVBMSA-N 378.473 2.861 0 50 GFAA COc1ccc(CC2CCN(C(=O)[C@H](Cc3ccccc3)NC(N)=O)CC2)cc1 363208659 WZBVSWCOAXERIR-NRFANRHFSA-N 395.503 2.756 0 50 GFAA O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(-c2cccnc2)cc1 363430838 IFDGZZUSIYMRQQ-RTBURBONSA-N 377.444 2.540 0 50 GFAA CN(Cc1csc(Br)c1)C(=O)[C@H]1CC12CCS(=O)(=O)CC2 373570106 UQMRKVWEVHNTSK-LLVKDONJSA-N 392.340 2.684 0 50 GFAA C[C@H]1[C@H](NC(=O)c2cccc(NC(=O)C3CC3)c2)CC(=O)N1Cc1ccccc1 390832872 IXIDUKNOWMOFER-MGPUTAFESA-N 391.471 2.955 0 50 GFAA Cc1cccc(-c2cccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CNC[C@H]4C3)c2)c1 419512773 KXQTWEYONSPJPQ-BHDDXSALSA-N 391.515 2.783 0 50 GFAA Cc1ccsc1[C@H](CNC(=O)Nc1ccc2c(c1)OCC(=O)N2C)N(C)C 534631820 JYFHLIOEGRLHNM-HNNXBMFYSA-N 388.493 2.836 0 50 GFAA COc1cccc(CN2CCN(C(=O)NCc3ccc(C)cc3C)CC2=O)c1 534651727 AEVCUMIKUGTBIH-UHFFFAOYSA-N 381.476 2.866 0 50 GFAA COc1cccc(SCC(=O)NC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)c1 670447213 IDLKYKLYMGFIKQ-JNKARSBBSA-N 399.520 2.638 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCNC(=O)[C@@H]2c2cccc(F)c2)c1 823531411 SZVLMWHPBXQTQN-NRFANRHFSA-N 397.450 2.807 0 50 GFAA C[C@H](C(=O)NCc1nncn1C1CCCCC1)c1nnc(O)c2ccccc12 827654310 IVOXQJJYCYLJPD-ZDUSSCGKSA-N 380.452 2.852 0 50 GFAA CCn1cc(CS(=O)(=O)Cc2csc(COc3ccc(F)cc3)n2)nn1 899959311 AUQYJSBRUOXMFW-UHFFFAOYSA-N 396.469 2.588 0 50 GFAA O=C(N[C@@H](c1ccc(Cl)c(F)c1)c1nn[nH]n1)[C@@H]1CCOC2(CCCC2)C1 907414435 WRAWYTVKCLQIIA-DOMZBBRYSA-N 393.850 2.937 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCCN(S(C)(=O)=O)C2)c2ccc(C)c(C)c2n1 952973455 XOYWOLMLTGDEQG-MRXNPFEDSA-N 389.521 2.561 0 50 GFAA Cc1ccsc1CN(CC(C)C)C(=O)CCN(C)[C@H]1CCS(=O)(=O)C1 952974749 NHWLCOPOUBHYNU-INIZCTEOSA-N 386.583 2.550 0 50 GFAA COc1ccc(-n2cnnc2)cc1NC(=O)[C@@H](C)N1CCc2ccccc2C1 952978500 LZDHAXCWOZGJLC-OAHLLOKOSA-N 377.448 2.661 0 50 GFAA COc1ccc2nc(CCN(C)C(=O)[C@H](Cc3cnc[nH]3)n3cccc3)[nH]c2c1 952978964 WKDUTBIBORGBJE-IBGZPJMESA-N 392.463 2.581 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)c2ccc3oc(O)nc3c2)n1 952979286 SAQCFQBHOMUKAJ-LBPRGKRZSA-N 378.410 2.566 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)NCc3ccc(C(F)(F)F)cc3)CC2=O)s1 1857713103 DSVNTVVTOXUBIA-NSHDSACASA-N 384.383 2.535 0 50 GFAA COc1ccccc1C(=O)NC[C@H]1[C@H]2CN(c3ncccc3F)C[C@]23CC[C@H]1O3 1857734795 RSWLVVSCHUBWPE-XKIVJUNCSA-N 397.450 2.643 0 50 GFAA Cc1cc(C[C@@H]2CN(c3cc(-c4ccc5c(c4)OCO5)ccn3)C[C@@H]2O)on1 1875250684 WXOKCNZAIACEQP-AEFFLSMTSA-N 379.416 2.814 0 50 GFAA N[C@H](C(=O)N1CCC[C@@H](NCC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 1875315032 FSSPCQJURMDKGQ-OLZOCXBDSA-N 383.336 2.848 0 50 GFAA C=CC(=O)N1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cnn(C(C)C)c2)Cc2ccccc21 1875389599 UWNDWPJMTYQYQI-CEXWTWQISA-N 378.476 2.828 0 50 GFAA O=C(NCc1nc(C(F)(F)F)no1)[C@H]1[C@H]2CC[C@@]1(c1ccnn1C1CCC1)C2 1875393737 RGEJAWBWTFUDOZ-IXBGWNDUSA-N 395.385 2.994 0 50 GFAA O=C(Cc1ccccc1OC1CCCC1)N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O 1875400671 IJGXRCBETDZYTH-PWIZWCRZSA-N 383.492 2.703 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)NCc2cccc3ncsc23)CC1=O 2356145359 MPYJESTZTYOAIX-AWEZNQCLSA-N 381.457 2.974 0 50 GFAA CC(C)n1cc(C(=O)N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)cn1 2356165866 ITYLOUPIMOECGA-DENIHFKCSA-N 399.491 2.765 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N3CCC(OC(F)(F)F)CC3)cn12 2356166950 PWDJNHHQQSHKEA-AWEZNQCLSA-N 386.374 2.560 0 50 GFAA COc1ccc(C)cc1N(C)C(=O)c1c(C)oc2ncnc(N3CCOCC3)c12 8596113 QXPIDOFMICCWDY-UHFFFAOYSA-N 396.447 2.961 0 50 GFAA COC(=O)c1ccc(C)c(S(=O)(=O)N[C@H](c2ccccc2)C(C)(C)CO)c1 225657950 QYBPNSCPMFLASI-GOSISDBHSA-N 391.489 2.820 0 50 GFAA COc1ccc(S(=O)(=O)C[C@](C)(O)C(=O)Nc2ccc(Cl)cc2)cc1 1388617 HDKOTSXOFOSMGX-KRWDZBQOSA-N 383.853 2.512 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2C(=O)CCn2cccc2)s1)N1CCOCC1 20855461 PYMRJQJXFQISMS-INIZCTEOSA-N 387.505 2.776 0 50 GFAA Cc1ccc(-n2cccn2)cc1NCC(=O)Nc1cccc(C(=O)N(C)C)c1 252482868 DPKUELXNVOGXKD-UHFFFAOYSA-N 377.448 2.933 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cn1cncn1 173060695 ITKOQCTYONLFNY-FQEVSTJZSA-N 389.503 2.621 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCCN(Cc4ccc(F)cc4)CC3)cc2n1 77353505 LBOVELZXWUKFCJ-UHFFFAOYSA-N 381.455 2.833 0 50 GFAA O=C(NC1CC1)c1noc([C@H]2CCCN2c2ncnc3c2oc2ccccc23)n1 364705396 LHLOGYBYFXBTCW-CYBMUJFWSA-N 390.403 2.993 0 50 GFAA COc1ccc(CN(C)C(=O)CCc2cc3n(n2)CCCNC3)c2cccnc12 72481300 WNFBGUJCUSVAFM-UHFFFAOYSA-N 393.491 2.524 0 50 GFAA CCn1cc(CN(CCOC)C(=O)c2c(C)nc3ccc(Cl)cn23)cn1 215511568 XJAYOHIYCCDOJX-UHFFFAOYSA-N 375.860 2.801 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)C1 237504751 IDEJKXWVEHUESO-QFBILLFUSA-N 386.517 2.860 0 50 GFAA COCc1ncc(C(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)s1 285327731 XYPKSFRIABCOBB-HNNXBMFYSA-N 395.912 2.746 0 50 GFAA Cc1ccc(N2CC[C@@H](Nc3cccc(C(=O)N4CCOCC4)c3)C2=O)cc1 177145215 RRQBNHCDBJQDDV-HXUWFJFHSA-N 379.460 2.685 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3cnccn3)csc2C1 426548489 JJFGJFXUZKFOCB-UHFFFAOYSA-N 397.504 2.674 0 50 GFAA COc1cccc(-c2ncc(CNC(=O)c3cnc(C4CC4)[nH]c3=O)s2)c1 91873219 SZQAESZLSXJRAE-UHFFFAOYSA-N 382.445 2.709 0 50 GFAA CC(C)N(CCO)Cc1ccccc1OC[C@@H](O)CN1CCc2ccccc2C1 95515168 YWOVDFZDLYUGBU-QHCPKHFHSA-N 398.547 2.687 0 50 GFAA O=C(C1CCC1)N1CC[C@]2(O)CCN(Cc3cccc(OC(F)F)c3)C[C@@H]2C1 95374663 UWVAZUMRAQPABM-DYESRHJHSA-N 394.462 2.873 0 50 GFAA Cc1ccc(C(=O)NCc2cc(-c3ccccc3)n[nH]2)cc1N1CCNC1=O 91725713 VUUDGJPJJNDXSH-UHFFFAOYSA-N 375.432 2.845 0 50 GFAA CC(C)=CCN1CC2(CCN(C(=O)c3c(Cl)c(C)nn3C)CC2)CC1=O 91319865 IOYMBIWKTRVICN-UHFFFAOYSA-N 378.904 2.803 0 50 GFAA Cc1cccn2c(CC(=O)N[C@@H]3CCCN(Cc4cccc(O)c4)C3)cnc12 97729586 GNTIITWENONDBN-GOSISDBHSA-N 378.476 2.672 0 50 GFAA Cc1cc(N2CC[C@H](N3CCN(C)CC3)[C@H](CCCO)C2)nc2ccccc12 91365038 PNDVNJBVBTYYRV-KNQAVFIVSA-N 382.552 2.758 0 50 GFAA CCCn1cc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)c(C)n1 91985530 JMXYAWMJEMMKLS-UHFFFAOYSA-N 384.528 2.620 0 50 GFAA O=C(NCCCc1nc2ccccc2s1)N1CCN(c2cnccn2)CC1 534587746 MSQVIFJTHNHEEW-UHFFFAOYSA-N 382.493 2.551 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCCc4ccc(C)cc4)c3CO2)cc1 263616311 IAVYGVFXWAQDFV-FQEVSTJZSA-N 392.459 2.839 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)C[C@H]2NC(=O)c3ccccc32)cc1 67833852 IATGOVHCLAGJEB-GOSISDBHSA-N 376.416 2.576 0 50 GFAA O=C([C@H](O)c1ccccc1)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1940196423 KWPIHCZISDQGNJ-QGZVFWFLSA-N 379.460 2.600 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC3(CC2)OCCc2ccsc23)cc1 487451989 YKPGKPSKQFNXGK-UHFFFAOYSA-N 391.514 2.856 0 50 GFAA COc1cccc([C@@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397519 CRRHRSHMNOBXDB-SJLPKXTDSA-N 397.523 2.733 0 50 GFAA O=S(=O)(Cc1c(Br)cccc1Br)N1CCCO1 1875340083 KKMCWVWXSXNAPN-UHFFFAOYSA-N 385.077 2.679 0 50 GFAA COc1cc(C)ccc1S(=O)(=O)N(Cc1ccccn1)C[C@H]1CCCO1 952984302 ZORYAKJJHSNZMK-QGZVFWFLSA-N 376.478 2.769 0 50 GFAA CCCc1nc(C(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)cs1 952984885 UCUVEGOXULEWLA-UHFFFAOYSA-N 389.477 2.586 0 50 GFAA CC(=O)NCc1ccc(C(=O)N(C)CCN(C)C(=O)[C@H]2CC[C@H]3C[C@H]3CC2)cc1 1775986867 MNYDNUIMQGUOQI-MZADTFQBSA-N 399.535 2.679 0 50 GFAA O=C(NCc1ccccc1-n1cccn1)NC1CCN(CC(F)(F)F)CC1 171205643 LMOZNYQEDFVIDE-UHFFFAOYSA-N 381.402 2.698 0 50 GFAA CCn1cnc2c(c1=O)CCN(C(=O)COc1cc(Cl)cc(Cl)c1)C2 192043740 KCJBHZGQZZTNFT-UHFFFAOYSA-N 382.247 2.534 0 50 GFAA O=C(c1cnn(Cc2ccccc2)c1)N1CCCN(Cc2cccnc2)CC1 1506420915 COSGCKOSUDTNHU-UHFFFAOYSA-N 375.476 2.675 0 50 GFAA O=C(c1ccnc(NCCn2ncc3ccccc3c2=O)c1)N1CCCCC1 1529160172 YRWKOXMRBBXPOS-UHFFFAOYSA-N 377.448 2.530 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N[C@H]2CC[C@@H](N)CC2)cc1 1704315445 DVSAMZMBBVSVCZ-IYBDPMFKSA-N 384.480 2.950 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2C)CCCN(C(=O)Cn2nc(C)nc2C)C1 11661741 YNEYPVHREDTHLO-QFIPXVFZSA-N 398.507 2.618 0 50 GFAA CCc1ccc(CN2CCC3(CC[C@H](CNC(=O)[C@H]4CCCO4)O3)CC2)o1 11966636 QECGDOWTEFFQFL-IEBWSBKVSA-N 376.497 2.651 0 50 GFAA CCN(Cc1ccncc1)Cc1ccc(OC)cc1OC[C@@H](O)CN1CCCC1 12442926 XTMSGWUHJRZTIT-NRFANRHFSA-N 399.535 2.948 0 50 GFAA Cc1ccc(CN2CCC3(CC2)C(=O)N(CCCc2ccncc2)C(=O)N3C)o1 14755476 WDELJCZBYNAPIS-UHFFFAOYSA-N 396.491 2.844 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@H](OCc3cccnc3)C2)nn1 15065254 JSGIKLXNSHRUCS-FQEVSTJZSA-N 391.475 2.851 0 50 GFAA COc1cc(Cl)ccc1OCc1cc(C(=O)N2CCN(C)[C@H](C)C2)no1 15071922 OJZQWOYFDKHSEE-GFCCVEGCSA-N 379.844 2.692 0 50 GFAA CNc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(-n3cccn3)cc2)ccn1 19334099 GWJRXESRCBMULS-SFHVURJKSA-N 390.447 2.552 0 50 GFAA COc1ccccc1C(=O)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169780439 YKLITHLGCYCYOF-UHFFFAOYSA-N 380.370 2.903 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(Cc2cnn3cccnc23)CC1 1857694246 HJPIRWVLJXAVFT-UHFFFAOYSA-N 384.461 2.553 0 50 GFAA Cc1csc2c(N3CC[C@H]4[C@@H]3CC(=O)N4CCc3cccnc3)ncnc12 1857707309 MWFIQNZZRCKXQT-HOTGVXAUSA-N 379.489 2.817 0 50 GFAA CCCOc1ccccc1CNC(=O)[C@@H]1CC(=O)N(c2nnc(CC)s2)C1 1857727956 GYKNQHFIONGAIH-CQSZACIVSA-N 388.493 2.559 0 50 GFAA COCCOC1CCN(c2cc(N[C@H]3CCCO[C@@H]3C(C)C)ncn2)CC1 328631394 KMUXQVOFYJWQJB-FXAWDEMLSA-N 378.517 2.724 0 50 GFAA O=C(N[C@H]1C[C@H]2CCCCN2C1=O)c1cc2ccc(C(F)(F)F)cc2nc1O 822302728 RQGHKQKEKKRFKY-DOMZBBRYSA-N 393.365 2.842 0 50 GFAA CCOc1ccc([C@H](CC(=O)O)NS(=O)(=O)c2ccc(C)cc2)cc1OC 4111093 QLRQXDZZOUKNCI-INIZCTEOSA-N 393.461 2.897 0 50 GFAA Cc1c(C(=O)N2CCN[C@H](C)C2)sc2nc(Cc3ccccc3)nc(N)c12 2325795238 SCLJEGJUZHJQKD-GFCCVEGCSA-N 381.505 2.607 0 50 GFAA O=C(C[C@H]1Oc2ccccc2NC1=O)Nc1cccc([C@H]2CCCC(=O)N2)c1 895189018 RCPRTOHDRFVNFU-CRAIPNDOSA-N 379.416 2.756 0 50 GFAA COc1ccc(C(=O)C[C@@]2(O)C(=O)N(C)c3ccc(Cl)cc32)cc1OC 1068808 CRQFZKZFZAKPGG-IBGZPJMESA-N 375.808 2.794 0 50 GFAA Cc1ccc(S(=O)(=O)NCC(=O)OCc2ccc(Br)cc2)cc1 1120689 SGLMMUUGDJQWRO-UHFFFAOYSA-N 398.278 2.779 0 50 GFAA C/C(=C/c1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 1135372 FXHPWMRZHNDWCH-NXVVXOECSA-N 386.473 2.750 0 50 GFAA Cc1ccc(S(=O)(=O)NCC(=O)OCc2ccccc2Br)cc1 2881648 MRQKTMJWJDMPGR-UHFFFAOYSA-N 398.278 2.779 0 50 GFAA CC[C@@H]1C(=O)N=C(SCC(=O)Nc2nc(-c3ccccc3)cs2)NC1=O 3664373 AWNUMOYWHCOVFB-UHFFFAOYSA-N 388.474 2.520 0 50 GFAA O=C(O)CN1C(=O)c2ccc(Oc3ccc(Br)cc3)cc2C1=O 4173600 NPLWXBMBTKKPPL-UHFFFAOYSA-N 376.162 2.922 0 50 GFAA CC(=O)Oc1ccccc1C(=O)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1 4867546 CDZMFMBKCOUJIT-AWEZNQCLSA-N 393.486 2.503 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987183 KGFLYLCKHGUYDY-GDBMZVCRSA-N 376.363 2.567 0 50 GFAA O=C(c1cnccn1)N1CCC(CO)(Cc2ccccc2C(F)(F)F)CC1 11842691 UUZLQFPDUVQJJF-UHFFFAOYSA-N 379.382 2.953 0 50 GFAA Cc1c([C@H](C)NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)cnn1C 11879219 AIBAJMAJSLRLRT-NSHDSACASA-N 384.392 2.515 0 50 GFAA CN(C)[C@H]1CCN(C(=O)c2cc(COc3cccc(C(F)(F)F)c3)[nH]n2)C1 11936465 QGSDQIMSYGSJAG-AWEZNQCLSA-N 382.386 2.784 0 50 GFAA C[C@]1(C2CCN(C(=O)c3ccc(Oc4ccccc4)o3)CC2)NC(=O)NC1=O 12134432 KIHCAPIODVFRSU-HXUWFJFHSA-N 383.404 2.522 0 50 GFAA CCOC(=O)C[C@@H]1CCCCN1C(=O)c1cn(Cc2ccccc2Cl)nn1 12439177 HXKIDEWEBBWDQR-HNNXBMFYSA-N 390.871 2.928 0 50 GFAA COc1cc(-n2nnc(C(=O)Nc3ccc(C(C)=O)cc3)c2N)ccc1Cl 16649093 ASKAKYXAIGCMIJ-UHFFFAOYSA-N 385.811 2.966 0 50 GFAA Cc1ncc2c(c1-c1noc(CCC3CC3)n1)CCN(C(=O)c1ccno1)C2 19146188 HRSNFDNALNEFOH-UHFFFAOYSA-N 379.420 2.969 0 50 GFAA CCn1cnnc1CN(C)c1ccc(-c2nc(COc3ccccc3)no2)cn1 19758044 PMLDVWUIDAFBDJ-UHFFFAOYSA-N 391.435 2.958 0 50 GFAA COc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCCCN(C)C)cc1 19898246 BUQNAGUPWNCAHE-CAPFRKAQSA-N 381.476 2.534 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCc2[nH]nc(CSc3ccccc3)c2C1)C(C)C 20389669 OERJAGBVHKRMEH-LJQANCHMSA-N 386.521 2.747 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(C(C)=O)cc3)n2)c(F)c1 49551100 VKRZXILGCHLXGZ-UHFFFAOYSA-N 395.390 2.899 0 50 GFAA C[C@H](C(=O)N1CCC(c2[nH]ncc2-c2cccc(F)c2)CC1)N1CCCC1=O 67842959 CHADPNLBIIRKMD-CQSZACIVSA-N 384.455 2.933 0 50 GFAA O=C(O)Cc1cc(C2CCN(C(=O)c3cc(-c4ccccc4)on3)CC2)n[nH]1 67847116 ULRAFJMKWUIQKU-UHFFFAOYSA-N 380.404 2.712 0 50 GFAA CNC1CCN(C(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71751207 YNSXSLIQPUHYEG-XMMPIXPASA-N 391.515 2.744 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(CC)cc1)CC2 91664727 HBIFVTXIVOHNTI-UHFFFAOYSA-N 380.492 2.898 0 50 GFAA C[C@@H](C(=O)O)N1CC2(CCC1=O)CCN(CCSc1ccccc1)CC2 91858235 JPQHQQSFYCBRMN-INIZCTEOSA-N 376.522 2.956 0 50 GFAA COCCCN1CC2(CCN(Cc3ccc(OC)cc3OC)CC2)CC1=O 95381460 XJVYPYSQNWJAAN-UHFFFAOYSA-N 376.497 2.555 0 50 GFAA CCn1nc(C)c(CCNc2nc3c(c(=O)[nH]2)Cc2ccccc2OC3)c1C 95502544 RBOZWQSMSZYWAB-UHFFFAOYSA-N 379.464 2.741 0 50 GFAA Cc1ccc2c(NC(=O)N3CCc4[nH]nc(C(=O)N(C)C)c4C3)cccc2n1 96162459 SLXIPHACGCILPN-UHFFFAOYSA-N 378.436 2.558 0 50 GFAA COc1ccccc1NC(=O)[C@@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1c(OC)cccc12 101959250 UDDBGPSXEQREKG-FTRWYGJKSA-N 399.472 2.586 0 50 GFAA Cc1noc(C2CC2)c1NC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O 156611577 QYTZJQMKVZLCTL-UHFFFAOYSA-N 375.450 2.825 0 50 GFAA Cc1cccc2[nH]c(CCC(=O)NCc3ccnc(O[C@H]4CCOC4)c3)nc12 163081128 VAWOQLBFTCTQOQ-INIZCTEOSA-N 380.448 2.683 0 50 GFAA O=C(Nc1nc2c(s1)CCC2)[C@@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 169772935 XHXLCWDSDGYCNI-SECBINFHSA-N 385.424 2.639 0 50 GFAA Cc1nc(C(=O)N2CCN3CCC[C@H]3C2)nn1-c1c(Cl)cccc1Cl 170877308 TVOMZESRSFXCOM-LBPRGKRZSA-N 380.279 2.803 0 50 GFAA C[C@@H]1CN(C(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)CCCO1 171267635 PLOCKKPTMQWEGY-MRXNPFEDSA-N 394.537 2.891 0 50 GFAA C[C@H](C(=O)Nc1ccccc1N1CCC(O)CC1)n1nnc(-c2ccccc2)n1 173674689 UAWBMILSSRRBHK-OAHLLOKOSA-N 392.463 2.501 0 50 GFAA O=C(c1c[nH]nc1-c1cccc(OC(F)F)c1)N1CCN2CCCC[C@@H]2C1 173889071 DJRWPWGNBPBYDK-CQSZACIVSA-N 376.407 2.988 0 50 GFAA CCN1CCN(C(=O)c2cnc(-c3ccc4c(c3)CCO4)s2)C(C)(C)C1=O 188101856 IVDOQMKFHJWLNU-UHFFFAOYSA-N 385.489 2.828 0 50 GFAA COc1ccccc1-c1nc(C2CCN(C(=O)c3nnc(C)s3)CC2)no1 191280538 ITINUDSZMISTIL-UHFFFAOYSA-N 385.449 2.925 0 50 GFAA CCC(CC)C(=O)N1CCC(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)CC1 194271353 GCQUXOKKPFBGRA-FQEVSTJZSA-N 399.535 2.835 0 50 GFAA CC(C)c1nc(CN2C[C@H]3CN(Cc4cccs4)C[C@@]3(C(=O)O)C2)co1 215575141 MAPYPOKJVGCJPY-LIRRHRJNSA-N 375.494 2.878 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CCO[C@@H](CC(=O)O)C1 237669411 ZKKOKBRYVANBAC-HNNXBMFYSA-N 391.855 2.517 0 50 GFAA O=C(N[C@H](CC(=O)N1CCC(C(=O)O)CC1)c1ccccc1)c1ccccc1 238023226 YVIHPCHBVOYHKA-LJQANCHMSA-N 380.444 2.871 0 50 GFAA Cc1cc(OC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)cc(C)c1Cl 239339149 LTDXGLOQYGSKQK-WKLICJCCSA-N 385.847 2.915 0 50 GFAA Cc1nc(-c2ccc(CNC(=O)[C@@H](C)n3c(=O)oc4ccccc43)cc2)no1 244763919 OXXVWTZQSBJQOI-GFCCVEGCSA-N 378.388 2.830 0 50 GFAA O=C(CN1CC[C@@H]2CCCC[C@H]2C1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 247806541 ZUTGZBUZGCQQJA-PMACEKPBSA-N 399.535 2.572 0 50 GFAA CCc1nnc([C@@H]2CN(S(=O)(=O)c3cc(Cl)sc3Cl)CCO2)o1 275368492 WTSNCTDAGUHJSE-ZETCQYMHSA-N 398.293 2.763 0 50 GFAA O=C1C[C@H](C(=O)NC[C@@H]2Cc3cccc(-c4cncnc4)c3O2)c2ccccc21 299759954 REAUDBHKDYAPCM-JXFKEZNVSA-N 385.423 2.934 0 50 GFAA Cn1cc(C(=O)N2CC[C@@H](c3cccc(Oc4ccccc4)c3)C2)c(O)nc1=O 360388606 HITXGDQYBKHGQY-MRXNPFEDSA-N 391.427 2.908 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(NC(=O)c3cccnc3)c2)c1 363216209 FWOCTWCBYVCNNO-UHFFFAOYSA-N 399.414 2.870 0 50 GFAA O=C(Nc1ncccc1CN1CCc2ccccc2CC1)c1cc2n(n1)CCO2 377909424 IKCBZZBPYIMQTA-UHFFFAOYSA-N 389.459 2.524 0 50 GFAA Cc1nc(N)ccc1-c1cccc(C(=O)N2CCC3(CC2)CN(C)C(=O)O3)c1 426404232 JZOPYMPYOHPXRS-UHFFFAOYSA-N 380.448 2.696 0 50 GFAA Cc1ccc(CN2CCN(C(=O)N[C@@H](C)CCCC(C)(C)O)CC2=O)cc1C 426500318 SIQFYGSCCUWOTH-SFHVURJKSA-N 389.540 2.987 0 50 GFAA COc1cc(Cl)cc(C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)c1 432005424 FFWHHEKQYJJKLN-ZDUSSCGKSA-N 375.856 2.899 0 50 GFAA NS(=O)(=O)N1CCc2ccc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)cc21 493965767 WDJBWAWQDDIGGH-CVEARBPZSA-N 391.880 2.648 0 50 GFAA COc1cccc(CN2CCC3(CC2)CN(C[C@H]2CCOC2)CCO3)c1F 824794509 QHJGNQWFVJKXPC-QGZVFWFLSA-N 378.488 2.538 0 50 GFAA Cc1ncnc(N2CCN(C3CCN(C(=O)c4ccccc4)CC3)CC2)c1C 952972064 ASCDQLOUNXYTAW-UHFFFAOYSA-N 379.508 2.520 0 50 GFAA O=C(c1ccncc1)N1CCC(NCc2nc(Cc3cccs3)no2)CC1 1506415823 CYMUDUAMYFFDFR-UHFFFAOYSA-N 383.477 2.511 0 50 GFAA CN(c1ccc(C(=O)Nc2cnn(Cc3ccccc3)c2)cc1)S(C)(=O)=O 1506431602 QVWXRQAGPZVBGP-UHFFFAOYSA-N 384.461 2.580 0 50 GFAA O=C(c1cccs1)[C@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cn2)C1 1529142251 IQKGRRTVFGUVJK-INIZCTEOSA-N 385.489 2.715 0 50 GFAA Cn1cnc2c(c1=O)CCN(C(=O)N[C@H]1CCCc3c(F)cc(Cl)cc31)C2 1775957857 QDQYRQVQOSZPRQ-INIZCTEOSA-N 390.846 2.718 0 50 GFAA COc1ccc(CN(C(=O)[C@@H]2C[C@@H]2C(=O)O)c2ccc3c(c2)OCO3)c(OC)c1 1775965304 SQSIMGNPNDHDOI-CVEARBPZSA-N 399.399 2.686 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N[C@H]1CC[C@@H](NC(=O)C2CCOCC2)C1 1857688739 YSZKJKGKDFNDHM-DLBZAZTESA-N 394.899 2.607 0 50 GFAA CCCN1CCOC2(CCN(C(=O)c3ccnc4ccccc34)CC2)CC1=O 1857694262 IEAKIPCSWSQKGQ-UHFFFAOYSA-N 381.476 2.869 0 50 GFAA CNC(=O)c1cccnc1N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857700505 VNUMLINPHRFHFO-QFIPXVFZSA-N 395.507 2.719 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NCc3cccc(Cl)c3C)CC2=O)s1 1857721158 CEAFITYKEUNZQE-GFCCVEGCSA-N 378.885 2.732 0 50 GFAA COc1cc(F)ccc1C(=O)N1CC[C@@]23O[C@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857730064 IYODXRCNXNIVFX-JQVVWYNYSA-N 396.418 2.749 0 50 GFAA COCCn1nc(Cc2cccc(Cl)c2)nc1[C@H]1CC[C@H]2OCCN[C@@H]2C1 1857733878 CUEWDNRSIUOICM-CGTJXYLNSA-N 390.915 2.793 0 50 GFAA CCOc1cc(CN2C[C@@H]3OCCC(=O)N(C)[C@H]3C2)cc(Cl)c1OCC 1857740793 NOUMOJLGZLKMSP-RDJZCZTQSA-N 382.888 2.569 0 50 GFAA CCCCN1CCC[C@@]2(CCc3c(N4CC(O)C4)nc(-c4cccnc4)nc32)C1 1875250481 DAIPUUXYAFIQBR-HSZRJFAPSA-N 393.535 2.799 0 50 GFAA C[C@H](NC(=O)c1ccnc(O)c1)C1CCN(C(=O)c2coc(C3CCC3)n2)CC1 1875303378 RHDOJVFTBUVYSR-ZDUSSCGKSA-N 398.463 2.713 0 50 GFAA COCc1cccc(S(=O)(=O)Nc2cnc(Br)c(OC)c2)c1 1875316923 IUHCVIKKZYVMFH-UHFFFAOYSA-N 387.255 2.800 0 50 GFAA Cc1cn(Cc2ccccc2)[nH]c1=NC(=O)c1cccc(N2CCCNC2=O)c1 1875336556 HBJARGHLDUXQER-UHFFFAOYSA-N 389.459 2.834 0 50 GFAA CNC(=O)N(C)c1ccc(Nc2ncc(C(C)C)c(N3CCNCC3)n2)cc1 2325770965 AMORUQQNRPAZDW-UHFFFAOYSA-N 383.500 2.529 0 50 GFAA N[C@@H]1CCc2cc(C(=O)N3CCC(F)(F)[C@@H](C(F)(F)F)C3)ccc2NC1=O 2325774966 LOCBDMKQNCEPCE-YPMHNXCESA-N 391.340 2.558 0 50 GFAA NCc1cccc(-c2ccc(C(=O)N[C@@H]3C[C@H](Cn4cccn4)C[C@H]3O)cc2)c1 2325793400 SORKYWTXZZEGQB-MTNREXPMSA-N 390.487 2.578 0 50 GFAA O=S(=O)(NC1CN(c2ccncc2)C1)c1cc2nc(Cl)ccc2s1 2325856019 ZEBOCMXKVUQEES-UHFFFAOYSA-N 380.882 2.512 0 50 GFAA COc1ccc(CCCC(=O)N2CCC[C@]3(CCc4c[nH]c(=N)nc43)C2)cc1 2356146596 MPNHAEIDTLMFID-QFIPXVFZSA-N 380.492 2.727 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2ccc(OC)c(Cl)c2)C1=O 2356149893 YBNOEIMJGGCQHP-IBGZPJMESA-N 380.872 2.592 0 50 GFAA Cc1cc(N2CCO[C@@H](c3nnn(C)n3)C2)c2ccc(C(F)(F)F)cc2n1 2356150015 IILRQNDQXLIPPZ-OAHLLOKOSA-N 378.358 2.663 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2ccc(CN3CCCC3)o2)CC[C@H]1O 2356169929 MCYKRFBTJCIBNG-WIYYLYMNSA-N 392.496 2.589 0 50 GFAA Cc1cc(C)n(CC2(CNC(=O)c3ccc(-c4cncc(N)n4)cc3)CC2)n1 2356170049 RZONETNIDWKJOA-UHFFFAOYSA-N 376.464 2.749 0 50 GFAA C[C@H]1CN(C(=O)c2cc(Cl)cn2C)CCN1C(=O)c1cc(Cl)cn1C 114413465 OCQCBGFGZYWOSW-NSHDSACASA-N 383.279 2.657 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@H](N2CCN(c3ccc(F)cc3)CC2)C1 55309832 RPCNTXPPIKUDCX-QFIPXVFZSA-N 396.510 2.967 0 50 GFAA CCSCCn1c(=O)n(Cc2ccc(F)cc2)c2ncc(C(=O)O)cc21 55227121 JYOXYZUSTNSPJH-UHFFFAOYSA-N 375.425 2.837 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)N2CCCN2[C@H]3c2ccc(Cl)cc2)cc1 100628322 FQAIRYRCTPLSPA-FHWLQOOXSA-N 397.862 2.884 0 50 GFAA CC(=O)N1CCN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CC1 20500976 MHCFIOCAIRSNSM-UHFFFAOYSA-N 391.475 2.975 0 50 GFAA CN1CCCC[C@@H]1CN1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1 424664389 OZPLPHSWMKTDIL-GOSISDBHSA-N 395.494 2.849 0 50 GFAA Cc1ccc(-c2nc(NCCN3CCOCC3)ncc2-c2cncnc2)cc1 65530774 FCWPDSKCGKSGQN-UHFFFAOYSA-N 376.464 2.653 0 50 GFAA Cc1ccc(C)c2c1NC(=O)[C@@H]2CC(=O)NCc1ccccc1-n1cncn1 65490017 GKSAHGVVZIQHEF-MRXNPFEDSA-N 375.432 2.626 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3nc4c(s3)C[C@H](C)CC4)CC(=O)N2C)cnn1C 328640148 XFIJWVDOSHEPAO-TUXXCZFBSA-N 387.553 2.619 0 50 GFAA O=C1CC[C@@H](NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C(=O)N1 153355728 DZRXYXTZPPEUFG-GFCCVEGCSA-N 396.230 2.502 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)cc1 72117344 HPJQGTMRJRIDJF-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA CN(C)c1ncc(Br)cc1C(=O)N1CCC(NCC2CC2)CC1 237064171 GKKLIHHJLIULIN-UHFFFAOYSA-N 381.318 2.514 0 50 GFAA Cc1noc(-c2ccccc2C(=O)N2CCC(NC(=O)c3ccoc3C)CC2)n1 172956364 ZLKFVFNFCFRZTF-UHFFFAOYSA-N 394.431 2.981 0 50 GFAA CN1CCCC[C@@H]1CCNC(=O)C1(c2ccc(S(C)(=O)=O)cc2)CCC1 219970820 RRAXXMMJAMIYDJ-QGZVFWFLSA-N 378.538 2.502 0 50 GFAA Cc1cccc(C)c1OC1CCN(C(=O)[C@H]2CC23CCS(=O)(=O)CC3)CC1 375127111 BDKQOKUFXWOVCT-GOSISDBHSA-N 391.533 2.888 0 50 GFAA O=C(CCC1CCN(c2ncccn2)CC1)N[C@H]1CCN(Cc2ccccc2)C1 77002426 CKYFXOXQKNGLLD-NRFANRHFSA-N 393.535 2.864 0 50 GFAA CN1CCN([C@@H]2CCCCN(C(=O)c3cccn3Cc3cccs3)C2)CC1 175994179 RTVWRCXPOYMVRK-GOSISDBHSA-N 386.565 2.840 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H]1CCCN(c2cnccn2)C1 220503779 VYUDHJIREAHKQQ-KRWDZBQOSA-N 377.448 2.768 0 50 GFAA Cc1cc(N2CCC(NC(=O)N3CCCC[C@H]3c3ncc[nH]3)CC2)nc(C)n1 176899495 CSUQNOHLURZZHV-KRWDZBQOSA-N 383.500 2.722 0 50 GFAA Cc1nn(CC(=O)N[C@@H]2COCC[C@@H]2OCc2ccccc2)c(C)c1Cl 222936292 KPHRGSZSJGKAHP-SJORKVTESA-N 377.872 2.644 0 50 GFAA Nc1cccc(-c2cccc(C(=O)N3CCC[C@H](CN4CCOCC4)C3)c2)n1 426387909 QHFFMFUOSUZHGP-QGZVFWFLSA-N 380.492 2.515 0 50 GFAA O=C(NCCc1cccc(C(F)(F)F)c1)N1CCC(O)(Cn2ccnc2)CC1 426477402 NRVUOQQUQIJSTQ-UHFFFAOYSA-N 396.413 2.681 0 50 GFAA O=C([C@H](O)c1cccc(Cl)c1)N1CCC2(CC1)Nc1ccccc1NC2=O 82100282 IFORTLLIHXHVDG-QGZVFWFLSA-N 385.851 2.799 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1csc(CC)c1)CC2 95511508 XGLXEALSAXOEEJ-UHFFFAOYSA-N 386.521 2.960 0 50 GFAA CCN(C)C1(CNC(=O)N2CCC(Cc3noc(C)n3)CC2)CCCCC1 426493192 NLCKMCAGFWIXBY-UHFFFAOYSA-N 377.533 2.997 0 50 GFAA CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)NC1CCN(Cc2cccnc2)CC1 426396453 MAPQXKNDQWAAMY-UHFFFAOYSA-N 384.528 2.908 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccc(C(=O)O)cc3)C2)cc1 95390253 WEAKDCRWKAHODA-QGZVFWFLSA-N 387.457 2.808 0 50 GFAA O=C1[C@H]2CC[C@H](CN(c3nc(-c4ccccc4)no3)C2)N1Cc1ccccn1 95510836 ROXSXCGEDBVOKP-FUHWJXTLSA-N 375.432 2.759 0 50 GFAA O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)Nc1cccc2nonc12 22752440 QQJBJXKGEQKCQA-UHFFFAOYSA-N 385.855 2.633 0 50 GFAA CCCc1nc(C)cc(N2C[C@@H]3c4cccc(OC)c4OC[C@]3(C(=O)O)C2)n1 95502263 BKQQGQSNKNLVAL-QVKFZJNVSA-N 383.448 2.813 0 50 GFAA CCc1n[nH]c(SCC(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccc2)C3)n1 95378612 MXPYHWDXKKPQHP-DLBZAZTESA-N 385.537 2.582 0 50 GFAA C[C@H](C(=O)Oc1cccc2cccnc12)N1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31 239046690 FXERADPWPCNZNP-MFQLSVIFSA-N 388.423 2.582 0 50 GFAA Cc1nccc(N2CCN([C@@H](C)C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)n1 183798830 UDHTUVXKXBDNKI-ZDUSSCGKSA-N 393.413 2.953 0 50 GFAA O=C(Nc1n[nH]c(C2CCC2)n1)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 184600774 NBRLHCUPRMSJCS-SNVBAGLBSA-N 377.807 2.856 0 50 GFAA CSc1ncc(CNC(=O)N2CCC(c3nc(C(C)C)no3)CC2)n1C 584895798 ZVZPKXDZNXXVDO-UHFFFAOYSA-N 378.502 2.738 0 50 GFAA COc1ccc([C@@H]2CCN(C(=O)c3cn4cc(CN)ccc4n3)[C@H]2C)cc1F 1875292362 FTBRUDLKGMKITL-XJKSGUPXSA-N 382.439 2.959 0 50 GFAA CO[C@H]1C[C@@H](Cn2ccc(NC(=O)OC(C)(C)C)n2)N(Cc2c[nH]nc2C)C1 1775985447 FSRFIXCZJLCFIP-HOTGVXAUSA-N 390.488 2.551 0 50 GFAA COc1ccc([C@H]2CN(c3cc(C(=O)NC4CC4)ccn3)C[C@@H]2N(C)C)cc1 1565511332 PDITXMQNKWRYBO-UXHICEINSA-N 380.492 2.516 0 50 GFAA C[C@@H](OC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)Nc1ccc(Cl)cn1 221998928 SVPGDYUXWAGBHO-AFGYVCNOSA-N 378.856 2.937 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2cc(Cl)ccc2OC)c1 170636395 IQVWHTROSSLWAS-UHFFFAOYSA-N 384.885 2.589 0 50 GFAA CCC[C@H]1CCc2nc(NC(=O)c3cc(N4CCNC(=O)C4)ccn3)sc2C1 190736846 QPYYKLWHLGCCNZ-ZDUSSCGKSA-N 399.520 2.632 0 50 GFAA O=C(NC[C@@H](O)c1c(F)cccc1Cl)[C@@H]1CCN(c2ccc(F)cc2)C1=O 741290848 JZAHLDCCQSJFJJ-XJKSGUPXSA-N 394.805 2.821 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)NC[C@H]1CCCN(C(C)=O)C1 1506398104 LFFMRBIMPBVIFL-CQSZACIVSA-N 388.917 2.584 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@H](CCN)C2)ccc1F 1704336404 NITPOANSTGPFCF-CYBMUJFWSA-N 390.459 2.756 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC[C@@H]1CCCN1C 1704325545 PJNWBADFRXXOGZ-HNNXBMFYSA-N 392.887 2.877 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)n(C)n1 1704339761 NWYUFDFDODKHEP-NRFANRHFSA-N 382.512 2.520 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)Cc3cccnc3)CC1)OCC2 1704299718 REUINAQZISTASN-UHFFFAOYSA-N 382.460 2.732 0 50 GFAA CC(C)N(Cc1cnn(C)c1)C(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1 11661698 ONJCCZLKLPKRLO-UHFFFAOYSA-N 397.435 2.502 0 50 GFAA C[C@H](NC(=O)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)c1ccccc1 12003229 FECKUGULJWBXDF-LBPRGKRZSA-N 392.864 2.898 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c(OC)cc1C 13494711 QEANYDKSJFTRHB-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA CCNC(=O)N1[C@H]2CC[C@@H]1[C@@H]1CN(C(=O)CCc3nc4ccccc4s3)C[C@@H]12 1857668476 LHAFMNLFPMMXSH-MDBPOYHNSA-N 398.532 2.880 0 50 GFAA O=C(CCc1ccncc1)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857722165 DFMNPOADWGXIOT-SLFFLAALSA-N 385.895 2.998 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H]1C[C@H]2CO[C@H](C(C)C)CN2C1 1875245519 CXCJOBTWWNAFMM-BJLQDIEVSA-N 383.492 2.806 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N[C@@](C)(CN)CC(C)C 225478744 OLEAOOPOSYLPQL-OAHLLOKOSA-N 393.347 2.808 0 50 GFAA NC(=O)CCCNC(=O)c1cccc(Sc2cccc(Br)c2)n1 151062416 WCTASGIKPBDJLH-UHFFFAOYSA-N 394.294 2.991 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)CCOc2ccc(F)cc2Cl)C1 779848440 CQGFSCIBIVCQFS-TZMCWYRMSA-N 383.807 2.928 0 50 GFAA Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N1CCC[C@]1(C)C(=O)O 263496376 XXYIMXGVFQDDHS-OAQYLSRUSA-N 380.448 2.898 0 50 GFAA C[C@@H](c1ccccc1)[C@H](O)CNC(=O)C(=O)c1ccc(Br)s1 856288385 GFHLFUKHCZPSEF-CMPLNLGQSA-N 382.279 2.974 0 50 GFAA CCOC(=O)c1ccc(NC(=S)N2CCC[C@@H](C(=O)N3CCCC3)C2)cc1 1443897 WKGYWACDJDKDEH-MRXNPFEDSA-N 389.521 2.895 0 50 GFAA Cc1ccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC[C@@H](C)C3)n2)cc1 1857797832 YZAKWXWHERAHCN-NVXWUHKLSA-N 393.491 2.905 0 50 GFAA Cn1c(CN2CCN(Cc3ccccc3F)[C@H](CCO)C2)nc2ccccc21 39518830 RTAWVEYFFIMBCS-GOSISDBHSA-N 382.483 2.781 0 50 GFAA CN(C(=O)c1cc2c(cnn2C)nc1C(F)F)[C@H]1CCN(c2ccncc2)C1 2325783878 JCEIUZXHAJDUCO-ZDUSSCGKSA-N 386.406 2.652 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cc(Cl)c(Cl)cc2C(=O)O)CC1 795112 JLUJNHWCJSMAHY-UHFFFAOYSA-N 375.208 2.606 0 50 GFAA O=C(c1ccco1)N1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1 1100388 ZOLRTPVBFRAWEJ-UHFFFAOYSA-N 389.260 2.733 0 50 GFAA COC(=O)COc1ccc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 1125748 CWRYPUUBTQOMSH-CXUHLZMHSA-N 386.791 2.989 0 50 GFAA Cc1nc2ccccn2c1CN(C)C(=O)c1cn(Cc2ccccc2F)nn1 11934164 GVAAKCASOHIXDE-UHFFFAOYSA-N 378.411 2.694 0 50 GFAA Cc1ccccc1CNC(=O)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12003395 SMWSIMCKKBSBCT-UHFFFAOYSA-N 392.864 2.645 0 50 GFAA CCC(=O)N[C@@H](c1nnc2n1CCN(C(=O)CC1=CCCCC1)CC2)C(C)C 15000406 UXIAXANGSDANMQ-HXUWFJFHSA-N 387.528 2.777 0 50 GFAA Cc1ccccc1[C@H]1CC(=O)c2c(C)nc(NCCN3CCOCC3)nc2C1 20101130 KBAODRCBGKUVTE-QGZVFWFLSA-N 380.492 2.750 0 50 GFAA COc1ccc(CN2CCN(Cc3ccccc3OC)C[C@@H]2CCO)c(F)c1 20450754 AJQRBXGWMBSXHR-IBGZPJMESA-N 388.483 2.912 0 50 GFAA O[C@H]1[C@H](N2CCN(c3ccc(F)cc3)CC2)c2ccccc2C12CCNCC2 23369132 MNXYJYOOTSFNCY-YADHBBJMSA-N 381.495 2.685 0 50 GFAA O=C1Nc2cc(F)ccc2[C@H]1CC(=O)N1CCc2nc[nH]c2[C@@H]1c1ccncc1 32578183 KQVRREZSIMJBBS-QRWLVFNGSA-N 391.406 2.544 0 50 GFAA CCc1cc(C(=O)OC)c(NC(=O)CN2CCN(c3ccccc3)CC2)s1 35800847 GWXMABYLMKWHIN-UHFFFAOYSA-N 387.505 2.858 0 50 GFAA Cn1cc(NC(=O)CN2CCC[C@H](C(=O)c3cccc(C(F)(F)F)c3)C2)cn1 71765105 HKBVTAMQZKLYMW-AWEZNQCLSA-N 394.397 2.972 0 50 GFAA Cc1ccc(N2CCN(c3nccc(-c4cc(C(=O)O)ccn4)n3)CC2)cc1 71767652 SAGPUWWSHDULKS-UHFFFAOYSA-N 375.432 2.872 0 50 GFAA O=C(c1cccc(O)c1)N1CCC[C@H](N2CCN(c3ccccc3F)CC2)C1 72147465 RJQHHLSPPUVFTL-SFHVURJKSA-N 383.467 2.958 0 50 GFAA CC(C)Cc1nc(CN(C)c2nc(-c3cccnc3)nc3c2cnn3C)no1 72156724 KYOCAVBMVWOXPB-UHFFFAOYSA-N 378.440 2.643 0 50 GFAA CC(C)=CCN1CCN(Cc2ccc(C)c(F)c2C)[C@H]2CS(=O)(=O)C[C@H]21 72422798 CEVOISFILQSCMB-MOPGFXCFSA-N 380.529 2.692 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)c3cn4cccnc4n3)CC2)OC1=O 77353528 NBMURGHXFZUYEB-UHFFFAOYSA-N 385.468 2.593 0 50 GFAA CC1(C)C[C@H](c2nccn2C2CCN(C(=O)N3CCOCC3)CC2)CCO1 82106478 AHTLFQBCVUIXGE-MRXNPFEDSA-N 376.501 2.645 0 50 GFAA O=C(O)CC[C@@H]1CN(c2nc3ccccc3s2)CC[C@@H]1N1CCOCC1 92037027 SVKOBTCGYGYBMD-ZBFHGGJFSA-N 375.494 2.688 0 50 GFAA COc1ccc(CN2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)c(F)c1 95370014 OJMZKIIDVIFHCF-INIZCTEOSA-N 384.459 2.587 0 50 GFAA O=C(N[C@H]1CCOC2(CCCCC2)C1)N1CCCC[C@@H]1CN1CCOCC1 157846135 NJKDMCGYPBOGEB-RBUKOAKNSA-N 379.545 2.765 0 50 GFAA Cc1nccn1C[C@@H](C)CNC(=O)[C@H]1Cc2cc(Br)ccc2O1 194140954 YJWPDJBGXURLKJ-MEDUHNTESA-N 378.270 2.710 0 50 GFAA C[C@H](C(=O)NCc1ccccc1CN1CCCC1=O)N1CCc2ccccc21 195033003 DSNBXJHMHNXXAJ-QGZVFWFLSA-N 377.488 2.876 0 50 GFAA O=C1CCCN1C1CCN(Cc2ccccc2OCCCn2ccnc2)CC1 216370044 XZJHNGFNUOSCQV-UHFFFAOYSA-N 382.508 2.939 0 50 GFAA C[C@@H](O)c1cc2n(n1)CCCN(Cc1cnc(NCc3ccccc3)nc1)C2 219172431 YYSOFDLCPQTIQH-MRXNPFEDSA-N 378.480 2.744 0 50 GFAA CCN(C(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1)[C@@H](C)CS(C)(=O)=O 229666842 MVKLWVXGMQKNDO-JYJNAYRXSA-N 397.541 2.587 0 50 GFAA O=C(O)[C@H]1CCCC[C@@H]1C(=O)OCCCCOC(=O)[C@H]1CCCC[C@H]1C(=O)O 239284778 CAOCATZETDLGIH-FZKCQIBNSA-N 398.452 2.635 0 50 GFAA CO[C@@H](CNC(=O)[C@@H]1C[C@@H]1c1ccccc1)CNC(=O)[C@@H]1C[C@H]1c1ccccc1 252511652 JAYXVKSAZONTGI-PVIWCNJMSA-N 392.499 2.841 0 50 GFAA CC(=O)[C@@H](NC(=O)CN1C[C@@H](C)Oc2ccc(Br)cc21)C(C)C 252540521 PJXSJBRMTQLPBJ-DIFFPNOSSA-N 383.286 2.766 0 50 GFAA COCCNC(=O)CN1C(=O)c2cc3ccccc3cc2Oc2ncccc21 253409038 LHPAFHNPAWBCSO-UHFFFAOYSA-N 377.400 2.750 0 50 GFAA CO[C@H](C)C(=O)Nc1cccc(NC(=O)N2CCC(c3nc(C)no3)CC2)c1 264182644 ACTYDXCSUXKYSN-GFCCVEGCSA-N 387.440 2.763 0 50 GFAA CCn1cc(CN2CCCN(C(=O)c3cnc4c(cnn4C(C)C)c3)CC2)cn1 264709360 YKZPGCIRVJVVMO-UHFFFAOYSA-N 395.511 2.577 0 50 GFAA CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(C(=O)Nc2c(-c4cnn(C)c4)nc4ccccn24)[C@H]31 288979451 DMHIXAMXFNWOGQ-XBRIKIQZSA-N 392.463 2.622 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](c2nc(C(F)(F)F)cn2C)C1 331853536 QYZBZUCSEZCHAQ-NSHDSACASA-N 392.403 2.612 0 50 GFAA CC(C)(C)NC(=O)c1cccc(NC(=O)N2CCO[C@H]([C@H]3CCCO3)C2)c1 363962106 PWXPXJZCIMHGRV-SJORKVTESA-N 375.469 2.627 0 50 GFAA COc1ccc(-c2ccc(NS(=O)(=O)c3ccnn3C)nc2)cc1Cl 373640041 PXOAXSPXIQJXDR-UHFFFAOYSA-N 378.841 2.945 0 50 GFAA O=C(O)Cn1ccc([C@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)n1 426580678 GMUMVJJSJADZHA-IBGZPJMESA-N 382.508 2.812 0 50 GFAA CC[C@@]1(C)Oc2ccc(NC(=O)C(=O)N[C@H]3CCN(c4ccccc4)C3)cc2O1 443734625 RPTFSEHIJBPOAN-AOMKIAJQSA-N 395.459 2.918 0 50 GFAA O=C(NCC1(CO)CCOCC1)c1cccc(-c2cnc3ccc(F)cn23)c1 584895662 NHCRDDFSKKMNJA-UHFFFAOYSA-N 383.423 2.659 0 50 GFAA CCCc1nc(C)cc(N2CCC[C@H](CNC(=O)c3c(C)ncnc3C)C2)n1 823015238 SJXLLGIUJKCZNH-QGZVFWFLSA-N 382.512 2.791 0 50 GFAA CS(=O)(=O)N1CCC(c2nnc3sc(-c4ccccc4Cl)nn23)CC1 825598287 RVNFKWVMFOGASR-UHFFFAOYSA-N 397.913 2.645 0 50 GFAA Cc1ccc(N2CC[C@H](NC(=O)c3ccc4c(c3)[C@@H](CN)CCC4)C2=O)cc1 851626641 FUKADRUAXVRWGN-NQIIRXRSSA-N 377.488 2.909 0 50 GFAA C[C@@H](Oc1cccc2ccccc12)C(=O)N1CC[C@@H](c2cc(O)nc(O)n2)C1 898231121 HVZYCXFZESYJNA-UKRRQHHQSA-N 379.416 2.824 0 50 GFAA O=C(O)c1cccc(CC(=O)N2CC[C@H](c3nccc(C(F)(F)F)n3)C2)c1 907880249 JQPCFRLSVYSCAO-ZDUSSCGKSA-N 379.338 2.752 0 50 GFAA c1cc2c(-c3noc([C@@H]4CCc5nnn(C6CCOCC6)c5C4)n3)cc[nH]c-2n1 952893351 ISENHTRPNXOKHT-GFCCVEGCSA-N 391.435 2.780 0 50 GFAA O=C(c1ccccc1-n1cncn1)N(CCOc1ccccc1)C[C@H]1CCCO1 952968523 KHKHUALSGKVWKW-LJQANCHMSA-N 392.459 2.968 0 50 GFAA CC(C)N1CC[C@H](N2CCN(c3ccccc3F)CC2)[C@H](CCC(=O)O)C1 1076027134 APTZTXVQULFCPZ-MJGOQNOKSA-N 377.504 2.911 0 50 GFAA Cc1c(CN2CC[C@H](N3CCC(O)CC3)[C@@H](O)C2)[nH]c2ccc(Cl)cc12 1565513720 IVTDZFGGHKRRSF-PMACEKPBSA-N 377.916 2.522 0 50 GFAA C[C@H](c1ccccc1)n1c(CN2C[C@H]3[C@@H](C2)C3(CO)CO)nc2ccccc21 1772811091 ORDJYIDFZOEIFO-QRQLOZEOSA-N 377.488 2.678 0 50 GFAA O=C(Cn1ccc2ccccc21)N1CCN(C(=O)C2CC2)C2(CCOCC2)CC1 1775962774 FDEREQJFMFVZED-UHFFFAOYSA-N 395.503 2.661 0 50 GFAA C[C@@]1(C(=O)N2CCOC3(CCN(C(=O)[C@H]4C[C@@H]4C(F)F)CC3)C2)CC=CCC1 1775986928 YPMAXOBGIHVWFD-TWOQFEAHSA-N 396.478 2.854 0 50 GFAA Cc1cc2c(cc1C(=O)N1CCO[C@@H](CN(C)C)[C@@H]1c1ccccc1)OCCO2 1857710385 UXVOAVTUXVQCHA-VXKWHMMOSA-N 396.487 2.910 0 50 GFAA Cc1ncsc1CN1C[C@@H]2[C@H](CNC(=O)CCC(C)C)[C@H]3CC[C@]2(C1)O3 1857711909 IAIOTRSMZXDDPY-TVKQPGBESA-N 377.554 2.983 0 50 GFAA CCc1nc(C)cc(N2CC[C@@H]([C@@H](C)NC(=O)c3cccc4[nH]ncc34)C2)n1 1875358289 QGJFZSVOIJSPNZ-HUUCEWRRSA-N 378.480 2.869 0 50 GFAA C=CC(=O)N[C@H](CNC(=O)c1nnc2ccccc2n1)c1ccc(C(C)C)cc1 1875385924 FNNHMQDGPGFFNH-LJQANCHMSA-N 389.459 2.922 0 50 GFAA COc1ccc([C@@H]2C[C@@H](C)N(C(=O)Cn3cnc4ccc(F)cc4c3=O)C2)cc1 2325734428 RFKHBTNHOVORHF-GDBMZVCRSA-N 395.434 2.949 0 50 GFAA O=C(c1ccc(Cc2nc[nH]n2)cc1)N1CCNC[C@H]1c1cccc(Cl)c1 2325795091 DLMLDISKBJMAKY-SFHVURJKSA-N 381.867 2.836 0 50 GFAA C[C@H]1COCC[C@H]1C(=O)N1CCC(n2nnc(-c3ccc(Cl)cc3)n2)CC1 2325810756 BNCZTSRBHSAREG-SUMWQHHRSA-N 389.887 2.830 0 50 GFAA CCCN1C[C@@H](c2nc(-c3ccc(N(C)C)cc3)nn2[C@H]2CCOC2)CC1=O 2325839648 AASIBVVJPGEZER-WMZOPIPTSA-N 383.496 2.698 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Cc2ccc(C(F)(F)F)cc2)C1=O 2356158903 DOXIKIJPPJCKKX-IBGZPJMESA-N 398.425 2.878 0 50 GFAA O=C(c1cnn2c(C(F)(F)F)cc(-c3ccccc3)nc12)N1CCOCC1 662845 VMIRXFZOESFYDS-UHFFFAOYSA-N 376.338 2.888 0 50 GFAA COc1ccccc1NC(=O)COc1c(Br)cc(CO)cc1OC 2554768 KNROIMZCUVWMHQ-UHFFFAOYSA-N 396.237 2.976 0 50 GFAA CCn1cc(Br)c(C(=O)NC(=S)Nc2ccccc2OC)n1 2766041 BYQXMKVHCGMKNP-UHFFFAOYSA-N 383.271 2.801 0 50 GFAA CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 4598915 XGJGWYRHLPSMLW-SJORKVTESA-N 378.469 2.943 0 50 GFAA CCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)C(=O)OCC)cc1 4951309 MCVREGKHTHUJKZ-UHFFFAOYSA-N 384.498 2.779 0 50 GFAA O=S(=O)(NCc1nc(-c2ccccc2)no1)c1ccc(Br)cc1 6766039 BQSVRXOCFJEGTD-UHFFFAOYSA-N 394.250 2.978 0 50 GFAA CC(=O)c1ccc(OCc2cc(C(=O)NCc3cn4c(n3)SCC4)no2)cc1 11932879 SOEMZDCPXVWUSM-UHFFFAOYSA-N 398.444 2.688 0 50 GFAA CCCC(=O)N1CCC(N2CCC[C@H](C(=O)NCCc3ccccc3)C2)CC1 12072751 FVAUAPXFURNSDT-FQEVSTJZSA-N 385.552 2.848 0 50 GFAA O=C(Nc1ccnn1C1CCN(Cc2ccc3c(c2)CCO3)CC1)[C@@H]1CCOC1 12074897 QKOHTSLJYJDWDF-GOSISDBHSA-N 396.491 2.630 0 50 GFAA O=C(CC[C@]1(Cc2cccs2)CCC(=O)N1)NCc1ccc2c(c1)OCO2 14960958 BBFXWAJTSQKODF-HXUWFJFHSA-N 386.473 2.765 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2F)CN1Cc1ccc(F)cc1F 14976274 KQQOZASLCAVUPA-KSSFIOAISA-N 392.377 2.650 0 50 GFAA O=C(NCC[C@H]1COc2ccccc2O1)c1cn(Cc2ccc(Cl)cc2)nn1 15074713 PBKCQLFXQZEBHB-INIZCTEOSA-N 398.850 2.940 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)NC[C@H](c3cccs3)N3CCOCC3)oc2c1 28291690 XBSRAPPOHUCLDE-MRXNPFEDSA-N 398.484 2.966 0 50 GFAA Cc1nnc(SCC(=O)NCCc2csc(-c3cccnc3)n2)s1 55119531 BGBMMNBQKXJYFS-UHFFFAOYSA-N 377.520 2.816 0 50 GFAA Cc1nc(-c2ccc(Cn3cnc4sc5c(c4c3=O)CCNC5)cc2)no1 65464412 VITIWJZUATWLKO-UHFFFAOYSA-N 379.445 2.510 0 50 GFAA COc1cc(C)ccc1OCc1cc(C(=O)NCc2n[nH]c3c2CCC3)no1 67879807 VYRAKLPFYLRBQJ-UHFFFAOYSA-N 382.420 2.712 0 50 GFAA O=S1(=O)C[C@@H](O)[C@H](n2ccnc2-c2ccc(-c3ccccc3Cl)o2)C1 71745967 CKSUPELWKCARGV-ZIAGYGMSSA-N 378.837 2.794 0 50 GFAA CNC1CCN(c2ccc(C(=O)N3CCC[C@@H](C(=O)CC(C)C)C3)cn2)CC1 71764384 XIOOFFAJFDVPEK-GOSISDBHSA-N 386.540 2.737 0 50 GFAA O=C(NCc1nccs1)c1ccc2c(c1)CN(CCc1ccncc1)C2=O 72412442 QHHLZBTXCUIWNX-UHFFFAOYSA-N 378.457 2.667 0 50 GFAA O=C(c1coc(CN2CCOCC2)c1)N1CCCN(C2CCCCC2)CC1 77357580 CREFXLMYBSKEIF-UHFFFAOYSA-N 375.513 2.592 0 50 GFAA O=C1CC[C@H](N2CCC3(CC2)Nc2ccccc2NC3=O)CCN1CC1CC1 82120020 VNKNIGLXQHWYJU-KRWDZBQOSA-N 382.508 2.676 0 50 GFAA Cc1nn(CC(=O)N2CCCN(C3CCCCC3)CC2)c(=O)c2ccccc12 91644217 ZOWWFCYTPBOKCY-UHFFFAOYSA-N 382.508 2.572 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4ccccc4)C3)CCC2=O)cn1 91931900 JPDHJBFRERMSIC-QFIPXVFZSA-N 378.476 2.830 0 50 GFAA C[C@H](NC(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1)c1nnn[nH]1 95374504 KYBYDKLVPIOUQU-KRWDZBQOSA-N 390.491 2.611 0 50 GFAA Cc1cc(C)nc(N2CCC(NCc3ccc(N4CCCC4=O)cc3)CC2)n1 95378150 AZRNJDLSPFUCLM-UHFFFAOYSA-N 379.508 2.979 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H](c2ncc[nH]2)C1)c1cc(Cl)ccc1Cl 95517280 CWYKVWJGOBACAP-LLVKDONJSA-N 381.263 2.853 0 50 GFAA COC(=O)c1ccc(CN2CCN(Cc3cccc(OC)c3)[C@H](CCO)C2)cc1 104333050 LENUXIUHXOTTMO-OAQYLSRUSA-N 398.503 2.551 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4c(F)cccc4F)nnc3c2)n1 169776195 VTPKBRRDMGLVEN-UHFFFAOYSA-N 398.373 2.940 0 50 GFAA Cn1cc(CCC(=O)N2CCS(=O)(=O)c3ccccc3C2)c2ccccc21 185046484 MXSSMUFJTDNNSC-UHFFFAOYSA-N 382.485 2.927 0 50 GFAA CC[C@H]1CCCN(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC1 185633100 XDTWQHPROSYAEW-INIZCTEOSA-N 379.526 2.948 0 50 GFAA CCN(c1ccccc1C)S(=O)(=O)NC(=O)C[C@H]1OCCc2ccccc21 191008111 UEAKEKBUJGBSCY-LJQANCHMSA-N 388.489 2.886 0 50 GFAA COc1c(Br)cccc1CN[C@@H]1CCN(CC(F)(F)F)C1=O 237295368 VUWFVAKZENIDJE-LLVKDONJSA-N 381.192 2.711 0 50 GFAA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N2CCc3sccc3[C@H]2CC)C1 240465870 GBAMCBZDSRJRBN-UKRRQHHQSA-N 386.539 2.577 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@H](O)c3ccc(F)cc3)c2C)cc1 241862547 SQZZHAZRWQVDTI-IBGZPJMESA-N 382.439 2.800 0 50 GFAA CN1[C@H]2CC[C@H]1CN(C(=O)C1CCN(C(=O)CCc3ccccc3)CC1)CC2 245456871 UBHKESRILHLIJV-SFTDATJTSA-N 383.536 2.553 0 50 GFAA CC[C@H](C(=O)N1C[C@@H](OC)C[C@H]1c1nc(-c2cccnc2)c[nH]1)N(CC)CC 253370530 SAISANLBZVYLDZ-UHOSZYNNSA-N 385.512 2.881 0 50 GFAA C[C@H]1Oc2ccccc2N(CC(=O)N[C@@H](CCC(=O)O)c2ccccc2)C1=O 268899943 SGOIQINCQRITGG-ZBFHGGJFSA-N 382.416 2.523 0 50 GFAA Cc1onc(-c2cccnc2)c1C(=O)N1CCS(=O)(=O)C2(CCCCC2)C1 287342266 GJVUPFFZMRPZFB-UHFFFAOYSA-N 389.477 2.619 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CC[C@H]4[C@H](C3)OCc3cnnn34)coc2c1C 299802256 KBVWBYLWQSLUQT-ROUUACIJSA-N 380.448 2.864 0 50 GFAA CCOc1ccc(S(=O)(=O)N(C)C)cc1NCc1cc(OC)ccc1OC 328594827 CNMLLHGGVRECCP-UHFFFAOYSA-N 394.493 2.965 0 50 GFAA Cc1noc([C@@H]2CCCCN2S(=O)(=O)c2cccc3c2OC(F)(F)O3)n1 333225534 XIOMUKMLYWKWBE-JTQLQIEISA-N 387.364 2.615 0 50 GFAA O=C(O)COc1ccc(S(=O)(=O)N2CCC[C@H](c3ccccc3)C2)cc1 414338691 RTGYUNNRLHCRTJ-INIZCTEOSA-N 375.446 2.718 0 50 GFAA O=C1N[C@H]2CN(CCc3ccc4ccccc4c3)CC[C@H]2N1C1CCNCC1 420396362 DCDCNHCVWJUADE-FCHUYYIVSA-N 378.520 2.602 0 50 GFAA Cc1cnn(-c2ccc(C(=O)NC3CCC(CS(C)(=O)=O)CC3)cc2)c1 452274098 NZWAFIKTLZHBMU-UHFFFAOYSA-N 375.494 2.514 0 50 GFAA O=C(N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)N1CCC2(CCCO2)CC1 584891816 YVHJCWCTNNUTAX-OAHLLOKOSA-N 377.872 2.800 0 50 GFAA COc1cc(C(=O)Nc2ccccc2NC(=O)CN(C)C)nc2ccccc12 952967114 HAJHDQSLNMNLCZ-UHFFFAOYSA-N 378.432 2.996 0 50 GFAA O=C(c1cnccn1)N1CCC(N2CCC([C@H](O)c3cccs3)CC2)CC1 952986468 ZVXOWRJVLAMJRG-IBGZPJMESA-N 386.521 2.588 0 50 GFAA CCCNc1ncc(CN2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)cn1 1529090943 KWZYQFSTIFBKSO-NQIIRXRSSA-N 377.492 2.882 0 50 GFAA Cn1nnc(-c2ccc(C(=O)N3CCC4(CC3)OCCc3ccsc34)cc2)n1 1704311589 CYPTXKNRFXJRLC-UHFFFAOYSA-N 395.488 2.643 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](C3CCN(C(=O)[C@H]4C[C@@H]4C)CC3)CC2)cnn1C 1775989982 BGUQGXBDPFCCOV-IEZWGBDMSA-N 386.540 2.865 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(Cc3ccc(OCCO)cc3)CC2)O1 1857700984 JNQYJNMHJYYYTG-UYAOXDASSA-N 377.525 2.978 0 50 GFAA O=C(NCC1CC1)c1cc2c(s1)CCOC21CCN(c2ncccn2)CC1 1857704615 ZLSKFPREHUQZAV-UHFFFAOYSA-N 384.505 2.746 0 50 GFAA Cc1cccc(CN2CC3(CCN(c4nc(C)cc(C)n4)CC3)OCCC2=O)n1 1857719793 VLLPLUJWVWWASV-UHFFFAOYSA-N 395.507 2.585 0 50 GFAA CCc1ccnc(C(=O)NC[C@@H]2CCC[C@H]2NC(=O)COc2ccc(F)cc2)c1 1875306825 CZFUAEQZUGHAOY-QFBILLFUSA-N 399.466 2.877 0 50 GFAA CC1(c2cccc(Cl)c2)CCN(C(=O)c2cnn3cc(C(N)=O)cnc23)CC1 1875318855 XCOPHYMNOUQRIK-UHFFFAOYSA-N 397.866 2.676 0 50 GFAA CC1(NC(=O)c2cc(F)cc(Cl)c2)CN(C(=O)c2ccc3n[nH]cc3c2)C1 1875358767 JGJLPRRKOOHDSH-UHFFFAOYSA-N 386.814 3.000 0 50 GFAA C[C@@H](C(N)=O)N1CCC2(CC1)C[C@@H](C)N(C(=O)CC(C)(C)CC(F)(F)F)C2 2325794000 NUQYGEWUVMCNMQ-KGLIPLIRSA-N 391.478 2.932 0 50 GFAA C[C@@H](CNC(=O)C(C)(C)c1cccnc1)N(C)C(=O)C[C@@H]1CCC(C)(C)CO1 2325794021 ODZSWIKBKWKTKV-WMZOPIPTSA-N 389.540 2.918 0 50 GFAA Cc1ccc([C@]23C[C@H]2CN(C[C@@H](O)Cn2cc(Br)cn2)C3)cc1 2325800462 JGVVDTUPXPSQGU-CGTJXYLNSA-N 376.298 2.588 0 50 GFAA C[C@@H](NC(=O)c1cnn(C2CCNCC2)n1)c1ccc(-c2ccncc2)cc1 2325820845 PGRBZJNMJJIYHW-OAHLLOKOSA-N 376.464 2.756 0 50 GFAA CCOc1ccc(NC(=S)NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1 715929 WAWANQCVCFEAKN-UHFFFAOYSA-N 397.456 2.585 0 50 GFAA COc1ccc(N([C@H](C)C(=O)Nc2ccc(F)cc2F)S(C)(=O)=O)cc1 1146491 WWQVXCJAJDKIMT-LLVKDONJSA-N 384.404 2.767 0 50 GFAA Cc1cccc2c1NC(=O)/C2=c1\sc2nnc(-c3cccc(Cl)c3)n2c1=O 4625709 HJQKZJWURIESOC-SQFISAMPSA-N 394.843 2.650 0 50 GFAA CCOC(=O)CN1C(=O)S/C(=C/c2ccc(O)c(Br)c2)C1=O 4819558 VXNGYNTUZNMGSC-IZZDOVSWSA-N 386.223 2.754 0 50 GFAA CN(CC(=O)N[C@H]1CCCN(Cc2ccc(Cl)cc2)C1)Cc1cccnc1 12306238 DFMKFZOQWOUJNK-FQEVSTJZSA-N 386.927 2.948 0 50 GFAA Cc1cccc([C@H]2c3[nH]c4ccccc4c3CCN2C(=O)CN2CCOC2=O)n1 13596192 HHCUADUIXZSAPP-NRFANRHFSA-N 390.443 2.798 0 50 GFAA COc1cccc(-c2cc(CC3(O)CCN(Cc4nccn4C)CC3)on2)c1 15079224 CEGMYULJUWWFFK-UHFFFAOYSA-N 382.464 2.653 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3ccc(OC)cc3F)CC2)CC1 15079470 XGDIEXUPUMFNLY-UHFFFAOYSA-N 391.531 2.991 0 50 GFAA CCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccco2)CC1 16552438 CMMVISILUZJECM-UHFFFAOYSA-N 383.448 2.910 0 50 GFAA CCOc1ccc(CN2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)cc1 19533328 KEWKSJRLEPKFJS-UHFFFAOYSA-N 390.505 2.600 0 50 GFAA COc1ccc(-c2noc(CN3CCN(CCOc4ccccc4)CC3)n2)cc1 20254631 NHGRCKBESJVUJB-UHFFFAOYSA-N 394.475 2.942 0 50 GFAA Cc1cccc2c(C(=O)NCCN3CCOCC3)cc(-c3cccnc3)nc12 20418367 TUAYGKIPOOISAT-UHFFFAOYSA-N 376.460 2.667 0 50 GFAA COc1ccc(CN2CCN(Cc3nccs3)C[C@@H]2CCO)c(C)c1C 22851970 VQUBWYQJFOEAPP-SFHVURJKSA-N 375.538 2.837 0 50 GFAA COc1cc(OC)c(NC(=O)N2CCN(c3ccc(C)nn3)CC2)cc1Cl 35597993 UPWRLGMCYLPUTO-UHFFFAOYSA-N 391.859 2.810 0 50 GFAA COc1cc(-c2nc3c([nH]2)C[C@H](c2ccccc2OC)CNC3=O)ccc1O 65424447 KKLTUPKRWDOJBC-ZDUSSCGKSA-N 379.416 2.869 0 50 GFAA CC(CO)(CO)Nc1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cn1 67803341 GHORFURNHGWZKB-GOSISDBHSA-N 383.492 2.647 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(F)cc3C)CC2)C1 67840639 RLLFOSFNPIDWSM-LJQANCHMSA-N 391.531 2.573 0 50 GFAA Cc1ccc2nccc(N3CC[C@H](N4CCN(C)CC4)[C@H](CCC(=O)O)C3)c2c1 95369727 GMRILFWPHABATA-NQIIRXRSSA-N 396.535 2.850 0 50 GFAA O=C(c1cccnc1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccc3c(c1)OCCO3)C2 95379169 UPMGBKQBEHZDQI-IEBWSBKVSA-N 379.460 2.589 0 50 GFAA Cc1noc(C)c1NC(=O)N1CCc2nnc(CCc3ccccc3)n2CC1 96163397 BXOYBIAKONZLLZ-UHFFFAOYSA-N 380.452 2.758 0 50 GFAA O=C1C[C@@H]([C@H]2CCCCN2C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1 132616009 UVBAAFHZFZTPTH-IAGOWNOFSA-N 380.448 2.745 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN[C@@H]1CCO[C@]2(CCSC2)C1 151354102 HLSPSFNTYGPQFF-IUODEOHRSA-N 379.448 2.814 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4ccccc34)C2)c1 169772767 USNBDTNPMJOFES-ZDUSSCGKSA-N 377.404 2.513 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(NC(=O)Cc2cnn(CC)c2)ccc1Cl 170602121 RHIADWIFGSWSBK-UHFFFAOYSA-N 398.916 2.768 0 50 GFAA Cc1nn(C)cc1[C@H](C)NC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 171859078 PSLPMZJFQSDKJV-AWEZNQCLSA-N 388.516 2.606 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1ccc(-n2cccn2)cc1 173337672 XFRJGUWXPKURBI-MRXNPFEDSA-N 376.464 2.756 0 50 GFAA O=C(c1ccccc1-c1ncc[nH]1)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 209870678 VQHFFPSQPOSTPZ-QAPCUYQASA-N 391.427 2.796 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 236586855 SGPVXEUUHMPDTF-NHCUHLMSSA-N 392.455 2.561 0 50 GFAA Cc1cccc(C[C@@H](CNC(=O)c2cc(N3CCCC3=O)ccc2F)C(=O)O)c1 237677308 NDFQNURRKGWQDX-INIZCTEOSA-N 398.434 2.934 0 50 GFAA CC[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)O)c2C(N)=O)C1 239439255 ZQMYMMLWEHGEMP-IJLUTSLNSA-N 376.478 2.967 0 50 GFAA CCc1nnc(NC(=O)CCN2CCC(c3nc(C(C)C)no3)CC2)s1 243892542 AINOPPFNFZBTEO-UHFFFAOYSA-N 378.502 2.815 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)CCCc2c[nH]c3ccccc23)C1 276549163 RXLUSGKKMFZUQW-KRWDZBQOSA-N 392.507 2.596 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(F)cc2)CN1Cc1cc(F)ccc1F 299763975 ZQAGZCNJWXSQSY-AEFFLSMTSA-N 392.377 2.650 0 50 GFAA CCNC(=O)c1ccc(C)c(NC(=O)NC[C@@H](CO)Cc2ccsc2)c1 299802516 YFYOYHTVCDTXJJ-HNNXBMFYSA-N 375.494 2.779 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1csc(-c2cnccn2)n1 363380483 LQLLHNXDSQWNGR-UHFFFAOYSA-N 380.408 2.855 0 50 GFAA COCCN1CC[C@@H](NC(=O)N2CCC(c3cccc4cnccc34)CC2)C1 365458416 FCLYIEIKSSASML-LJQANCHMSA-N 382.508 2.845 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3CCCO[C@@H](Cn4cccn4)C3)n[nH]2)cc1 426382864 CNEFRPZEXVJMDR-GOSISDBHSA-N 379.464 2.767 0 50 GFAA Cc1ccc(CNC(=O)N2CCC(C(=O)NCc3ccccn3)CC2)cc1F 426563041 ODQFWBHSTAYTDH-UHFFFAOYSA-N 384.455 2.767 0 50 GFAA COC(=O)c1c(-c2ccc(C(=O)NCCCNc3cccnc3)cc2)cnn1C 534676269 WDUBMGQMLXRXRE-UHFFFAOYSA-N 393.447 2.501 0 50 GFAA COc1cc(C(=O)O)cc(-c2ccc(C(=O)N3CCC[C@H](N(C)C)C3)cc2)n1 584894775 NDCFBABJVRDMGJ-KRWDZBQOSA-N 383.448 2.622 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)c1ccc(C(=O)N2CCOCC2)cc1 1125273741 PFHVFGPJTHKFAH-UHFFFAOYSA-N 390.443 2.656 0 50 GFAA CC(C)c1cc(C(=O)N(C)[C@@H](C)c2ccc3c(c2)OCCO3)nc2ncnn12 1506402565 JTKMBKDPMZKNOT-ZDUSSCGKSA-N 381.436 2.852 0 50 GFAA CC(C)=CCN1CCC2(CC[C@@H](CNC(=O)CSc3nnc(C)o3)O2)CC1 1506408823 QJDDQPUGMKKLOM-INIZCTEOSA-N 394.541 2.566 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCC[C@@H](c4nc(CC(C)C)no4)C3)c12 1529196180 VYCIMNKHIYQSBF-CYBMUJFWSA-N 398.467 2.940 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)Cc3ccc(OC)c(OC)c3)CC2)O1 1857707992 DJGGTBUAVXTGET-SJORKVTESA-N 377.481 2.557 0 50 GFAA COc1cccc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c1OC 1857731528 UMFNJFWESPALFB-FUHIMQAGSA-N 382.460 2.648 0 50 GFAA C[C@H]1C[C@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)CC(=O)N1 1875270419 JPXAYQHEUGFARX-IUCAKERBSA-N 382.233 2.714 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)C2(c3ccccc3F)CCC2)C1)c1cncnc1 1875305216 MUWZEUGCSDWLSY-MRXNPFEDSA-N 396.466 2.706 0 50 GFAA COC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1NC(=O)c1cc(Cl)nn1-c1ncccc1Cl 1875310181 HOEOMAIRZWXEGC-KLBPJQLPSA-N 395.246 2.502 0 50 GFAA NC(=O)[C@H](CNC(=O)CC[C@@H]1CCc2ccccc2C1=O)Cc1ccc(F)cc1 1875316133 WSPNROZVXJFASN-ROUUACIJSA-N 396.462 2.811 0 50 GFAA Cc1cccc(CCC(=O)N[C@H](CO)Cc2cncs2)c1Br 1875323145 YVCIQVBLLUVNNS-ZDUSSCGKSA-N 383.311 2.866 0 50 GFAA CN(C)C(=O)[C@@H](CNC(=O)Nc1ccc(N2CCCC2)nc1)c1ccccc1 2325800381 AOKQTXMNCJTKQD-SFHVURJKSA-N 381.480 2.675 0 50 GFAA CCN(C[C@H](C)NC(=O)[C@@H]1C[C@H]1F)C(=O)Cc1cc(Br)cs1 2325822318 QDEHLJQNYOPESL-ZWKOPEQDSA-N 391.306 2.764 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCc3cnccn3)C2=O)cc1 2356134618 UXOFKXRTAVQDRV-QFIPXVFZSA-N 378.476 2.906 0 50 GFAA O=C(NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc2ccccn12 2356151118 SILCKTHLYIBUGV-UHFFFAOYSA-N 383.473 2.522 0 50 GFAA CCOC(=O)c1sc(NC(=O)COC(=O)c2ccccc2OCC)nc1C 781747 RLIRVZQZGLFOMC-UHFFFAOYSA-N 392.433 2.822 0 50 GFAA CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cc(OC)ccc1Br 997852 FGNOISQTHYASFS-ZDUSSCGKSA-N 385.283 2.814 0 50 GFAA COc1ccc([C@@H]2c3c(-c4ccc(F)cc4)nnc(O)c3Nc3nnnn32)cc1 10232633 KCOXGAOXTDQURU-QGZVFWFLSA-N 391.366 2.678 0 50 GFAA COCCCNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCC(C)C)c1=O 12245812 HSWROBVUJKXTSR-UHFFFAOYSA-N 391.512 2.506 0 50 GFAA COC(=O)c1ccc(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)cc1 12701252 MSQNWJMHVMNQGW-SFHVURJKSA-N 398.434 2.667 0 50 GFAA CCN1CCC(C(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)CC1 15079082 CTAHNXVKTXBJNE-QFIPXVFZSA-N 398.595 2.840 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)Nc3ccccc3O)cs2)no1 16649464 YJVLVWVUHBIOFW-UHFFFAOYSA-N 379.419 2.803 0 50 GFAA c1cc(-c2ccn(CCCN3CCOCC3)n2)cc(-c2cnn3cccnc23)c1 19146556 VDICBSBCJZRGEE-UHFFFAOYSA-N 388.475 2.982 0 50 GFAA CN1CCN(CCC(=O)N2CCC[C@@H](CCc3ccc(F)c(F)c3)C2)CC1 19839037 GJIPJHMBIAAZKX-SFHVURJKSA-N 379.495 2.774 0 50 GFAA O=C(c1ccc2c(c1)OCO2)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 20233879 WMZYCGQWNSYCQH-QGZVFWFLSA-N 387.457 2.840 0 50 GFAA COc1ccccc1-n1c(=O)n(Cc2ccccc2F)c(=O)c2cccnc21 20275142 OFVVFSDTXWRWSE-UHFFFAOYSA-N 377.375 2.743 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(C3CSCCSC3)CC2)[C@H]1O 20601722 YCIIIMODDIHRCU-MOPGFXCFSA-N 378.607 2.846 0 50 GFAA Cc1ccccc1CN1CCN(CC(=O)Nc2cccc3nsnc23)CC1 22752158 ZDUOEIKIRFXVQY-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA CCc1oc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC)cc1CN1CCCC1 55343210 LECDBLBLTJZHMM-SFHVURJKSA-N 384.476 2.952 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(OC)cc2)CN1Cc1cccc(C)c1 64058571 BBFWNGBWVLLJFC-QUCCMNQESA-N 382.460 2.550 0 50 GFAA Cc1ccc(CN(Cc2ccc3c(c2)OCO3)C(=O)CCc2n[nH]c(N)n2)cc1 65461216 WVSQSCKTPALYLX-UHFFFAOYSA-N 393.447 2.586 0 50 GFAA O=C(O)c1ccccc1CN1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 67561608 XGSCOZWYJRDUCO-UHFFFAOYSA-N 378.432 2.638 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)C4CCCCC4)CC3)nc(C)n2)n1 67630001 UVSUIYIHJULLOF-UHFFFAOYSA-N 382.512 2.816 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCc3ccccc3F)C2=O)c1 67643564 PGHVFWKJTMQCBU-OAQYLSRUSA-N 390.430 2.617 0 50 GFAA Cc1ccc2nc(CNC[C@]3(O)CCCN(CC4CCCCC4)C3=O)[nH]c2c1 67743076 WGDCGJPRXXDHDM-JOCHJYFZSA-N 384.524 2.895 0 50 GFAA COCCCn1c(CN2C[C@]3(C)C[C@H]2CC(C)(C)C3)cnc1S(C)(=O)=O 67785833 IKUHMALIYKKMET-DNVCBOLYSA-N 383.558 2.724 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cc(C2CC2)on1 67878638 WJHMZALSHMIBMB-UHFFFAOYSA-N 377.448 2.951 0 50 GFAA CC(C)S(=O)(=O)CCNC(=O)c1csc2nc(-c3ccccc3)cn12 67883591 KHDOFWJMUYWUPS-UHFFFAOYSA-N 377.491 2.616 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3n[nH]c4c3CCC4)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72159406 IIPCRYPUFGQCTB-VLCRHTCISA-N 376.504 2.909 0 50 GFAA O[C@H]1[C@H](n2cc(-c3ccc(F)cc3F)nn2)c2ccccc2C12CCNCC2 72173854 GJDQXKXMLXYSST-UXHICEINSA-N 382.414 2.808 0 50 GFAA C[C@@H](C1CCN(C(=O)COc2ccc(F)c(Cl)c2)CC1)N1CCOCC1 72420042 BUNWOXKBCXGRSZ-AWEZNQCLSA-N 384.879 2.817 0 50 GFAA CC(C)Oc1ccc2c(NC(=O)c3ccc(Cn4cnnn4)cc3)nn(C)c2c1 72422020 VKIBCHCOSWCJAW-UHFFFAOYSA-N 391.435 2.648 0 50 GFAA COc1ccc(N2CCN(C(=O)c3c(C)[nH]c(C(C)=O)c3C)[C@@H](C)C2=O)cc1 82096329 LVJRBFWKTKZREV-AWEZNQCLSA-N 383.448 2.720 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2cc(C)nc(C)n2)C3)cc1 91934914 RXUKKCIMWLSKIP-RBUKOAKNSA-N 380.492 2.839 0 50 GFAA COCCCN1CC2(CCN(C(=O)c3cc(Cl)ccc3O)CC2)CC1=O 95371325 JQLYECZXPUSOMS-UHFFFAOYSA-N 380.872 2.537 0 50 GFAA CNc1nc(C(=O)N2CCc3ccc(NC(=O)[C@H]4CCCO4)cc3C2)cs1 95498203 BKIMFQGILXTAHU-MRXNPFEDSA-N 386.477 2.501 0 50 GFAA Cc1cc(N2CCC(c3nccn3Cc3cccnc3)CC2)nc(N(C)C)n1 95500780 BXHGALUIEQPRSL-UHFFFAOYSA-N 377.496 2.875 0 50 GFAA CCc1nccn1CCC(=O)N1CCC[C@H](CNC(=O)c2ccc(F)cc2)C1 95511412 ZDOBEYRWMBSKCJ-MRXNPFEDSA-N 386.471 2.643 0 50 GFAA O=C(NC1CCCC1)c1ccc(OC2CCN(C(=O)CCO)CC2)c(Cl)c1 95518664 BRNPODIGVHLGQM-UHFFFAOYSA-N 394.899 2.765 0 50 GFAA Cc1n[nH]cc1CN(C)Cc1cccc(OC[C@H](O)CN2CCCCCC2)c1 95523980 RUWKHOVQUAIIKS-OAQYLSRUSA-N 386.540 2.966 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccccn2)C(=O)c2c[nH]nc2C2CCCCC2)N1 97681857 LXWDGSXTMLMYQO-KRWDZBQOSA-N 381.480 2.773 0 50 GFAA CCOC(=O)CSc1nnc2[nH]c3c(c(=O)n12)[C@](C)(CC)Cc1ccccc1-3 101170577 QNGJMQMZPDVAKP-HXUWFJFHSA-N 398.488 2.964 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)c1cccc2c1CCC2 122059758 ZOKGKOKAFWIJBI-HNNXBMFYSA-N 385.489 2.861 0 50 GFAA O=C(CCNC(=O)N1CCc2ccccc2C1)N1CCc2cccc(F)c2C1 132805758 NGMVNUXOQDBJJJ-UHFFFAOYSA-N 381.451 2.868 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(c4cccc(C)c4)C(=O)[C@@H]3N3CCCN23)cc1 136730887 RNJVDKSWQXFFLJ-XUVXKRRUSA-N 377.444 2.539 0 50 GFAA Cc1nc2sc3c(c2c(=O)n1C[C@H](O)CN1CCC(C)CC1)CCCC3 155049691 VVJUBTXLNNJENL-OAHLLOKOSA-N 375.538 2.738 0 50 GFAA CC(C)C(=O)N1CCC[C@H]1C(=O)N1CCN(Cc2ccccc2Cl)CC1 161322660 RGTXEPSDWBFQJF-SFHVURJKSA-N 377.916 2.631 0 50 GFAA O=C(NS(=O)(=O)c1ccc(-n2cccc2)cc1)c1cnn(-c2ccccc2)c1 170597116 OQDAZQLIAOPBLK-UHFFFAOYSA-N 392.440 2.782 0 50 GFAA CNS(=O)(=O)c1ccc(/C=C/C(=O)Nc2nc3c(s2)CCCCC3)cc1 170651474 AZDBTQCTRYQZFR-FMIVXFBMSA-N 391.518 2.972 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)c1cn(Cc3cccs3)nn1)CC2 173067487 YIURGOJICZBESG-UHFFFAOYSA-N 384.461 2.604 0 50 GFAA O=C(c1ccc(OCC(F)(F)F)nn1)N1CCCN(c2ccccc2)CC1 180520433 HVWHOORQQBFSRT-UHFFFAOYSA-N 380.370 2.770 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCN(Cc2ccc(F)c(Cl)c2)CC1 225883607 IPNCPTBPSQGIRF-DFEHZGFQSA-N 394.874 2.870 0 50 GFAA COc1ccccc1NC(=O)[C@H](CCSC)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 248148321 YVOMCBKBXQJPJV-FMKPAKJESA-N 390.505 2.931 0 50 GFAA O=C(C1CCCCC1)N1CC[C@H](NS(=O)(=O)c2cnc3ccccc3c2)C1 252493916 NGJQMHONMCGWCM-KRWDZBQOSA-N 387.505 2.694 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1ccc(N2CCOCC2)cn1 252548988 QOOAXRQSCWSWQP-UHFFFAOYSA-N 399.401 2.943 0 50 GFAA CCc1ccc([C@@H]2CNCCN2C(=O)c2cc3c(nc2O)CCCC3=O)cc1 261709006 KIAUNWZHOHASRJ-IBGZPJMESA-N 379.460 2.655 0 50 GFAA O=C1CCc2cc(OCCCC(=O)N[C@@H](Cc3ccccc3)C(=O)O)ccc2N1 262389941 FNLNTLRNCMIUCU-IBGZPJMESA-N 396.443 2.542 0 50 GFAA COc1ccc(CN[C@H]2CNC(=O)c3cc(-c4cccc(OC)c4)nn32)cc1 263616811 KRGFPYYQTJMBMM-HXUWFJFHSA-N 378.432 2.599 0 50 GFAA CCOc1cccc(CN[C@H]2CNC(=O)c3cc(-c4ccc(OC)cc4)nn32)c1 263617967 QRKKWMVEHUANKN-OAQYLSRUSA-N 392.459 2.989 0 50 GFAA CCOc1cc(CN[C@@H]2CCC(=O)N[C@H]2c2cnn(C)c2)cc(Cl)c1OC 275700486 XOJNRDGSGXRMFK-QAPCUYQASA-N 392.887 2.590 0 50 GFAA CC(C)(NS(C)(=O)=O)c1noc([C@H]2CCN(c3ccccc3Cl)C2)n1 289770774 LFCHJIQKEBOMLM-NSHDSACASA-N 384.889 2.501 0 50 GFAA CNC(=O)c1ccc(Cl)c(NC(=O)N2CCC[C@H](Cn3ccnc3)C2)c1 299785599 MNKYXBWITMCODL-CYBMUJFWSA-N 375.860 2.840 0 50 GFAA COc1ccccc1-c1nc(C2CCN(c3ccnc(C(N)=O)c3)CC2)no1 302712148 KXOLDBAZAJOEBD-UHFFFAOYSA-N 379.420 2.623 0 50 GFAA C[C@H](NC(=O)[C@@H](C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)[C@H]1C[C@H]2CC[C@H]1C2 333480447 XUHUZIMQSSZNKP-QTCMIBMWSA-N 383.536 2.597 0 50 GFAA Cn1cc(-c2nn(C)cc2C(=O)NCc2ccccc2N2CCCCC2)cn1 363740589 IVEFLOWQNNIWEN-UHFFFAOYSA-N 378.480 2.741 0 50 GFAA COc1ccc(C(=O)N[C@H](C)c2ccccc2-n2cccn2)cc1OCCN 426536243 GUGYMRYQSDBXLD-OAHLLOKOSA-N 380.448 2.709 0 50 GFAA Cc1nc(C2CCN(C(=O)N[C@H](C)c3cnn(-c4ccccc4)c3)CC2)n[nH]1 426684536 RFIPIURRWBLABN-CQSZACIVSA-N 379.468 2.949 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(NC(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)c1C 483421705 VFGBHPZTFZXBDJ-HOCLYGCPSA-N 379.526 2.797 0 50 GFAA COc1cccc(-c2cc(CNC(=O)N(C)Cc3n[nH]c4c3CCC4)on2)c1 584901267 HGWWWMSOXKIQRB-UHFFFAOYSA-N 381.436 2.904 0 50 GFAA Cc1noc2nc(C3CC3)cc(C(=O)NCCc3nc(-c4ccccn4)no3)c12 670456109 NGBADYBHKYHAPU-UHFFFAOYSA-N 390.403 2.826 0 50 GFAA O=C1NC(=S)N/C1=C\c1ccc(-c2ccc(I)cc2)o1 828941871 NBNJTPAUOUJEJS-XFFZJAGNSA-N 396.209 2.896 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(c3nc(C(C)(C)C)ns3)C2)ccn1 886028012 OGOFSNHHAHKUNS-OAHLLOKOSA-N 375.498 2.524 0 50 GFAA Cc1ccccc1CN1CCC(N2C(=O)N[C@H]3CN(C(=O)C(C)C)CC[C@H]32)CC1 888103300 CEPNZIFLNXJHTA-LEWJYISDSA-N 398.551 2.610 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCC[C@@H](c2nnc3ccccn23)C1 952967797 DKHIURZLIVYVFW-MRXNPFEDSA-N 379.464 2.938 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)c2cnn(-c3ccccn3)c2C)n1 952988368 LLNFODHEJIJYHQ-INIZCTEOSA-N 396.451 2.515 0 50 GFAA Cc1cc(C)n(C[C@@H](C)N2CCN(c3cc(O)nnc3-c3ccccc3)CC2)n1 1506397393 SYHJDGJLPZZLJY-GOSISDBHSA-N 392.507 2.873 0 50 GFAA FC(F)Oc1cc(Cn2c([C@H]3CCCOC3)nnc2N2CCCC2)ccn1 1750371912 WHUOMEANFNBOCO-AWEZNQCLSA-N 379.411 2.817 0 50 GFAA CN1CC[C@]2(C(=O)N3CCCC3)CCCN(C(=O)/C=C/c3ccccc3)[C@H]2C1 1800410742 ZRBPXUVSAASQAB-QLFBYERYSA-N 381.520 2.635 0 50 GFAA O=C(Cc1ccsc1)NC[C@H]1[C@H]2CN(c3ccncc3F)C[C@]23CC[C@H]1O3 1857725930 AKOFBZRPPKHADG-QHDJUILOSA-N 387.480 2.625 0 50 GFAA O=C(NCC1(c2ccccc2Cl)CCOCC1)[C@H]1CNCC[C@@]12CCOC2 1875277092 GFCOMBKLQIEYBK-UTKZUKDTSA-N 392.927 2.521 0 50 GFAA Cc1c[nH]nc1C(=O)NCC[C@@H]1CCCN(C(=O)c2ccnc3ccccc23)C1 1875310242 KBEFKQNRTYIXTR-INIZCTEOSA-N 391.475 2.939 0 50 GFAA N[C@H](Cc1ccoc1)C(=O)N1CCc2[nH]c3ccc(Br)cc3c2C1 2325793374 RTTLBDQRVYUVQH-OAHLLOKOSA-N 388.265 2.978 0 50 GFAA C[C@H]1COCC[C@@H]1C(=O)N1CCC(n2nnc(-c3ccc(Cl)cc3)n2)CC1 2325810755 BNCZTSRBHSAREG-GUYCJALGSA-N 389.887 2.830 0 50 GFAA COc1ccc(CN2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1O 2356153476 ITCFCGOMXHSBQC-JBYIUTFZSA-N 388.508 2.661 0 50 GFAA O=C(NCc1ccc(F)c(F)c1)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356153677 QJJTVCJVGDXCNX-YGHRGLEHSA-N 397.425 2.913 0 50 GFAA Cn1cnnc1S[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1 797125 YJSLERVIOOTPTK-UONOGXRCSA-N 386.930 2.850 0 50 GFAA CC1(C)CC(=O)c2sc(NC(=O)CN3C(=O)c4ccccc4C3=O)nc2C1 2503031 WIXLLLJJTIUPNY-UHFFFAOYSA-N 383.429 2.533 0 50 GFAA O=S(=O)(c1ccc2nc[nH]c2c1)N1CCC2(CC1)OCCc1sccc12 2356143239 ZREIZLHQHMMKMO-UHFFFAOYSA-N 389.502 2.877 0 50 GFAA Cc1noc([C@@H]2CCCN2C(=O)c2cc3c(s2)CCOC32CCNCC2)n1 2356143386 FVXJDUWWGCRBAX-AWEZNQCLSA-N 388.493 2.568 0 50 GFAA COC(=O)c1ccc(N2CCOCC2)c(NC(=O)COc2ccc(C)cc2)c1 6710108 PITFRQTZUFDQNY-UHFFFAOYSA-N 384.432 2.636 0 50 GFAA Cc1cc(NC(=O)NC[C@H](N)c2ccccc2)ccc1-n1nnnc1C(C)C 415464792 NIBKHPPZPHSOFB-KRWDZBQOSA-N 379.468 2.916 0 50 GFAA CCCC(=O)Nc1cccc(C(=O)NC[C@H](c2cccnc2)N2CCOCC2)c1 55090182 MYEUBEGKQKETEH-HXUWFJFHSA-N 396.491 2.624 0 50 GFAA Cc1cc(C)c2nccc(N3CCN(C4CCN(C)CC4)[C@@H](CCO)C3)c2c1 106991674 MAHUNNGYNADBDL-FQEVSTJZSA-N 382.552 2.819 0 50 GFAA COc1ccc(C(=O)N2C[C@H](O)[C@@H](N3CCc4c(Cl)cccc4C3)C2)cc1 23337938 MNYAIMIVNKSAQZ-PMACEKPBSA-N 386.879 2.592 0 50 GFAA CN1CCN(C(=O)c2cnn(-c3ccccc3)c2NC(=O)c2cccs2)CC1 22022974 AVCYPCIFSYGJLT-UHFFFAOYSA-N 395.488 2.574 0 50 GFAA O=C(CCC1CCN(C(=O)Cn2cccn2)CC1)NCc1cccc(Cl)c1 67758684 RFQZMJDVMIKPCS-UHFFFAOYSA-N 388.899 2.872 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(C)[nH]c(C)cc2=O)CCC(=O)N1Cc1ccccc1 71759692 KXDVIKGLPJMMHR-GOSISDBHSA-N 381.476 2.645 0 50 GFAA CCN1CCN(Cc2ccc3oc4ccccc4c3c2)[C@H]2CS(=O)(=O)C[C@H]21 77406508 IWNOVCGTXALBEC-MOPGFXCFSA-N 384.501 2.889 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@@H](CC(=O)NCCCC(C)(C)C)CO2 71776853 ZUEZCYKAWGCWOS-INIZCTEOSA-N 375.513 2.918 0 50 GFAA COc1cc(C)c(CN(C)C(=O)NCc2ccc(-n3ccnc3)nc2)cc1OC 363224106 PZVCAWYRHMGMLH-UHFFFAOYSA-N 395.463 2.935 0 50 GFAA O=C1CCCN1C[C@H]1CCCCN1C(=O)C1CCN(C(=O)c2ccccc2)CC1 363565892 JEERZVOYVGUJFZ-HXUWFJFHSA-N 397.519 2.542 0 50 GFAA CON(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](C3CC3)C2)ccc1Cl 368043984 IUJWIARWJGFKOB-CQSZACIVSA-N 386.901 2.784 0 50 GFAA CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N1C[C@@H](C)O[C@H](C)C1 242339124 ZFCPPABPIOZQBF-UYZGVZLJSA-N 376.541 2.979 0 50 GFAA Cc1c(C(=O)N2CCC[C@@](O)(CN(C)C)C2)n[nH]c1-c1ccc(Cl)cc1 72163905 HINFWASBUHVYRN-LJQANCHMSA-N 376.888 2.567 0 50 GFAA C[C@]1(Cc2ccccc2)CCCN1C(=O)NCc1ccccc1S(N)(=O)=O 288057232 SHZZOSYCAJNOFH-HXUWFJFHSA-N 387.505 2.641 0 50 GFAA Cc1cc(C)cc(NC(=O)[C@@H]2[C@@H]3C(=O)N(c4cc(C)on4)C[C@@]34C=C[C@H]2O4)c1 229851473 PWNRLDPQVXUNFA-HVSHLEFESA-N 379.416 2.525 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)[C@H]3CCN(C)C3)csc2C1 426737544 TUJNCYXFEBNIAE-HNNXBMFYSA-N 388.537 2.687 0 50 GFAA CC(=O)c1ccc(F)cc1-c1ccc(C(=O)N2CCS(=O)(=O)CC2)cc1 426490238 RQQKIZJBALTQGT-UHFFFAOYSA-N 375.421 2.566 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@@H](CCO)C1CCCCC1 179401450 JXRCSWRUYKESPW-IBGZPJMESA-N 398.507 2.520 0 50 GFAA CN(C)C[C@@H](c1ccccc1)N(C)C(=O)c1cnc(-c2ccccc2)[nH]c1=O 91664626 BVZGWOYEGADNSR-IBGZPJMESA-N 376.460 2.812 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)N1CCCC[C@@H]1c1ccc(F)cc1 95518969 HDCGRHWAFQSWMY-LJQANCHMSA-N 384.455 2.736 0 50 GFAA Cc1cnc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)cn1 95387887 BWXZVDMUIMIAAK-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(c2nccnc2N2CCCC2)C1 95512609 HSYQQMUAWVBRSF-GOSISDBHSA-N 383.544 2.609 0 50 GFAA CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@@H]1c1ccc(OC)cc1 55228002 IKNVYAPBJGMVBC-LJQANCHMSA-N 387.480 2.742 0 50 GFAA COc1cccc([C@H]2CCCN2C(=O)COc2ccc(N3CCCC3)nn2)c1 299786534 MXMSVAAKRPCCBM-GOSISDBHSA-N 382.464 2.828 0 50 GFAA N=[S@@]1(=O)CCC[C@]2(CCCN2C(=O)NCc2ccc(N3CCCC3)nc2)C1 1875393096 GDPPYJINVSQJEV-XHCCPWGMSA-N 391.541 2.567 0 50 GFAA COc1cc2c(=N[C@H](C)c3ccc(OCC(N)=O)cc3)[nH]c(C)nc2cc1F 1875320241 MKRRSCBCRDSOCO-LLVKDONJSA-N 384.411 2.545 0 50 GFAA C[C@@H](Cc1ccc(F)cc1Cl)N[C@@H]1C[C@@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875311542 DUCROZJLHMDVIS-PCHOHSICSA-N 395.862 2.734 0 50 GFAA CC[C@H]1CC[C@](O)(C(=O)N2CCC(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1875271776 SYTDCQSAEPOXSH-OXJNMPFZSA-N 379.522 2.701 0 50 GFAA Cc1ccccc1-n1cc(CN2CCNC(=O)[C@H]2c2ccccc2Cl)nn1 952845621 ICFGTZCKNBVGOA-LJQANCHMSA-N 381.867 2.902 0 50 GFAA Cn1ccnc1[C@@H]1[C@@H](C(=O)N2CC(c3ccc(F)cc3)C2)CCC(=O)N1C1CC1 888093572 HUGYYIUXIAZSGZ-ICSRJNTNSA-N 396.466 2.627 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)NC[C@H]1CCOC1)CC2 276602594 VOLYSZAWROGJEG-SJLPKXTDSA-N 391.537 2.697 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)c1nccc(N2CCC[C@H](O)C2)n1 1529145945 QKHURQLNXNEZEH-INIZCTEOSA-N 380.496 2.691 0 50 GFAA CC(C)CCN1CCNC(=O)[C@@H]1CC(=O)N(C)Cc1ccc(C(F)(F)F)cc1 11843093 WEWXEKZRXPFBDC-KRWDZBQOSA-N 399.457 2.900 0 50 GFAA COCCC(=O)N1CC[C@@]2(CCCN(Cc3cccc(OC)c3OC)C2)C1 12479284 DBBQRAPKZRHYRN-OAQYLSRUSA-N 376.497 2.555 0 50 GFAA Cc1nonc1C(=O)N(CC1CCN(C2CCCC2)CC1)C[C@H]1CCCO1 12586931 IYETTYSCGDPTMM-GOSISDBHSA-N 376.501 2.654 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)C3CCN(C)CC3)CC2)cc1 12704116 CLDMLDGSLUUCFC-UHFFFAOYSA-N 387.568 2.750 0 50 GFAA CSc1nnc(CNC(=O)Cc2csc(C)n2)n1-c1ccc(F)cc1 14881398 AJRLPHNFOFODAW-UHFFFAOYSA-N 377.470 2.752 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)N2CCCCO2)[C@H](c2ccccc2Cl)N1C 15080052 ZXUBTFDLTVLJCM-QOKNQOGYSA-N 380.872 2.819 0 50 GFAA COc1cc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c(C)cc1Br 16578919 YMPIWVGNRHIZOR-PHIMTYICSA-N 378.288 2.564 0 50 GFAA C[C@@H]1CCCN([C@H]2CCC(=O)N(CCS(=O)(=O)c3ccccc3)CC2)C1 19798658 GXNVZKPVOVQABJ-MSOLQXFVSA-N 378.538 2.573 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)N1CCCNCC1 1857714509 BXSJPYLFUIIVND-CQSZACIVSA-N 376.888 2.910 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4nccn4C)C3)nc2c1 1857728998 JBTWRQSMCRQSDT-HNNXBMFYSA-N 397.479 2.535 0 50 GFAA CN(C)c1ncc(Br)cc1C(=O)N1CC[C@@H](Oc2ccncc2)C1 120598540 FRYLDCDKZBQXIM-CQSZACIVSA-N 391.269 2.599 0 50 GFAA O[C@@H](COc1ccccc1)CN1CCN(c2ncc(C(F)(F)F)s2)CC1 252491753 LSGWCNMKFBBMLR-CYBMUJFWSA-N 387.427 2.724 0 50 GFAA COc1cc2c(cc1OC)CN([C@H]1CCCN(CCCn3cccn3)C1)CC2 20785618 HWEUCLGYUXCQNC-FQEVSTJZSA-N 384.524 2.813 0 50 GFAA O=C1COc2c(cc(Cl)cc2NC(=O)[C@H]2CCCN2c2nccs2)N1 367974145 RGJNMKHTLZMBOE-GFCCVEGCSA-N 378.841 2.735 0 50 GFAA O=C(NCc1ccc(COC2CCOCC2)cc1)c1nc2ccccc2c(=O)[nH]1 161995910 DFHAWTUBQLTCKK-UHFFFAOYSA-N 393.443 2.549 0 50 GFAA O=C(Nc1ccc(-n2nnnc2O)cc1)c1cc(C(F)(F)F)cc(Cl)n1 811387346 VRHFDSPITCLSKG-UHFFFAOYSA-N 384.705 2.687 0 50 GFAA Cc1ccc(N2CCNC2=O)cc1NC(=O)N1Cc2cnn(C)c2CC(C)(C)C1 852974704 RHIIIHYSPQKVQC-UHFFFAOYSA-N 396.495 2.875 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCC(C)C)C[C@H]1NC(=O)c1cccc2c1NCCC2 2100482506 DYBFZXNPJSTRTJ-QXAKKESOSA-N 387.524 2.730 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCC2=CCCCC2)CC[C@@H]1NC(=O)c1cc[nH]n1 2100536824 ADEKMUNQEJFYIM-LNLFQRSKSA-N 388.512 2.720 0 50 GFAA Cc1nccn1-c1cc(NCCNC(=O)c2cccc(C(F)(F)F)c2)ncn1 35598165 XPWJAVGUVUCIGG-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA CCC(CC)[C@H]1CCN(C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)C1 2325761182 WGNQMQVZCPOEIW-ZDUSSCGKSA-N 379.482 2.702 0 50 GFAA O=C(Nc1cccc2c1CNCC2)[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 2325774681 IONOVEYAJYVDLW-INIZCTEOSA-N 391.450 2.931 0 50 GFAA O=C(O)c1cccc(S(=O)(=O)NC[C@H](O)c2csc3ccccc23)c1 2325875525 VANUTSMIPWIUPB-HNNXBMFYSA-N 377.443 2.611 0 50 GFAA O=C(NCc1ccc(-c2nn[nH]n2)cc1)[C@@H](Cc1cccnc1)C1CCCC1 865592809 BUSDUOUOHOZRBN-IBGZPJMESA-N 376.464 2.927 0 50 GFAA CCOc1cc2c(cc1CN1CC[C@@H](O)[C@@](CO)(CCCOC)C1)CCC2 2356137825 BBPQENYYAMRRCO-YADHBBJMSA-N 377.525 2.546 0 50 GFAA O=C(N[C@@H](CSCCO)C(=O)O)OCC1c2ccccc2-c2ccccc21 2567625 VDIVFUTVJUGBOW-SFHVURJKSA-N 387.457 2.704 0 50 GFAA COC(=O)[C@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(Cl)cc1 4071068 DXQDJIWIUZLXPO-KRWDZBQOSA-N 392.864 2.884 0 50 GFAA biogenic O=C(NCc1nccn1-c1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 225702037 XXCUWBRYTCBSPT-UHFFFAOYSA-N 391.399 2.799 0 50 GFAA O=C1C[C@H](Nc2ccc(N3CCOCC3)cc2)C(=O)N1c1ccc(Cl)cc1 100568037 SLNRJSZMIORPRD-SFHVURJKSA-N 385.851 2.921 0 50 GFAA Cc1c(-c2ccccc2)n[nH]c1C(=O)N1CCC([C@@H](C)N2CCOCC2)CC1 72420133 OWEOKIFIQCMQHH-QGZVFWFLSA-N 382.508 2.958 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@H](O)c3ccc(C)cc3)c2C)cc1 252496007 PEGHXXXLROMOSZ-FQEVSTJZSA-N 378.476 2.969 0 50 GFAA O=C(N[C@H]1CCCN(CCCc2ccccc2)C1)c1nnc2n1CCCCC2 72154529 ZCOFYWNILHTXAN-IBGZPJMESA-N 381.524 2.832 0 50 GFAA CC(C)n1cnc(C(=O)NC2CCC(NC(=O)c3cn(C(C)C)cn3)CC2)c1 282714752 LHCPKISDTHNLIR-UHFFFAOYSA-N 386.500 2.712 0 50 GFAA CCCCC[C@H](O)/C=C/[C@@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(=O)OC 33840710 YHZGUPUYNUZFPZ-YXAYYDLRSA-N 384.513 2.534 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N3CC(=O)N[C@H]4CCCC[C@H]43)ccc12 131163011 DHBSTLIHAMRAEK-PKOBYXMFSA-N 389.459 2.612 0 50 GFAA O=C(C(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1)c1ccco1 71662497 DEFCYXWGCTVLEP-GDIGMMSISA-N 386.398 2.829 0 50 GFAA O=C(NCC[S@@](=O)Cc1ccccc1)NC[C@@H](O)c1ccccc1Cl 127148635 OSBDLIQTKBCSCC-NSYGIPOTSA-N 380.897 2.622 0 50 GFAA CC(C)[C@H]1CN(CC(=O)N(C)C(C)C)CCC(=O)N1Cc1ccc(F)cc1 71761273 OZFSHULMGCRLRY-LJQANCHMSA-N 377.504 2.751 0 50 GFAA COc1ccc(-n2nc(C(=O)NCc3ccc(-n4ccnc4)nc3)cc2C)cc1 378377159 MOEFTLPDSUYJHT-UHFFFAOYSA-N 388.431 2.700 0 50 GFAA Cc1n[nH]c(CCNC(=O)c2cnc3c(c2)nc(-c2ccccc2Cl)n3C)n1 77342786 VKQBDBOANWHVLL-UHFFFAOYSA-N 395.854 2.688 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)c3ccc(OC)c(OC)c3)n2)c1 44901858 OSRQHEPQABBTAL-UHFFFAOYSA-N 380.400 2.819 0 50 GFAA CCc1cc(N2CCC(NC(=O)c3ccc(C(F)(F)F)nc3)CC2)ncn1 177160917 LSLIDWOIGWBLBW-UHFFFAOYSA-N 379.386 2.852 0 50 GFAA Cc1cnn([C@@H](C)C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)c1 82126146 YXLJOUKWSAATCQ-KRWDZBQOSA-N 384.528 2.804 0 50 GFAA O=C(NC1CCN(CCc2ccccc2)CC1)N[C@H]1CCN(c2ccccn2)C1 178705289 YFDQGPAHUBTJTD-NRFANRHFSA-N 393.535 2.667 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCO[C@@H](Cn2cccn2)C1 221371065 QOJSXNZGUNHYBZ-GOSISDBHSA-N 380.448 2.707 0 50 GFAA CC(=O)NCCC(=O)N1CCC2(CC1)C[C@H](c1ccccc1)CN(C1CC1)C2 95357996 VDODOUQMJRDTSD-FQEVSTJZSA-N 383.536 2.773 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(C(=O)CCc3ccccc3)CC2)n1C 96150411 GMEWCZHXNUUHNZ-UHFFFAOYSA-N 392.507 2.707 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNC(=O)c2ccccc2-c2nc[nH]n2)C1 97743168 FPPOZEAAISMSNI-KRWDZBQOSA-N 375.476 2.999 0 50 GFAA O=C(c1cc(Cl)ccc1F)N1C[C@@H]2CN(C3CCCC3)C[C@]2(C(=O)O)C1 96148569 FBSYCSVVFIIUGI-BUXKBTBVSA-N 380.847 2.880 0 50 GFAA O=C(NCc1cc2n(n1)CCCN(C1CCCCC1)C2)c1ccc(CO)cc1 92037336 MMERNJFBSCWDBW-UHFFFAOYSA-N 382.508 2.844 0 50 GFAA CCc1nccn1CCCNC(=O)Nc1c(C)c(C)c2c(c1C)NC(=O)CO2 96148581 BQVUAQOFUHNLEX-UHFFFAOYSA-N 385.468 2.913 0 50 GFAA Cc1ccc2c(C)c(C(=O)N[C@H]3C[C@@H](c4nnc(CN(C)C)n4C)C3)oc2c1 244817206 SWBITWVGCPCBEF-GASCZTMLSA-N 381.480 2.916 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N2CC(n3nc(C)cc3C)C2)cc1 534632502 OFOYBUXXDOCMKJ-UHFFFAOYSA-N 380.452 2.665 0 50 GFAA Cc1ncsc1CCCNC(=O)[C@@H]1CC(Cc2ccc3c(c2)OCO3)=NO1 299763827 FBUNEWNHSKUIJC-KRWDZBQOSA-N 387.461 2.617 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@H]([C@H](C)c2ccccc2)C1 1875297494 STZVMAFOOGBMIV-WBMJQRKESA-N 376.478 2.810 0 50 GFAA O=C1OCCN1[C@@H](CC(=O)N1c2ccncc2N2CC[C@H]1C2)c1ccccc1 1875396730 SSNATLKWKWLOEH-WMZOPIPTSA-N 378.432 2.591 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)Nc3cccc(N(C)C(N)=O)c3)ccc21 1875372176 YNKVCGULSJZGQZ-UHFFFAOYSA-N 378.432 2.919 0 50 GFAA C[C@]1(c2ccc(CN=c3cc(C4CCCCC4)nc[nH]3)cc2)NC(=O)NC1=O 1875360671 FDVQDILCEYGZGT-OAQYLSRUSA-N 379.464 2.613 0 50 GFAA CC(C)Cc1ccc([C@H](C)C(=O)NCc2cn([C@H]3C[C@H](C(=O)O)C3)nn2)cc1 1875305537 DLVITBUBZHEJAG-FNHZYXHNSA-N 384.480 2.932 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1NCc1ccc(OCc2ccncc2)cc1 1875400403 YOTBYTUZIGYCDE-KSEOMHKRSA-N 378.476 2.786 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)Cc2cccs2)C1)c1ccc2nc[nH]c2c1 952965002 CIVSJRVQPOXSEQ-CQSZACIVSA-N 382.489 2.836 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCC[C@@]3(C2)C(=O)Nc2ccccc23)n[nH]1 952986859 GQADJSJEIDJCCD-NRFANRHFSA-N 375.432 2.541 0 50 GFAA O=C(NCCc1csc(-c2ncccn2)n1)[C@@H]1CCCN(Cc2ccco2)C1 952991161 ZRXBUUYPCQHHKM-OAHLLOKOSA-N 397.504 2.764 0 50 GFAA C[C@H](N)[C@@H](C)C(=O)NCCSCCOc1cccc(Br)c1 192048403 RMKGWJGTDUWMHD-NEPJUHHUSA-N 375.332 2.661 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@H](C)N2CCCC2)ccc1F 1704308012 CFMIHABRECAXFP-ZDUSSCGKSA-N 390.459 2.769 0 50 GFAA Cc1ccc(Cn2c(CN3CCC([C@H](O)CO)CC3)nc3ccccc32)cc1 1772705043 JUTBVGZPWZFBGS-JOCHJYFZSA-N 379.504 2.958 0 50 GFAA Cc1cc(NC(=O)CCc2c(C)nc3ncnn3c2C)ccc1N1CCCC1=O 11746172 YBOAAEDVECQVIT-UHFFFAOYSA-N 392.463 2.748 0 50 GFAA COc1ccc(-c2noc(CN3CCC[C@@H](CCCO)C3)n2)c(OC)c1OC 11774648 SBJHCNOWHSITOT-AWEZNQCLSA-N 391.468 2.747 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@H](n3cc(C(=O)N4CCOCC4)nn3)C2)cc1 12326030 CXLSRCORCKDVBN-HXUWFJFHSA-N 397.523 2.711 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)C4CCC4)C3)C2=O)c1OC 12597457 VMUUKOIEZQLHEG-JOCHJYFZSA-N 386.492 2.845 0 50 GFAA CCOC(=O)[C@@]1(CCOC)CCCN(Cc2cc(OC)c3c(c2)OCO3)C1 15063945 RXTJQVBMPOFTLS-HXUWFJFHSA-N 379.453 2.606 0 50 GFAA COc1cc(OC)c(C(=O)N2CCN(Cc3ccc(F)cc3)CC2)cc1OC 16604145 NDHFXJCSQNTXJN-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA CNC(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)Cc1ccc(Cl)cc1Cl)C2 1857531693 CPRHBKCTOAWEFB-ZBINZKHDSA-N 394.258 2.898 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(Cc3ccc4c(c3)OCCO4)CCN12 1857673219 LMFPYVZWZQLIPB-JOCHJYFZSA-N 380.444 2.707 0 50 GFAA CCc1ccccc1CN1C[C@H](C(=O)O)C2(CCN(Cc3ncc[nH]3)CC2)C1 1857684145 AOYMLUWMTFWCHI-LJQANCHMSA-N 382.508 2.771 0 50 GFAA COc1ccc(C(=O)NCc2cc[nH]n2)cc1Oc1cccc(OC)c1CN 1857685551 MPIXXUXZRHCQLH-UHFFFAOYSA-N 382.420 2.608 0 50 GFAA COc1ccc2cc(CN3C[C@@H]4[C@H](CNC(C)=O)[C@H]5CC[C@]4(C3)O5)ccc2c1 1857717433 RUJKBFCFRZPKRG-WBADGQHESA-N 380.488 2.964 0 50 GFAA O=C(c1c[nH]nc1C1CCCCC1)N1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1 1857723265 XNJZAAAPGMXHFK-OFNKIYASSA-N 397.519 2.886 0 50 GFAA CCCOc1c(CN2CC[C@@]34OCCN3C(=O)C[C@@H]24)cc(Cl)cc1OC 1857731886 SFBJMRNEMHNPGM-APWZRJJASA-N 380.872 2.671 0 50 GFAA O=C(CCc1ccsc1)N1CCN([C@H]2CCN(c3ccccc3)C2=O)CC1 112622696 CDFKWDRGAYQBHA-IBGZPJMESA-N 383.517 2.630 0 50 GFAA O[C@H](COc1ccccc1)CN1CCN(c2ncc(C(F)(F)F)s2)CC1 252491754 LSGWCNMKFBBMLR-ZDUSSCGKSA-N 387.427 2.724 0 50 GFAA Cc1nc(N2CCN([C@@H]3CCN(c4c(F)cccc4F)C3=O)CC2)sc1C 157476864 VKEGLPPBTVWAGT-MRXNPFEDSA-N 392.475 2.966 0 50 GFAA COc1ccc(CN2CCC(CNC(=O)N[C@@H](C)c3cnn(C)c3)CC2)cc1 266532448 KTMWEXBUOUODPD-INIZCTEOSA-N 385.512 2.701 0 50 GFAA CN(C)Cc1cccc(Cn2nc(-c3ccc4c(c3)OCCO4)ccc2=O)c1 2325761012 SNRBDJQCPNLYDK-UHFFFAOYSA-N 377.444 2.791 0 50 GFAA CC(=O)NC1(C)CCN(CC(=O)NCC2(c3ccc(F)cc3)CCCC2)CC1 2325804090 UZHVQSOVFAAQOP-UHFFFAOYSA-N 389.515 2.744 0 50 GFAA NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1cc2ccccc2o1)c1ccc(Cl)cc1 2325850717 FYCFYCHXICQMMS-IRXDYDNUSA-N 385.851 2.689 0 50 GFAA CCOC(=O)CN1C(=O)[C@@](O)(CC(=O)c2cc(C)c(C)cc2C)c2ccccc21 1064958 YMKWRUBKSNTRNS-HSZRJFAPSA-N 395.455 2.982 0 50 GFAA COc1ccc([C@H]2C(C(=O)NCc3ccccc3)=C(C)Nc3ncnn32)cc1 4695800 GUTCRUDPBHYHBM-IBGZPJMESA-N 375.432 2.892 0 50 GFAA CC(=O)c1cc(C(=O)N(C)C[C@@H]2CCCN(CCc3ccccc3F)C2)[nH]n1 11819105 WHJGRUCQPUJYID-INIZCTEOSA-N 386.471 2.778 0 50 GFAA COC(=O)CCC(=O)N1CC[C@@H](C2CCN(Cc3cccc(F)c3F)CC2)C1 11842847 DUTHVTPPVTWGAS-MRXNPFEDSA-N 394.462 2.979 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)c3cc(C)nn3C)C2)cc1 12073507 IVUIAONBXIJQGP-LJQANCHMSA-N 384.524 2.764 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)c2cc(C)n(C)n2)C1 12438381 YUVLAQSOBQYCDN-GOSISDBHSA-N 384.524 2.764 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H]2CC(=O)N(Cc3cccc(F)c3)C2)c(C)c1 12707035 SWNDCMMVRBFYJH-KRWDZBQOSA-N 376.453 2.522 0 50 GFAA CCN(Cc1ccccc1)[C@@H]1CCc2c(c(C(=O)N3CCSCC3)nn2C)C1 14748928 WOMODPIMCGQYNV-GOSISDBHSA-N 398.576 2.989 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1nnc2n1CCCCC2 19836243 BIHNXYRXHDNBPM-UHFFFAOYSA-N 378.480 2.666 0 50 GFAA COC(=O)C1[C@H](c2ccccc2)C(C(=O)N2CCN(C)CC2)[C@H]1c1ccccc1 19893305 HZUPVYCEFDDLAF-JTVPBKEVSA-N 392.499 2.747 0 50 GFAA Nc1ncc(-c2cc(C(=O)N3CCCN4CCC[C@H]4C3)c3ccccc3n2)cn1 23429922 MUHPNZOENVVEPW-INIZCTEOSA-N 388.475 2.584 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)c1OC 39510114 HMPUARZYOLUQQY-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA COCCN(C)C(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 55270950 ONIXQNRPBIXFAQ-UHFFFAOYSA-N 387.568 2.776 0 50 GFAA O=C1NC[C@H](c2ccc(F)cc2)Cc2[nH]c(Cc3cnc4ccccn34)nc21 65386790 FUXZDQKMBKWKAK-CQSZACIVSA-N 375.407 2.857 0 50 GFAA O=C(c1cc(=O)c(O)co1)N1CCC[C@H](c2[nH]ncc2-c2ccc(F)cc2)C1 67434152 RLLXILWIJZZSEL-ZDUSSCGKSA-N 383.379 2.894 0 50 GFAA CNc1cc(C(=O)N[C@H]2CC[C@H](Nc3nccc(-c4ccccn4)n3)C2)ccn1 72152772 FZJGCAYWBBSEDM-HOTGVXAUSA-N 389.463 2.738 0 50 GFAA Cc1ccc2nc(N3CCC[C@H](O)C3)c(CN(C)Cc3cnccn3)cc2c1 72447418 HBFSNDWQMIAUGG-FQEVSTJZSA-N 377.492 2.926 0 50 GFAA CSc1nccc(N2CCC(C(=O)O)(n3ccc(-c4ccco4)n3)CC2)n1 72448003 LGYXFELLQXJJFU-UHFFFAOYSA-N 385.449 2.735 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1)c1cn(CC[C@H]2CCCCN2)nn1 77357969 ZKQYRKTZCRBPMB-OAHLLOKOSA-N 381.402 2.759 0 50 GFAA Nc1cc(N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C2CC2)C3)ncn1 91586181 LLHFFQYLYLDXBP-SFHVURJKSA-N 377.492 2.824 0 50 GFAA CCNC(=O)N1CCC(n2cc([C@H](C)Cc3ccc4c(c3)OCO4)nn2)CC1 91691171 KCTILQZFODTRCS-CQSZACIVSA-N 385.468 2.719 0 50 GFAA Cc1ccccc1[C@@H]1CN(C(=O)c2cc(-c3ccccn3)n[nH]2)C[C@H]1C(=O)O 91746833 KWBMFPVCSCQVAP-JKSUJKDBSA-N 376.416 2.721 0 50 GFAA Cc1nccn1CCC(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95368132 SHGPTSDLXFJIHL-GHTZIAJQSA-N 378.520 2.672 0 50 GFAA O=C(CN1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N2)NCC1CCCCC1 95370443 DUDZVMGVCIDGEC-FQEVSTJZSA-N 383.536 2.821 0 50 GFAA CCc1ncc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(OC)cc2)C3)cn1 95371865 MXKPGTACANKYRW-PKOBYXMFSA-N 380.492 2.784 0 50 GFAA Cc1ncsc1CCC(=O)N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)O)C1 95376201 GAXRMIQTTWIPEL-MGPUTAFESA-N 386.473 2.549 0 50 GFAA O=C(c1cc(-c2ccccc2O)n[nH]1)N1CCC[C@H](OCc2ccccn2)C1 95388021 JNIVJWQNHILVOM-INIZCTEOSA-N 378.432 2.999 0 50 GFAA CCc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4F)CC3)C2=O)cc1 95496420 GRDUOYWBTUCWBY-FQEVSTJZSA-N 381.451 2.842 0 50 GFAA O=C1CC2(CCN(C(=O)N3CCOCC3)CC2)CN1Cc1ccc(Cl)cc1 95498974 RHFWPICGEJIKTB-UHFFFAOYSA-N 391.899 2.607 0 50 GFAA COCCCCN1CCN(c2nc(C)nc3c2Cc2ccccc2OC3)CC1 95521504 NMJILLOQODBMCL-UHFFFAOYSA-N 382.508 2.817 0 50 GFAA Cc1ccccc1N1CCN(c2cc(C(=O)N3CCOCC3)ccn2)[C@H](C)C1 95525376 NTVJUBOBOPTOIR-GOSISDBHSA-N 380.492 2.578 0 50 GFAA COc1ccc(F)c(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 95526543 IMMDJXJJVXQMGJ-UHFFFAOYSA-N 398.482 2.843 0 50 GFAA O=C(C1CCCC1)N1C[C@@H]2CN(Cc3cc(F)cc(F)c3)C[C@]2(C(=O)O)C1 96131506 FDWICKTZOVDKGC-YWZLYKJASA-N 378.419 2.500 0 50 GFAA Cn1c(CN2CCCCCC2)nnc1C1CCN(C(=O)c2cccnc2)CC1 96166668 YZDUNCAWVWMZRQ-UHFFFAOYSA-N 382.512 2.606 0 50 GFAA O=C(C1CCCCC1)N1CCN([C@H]2CCN(c3c(F)cccc3F)C2=O)CC1 118960677 VCLSOZNAWHWINJ-SFHVURJKSA-N 391.462 2.795 0 50 GFAA O=C(CN1CCCN(C(=O)c2cccc(F)c2)CC1)NCC1CCCCC1 126692093 YQLRJNBYBWMTKB-UHFFFAOYSA-N 375.488 2.670 0 50 GFAA Cc1cc(C(=O)N[C@H]2CS(=O)(=O)c3ccccc32)c2cnn(C(C)C)c2n1 172327683 WSNILRDXLICYML-INIZCTEOSA-N 384.461 2.579 0 50 GFAA Cc1nsc(N2CCCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)n1 173879311 WAHUHDRGZQGISQ-UHFFFAOYSA-N 390.893 2.540 0 50 GFAA CC(C)(C)C(=O)Nc1nc(CC(=O)NCc2ccnc(-n3ccnc3)c2)cs1 173885866 XAYZDIKFDVLXRT-UHFFFAOYSA-N 398.492 2.567 0 50 GFAA CC(=O)N1CCC(NC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)CC1 184604602 YBRVKGSUHFCMRG-HNNXBMFYSA-N 398.429 2.594 0 50 GFAA COc1cc(C)sc1C(=O)N[C@@H]1COCC[C@H]1Oc1ccc(CO)cc1 223695360 DONAZBFVCSLSTP-HZPDHXFCSA-N 377.462 2.524 0 50 GFAA O=C(Nc1ncc(-c2ccccc2)s1)C(=O)N1CCC[C@H]1Cn1ccnc1 225742921 NZQWVDQGNZCXCB-HNNXBMFYSA-N 381.461 2.636 0 50 GFAA COc1ccccc1COC[C@@H](O)CN1CCO[C@@H](c2ccc(F)cc2)C1 229698209 DAEYUBBZOKTJJV-PZJWPPBQSA-N 375.440 2.785 0 50 GFAA CCN(CC)C(=O)c1cn([C@H]2CC[C@@H](NC(=O)c3cccs3)CC2)nn1 244678927 IMKZLFZUYBHRGF-OKILXGFUSA-N 375.498 2.735 0 50 GFAA COCCCNc1cnn(C23C[C@@H]4CC(C[C@H](C4)C2)[C@H]3C(=O)O)c(=O)c1Cl 245257679 CMBTUTCYOMITKY-PCPLBYIQSA-N 395.887 2.581 0 50 GFAA O=C(N[C@H]1C[C@H](c2cc(O)nc(C3CC3)n2)C1)c1ccc(-n2cccn2)cc1 253535242 LEFCTIZLLGCZHQ-WKILWMFISA-N 375.432 2.921 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1 299778121 PDWRJFNXUMDKTG-MRXNPFEDSA-N 378.448 2.549 0 50 GFAA Cn1c(O)nc2ccc(C(=O)N3CCC4(CC3)C[C@H]4C(=O)N3CCCCC3)cc21 329126757 ULQKGWDGUBMSQL-INIZCTEOSA-N 396.491 2.534 0 50 GFAA CC(C)n1cc(S(=O)(=O)N2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)cn1 333181537 PWBQESSHFVMQIV-CQSZACIVSA-N 395.447 2.834 0 50 GFAA O=S(=O)(c1cnn([C@@H]2CCOC2)c1)N1CCC[C@@H]1C[C@H]1C[C@H]2CC[C@H]1C2 333437862 JCRJNAFIELAJKM-QXDIGNSFSA-N 379.526 2.824 0 50 GFAA CC(C)(C)NC(=O)c1cccc(NC(=O)N2CCO[C@@H]([C@@H]3CCCO3)C2)c1 363962103 PWXPXJZCIMHGRV-DLBZAZTESA-N 375.469 2.627 0 50 GFAA Cc1c(C(=O)N2CCC[C@@]23CCOC3)sc2nc3n(c(=O)c12)CCCCC3 367653583 OQRFIAZMGILDBM-FQEVSTJZSA-N 387.505 2.888 0 50 GFAA CCCc1cc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)n2ncnc2n1 377161558 LOAUNGVEYKQUEK-KRWDZBQOSA-N 393.495 2.730 0 50 GFAA CN(C(=O)N1CCC(c2c[nH]c3ccccc23)CC1)[C@@H]1CCS(=O)(=O)C1 408018670 UTOYACNZUNXKOA-OAHLLOKOSA-N 375.494 2.586 0 50 GFAA CC(C)NC(=O)CCN1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 426445465 HDILNVHNEUIXGE-OAQYLSRUSA-N 375.488 2.555 0 50 GFAA Cn1cc(CCNC(=O)N2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)cn1 426548786 MTYCPKAODHKTHX-LEWJYISDSA-N 378.476 2.676 0 50 GFAA CCOCCCn1c(Cc2ccccn2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C 460688751 DLIISTKNZIWILW-QZTJIDSGSA-N 386.544 2.609 0 50 GFAA CN1C(=O)C[C@H](C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)c2ccccc21 952975449 NMYADSXGNRXEMV-SFHVURJKSA-N 377.444 2.597 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)NC[C@H](c3ccco3)N(C)C)o2)c1C 1506425067 CCSRXCRIALCBPV-CYBMUJFWSA-N 379.438 2.726 0 50 GFAA COCC(=O)N1CC[C@@]2(O)CCN(Cc3ccc(C)c4ccccc34)C[C@H]2C1 1565528081 IGAVFGBMADOYBQ-CVDCTZTESA-N 382.504 2.580 0 50 GFAA Cc1cccc(OCC(=O)N2CCCN(C(=O)c3ncoc3C(C)C)CC2)c1 1772701869 PGUWIFMYMPXULX-UHFFFAOYSA-N 385.464 2.860 0 50 GFAA COc1ccc(-c2nccn2C23C[C@H]4C[C@@H](CC(n5nnc(C)n5)(C4)C2)C3)cn1 1857673112 GPCPNJOBHJZFLB-AJHHTPGJSA-N 391.479 2.953 0 50 GFAA Cc1ccc2ncnc(N3CCN4C(=O)OC[C@@]4(Cc4ccccc4)C3)c2n1 1857700177 BGVDVQSROBPMLT-OAQYLSRUSA-N 375.432 2.587 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCc4cccnc4N)C3)nc2c1 1857727747 YTGJZYKVWNFJES-AWEZNQCLSA-N 395.463 2.737 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2ccc3oc(=O)n(C)c3c2)C[C@H](C(C)C)O1 1875246369 OKDZNARTIITLFK-RDTXWAMCSA-N 396.509 2.736 0 50 GFAA CCN(CC1CCN(C(=O)c2scnc2C)CC1)c1nccc(OC)n1 1875302361 MQJIPUVPPTXLMD-UHFFFAOYSA-N 375.498 2.629 0 50 GFAA COCCN(C(=O)[C@@H](O)CN1CCCC1)[C@@H](C)c1cccc(C(F)(F)F)c1 1875308803 YHCPLVVCHKRMMN-YOEHRIQHSA-N 388.430 2.698 0 50 GFAA COc1ccc(C)cc1CCNC(=O)N1CCC[C@]12CCC[S@](=N)(=O)C2 1875393792 SWLAQFKJKMTTAX-BCHFMIIMSA-N 379.526 2.931 0 50 GFAA CC(C)(C)O[C@@H]1C[C@@H](NC(=O)N=c2nc(C3(C)CC3)[nH]s2)C12CCOCC2 1875396510 KINZGWKQOGMYEC-CHWSQXEVSA-N 394.541 2.886 0 50 GFAA CCc1nc([C@H]2OCC(=O)N[C@@H]2c2ccc(OC)c(OC)c2)n(C(C)(C)C)n1 2100483476 WTIAMOQGDGSNMC-MSOLQXFVSA-N 388.468 2.542 0 50 GFAA O=C(c1n[nH]c2cc(OC(F)(F)F)ccc12)N1CCNC[C@@H]1c1ccncc1 2325753373 CEAWKXTUYJQCEX-OAHLLOKOSA-N 391.353 2.643 0 50 GFAA CN(C)[C@H]1CCN(Cc2cn(C)nc2C(=O)Nc2cccc3ccc(O)cc23)C1 2325759955 YVXDSJIBKHXORM-KRWDZBQOSA-N 393.491 2.667 0 50 GFAA O=C(NS(=O)(=O)c1cccc(Cl)c1OC(F)F)c1conc1C1CC1 2325773624 BKDNJOBXMSPNPL-UHFFFAOYSA-N 392.767 2.926 0 50 GFAA O=C1CCN(C[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)C(=O)N1Cc1ccc2c(=O)cc[nH]c2c1 2325779776 BRECGDKMCRVKSZ-AEIBSFOJSA-N 391.471 2.975 0 50 GFAA CN1CCN(c2cc(F)cc(CNC(=O)c3cc4ccc(O)cc4[nH]3)c2)CC1 2325859789 KOBGLAFXDCLIDQ-UHFFFAOYSA-N 382.439 2.694 0 50 GFAA CC1=CC[C@@H](C(C)(C)O)C[C@@H]1OC(=O)CN1C(=O)N(C)C2(CCCCC2)C1=O 2325869469 PCVNQQQJBLIPKN-CVEARBPZSA-N 392.496 2.622 0 50 GFAA Cc1noc([C@H]2CCCN2C(=O)c2cc3c(s2)CCOC32CCNCC2)n1 2356143387 FVXJDUWWGCRBAX-CQSZACIVSA-N 388.493 2.568 0 50 GFAA O=C(NCc1cccc2ncnn12)c1ccc(CN2CCc3ccccc3C2)o1 2356153373 DHMIZXWFDPCDQR-UHFFFAOYSA-N 387.443 2.811 0 50 GFAA Cc1noc(C)c1CN(C)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356157545 KVFPMELRMRJTAB-UHFFFAOYSA-N 375.494 2.777 0 50 GFAA O=C1CC[C@H](Cc2nc(-c3cccc(F)c3)nn2-c2cnc3ccccc3n2)N1 2356161268 NHUKYEJHFKLYTF-OAHLLOKOSA-N 388.406 2.838 0 50 GFAA COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1ccc(OC)cc1OC 808723 VOFJSQOVAHAXGD-UHFFFAOYSA-N 375.421 2.627 0 50 GFAA O=C(c1c(O)cccc1O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356139862 KHXAVXATODOUDI-JOCHJYFZSA-N 380.444 2.895 0 50 GFAA COc1ccccc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 2885095 NCEUKOMGCYKYPO-CQSZACIVSA-N 392.452 2.874 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1 3880496 JPEJOQREZRTQDG-UHFFFAOYSA-N 393.896 2.809 0 50 GFAA Cc1c(C)n(CCN(C)C)c2ncn3nc(-c4ccc(N(C)C)cc4)nc3c12 6673169 OUDIKWQJCKSDOL-UHFFFAOYSA-N 377.496 2.990 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2ccc(COC)o2)C[C@H]1CCO 104525385 WIIQFCSYHFAKAQ-LJQANCHMSA-N 388.508 2.894 0 50 GFAA Cc1ccc2oc(C(=O)NC[C@@H](c3cccs3)N3CCOCC3)cc(=O)c2c1 23745099 UEAQNABGHLHZLG-INIZCTEOSA-N 398.484 2.966 0 50 GFAA CS[C@H](C)C(=O)N1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 77515806 NVBPMPCDPUHUMK-OAHLLOKOSA-N 378.494 2.630 0 50 GFAA COc1cc(C(=O)N[C@@H]2CC(=O)N(Cc3cccc4ccccc34)C2)ccn1 72172871 PYQKSBNQYDUPME-GOSISDBHSA-N 375.428 2.774 0 50 GFAA CCOc1ccc(NC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1OC 363733428 XMXMGIJVAIYXCB-MRXNPFEDSA-N 384.436 2.806 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CCOCC(F)(F)C1 365746292 JFVMFSKTAHGZRH-SECBINFHSA-N 384.349 2.800 0 50 GFAA O=C(O)[C@H]1CC2(CCN(Cc3cc(F)ccc3F)CC2)CN1C(=O)C1CC1 72480370 CJXBSRRWLBEGDU-QGZVFWFLSA-N 378.419 2.643 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCNC[C@H]1c1cccc(Cl)c1 261862490 SIWATISNHCKQPZ-SFHVURJKSA-N 398.898 2.500 0 50 GFAA CNCCN(C)C(=O)c1ccccc1SCC(=O)N1CCc2ccccc21 237339760 LKDOEAJNIAMQJS-UHFFFAOYSA-N 383.517 2.659 0 50 GFAA O=C(c1ccc(-n2cnnc2)cc1)N1CCC([C@H](O)Cc2ccccc2)CC1 77517925 SQTFFQVECCGFAM-OAQYLSRUSA-N 376.460 2.723 0 50 GFAA COc1ccc(OC2CCN(C(=O)C[C@H]3CN(C(C)C)CCO3)CC2)cc1 77520731 CFCYFQGSEXJORL-FQEVSTJZSA-N 376.497 2.564 0 50 GFAA CCOc1ncccc1C(=O)N1CCC2(CC1)CN(CCC(C)C)C(=O)O2 77503502 MVOHPKZOPWBMFC-UHFFFAOYSA-N 375.469 2.953 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)cc1F 71388834 BFUITAIJGGWVJN-KRWDZBQOSA-N 389.515 2.789 0 50 GFAA CCC(CC)CNc1cnc2c(c1)c(NC(=O)COC)c(C(=O)OC)n2C 14537983 IFHBZGSBHGHRHD-UHFFFAOYSA-N 376.457 2.793 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NCC3CCCCC3)cc12 14532121 NXGRFLCBTUTONB-UHFFFAOYSA-N 388.468 2.937 0 50 GFAA O=C1[C@@H](N2CCN(c3ncccc3Cl)CC2)CCN1c1c(F)cccc1F 176157852 XTGUTPJTSJBUTG-INIZCTEOSA-N 392.837 2.941 0 50 GFAA O=C(c1nn(-c2ccccc2F)cc1O)N1CCC(OC[C@@H]2CCCO2)CC1 176398484 JDOUOLHDPCIDCQ-HNNXBMFYSA-N 389.427 2.517 0 50 GFAA CC(C)N1C(=O)[C@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C(=O)N=C1S 229811257 OWICDEKJFINHEP-KSSFIOAISA-N 377.897 2.914 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nnc(CN4CCCC4)n3C3CC3)CC2)no1 96149333 NRGUVDRGHBFMGZ-UHFFFAOYSA-N 384.484 2.525 0 50 GFAA COc1ccc2[nH]cc(CCNC(=O)COCc3nc4ccccc4[nH]3)c2c1 426582880 UAMOGHVOEXQJIB-UHFFFAOYSA-N 378.432 2.928 0 50 GFAA N[C@H](C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1)C1CCCCC1 95503135 MLXXJFLTVQBORN-FQEVSTJZSA-N 381.524 2.940 0 50 GFAA CC(C)=CCN1CC2(CCN(C(=O)c3[nH]nc4c3C[C@H](C)CC4)CC2)CC1=O 95374255 ZXRFLGDPNOPALQ-MRXNPFEDSA-N 384.524 2.955 0 50 GFAA CCc1ccc(CN2CCC3(CC2)CCN(C2CCOCC2)C[C@@H]3CO)nc1 97578989 SGFBFFAIPHUYJZ-HXUWFJFHSA-N 387.568 2.719 0 50 GFAA CC[C@H](O)Cn1nc(-c2cccnc2)nc1-c1cn(C)c2ccccc2c1=O 95386763 YZVQEWXUVMGAGH-HNNXBMFYSA-N 375.432 2.630 0 50 GFAA CC(=O)CCCC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95382629 GXUUICAIFYWTCU-MTNREXPMSA-N 384.476 2.563 0 50 GFAA O=C(N[C@@]12CC[C@@H](OC(=O)c3ccccc3)[C@@H](SC1)[C@@H]2O)c1ccccc1 245255684 KTLCCBNUTRMVBR-WIRSXHRWSA-N 383.469 2.651 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)NC[C@H](C(C)C)N3CCCC3)cc12 820696243 DAOVIYHCFNAFSR-GOSISDBHSA-N 377.510 2.648 0 50 GFAA Cn1cnc(C(=O)N2Cc3cnn(-c4ccccc4Cl)c3CC(C)(C)C2)n1 952892740 PQMKLGDDARJQGA-UHFFFAOYSA-N 384.871 2.879 0 50 GFAA C[C@H](OCc1ccc(F)cc1)C(=O)N1CC2(CCSCC2)C[C@@H]1C(=O)O 1875305937 NDNHNRHYDKCPTO-XJKSGUPXSA-N 381.469 2.930 0 50 GFAA CC(C)[C@@]1(O)CCN(C(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)C1 1875278545 KFSLYCXGQQSRJB-HSZRJFAPSA-N 392.455 2.716 0 50 GFAA CC[C@@H](c1ccccc1)c1nnc(N2CCO[C@H](C)C2)n1CCCNC(C)=O 1764009229 KHFQCWCLCIZYEJ-APWZRJJASA-N 385.512 2.571 0 50 GFAA CSc1nn2c(=O)cc(CN3CCc4c([nH]c5ccccc45)C3)nc2s1 1506399595 AZPWWJFDYRTNGA-UHFFFAOYSA-N 383.502 2.913 0 50 GFAA O=C(c1cccnc1)N1CCC(NC[C@@H](c2cccnc2)N2CCCCC2)CC1 1506410248 SLMAHWQMDIJAEH-QFIPXVFZSA-N 393.535 2.898 0 50 GFAA Cc1cc(F)ccc1C(=O)N1CCC[C@@]2(C(=O)N3CCCC3)CCN(C)C[C@H]12 1775981023 GNPSSVICCVONBK-SIKLNZKXSA-N 387.499 2.683 0 50 GFAA O=C(NCc1cccc(F)c1)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772818337 QLNZPTYCOVTLCM-CQSZACIVSA-N 375.469 2.540 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@@H](Nc3ccc4c(c3)OCCO4)C2)n1 11820828 JZCTWJKVVLUBQG-GOSISDBHSA-N 384.480 2.764 0 50 GFAA CN(C)S(=O)(=O)NC[C@@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 12454575 FSZPVDMIPVWMIO-IBGZPJMESA-N 387.549 2.962 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@@H](NCc1ccccc1)C2 14743730 FVGMDPRSJZGYPE-LJQANCHMSA-N 389.503 2.875 0 50 GFAA CNC(=O)c1cn(CCCc2ccccc2)cc(C(=O)N2CCCCCC2)c1=O 15066936 DAHGUXLBDDGSAT-UHFFFAOYSA-N 395.503 2.857 0 50 GFAA O=C(Cc1ccc(F)cc1)NCc1nnc2ccc(-c3ccc(F)cc3)nn12 169781144 SGDXCIMBZAVQIX-UHFFFAOYSA-N 379.370 2.928 0 50 GFAA CC[C@]12COC(=O)N1CCN(C(=O)c1ccc(N3CCCC3)c(Cl)c1)C2 1857676424 NVDBYAJJRODLHQ-IBGZPJMESA-N 377.872 2.997 0 50 GFAA COc1ccc(CC(=O)N2CCC[C@]3(CCc4c(O)nc(C)nc43)C2)cc1F 1857698184 GYKSTTKBYDEBCA-NRFANRHFSA-N 385.439 2.687 0 50 GFAA Cc1occc1C(=O)N1C[C@@H]2[C@H](CNC(=O)CCC3(C)CC3)[C@H]3CC[C@]2(C1)O3 1857714774 LDHYTMLPAXBMSO-KCXPTXFHSA-N 386.492 2.904 0 50 GFAA CC[C@@H](NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1)C(=O)N(C)C 1857736307 OJJCLBJYSWXKJS-CQSZACIVSA-N 392.887 2.681 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(NC2CCN(c3ncccn3)CC2)ncn1 328638587 PFFHHLWWUPKVHS-PXNSSMCTSA-N 397.527 2.963 0 50 GFAA CC[C@]1(C2CCN(Cc3ccoc3)CC2)NC(=O)N(Cc2ccccn2)C1=O 11996056 GTYUUWWECOIHIL-OAQYLSRUSA-N 382.464 2.787 0 50 GFAA C[C@H](O)CNC(=O)c1cccc(OCc2ccn(-c3ccc(F)cc3F)n2)c1 252497533 QKABGTGJNXTUMS-ZDUSSCGKSA-N 387.386 2.840 0 50 GFAA C[C@@H](NC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1)[C@H]1CCOC1 363421148 BHOZEGXCNZDOBV-ZBFHGGJFSA-N 379.888 2.623 0 50 GFAA O=C(c1cnn(CCC(F)(F)F)c1)N1CC[C@H](c2ccccc2)S1(=O)=O 814091789 KGLKMOZAIIZZFK-CQSZACIVSA-N 387.383 2.753 0 50 GFAA C[C@H](CO)N1CCCN(c2nc3ccccc3c(=NCc3ccccc3)[nH]2)CC1 2325756821 DNGLIVYAKYGJPM-GOSISDBHSA-N 391.519 2.557 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H](CC(=O)N(C)[C@@H](C)c2cccnc2)OCC12CCC2 2325785325 QCTWTKFKGKAHAT-PKOBYXMFSA-N 397.523 2.846 0 50 GFAA O=C(O)C[C@@H]1CN(c2ncnc3[nH]c4cc(Br)ccc4c23)CCO1 2325844212 AQTOJEIGEGYIJF-SNVBAGLBSA-N 391.225 2.554 0 50 GFAA CS(=O)(=O)N1CCN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CC1 1074144 IVSKCHIOVXERHG-UHFFFAOYSA-N 395.484 2.619 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)N(Cc1ccco1)c1ccc(O)cc1 1155294 YBSNAXBAQYDFBY-UHFFFAOYSA-N 375.384 2.929 0 50 GFAA CN1CCN(c2ccc3nc(-c4c(N)c5c(F)cccc5[nH]c4=O)[nH]c3c2)CC1 3816310 PIQCTGMSNWUMAF-UHFFFAOYSA-N 392.438 2.545 0 50 GFAA investigational Cc1ccc(CNC(=O)CN(c2ccc(F)c(Cl)c2)S(C)(=O)=O)cc1 4820441 UWHUGDAXLIBGDE-UHFFFAOYSA-N 384.860 2.870 0 50 GFAA CN(Cc1noc(-c2ccccc2)n1)C(=O)CCNC(=O)c1ccccc1F 55324936 ZWVNXVUUTZRSQK-UHFFFAOYSA-N 382.395 2.654 0 50 GFAA Cc1ccccc1-c1cc(O)c2c(c1)CN(Cc1cc(=O)[nH]c(O)n1)CCO2 67740465 YFUCSLXDOPLVEN-UHFFFAOYSA-N 379.416 2.551 0 50 GFAA O=C(c1ccc(Cl)cc1)c1ccc(OC[C@@H](O)CN2CCOCC2)cc1 20293860 WXHVFFOONPLLGV-SFHVURJKSA-N 375.852 2.643 0 50 GFAA OC[C@@H]1CCCCN1CCn1cnc(-c2ccccc2)c1CCn1cccn1 65428243 MMXYOCGFLWMDDA-FQEVSTJZSA-N 379.508 2.836 0 50 GFAA O=C1CC[C@H](OC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)CN1 860765592 FMROUCCUTWCCAE-LBPRGKRZSA-N 380.326 2.674 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65534730 AAHNBPZVSHGPSB-LSDHHAIUSA-N 384.388 2.526 0 50 GFAA COc1ccc(CN2CCC(NC(=O)c3cn(C(C)(C)C)nn3)CC2)cc1F 252490679 KYXLZFGOTSRTJD-UHFFFAOYSA-N 389.475 2.575 0 50 GFAA CCOC(=O)c1n[nH]cc1[C@@H]1C[C@H]2CN(c3ccccc3)C(=O)[C@]23CCCN13 11817358 GTKPTEVFKQYKPT-LFRPXUGBSA-N 380.448 2.529 0 50 GFAA O=C1CC[C@H](CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)N1 72428081 JNEUAQLUPXKCFH-HXUWFJFHSA-N 377.488 2.589 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)NCc2ccc(Cl)c(Cl)c2)CCC(=O)N1 218199939 RTKZHQYUBCGTFD-KRWDZBQOSA-N 387.263 2.903 0 50 GFAA CN(C)c1cc(C(=O)N2CCC([C@H]3C[C@H](N)CCO3)CC2)nc2ccccc12 333246138 FTVXSYBNFKFQBE-IIBYNOLFSA-N 382.508 2.659 0 50 GFAA CN1CCC(N2CCN(c3ccc4cc(Cl)ccc4n3)C[C@@H]2CCO)CC1 72417785 DGADDJFGFBAAIX-IBGZPJMESA-N 388.943 2.855 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)c2c(C)noc2n1 130682329 LZOCBDDFPCYQNJ-HNNXBMFYSA-N 382.395 2.904 0 50 GFAA C[C@@H](NC(=O)c1ccc(Br)c(O)c1)c1nnnn1-c1ccccc1 133468931 UHJJIZCYTJXOGD-SNVBAGLBSA-N 388.225 2.621 0 50 GFAA CCc1cc(C(=O)N[C@@H](c2cnc3ccccc3c2)C2CC(O)C2)cc(=O)[nH]1 223924591 DOZJZGZZFQGSTC-JCPMGCNXSA-N 377.444 2.728 0 50 GFAA CC(C)NC(=O)CCN1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 426445461 HDILNVHNEUIXGE-NRFANRHFSA-N 375.488 2.555 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)COc2cccc(Cl)c2)CC1 95527248 PECZSGIVIUZBAH-UHFFFAOYSA-N 377.872 2.968 0 50 GFAA O=C(NCc1ccc2c(c1)CCO2)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12 426698507 WGXAMCVWNPDOGB-QFIPXVFZSA-N 377.444 2.817 0 50 GFAA COCCCn1cnnc1[C@@H](C)NC(=O)Nc1ccc2nc(C)c(C)nc2c1 96150318 QZJZKWKFFNGLSB-CQSZACIVSA-N 383.456 2.757 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@@H](c3ccc(F)cc3)N(C)C)CC2)CC1=O 95357551 ZLCLOEURRHBJTB-HXUWFJFHSA-N 389.515 2.926 0 50 GFAA COCC(=O)Nc1ccc(C)c(NC(=O)NCCN2CCc3ccccc32)c1 96140499 WYGYRXVPZYJKFG-UHFFFAOYSA-N 382.464 2.764 0 50 GFAA Cc1ccc(S(=O)(=O)n2ccc3c(Br)cn(C)c(=O)c32)cc1 145441401 PZEBKVLFDUMYSY-UHFFFAOYSA-N 381.251 2.648 0 50 GFAA Cc1cc(CC(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(-n3cccn3)cc2)on1 95528760 XMYZJZJGIXZCDQ-LJQANCHMSA-N 393.447 2.731 0 50 GFAA CCc1c(C)nn(CCNC(=O)Nc2ccc3c(c2)N(C)C(=O)[C@@H](C)O3)c1C 95521379 QPXMKUQITCSTGW-CQSZACIVSA-N 385.468 2.628 0 50 GFAA CSCc1noc(CN2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)n1 95380663 BOXKMEJLRBWMIY-MAUKXSAKSA-N 384.549 2.996 0 50 GFAA O=C(c1[nH]nc2c1CCCC2)N1CCc2c(ncn2CCc2ccccc2)C1 181811597 CDNMANWZDLXQLR-UHFFFAOYSA-N 375.476 2.926 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)c3ccc4c(c3)CCCN4S(C)(=O)=O)c2c1C 182644672 WDXGSLKPCVZOJT-UHFFFAOYSA-N 399.476 2.539 0 50 GFAA CCOC(=O)c1nc(NC(=O)CC2(n3cccc3)CCOCC2)sc1C 253409110 LKPIYXKFVGOVOZ-UHFFFAOYSA-N 377.466 2.964 0 50 GFAA CN1CCCC[C@@H]1CCNC(=O)c1ccc(N2CCc3ncccc3C2)nc1 67786270 AMQOXMXBBXMSGL-LJQANCHMSA-N 379.508 2.644 0 50 GFAA O=C(Nc1nccs1)c1cccc(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c1 827691978 DWVDQHLNFXGIOB-LWWSYDQCSA-N 383.429 2.857 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@H]1CCCN(C(=O)C(C)C)C1 824742922 YLIMKGXTQMSSMS-INIZCTEOSA-N 382.526 2.744 0 50 GFAA C[C@@H](CCc1cccc(F)c1)C(=O)N1CCOC2(CCS(=N)(=O)CC2)C1 1875396144 WZWKBLZNCLQBKJ-HJXLATRASA-N 382.501 2.833 0 50 GFAA CCN(C(=O)c1cnn(C)c1C)[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C1 1875312965 VCLVCZGQBOHHIF-CQSZACIVSA-N 381.402 2.883 0 50 GFAA CC(C)CO[C@@H](C)c1noc(Cn2c(Cc3ccc(F)cc3)noc2=O)n1 1875316150 XNOOOSDCXAIFIN-LBPRGKRZSA-N 376.388 2.731 0 50 GFAA COC(=O)[C@H]1C[C@](O)(c2ccc(OCc3cc4ccccc4n(C)c3=O)cc2)C1 1875281202 VKSYSQIRZVRBGI-LBEPJEHYSA-N 393.439 2.888 0 50 GFAA CC(C)c1noc(CN2CCN(C(=O)c3ccc(C(F)(F)F)cc3O)CC2)n1 170592031 YMLMZTMHIXVNOJ-UHFFFAOYSA-N 398.385 2.875 0 50 GFAA O=C(c1cc2c(s1)-c1ccccc1CC2)N1CCC[C@H](N2CCNCC2=O)C1 186635279 NMKRRGCVVRBNRY-KRWDZBQOSA-N 395.528 2.550 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1csc(-c2ccccn2)n1 192220574 LUZCRJWFSYHDPS-INIZCTEOSA-N 396.447 2.875 0 50 GFAA O=C(CN1CCCCCCC1=O)Nc1ccccc1C(=O)NCc1cccnc1 195375228 HNVDILRGUFEFQA-UHFFFAOYSA-N 394.475 2.743 0 50 GFAA CN1CCC(CNC2CCN(C(=O)c3ccncc3)CC2)(c2ccccc2)CC1 1506431427 JOIQEAMVUYMASS-UHFFFAOYSA-N 392.547 2.939 0 50 GFAA O=C(NCc1nc2ccccc2o1)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772814546 GIFVZQBZVKVQNI-ZDUSSCGKSA-N 398.488 2.542 0 50 GFAA CN1CCCN(C(=O)c2cc(COc3cccc(C(F)(F)F)c3)[nH]n2)CC1 11663717 ASDCPFAZMIOJRG-UHFFFAOYSA-N 382.386 2.785 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)[C@H]1CCCN(C2CCN(C(C)C)CC2)C1 11842129 YONIVCJAGNELHR-IBGZPJMESA-N 389.588 2.580 0 50 GFAA CO[C@@H](C(=O)NC[C@H]1Cc2cc(-c3cnccn3)ccc2O1)c1ccccc1 12052660 JMMXOPQJNVNWPQ-WIYYLYMNSA-N 375.428 2.951 0 50 GFAA C/C(Cl)=C\CSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 12342772 DLMIPWXQBRRCMW-DHZHZOJOSA-N 376.869 2.706 0 50 GFAA CN(C(=O)c1ccc2c(c1)no[n+]2[O-])[C@@H]1CCCN(CCCc2ccccc2)C1 12764210 DXJDSVIQXQJVAA-LJQANCHMSA-N 394.475 2.630 0 50 GFAA CCS(=O)(=O)N1C[C@@H](C(=O)NCCC2=CCCCC2)Oc2ccccc21 13678225 NGCAONMVGNEXEY-SFHVURJKSA-N 378.494 2.610 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2F)CN(C(=O)c2ccncc2)CC1=O 14532221 DGPQRNROISDMHV-IBGZPJMESA-N 399.466 2.747 0 50 GFAA COc1cccc(CN2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)c1 1857685480 KXSSPTZNWAFNID-VXKWHMMOSA-N 384.524 2.857 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cc(-c4ccccc4O)[nH]n3)CC2)O1 1857695252 AZIILXJIGIQUTM-CABCVRRESA-N 385.464 2.707 0 50 GFAA Cc1cncc(C(=O)NC[C@H]2[C@H]3CN(c4ncccc4C)C[C@]34CC[C@H]2O4)c1 1875248048 VYGNTGXJXFFPGQ-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA CN(C)C1(CNC(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)CCOCC1 373869277 KKPVPRONGZJSBD-AWEZNQCLSA-N 377.451 2.861 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3cnc4c(c3)CCCC4)C1)CC2 1704341997 BDSCUWWZMPXXDU-HSZRJFAPSA-N 391.519 2.937 0 50 GFAA C[C@@H](C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)Cc1cccc(F)c1F 912934642 ULNVGBQUIGXFBG-LRDDRELGSA-N 395.427 2.908 0 50 GFAA COc1cc(S(=O)(=O)NCc2ccco2)c(OC)cc1Br 1102704 KXESFHFZUNBYGO-UHFFFAOYSA-N 376.228 2.538 0 50 GFAA Cn1cc(I)c(C(=O)N[C@H]2CCCc3ccccc32)n1 657041 DWPQRXCJZIMRMJ-ZDUSSCGKSA-N 381.217 2.832 0 50 GFAA Cc1ccc(NC(=O)c2cc(N3C(=O)C=CC3=O)ccc2N2CCOCC2)cc1 794603 QKXCOBBZMYPLCG-UHFFFAOYSA-N 391.427 2.513 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 1057386 QXIIVOAZLIZDLW-AWEZNQCLSA-N 390.461 2.575 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3cc(C)on3)o2)cc1OC 2720349 HZNOVEPWWFZISN-UHFFFAOYSA-N 376.394 2.781 0 50 GFAA Cc1c(S(=O)(=O)Nc2cnn(Cc3cccc(C(F)(F)F)c3)c2)cnn1C 2792732 MZCAZHMGASCPBH-UHFFFAOYSA-N 399.398 2.793 0 50 GFAA O=C(NC(=S)Nc1ccccc1C(=O)O)c1cncc(Br)c1 4758677 AXNAZCFSQXGZQI-UHFFFAOYSA-N 380.223 2.669 0 50 GFAA O=C(NC(=O)c1ccccc1)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 4840375 FNJLOCBKDRQVPC-UHFFFAOYSA-N 387.461 2.823 0 50 GFAA CCOC(=O)c1cc(C(=O)Nc2sc3c(c2C(=O)OCC)CCC3)n(C)n1 5672928 IFCNAVOUMAJCCW-UHFFFAOYSA-N 391.449 2.576 0 50 GFAA NS(=O)(=O)c1ccc(-n2nc(C(=O)O)cc2-c2ccc(Cl)cc2)cc1 5675834 NHAUQESLCOSREJ-UHFFFAOYSA-N 377.809 2.538 0 50 GFAA COc1ccc(C(=O)N2CCN(c3ccc(Nc4ccncc4)nn3)CC2)cc1 11697924 DMECSZDWKXKYFF-UHFFFAOYSA-N 390.447 2.586 0 50 GFAA Cc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3n[nH]c4c3CCC4)C2)o1 12316617 LRFUXTFEJATFJO-HNNXBMFYSA-N 384.480 2.749 0 50 GFAA CN(Cc1cscn1)[C@@H]1CCc2c(c(C(=O)N3CCCCCC3)nn2C)C1 14538395 NEHRWYASALPEJC-MRXNPFEDSA-N 387.553 2.882 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(C)[C@@H](C)c2ccncn2)n[nH]1 15064263 XZSOXVASQSYFCS-ZDUSSCGKSA-N 375.436 2.739 0 50 GFAA COc1cc(OC)c(CN2CCN(C3CCCC3)[C@@H](CCO)C2)c(OC)c1 19789820 MXRPTZMSHUGZCI-KRWDZBQOSA-N 378.513 2.524 0 50 GFAA CCOC(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1[nH]cnc1C)CC2 20918163 JTZKOMFWNSCGKK-UHFFFAOYSA-N 379.464 2.698 0 50 GFAA C(=C/c1ccccc1)\CN1CCN(c2ccc(CN3CCOCC3)cn2)CC1 65384020 PITBFHSTIPGLJR-QPJJXVBHSA-N 378.520 2.749 0 50 GFAA O=C(O)CSc1nnc(-c2cc(C3CC3)n[nH]2)n1-c1ccc(F)cc1F 67446551 BFFKNBDGBRXOQC-UHFFFAOYSA-N 377.376 2.990 0 50 GFAA O=C(O)c1nn(Cc2ccccn2)c2c1CN(C(=O)/C=C/c1ccccc1)CC2 67883804 GHLCHPAVLXDLCD-MDZDMXLPSA-N 388.427 2.623 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](N(C)Cc1ccc(-n3cccn3)cc1)C2 67982234 UMGUJRNVDFVCEA-QGZVFWFLSA-N 379.464 2.776 0 50 GFAA COc1ncccc1C(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72151048 GCUBPNGQEDQKLF-XUVXKRRUSA-N 381.451 2.932 0 50 GFAA Cc1ccc(-n2cccn2)c(CN2CCC(C(=O)O)(n3cc(C)cn3)CC2)c1 77319337 AJXZJIHQXVHQGE-UHFFFAOYSA-N 379.464 2.762 0 50 GFAA C[C@H](CN1CCCC1)C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 91846068 WFORZBVKODBNKU-GOSISDBHSA-N 381.524 2.764 0 50 GFAA O=C(c1cnc(COc2ccccc2)[nH]c1=O)N1CCC[C@H]1c1ccccn1 91932736 YSMMPMXYSXQZGG-SFHVURJKSA-N 376.416 2.721 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1CCCN(Cc2cccs2)CC1 95380772 ZCZVFQZAAZQHFX-UHFFFAOYSA-N 379.489 2.948 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@H]1CN(C(=O)C2CCCC2)C[C@@H]1C1CC1 95387314 BVJWNMCCFFAOQO-MSOLQXFVSA-N 384.476 2.501 0 50 GFAA Cc1ccc(OCCS(=O)(=O)N2C[C@@H]3CC[C@H](C2)N(CC2CC2)C3)cc1 95524207 PZAMXTJPWPVYCF-RTBURBONSA-N 378.538 2.510 0 50 GFAA Cc1ccc(-c2ccnc(N3C[C@H]4C[C@H](C3)[C@@H]3CCCC(=O)N3C4)n2)c(C)n1 102111684 HHCAKHSDEGFSPS-HLIPFELVSA-N 377.492 2.993 0 50 GFAA Cn1cnc2cc(C(=O)N3CCCN(C(=O)CCc4ccccc4)CC3)ccc21 133428103 DUCCJUOCOILGJF-UHFFFAOYSA-N 390.487 2.881 0 50 GFAA Cc1ccc2cc(C(=O)NC3CCN(C(=O)c4cnccn4)CC3)c(C)nc2c1 135574246 BZRPVLVRCNOAOM-UHFFFAOYSA-N 389.459 2.676 0 50 GFAA CCN1CCc2nc(NC(=O)[C@H]3CCCCN3C(=O)c3cccnc3)sc2C1 151955240 ZDKRCZMSLBXGOI-MRXNPFEDSA-N 399.520 2.550 0 50 GFAA COc1cccc(CC(=O)N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)c1 169772293 DURZWTYGVIIXPM-UHFFFAOYSA-N 394.397 2.704 0 50 GFAA CN(C)C(=O)CN(C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)c1ccccc1 174082635 WNJGVTNHIQHAME-LJQANCHMSA-N 393.487 2.660 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N(C)C[C@H]3CCCC[C@@H]3O)CC2)oc1C 182850300 OIDDBNFOPXESRK-MOPGFXCFSA-N 392.544 2.696 0 50 GFAA CC1(C(=O)NC2CCN(C[C@H]3CCOC3)CC2)CCN(Cc2ccccc2)CC1 184799377 GKBMITNSFLKNAK-OAQYLSRUSA-N 399.579 2.906 0 50 GFAA FC(F)n1ccnc1CN1CCN(c2cncc(OCC3CCCC3)n2)CC1 185254493 XTULERGWBLEXNH-UHFFFAOYSA-N 392.454 2.959 0 50 GFAA c1ccc2nc(N3CC[C@@H](OCc4ccncc4)C3)c(N3CCOCC3)nc2c1 192903876 PIMIJHKEPNRHQA-GOSISDBHSA-N 391.475 2.657 0 50 GFAA O=C(O)CN(C(=O)[C@H]1C[C@H]1c1cccc(Br)c1)C1CCOCC1 238105687 YNSBYDVUYWOBQL-GJZGRUSLSA-N 382.254 2.645 0 50 GFAA OC1(CNCc2cn(Cc3ccccc3)nc2-c2cccnc2)CCOCC1 238157349 WAGLNCHXBDBIGL-UHFFFAOYSA-N 378.476 2.625 0 50 GFAA Cc1nn(C)cc1NC(=O)CN1CCC[C@H](c2nc(-c3ccccc3)no2)C1 244817185 SVSIEJNQNGAYPB-INIZCTEOSA-N 380.452 2.597 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)c1ccc(CSc2nnc[nH]2)o1 252506903 WCUGZXGONSIBHL-UHFFFAOYSA-N 375.479 2.955 0 50 GFAA COCc1nc(O)cc([C@H]2C[C@H](NC(=O)c3ccc(Cl)cc3OC)C2)n1 253535569 FJDQETSGHLSFIL-UMSPYCQHSA-N 377.828 2.667 0 50 GFAA COc1ccccc1Cn1ccn2nc(-c3cccc(F)c3)c(CO)c2c1=O 263619479 YVPCZABTOCOSKC-UHFFFAOYSA-N 379.391 2.851 0 50 GFAA CO[C@@H](C)C(=O)Nc1cccc(NC(=O)N2CCC(c3nc(C)no3)CC2)c1 264182651 ACTYDXCSUXKYSN-LBPRGKRZSA-N 387.440 2.763 0 50 GFAA O=C(NCc1ccc(N2CCOC2=O)cc1)c1cccc(OCC(F)(F)F)n1 273000824 VGAPCNXCAWLWHF-UHFFFAOYSA-N 395.337 2.909 0 50 GFAA O=C([C@H]1CC12CCS(=O)(=O)CC2)N1CCOc2ccc(C(F)(F)F)cc21 274941476 QYRBNLFBAKAWEO-GFCCVEGCSA-N 389.395 2.646 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cc(Cl)cc2c1OCC2 328610695 IWBOSSKRWCNFRQ-ZDUSSCGKSA-N 396.900 2.803 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N3CCC(n4ccnc4)CC3)cc2)C[C@@H](C)O1 363155171 HNXRGDBDOZPVBP-QZTJIDSGSA-N 382.508 2.970 0 50 GFAA O=C(NCCC(=O)N1CCC(N2CCCC2=O)CC1)c1ccc2ccccc2c1 363478183 HXMJGTJTYZIAQX-UHFFFAOYSA-N 393.487 2.573 0 50 GFAA CCCc1nnc(SCC(=O)N2C[C@H]3CCCC[C@]32c2ccccc2)n1N 365866095 LEMINWZXOFTFFD-UZLBHIALSA-N 385.537 2.964 0 50 GFAA COCCN(C[C@H]1CCCN2CCCC[C@H]12)C(=O)c1cc(-c2ccncc2)[nH]n1 409414276 OOGZCDNDXMFHDM-WIYYLYMNSA-N 397.523 2.825 0 50 GFAA COc1ccc2cc([C@H]3CN(C(=O)NCc4nnc(C)o4)CCO3)ccc2c1 426380754 VVMKKZKRUOVNAO-GOSISDBHSA-N 382.420 2.823 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCC(Oc4ncccn4)CC3)c2)nn1 426628253 MTXGZHJJWUHKNV-UHFFFAOYSA-N 375.432 2.926 0 50 GFAA Cc1csc(CCC(=O)Nc2ccc(-n3ncc4c(O)ncnc43)cc2)n1 443953091 QNXZYKDOXSYNCQ-UHFFFAOYSA-N 380.433 2.857 0 50 GFAA Cc1ccc(OC[C@H](C)NC(=O)N2CCN(Cc3ccccc3)C(=O)C2)cc1 534629976 GERKRTRNHVBBSM-SFHVURJKSA-N 381.476 2.816 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)C1 814335992 PYWVYBVWQZGGHS-BXUZGUMPSA-N 381.391 2.999 0 50 GFAA COc1cc(NC(=O)[C@H]2CCCCN2Cc2ccccc2)cc(-n2cnnn2)c1 952965966 GETYEMGMJLHAOX-HXUWFJFHSA-N 392.463 2.664 0 50 GFAA COc1cccc(OC[C@H]2CCCN(C(=O)CSc3nnc(C)o3)C2)c1 1506422457 BJILEPKHJFDZAV-AWEZNQCLSA-N 377.466 2.796 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@H](OC)C2)ccc1F 1704310818 UGZRONZOLHTNNC-ZDUSSCGKSA-N 377.416 2.806 0 50 GFAA CCc1ccccc1C(=O)N1C[C@@H]2CN(CCCn3cccc3)C[C@]2(CO)C1 1772709785 NKEYOLDFKKSRPQ-NZQKXSOJSA-N 381.520 2.507 0 50 GFAA CCC(=CC(=O)N1C[C@@H](NC(=O)c2cn(C)nc2C)[C@H](C(F)(F)F)C1)CC 1775990851 FSYMADVEJIWNGI-HUUCEWRRSA-N 386.418 2.594 0 50 GFAA CC(C)(O)CC(=O)NC1(C2CCN(C(=O)[C@@H]3C[C@H]3c3ccsc3)CC2)CC1 1775993077 XXTDXMVKKCZOJX-DLBZAZTESA-N 390.549 2.900 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)COc2ccccc2)CC1 1857682126 ITCIHDDFKZCVMW-UHFFFAOYSA-N 387.457 2.916 0 50 GFAA CN1C(=O)CCO[C@H]2CN(C(=O)Nc3ccc4c(c3)Cc3ccccc3-4)C[C@@H]21 1857701733 ZKDNJWMEYUZAHJ-PMACEKPBSA-N 377.444 2.721 0 50 GFAA O=C(Cc1ccccc1F)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857710669 JPMZOKCWYUESOT-JQVVWYNYSA-N 380.419 2.669 0 50 GFAA O=C(c1ccccc1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857733569 PDZHKJKFLLOKPE-VXKWHMMOSA-N 380.488 2.726 0 50 GFAA COc1cccc(C[C@@H](NC(=O)N2CC[C@H](C(=O)N3CCCC3)C2)C2CC2)c1 1875257244 KCHJIBBVMCJBEW-AZUAARDMSA-N 385.508 2.670 0 50 GFAA CN(CC1CC1)C[C@@H]1CCN(C(=O)Nc2ccc(F)c(N3CCOCC3)c2)C1 1875271530 LSUFEHYHHMKZEF-KRWDZBQOSA-N 390.503 2.858 0 50 GFAA COc1ccc(CN2C(=O)[C@]34CC[C@@]3(CN(Cc3ccccc3)C4)C2=O)cc1 1875287669 UFISKFQKTYXRFN-DHIUTWEWSA-N 376.456 2.846 0 50 GFAA O=C(Nc1cccc2nn[nH]c12)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1875289439 SJMPAWMFHAKUSF-BTYIYWSLSA-N 391.431 2.945 0 50 GFAA COc1cn(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1C[C@H](C)CNC[C@@H]1C 1875301575 MZQLVJAIJXCIRN-OLZOCXBDSA-N 396.413 2.970 0 50 GFAA CC(C)c1nc(O)ccc1-c1nc(CC(N)=O)nn1-c1ccc2ccccc2n1 2100556208 IMPLPXFDSOLQEV-UHFFFAOYSA-N 388.431 2.734 0 50 GFAA CN(C(=O)c1cc2c(cnn2C)nc1C(F)F)[C@@H]1CCN(c2ccncc2)C1 2325783877 JCEIUZXHAJDUCO-CYBMUJFWSA-N 386.406 2.652 0 50 GFAA Nc1cc2c(cc1C(=O)c1cccc(I)c1)OCCO2 4342649 GCPIEQGRZRNYSZ-UHFFFAOYSA-N 381.169 2.876 0 50 GFAA CCCCCOc1ccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1 6398562 FUCMGZHMQIHEQW-UHFFFAOYSA-N 390.505 2.876 0 50 GFAA CCc1ccc(CNC(=O)c2cnc3sc(N4CCCCC4)nn3c2=O)cc1 8602977 RJCNUFIRQAJLKG-UHFFFAOYSA-N 397.504 2.634 0 50 GFAA CN(Cc1cccc(-n2cccn2)c1)C(=O)c1cn(Cc2ccccc2F)nn1 11661540 SMCHEPPDTFOJCV-UHFFFAOYSA-N 390.422 2.923 0 50 GFAA NC(=O)C1(C(=O)N2CCC([C@H]3CCN(Cc4ccc(Cl)cc4)C3)CC2)CC1 11844619 PJYXHLRAKYNSBU-KRWDZBQOSA-N 389.927 2.666 0 50 GFAA CCN(CC)C(=O)C1CCN(C(=O)[C@H]2CC(Cc3ccc(F)cc3)=NO2)CC1 11975777 YUQQAEYGXJTPTJ-LJQANCHMSA-N 389.471 2.620 0 50 GFAA O=C(COc1ccccc1)NC[C@@H]1CCC2(CCN(Cc3ccncc3)CC2)O1 12041859 JULQILOLZHJWRJ-NRFANRHFSA-N 395.503 2.790 0 50 GFAA Cc1ccoc1C(=O)N[C@@H]1CC(C)(C)Cc2nc(N3CCC(O)CC3)ncc21 12053968 YYKUKTPYXMBXTJ-MRXNPFEDSA-N 384.480 2.783 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@@H](C)Cn3nc(C)cc3C)CC2)CC1 15061999 YMQGBTCJOKZBEB-FQEVSTJZSA-N 389.588 2.545 0 50 GFAA CN(C)CC(C)(C)CNC(=O)c1cc(-c2cccs2)cc(-n2cnnn2)c1 15069658 LJXVVFAJEKJFLM-UHFFFAOYSA-N 384.509 2.708 0 50 GFAA O=C(c1ccccc1I)N1CCN(c2ccccn2)CC1 18220276 OJDKKAYHRJRALP-UHFFFAOYSA-N 393.228 2.649 0 50 GFAA O=C(Cn1nc(-c2ccc(F)cc2)ccc1=O)N1CCO[C@H](c2ccccc2)C1 44900949 CUGICDOGASKLNJ-FQEVSTJZSA-N 393.418 2.650 0 50 GFAA O=C(c1scc2c1OCCO2)N1C[C@@H]2C[C@H]1C(=O)N2c1cccc(Cl)c1 77484833 VOPJSDIVNVICOZ-STQMWFEESA-N 390.848 2.803 0 50 GFAA O=C1CC[C@]2(CCCN(Cc3nnc(C4CC4)o3)C2)CN1Cc1ccccn1 91645677 NOWJOKCCWURSDB-NRFANRHFSA-N 381.480 2.747 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)n1 95372199 FHNPTTSTNKOIOV-CEWLAPEOSA-N 380.492 2.614 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95390661 AHJCQSUKFNKHLK-GOSISDBHSA-N 386.459 2.994 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@H](c3nccn3CCN(C)C)C2)cs1 95506710 PRLCLLLBRGGYBS-HNNXBMFYSA-N 375.542 2.874 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(-n3cccn3)cc2)C1 95524406 RGYLZRBFMDBMOI-SFHVURJKSA-N 379.464 2.735 0 50 GFAA Cc1cccc(=O)n1CCC(=O)N(Cc1ccncc1)C[C@H](O)c1ccccc1 97814918 BHUUMZDUGWRARA-NRFANRHFSA-N 391.471 2.704 0 50 GFAA CN1CCC[C@H]1CCN1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1 120172254 OMAHFYCIQGGIRO-AWEZNQCLSA-N 391.990 2.582 0 50 GFAA COc1ccc(CN2CCN([C@H](C)c3nc(C)no3)CC2)c(OC(F)F)c1 121264498 MCNYLURSVMZTBN-GFCCVEGCSA-N 382.411 2.867 0 50 GFAA CCCc1cc(NC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)n2ncnc2n1 131796282 NMHIXINXXXPMGB-AWEZNQCLSA-N 389.843 2.647 0 50 GFAA CCOC(=O)[C@@H](NC(=O)Cc1cccnc1)c1c(C)nn(-c2ccccc2)c1C 170624640 NLUFKVWSWKWQLO-NRFANRHFSA-N 392.459 2.847 0 50 GFAA COc1ccccc1CC(=O)N1CCC(NC(=O)c2ccc(C)c(N)c2)CC1 170677564 NGYRBJRHYCOFNJ-UHFFFAOYSA-N 381.476 2.549 0 50 GFAA CCc1nn(C)cc1C(=O)N1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1 179969231 YCGOXBDFDWOZKV-HNNXBMFYSA-N 394.479 2.552 0 50 GFAA C[C@H](NC(=O)NCc1ncc(-c2ccccc2)cn1)c1nnc2n1CCCC2 184561135 RZKAOLAZLHWDCV-AWEZNQCLSA-N 377.452 2.632 0 50 GFAA CS(=O)(=O)c1ccc(NC(=O)NC[C@@H](c2ccccc2)C(F)(F)F)cn1 186493006 MBXJHQXXOMSRRB-ZDUSSCGKSA-N 387.383 2.953 0 50 GFAA Cc1cccc2nc(C(=O)N3C[C@@H]4CC[C@H]3CN(Cc3ccncc3)C4)cn12 222518039 XYSHIBBNZDVKKZ-MOPGFXCFSA-N 375.476 2.774 0 50 GFAA CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@H](S(C)(=O)=O)C1 239722360 CCMADLNTILRFON-KGLIPLIRSA-N 396.488 2.591 0 50 GFAA Cc1csc2nc(CNC(=O)C[C@@H]3CN(Cc4ccccc4)CCO3)cn12 244873594 WSQMYFCCTQKHOZ-GOSISDBHSA-N 384.505 2.612 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)CC1 245900183 DNZJZDTTXLMGHV-PKOBYXMFSA-N 386.540 2.790 0 50 GFAA Cn1ccc2c(NC(=O)C[C@H]3N=C(O)N(Cc4ccccc4)C3=O)cccc21 252537277 KWJSSEFSIDSZTH-QGZVFWFLSA-N 376.416 2.832 0 50 GFAA COc1cc2c(cc1OC)CC(=O)N(CCC(=O)NCCc1ccccc1)C=C2 253414636 YASRQTINRNDVTO-UHFFFAOYSA-N 394.471 2.808 0 50 GFAA biogenic O=C(N[C@H]1CCC[C@H]1C(=O)O)c1csc(-c2cnn(-c3ccccc3)c2)n1 263020798 YBEIXDUXKLRXQY-CABCVRRESA-N 382.445 2.979 0 50 GFAA C[C@H]1CN(C(=O)C(C)(C)C)C[C@H](C)N1C(=O)c1ccc(Br)cn1 293760846 UGRPHWWIZGHMHB-RYUDHWBXSA-N 382.302 2.952 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(OC[C@H]3CCCO3)c2)c1 298465584 XXTOOKIYYBRVEM-LJQANCHMSA-N 379.420 2.781 0 50 GFAA O=C(NCc1cc2n(n1)CCN(Cc1nc3ccccc3[nH]1)C2)C1CCCC1 299760120 RTMBEPZXLZWFAB-UHFFFAOYSA-N 378.480 2.582 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCCn4cccn4)csc3C2)nc1 426475592 XQXLNIYMDKXAKI-UHFFFAOYSA-N 395.532 2.890 0 50 GFAA COc1ccc(CN2CCN(C(=O)NC[C@@H](C)c3ccccc3)CC2=O)cc1 426518855 VONWKIBRSIYGIL-QGZVFWFLSA-N 381.476 2.853 0 50 GFAA NC(=O)c1ccc(OCC(F)F)c(NC(=O)c2nc3cccnc3s2)c1 428512090 GHYZTLPLGFYOJV-UHFFFAOYSA-N 378.360 2.686 0 50 GFAA Cc1nnnn1-c1cc(NC(=O)N2Cc3ccccc3O[C@H](C)C2)ccc1F 432867861 UKJWVFULZCWEDC-GFCCVEGCSA-N 382.399 2.925 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)NCCN2CCC[C@@H](CO)C2)c1C 670434042 SAMBURXOAYKQMN-QGZVFWFLSA-N 382.570 2.584 0 50 GFAA O=C(NC1CCN(Cc2ccc(-c3ccccc3)cc2)CC1)N[C@@H]1CCNC1 828038222 UINXBDYGCODABK-JOCHJYFZSA-N 378.520 2.979 0 50 GFAA O=C1C[C@H](C(=O)NCc2nc(-c3ccccc3Cl)no2)C2(CCCC2)O1 828244560 OYJQVQYOKHEYQU-GFCCVEGCSA-N 375.812 2.882 0 50 GFAA COC(=O)C[C@H](c1ccccc1)c1c(O)n(CCc2cnc[nH]2)c(C)cc1=O 888090202 IQDXCJKQAUMJEV-QGZVFWFLSA-N 381.432 2.523 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3ccc(-c4noc(C5CC5)n4)cc3)CCN12 1529113342 XCFJWZFXYJLCFN-RBUKOAKNSA-N 396.491 2.939 0 50 GFAA CNc1nc(C(N)=O)c(NC(=O)[C@H](c2ccc(F)cc2)N2CCCCC2)s1 1529173117 MNVGZBVLUSUIFO-AWEZNQCLSA-N 391.472 2.589 0 50 GFAA O=C([C@@H]1CCCN2CCCC[C@H]12)N1CCCN(CC[C@H](O)c2ccccc2)CC1 1772700702 ILHPRVOSTWRBGG-ZLNRFVROSA-N 399.579 2.909 0 50 GFAA O=C(c1ccc(-c2cccc(F)c2)cc1)N1CC[C@@H](O)[C@@]2(CCCNC2=O)C1 1857674710 VBADUOKGFBMFAA-DENIHFKCSA-N 382.435 2.596 0 50 GFAA O=C(N[C@H]1CC[C@@H](NC(=O)c2ccc(F)c(F)c2)C1)c1ccc2nc[nH]c2c1 1857704729 CXPYPZCXVJGKRI-KGLIPLIRSA-N 384.386 2.922 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4cncnc4)C[C@]34CC[C@H]2O4)c(C)c1 1857719483 MTUHJEPOTANGBB-ZZLPTCMGSA-N 392.503 2.503 0 50 GFAA Cc1c(C(=O)N2CCC([C@H](O)CN(C)CC(C)C)CC2)[nH]c2c1C(=O)CCC2 1857730144 KGEPRJDUPBPHOJ-LJQANCHMSA-N 389.540 2.643 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)CCCCc2ccccc2)[C@H]1c1cnn(C)c1 1857736007 LPJILABIEYWJDO-UNMCSNQZSA-N 384.524 2.663 0 50 GFAA Cc1cn2cccc(C(=O)N3CCN4[C@@H](c5ccccc5)COC[C@H]4C3)c2n1 1875250257 JPPUBANXRJUFSV-UYAOXDASSA-N 376.460 2.541 0 50 GFAA C[C@@H](Oc1ccc(Br)cc1Cl)c1noc(-c2nnn(C)n2)n1 1875286372 RRTRCMRVBLENAR-ZCFIWIBFSA-N 385.609 2.816 0 50 GFAA COc1ccc(-c2cc3c(=O)ccoc3nc2N(C)CC2CCNCC2)cn1 1875308068 RKUMJYNDECJBFO-UHFFFAOYSA-N 380.448 2.694 0 50 GFAA CNC(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)CCc1ccc3ccccc3n1)C2 1875394690 SGHSPFUICRCNTF-YJLNNSPDSA-N 390.443 2.530 0 50 GFAA CNC(=O)C[C@@H]1CN(C(=O)c2ccnc(Oc3ccc(C(C)C)cc3)c2)C[C@H]1O 1875403840 GOCIEPHFPPIHKV-IEBWSBKVSA-N 397.475 2.566 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCO[C@@H]2CC[C@H](C(N)=O)C[C@H]21 1940193477 YBWZYSSUYWKQFJ-QXAKKESOSA-N 379.460 2.552 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccccc2)nc1 2325785765 MNPUITGWITUXRJ-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA CC[C@]1(O)CCC[C@H]2CN(C(=O)CCCc3nc(-c4cccnc4)no3)C[C@H]21 2356149246 QFZILCWESXHJLO-FVJLSDCUSA-N 384.480 2.854 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)c1cccc(F)c1 815606 KANUCCGZDGNASN-MRXNPFEDSA-N 378.425 2.535 0 50 GFAA CC(=O)O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@@H]2OC3(CCCCC3)O[C@@H]21 12379850 BNYMWYFDNNGEAG-QXDIGNSFSA-N 382.453 2.795 0 50 GFAA biogenic C[C@H](c1ccncn1)N(C)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 55074315 MKOIQBVIMLBVIV-OAHLLOKOSA-N 391.541 2.850 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(Cc3cnn(C(C)(C)C)c3)CC2)c(C)s1 113949009 BAFFKAFGPTWIFO-UHFFFAOYSA-N 396.582 2.823 0 50 GFAA COc1ncccc1-c1nn(CC(=O)Nc2cc(C)nn2C)c2ccccc12 55074328 YXMUVARPGXFIGW-UHFFFAOYSA-N 376.420 2.788 0 50 GFAA Cc1ccc(C(=O)NCc2nc3ccccc3c(=O)[nH]2)cc1NC(=O)C1CC1 55053801 QXKOOAXXDDKJKW-UHFFFAOYSA-N 376.416 2.510 0 50 GFAA COc1ccc(-c2nc(CN3CCN(c4nonc4C)CC3)c(C)o2)cc1C 55343533 KAKBYBSWFFZUKL-UHFFFAOYSA-N 383.452 2.981 0 50 GFAA Cc1cccc(CN2CCN(Cc3cccn3-c3cccnc3)C[C@H]2CCO)n1 104428960 RWQNQKZEKJELAJ-JOCHJYFZSA-N 391.519 2.645 0 50 GFAA CCCCN1C(=O)C[C@H](C(=O)/N=c2\sccn2C)[C@H]1c1ccc(OC)cc1 139403224 PUNBTRWTKOQMSJ-WLOXRLQYSA-N 387.505 2.912 0 50 GFAA COc1ccc(C(=O)CNC(=O)[C@@H](C(C)C)N2Cc3ccccc3C2=O)cc1 409413001 DPJGOBJIANTBKQ-HXUWFJFHSA-N 380.444 2.675 0 50 GFAA CC(=O)N1CCN(C(=O)[C@H](C)NCC2(c3cccc(C)c3)CCCCC2)CC1 120440841 COYTWYWMEZDCSA-IBGZPJMESA-N 385.552 2.866 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)c1C(=O)OC(C)C 6184391 STINFIHLUWESGO-WDEREUQCSA-N 396.465 2.550 0 50 GFAA COc1ccc(-c2cncc(C(=O)NCc3nc(C(F)(F)F)n[nH]3)c2)cc1 482210455 LRNMDZJXKNAETH-UHFFFAOYSA-N 377.326 2.824 0 50 GFAA COc1nc2c(cc1CNC(=O)CCc1ccco1)C(=O)N(C1CCCC1)C2 71589423 MRHCIHUNNPSADM-UHFFFAOYSA-N 383.448 2.831 0 50 GFAA O=C(Nc1cccnc1N1CCCC1)N[C@H](CO)c1nc(-c2ccccc2)no1 363383128 JWUHFPUXQVSFCT-MRXNPFEDSA-N 394.435 2.587 0 50 GFAA Cc1coc(-c2cccc(NC(=O)c3ccc([C@@]4(C)NC(=O)NC4=O)cc3)c2)n1 154768127 NZJJVCPOGOFIJF-OAQYLSRUSA-N 390.399 2.957 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CCC3(CCO3)CC2)nc2cccnc21 77386845 CIHMVTWJSFJHHL-MRXNPFEDSA-N 386.496 2.743 0 50 GFAA CCOCCC1(C(=O)N2CCC[C@@H](N(C)Cc3noc(C)n3)CC2)CCC1 369586129 MYNXRJJDXWPBGN-QGZVFWFLSA-N 378.517 2.788 0 50 GFAA Cc1ccn2c(CN3CCC[C@@H](CO)C3)c(C(=O)N3CCCCCC3)nc2c1 71761405 YFZIACIRDZBSBG-GOSISDBHSA-N 384.524 2.863 0 50 GFAA O=S1(=O)CCC[C@H](CS(=O)(=O)N2CCC[C@@H]2CCC2CCCCC2)C1 333375406 DUITZYXTVRHPOW-ZWKOTPCHSA-N 391.599 2.966 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccsc3)[C@H](CCO)C2)cc1CO 38149386 LNYFGPHXFSRLLQ-HXUWFJFHSA-N 390.549 2.708 0 50 GFAA CCN(CC)CC(=O)N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426383371 UVCZNTUKOVJBDZ-OAQYLSRUSA-N 393.478 2.648 0 50 GFAA CN(CC(=O)N1CCN(c2ccccc2Cl)C(=O)C1)Cc1ccccc1F 82097427 APNLWZKEMMQZRA-UHFFFAOYSA-N 389.858 2.786 0 50 GFAA CCSCCC(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 95529339 KGXHVKBDJAWYSV-UHFFFAOYSA-N 390.553 2.555 0 50 GFAA CCCCN(Cc1ccc(F)cc1)C(=O)CN1CC2(CCNCC2)OC1=O 95531034 ZASTUJWDPJUBNI-UHFFFAOYSA-N 377.460 2.529 0 50 GFAA CN(Cc1cccc(-c2nnn[nH]2)c1)C(=O)c1ccc([C@H]2CCCNC2)cc1 95388616 SFANMRCJHIMMAL-IBGZPJMESA-N 376.464 2.606 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@@H]4CCCN4)csc3C2)nc1 426544652 GSQRHTYZCNDHAP-INIZCTEOSA-N 384.549 2.746 0 50 GFAA Cc1nnnn1-c1ccc(NC(=O)NC[C@H](c2ccco2)N2CCCC2)cc1 96163289 DZSAHNUANWMUTO-QGZVFWFLSA-N 381.440 2.522 0 50 GFAA CC(C)Cc1ncc2c(n1)CN(C(=O)Nc1cccc(Cn3cncn3)c1)C2 95522075 LTZTWUMCUJQIOL-UHFFFAOYSA-N 377.452 2.863 0 50 GFAA CCn1ccnc1C1CCN(C(=O)CCCn2cnc3ccccc3c2=O)CC1 95499636 ZDSQJGJJQFYQPD-UHFFFAOYSA-N 393.491 2.799 0 50 GFAA CCn1c(CN(C)Cc2c[nH]nc2-c2ccc(F)cc2)nnc1[C@H]1C[C@@H](N)C1 240228085 KFVLOFUTSPZWDU-KDYLLFBJSA-N 383.475 2.664 0 50 GFAA c1ccc(N2CCN(c3ncncc3-c3nc(-c4ccsc4)no3)CC2)nc1 263615564 DBERNSMDKFUESY-UHFFFAOYSA-N 391.460 2.977 0 50 GFAA CC(=O)N1CCOc2ccc(CN3CCN(C)C[C@@H]3c3ccccc3)cc2C1 299774121 APDVZESEUAEBIO-JOCHJYFZSA-N 379.504 2.916 0 50 GFAA Cc1ccccc1-n1cc(CN2CCN(Cc3ccccc3CO)CC2)cn1 828831891 PTHHJAONIHSZHE-UHFFFAOYSA-N 376.504 2.991 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)N[C@@H](CO)Cc3ccccc3)CC2)cc1 828777891 WNZQOEUVTQXXET-OAQYLSRUSA-N 380.488 2.567 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N3CC[C@@]4(C)[C@@H](C3)C4(F)F)CC2=O)cc1OC 1875255900 FRCQVPQYNDVTSX-FXHACXQTSA-N 394.418 2.560 0 50 GFAA O=C(NC[C@@H]1CS(=O)(=O)c2ccccc21)N1CC[C@@]2(CCc3ccccc32)C1 873027111 MLJFXIYNXPCKMV-VGSWGCGISA-N 396.512 2.857 0 50 GFAA Cc1cccc(OC[C@H](O)CNC(=O)[C@@H](Cc2ccc(O)cc2)C(F)(F)F)c1 1875318304 FGNYTIHTHABJME-SJLPKXTDSA-N 397.393 2.978 0 50 GFAA O=C(NCC1CCN(C(=O)CCc2cccc(Cl)c2)CC1)[C@H]1CCOC1 952989740 OSQQCSMRGLLLGX-KRWDZBQOSA-N 378.900 2.664 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)N1CCc2ccc(F)cc21 171781541 DVAQNGBGMAJQFP-FQEVSTJZSA-N 383.467 2.841 0 50 GFAA Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N[C@@H]3CCN(C)C(=O)C3)c12 193168863 ILXHYSDVNADFPN-CQSZACIVSA-N 385.512 2.969 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)C1 779845759 JIRFKRMSRKXJSM-MCIONIFRSA-N 386.235 2.707 0 50 GFAA COc1ccc(S(=O)(=O)NCc2csc(N3CCCC3)n2)cc1Cl 1506415076 UTIATJFHHUIHMF-UHFFFAOYSA-N 387.914 2.884 0 50 GFAA CCc1ccc(OCCN(C)Cc2cc(=O)n3nc(SC)sc3n2)cc1 1506420535 HSPFVBJFCPQMEV-UHFFFAOYSA-N 390.534 2.946 0 50 GFAA CCc1nccn1CCC(=O)N1CCCN([C@@H]2CCN(c3ccccc3)C2)CC1 1775979483 IQJJLGPUAZVJIE-OAQYLSRUSA-N 395.551 2.649 0 50 GFAA COc1ccc(N([C@H](C)C(=O)N[C@@H](C)c2ccccc2)S(C)(=O)=O)cc1 12383827 RZTDLPNHAIPQMA-LSDHHAIUSA-N 376.478 2.727 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@H](C)Cc3cc(C)ccn3)CC2)CC1 12435593 MFYUHWTYMVZORB-HXUWFJFHSA-N 386.584 2.977 0 50 GFAA Cn1nc(C(=O)N2CCCCCC2)c2c1CC[C@H](NCCCc1ccncc1)C2 14732160 RAMACLZQDAVWLG-IBGZPJMESA-N 395.551 2.911 0 50 GFAA CCOCCC(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 4807531 LIRRRUPGYCOGGJ-UHFFFAOYSA-N 376.478 2.872 0 50 GFAA O=C(N[C@H]1CCC[C@H]2CN(C(=O)c3ccncc3)C[C@@H]12)c1ccc2c(c1)CCO2 1857674379 FWYUDLGBZPWVLH-ZCNNSNEGSA-N 391.471 2.687 0 50 GFAA COc1cc2c(cc1-c1nccn1Cc1ccc(C(=O)N(C)C)o1)OCCO2 1857679971 CKIYLCAQJPVURY-UHFFFAOYSA-N 383.404 2.673 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)OCCc2sc(C(=O)O)cc23)cc(O)n1 1857688358 FNIIRMPVUQEAQR-UHFFFAOYSA-N 388.445 2.560 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2noc(-c3c(F)cccc3F)n2)CC[C@H]1N 1857727639 WFYYTCCTPUDSQU-NILFDRSVSA-N 394.422 2.554 0 50 GFAA COc1ccc(CN2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c(Cl)c1OC 1857730518 VHSLHFXUVZPUJO-NBQZKYEYSA-N 394.899 2.915 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NCCc1nc(C)c2c(n1)CCC2 1857731405 HBJIJLXAGZNOGU-UHFFFAOYSA-N 394.504 2.722 0 50 GFAA O=C(c1cscn1)N1CC[C@H]2[C@H](CCC(=O)N2CCc2cccs2)C1 222463936 NMAVHLQRJDKTNN-CJNGLKHVSA-N 375.519 2.900 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N=c2sccn2Cc2ccccc2F)c1 245267417 LPSVUOCVGMDHQP-UHFFFAOYSA-N 390.461 2.882 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)CN2C(=O)c1cnn2ccccc12 248012055 JGPDVATWLFLNHR-SJORKVTESA-N 379.464 2.676 0 50 GFAA Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@@H](NCc1ccncc1)C2 14746219 QLHHACWCQUWKPO-GOSISDBHSA-N 393.466 2.531 0 50 GFAA O=C(CCn1ccc2ccccc21)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785546 DHRGXVQQRALTGO-LSBZLQRGSA-N 386.883 2.837 0 50 GFAA Cc1cc(C)n(C(=O)c2ccc(NC(=O)[C@@H]3COc4ccccc4O3)cc2)n1 1079767 KMLJFXVJUCONBM-IBGZPJMESA-N 377.400 2.967 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cc4ncccn4n3)C2=O)cc1 2356136063 FOUSHFQEHNLHRT-QFIPXVFZSA-N 389.459 2.840 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@]12CCCN2Cc1cccc2ccnn12 2356167067 HJJOYAPCXLFCTO-NQSCKRDGSA-N 382.508 2.595 0 50 GFAA O=C1C[C@H](CNC(=O)C2(c3cccc(Br)c3)CCCCC2)CN1 413882296 QEVDTOUEGXNOLA-ZDUSSCGKSA-N 379.298 2.903 0 50 GFAA CCc1cc(N2CCC(NC(=O)Cc3ccc([Si](C)(C)C)cc3)CC2)ncn1 225506142 URRYOCYBUACTQB-UHFFFAOYSA-N 396.611 2.912 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)NCCc2nc(C)c3c(n2)CCC3)c1 55371053 JCQWCISNIATKCS-UHFFFAOYSA-N 380.492 2.914 0 50 GFAA CCOC(=O)N1CCN(Cc2nc3cc(NC(=O)CC)ccc3n2CC)CC1 20707377 ABQNZRMYQBRUNI-UHFFFAOYSA-N 387.484 2.679 0 50 GFAA CC(=O)Nc1cccc(NC(=O)c2cccc(N(C)S(C)(=O)=O)c2C)c1 65363379 ZAQSEVBOAWMDED-UHFFFAOYSA-N 375.450 2.602 0 50 GFAA COc1ccccc1/C=C/CN1CCC(n2cc(C(=O)N3CCCC3)nn2)CC1 20271956 VEBDTNBCICJHAZ-SOFGYWHQSA-N 395.507 2.873 0 50 GFAA O=C(NC[C@@H](O)c1ccc(F)c(F)c1)NC[C@H]1CCN(c2ccccc2)C1 229739491 SFFVHCJGANFOOD-AUUYWEPGSA-N 375.419 2.824 0 50 GFAA CCn1ncc(-n2c(S)nnc2-c2nn(C)c(C)c2Br)c1C 2802171 QLZZCMRVNJTUOS-UHFFFAOYSA-N 382.291 2.552 0 50 GFAA Cc1cc(S(=O)(=O)N2C[C@H](C)C(=O)N(C)c3ccccc32)sc1C(=O)O 365574103 UJTTZRUBRDIGOA-NSHDSACASA-N 394.474 2.563 0 50 GFAA COCCN1C(=O)C[C@@H](CNC2CC(c3cccc(C)c3)C2)[C@@H]1c1cnn(C)c1 328639245 WUEWOHPZCHMGTC-JHYNZKOVSA-N 396.535 2.800 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)N2CCO[C@H](c3ccccc3)C2)cn1 127698817 OKJITHRWOTXDMV-IBGZPJMESA-N 377.448 2.859 0 50 GFAA C[C@H](NC(=O)C1CCCC1)C(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 333740010 LHRIMKHYEVFVRV-ZFWWWQNUSA-N 390.446 2.889 0 50 GFAA O=C(C[C@H]1CCCO1)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 237953324 GAAUVGANZHICQS-DOMZBBRYSA-N 395.253 2.611 0 50 GFAA O=C(C1CCCCC1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 82086757 MMFAFUITJVJNAN-IBGZPJMESA-N 375.557 2.892 0 50 GFAA Cc1nc(N)ccc1-c1ccc(C(=O)N[C@H]2CCCN(c3ncccn3)C2)cc1 426406065 IUXATBACAATAFR-SFHVURJKSA-N 388.475 2.828 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2ccnnc2)C1)NCc1ccc(F)c(F)c1 95497404 CVBILJRRQAKKCO-AWEZNQCLSA-N 388.418 2.704 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95531309 NCINDXACOKXXFL-QGZVFWFLSA-N 386.459 2.994 0 50 GFAA CCN1C[C@@]2(CCCN(CCOc3c(OC)cccc3OC)C2)CCC1=O 91693723 SCLQPNWCRLXYNO-NRFANRHFSA-N 376.497 2.807 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(CCc3cn[nH]c3)CC2)c1 95523668 BCHQBFZUDQROLB-UHFFFAOYSA-N 398.507 2.740 0 50 GFAA CCC[C@@H](NC(=O)Nc1cc(NS(C)(=O)=O)ccc1F)c1nccn1C 97805497 RXKBIFWMFABITL-CYBMUJFWSA-N 383.449 2.594 0 50 GFAA CS(=O)(=O)Nc1cc(F)ccc1NC(=O)c1c(Cl)nc2ccccn12 181089864 ONVSYAIIVQLODD-UHFFFAOYSA-N 382.804 2.751 0 50 GFAA O=C(CCCn1ccnc1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95529891 JMIGPRIYTPBZEP-IBGZPJMESA-N 378.480 2.709 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(COc3ccc(F)c(C(F)(F)F)c3)n2C)C1 244685563 ISLYUHBWKMEUMK-XYPYZODXSA-N 386.349 2.934 0 50 GFAA Cc1cccc(F)c1S(=O)(=O)N1CCN(c2ncnc3ccsc23)CC1 184917520 KHCFKTZDYYJWKS-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA O=C(Cc1ccc2c(c1)NC(=O)C2)NCc1cccc(COC2CCOCC2)c1 182675489 FXSSLUMDZPABSV-UHFFFAOYSA-N 394.471 2.736 0 50 GFAA CCCn1cc(CNC(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)cn1 534640085 MOKDSXGYNBXGHW-UHFFFAOYSA-N 377.439 2.599 0 50 GFAA COc1ccc2cc(S(=O)(=O)N[C@@H]3CCCN(C(=O)C(C)C)C3)ccc2c1 824758368 YFDQHRGSIMVQCR-QGZVFWFLSA-N 390.505 2.774 0 50 GFAA Oc1ncnc2cc(-c3noc([C@H]4CCc5nnn(C6CCC6)c5C4)n3)ccc12 952892558 DVYAHDXGKPNJOH-LBPRGKRZSA-N 389.419 2.974 0 50 GFAA COC(=O)Nc1ccc(NC(=O)C(=O)N[C@H]2C[C@]23CCc2ccccc23)cc1 1875276046 GOSAHJFQNMIZBP-UWJYYQICSA-N 379.416 2.576 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1Nc1nccc2c(Br)cncc12 1875399286 VAMHSIHFAIZLLV-IUIKQTSFSA-N 388.269 2.840 0 50 GFAA Cn1cc(C[N@@]2C[C@@H]2COc2cccc3c2N(C(=O)OC(C)(C)C)CC3)cn1 1875385480 UGGXBPBSRCZDFE-OSPHWJPCSA-N 384.480 2.981 0 50 GFAA Cc1ccc2c(c1)C[C@@H](C(=O)Nc1cccc([C@H]3CCCC(=O)N3)c1)S2(=O)=O 1875392625 KWFSIZJFBGNZMF-MJGOQNOKSA-N 398.484 2.673 0 50 GFAA CC(C)n1cc(C[C@@H]2NC(=O)N(CCCc3cccc(Cl)c3)C2=O)nn1 1875361001 NDMXAHXUPBSQJM-INIZCTEOSA-N 375.860 2.608 0 50 GFAA CN(C)C/C=C/C(=O)NC[C@@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C 1875377379 ZADZLMZNCJOHTQ-IQIBNGDESA-N 379.423 2.552 0 50 GFAA Ic1ccc(OCc2nc(Cc3cn[nH]c3)no2)cc1 1875355912 GTDCHGHGTVACQE-UHFFFAOYSA-N 382.161 2.567 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccncc1Oc1ccccc1 1875401011 QDXLWBKSYRJAII-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA COc1ccc(CN(Cc2c(C)nn(C)c2C)C2CC2)cc1Cn1cncn1 952968745 GFCQSLSYOZNDIH-UHFFFAOYSA-N 380.496 2.850 0 50 GFAA O=C(NC[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2F)C1)c1cccs1 952976290 NONAIWRJFWWNHZ-AWEZNQCLSA-N 396.509 2.859 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)Cc2cnc3c(C)cccn23)n1 952973671 YEDGGTPFYIAQOP-MRXNPFEDSA-N 383.452 2.511 0 50 GFAA O=C(c1ccccc1SCc1ccc(F)cc1)N1CC[C@H](CO)[C@H](O)C1 1529133608 RSHCHFQGFKSTFX-CRAIPNDOSA-N 375.465 2.933 0 50 GFAA O=S(=O)(NC1CCCC1)[C@@H]1CCCN(c2nc(C(F)(F)F)cs2)C1 302027313 AIKRYUXXXLLNGD-LLVKDONJSA-N 383.461 2.993 0 50 GFAA COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 186661837 XDFXSZUCKWCJET-FUHWJXTLSA-N 376.497 2.661 0 50 GFAA Cc1c(-c2cc(CN3CC[C@@H](CN(C)Cc4cccnc4)C3)on2)cnn1C 195282470 YUHBDGLEMLJYCG-SFHVURJKSA-N 380.496 2.732 0 50 GFAA CNC(=O)Cn1cc(NC(=O)CCc2ccc(-c3ccc(Cl)cc3)[nH]2)cn1 1506428385 QIDDGHOBZAOVDQ-UHFFFAOYSA-N 385.855 2.849 0 50 GFAA CCN(Cc1nccn1C)S(=O)(=O)c1cc(Cl)c(OC)cc1Cl 1506414744 RSNSSJLIKCAKDU-UHFFFAOYSA-N 378.281 2.946 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2CCOCc2ccccc2)cc1OC 1529161805 QPPNPXQDXIUJLM-FGZHOGPDSA-N 387.476 2.655 0 50 GFAA Cc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1I 675391 JTLYGDKMOFCZLP-UHFFFAOYSA-N 380.185 2.951 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3ccc(OCc4ccccn4)cc3)C[C@@H]2O)n[nH]1 1529141502 JQIQSGMEJRBODP-GCJKJVERSA-N 378.476 2.728 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@@H](O)CC(C)C)CC1)OCC2 1704299291 IBCLNSDFKZGRQJ-KRWDZBQOSA-N 377.481 2.501 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)Cc3ccc(C(F)(F)F)cc3)C[C@@H]12 1704306539 WIJAFZPKTFNRMQ-QAPCUYQASA-N 384.398 2.645 0 50 GFAA O=C(O)c1c(NCCn2ncc3ccccc3c2=O)noc1-c1ccccc1 1772707835 ZXCSKNZBZPEHEK-UHFFFAOYSA-N 376.372 2.862 0 50 GFAA CN(C)C[C@]12CN(C(=O)C3CCC3)C[C@@H]1CN(c1ccc3ccccc3n1)C2 1772804349 NAYFIFPAGAMKHA-CVDCTZTESA-N 378.520 2.861 0 50 GFAA COCc1c(C(=O)N2CCC[C@H](C)C2)cnn1-c1nccc(-c2ccco2)n1 12048699 KVQHAHMLCAFQGG-AWEZNQCLSA-N 381.436 2.941 0 50 GFAA CSCCCNC(=O)c1cn(CC(C)C)cc(C(=O)NC2CCCC2)c1=O 12245684 AFHZGKNPSJOFEV-UHFFFAOYSA-N 393.553 2.660 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cc(Cc2ccc3c(c2)OCO3)no1)c1ccccc1 12281354 IJHMIGBEUPTMEW-IBGZPJMESA-N 394.383 2.638 0 50 GFAA COc1ccc(C(=O)NC2CCCCC2)cc1S(=O)(=O)N1CCCCC1 13945915 YEGPZVKTOVPGML-UHFFFAOYSA-N 380.510 2.932 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)NCCSc3ccccc3)ccc21 15335057 SDRGGQGDJAZGSA-UHFFFAOYSA-N 376.503 2.666 0 50 GFAA Nc1nc(SCC(=O)N2CCc3ccccc32)[nH]c(=O)c1-c1ccccc1 18022863 ZPHATIJXBSCHRD-UHFFFAOYSA-N 378.457 2.701 0 50 GFAA Cc1ccc([C@H]2NC(=O)N(CC(=O)Nc3ccccc3F)C3=C2C(=O)OC3)cc1 169757940 DURFLHHATIRGDT-LJQANCHMSA-N 395.390 2.650 0 50 GFAA CN(CC(=O)Nc1cc(Cl)ccc1O)S(=O)(=O)c1ccc(Cl)cc1 2850351 CLQQQZARDMZMAY-UHFFFAOYSA-N 389.260 2.958 0 50 GFAA O=C(NC1CCCCC1)[C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857696600 IQQVQXODGZPVBM-HNNXBMFYSA-N 384.505 2.931 0 50 GFAA O=C(CCC1CCC1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857717986 JHGHZIBCGFEHNW-GMAHTHKFSA-N 386.536 2.992 0 50 GFAA COc1ccccc1Cc1nc([C@H]2C[C@@H](N)[C@H](O)C2)n(-c2cccc(F)c2)n1 1857722822 OYOYGEHVOCTOFO-BMGDILEWSA-N 382.439 2.571 0 50 GFAA Cn1c(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccn2)nc2ccccc21 248090021 VAJLXIJUOWENFC-AEFFLSMTSA-N 375.476 2.591 0 50 GFAA CC(=O)NCc1ccc(C(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)cc1 367852033 YIOQKSQKVXXOET-HSZRJFAPSA-N 380.488 2.780 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3nc4ccccc4[nH]3)C1)CC2 1704338304 QSZFSWQDEXQVAS-NRFANRHFSA-N 376.464 2.539 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCC[C@]3(CCc4cnc(N)nc43)C2)cc1 1704340902 XOKOJYFTRNLZMV-QFIPXVFZSA-N 390.491 2.938 0 50 GFAA CC(=O)Nc1cccc(CNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)c1 811999554 QXISXIRGIXFEFC-INIZCTEOSA-N 375.375 2.726 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N[C@H](CO)[C@@H](O)C1CCCCC1 913047656 AOZJSFSZTCVOCX-QAPCUYQASA-N 378.494 2.672 0 50 GFAA Cc1ccc(N2CC[C@H](NC(=O)c3ccc4c(c3)[C@H](CN)CCC4)C2=O)cc1 851626642 FUKADRUAXVRWGN-RXVVDRJESA-N 377.488 2.909 0 50 GFAA CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Br)c(O)c(OC)c1 4143201 KVUGONHEFAHWIB-CYBMUJFWSA-N 399.241 2.744 0 50 GFAA N=c1cc[nH]cc1-c1cn([C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)nn1 2325860083 WXMWVIPZRXOLRB-MRXNPFEDSA-N 388.353 2.749 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)N[C@@H]3C[C@@H]3Cc3ccccc3)CC2=O)cc1 2325872175 LDBWMPBPYCPWTA-SQGPQFPESA-N 379.460 2.731 0 50 GFAA COc1ccc(C)cc1N(CC(=O)N[C@H](C)c1ccccc1)S(C)(=O)=O 2174702 MVNVJZGJKWNIJR-OAHLLOKOSA-N 376.478 2.647 0 50 GFAA Cn1c(C(=O)N[C@@H](c2ccccc2)c2n[nH]c(=N)s2)cnc1-c1ccccc1 2356165999 SFEGETQHPXLZGP-INIZCTEOSA-N 390.472 2.871 0 50 GFAA CN(C)Cc1nc(N2CC[C@H](CO)[C@@H](O)C2)c2c(-c3ccccc3)csc2n1 225360000 MANSNGNSLWLXQE-WBVHZDCISA-N 398.532 2.599 0 50 GFAA CN1CCN(C(=O)c2cc3nc(-c4ccccc4)cc(C(F)(F)F)n3n2)CC1 55250666 DQMZVMDRFHMFIT-UHFFFAOYSA-N 389.381 2.803 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H]3CC(=O)N(c4cccc(F)c4)C3)n1)CCNC2 20535543 ZGUKWIYQSAXMDY-CYBMUJFWSA-N 393.422 2.745 0 50 GFAA COc1ccc(OC)c(-n2cnnc2CN2CCN(c3ccc(F)cc3)CC2)c1 67868704 PVCQEXUMJHEJQG-UHFFFAOYSA-N 397.454 2.746 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(C)cc3F)CC2)C1 67820068 LEZGTEWDTQXOGE-LJQANCHMSA-N 391.531 2.573 0 50 GFAA Cn1nc2c(c1C(=O)N1CCC[C@H](C(=O)c3ccc4c(c3)OCO4)C1)CCCC2 20599783 USFFLQFUJUHJPX-HNNXBMFYSA-N 395.459 2.763 0 50 GFAA O=c1c2c3c(sc2ncn1Cc1cccc(F)c1)C[C@H](N1CCOCC1)CC3 23337556 FUGGWJNUCODBFK-MRXNPFEDSA-N 399.491 2.835 0 50 GFAA COc1ccccc1[C@@H]([C@@H](O)C(=O)c1c[nH]c2ccccc12)N1CCN(C)CC1 23119751 TVHUIRWEOFXBRT-JTHBVZDNSA-N 393.487 2.709 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(NCC(C)(C)CO)nc2)C1 67587782 UGPKJSFJHVGHLR-QGZVFWFLSA-N 375.513 2.979 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)[C@H]2CCCCO2)CCO3)n1 67560747 JTHFYGYMHJWVJU-GOSISDBHSA-N 383.448 2.756 0 50 GFAA NC(=O)c1c(NC(=O)c2nn3cccnc3c2Cl)sc2c1CCCC2 2790113 BUMVXEBDRGLASW-UHFFFAOYSA-N 375.841 2.674 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2ccc(NCc3ccc4c(c3)OCO4)nc2)C1 14976751 MJUXDBYHENDSSA-MRXNPFEDSA-N 383.448 2.921 0 50 GFAA CCCCc1nc(CN2CCO[C@H](C(=O)Nc3cnccc3C)C2)c(Cl)[nH]1 72459194 FMYVCKKXNNQZNV-INIZCTEOSA-N 391.903 2.949 0 50 GFAA C[C@H](c1nc(Cc2ccccc2)no1)N(C)CCN1C(=O)c2ccccc2C1=O 159023940 FCLCODBVJZPIPE-OAHLLOKOSA-N 390.443 2.949 0 50 GFAA O=C(Cn1cnccc1=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 490430139 VVYKNSPZLYMKLA-INIZCTEOSA-N 382.807 2.868 0 50 GFAA CCN(CC)CC(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 72151871 GVXHCKDHKUOPJP-NRFANRHFSA-N 375.488 2.509 0 50 GFAA CSc1cccc(NC(=O)CN2C(=O)[C@H]3CCCN3C(=O)c3ccccc32)c1 212511434 UAPLTNULDCGMBK-GOSISDBHSA-N 395.484 2.998 0 50 GFAA COc1ccc(/C=C/CN2C[C@@H]3CN(Cc4ccncc4)C[C@]3(C(=O)O)C2)cc1 215886307 YIONSYDPFWWXFT-FHPHHSFESA-N 393.487 2.622 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccnc(N4CCCC4)n3)CC2)cc1F 72117600 GOYWMKBKLKCELF-UHFFFAOYSA-N 384.459 2.878 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@H](CC(=O)NCCCc1ccccc1)CO2 71764268 JCHMOFNVFUUEHX-LJQANCHMSA-N 395.503 2.725 0 50 GFAA CC(C)NS(=O)(=O)c1cccc(C(=O)N2CCOC3(CCCCC3)C2)c1 174456866 QJJVADOZQGNFFX-UHFFFAOYSA-N 380.510 2.549 0 50 GFAA C[C@H]1CN(C(=O)CCC[S@@](=O)c2ccc(Br)cc2)C[C@@H](C)N1 179162090 OWVHGOAAYZVWDP-GPAUDHNESA-N 387.343 2.546 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(C(=O)c3ccn(C)n3)CC2=O)cc1 426549041 BGNPHHGNELLJFK-FQEVSTJZSA-N 388.471 2.829 0 50 GFAA CN(C(=O)Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1)C1CCSCC1 95503549 FPIGXEJZVYEQNI-QGZVFWFLSA-N 377.510 2.955 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1 91848848 VHOPPOKNASRSSY-UHFFFAOYSA-N 378.476 2.644 0 50 GFAA CN1CCN(CC[C@@H]2CCCCN2C(=O)NCc2ccc(F)c(F)c2)CC1 426726738 JANADICJICWSKF-KRWDZBQOSA-N 380.483 2.666 0 50 GFAA CCc1nc(CN2CCC[C@@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)no1 95506360 NSNYKOGHLUNLLO-OAHLLOKOSA-N 380.452 2.873 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n(C)n1 95386297 DUTSJJJHZGOOBW-CWFSZBLJSA-N 386.446 2.709 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 91391156 VTVNMSIXJNUJSQ-UHFFFAOYSA-N 378.476 2.644 0 50 GFAA CSc1nn2c(=O)cc(CN(C)[C@@H](C)Cc3ncccc3C)nc2s1 244795041 QYNRWQCSUCUCSM-LBPRGKRZSA-N 375.523 2.639 0 50 GFAA Cc1cccc(F)c1C(=O)N1CCC2(CC1)CN(C(=O)c1ccc[nH]1)CCO2 825224381 DUFZLPBALUEDIR-UHFFFAOYSA-N 385.439 2.610 0 50 GFAA Cc1ccc([C@H](C)CCN2CCOC3(CCN(c4ccnc(N)n4)CC3)C2)o1 827591847 RGCIMEDOFWRVAH-MRXNPFEDSA-N 385.512 2.825 0 50 GFAA O=C(NCC1([C@@H](O)c2ccccc2)CC1)c1cc(F)ccc1N1CCOCC1 752351854 NDDIYUVIBHKWIO-FQEVSTJZSA-N 384.451 2.906 0 50 GFAA Cn1nnc2c1CC[C@H](NCc1cc3c(Br)cc(F)cc3[nH]1)C2 922223947 DQGSFQWNRVKMIM-JTQLQIEISA-N 378.249 2.845 0 50 GFAA O=C(CN[C@H](CO)[C@@H]1CCc2ccccc21)NCCc1nc2ccccc2s1 1875281510 FEPMONJFHAHUQH-IEBWSBKVSA-N 395.528 2.636 0 50 GFAA O=C([C@H]1CCc2n[nH]cc2C1)N1CC(Oc2ccc(Br)cc2)C1 1875302244 GWCWYBVQKWUYCL-NSHDSACASA-N 376.254 2.567 0 50 GFAA Cc1csc(C(=O)NC[C@]2(O)CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)c1 1875305692 YOAGFFKVCZDIOB-DENIHFKCSA-N 398.528 2.944 0 50 GFAA C=CC(=O)NCC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)c2ccc(Cl)cc21 1875387250 XJQNKNONLBMZBM-AWEZNQCLSA-N 393.871 2.945 0 50 GFAA COc1cccc(C(=O)N2C[C@@H]3C[C@H]2CN3c2nccc(C(F)(F)F)n2)c1F 1875311923 DNNIQXXHWWLVBH-QWRGUYRKSA-N 396.344 2.746 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2ccccn2)nc1 1875401126 GDMCERFSWFYGIQ-YJBOKZPZSA-N 390.447 2.591 0 50 GFAA Cn1c([C@H]2CCCN2C(=O)c2nc(N)nc3c2CCCC3)nc2ccccc21 1506410194 JRQCNCJODHCWIK-QGZVFWFLSA-N 376.464 2.802 0 50 GFAA OC1CCN([C@H]2CCN(Cc3cccc(Oc4ccccc4)c3)C[C@@H]2O)CC1 1614377036 IOGFKIOUSVDRQR-GOTSBHOMSA-N 382.504 2.871 0 50 GFAA COc1ccccc1-n1cc([C@@H](C)NC(=O)c2cc(O)cc(C(=O)O)c2)cn1 1772709831 NTRCOANYDYLXMI-GFCCVEGCSA-N 381.388 2.776 0 50 GFAA CSCC(=O)N1C[C@@H]2CN(C(=O)c3ccc[nH]3)C[C@]2(CCc2ccccc2)C1 1772706503 QVQHGSFLQBZWGU-GCJKJVERSA-N 397.544 2.911 0 50 GFAA COc1ccccc1NC(=O)[C@@H](C)Sc1nnnn1-c1ccccc1OC 11692799 IMEFESCJQUAMEV-GFCCVEGCSA-N 385.449 2.799 0 50 GFAA O=C(NCCc1nc(-c2ccccc2)cs1)c1cn(C[C@@H]2CCCO2)nn1 11933806 ACKFREGJVVWQDW-HNNXBMFYSA-N 383.477 2.553 0 50 GFAA COc1ccc(CCN(C)C(=O)c2cn(Cc3ccccc3F)nn2)cc1OC 12229133 FAHHIRBPKGAZHX-UHFFFAOYSA-N 398.438 2.797 0 50 GFAA CCOC(=O)[C@]1(CCOc2ccccc2)CCCN(C(=O)CCn2cccn2)C1 12387592 WVPJRUVOZGJPKP-QFIPXVFZSA-N 399.491 2.914 0 50 GFAA COc1cc(C(=O)N[C@@H](C)c2ccccc2)c(N(C)S(C)(=O)=O)cc1OC 13582533 ALIGQSCKMGRWIJ-ZDUSSCGKSA-N 392.477 2.591 0 50 GFAA COc1cc(C(=O)N[C@H]2CCOC2)ccc1OC1CCN(C2CCCC2)CC1 15074080 XVHXMSUQBQVIQN-KRWDZBQOSA-N 388.508 3.000 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@H]1c1ccc(OC)c(OC)c1 975664 KGFMWASPPDZZQT-INIZCTEOSA-N 376.434 2.527 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2nc(-c3ccc(F)cc3)[nH]c2C)on1 1857670484 PGFGEEBVDJPQDI-PBHICJAKSA-N 384.411 2.808 0 50 GFAA COc1c(C)cnc(CN2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1C 1857706865 UGDRAAKLGZMDMS-JOCHJYFZSA-N 381.476 2.956 0 50 GFAA Cn1c(C(=O)N2CC[C@H](O)[C@@](CO)(Cc3ccc(F)cc3)C2)cc2ccccc21 1857710185 KUQAJYFSPLRZID-GMAHTHKFSA-N 396.462 2.746 0 50 GFAA COc1ccccc1CCC(=O)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1875247401 LIKOHJFSGCKDQF-NFBKMPQASA-N 397.471 2.535 0 50 GFAA COc1c(C(=O)O)cc(-c2cccc(O[C@H](C)C(=O)O)c2)c(OC)c1OC 1875250780 GUJALQIYDDBYLW-SNVBAGLBSA-N 376.361 2.930 0 50 GFAA Cn1cnnc1[C@H]1CCCN(C(=O)C[C@@](C)(C(=O)O)c2ccc(Cl)cc2)C1 414070997 CQKWIGWGSRHTBX-ORAYPTAESA-N 390.871 2.607 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)CC[C@@H]1CCCCO1)CCC2 124260242 GVPJHNLYOWLZJM-INIZCTEOSA-N 380.510 2.565 0 50 GFAA CCc1ccccc1N1C[C@H](C(=O)Nc2cc(C3CCOCC3)[nH]n2)CC1=O 266295523 BTNCUMKUKDWCDD-MRXNPFEDSA-N 382.464 2.858 0 50 GFAA CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCCn1ncc2ccccc2c1=O 2325732306 NYFBVSTYWYVOIN-YVWKXTFCSA-N 385.508 2.990 0 50 GFAA Cc1noc(C(C)(C)NC(=O)C[C@@H]2CN(C[C@H]3CC3(C)C)C3(CCC3)CO2)n1 2325785277 NIPMLDAKLHJHOV-HZPDHXFCSA-N 390.528 2.789 0 50 GFAA NC[C@]1(F)CC[C@H](CNC(=O)c2c[nH]c3ncc(Br)cc23)CC1 2325795753 WUKCYPSFMKIWHP-HZRBXJLLSA-N 383.265 2.912 0 50 GFAA Cc1nc(O)c2nc(C(=O)N3[C@H]4CC[C@H]3CC(O)(c3ccccc3)C4)ccc2n1 2325796477 SZBRLUSBSAARQW-HOTGVXAUSA-N 390.443 2.694 0 50 GFAA Cc1ccc([C@]23C[C@H]2CN(C[C@H](O)Cn2cc(Br)cn2)C3)cc1 2325800464 JGVVDTUPXPSQGU-RYQLBKOJSA-N 376.298 2.588 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NC2CC2)c1 869127861 LQWHJHFVERKSIN-HXUWFJFHSA-N 389.455 2.657 0 50 GFAA CCOC(=O)[C@]1(NC(=S)N(CC)CC)Sc2cc(C)ccc2NC1=O 1192808 BICLEBNYIWFZJS-QGZVFWFLSA-N 381.523 2.515 0 50 GFAA CN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356161312 PEGPQQUSOUVPBA-FHJLPGHOSA-N 375.472 2.977 0 50 GFAA O=C(CCc1cnccn1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356168713 CETVSDSLVJTXOP-JOCHJYFZSA-N 378.476 2.593 0 50 GFAA CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)NCCCOC2CCOCC2)C1 225433524 ZTVPWGLAFORBHW-MRXNPFEDSA-N 399.532 2.613 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)Nc1ccc(CC(=O)N2CCOCC2)cc1 115028119 QNEBAATYYNQFAV-NRFANRHFSA-N 394.471 2.731 0 50 GFAA C[C@H](Cc1ccsc1)NS(=O)(=O)c1cccc(C(=O)N2CCCC2)c1 67876765 ZJFLDNSLFLCHPR-CQSZACIVSA-N 378.519 2.894 0 50 GFAA CCCC(=O)Nc1ccc2c(c1)nc(CN1CCN(C(=O)OCC)CC1)n2C 20707402 FCYUTOJVFASUCQ-UHFFFAOYSA-N 387.484 2.586 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3ccccc3OCC)CC2)nc(C)n1 65362331 NPJHFBNARAAJLJ-UHFFFAOYSA-N 384.484 2.970 0 50 GFAA COc1cccc(CNC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c1OC 252490180 KLFXILPYBXKKEP-VOTSOKGWSA-N 379.457 2.584 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21)n1c(S)nnc1-c1cccs1 252515560 LPGQDESJQXVDIX-LPWJVIDDSA-N 378.523 2.930 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN[C@@H]1CCO[C@@]2(CCSC2)C1 151354247 HLSPSFNTYGPQFF-DOMZBBRYSA-N 379.448 2.814 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)N1CCC[C@](O)(CN(C)C)C1 72141883 AOLWVJHHAVZFOG-IBGZPJMESA-N 377.872 2.832 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)CC1 328630567 JNOQRTILIJZEIL-LEWJYISDSA-N 386.471 2.552 0 50 GFAA COc1cc(F)c(NC(=O)N2CCC[C@H]2C[C@H](O)c2cnn(C)c2)cc1F 363951426 WXRIKLWNLQUCJS-LRDDRELGSA-N 380.395 2.827 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cc(=O)[nH]c3ccccc23)CCC(=O)N1CC1CC1 71771601 KTXCFOFXTDLMLA-LJQANCHMSA-N 381.476 2.637 0 50 GFAA O=C(Nc1ccc(NC(=O)C2(n3cccn3)CCNCC2)cc1)c1cccs1 261978083 RIFCDNQEYVMXFG-UHFFFAOYSA-N 395.488 2.914 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)N[C@H]3CCO[C@H](C4CC4)C3)CC2)cc1 128983424 MJDBBESFAUKUEE-FPOVZHCZSA-N 387.524 2.870 0 50 GFAA COc1ccccc1NC(=O)c1cnn(C)c1C(=O)Nc1ccccc1OC 20616260 PEFSRQDCODEMED-UHFFFAOYSA-N 380.404 2.942 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2C[C@H](CO)[C@H](CN(C)C)C2)cc1F 91974341 IHHOFNSXYVZREW-WOJBJXKFSA-N 384.495 2.967 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2c(Cl)cnn2C)C3)cc1 95385892 WLYWLBGZHFWXNT-JKSUJKDBSA-N 388.899 2.819 0 50 GFAA CN(Cc1ccccc1)c1ncc2c(n1)CC(C)(C)C[C@@H]2NC(=O)C(C)(C)N 91305961 UODZZNJOVITTJC-KRWDZBQOSA-N 381.524 2.980 0 50 GFAA O=C(Nc1ccnn1C1CCCCC1)N1CCC[C@@H](CN2CCOCC2)C1 96162356 JOYLVJWJXUYIKN-KRWDZBQOSA-N 375.517 2.964 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@@H](C)CNC(=O)Nc2cccn3cnnc23)n1 96166502 ABQWVJCJFXXFIP-JTQLQIEISA-N 381.362 2.711 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)c1C 91877141 ULYAJEXXSJYAGL-UHFFFAOYSA-N 380.448 2.873 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@@H]1CCS(=O)(=O)C1)c1cccs1 334157924 MTMGPVIQYABMIA-CQSZACIVSA-N 387.486 2.645 0 50 GFAA O=C(CCC(F)(F)F)N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1 91650329 VVUUWLWOCHDIQY-UHFFFAOYSA-N 386.418 2.526 0 50 GFAA Cc1ccc(CN2CCN(Cc3nnc(-c4cccnc4)o3)[C@H](C)C2=O)cc1 244811740 SKHKHOGOSODMIX-MRXNPFEDSA-N 377.448 2.673 0 50 GFAA Cc1ccc(CCC(=O)N[C@H]2CC[C@@H](n3cc(C(=O)NC4CC4)nn3)CC2)cc1 247855219 CKEGMIHSZWRVKH-IZAXUBKRSA-N 395.507 2.711 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N(C)Cc1cc(C(=O)O)c(C)o1 299749036 IXYXWUXZLZNXFP-IBGZPJMESA-N 384.432 2.781 0 50 GFAA Cc1cccc(CC2(O)CCN(S(=O)(=O)c3cc(C(=O)O)cs3)CC2)c1 906964541 MRHITUOOCUYRIS-UHFFFAOYSA-N 395.502 2.513 0 50 GFAA NC(=O)c1cccc(CN(Cc2ccccc2)C(=O)[C@@H](F)C2CCNCC2)c1 1875292158 YQUHRZYNGPVFQA-FQEVSTJZSA-N 383.467 2.652 0 50 GFAA C[C@H]1CCNC(=O)[C@H]1CN1CCC(=O)N(CCc2cc3ccccc3s2)C1=O 1875299045 WPYABGMXTGKGJQ-YOEHRIQHSA-N 399.516 2.870 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCC[C@H](CN(C)C(=O)c4cocn4)C3)n[nH]2)o1 1875341766 HABOCQXZUWZSED-CQSZACIVSA-N 397.435 2.591 0 50 GFAA CS(=O)(=O)[C@H]1CC[C@H](NC(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320344 PQJPZHIIKAAFBW-RYUDHWBXSA-N 376.400 2.673 0 50 GFAA CCc1nc2cc(NC(=O)[C@H](c3ccccc3)n3cnnn3)ccc2n1CC 952872120 KEJIVCFHMMHGNT-IBGZPJMESA-N 375.436 2.833 0 50 GFAA COc1cccc(CN2CC[C@H](N3CCCC3)[C@H](CCC(=O)O)C2)c1OC 1076137614 ADRHKSMYJHDUOB-AEFFLSMTSA-N 376.497 2.855 0 50 GFAA CCOc1cccc(S(=O)(=O)N2CCC(O)(Cc3ccccc3F)CC2)c1 1339919625 BLJWYMHHTLOKTF-UHFFFAOYSA-N 393.480 2.983 0 50 GFAA COc1cc[nH]c(=O)c1C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1 170610217 PHEXJPCCYOYOHJ-UHFFFAOYSA-N 382.376 2.551 0 50 GFAA Cc1nn(C)cc1[C@@H](C)NC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 171859080 PSLPMZJFQSDKJV-CQSZACIVSA-N 388.516 2.606 0 50 GFAA O=C(CN1CCCCC1=O)NC[C@@H](c1ccccc1)N1CCc2sccc2C1 192567397 OPHRGUAIQKCVRP-IBGZPJMESA-N 397.544 2.976 0 50 GFAA CCCn1ncc(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)c1C 1529119518 JFXWMWLBVLVRPV-NHCUHLMSSA-N 389.496 2.553 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)c1ccc(Cl)cc1 632209 CAPOMEGYBKPODQ-UHFFFAOYSA-N 378.881 2.691 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 1128978 YJQWCKFPMYMHFS-LBPRGKRZSA-N 376.434 2.744 0 50 GFAA O=C(c1ccc[nH]1)N1C[C@H]2CN(Cc3cc[nH]n3)C[C@]2(CCc2ccccc2)C1 1772804575 ATIHXWWXSYXZTD-AUSIDOKSSA-N 389.503 2.945 0 50 GFAA COCCC(=O)Nc1ccc2c(c1)CN(C(=O)Nc1ccc3c(c1)OCO3)CC2 12076377 NBCUHKINPYAANR-UHFFFAOYSA-N 397.431 2.981 0 50 GFAA O=C(CCC1CCN(C(=O)CCc2cccs2)CC1)NC[C@@H]1CCCO1 12196025 HYEPSKUHHCNVKR-KRWDZBQOSA-N 378.538 2.995 0 50 GFAA C[C@@H]1CN(c2ccccc2)CCN1C(=O)c1cn(Cc2ccc(F)cc2)nn1 12203421 AUZHPQBCIDVRKJ-MRXNPFEDSA-N 379.439 2.816 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)c1ccc(OC2CCN(C)CC2)c(OC)c1 12441034 KXMIQUZYMHERTH-UHFFFAOYSA-N 386.496 2.564 0 50 GFAA COc1cccc(CCNC(=O)CCc2nnc(COc3ccccc3)o2)c1 12597631 QVIDXJCZVGGZDT-UHFFFAOYSA-N 381.432 2.949 0 50 GFAA CNC(=O)c1nn(CC2CCCCC2)c2c1C[C@H](NCCOC(C)C)CC2 14531969 SZZQGHBYIXFYJR-QGZVFWFLSA-N 376.545 2.695 0 50 GFAA Cc1ccc(C2=NOC3(CCN(C(=O)COc4ccc(F)cc4)CC3)N2)cc1 169754976 MBGDXYBRECEFJC-UHFFFAOYSA-N 383.423 2.813 0 50 GFAA COc1ccc(CNC(=S)NC(=O)c2cncc(Br)c2)cc1 1004492 VDFJAPYZXPDLMB-UHFFFAOYSA-N 380.267 2.657 0 50 GFAA O=C(c1cn2c(n1)CCNCC2)N1CCC[C@H](c2nc3ccccc3s2)C1 1857736744 UBLVULZJLLGMPB-AWEZNQCLSA-N 381.505 2.658 0 50 GFAA Cc1cc(S(=O)(=O)Nc2cc(C)n(CC(F)(F)F)n2)ccc1C(=O)O 416944261 BGPFMSAVGPCUSK-UHFFFAOYSA-N 377.344 2.561 0 50 GFAA O=C(CCCNC(=O)C1CC1)N[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)OCc1ccccc1 241231200 KSZKONQNRCZRGW-FMWKFLBASA-N 398.503 2.567 0 50 GFAA COc1ccc(C(=O)N2CCCC[C@@H]2CCn2cc(C(=O)NC(C)C)nn2)cc1 19809862 ASLIAIVMCSIISY-QGZVFWFLSA-N 399.495 2.510 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cnc3c(c2)COCC3)(c2ccccc2)CC1 847673828 UTPYHZYKZNXFQF-UHFFFAOYSA-N 391.471 2.839 0 50 GFAA COc1ccc(-c2nnn(CC(=O)Nc3ccc(OC(F)(F)F)cc3)n2)cc1 720577 PWNBLULLOCXAFY-UHFFFAOYSA-N 393.325 2.886 0 50 GFAA CC1CCN([C@@H]2CC(=O)N(c3ccc(I)cc3)C2=O)CC1 811160 CKOJXPDTAMPVJN-CQSZACIVSA-N 398.244 2.655 0 50 GFAA Cc1cc(C(=O)N[C@@H](CNC(=O)c2cc3ncccn3n2)C2CCCC2)oc1C 2325787032 XNOVDZBBPCGSNB-KRWDZBQOSA-N 395.463 2.658 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c2c(C(=O)OC)c(Cl)cc(C(=O)OC)c12 820727 KZZQHBQCVOWSTC-UHFFFAOYSA-N 394.763 2.640 0 50 GFAA CCOCCn1nc(CC(C)C)nc1-c1ccc2nnc([C@@H](O)C(C)C)n2c1 2356145154 DGLJSZDXNRPDCF-SFHVURJKSA-N 386.500 2.912 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3cc[nH]c(=N)c3)C2)c2cccc(=O)n21 2356157252 HNHIAPMKQYCFBW-AOIWGVFYSA-N 380.492 2.893 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)Nc1ccc(-n2ccc(C(=O)O)n2)cc1 225460854 JRYLUSSJPJGBFU-UHFFFAOYSA-N 388.383 2.524 0 50 GFAA O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1cc(=O)c2ccccc2o1 28289759 VXTQVGKNKUPQDO-GOSISDBHSA-N 378.428 2.596 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)c1cccc3ncccc13)CC2 115290987 GQNPVXUGKAGZSA-UHFFFAOYSA-N 381.457 2.688 0 50 GFAA Cc1nc([C@H](C)NC(=O)c2cc(COc3ccc(F)cc3Cl)on2)n[nH]1 67821621 YEALWUYKMSBAIK-QMMMGPOBSA-N 379.779 2.964 0 50 GFAA COc1ccc(NC(=O)C2CCC(N3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)CC2)cc1 101257480 YSUCNGMRMPFCKW-MCGQFKPXSA-N 394.471 3.000 0 50 GFAA COc1cc(CN2CCN(Cc3cccc(F)c3)C[C@@H]2CCO)cc(OC)c1 20913880 DCSAOWGOFPZAEE-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)cc1 67621208 CXULZIHTRLWGKS-UHFFFAOYSA-N 379.508 2.910 0 50 GFAA CC(C)c1cc(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)nc(N)n1 1506418339 QKJGRZXWNZMRMO-UHFFFAOYSA-N 379.508 2.845 0 50 GFAA C[C@@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)[C@H]3CC(=O)N(C4CC4)C3)cc2)C1 230169247 WYMCGQXZFBZLBA-HLIPFELVSA-N 383.536 2.792 0 50 GFAA CS[C@@H]1CN(C(=O)c2ccc(NC(=O)[C@@H]3C[C@H]3C)cc2)C[C@H]1N1CCCC1 252487245 UWLKEOOALBEPSH-UTRMSSBJSA-N 387.549 2.933 0 50 GFAA Cc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1ccc(OC2CCCC2)cc1 328611817 MSSOQLAPFHXBHP-QGZVFWFLSA-N 376.482 2.721 0 50 GFAA CC(C)N1C[C@@H](Nc2nc3ccccc3nc2N2C[C@@H](C)O[C@H](C)C2)CC1=O 252517637 NPGYZSSTAONNLL-OAGGEKHMSA-N 383.496 2.665 0 50 GFAA CC(C)CC(=O)Nc1ccc(C(=O)N2CCC[C@@H]2C(=O)NC2CC2)cc1F 172743033 GJHQZLNVKJBQLO-QGZVFWFLSA-N 375.444 2.694 0 50 GFAA COC1(CNC(=O)Nc2cc(F)ccc2N2CCCN(C(C)=O)CC2)CCC1 363945088 JLKHHZNCOVJKQW-UHFFFAOYSA-N 392.475 2.575 0 50 GFAA COc1ccccc1N1CCN(c2ncccc2CNC(=O)c2ccco2)CC1 39362794 CVJDPVCHKDZKFC-UHFFFAOYSA-N 392.459 2.940 0 50 GFAA CNC(=O)c1ccc(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)cc1 237221785 IEZQXHZATSCFFZ-IAGOWNOFSA-N 395.503 2.585 0 50 GFAA CC1(C)CN(CC2(CN3CC(C)(C)[C@@H]3[C@@H]3CCCO3)COC2)[C@@H]1[C@@H]1CCCO1 368076387 VCNOIJRLNLJAHM-LWYYNNOASA-N 392.584 2.782 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1 378101360 PWVKHKQSWICFSB-NRFANRHFSA-N 377.504 2.984 0 50 GFAA C[C@H](NC(=O)CSc1nnc([C@@H](O)c2ccccc2)n1C)c1ccccc1 30953052 IRVFNKDIZOHQER-KSSFIOAISA-N 382.489 2.866 0 50 GFAA Cc1nnc([C@@H]2CN(C(=O)c3csc(Cc4ccccc4F)n3)CCO2)o1 376911133 LSIYOVYWCBSUHF-HNNXBMFYSA-N 388.424 2.778 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)CN2CCC[C@H]2Cc2ccc(OC)cc2)C1 241774212 RNXYBNNVFFFFMD-OALUTQOASA-N 388.508 2.504 0 50 GFAA COc1ccccc1N1CC[C@@H](NS(=O)(=O)c2cnc3ccccc3c2)C1 242038537 VLWGRILEWXKSQP-MRXNPFEDSA-N 383.473 2.801 0 50 GFAA COc1cccc2ccc(N3CCC[C@]4(CCC(=O)N(CCCO)C4)C3)nc12 82121027 DYYSKPDBLWOZJY-QFIPXVFZSA-N 383.492 2.835 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1ccc(C(=O)O)c(C)n1 263359979 TWNDQMCMHCMICG-QGZVFWFLSA-N 397.431 2.649 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@@]2(CCC(=O)N(Cc3ccncc3)C2)C1 82106733 HWFAGCKKGUQCDK-HSZRJFAPSA-N 392.503 2.841 0 50 GFAA O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1CCn1cccn1 426612768 ZZSNMVYXUWWQSG-QGZVFWFLSA-N 379.468 2.823 0 50 GFAA O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 239173579 OFDYCTCARALERY-SLFVNDPXSA-N 390.439 2.678 0 50 GFAA COCCN1C[C@]2(CCCN(Cc3nnc(-c4ccccc4)o3)C2)CCC1=O 91780956 KOCYPBOWBAXBMQ-OAQYLSRUSA-N 384.480 2.588 0 50 GFAA CC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(C)c(Cl)c1)CC2 91351016 QBKWQSHLFAKLNY-UHFFFAOYSA-N 386.883 2.908 0 50 GFAA Cn1c(CN2CCCCC2)nnc1C1CCN(C(=O)c2ccc(O)cc2)CC1 96150176 SBZINSIWSWXNEZ-UHFFFAOYSA-N 383.496 2.526 0 50 GFAA Cc1c(CC(=O)N(C)C[C@H](C)O)c2c(n1Cc1ccccc1F)CCCC2=O 95527630 DPHYNHPVPIGHBC-AWEZNQCLSA-N 386.467 2.885 0 50 GFAA Cc1nc(CN2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n[nH]1 95528276 AARYUPVAOGYIEH-UHFFFAOYSA-N 383.496 2.783 0 50 GFAA COc1coc(CN2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)cc1=O 91321842 KYGPFGVPLYLHCH-QFBILLFUSA-N 380.488 2.712 0 50 GFAA COCCCN1CC2(CCN(Cc3cnc(CC4CCCC4)[nH]3)CC2)CC1=O 95386368 JXASPPDKXNCDCD-UHFFFAOYSA-N 388.556 2.993 0 50 GFAA CCCCn1ccnc1[C@H]1CCCN(C(=O)c2cccc(OCC(N)=O)c2)C1 95502640 KRYBJQZNQAJUDI-KRWDZBQOSA-N 384.480 2.567 0 50 GFAA Cc1ncccc1C(=O)N1CCC2(CCN(Cc3ccccn3)CC2)[C@H](CO)C1 97717456 WMHSRMGEIYRAFH-IBGZPJMESA-N 394.519 2.522 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)c1 299338359 FTDAEVZVCXJBFP-VQISRLSMSA-N 385.869 2.601 0 50 GFAA O=C(Cn1cc(-c2ccc(Cl)cc2)ncc1=O)N[C@@H](C(=O)O)c1ccccc1 252499846 SGHPGJOXXKVAPN-LJQANCHMSA-N 397.818 2.506 0 50 GFAA Cn1cccc1CNC(=O)CC[C@@H]1N=C(O)N(c2cccc3ccccc23)C1=O 252494906 OHQQOYKSXDGSTA-SFHVURJKSA-N 390.443 2.904 0 50 GFAA CCn1cc(-c2ccc(C(=O)N3CCC[C@@H](CN4CCOCC4)C3)cc2)cn1 534590840 JQBJQCUOMBTSPW-SFHVURJKSA-N 382.508 2.754 0 50 GFAA CCC(=O)N1CCC2(CC1)CN(C(=O)N[C@@H](C)c1ccc(F)cc1)CCO2 822529373 FTNFFIXXDDYDDD-HNNXBMFYSA-N 377.460 2.700 0 50 GFAA O=C(NC[C@@H](O)c1cccc(O)c1)NC1CCN(Cc2ccccc2F)CC1 584895160 RCERIWXFRJHNOU-HXUWFJFHSA-N 387.455 2.529 0 50 GFAA CONC(=O)C1CCN(C(=O)N[C@H](C)c2ncc(-c3ccc(F)cc3)o2)CC1 1875300808 RHBBRQPYYHZWGM-GFCCVEGCSA-N 390.415 2.641 0 50 GFAA CC(=O)N1CCC2(CC1)CC(=O)c1ccc(OC[C@H]3C[N@@]3CC3CC3)cc1O2 1875381614 BDXCQIMAJUUFTI-MZNJEOGPSA-N 384.476 2.506 0 50 GFAA Cc1nc(Cn2cc(C(=O)NC[C@H](C)c3c(Cl)cccc3Cl)nn2)no1 278753313 QHAYCIHJAKRPID-VIFPVBQESA-N 395.250 2.858 0 50 GFAA CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2O)cc1 170604757 HHGBUGUZGVXVLZ-UHFFFAOYSA-N 389.477 2.993 0 50 GFAA C[C@H]1CCCCCN1C(=O)NCc1ccc(CN2C(=O)NC(C)(C)C2=O)cc1 170626948 XYEJLTUTSUPUDB-HNNXBMFYSA-N 386.496 2.991 0 50 GFAA O=S(=O)(c1ccc(CN[C@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1)N1CCCC1 194002426 NSDRNHYXFLQXIC-HSALFYBXSA-N 390.549 2.908 0 50 GFAA COc1cc(C)c(S(=O)(=O)N[C@H]2COC[C@H]2Cc2ccncc2)c(C)c1C 1704298532 IRUAOOQLELZMTQ-MSOLQXFVSA-N 390.505 2.551 0 50 GFAA CC(=O)NC[C@H]1CCCN(c2cc(Sc3ccc(F)cc3)nc(N)n2)C1 1704309985 VCEZDWGNKPAAAP-CYBMUJFWSA-N 375.473 2.702 0 50 GFAA C[C@H](C(=O)N1CCC(CCC(=O)N(C)Cc2ccccc2)CC1)n1cncn1 12052623 ZBGGEKBMEDMTMC-QGZVFWFLSA-N 383.496 2.517 0 50 GFAA c1cnc(Oc2ccc(CNCc3cccnc3N3CCOCC3)cc2)nc1 12386952 KOCBZYJQHXOQLR-UHFFFAOYSA-N 377.448 2.790 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)N[C@H]3C=CS(=O)(=O)C3)cs2)cc1 12389197 NWESILYXZCXAES-HNNXBMFYSA-N 376.503 2.903 0 50 GFAA Cn1cc(CCNC(=O)CCc2nnc(CCCCc3ccccc3)o2)cn1 12455424 MXHHPYZHMMSFJX-UHFFFAOYSA-N 381.480 2.660 0 50 GFAA CSc1ccc(CN2CCC[C@@H]2C(=O)Nc2cccc(-n3cnnn3)c2)cc1 12588114 AWOYXRGJPJVKAA-LJQANCHMSA-N 394.504 2.987 0 50 GFAA COCCCNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc(F)cc2)CN(CC(C)C)C1 14746150 PIVNQZZISVKFKY-DLBZAZTESA-N 393.503 2.511 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)N3CCCC[C@@H]3CCO)o2)c1 14963982 BILJEHLIFIYYJO-QGZVFWFLSA-N 387.480 2.560 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1ccccc1Cl)CC2)c1ccco1 19852103 QKZRPNORUYHHFK-UHFFFAOYSA-N 399.882 2.555 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)[C@@H](C)Oc4ccccc4)C3)nn2)n1 169778141 WBPXIDCNIUKTFL-CABCVRRESA-N 396.451 2.692 0 50 GFAA CN=[S@@]1(=O)CCC[C@]2(CCCN2C(=O)c2cc(OC)c(C)c(OC)c2)C1 1857527974 NTBOQPCTXDZHAK-NIYFSFCBSA-N 380.510 2.879 0 50 GFAA O=C1CCOC2(CCN(C(=O)C3(c4ccc(Cl)cc4)CCC3)CC2)CN1 1857710976 FMOLCQVDOLTQOC-UHFFFAOYSA-N 376.884 2.659 0 50 GFAA O=C1CC2(CCN(C(=O)CCc3ccc(-c4cccs4)o3)CC2)OCCN1 1857681840 CALLJDJRKAINLL-UHFFFAOYSA-N 388.489 2.838 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)NCc3csc(-c4ccccc4)n3)CC2=O)s1 1857700339 UHBVCSFZSCFPMQ-CYBMUJFWSA-N 399.501 2.639 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1c(Cl)cncc1Cl)C[C@H]2O 1857718931 ANBRQORWLWABLF-UTRMSSBJSA-N 379.287 2.957 0 50 GFAA O=C(NCCCc1nc2ccccc2s1)[C@H]1CC(=O)N(c2nccs2)C1 1857739866 WQAVUHYEEQCXGW-LBPRGKRZSA-N 386.502 2.855 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CC[C@](C)(O)[C@H](Cc3ccccc3)C2)c1C 211432524 CGNSJINGJGAXAY-KNQAVFIVSA-N 383.492 2.545 0 50 GFAA CC1(C)CN(Cc2cnn([C@]3(C)CCS(=O)(=O)C3)c2)CC[C@H]1C(F)(F)F 408349894 VUTWXYKQKCVGMH-GDBMZVCRSA-N 393.475 2.827 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cnc(-c4ccncc4)nc3)C1)CC2 1704299768 SIMNGHOGJLMMQN-QFIPXVFZSA-N 386.459 2.757 0 50 GFAA O=C(c1cc(O)no1)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100534706 UZQVNIIOMGQEQT-IBGZPJMESA-N 393.443 2.958 0 50 GFAA COc1ccc(-c2nc3c(c4cc(OC)c(OC)cc24)C(=O)NC3=O)cc1OC 689998 SZMVTJZXKGXIEJ-UHFFFAOYSA-N 394.383 2.820 0 50 GFAA O=C(OCCc1cn2ccccc2n1)c1cccc(NS(=O)(=O)C2CC2)c1 2325774766 QLTJQGJHGIZQCS-UHFFFAOYSA-N 385.445 2.638 0 50 GFAA O=C([C@H]1[C@@H]2[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]1[C@@H]5C[C@H]42)N1CCC[C@@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 2325826688 JSMMIBWSEBKMQS-OCXCMLMQSA-N 380.532 2.630 0 50 GFAA O=C(NCC1(N2CCSCC2)CCCCC1)c1ccc(-n2ccnn2)cc1 125527917 IVRHNZBJIXDGKE-UHFFFAOYSA-N 385.537 2.749 0 50 GFAA CS(=O)(=O)c1ccc2nc(NS(=O)(=O)c3ccc(F)cc3)sc2c1 831818 UXGAHMBSAWQTPM-UHFFFAOYSA-N 386.451 2.640 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC[C@@]12CCCN(C)C2=O 2356148518 CFQGZCIGCSYMQN-JOCHJYFZSA-N 380.492 2.645 0 50 GFAA O=C(N[C@H](O)C(Cl)(Cl)Cl)c1cccc(I)c1 3122221 UDACDWUYMLWHPQ-MRVPVSSYSA-N 394.423 2.710 0 50 GFAA C[C@H](Sc1nnc(-c2cccnc2)n1C)C(=O)Nc1ccc2c(c1)OCO2 9304384 WYSNQXWGHIPBCD-NSHDSACASA-N 383.433 2.725 0 50 GFAA O=C(c1ccccc1)[C@H]1CCCN(C2CCN(C(=O)c3cnccn3)CC2)C1 67787038 AZZKQRQNIZSCMG-SFHVURJKSA-N 378.476 2.676 0 50 GFAA CC(=O)N[C@H]1CCN(C(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)C1 67786529 WYWQCNXKRMRTOY-ZDUSSCGKSA-N 397.353 2.623 0 50 GFAA CC1=C(C(=O)N(C)Cc2nc3ccc(C)cc3[nH]2)[C@@H](c2ccoc2)NC(=O)N1 67755219 GAOMZWNPWAABFA-GOSISDBHSA-N 379.420 2.751 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)Cc3ccc(Cl)cc3)nn2)n1 67613587 HDFPRZRDDZAODE-UHFFFAOYSA-N 384.871 2.703 0 50 GFAA COC(=O)c1c(NC(=S)NCc2cnn(C)c2)sc2c1CC[C@H](C)C2 6202342 ARGRHKMQHHZIMR-JTQLQIEISA-N 378.523 2.880 0 50 GFAA O=Cc1ccc(OCC(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1 123400191 RUQURBNUWJXNAL-QGZVFWFLSA-N 382.464 2.602 0 50 GFAA CN(C(=O)Cn1cnc(-c2ccccc2)n1)[C@H]1CCCN(c2ccccc2)C1=O 152673978 MMXVCXCZEGKMBC-IBGZPJMESA-N 389.459 2.599 0 50 GFAA C[C@H](C(=O)N(C)C1CCCCC1)[S@@](=O)Cc1nc(O)cc(C(F)(F)F)n1 155291680 CBFQDWNDMKVRSA-AFNXNYLOSA-N 393.431 2.629 0 50 GFAA O=C(CCC1CCN(c2cnccn2)CC1)N[C@H]1CCN(Cc2ccccc2)C1 76949839 OXIUOCQPLILJHV-NRFANRHFSA-N 393.535 2.864 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)C1 237391437 QVWGOHJIJMSREM-LJQANCHMSA-N 382.445 2.933 0 50 GFAA O=C(OC[C@H]1CCCCN1Cc1cc2ccccc2nc1O)N1CCOCC1 375791989 ZNSLIULDDZFWRS-GOSISDBHSA-N 385.464 2.764 0 50 GFAA CC(C)C[C@@H](Nc1nc(-c2ccncc2)nc2c1cnn2C)c1ncnn1C 72133206 JKPXUTNFNDFVNC-OAHLLOKOSA-N 377.456 2.753 0 50 GFAA CCN(CC)[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccco2)C1 174160147 BAHNZMOCXBRWTR-WOJBJXKFSA-N 395.503 2.789 0 50 GFAA COc1ccc(OC[C@@H]2CCCN(C(=O)CN(C)Cc3ccncc3)C2)cc1 77407302 GVCYTBAVBULWQR-LJQANCHMSA-N 383.492 2.840 0 50 GFAA CN(CC(=O)N1CCC[C@@H](Cc2nc3ccccc3[nH]2)C1)Cc1ccncc1 82097924 FOUMVZNGOCULLD-SFHVURJKSA-N 377.492 2.871 0 50 GFAA Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCc2c(cccc2N2CCOC2=O)C1 176352662 JKJCMEHCKMIOBU-CYBMUJFWSA-N 383.452 2.514 0 50 GFAA Cc1nc(CN2CCC(C(=O)NC[C@](C)(O)c3cccs3)CC2)cs1 177914874 COSXAACEPBJKHT-SFHVURJKSA-N 379.551 2.749 0 50 GFAA N=c1cc[nH]cc1-c1cccc(C(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)c1 426506652 LUEPLHLNAUJXAS-SFHVURJKSA-N 378.476 2.636 0 50 GFAA Cn1cc(CCC(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)O)C2)cn1 426465513 VMYZAKXOANHEON-IPJJNNNSSA-N 381.476 2.850 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(Cc2cscn2)C3=O)c(F)c1 95512250 IIYUGVTWNKKRCE-GOEBONIOSA-N 375.469 2.914 0 50 GFAA CN1CCN(C[C@@H]2CN(Cc3ccccc3-c3ccccc3)C[C@@H]2CO)CC1 95366732 AZXDSAWVGJSAEM-DHIUTWEWSA-N 379.548 2.641 0 50 GFAA Cc1cc(C)c2c(NCCN3CCN(Cc4ccccc4)CC3)ncnc2n1 95372995 KQZAFJSOLRVELR-UHFFFAOYSA-N 376.508 2.871 0 50 GFAA O=C(NCc1ccccn1)c1cccc(OC2CCN(c3cnccn3)CC2)c1 96150139 FSGGHYZJWNTQHL-UHFFFAOYSA-N 389.459 2.849 0 50 GFAA Cc1nc2ccc(C(=O)NCCS(=O)(=O)c3ccc(F)cc3)cc2nc1C 95362379 XGLOTFQFOCCOGF-UHFFFAOYSA-N 387.436 2.589 0 50 GFAA O=C(N[C@@H](c1ccccn1)[C@H]1C[C@H](O)C1)c1cnc(Nc2ccccc2)nc1 244795555 RIMMQLLQFBZJJM-LSBZLQRGSA-N 375.432 2.857 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1cc(Cl)cn1C)CC2 299440207 ZYMLTCFHQRJSIV-CQSZACIVSA-N 392.839 2.910 0 50 GFAA Cc1[nH]nc(C(C)C)c1-c1ccc(C(=O)N2CC[C@@H](CN(C)C)[C@H](O)C2)cc1 534578243 AFFJYIKLFDBEGI-RBUKOAKNSA-N 384.524 2.893 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)Cc1c(C)nc(O)nc1O 1940197719 LIALGARGZGHTGW-UHFFFAOYSA-N 387.827 2.584 0 50 GFAA Cc1c(NC(=O)c2ccc(N3CCN(C)CC3)cc2)cccc1-c1nncn1C 823792769 RNJKXTQLTZOMJT-UHFFFAOYSA-N 390.491 2.795 0 50 GFAA O=C([C@H](F)CN(Cc1ccccc1)Cc1ccccc1)N1CCn2cnnc2C1 864097082 ZDTKPMPAKIKXFO-HXUWFJFHSA-N 393.466 2.661 0 50 GFAA CN1CCN(c2ncc(C(=O)Nc3c[nH]nc3-c3ccccc3F)s2)CC1 1875252612 TYENHJKEISUTEC-UHFFFAOYSA-N 386.456 2.676 0 50 GFAA Cc1nc(COc2ccccc2C(=O)Nc2cnn([C@H]3CCOC3)c2C)no1 1875268334 IJGXUYWDYZNAJT-AWEZNQCLSA-N 383.408 2.676 0 50 GFAA Cc1ncncc1C(=O)N1CCC2(CC1)C[C@@H](O)c1nn(C3CCCC3)cc1O2 1875394318 FGFXYOGQDDUECX-QGZVFWFLSA-N 397.479 2.588 0 50 GFAA Cc1cc(CC(C)C)nc(N2CC[C@@H](NCc3nc(-c4ccccn4)no3)C2)n1 952865036 NRVRNWPZSHWUTN-MRXNPFEDSA-N 393.495 2.797 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CC1 952985000 DTTRBUHQKROHAB-UHFFFAOYSA-N 388.489 2.815 0 50 GFAA Cc1ccnc(NNC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1 170659203 XGSIQNOMWOOXNZ-UHFFFAOYSA-N 388.493 2.712 0 50 GFAA COc1ccc([C@H](CN2C(=O)[C@H]3Cc4ccccc4CN3C2=O)N(C)C)cc1 170613693 USOXKHBRWBJRLW-UXHICEINSA-N 379.460 2.687 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)[C@H]1c1ccccc1 171851953 YRNCZPMYJUSSIA-IFMALSPDSA-N 393.487 2.651 0 50 GFAA CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1 195460263 FHCCNHRAVVSLSR-MJGOQNOKSA-N 399.535 2.692 0 50 GFAA Cc1cc(N2CCC(CNC(=O)c3cc(-c4ccccc4)on3)CC2)nc(N)n1 1506410551 VKQIRAXXWOGARI-UHFFFAOYSA-N 392.463 2.669 0 50 GFAA Cc1cccc(CC(=O)N2C[C@H]3CN(CCO)C[C@@]3(CCc3ccccc3)C2)c1 1772710520 SETGIZVRVOMYII-NOZRDPDXSA-N 392.543 2.923 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN2Cc2cnn(C)c2C)cc1 11819642 ZMIBCSYNABSSKI-HXUWFJFHSA-N 378.480 2.826 0 50 GFAA Cc1cccnc1CN(C)C(=O)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 11821594 BMJPMMDQCMZIMU-SFHVURJKSA-N 383.467 2.969 0 50 GFAA COc1cc(=O)n2c(c1C(=O)N[C@H](C)c1ccco1)CCN(CC=C(C)C)CC2 11995973 PKZDVPRXSNFPHB-MRXNPFEDSA-N 399.491 2.765 0 50 GFAA CCCn1c(C)c(CC(=O)N2CCN(C(C)=O)CC2)c2c1CC(C)(C)CC2=O 12073007 IWZPNJZVSBOFRV-UHFFFAOYSA-N 387.524 2.595 0 50 GFAA Cc1ccc(-c2n[nH]cc2CN2CCC(C(N)=O)(N3CCCCC3)CC2)cc1C 12446586 IRBOTPUNVSTQIH-UHFFFAOYSA-N 395.551 2.999 0 50 GFAA O=C(NC1CCCC1)C1CCN(S(=O)(=O)CCCc2ccccc2)CC1 13676755 UIKUSXAGTMDDAP-UHFFFAOYSA-N 378.538 2.720 0 50 GFAA COc1ccc(C)cc1N(CC(=O)Nc1ccc(F)c(F)c1)S(C)(=O)=O 2856189 VTRLWUZJCCXPCI-UHFFFAOYSA-N 384.404 2.687 0 50 GFAA Cn1nc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)cc1C1CC1 1857673301 RSLNDFGRTBJDKX-QFIPXVFZSA-N 393.491 2.791 0 50 GFAA CN1CCOC2(CCN(C(=O)c3ccc(N4CCCC4)c(Cl)c3)CC2)C1 1857688594 RUZHEYOUOWUNSD-UHFFFAOYSA-N 377.916 2.877 0 50 GFAA Cc1cc(C)cc(CN2CC3(CCN(c4nncs4)CC3)OCCC2=O)c1 1857724213 PZIQGUPNTLSMMT-UHFFFAOYSA-N 386.521 2.943 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)C2(c3cccc(Br)c3)CCOCC2)C1 237639308 UYWMTSRUPUJRIL-KRWDZBQOSA-N 396.281 2.821 0 50 GFAA O=C1Cc2ccccc2N1CCNS(=O)(=O)Cc1ccccc1C(F)(F)F 113286381 AUWXGLZRZNYCGI-UHFFFAOYSA-N 398.406 2.714 0 50 GFAA COc1ccc(C2(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)CC3(CCC3)C2)cc1 370260190 GIYRSJDCAAERLP-INIZCTEOSA-N 377.506 2.543 0 50 GFAA O=C(Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc2c(c1)OCO2 1078465 WGYZABRDULXSDH-UHFFFAOYSA-N 391.309 2.726 0 50 GFAA CC(C)c1ccc(C[C@H](NC(=O)c2ccccc2)C(=O)N[C@@H](C)C(=O)O)cc1 4742766 MUBGUUXDHCFYLH-KXBFYZLASA-N 382.460 2.740 0 50 GFAA CC[C@@H](C)N(C)CCNC(=O)C(=O)N1CC[C@@H](c2cc(C)c(Cl)cc2O)C1 2325757205 VENSYVCLVVSEBS-HUUCEWRRSA-N 395.931 2.516 0 50 GFAA O=C1NCC2(CC2)C(=O)N1C[C@H]1CCN(c2cccc(Br)c2)C1 2325770386 KXTAQDFOTNRFHH-LBPRGKRZSA-N 378.270 2.607 0 50 GFAA NC(=O)N1CC[C@@H](NC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)C1 114366098 NFUYBRMPIBGAKG-OAHLLOKOSA-N 378.407 2.924 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCN[C@@H](c2ccccc2)C1 2356158253 ZXYSCSXHMMRYBD-GOSISDBHSA-N 397.544 2.686 0 50 GFAA C[C@]12CC[C@H](O)C[C@H]1CC[C@@H]1[C@@H]2C[C@@H](O)[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@]12O 3982471 SHIBSTMRCDJXLN-KCZCNTNESA-N 390.520 2.575 0 50 GFAA biogenic,world Cc1ncc2c(c1-c1noc(-c3ccc[nH]3)n1)CCN(C(=O)c1ccon1)C2 20406952 UJLJMBBENJHDCK-UHFFFAOYSA-N 376.376 2.622 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@H](NCC(F)(F)F)C2 20706760 KIJVGRHAQICIHG-ZDUSSCGKSA-N 384.402 2.777 0 50 GFAA COc1ccc(-c2noc(CN3CCN(Cc4cccc(F)c4)C(=O)C3)n2)cc1 64151803 SCWUGECMCPRPRW-UHFFFAOYSA-N 396.422 2.729 0 50 GFAA O=C(CN1CCC[C@@H](c2nnc3ccccn23)C1)NCCc1ccc(Cl)cc1 172556473 KHMLAXIAFLNLMS-QGZVFWFLSA-N 397.910 2.921 0 50 GFAA Cc1cc(C(=O)NCc2ccnc(OCCN(C)C)c2)c2cnn(C(C)C)c2n1 124408332 JKWICSZSUBPMCH-UHFFFAOYSA-N 396.495 2.586 0 50 GFAA O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCC([C@H]2CCOC2)CC1 363754768 OREDMMFYRSCGDE-AWEZNQCLSA-N 391.411 2.869 0 50 GFAA O=S1(=O)CCN(Cc2nc3cc(Br)ccc3o2)[C@H](C2CC2)C1 333140742 YRKGPHBVRBZJSG-ZDUSSCGKSA-N 385.283 2.599 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)[C@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)n[nH]1 155859754 LKURDPHMCWAZIQ-BEMZLSERSA-N 398.551 2.973 0 50 GFAA COc1ccccc1N1CCN([C@H]2CCCN(c3ncnc4[nH]ccc34)C2)CC1 72158267 PWSTZYVYRZZNET-KRWDZBQOSA-N 392.507 2.758 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N3CCC[C@H](c4n[nH]cc4NC(C)=O)C3)c2c1 374836671 GYRHKZPISKIHMQ-AWEZNQCLSA-N 395.463 2.807 0 50 GFAA NC(=O)c1ccnc(N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)c1 72164906 MSPWDOCCHYWBPD-CDHQVMDDSA-N 384.430 2.525 0 50 GFAA CN(C)c1ncccc1CNC(=O)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 376581136 WNYAFTWGIZACMH-AABGKKOBSA-N 380.492 2.862 0 50 GFAA COc1cccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)c1 71775580 SORUCCAIKSHSGD-LJQANCHMSA-N 399.535 2.634 0 50 GFAA CC(C)c1ccc(N2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3CCSCC3)[C@H]4C2=O)cc1 77301467 VNMCLCOYUKYELV-WEMPKCCASA-N 398.528 2.672 0 50 GFAA C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1nccc(C(F)F)n1 288900818 URBKFGMJKGKVST-NSHDSACASA-N 391.426 2.950 0 50 GFAA CCCN1C[C@H](NC(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)CC1=O 97076310 HKSZIQZTPXMHAV-CYBMUJFWSA-N 380.876 2.611 0 50 GFAA Cc1c(CN2CC[C@@]3(O)CCN(C(=O)N4CCCC4)C[C@H]3C2)[nH]c2ccccc12 95379942 MTKXWTSDCHSMRR-WZONZLPQSA-N 396.535 2.951 0 50 GFAA O=C(C[C@@H]1C=CCC1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 95523030 MGTKMXPREZPSNZ-MRXNPFEDSA-N 382.508 2.769 0 50 GFAA CCn1ncc(C(=O)N2CCC3(CC2)c2[nH]cnc2CCN3CC(C)C)c1C 95505768 BLFAIVJMADPRRH-UHFFFAOYSA-N 384.528 2.580 0 50 GFAA O=C(CN1CCC(c2ccccc2)CC1)NCc1ccc(-n2cncn2)cc1 95365317 XZDLAMJJEPAZSA-UHFFFAOYSA-N 375.476 2.763 0 50 GFAA Cc1csc(CNC(=O)c2ccc3c(c2)[nH]c(=O)n3[C@H]2CC[C@H](O)CC2)n1 244787805 QDZSXTPPQMNSSD-HDJSIYSDSA-N 386.477 2.501 0 50 GFAA O=C(Cn1c(=O)[nH]c2ccccc21)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 185065951 MIESGSPBRMDBQN-UHFFFAOYSA-N 390.443 2.658 0 50 GFAA CCCC(=O)NCc1cc(NC(=O)Cc2cscn2)cc(C(=O)OC)c1 299769618 QSGHKVCFAHZASL-UHFFFAOYSA-N 375.450 2.527 0 50 GFAA c1cn2nc(N3CCN(Cc4cc(CN5CCCC5)cs4)CC3)ccc2n1 820414119 CSEZFNWJZNUYMV-UHFFFAOYSA-N 382.537 2.709 0 50 GFAA O=C(CCCc1nn[nH]n1)N[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 1875302638 ZWIDZAIOMKPGQD-LBPRGKRZSA-N 381.280 2.961 0 50 GFAA Cc1nc(-c2ccco2)cc(N2C[C@@H]3CCS(=O)(=O)[C@]3(C(F)(F)F)C2)n1 1875392555 IITMRRSABBWMER-XHDPSFHLSA-N 387.383 2.601 0 50 GFAA C[C@@H]1CC[C@@H](CN)N(C(=O)c2cnc3sc(Cc4ccccc4)cn3c2=O)C1 1875278036 URPYJTUQSINECQ-ZBFHGGJFSA-N 396.516 2.546 0 50 GFAA Cn1nc(CNC(=O)CN2CCOc3ccccc3C2)c2c(Cl)cccc21 952981884 VLGBXZBFSREENB-UHFFFAOYSA-N 384.867 2.738 0 50 GFAA Nc1nnc(SCC(=O)N(CCc2ccccc2)Cc2ccccn2)s1 952978731 RRULNMJTMUHBQO-UHFFFAOYSA-N 385.518 2.879 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccc1)C2 1565507005 HZJLKKGVCZSYOQ-MJGOQNOKSA-N 380.492 2.722 0 50 GFAA CC(=O)Nc1ccc(CN2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)cc1 1565525908 HUOGHZPLGCSVBW-RXVVDRJESA-N 378.476 2.777 0 50 GFAA CS(=O)(=O)c1cccc(Cl)c1CNc1cnn(Cc2cccnc2)c1 1320435255 QFMRTMOBNRQKTR-UHFFFAOYSA-N 376.869 2.995 0 50 GFAA Cc1ccc(CCC(=O)NCC(=O)N2CCC[C@]2(CO)Cc2ccccc2)cc1 170609954 LBQUUSZKRZGQAS-XMMPIXPASA-N 394.515 2.640 0 50 GFAA Cc1ccn(-c2ccccc2CNS(=O)(=O)CCc2ccc3c(c2)CCO3)n1 189737583 OLYKQAWRWTUWGV-UHFFFAOYSA-N 397.500 2.778 0 50 GFAA CCN1CCC[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(-c3cnco3)cc2)CC1 1704315654 AJPNNEIOEZKEQI-LJQANCHMSA-N 396.491 2.500 0 50 GFAA CC(=O)Nc1ccc2nc(CN3C[C@H](Cc4cc(C)no4)[C@@H](O)C3)ccc2c1 1615739018 DFZMKVNLADVJOL-KKSFZXQISA-N 380.448 2.525 0 50 GFAA Cc1nc(CC(=O)N2CCCN(Cc3ccccc3-n3cccn3)CC2)cs1 1772703462 XLTCVHYQCZHQIG-UHFFFAOYSA-N 395.532 2.914 0 50 GFAA Cc1cc(-c2nc(C3CCOCC3)nn2[C@H]2CCOC2)c2c(C)nn(C)c2n1 1772813697 PFZYQHDTFVCPRY-HNNXBMFYSA-N 382.468 2.699 0 50 GFAA C[C@@H](Cc1cc(C(=O)N2CCN(c3ncccn3)CC2)on1)c1ccccc1 12052984 WVKLMCTUWDPGLF-INIZCTEOSA-N 377.448 2.773 0 50 GFAA O=C(NCCc1nnc(SC[C@@H]2CCCO2)n1-c1ccccc1F)C1CC1 14995446 NOVRWHQVKGLMLU-AWEZNQCLSA-N 390.484 2.746 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)C4(c5ccccc5)CC4)nnc23)n1 169776001 CTIQEIJGOKMVLI-UHFFFAOYSA-N 388.431 2.690 0 50 GFAA Cc1cc(=O)oc2cc(NC(=S)N3CCN(C(=O)c4ccco4)CC3)ccc12 2858910 JWMSVXUNCRNUKU-UHFFFAOYSA-N 397.456 2.849 0 50 GFAA Cc1ccc(S(=O)(=O)NCc2ccccn2)cc1C(=O)NC1CCCCC1 4865781 IVCXDEZZSZIIMW-UHFFFAOYSA-N 387.505 2.931 0 50 GFAA COc1ccc(C2(CNC(=O)C(=O)NCc3ccccc3)CCCC2)cc1OC 4918070 LGYPKYCDNMYCPD-UHFFFAOYSA-N 396.487 2.948 0 50 GFAA Cc1noc([C@@H]2COCCN2C(=O)[C@@H]2C[C@@]23CCOc2ccc(Cl)cc23)n1 1857531751 WUJRGGQQMZSTTE-YZVOILCLSA-N 389.839 2.672 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N(C)Cc4nnc(C)o4)C3)nc2c1 1857673725 ZUJVGMKWJYUCFC-CQSZACIVSA-N 399.451 2.793 0 50 GFAA Cc1nc(NC2CC2)c2c(n1)C1(CC2)CCN(C(=O)c2c(C)c(C)nn2C)CC1 1857681688 CBRJPPWQVABGCV-UHFFFAOYSA-N 394.523 2.830 0 50 GFAA CN(C)C(=O)c1cccc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857732465 RJHXCKYDAMNECA-JOCHJYFZSA-N 393.491 2.641 0 50 GFAA CCCc1nnc(N2C[C@H](C(=O)NCc3nc4c(C)cccc4o3)CC2=O)s1 1857732972 PHKPVPBGTAOGJK-GFCCVEGCSA-N 399.476 2.610 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC(C2CCN(c3nncs3)CC2)CC1 1857733172 YHJDPPRCFWNQLX-UHFFFAOYSA-N 386.525 2.714 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)c4cccc(C)n4)[C@H]4CC[C@]3(C2)O4)nc1 1875242839 DYMBSZJEXHVOQV-ODULNIPZSA-N 378.476 2.507 0 50 GFAA Cc1cc2[nH]cc(C(=O)N3C[C@H](C(C)(C)C)O[C@H](c4ccccc4)C3)c(=O)n2n1 1875246969 IHBKIEASLQJJNF-ZWKOTPCHSA-N 394.475 2.959 0 50 GFAA COc1ccc2nc(NC(=O)[C@@H](C)N3C(=O)c4ccccc4C3=O)sc2c1 951198 SRKBSZAQLODGQE-SNVBAGLBSA-N 381.413 2.928 0 50 GFAA CC[C@@H](Sc1nc(=O)cc(N)n1-c1cccc(C)c1)C(=O)Nc1cc(C)on1 1143037 WLPRYRZXSWHYCR-CQSZACIVSA-N 399.476 2.929 0 50 GFAA Cc1cccc(C(=O)N2CCNC(=O)[C@@H]2CC(=O)Nc2cccc(Cl)c2)c1 2434391 JZHPSJSYQOAEHL-KRWDZBQOSA-N 385.851 2.618 0 50 GFAA Cc1ccc(CN2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 5016081 DZJRHAAVBYPCFU-FQEVSTJZSA-N 379.460 2.571 0 50 GFAA Cc1c(C(N)=O)sc2ncn(CC(=O)Nc3ccc(C(C)(C)C)cc3)c(=O)c12 5610332 HSDDSGVPXDMWLK-UHFFFAOYSA-N 398.488 2.802 0 50 GFAA COCCN(Cc1cc2ccc(C)cc2[nH]c1=O)S(=O)(=O)c1ccccc1 9449737 CCGLLKFSOINILC-UHFFFAOYSA-N 386.473 2.674 0 50 GFAA CO[C@@H](C(=O)Nc1ccnn1C1CCN(Cc2cc[nH]n2)CC1)c1ccccc1 11819653 FZWKNMYYXXROHT-HXUWFJFHSA-N 394.479 2.770 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccccc2F)C1)C(=O)CCN1CCCO1 12198911 RDOJQTRZDVSBIH-SFHVURJKSA-N 377.504 2.566 0 50 GFAA COc1ccc(OCc2nc(C(=O)NCc3cn4ccsc4n3)co2)cc1 12307190 CFBLRSFJGYXXAL-UHFFFAOYSA-N 384.417 2.901 0 50 GFAA C/C=C/COc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc2ccccc12 12343342 UYBFKRDMWPNZCC-SNAWJCMRSA-N 390.443 2.590 0 50 GFAA Cn1ccnc1SCCNC(=O)[C@@H]1CCC(=O)N(C2CCCCCC2)C1 12447140 ROTKEMNTRXUKKE-OAHLLOKOSA-N 378.542 2.590 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@@H](C(=O)c2ccc3c(c2)OCO3)C1 12589246 YTIGUIGTEFPQQT-QGZVFWFLSA-N 397.475 2.820 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(c4cnccn4)C3)C2=O)c1OC 12714128 OMEQIMCXYOQNPD-OAQYLSRUSA-N 382.464 2.513 0 50 GFAA O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccc(CN2CCOCC2)cc1 12767772 FQGZGGWLQGEDGE-UHFFFAOYSA-N 379.460 2.898 0 50 GFAA Cc1c(NS(=O)(=O)Cc2ccc(F)cc2)c(=O)n(-c2ccccc2)n1C 13997889 QRYYZYIKOZTJTF-UHFFFAOYSA-N 375.425 2.565 0 50 GFAA CC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccncc1)C2 14742893 VESWGSCTMPZEPC-UHFFFAOYSA-N 395.507 2.805 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@@H](C)c2ccncn2)n1Cc1ccccc1 67588101 AUYKEIDRPYDLLW-INIZCTEOSA-N 399.520 2.708 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2[nH]c3ccc(Cl)cc3c2-c2ccccc2)CCN1 71754432 BFNCPXKDCJTJEK-MRXNPFEDSA-N 383.835 2.987 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N1CCC[C@H]1c1nc2ccccc2[nH]1 72474420 IIVXPMFFOFGPET-IBGZPJMESA-N 378.480 2.549 0 50 GFAA Cn1ccc(C(=O)N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)n1 91288677 QFZSGPOIRZUAGB-VMPITWQZSA-N 378.476 2.588 0 50 GFAA O=C(COc1ccccc1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91452231 HBXOUJMTFKGGBE-UHFFFAOYSA-N 393.487 2.892 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(CCOc1ccc(Cl)cc1)CCN2C 91550912 GGSLXUZCDUKJON-HXUWFJFHSA-N 379.932 2.737 0 50 GFAA CCc1ncc(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)cn1 91820214 XXTNISLUFGANGL-UHFFFAOYSA-N 382.512 2.704 0 50 GFAA O=C(c1cccc(S(=O)(=O)N[C@H]2CCCOC2)c1)N1CCCCCCC1 95380757 MZFNYWSEHVWAFT-KRWDZBQOSA-N 380.510 2.550 0 50 GFAA COc1cc(CN2CC(c3cccnc3)C2)ccc1OC[C@@H](O)CN(C)C(C)C 95499279 FFNYQXLUQNSGMA-NRFANRHFSA-N 399.535 2.770 0 50 GFAA O=C(OC1CCCC1)c1ccc(NC(=O)N2CCC3(CC2)C[C@H](O)CO3)cc1 95500252 FIMMUVPXGDSYLZ-KRWDZBQOSA-N 388.464 2.934 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95522823 MLSPKJRRMLWTHN-MRXNPFEDSA-N 377.448 2.750 0 50 GFAA Cc1cc(N2CCC(NCCn3cccn3)CC2)nc(-c2ccccc2O)n1 95524708 PQEGGNUZKVAEEG-UHFFFAOYSA-N 378.480 2.613 0 50 GFAA COc1cc(NC(=O)N2CCCC[C@@H]2CN2CCOCC2)c2ncccc2c1 96151747 XVJYRYLTFYFLRL-QGZVFWFLSA-N 384.480 2.962 0 50 GFAA CC(C)Cc1cc(CNC(=O)Nc2cc(NS(C)(=O)=O)ccc2F)no1 97655480 QTKLNQTWAZGCOA-UHFFFAOYSA-N 384.433 2.705 0 50 GFAA COC(=O)C1(CNC(=O)c2ccc3c(c2)C[C@H](c2ccccc2)OC3=O)CC1 170600863 UBFJZKKIJGQJDL-GOSISDBHSA-N 379.412 2.824 0 50 GFAA Cn1cc([C@@H]2CCN(C(=O)Nc3cc(Cl)ccc3N3CCOCC3)C2)cn1 172143356 QSVNUADWWPOOOU-CQSZACIVSA-N 389.887 2.932 0 50 GFAA CN(C[C@H](c1cccs1)N1CCOCC1)C(=O)c1cc(F)cc2[nH]cnc12 176544609 UGMAAIJNDCVIFP-MRXNPFEDSA-N 388.468 2.909 0 50 GFAA COc1cc(OC)cc([C@H]2CC(c3ccc(F)cc3)=NN2S(C)(=O)=O)c1 225495050 VGBPXUFKRNTESJ-GOSISDBHSA-N 378.425 2.954 0 50 GFAA COC(=O)CC1(CN2CCN([C@H](C)c3nc(-c4ccccc4)no3)CC2)CC1 225640515 BEJNABOHIFVBJZ-MRXNPFEDSA-N 384.480 2.759 0 50 GFAA CCOC(=O)c1ncn(C2CCN(c3ncnc4cccc(C)c34)CC2)c1N 225648052 RFGSOUMRUYYUEZ-UHFFFAOYSA-N 380.452 2.735 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@H]1C=Cc3cc(F)ccc3N1[C@H]2C(=O)c1ccccc1Cl 245256120 NVPOKVXVPBYCIS-XMTFNYHQSA-N 396.805 2.835 0 50 GFAA O=C(N[C@@H](C(=O)NCCc1nc2ccccc2[nH]1)c1ccccc1)c1cccnc1 252484826 GIWNPVFIHCPNJO-OAQYLSRUSA-N 399.454 2.788 0 50 GFAA CC(C)c1cc(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)no1 263514955 DKEYFTACLULXFM-UHFFFAOYSA-N 385.420 2.987 0 50 GFAA COc1ccc(CN[C@H]2CNC(=O)c3cc(-c4ccc(F)cc4)nn32)cc1OC 263619149 XEQWDEOKWNHRRZ-HXUWFJFHSA-N 396.422 2.738 0 50 GFAA CC(C)N1CCN(C2CCN(C(=O)[C@@H](C)Oc3cccc(F)c3)CC2)CC1 270958249 UPSILMPAIUOUNY-QGZVFWFLSA-N 377.504 2.610 0 50 GFAA Cc1nn(C)c(C)c1OCC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 282813266 QZACGPANKKDCIF-OAHLLOKOSA-N 394.516 2.568 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1nc(N2CCCC2)ncc1Cl 299753945 ZYCIBRWLEDWYJE-XBFCOCLRSA-N 378.860 2.588 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)NC[C@@H]1Cc2cccc(-c3ncccn3)c2O1 299781817 UWZHYWBZRPVCOJ-INIZCTEOSA-N 377.448 2.536 0 50 GFAA Cn1ncc(NC(=O)N2CCC([C@@H]3OCCC[C@H]3N)CC2)c1-c1ccccc1 333270264 FZYXULWEQFNJBP-XLIONFOSSA-N 383.496 2.837 0 50 GFAA O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)N1CC[C@@H](N2CCCC2)C1 363459334 KHCSRXFCEAJKGP-NVXWUHKLSA-N 378.467 2.671 0 50 GFAA O=C(c1cc(-c2cccnc2)nc2ccccc12)N1Cc2cnn(CCO)c2C1 426662298 QIQFBINSNZETJG-UHFFFAOYSA-N 385.427 2.642 0 50 GFAA O=C(Cn1ccc([C@H]2CCCNC2)n1)N1CCC(OCc2ccccc2)CC1 426701467 RBKIGCBIGPCVAP-IBGZPJMESA-N 382.508 2.558 0 50 GFAA Cc1nnnn1-c1ccc(C(=O)N2CC[C@@](F)(c3ccccc3F)C2)c(F)c1 451538039 UYOZXDDQKGYCMJ-IBGZPJMESA-N 387.365 2.960 0 50 GFAA CCn1c(=O)c2ccccc2n(CC(=O)N[C@@H](c2ccccc2)C2CCC2)c1=O 729380514 VTVUVJQHPFOERV-NRFANRHFSA-N 391.471 2.841 0 50 GFAA CCOc1ccc(N2C[C@@H](C(=O)N3CCOCC4(CCCC4)C3)CC2=O)cc1 773061014 DOYFRKWZBBBIHK-KRWDZBQOSA-N 386.492 2.857 0 50 GFAA O=C(c1cccc(OCC(F)F)n1)N1CC[C@H](c2ccccc2)S1(=O)=O 814087410 JLLDPAQZGUSPJI-CQSZACIVSA-N 382.388 2.643 0 50 GFAA O=C(NCC1CCN(C(=O)CCCc2cccs2)CC1)C1CCOCC1 827763589 BPZOKMFWVWWQKL-UHFFFAOYSA-N 378.538 2.852 0 50 GFAA Cc1cc([C@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)ccc1F 1506428205 NOUXFAOQTZMLHH-LJQANCHMSA-N 385.439 2.683 0 50 GFAA CC[C@@H](NC(C)=O)C(=O)Nc1nnc(CCOc2cc(C)ccc2C)s1 1529154162 HWRPZWUWVWAVOB-CQSZACIVSA-N 376.482 2.630 0 50 GFAA CC/C(C)=C/CCN1CCC2(CC1)OCC[C@@](C)(NC(=O)CSC)[C@@H]2O 1772706441 ZMBODJSYTMDMRZ-WQVUSMBOSA-N 384.586 2.587 0 50 GFAA Cc1ccc(CC(=O)N2C[C@@H]3CN(Cc4ccoc4)C[C@]3(CCC(=O)O)C2)cc1 1775984207 KAXWLLLBBVGYRN-NZQKXSOJSA-N 396.487 2.956 0 50 GFAA O=C(N1CCSCC1)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1ncc[nH]1 1857701476 VWLBRPIZSBRVSX-NNMXDRDESA-N 396.560 2.951 0 50 GFAA COc1c(F)cccc1CN1C[C@@H]2[C@H](CNC(=O)C3CCC3)[C@H]3CC[C@]2(C1)O3 1857712965 PECNOZWRYFQBBB-ODULNIPZSA-N 388.483 2.730 0 50 GFAA CSc1ccc2c(C)cc(-n3nc(C)nc3CN3C(=O)CN(C)C3=O)nc2c1 1875243252 YGDIVULHUHWVSS-UHFFFAOYSA-N 396.476 2.548 0 50 GFAA COc1ccccc1NC(=O)[C@H]1CCCN(S(=O)(=O)c2sccc2F)C1 1875271118 YSDSQFDHEMZOSS-LBPRGKRZSA-N 398.481 2.935 0 50 GFAA COc1ccc(Br)cc1CC(=O)NC1(CC(N)=O)CCCCC1 1875271886 SIOAAFQFCPEGJR-UHFFFAOYSA-N 383.286 2.695 0 50 GFAA C[C@H]1CN(C(=O)N[C@@H](C)c2ncc(-c3ccc(F)cc3)o2)CCS(=O)(=O)C1 1875301140 BGYVCNGPSVCJFA-STQMWFEESA-N 395.456 2.618 0 50 GFAA O=C1CC2(CN1)CC(NC(=O)c1cc(-c3ccccc3C(F)(F)F)no1)C2 1875315692 DPTPQGNHHZCVIZ-UHFFFAOYSA-N 379.338 2.759 0 50 GFAA C=CC(=O)NCC(=O)NCc1ccnc(Oc2ccccc2C(F)(F)F)c1 1875371014 LQQSERFPYZJUIE-UHFFFAOYSA-N 379.338 2.811 0 50 GFAA COc1ccc([C@@]23CC[C@@H](C2)[C@H]3C(=O)N2CCC23CCS(=O)(=O)CC3)cc1 1875396336 CDDHAMHYIZFQEC-UQASEVPWSA-N 389.517 2.543 0 50 GFAA O=C(c1ncc[nH]1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940195536 VXBCJIJBBXYTIN-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA Cc1c(CC(=O)N2CCC(c3ccccc3CN)CC2)nnn1-c1ccccc1 2325789294 ILMOHLLFFYMLHY-UHFFFAOYSA-N 389.503 2.983 0 50 GFAA NC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2OCC2CC2)c(O)c1 2325875129 HKFJVVSEZUMAGZ-UHFFFAOYSA-N 396.852 2.734 0 50 GFAA CN(Cc1ccc2nonc2c1)C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356137027 OTDAAQKZOUWZSN-UHFFFAOYSA-N 398.488 2.708 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 2356143032 RMQNCIVSYJSNGG-NRFANRHFSA-N 375.432 2.664 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)c3cccc4c3OCCO4)s2)n1 2356153188 VXYVDVGNXNLGNN-UHFFFAOYSA-N 385.449 2.618 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)nn1C(C)C 2356159287 UMBYYFTXZPFCAD-NRFANRHFSA-N 382.512 2.749 0 50 GFAA O=C(Nc1ccc(Cn2cc(C(F)(F)F)ccc2=O)cc1)N1CCOCC1 1400127 SAYHCOIKQROWCG-UHFFFAOYSA-N 381.354 2.780 0 50 GFAA CCC(=O)N1CCc2cc(CNC(=O)Cc3ccc(OC)c(OC)c3)ccc21 8607143 PEXKPOQEPXSZQC-UHFFFAOYSA-N 382.460 2.862 0 50 GFAA O=C(Nc1ccccc1)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697968 HUIXNOGSSXNEEE-UHFFFAOYSA-N 375.436 2.969 0 50 GFAA CCN(CC)CCN1C(=O)CC[C@@H]2CN(C(=O)/C=C/c3cccs3)CC[C@@H]21 11870432 IZCLBBDLTJFKOR-BULUQRFKSA-N 389.565 2.943 0 50 GFAA CCOC(=O)c1cnc(SC)nc1Nc1ccc(N2CCN(C)CC2)cc1 11907855 LGJHBPCJLXLUKS-UHFFFAOYSA-N 387.509 2.871 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)cc(OC)c1OC 19549544 KHKINDLZDUXXQW-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3ccccc3C)CC2)cc(OC)c1OC 19608269 GGAOCVNGJMKBOF-UHFFFAOYSA-N 384.476 2.979 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(Cc3ccccc3F)[C@H](CCO)C2)cc1 22851378 MPQQTYTVRHDXJB-OAQYLSRUSA-N 385.483 2.853 0 50 GFAA C[C@H]1CN(Cc2ccc(-c3nc(-c4cccnc4)cc(=O)[nH]3)cc2)CCN1C 48501656 BSFQTCHMBOXWKQ-INIZCTEOSA-N 375.476 2.635 0 50 GFAA Cc1ncn(-c2cc(NCCNC(=O)Nc3ccc(F)cc3F)ncn2)c1C 72115799 RGMNXTCJYMWPSU-UHFFFAOYSA-N 387.394 2.791 0 50 GFAA O=C(NC[C@]1(O)CCCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1)C1CC1 72154095 TUCCADMDBKPYIO-SFHVURJKSA-N 384.398 2.589 0 50 GFAA CC(C)=CCN1CCNC(=O)[C@H]1CC(=O)N1CCc2[nH]c3c(C)cccc3c2C1 72158076 ZJELQKXMFUMSCB-HXUWFJFHSA-N 394.519 2.518 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)Cn3cnc4ccccc43)cn2)c1 72422686 NPUVABOLQRPKAH-UHFFFAOYSA-N 375.432 2.889 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CCN(Cc3cccc(C)c3)CC2)c1C 72468509 KHDAQSJGFQRODA-UHFFFAOYSA-N 382.508 2.745 0 50 GFAA CCc1ccc(CN2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)nc1 91747112 TVGLVXCSLJGUMN-UHFFFAOYSA-N 381.524 2.814 0 50 GFAA COCCCN1CC2(CCN(C(=O)Cn3ccc4ccccc43)CC2)CC1=O 95382079 NIBXXMLCSHKUKD-UHFFFAOYSA-N 383.492 2.519 0 50 GFAA CC(C)CCN1C[C@@]2(CCCN(C(=O)Cc3ccc(CO)cc3)C2)CCC1=O 95502395 WGEUUWRVQIGODH-QHCPKHFHSA-N 386.536 2.999 0 50 GFAA COc1cc(CN2CCC3(CCO3)CC2)ccc1OC[C@@H](O)CN(C)C(C)C 95509646 KMZFSWLLLFSRCJ-IBGZPJMESA-N 392.540 2.530 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4csc(C)n4)C3)CCC2=O)cn1 95512146 SGNIWONUQJPRSN-HXUWFJFHSA-N 399.520 2.595 0 50 GFAA CCN1CCC(N2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)CC1 96163609 OVMREBFDSQVKEF-UHFFFAOYSA-N 383.544 2.522 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(C)o3)[C@H](CCO)C2)c(OC)c1C 104395909 ROEZIAAPEVHJSD-LJQANCHMSA-N 388.508 2.982 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)NOC[C@@H]1CCOC1)OCc1ccccc1 170607695 NEGGOQDKIWGWFP-WOJBJXKFSA-N 398.459 2.608 0 50 GFAA O=C(c1csc(C(F)(F)F)n1)N1CCCN(Cc2cscn2)CC1 170608000 WKJCBHNJFIGTGR-UHFFFAOYSA-N 376.429 2.967 0 50 GFAA C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCC[C@@H]2CCNC2)cc1 178940558 AFBJFHPFOVQJIM-KSZLIROESA-N 387.524 2.584 0 50 GFAA C[C@@H]1CN(C(=O)NCC(C)(C)Cc2cccc(Cl)c2)CCS(=O)(=O)C1 192195990 VVSXNLSHRKXVHY-CQSZACIVSA-N 386.945 2.985 0 50 GFAA O=C(NCc1ccccc1)C1CCN(C(=O)N[C@@H]2COc3ccccc32)CC1 194701292 OYOZXBLOEBYARS-LJQANCHMSA-N 379.460 2.858 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1CCCn2nc([C@@H](O)C3CCC3)cc2C1 219914826 LAPQRWDIEPRBGJ-NRFANRHFSA-N 391.475 2.948 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cn1ccc2ccccc21 247941837 PUFOKZLSHGNGQJ-MJGOQNOKSA-N 388.471 2.800 0 50 GFAA c1cncc(-c2noc(-c3cc4n(n3)C[C@H](c3ccc5c(c3)OCO5)OC4)n2)c1 263618048 QZWGCQYZVGFXTO-GOSISDBHSA-N 389.371 2.995 0 50 GFAA O=C(c1cccc2[nH]ccc12)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263619497 YXMJNVJJKMTWID-UHFFFAOYSA-N 384.439 2.971 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 268880522 DEFHSJCLNQXTIX-HBUWYVDXSA-N 387.457 2.960 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OCc4ccccc4)cc3)C(=O)[C@@H]2C1 278227455 YDVWABZWCCVOEK-LPHOPBHVSA-N 394.427 2.986 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3ccc(-n4ccnc4)cc3)cc2C1 299772504 AEVFTEHXVPDBTL-UHFFFAOYSA-N 378.480 2.615 0 50 GFAA O=C(CC1CC(c2ccccc2)C1)N1CC(S(=O)(=O)NC2CCCC2)C1 328677734 SHPMFTNBDJADLF-UHFFFAOYSA-N 376.522 2.643 0 50 GFAA Cc1cc(C)c2nc(C3CC3)cc(C(=O)N3CCN4C(=O)N=C(O)[C@@H]4C3)c2c1 328964690 RWBHKSASVQSWKJ-KRWDZBQOSA-N 378.432 2.946 0 50 GFAA CN1CCC[C@H](CNS(=O)(=O)CCC2CCOCC2)[C@H]1c1cccs1 330305386 QPOOLSYIYJCYQB-AEFFLSMTSA-N 386.583 2.867 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2coc3c2C(=O)CCC3)c2ccsc2S1(=O)=O 333042552 FHRMJMDJKXPUFO-CABZTGNLSA-N 379.459 2.897 0 50 GFAA Cn1cc(C[C@H]2CCN(C(=O)NCCc3ccn(-c4ccc(F)cc4)n3)C2)cn1 363115385 ZDMSBRNBFTXZPJ-MRXNPFEDSA-N 396.470 2.562 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@H]1CCN(c2ccccc2)C1 363618358 BCYZSJNHWATJJP-GOSISDBHSA-N 376.464 2.593 0 50 GFAA CN(Cc1nccn1C(F)F)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccn1 363799145 RSDQRTVQQUEJAS-KFWWJZLASA-N 390.438 2.864 0 50 GFAA C[C@@H](c1nc(-c2cccnc2)no1)N1CCc2ccc(S(C)(=O)=O)cc2CC1 374813111 XVPQFHVSIPLIMG-AWEZNQCLSA-N 398.488 2.697 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N3CCC[C@@H](c4n[nH]cc4NC(C)=O)C3)c2c1 374836673 GYRHKZPISKIHMQ-CQSZACIVSA-N 395.463 2.807 0 50 GFAA Cc1ccccc1[C@H](NC(=O)N(C)CCCN1CCOCC1)c1ccncc1 426503230 GOWAJJLXGKPJSV-OAQYLSRUSA-N 382.508 2.843 0 50 GFAA CCc1nccn1CCCNS(=O)(=O)c1ccc(OC)c2c1CCCC2 670472809 FENTXSRHRQALKC-UHFFFAOYSA-N 377.510 2.702 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@H](C)[C@](C)(CO)C1 888101835 XGRBCOCPQUOXJA-ZBEGNZNMSA-N 376.375 2.754 0 50 GFAA C[C@H](NC(=O)CN1CCOc2ccccc2C1)c1ccc2c(c1)OCCCO2 952969861 BUTGMXOAIHSAKI-INIZCTEOSA-N 382.460 2.920 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCC[C@H](c4nc(CC(C)C)no4)C3)c12 1529196189 VYCIMNKHIYQSBF-ZDUSSCGKSA-N 398.467 2.940 0 50 GFAA Cc1nc(C2CC2)ncc1C(=O)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 1565509079 XZVBHJGMALSLOS-PBHICJAKSA-N 383.521 2.856 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCCN(C(=O)Cc2cn(C)c3ccccc23)CC1 1772707421 SWCUFOQXIMYEKK-UHFFFAOYSA-N 378.476 2.732 0 50 GFAA C[C@]12CC[C@@H]3[C@H](CC[C@@H]4C[C@@H](O)CC[C@@]43CO)[C@]1(O)CC[C@@H]2C1=CC(=O)OC1 1848443833 CDMVQQAHEQVSMF-PZPZQMKNSA-N 390.520 2.577 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)C3CCC3)C[C@]23CC[C@H]1O3)c1cc(F)cc(F)c1 1857715224 HOIDLNDTTRDYDT-XKGFGPFHSA-N 390.430 2.501 0 50 GFAA Cn1nc2c(c1CNC[C@H](CCO)c1ccc(C(F)(F)F)cc1)COCC2 1875299384 JFFXCIJXFCSYQE-AWEZNQCLSA-N 383.414 2.767 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2C[C@H]3CC[C@@H](C2)[C@H](C(=O)O)C3)cc1F 1875305379 BXHQEQMWSAHVJL-AEGPPILISA-N 377.412 2.757 0 50 GFAA O=C(N[C@H]1[C@@H]2CN(C(=O)CC3CC(F)(F)C3)C[C@@H]21)c1cnc2ccccc2c1 1875325015 GCLOIWQJXFJHKH-MNZLEMJZSA-N 385.414 2.857 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCCC[C@@H]2C(=O)OCc2ccccc2)CC1 1875365340 WLGNTUNIVUUARD-LJQANCHMSA-N 384.476 2.536 0 50 GFAA COC(=O)/C=C/C(=O)N1CCC2(CC1)C[C@H]2c1nnc(-c2cccc(F)c2)o1 1875379207 PGODXPATDXGMHP-NFAHFFEMSA-N 385.395 2.701 0 50 GFAA O=C(Nc1nccs1)C1CCN(C(=O)c2ccc3c(=O)ccoc3c2)CC1 2325749007 RYEGAPHAKXPHSK-UHFFFAOYSA-N 383.429 2.740 0 50 GFAA O=C(NCc1cc(C2CCNCC2)no1)Nc1ccc(-c2nncs2)cc1 2325754057 CTEVRTSUTHOAMF-UHFFFAOYSA-N 384.465 2.982 0 50 GFAA CN1CCO[C@@H](CN(C)C(=O)C2C[C@@H]3CCC[C@H](C2)C32SCCS2)C1 2325760318 JFJTYKHQNZWCSL-NPYXIHBLSA-N 384.611 2.778 0 50 GFAA COC(=O)c1cnc(C(=O)N2CCC(Oc3ccc(Cl)cc3)CC2)cn1 2325782404 WSOMWSNTLFGVRD-UHFFFAOYSA-N 375.812 2.600 0 50 GFAA C[C@H](CC(F)(F)F)C(=O)N[C@]1(C)CCN(C(=O)CN(C)CC(C)(C)C)C1 2325794877 UWLNGVVLUOBGAU-CXAGYDPISA-N 379.467 2.660 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCC[C@H](c2ncc[nH]2)C1 2356156045 SXSUPGYRRATOQI-AWEZNQCLSA-N 386.521 2.642 0 50 GFAA Cc1nnc(N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c2ccccc12 2356167285 MAAFMPDXRYJRJJ-DENIHFKCSA-N 377.444 2.823 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356134014 SRCLZFRKYYFHNN-JOCHJYFZSA-N 379.508 2.729 0 50 GFAA COc1cc(COC[C@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC 2686944 HBVSYOPPYRXUFP-LJQANCHMSA-N 387.476 2.648 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(C2CCN(C3CCCC3)CC2)CC[C@H]1O 2356147379 TUMPORPOFRAGIK-FYYLOGMGSA-N 386.536 2.774 0 50 GFAA CCCn1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)c(C)n1 20598324 JMSZVSHGPHLWNS-IBGZPJMESA-N 392.494 2.949 0 50 GFAA COc1ccc(CN2C(=O)O[C@@H]3CN(Cc4cccc(C)n4)C[C@@H]32)cc1OC 55371500 SVRSPWXEUPFOFW-FXAWDEMLSA-N 383.448 2.612 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@H]3CCC(=O)N(C4CCCC4)C3)CC2)c1 20782606 VKIVTSMWYOIUHM-IBGZPJMESA-N 399.535 2.521 0 50 GFAA NC(=O)N[C@H](CC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cccs1 229850369 IDNLVKRPZVTUBI-DLBZAZTESA-N 386.521 2.628 0 50 GFAA O=C(c1ccc(N2CCNCC2)nc1)N1CCC(CCc2ccccc2)CC1 67641082 OJBNDWNJUOCDCA-UHFFFAOYSA-N 378.520 2.976 0 50 GFAA COC(=O)[C@H](CC(C)C)N(C)C(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 253418541 VZDPMDRNNBBANY-ZDUSSCGKSA-N 395.399 2.640 0 50 GFAA Cc1cc2c(SCC(=O)N[C@@H]3CCOC4(CCOCC4)C3)ncnc2s1 77518067 HDEWAROUSLTPLD-CYBMUJFWSA-N 393.534 2.936 0 50 GFAA O=C(CN1CCN(CC2CCOCC2)CC1)N1CCC(Cc2ccccc2)CC1 172423978 XDYYTNYCJNOVKJ-UHFFFAOYSA-N 399.579 2.512 0 50 GFAA CCCCN1C(=O)CC[C@@H](C(=O)N2CCCNCC2)[C@H]1c1ccccc1OC 236775517 DLXWGVRQVUXGBE-WIYYLYMNSA-N 387.524 2.597 0 50 GFAA Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CNC(=O)Nc1cccc2c1CCO2 333118733 GUWHKTUFATVJDS-GJZGRUSLSA-N 388.443 2.960 0 50 GFAA CN1CCN(Cc2cccc(NS(=O)(=O)c3ccc(Cl)s3)c2)CC1 153937276 NLXTYNLPIUKLSP-UHFFFAOYSA-N 385.942 2.950 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H](C)Cc2c(C)nn(C)c2C)cc1 363253299 LFUYVDLJTYLQFJ-XOBRGWDASA-N 398.507 2.854 0 50 GFAA NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NC34CCC(CC3)C4)c2)C1 363752854 MQQXXUBRZHCFQU-COFLGROHSA-N 384.524 2.516 0 50 GFAA CCOc1ccc(-c2nc(C)c(C(=O)N3CCO[C@@H](CC(=O)O)C3)s2)cc1 262874185 YBKHEXUQRSTAQD-HNNXBMFYSA-N 390.461 2.833 0 50 GFAA Cc1nc([C@H]2CCCOC2)sc1C(=O)Nc1cccc(NS(C)(=O)=O)c1 368314786 GYIGLZKBYVFWHD-LBPRGKRZSA-N 395.506 2.969 0 50 GFAA Cc1cccc(CN(C(=O)C[C@@H]2C(=O)NCCN2Cc2ccoc2)C(C)C)c1 72169584 GFDOWADQFWZPIM-HXUWFJFHSA-N 383.492 2.716 0 50 GFAA CC(=O)Nc1nc(-c2cccs2)c(CC(=O)N2CCC(C(=O)O)CC2)s1 218141505 VEGWIKOIOSTOIS-UHFFFAOYSA-N 393.490 2.696 0 50 GFAA CCOC[C@H](NC(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1)C(C)C 242048067 VSLBKIJJNNRTAY-IBGZPJMESA-N 386.496 2.696 0 50 GFAA CC(C)CN1CCO[C@@H](CNC(=O)N[C@H]2CCCOc3c(F)cccc32)C1 245526150 OUZSFSQCJJWNQX-YJBOKZPZSA-N 379.476 2.695 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](N3CCc4ccccc4C3)C2)c1 72161551 BZEPUBPLDSNMKA-HXUWFJFHSA-N 398.528 2.753 0 50 GFAA C[C@H]1CCC[C@@H](C)N1C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 17081364 KSZZWHZFRCYRAH-GASCZTMLSA-N 397.566 2.667 0 50 GFAA O=C(NCc1ccccc1CN1CCCC1=O)c1ccccc1N1CCOCC1 195350136 BTZJQRVTMJJYSB-UHFFFAOYSA-N 393.487 2.576 0 50 GFAA Cc1cc(C(=O)N2CCCC[C@H]2c2cccc(F)c2)c2c(O)nc(=O)n(C)c2n1 426662375 VOQDZKXWVFZKQX-INIZCTEOSA-N 396.422 2.849 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@]2(CCCN(CC3CC3)C2)C1 426394451 ATNGWYSQWMICBC-QFIPXVFZSA-N 382.508 2.804 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)CN1C[C@@H](c2ccccc2)CC1=O)C1CC1 95517840 GHUALEMPOHTPBF-SFHVURJKSA-N 380.492 2.544 0 50 GFAA Cc1cccc2cc(C(=O)N3CCC4(CC3)c3[nH]cnc3CCN4C)n(C)c12 91441675 FMIWHWPTWPBWIG-UHFFFAOYSA-N 377.492 2.829 0 50 GFAA c1nc(Cc2nc(C3CCOCC3)nn2Cc2ccc3c(c2)OCO3)cs1 96139265 GPRYBXFUGVYRMX-UHFFFAOYSA-N 384.461 2.996 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N(C)Cc3n[nH]c4c3CCCC4)c(=O)[nH]2)cc1 91951353 OTSNXGRPELWGPK-UHFFFAOYSA-N 377.448 2.619 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N(C)C[C@@H]3CCCN4CCCC[C@@H]34)CC2=O)cc1 299754449 PXMAICBDTVDHQB-UEXGIBASSA-N 399.535 2.771 0 50 GFAA biogenic CCC(CC)(C(=O)O)C(=O)N1CCC2(CC1)C[C@@H]2N(C)Cc1nccs1 952887356 PEOPMCPZXFJRES-AWEZNQCLSA-N 379.526 2.847 0 50 GFAA C=CC(=O)N[C@@H](C)[C@@H]1CN(C(=O)c2cc(-c3ccc(Cl)cc3)on2)CCO1 1875386211 LCYALKHVWGSHHE-SJCJKPOMSA-N 389.839 2.527 0 50 GFAA Cc1cccc(N2CCN(S(=O)(=O)c3onc(C4CC4)c3Cl)[C@H](C)C2)n1 1875392070 ZZQWSDVJZDWDNL-GFCCVEGCSA-N 396.900 2.808 0 50 GFAA C=CC(=O)NC[C@H](NC(=O)[C@H]1CCCN(C(C)=O)C1)c1ccc2ccccc2c1 1875386350 NXNASBDSDIGUFA-SFTDATJTSA-N 393.487 2.558 0 50 GFAA O=C(CCc1ccccc1C(F)(F)F)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875402374 DVGPWHCQGXNXRI-KBRIMQKVSA-N 381.398 2.790 0 50 GFAA O=C(CC1=CCOCC1)N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403210 RXFGWYJXRXDWJR-MISYRCLQSA-N 381.476 2.543 0 50 GFAA C[C@H]1C(=O)N(Cc2ccccc2)CCN1C(=O)CCn1cnc2ccccc21 952981915 DVCCYDVEOKSQLP-KRWDZBQOSA-N 376.460 2.686 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(c3ncnc4c(C)cccc34)C2)ccn1 886062822 PKJQQSIKQRJCOG-GOSISDBHSA-N 377.448 2.627 0 50 GFAA C[C@H](CNS(=O)(=O)Cc1noc2ccccc12)N1CCc2sccc2C1 185671247 RUKREHRUOLREQJ-CYBMUJFWSA-N 391.518 2.756 0 50 GFAA CCc1ccc(C(=O)N2C[C@H]3[C@H](NC(=O)c4ccc5cccnc5n4)[C@H]3C2)s1 1775989830 BHGXCQNGEUUDSJ-HWWDLCQESA-N 392.484 2.754 0 50 GFAA Cn1cc(CCC(=O)N2C[C@H]3C[C@H](c4ccccc4)CC[C@@]3(C(=O)O)C2)cn1 1565510849 VMYZAKXOANHEON-WOIUINJBSA-N 381.476 2.850 0 50 GFAA Cc1nc(C2CC2)nc2sc(C(=O)NC[C@@H](O)C3CCOCC3)c(C)c12 169990913 DOEZIAYTQBZDHD-CQSZACIVSA-N 375.494 2.703 0 50 GFAA CNS(=O)(=O)c1cc(NC(=O)COc2ccccc2C(C)(C)C)ccc1O 170617783 YRKOZRRNKDNAFF-UHFFFAOYSA-N 392.477 2.615 0 50 GFAA CCOC(=O)C1=C(CSc2ncnc3sc(C)cc23)NC(=O)N[C@@H]1C 781896968 FBTCIACGVLISIY-SECBINFHSA-N 378.479 2.610 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N(Cc3cnn(C)c3)C3CC3)c(C)s2)n[nH]1 1506405290 YUJYFQAUQATASS-UHFFFAOYSA-N 391.522 2.842 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CN1CCCN(C(=O)c2cncn2C)CC1 1529110287 LJDIJNNXCUFXBB-UHFFFAOYSA-N 392.507 2.571 0 50 GFAA Nc1ncc2c(n1)[C@@]1(CCCN(CCCOc3ccc(C(=O)O)cc3)C1)CC2 1704315280 ZJVXEBMJEKKEGI-NRFANRHFSA-N 382.464 2.506 0 50 GFAA CCc1ccc(NC(=O)CN(c2cc(OC)ccc2OC)S(C)(=O)=O)cc1 1125943 LLBRJYPEHFWQQE-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA COc1ccc(OC)c(CNC(=O)c2cc(COc3ccc(C)nc3)on2)c1 11822129 SQHUVELUNNVGHT-UHFFFAOYSA-N 383.404 2.904 0 50 GFAA C[C@H](NC(=O)c1ccco1)c1nnc2n1CCN(Cc1cccc(F)c1)CC2 12020586 MJZNPHGLDSSYIC-AWEZNQCLSA-N 383.427 2.560 0 50 GFAA CCCC(=O)N1CCC(N2CCC[C@@H](C(=O)NCCc3ccccc3)C2)CC1 12072748 FVAUAPXFURNSDT-HXUWFJFHSA-N 385.552 2.848 0 50 GFAA Cc1cc(C(=O)N2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)c(C)o1 12387052 XTIAPPIJMQVZGI-OAHLLOKOSA-N 386.452 2.545 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C(=O)CCc2cnn(C)c2)cc1 12715931 OHQWGNVUKLZPRI-UHFFFAOYSA-N 398.551 2.774 0 50 GFAA COc1ccc(NC(=O)c2ccc3c(c2)N(C)[C@H]2CCCN2C3=O)cc1OC 169765788 YOHDEIMDQFZFRZ-LJQANCHMSA-N 381.432 2.968 0 50 GFAA O=C1CCCN1CCCNC(=O)N1CCC(Oc2ccccc2Cl)CC1 153842821 YSXJJAYFRNHMHR-UHFFFAOYSA-N 379.888 2.905 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](N3CCCc4ccccc43)C2=O)cc1 4759801 HMHVFVKTNCWSGB-LJQANCHMSA-N 378.428 2.948 0 50 GFAA CCS(=O)(=O)c1cccc(CC(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)c1 159168934 VEZZFLJPFMRKDA-UHFFFAOYSA-N 384.461 2.755 0 50 GFAA COc1cc(Cc2cc(OC)c(OC)cc2C(=O)O)c(C(=O)O)cc1OC 4566206 KUIGSAARMBZYDH-UHFFFAOYSA-N 376.361 2.708 0 50 GFAA CCCOc1ccc(/C=c2/sc3nc(=O)c(-c4ccccc4)nn3c2=O)cc1 1775389 LLZQIDQDWOWPLF-GHRIWEEISA-N 391.452 2.515 0 50 GFAA COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OCC(C)C)cc1 5865368 XDGVFQWJZMLMFW-QGZVFWFLSA-N 378.494 2.704 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)cn1)N1CC[C@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1857531285 DHNDATQPSGVVPZ-ZBFHGGJFSA-N 398.854 2.963 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCc4cscn4)CC3=O)sc2c1 1857668137 WWINFEYGNCRESM-GFCCVEGCSA-N 386.502 2.773 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4sccc4C)[C@H]4CC[C@]3(C2)O4)n1 1857721049 XCWWCRKNOYVQPT-QCBUCWTNSA-N 384.505 2.569 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2CC[C@@]34OCCN3C(=O)C[C@@H]24)cc1 1857731864 RQUPWGUAOPBHJU-OFNKIYASSA-N 376.456 2.759 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3Cl)C[C@]23CC[C@H]1O3 1857737512 QHAMXPDMUIRCQP-BUIAKZPTSA-N 380.941 2.799 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)cc2)n1 1875241590 XTFJDRWWPXGZLX-YADHBBJMSA-N 390.487 2.619 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2cn(-c3ccc(Br)cc3)cn2)C1 237661289 GSJHVALXSSVWCI-MRXNPFEDSA-N 378.226 2.572 0 50 GFAA NCC1(c2ccccc2)CCN(C(=O)C(=O)Nc2ccc3sncc3c2)CC1 2325765467 KWKGIMQDNVSNGH-UHFFFAOYSA-N 394.500 2.754 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)CO[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)CC2)[nH]1 2325783440 ZZKQDJFTCLLXJI-ZTFGCOKTSA-N 378.517 2.521 0 50 GFAA CCOCC1(C(=O)NC[C@@H]2CN(C(=O)c3ccc4cc[nH]c4n3)CC[C@@H]2C)CC1 2325793627 BAZCSUZHHYIUJK-DOTOQJQBSA-N 398.507 2.594 0 50 GFAA CCO[C@H](C(=O)NC1(CC)CCN(C(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)CC1)C1CC1 2325794170 TUWDTZAWPCCHCP-CADBVGFASA-N 392.540 2.504 0 50 GFAA CC(C)NC(=O)Nc1ccc(C(=O)N[C@@H]2c3cccc(O)c3C[C@H]2C(=O)O)cc1 2325820991 GNIIMSGFFQRDIB-SJLPKXTDSA-N 397.431 2.650 0 50 GFAA Cc1sc2nc(CN3CCOCC3)nc(N[C@@H]3CCN[C@@H]4CC[C@H]43)c2c1C 2332239225 CWQXOJRNRLMNLK-BZUAXINKSA-N 387.553 2.693 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cccnc2)cc1C(=O)NC1CCCCC1 645327 AOFRDDHCAXPJLX-UHFFFAOYSA-N 389.477 2.954 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)cc1 1136991 CZBFDAWEOHQCTH-UHFFFAOYSA-N 375.450 2.584 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N2CCCC2)C[C@H]1Nc1ncc(F)c(OC)n1 2356152347 FQDFCYYMOLEMOS-NUEKZKHPSA-N 380.464 2.623 0 50 GFAA Cc1ccc(N(CC(=O)NC[C@@H](C)c2ccccc2)S(=O)(=O)N(C)C)cc1 8602052 BFLKCESNGXEGHN-QGZVFWFLSA-N 389.521 2.528 0 50 GFAA COC(=O)[C@@H](NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1)c1cncn1C 225556379 ILJNQJOVELLWKE-YWZLYKJASA-N 393.443 2.885 0 50 GFAA COc1cc(S(=O)(=O)NC[C@H]2CCCCC2(F)F)cc(C(=O)O)c1OC 414332575 VKPRJYRNRBHNDO-SNVBAGLBSA-N 393.408 2.506 0 50 GFAA Cc1cnn(C[C@H]2CN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CCO2)c1 112136674 FQYVXFLQJOKDPO-LJQANCHMSA-N 386.471 2.863 0 50 GFAA O=C(CN1CCN(C(=O)N2CCCCC2)CC1)Nc1ccc(F)cc1Cl 115500598 BFOGGUXIJGQWGS-UHFFFAOYSA-N 382.867 2.641 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)NCCSC)[C@H](c2ccccc2Cl)N1C 55166791 KWOKFUOJSXSWAC-YEWWUXTCSA-N 384.929 2.744 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1cnc2sc3c(n2c1=O)CCCC3 10327413 QNOLNNWGXSUDOD-UHFFFAOYSA-N 383.429 2.674 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)Nc3cnn(C)c3)c3ccccc3C(=O)N2C)cc1 61720676 PEOSYHQRGDORMT-VQTJNVASSA-N 390.443 2.978 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N3CCC(n4ccnc4)CC3)cc2)C[C@@H](C)O1 363155170 HNXRGDBDOZPVBP-HDICACEKSA-N 382.508 2.970 0 50 GFAA COc1cc(C(=O)N2CCC3(CC2)NC(C(C)(C)C)=NC3=O)c2ccccc2n1 63882145 DWTUHBFGFPPFIO-UHFFFAOYSA-N 394.475 2.793 0 50 GFAA COc1cccc(-c2noc3c2CN(Cc2cc(=O)[nH]c(C4CC4)n2)CC3)c1 67894706 YFEDGPOLIQIRIE-UHFFFAOYSA-N 378.432 2.869 0 50 GFAA Nc1nc2c(s1)[C@@H](c1ccccc1OCCCn1ccnc1)CC(=O)NC2 65454025 PFAFLKJZLKAFSQ-CQSZACIVSA-N 383.477 2.543 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN(CCCn2cccn2)CC1 12441087 IBRRSLPPZPKZBG-UHFFFAOYSA-N 398.507 2.717 0 50 GFAA NC(=O)CC[C@H]1CCCN(c2nnnn2Cc2ccc(-c3ccccc3)cc2)C1 77486099 LFCSLZOXIBIYPR-QGZVFWFLSA-N 390.491 2.870 0 50 GFAA CSCCCN1C(=O)CC[C@H]2CN(C(=O)CCc3n[nH]c(C)c3C)CC[C@H]21 72447453 ZJRAJBUAQXUDFY-FUHWJXTLSA-N 392.569 2.552 0 50 GFAA Cc1ccc(NC(=O)[C@H]2C[C@H](C(=O)O)CN(Cc3cccc(F)c3C)C2)cn1 72142068 UQXSWOZALGBVTR-IRXDYDNUSA-N 385.439 2.999 0 50 GFAA C[C@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)[C@@H]1CN 237654762 CKJOTKLGBKGPJD-OXJNMPFZSA-N 386.517 2.860 0 50 GFAA CN1C(=O)[C@](CC(=O)N2CCC(O)CC2)(Cc2ccccc2)c2ccccc21 71757255 VZOOLSSGISUFNA-QHCPKHFHSA-N 378.472 2.517 0 50 GFAA CC(=O)Nc1ccc(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)cc1 44901405 CDWOPTVCTYJOJC-UHFFFAOYSA-N 380.379 2.647 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(C(=O)Cn3ccnc3)CC2=O)cc1 82121696 CISIOYBDKCLDRL-NRFANRHFSA-N 388.471 2.678 0 50 GFAA COc1ccc(N2C[C@@H](C)N(C(=O)c3csc(SC)n3)CC2=O)cc1 82166375 BMSAYBQLPYJEGJ-LLVKDONJSA-N 377.491 2.751 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](OCc3ccccn3)C2)sc2[nH]cnc(=O)c12 426545255 ZBKPAFQWDRZWHI-CQSZACIVSA-N 384.461 2.509 0 50 GFAA NC(=O)c1ccc(-c2nc3c([nH]2)CCN(C(=O)c2cc4ccccc4[nH]2)C3)cc1 220127723 DVJBHJMKKBBSRI-UHFFFAOYSA-N 385.427 2.855 0 50 GFAA C[C@H]1CN(C[C@@H]2CN(Cc3ccccc3C(F)(F)F)C[C@@H]2CO)C[C@@H](C)O1 91690595 UWTYJGCHRZSZAX-CYGHRXIMSA-N 386.458 2.855 0 50 GFAA COc1cc2c(cc1C(=O)N1CCC3(CC1)c1nc[nH]c1CCN3C)CCC2 91986005 JFSAGXKNUOQSTI-UHFFFAOYSA-N 380.492 2.526 0 50 GFAA O=C(O)c1cccc(C[C@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)c1 95362398 PHXJZIWSROISEF-MRXNPFEDSA-N 376.416 2.670 0 50 GFAA COCCN(Cc1cccnc1)C(=O)[C@@H]1CCC(=O)N(CC2CCCCC2)C1 91713280 RYQKANPWCGQCKS-HXUWFJFHSA-N 387.524 2.876 0 50 GFAA O=C(NC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cc(-c2ccccn2)n[nH]1 97475008 DUAMJOIAFSNICD-INIZCTEOSA-N 376.338 2.954 0 50 GFAA COc1cccc(CN2CC3(CCN(Cc4noc(C5CC5)n4)CC3)CC2=O)c1 95505908 VIULMNRLYHIVOQ-UHFFFAOYSA-N 396.491 2.970 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C)cc(C)c1)CC2 95502991 BDCOWHQLFNBZNX-UHFFFAOYSA-N 380.492 2.953 0 50 GFAA O=C(c1nc2ccccn2c1F)N1CCC(c2nnc3n2CCCCC3)CC1 91942974 AAXNXHZGLFPAQC-UHFFFAOYSA-N 382.443 2.811 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCCN(Cc3ccc(-n4ccnc4)cc3)C2)n(C)n1 825286209 VLZAHGJAOAGMNQ-LJQANCHMSA-N 392.507 2.556 0 50 GFAA O=C(NCCCc1nc2ccccc2[nH]1)N1CCC(N2CCSCC2)CC1 584895353 WZIOJVVKWYWGGO-UHFFFAOYSA-N 387.553 2.718 0 50 GFAA CC(C)[C@H]1C(=O)N(C)CCN1S(=O)(=O)c1cccc2cccc(Cl)c12 952979314 NPWANPBLXPQQME-KRWDZBQOSA-N 380.897 2.981 0 50 GFAA O=C1C[C@H](C(=O)N2CCN(c3nsc4ccccc34)CC2)C2(CCCC2)O1 952981841 KRHMJXPRDVXOPZ-OAHLLOKOSA-N 385.489 2.821 0 50 GFAA CNc1nc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)cs1 1565512609 USFQXHTUNHQFQC-PBHICJAKSA-N 382.533 2.889 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NCc3ccccc3-n3ccnc3)c2c1 302720295 ZQPHBQINCCRFQT-UHFFFAOYSA-N 379.445 2.831 0 50 GFAA O=C(Nc1cc(Cl)cc(Cl)c1)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 170591903 QEFRMGMUXSBBSS-IUODEOHRSA-N 393.292 2.851 0 50 GFAA Cc1cccc(S(=O)(=O)Nc2ccccc2CC(N)=O)c1Br 170617459 HBKNLSLKKMGRTH-UHFFFAOYSA-N 383.267 2.586 0 50 GFAA CCOc1ccc(N2C[C@@H](C(=O)Nc3ccccc3C(=O)OC)CC2=O)cc1 1165313 JUZIQFTXDGPRHX-AWEZNQCLSA-N 382.416 2.864 0 50 GFAA CC(=O)N1C[C@H]2CN(c3ncnc4[nH]ccc34)C[C@@]2(CCc2ccccc2)C1 1772813195 VEHVKKFFUKTZPW-PGRDOPGGSA-N 375.476 2.875 0 50 GFAA Cc1ccccc1CNC(=O)[C@@]12CCCN(C(=O)c3ccc[nH]3)[C@H]1CN(C)CC2 1775977312 FIRHQUCGRYSLEV-NZQKXSOJSA-N 394.519 2.566 0 50 GFAA COc1cc(C(=O)N2CCC(c3nnc4ccccn34)CC2)cc(OC)c1OC 12390292 YUTZUSQJZCHHSO-UHFFFAOYSA-N 396.447 2.775 0 50 GFAA CC(=O)NCCC(=O)N(C)CC1CCN(CCc2ccc(Cl)cc2)CC1 12711996 OGXTVIGIXIDHIK-UHFFFAOYSA-N 379.932 2.579 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCCCOC(C)C)C2 14732574 AJZBQXZUNCIAEG-QGZVFWFLSA-N 376.545 2.791 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ncccc3O)C1)CC2 1857667573 IZEMNZVDLKVMCZ-NRFANRHFSA-N 382.464 2.701 0 50 GFAA O=C(c1cc2ncccn2n1)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857673629 QCDSHFMUBKJMEV-IEBWSBKVSA-N 392.459 2.617 0 50 GFAA Cc1cccn2ncc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)c12 1857689508 GAOCDTWXPWECLM-WSTZPKSXSA-N 376.460 2.587 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nccs2)C1)N1CCC(Oc2ccccc2F)CC1 1857695790 YESGLOUCRJZWRL-CYBMUJFWSA-N 389.452 2.705 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cc4ccccc4n(C)c3=O)C[C@H]12 1857709796 RSBPQBNHBPUPFN-QQDKQVRDSA-N 394.471 2.612 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)Nc3cc(Cl)ccc3C(=O)N(C)C)cn21 416954924 VHGCXDDLXNDABU-LLVKDONJSA-N 396.900 2.936 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)C[C@H]3CCOc4ccccc43)CC2)cc1 117595004 QBOQRXGSHNYEJK-GOSISDBHSA-N 394.471 2.936 0 50 GFAA NC[C@H]1CCCN(C(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)C1 425261900 ZUWGXQYDRAZRPP-GFCCVEGCSA-N 376.863 2.964 0 50 GFAA O=C(CN1CCN(C(=O)c2cnc3ccccc3c2)CC1)Nc1ccc(F)cc1 253419381 RDAMAEIJDMGQIT-UHFFFAOYSA-N 392.434 2.770 0 50 GFAA COc1ccc(C2(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)CC3(CCC3)C2)cc1 370260191 GIYRSJDCAAERLP-MRXNPFEDSA-N 377.506 2.543 0 50 GFAA CC(=O)N(C)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c1 266681414 ZNJKSEGBWLUURE-FQEVSTJZSA-N 379.460 2.842 0 50 GFAA O=C(CCCn1c(O)nnc1O)N1CCC[C@@H]1c1ccccc1Br 906954296 KQQUZNQFQULXRR-CYBMUJFWSA-N 395.257 2.596 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(I)cc1)[C@H]1C=C[C@H]2CC1 100559742 BNGSBGUINYKDPI-NUZBWSBOSA-N 379.197 2.993 0 50 GFAA COc1cccc(OC)c1C(=O)Nc1ccc(I)cn1 13281416 HHLWGISSODNSLD-UHFFFAOYSA-N 384.173 2.956 0 50 GFAA Cc1nccnc1N1CCN(C(=O)[C@H](C)n2ccnc2-c2ccccc2)CC1 2325749148 OFTXLHBXTIVFFU-KRWDZBQOSA-N 376.464 2.558 0 50 GFAA Cc1ccc([C@@H](C)C(=O)NC[C@@](C)(NC(=O)C2(CN(C)C)CC2)C2CC2)cc1 2325793792 HZUSYWIXRRDCEJ-VGOFRKELSA-N 385.552 2.841 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCCCC1)c1cccc(C(F)(F)F)c1 882387 BFASVGGFPYEXNY-UHFFFAOYSA-N 378.416 2.874 0 50 GFAA NC(=O)CSc1nnc(-c2ccncc2)n1-c1cccc(C(F)(F)F)c1 1058204 RYJACQBHVBYBPX-UHFFFAOYSA-N 379.367 2.926 0 50 GFAA OCCN(Cc1ccccc1)C[C@H](O)COc1ccc(Br)cc1 2818421 AZAQEODUJOBDSQ-KRWDZBQOSA-N 380.282 2.683 0 50 GFAA COc1cc(NC(=O)CN(C)S(=O)(=O)c2ccccc2)c(OC)cc1Cl 2866880 JKCABQNNDXCDDY-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA Cc1c(C(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)oc2ccccc12 2872526 SPHGUILKVCUQGA-UHFFFAOYSA-N 384.457 2.888 0 50 GFAA CCOc1c(I)cc(CN[C@H](CC)CO)cc1OC 4670855 RMMJAYHZDJQZTQ-LLVKDONJSA-N 379.238 2.559 0 50 GFAA CC(=O)Nc1ccc(N2C[C@@H](C(=O)N3CCc4ccccc4C3)CC2=O)cc1 9197450 XCTBQKDCDVLDBF-SFHVURJKSA-N 377.444 2.583 0 50 GFAA O=C(c1cc(=O)c(O)co1)N1CCC[C@@H](c2[nH]ncc2-c2ccc(F)cc2)C1 67434146 RLLXILWIJZZSEL-CYBMUJFWSA-N 383.379 2.894 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)[C@@H](COCc1ccccc1)CC(=O)N2 65451365 QZWFYKKMOFKGOU-CQSZACIVSA-N 390.461 2.709 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(Cc3cccn3S(=O)(=O)c3ccccc3)C2)n1 67712617 XZOFTAXUTXZMQE-LJQANCHMSA-N 384.505 2.985 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NCCc1cnn(-c3ccccc3)c1)C2 64387338 JUQVONQTPBNXOL-GOSISDBHSA-N 377.444 2.791 0 50 GFAA CN(c1cc(C(=O)Nc2cccc(CS(N)(=O)=O)c2)ccn1)C1CCCC1 252518179 AFSHQWUWSBKSRL-UHFFFAOYSA-N 388.493 2.501 0 50 GFAA CN(Cc1nccn1C(F)F)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 122064513 RSDQRTVQQUEJAS-ILXRZTDVSA-N 390.438 2.864 0 50 GFAA CC(C)c1cc(C(=O)NCCCN2CCCc3ccccc32)nc2ncnn12 216507035 RDYGSQYSFJCAHF-UHFFFAOYSA-N 378.480 2.820 0 50 GFAA CC(C)(C)C1CCN(c2nnc([C@@H]3COCCO3)n2C[C@@H]2CCOC2)CC1 328805045 CVEDFVMOOADCKD-RDJZCZTQSA-N 378.517 2.665 0 50 GFAA O=C(Cc1c(F)cccc1Cl)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O 72153610 NCEVMPUOPKUCAF-UXHICEINSA-N 388.870 2.875 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(NC(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)c1C 483421706 VFGBHPZTFZXBDJ-ZBFHGGJFSA-N 379.526 2.797 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)Cc3cccnc3)[C@@H]3C4CCN(CC4)[C@H]23)c1 72139010 OUEHIMIHFNTXOX-MDNUFGMLSA-N 377.488 2.722 0 50 GFAA COc1cc(NC(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)ccn1 489825580 MXPCJAAIMZJSQC-HNNXBMFYSA-N 394.353 2.814 0 50 GFAA COc1cc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)ccc1NC(N)=O 378144078 QKXSXYOVTPMMSZ-QGZVFWFLSA-N 396.447 2.819 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 72121775 DSIZCHYSSGNLOW-SFHVURJKSA-N 387.524 2.570 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCC3(CC2)c2ccccc2C[C@H]3O)CC1 72151877 FYJVKRHLVFNRFA-JOCHJYFZSA-N 391.515 2.637 0 50 GFAA CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C 242339234 ZGCILIIUXPJJDC-VSZNYVQBSA-N 389.496 2.945 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)N1CCCN(Cc2cccnc2)CC1 426641327 FTEHQHPTVZECDP-UHFFFAOYSA-N 385.537 2.834 0 50 GFAA CC(=O)NC1CCN(C(=O)c2ccc(-c3cc(C(N)=O)ccc3C)cc2)CC1 426683767 HDVIKJNYDPZZCM-UHFFFAOYSA-N 379.460 2.502 0 50 GFAA Cc1ccccc1N1CCN(C(=O)C2(c3ccccc3)CCN(C)CC2)CC1=O 82108785 XJJJTLKROQHODO-UHFFFAOYSA-N 391.515 2.834 0 50 GFAA COc1ccc(CN(C)C(=O)c2cnc3cccc(C)n3c2=O)c2cccnc12 97653963 HQNMCLMGPCRBOU-UHFFFAOYSA-N 388.427 2.832 0 50 GFAA CC(=O)N[C@H]1CCN(C(=O)Nc2cc(C)nn2Cc2cccc(Cl)c2)C1 97522264 AIERXSIJFGCLGZ-INIZCTEOSA-N 375.860 2.636 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C3CCNCC3)C2)c(OC)c1 95523823 NMRBFLBZPCFFNA-KRWDZBQOSA-N 389.540 2.564 0 50 GFAA Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NCc1cccc(CN2CCOCC2)c1 180795366 QVBVWIGIMXMETK-HXUWFJFHSA-N 397.523 2.905 0 50 GFAA Cc1csc(NC(=O)[C@H](C)N2CCc3sc(C(=O)N(C)C)cc3C2)n1 244882520 XTIXEXAUHZNUDA-NSHDSACASA-N 378.523 2.600 0 50 GFAA O=C(CCn1cnc2ccccc21)NCC1(N2CCOCC2)CCCCCC1 827822263 ANEODMPCNCMFKP-UHFFFAOYSA-N 384.524 2.968 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)NC[C@@H](C(C)C)N3CCCC3)cc12 820696244 DAOVIYHCFNAFSR-SFHVURJKSA-N 377.510 2.648 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)c2nc(-c3ccn(C)n3)no2)cc1 864097588 XJSFQMRYGWCDLQ-MRXNPFEDSA-N 389.481 2.844 0 50 GFAA Cc1c(C(=O)N[C@@H](C)[C@H](N)c2ccco2)nnn1-c1ccc(Cl)cc1F 1875340726 OVTOXMQXOBFXNP-VFZGTOFNSA-N 377.807 2.780 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](C)c3ccccc3F)C2)c1C 1875397054 JECHITHBVYDKQU-HZPDHXFCSA-N 385.487 2.864 0 50 GFAA COc1cccc(CNCCN=c2cc[nH]cc2C)c1OCCCn1ccnc1 952984335 ZVRCGCHLWXDGAU-UHFFFAOYSA-N 395.507 2.688 0 50 GFAA Cc1nc2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@@H](O)C4)c3)cc2o1 280238232 HUPXTYGKLUEORB-QGZVFWFLSA-N 379.416 2.985 0 50 GFAA Cc1nn(C)c(C)c1C(=O)Nc1ncnc2c1c(C)c(C)n2C[C@H]1CCCO1 189898755 ZRRFITZYPKZZOH-OAHLLOKOSA-N 382.468 2.830 0 50 GFAA COc1cc(C(=O)N2CCCN(C(=O)c3ccco3)CC2)nc2ccccc12 1506427546 MPXPJJORQQLILD-UHFFFAOYSA-N 379.416 2.825 0 50 GFAA Cc1c(NC(=O)c2ccco2)cccc1C(=O)N1C[C@@H]2CCCN2C(=O)[C@H]1C 1772710677 ZJZBFTOPQUIHJA-CABCVRRESA-N 381.432 2.676 0 50 GFAA COc1cc(S(=O)(=O)N2CCC(c3ccnc(O)c3)CC2)c(C)cc1C 1772813803 VGLOTCUPNTUCLA-UHFFFAOYSA-N 376.478 2.981 0 50 GFAA CN(C)C[C@]12CNC[C@@H]1CN(C(=O)c1cccc(NCc3cccs3)c1)C2 1772707109 POFFVAMRLIHYQV-UTKZUKDTSA-N 384.549 2.583 0 50 GFAA CCOc1cc(/C=C2\SC(=N)NC2=O)cc(I)c1O 5005651 ZNHAWKGOTOEECZ-UITAMQMPSA-N 390.202 2.534 0 50 GFAA COC(=O)[C@@H](NC(=O)CCN1Cc2cc(Cl)ccc2O[C@@H](C)C1)C(C)C 12281712 YZGWBPYFGYIWID-UGSOOPFHSA-N 382.888 2.627 0 50 GFAA Cn1cc(CCNC(=O)c2coc(COc3cccc4cccnc34)n2)cn1 12570997 UZGXWGWHCXIJEX-UHFFFAOYSA-N 377.404 2.508 0 50 GFAA O=C(CCc1cnccn1)N1CCO[C@H](Cc2cccc(C(F)(F)F)c2)C1 12578053 VJPUCWXOBJQBEW-QGZVFWFLSA-N 379.382 2.898 0 50 GFAA Cc1cc(C)n(CCNC(=O)CCc2nnc(CCCc3ccccc3)o2)n1 12597477 OBZLOQZPUHBGGL-UHFFFAOYSA-N 381.480 2.807 0 50 GFAA COc1cccc(CCN[C@@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)c1 14753418 LWXMWLBLUDXCOW-GOSISDBHSA-N 396.535 2.744 0 50 GFAA CCn1c(SCC(=O)NC[C@@H]2CCCO2)nnc1-c1c[nH]c2ccccc12 17968273 DKXXRPQMNVGOAQ-ZDUSSCGKSA-N 385.493 2.834 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H](N(C)CCCN(C)C)C2)cc1Cl 19338499 PJYWIAMFZDOOLW-INIZCTEOSA-N 387.977 2.685 0 50 GFAA O=C1C[C@H](N2CCN(c3cccc(Cl)c3)CC2)C(=O)N1c1ccc(F)cc1 19782411 HGDVRYUQXFNFMW-SFHVURJKSA-N 387.842 2.933 0 50 GFAA CC(C)[C@H](NC(=O)c1ccc(Br)cc1)c1nc(-c2nnc[nH]2)no1 154666249 ORDQJJJIKCUMGB-NSHDSACASA-N 391.229 2.744 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCCNc3ncc(Cl)cc3Cl)n[nH]c21 1857531674 WRWZZXFGJARZGJ-BDAKNGLRSA-N 384.267 2.976 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)Cc2n[nH]c3ccccc23)[C@H]1c1ccccc1 1857687988 OIRHTTONPLUCJP-UNMCSNQZSA-N 378.476 2.636 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccnc4)[C@H]4CC[C@]3(C2)O4)c1F 1857712655 KVCQGIBTJUIZNU-DZCCDHAISA-N 395.478 2.939 0 50 GFAA Cc1c(C(=O)N2CCN3[C@@H](c4ccccc4)COC[C@H]3C2)[nH]c2c1C(=O)CCC2 1857734202 NSQGYDQOLLBPNQ-IEBWSBKVSA-N 393.487 2.740 0 50 GFAA Cc1c(O)cccc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857736578 SOYFXWXZHVCGHO-KPLVRAHFSA-N 378.428 2.615 0 50 GFAA CC[C@@]1(C(=O)N2CCCN(C)CC2)C[C@@H]2CC[C@H]1N2Cc1scnc1C 1875248071 WSFKIMQFJWLVSE-ILZDJORESA-N 376.570 2.749 0 50 GFAA O=C(O)CN(C(=O)c1ccc(Br)cc1Cl)C1CCOCC1 238108479 WZGVDTUUAVZBEY-UHFFFAOYSA-N 376.634 2.808 0 50 GFAA O=C(NCCC(=O)N1CC[C@@]2(CCCOC2)C1)NC12CC3CC(CC(C3)C1)C2 375387220 AMBADNBSQQPOFZ-UTANWOJPSA-N 389.540 2.674 0 50 GFAA COc1cc(NC(=O)[C@@H]2C[C@@]23CCOc2ccccc23)cc(S(C)(=O)=O)c1 375867807 RBBGZVLTJOEXQM-FXAWDEMLSA-N 387.457 2.778 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cccc(C)c3C)CC2)cc1 892707 RRDFNYQGQXQDCH-UHFFFAOYSA-N 387.505 2.773 0 50 GFAA CN(C)[C@H]1C[C@H]2C[C@@H](N(C)C(=O)c3c[nH]c(=N)nc3-c3ccccc3)C[C@H]2C1 2100482596 KYEJLSFQZXZVAI-USTZCAOPSA-N 379.508 2.747 0 50 GFAA CN1CCCN(C(=O)c2ccccc2NC(=O)c2ccc3cccnc3n2)CC1 2325757091 HHFIHXDIELPLEG-UHFFFAOYSA-N 389.459 2.660 0 50 GFAA CC(C)(CN1CCC(=O)N(C[C@]23CCC[C@@H]2C3(F)F)C1=O)C(=O)N1CCCC1 2325783673 SPCQTPFDXPCALF-IFXJQAMLSA-N 397.466 2.725 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2cccc(F)c2)cn1 2325786124 CROFAQZVGACBAJ-VHKYSDTDSA-N 396.422 2.779 0 50 GFAA O=C(NCCCC(=O)N1CCc2sccc2C1)NC12CC(C(F)F)(C1)C2 2325795866 BEOSPQQXFLXGBO-UHFFFAOYSA-N 383.464 2.900 0 50 GFAA CO[C@@H]1COCC[C@@H]1Cn1nnnc1N1CCC[C@H](CCCc2ccccc2)C1 2325842335 VDJMIJUIBMMUDF-PWRODBHTSA-N 399.539 2.964 0 50 GFAA C[C@H]1CC(C(=O)N2CCCC[C@H](NC(=O)c3cccc(C(N)=O)c3)C2)C[C@H](C)C1 2325864554 SLFLNYWWRYVDKW-QINHECLXSA-N 399.535 2.969 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)NCc2ccc(-c3noc(C)n3)cc2)cc1 2325888290 CUWNKEVJSRYWOH-UHFFFAOYSA-N 376.416 2.777 0 50 GFAA O=C(N[C@@H]1CC2(CN(Cc3cccnc3)C2)n2ccnc21)[C@@H]1C[C@H]1c1ccccc1 2332237896 PYTMEJHMSVFAJD-PWRODBHTSA-N 399.498 2.854 0 50 GFAA O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1)NC[C@@H]1CCCO1 802398 IQJRCDNFDJZQPC-INIZCTEOSA-N 395.484 2.773 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OC(C)C)[C@@H]1c1cccc(F)c1 864377 BUIRXUKDPLWXQU-IKVWTGGYSA-N 394.439 2.769 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 1009631 AGBRNNFXUULIMS-CPUCHLNUSA-N 382.313 2.930 0 50 GFAA COc1ccc(OC)c(NC(=O)CSc2nnc(-c3ccc(N)cc3)n2C)c1 2836795 ZBEKISAFIOZVFQ-UHFFFAOYSA-N 399.476 2.812 0 50 GFAA O=S1(=O)CC[C@H](NC(=S)SCc2ccccc2Br)C1 4531301 UTLJHPMPJMKBNK-JTQLQIEISA-N 380.354 2.744 0 50 GFAA CCc1ccccc1-n1nnnc1SCC(=O)Nc1ccc2nccnc2c1 5346033 NQPBOCRVOWISFG-UHFFFAOYSA-N 391.460 2.899 0 50 GFAA CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)NC)cc2)cc1 7054921 LIVBLANDAOXWDA-ZDUSSCGKSA-N 382.507 2.909 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)N[C@@H]1CCCN(CCc2ccccc2)C1 11878353 KZVKYXKUEVMIJR-LJQANCHMSA-N 392.503 2.543 0 50 GFAA O=C(CCc1nnc(CCCc2ccccc2)o1)NCc1n[nH]c2c1CCC2 12306034 VTUNGDSQRHLAGH-UHFFFAOYSA-N 379.464 2.706 0 50 GFAA O=C(NCCCc1cccnc1)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12308034 HDNOVZVBMKAWFN-IBGZPJMESA-N 383.467 2.751 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC(N3CCC(C(=O)NC(C)C)CC3)CC2)o1 12454151 JMPODLQZUMSVBA-UHFFFAOYSA-N 375.513 2.738 0 50 GFAA COc1cc2c(cc1OC)CN([C@H]1CCCN(C(=O)c3ocnc3C)C1)CC2 12588790 CSSWYKPOBDPXOU-KRWDZBQOSA-N 385.464 2.663 0 50 GFAA Brc1cc2c(cc1COc1ccc(-c3nn[nH]n3)cc1)OCO2 12731140 GXMNZRHVGRULQD-UHFFFAOYSA-N 375.182 2.937 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)N(C)Cc2ccccc2)c1=O 14971943 SNKJNSMAMBKQEG-UHFFFAOYSA-N 381.476 2.985 0 50 GFAA O=C(NCc1ccco1)c1ccc([C@@H]2CCCN2C(=O)Cn2cccn2)s1 20536845 IWTBFOSSIXJTFB-HNNXBMFYSA-N 384.461 2.831 0 50 GFAA CN1CCN(CC(=O)Nc2nc(-c3ccc(Br)cc3)cs2)CC1 23095659 VPWBMPVZIUPTCV-UHFFFAOYSA-N 395.326 2.759 0 50 GFAA CN(Cc1cccs1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71763481 SIUXSDCUTMCZIG-KRWDZBQOSA-N 389.565 2.820 0 50 GFAA CC(C)(C)NC(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72130799 MLKUKEXEQNPDIZ-OAQYLSRUSA-N 393.531 2.924 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)c1 72469548 GYJBKZUYEZTZLI-FQEVSTJZSA-N 380.488 2.921 0 50 GFAA CCn1c(N)nc2cc(C(=O)NC3CCN(c4cccc(C)c4)CC3)cnc21 77340644 LMBNUVKZHVIQDV-UHFFFAOYSA-N 378.480 2.741 0 50 GFAA CN(CC(=O)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2)Cc1ccccn1 95354573 KFKSHDGOQFYZIY-IFMALSPDSA-N 378.520 2.636 0 50 GFAA COc1ccc2c(C)c(C(=O)N3C[C@H]4CC[C@@H]3CN(C(=O)N(C)C)C4)oc2c1 95367219 APXPOHUZOPMAHJ-LSDHHAIUSA-N 385.464 2.968 0 50 GFAA Cc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(F)cc2)C3)c(=O)n1C 95374418 BYIMXDMKQWMMRS-PKOBYXMFSA-N 383.467 2.569 0 50 GFAA CS(=O)(=O)Nc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1 95497916 OVAIERJLXSNZRN-UHFFFAOYSA-N 380.514 2.540 0 50 GFAA Cc1noc(-c2ccc(N3CCC[C@@H](c4nccn4CCN(C)C)C3)nc2)n1 95512638 PNLSTKZGDCOMQR-QGZVFWFLSA-N 381.484 2.582 0 50 GFAA Cc1c(CC(=O)N[C@@H]2CCNC2)c2c(n1Cc1ccccc1F)CCCC2=O 95518601 FIOCOHGDGITQBE-MRXNPFEDSA-N 383.467 2.524 0 50 GFAA CCn1nc(-c2csc(C)n2)nc1C1CCN(C(=O)[C@@H]2CCCO2)CC1 96140782 NOPKIPLXUDCGHQ-HNNXBMFYSA-N 375.498 2.615 0 50 GFAA CCN(CC)CCCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@@H](C)CC3 100663162 JVKBVLNPPVEOHA-ZDUSSCGKSA-N 389.471 2.815 0 50 GFAA CN(C)C(=O)N1CCC(c2nc(-c3ccc(N4CCCCC4)nc3)no2)CC1 109567406 REHHNALRRXHBTR-UHFFFAOYSA-N 384.484 2.983 0 50 GFAA Cn1ccnc1-c1csc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)n1 125710774 IGVYDJMJIMMURG-MRXNPFEDSA-N 395.488 2.716 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)CC1 127898939 AODWEXXFOHIERS-AWEZNQCLSA-N 396.894 2.568 0 50 GFAA CCCCN1C(=O)C[C@H](C(=O)/N=c2\sccn2C)[C@@H]1c1ccc(OC)cc1 139403359 PUNBTRWTKOQMSJ-HTXRYDERSA-N 387.505 2.912 0 50 GFAA COc1ccnc(N2CCN([C@H](C)c3nc(-c4ccc(C)c(F)c4)no3)CC2)n1 140257651 JVOCEDHGNCXJPW-CQSZACIVSA-N 398.442 2.866 0 50 GFAA CCc1nc(C)c([C@@H](C)N(C)S(=O)(=O)c2cnc3c(c2)c(C)nn3C)s1 173229793 QSEBGUSAQBJCSO-GFCCVEGCSA-N 393.538 2.986 0 50 GFAA Cc1cc(N2CC[C@@H](Nc3ccc(C(=O)NC4CCCC4)cc3C)C2=O)n(C)n1 177167417 XZUOPKZBRIBBTC-LJQANCHMSA-N 395.507 2.927 0 50 GFAA COc1cccc(CCC(=O)N2C[C@@H]3CC[C@H]2CN(Cc2[nH]cnc2C)C3)c1 248031125 LTLPJEWRYZOKBK-MOPGFXCFSA-N 382.508 2.782 0 50 GFAA CC1(C)[C@@H]2C[C@@H]1CC(=O)[C@]2(C)OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 252485011 GMFYNJHSTOUGIQ-YFWQCPHISA-N 394.537 2.649 0 50 GFAA C[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C[C@H]1C(=O)O 263030343 RWBHCNVTBCDYMT-KMUNFCNLSA-N 399.274 2.777 0 50 GFAA CO[C@]1(C)CCCN(C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)CC1 280460560 AKJMUSJVECPQHX-LJQANCHMSA-N 395.525 2.859 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2csc(C)n2)nc(C)n1 328606590 SBYHGGATDQOWDL-HOCLYGCPSA-N 377.489 2.543 0 50 GFAA O=C(Nc1n[nH]c(-c2ccccc2Cl)n1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 363437078 OVRZAYNSTLYPNV-GFCCVEGCSA-N 396.838 2.507 0 50 GFAA CCOc1ccc(NC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1OC 363733425 XMXMGIJVAIYXCB-INIZCTEOSA-N 384.436 2.806 0 50 GFAA COCc1cc(NC(=O)C(=O)N2CCC3(CC2)C2CC4CC(C2)CC3C4)ncn1 373706909 IDGMJUKQOITMDC-UHFFFAOYSA-N 398.507 2.626 0 50 GFAA O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC[C@@H]1Cn1cnc2ccccc21 901211784 HSQCAJURFXOMQM-OAHLLOKOSA-N 375.432 2.710 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1cc(Cl)ccc1C(=O)[C@@H]1CCOC1)C1CC1 952832855 AUYVRNAJZBKVOY-MLGOLLRUSA-N 387.885 2.726 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC(CNC(=O)c3ccco3)CC2)c(C)s1 952981295 SKQYGBVHMZLKDC-UHFFFAOYSA-N 382.507 2.789 0 50 GFAA COc1cc(-c2onc(NCCCN3CCCC3=O)c2C(=O)O)ccc1F 1704332128 PEXAFMGAQWLOBL-UHFFFAOYSA-N 377.372 2.612 0 50 GFAA c1ccc(-c2ncc3c(n2)[C@@]2(CCCN(CCN4CCOCC4)C2)CC3)cc1 1704336128 GGNAMOJMGRAXMT-QHCPKHFHSA-N 378.520 2.756 0 50 GFAA NCC(=O)N1C[C@H]2CN(C(=O)CCC3CCCC3)C[C@]2(CCc2ccccc2)C1 1772701049 MDAZQHYEDXHXLE-ZJSXRUAMSA-N 397.563 2.835 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCc1noc(C2CCC2)n1 1857667695 OVGJAZLGCYERDB-CYBMUJFWSA-N 396.451 2.796 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(c3ncc(Cl)cc3F)C1)CC2 1857667786 ZJYVISNVMXJNLA-SFHVURJKSA-N 377.851 2.920 0 50 GFAA COc1cc2c(cc1-c1nccn1Cc1nc(-c3cccnc3)no1)OCCO2 1857691149 WDMUIJWAXMQMGP-UHFFFAOYSA-N 391.387 2.823 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4cccnc4)C[C@]34CC[C@H]2O4)cc1 1857710025 DSOXZJFBELUWGE-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA Cc1ccc(-c2csc(=O)n2CC(=O)N2C[C@H]3CCCC[C@]3(CN)C2)cc1 1875287431 KHSATXRXUFYUNY-UTKZUKDTSA-N 385.533 2.863 0 50 GFAA C[C@@H](N=c1[nH]ccn2nc(-c3ccccc3)cc12)c1cccc(S(N)(=O)=O)c1 1875324464 ZUXVLKSOHMTMTC-CQSZACIVSA-N 393.472 2.639 0 50 GFAA O=C(O)C[C@H](NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)O 1875345652 DZWVVEOSFALQLP-VIFPVBQESA-N 389.216 2.775 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@H](c2cccc(F)c2)c2cnn(C)c2)CC1 1875370546 SWMOHGPDAAPKNV-HXUWFJFHSA-N 384.455 2.532 0 50 GFAA CCc1nc(C)c(C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C(C)C)cc2O3)o1 1875394757 VWSDDJNIZJJDJE-AWEZNQCLSA-N 388.468 2.814 0 50 GFAA O=C(C[C@@H]1CN(C(=O)c2ccccc2)C2(CCC2)CO1)N1CC[C@@]2(CCCO2)C1 2325785302 PAWUENTUBNVIPI-XXBNENTESA-N 398.503 2.622 0 50 GFAA CC1(C)CO[C@@H](CCC(=O)N[C@H]2COCC[C@H]2NC(=O)[C@H]2CC[C@H](C)CC2)C1 2325794985 ZAAGNMUSTIVAKR-FKSLSLAPSA-N 394.556 2.798 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2cnn(-c3cccc(F)c3)c2)C1=O 2356138487 NEVGASHFISOEQF-NRFANRHFSA-N 386.471 2.615 0 50 GFAA c1cnc2c(OCc3cccc4ncnn34)ccc(CN3CCOCC3)c2c1 2356158593 QHSZJVSQDWQXEZ-UHFFFAOYSA-N 375.432 2.689 0 50 GFAA COCCCNC(=O)CN(c1cc(C)ccc1C)S(=O)(=O)c1ccccc1 2072039 XNAIVLIEHQOAGE-UHFFFAOYSA-N 390.505 2.651 0 50 GFAA Cc1ccccc1NC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cccc(Cl)c1 2200528 MZVIMDOZWBTGOT-KRWDZBQOSA-N 385.851 2.618 0 50 GFAA CCOc1ccccc1N(CC(=O)NC(C)C)S(=O)(=O)c1ccccc1 2936046 CKKYKSQHWRQIRH-UHFFFAOYSA-N 376.478 2.805 0 50 GFAA CC(=O)N1CCN(C(=O)[C@H]2CC(C(c3ccccc3)c3ccccc3)=NO2)CC1 12181826 QSDLUXLQPJCTLT-OAQYLSRUSA-N 391.471 2.654 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NC2Cc3ccccc3C2)c1=O 12218438 HILWYIAQFFIJQE-UHFFFAOYSA-N 393.487 2.610 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@]1(O)CN1CCC(N2CCCC2)CC1 14981214 HIBHIIONFIHUCT-DEOSSOPVSA-N 399.579 2.533 0 50 GFAA CC(=O)c1ccc(N2CCC(n3cc([C@H](O)c4ccccc4)nn3)CC2)nc1 19148029 VGVGYBDODCYRMJ-OAQYLSRUSA-N 377.448 2.799 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)c2c[nH]nc2C)CC1 19781616 WXYWOAHXGZGUNS-UHFFFAOYSA-N 385.464 2.755 0 50 GFAA CCCn1c2ccc(F)cc2c2nnc(SCCN3CCOCC3)nc21 20029448 QFYIRIKOYQAITC-UHFFFAOYSA-N 375.473 2.953 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC(n2cc(-c3cccnc3)nn2)CC1 48187533 BJWDGIMNRKNMDZ-UHFFFAOYSA-N 377.404 2.546 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl)NCC1CCCCC1 55169094 ASFGJFUCZMKLPT-SFHVURJKSA-N 395.906 2.866 0 50 GFAA COc1cccc(-n2cc([C@@H](C)NC(=O)c3cccc(NCC(=O)O)c3)cn2)c1 55359360 MYYROSBPKYZNFX-CQSZACIVSA-N 394.431 2.868 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N[C@H]2CCCC[C@@H]2O)nc1 67964881 JMJRGGXZZUUDCR-ROUUACIJSA-N 385.512 2.937 0 50 GFAA Cc1nc(N)ncc1C(=O)N1CCCN(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71774540 GKDDARSCFVLVSH-LJQANCHMSA-N 385.487 2.879 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NS(=O)(=O)c3cn(C)cn3)C2)cc1 72128200 ZHHMUYIEABLXKI-LJQANCHMSA-N 390.553 2.562 0 50 GFAA COc1ccc(-c2nccn2[C@@H]2c3ccccc3C[C@@H]2O)cc1Cn1cncn1 77321227 KWHVKASVQKZROE-PZJWPPBQSA-N 387.443 2.705 0 50 GFAA COc1cccc(CN2CC3(CCN(Cc4cccnc4N)CC3)CC2=O)c1 77340173 RZEVTHYYAKUBHF-UHFFFAOYSA-N 380.492 2.687 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)o1 82137799 UTILAHYONRHMSI-OAQYLSRUSA-N 383.448 2.728 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 91548713 VKVSUIAZQVFNFB-GYVBGXKYSA-N 381.520 2.948 0 50 GFAA COCCC[C@]1(C(=O)O)CCCN(C(=O)c2cc3c(cc2OC)CCC3)C1 92028987 DOSIOKQLAOLIGN-OAQYLSRUSA-N 375.465 2.918 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC(c2nccn2Cc2ccncc2)CC1 95496759 ZGGQCGNZYNYLME-UHFFFAOYSA-N 376.460 2.981 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)c3cnc(C)nc3)C2)cc1 95527686 UYEGHRTUIYDYJD-LJQANCHMSA-N 382.508 2.820 0 50 GFAA Cc1ccc(N2C(=O)C[C@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c(C)c1 97759514 XOLBQZSYCYVOQJ-FQEVSTJZSA-N 381.451 2.897 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCO[C@@H](c2nccs2)C1)c1c(F)cccc1F 110883364 WCSAWRGXZAMTJR-HUUCEWRRSA-N 395.431 2.589 0 50 GFAA CC(=O)N[C@H]1CCCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 118775744 GJCUQNWDDNNGJC-LBPRGKRZSA-N 392.809 2.683 0 50 GFAA O=C(Cc1ccn[nH]1)N[C@@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1 121504446 IOTPHBBXVVACJL-MRXNPFEDSA-N 376.416 2.666 0 50 GFAA CCOC(=O)CC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1 145834841 QMFIAXPHJVQYIX-INIZCTEOSA-N 393.436 2.536 0 50 GFAA CC(C)CNC(=O)c1ccc(Cn2ccn3nc4c(c3c2=O)CCCC4)cc1 169760213 SZDVPJRGVGIITB-UHFFFAOYSA-N 378.476 2.809 0 50 GFAA CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)c1 170600206 LRAMVDKHWQSYRU-PBHICJAKSA-N 392.521 2.502 0 50 GFAA CCc1nnc(-c2ccc(NC(=O)NC3CCN(c4ncccn4)CC3)cc2)o1 176017702 DSHDVDXUUGHDRD-UHFFFAOYSA-N 393.451 2.880 0 50 GFAA COc1ccc(CCNC(=O)N2C[C@@H](OC)C[C@@H]2c2nc(C)no2)c(Cl)c1 190133282 GOIMVVPBGFJRHH-GOEBONIOSA-N 394.859 2.754 0 50 GFAA CCN(C1CCN(C(=O)Nc2ccc3sncc3c2)CC1)S(C)(=O)=O 194242134 XRGBPISTOBZSDN-UHFFFAOYSA-N 382.511 2.574 0 50 GFAA CCC(CC)C(=O)N1CCC(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)CC1 194271367 GCQUXOKKPFBGRA-HXUWFJFHSA-N 399.535 2.835 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC(=O)[C@@H](C)N3CCc4ccccc43)cn2)n1 195082232 LOGWLOHEENUKHY-QGZVFWFLSA-N 375.476 2.952 0 50 GFAA O=C(NC1CCN(CC(F)(F)F)CC1)c1cccc(NC(=O)[C@H]2CCCO2)c1 195146639 HERJFNOKWHUEFT-MRXNPFEDSA-N 399.413 2.561 0 50 GFAA CC(=O)N[C@H]1CN(C(=O)c2c(C)nc3ccccn23)C[C@@H]1c1ccc(C)cc1 213435262 MCWXUFYEFFIPGD-MOPGFXCFSA-N 376.460 2.695 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@H](c3cnc4ccccc4n3)C2)cc1 225505125 VRQRZHUPESTEQO-IBGZPJMESA-N 382.445 2.749 0 50 GFAA CC(C)Oc1ccc(F)cc1NC(=O)NCC1(O)CN(C(=O)OC(C)(C)C)C1 225852592 HNDSLUYVGCHDIN-UHFFFAOYSA-N 397.447 2.716 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCC(C(=O)O)(c2ccccc2)CC1 237457800 PVAIIHHRGSNRBM-OAHLLOKOSA-N 383.492 2.861 0 50 GFAA Cc1nc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)nn1-c1ccccc1Cl 237681218 MHQRHQCJQIORRH-QGZVFWFLSA-N 396.834 2.881 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)CCO1 238064214 NWDMFEIVVQCRAO-INIZCTEOSA-N 383.448 2.592 0 50 GFAA COc1cc([C@@H](C)N[C@H]2CCCN(c3cccnc3)C2=O)cc(OC)c1OC 240540888 GPYSUEWPJNFKMS-PBHICJAKSA-N 385.464 2.954 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cn(-c3ccc(Br)cc3)cn2)C1 272073895 ZWBMTTZYPZKESY-LLVKDONJSA-N 378.226 2.572 0 50 GFAA O=C(CCCCCc1ccc(F)cc1)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 274989780 AYWCOVIMPQNKAK-QUCCMNQESA-N 397.512 2.781 0 50 GFAA C[C@H]1CCCN(C(=O)C2CCN(C(=O)N[C@H]3CCN(c4ccccc4)C3)CC2)C1 363392380 HGLYOWFXRQGLAR-ICSRJNTNSA-N 398.551 2.945 0 50 GFAA COc1nccnc1-c1ccc(C(=O)NCC2(Cn3ccnc3C)CC2)cc1 426442479 DBKBLKIJCKPOSL-UHFFFAOYSA-N 377.448 2.867 0 50 GFAA Cc1cc2nc(CCC(=O)N3CCCO[C@H](Cn4cccn4)C3)[nH]c2cc1C 426623185 HKYMBUGFRKUNRE-KRWDZBQOSA-N 381.480 2.627 0 50 GFAA O=C(c1ccc(-c2cccc(O)n2)cc1)N1CCCO[C@@H](CN2CCCC2)C1 426728083 AAGBFOHSAGXZMJ-IBGZPJMESA-N 381.476 2.781 0 50 GFAA COc1ccc(CNS(C)(=O)=O)cc1NC(=O)N1CC2(CCC2)C[C@H]1C 455825501 LRQASJSVSULBAI-CYBMUJFWSA-N 381.498 2.541 0 50 GFAA CNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)c1 584901951 XKQNOFGGJJPNIL-MRXNPFEDSA-N 385.489 2.912 0 50 GFAA O=C(Cc1cc(Br)ccc1Cl)N1CCc2ncnc(O)c2C1 907104385 LNMJRJHTWTVSQA-UHFFFAOYSA-N 382.645 2.726 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N[C@@H](C)c1cc2n(n1)CCCC2 912034611 ASRKVPVJRHAYMR-AWEZNQCLSA-N 375.494 2.894 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC2CCOCC2)ccc1F 1704306510 NZXQTMLXVUGKHW-UHFFFAOYSA-N 377.416 2.712 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N[C@@H](C)C(C)(C)O 1704327443 FHTPVKSUCYRYID-NSHDSACASA-N 381.860 2.943 0 50 GFAA COc1ccc([C@H](CC(=O)NC[C@@H](C)O)c2ccc3cccnc3c2O)cc1 1848443400 OEXICGODEIUYPY-KUHUBIRLSA-N 380.444 2.968 0 50 GFAA CN(C)c1nc(N2CCCCC2)c2c(n1)C1(CC2)CCN(C[C@@H]2CCCO2)CC1 1857694483 PNCMNCMREGIVNT-SFHVURJKSA-N 399.583 2.992 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CC[C@@]45OCCN4C(=O)C[C@@H]35)cc2)c1 1857716294 GCUDQMBVDYOADO-KNQAVFIVSA-N 378.428 2.536 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCN4CCCC4)C3)nc2c1 1875246108 YYPKYHPWHIHADN-INIZCTEOSA-N 386.496 2.655 0 50 GFAA CC1(CN)CCN(C(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)CC1 1875292740 RHUKRGFTEFVMMN-HXUWFJFHSA-N 379.504 2.615 0 50 GFAA C[C@@H]1c2cc(O)ccc2CCN1Cc1nc(Nc2ccc(F)cc2)[nH]c(=N)n1 2325756512 AMUYTSKXAVHHFS-GFCCVEGCSA-N 380.427 2.992 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cccc(-c2cnco2)c1 2325785683 IXNNEDUHLYDKKZ-JCURWCKSSA-N 386.839 2.761 0 50 GFAA O=C(c1ccc(Br)cc1Br)N1CCN[C@@H](CF)C1 2325792416 ZOVOEAQWNIVTFK-VIFPVBQESA-N 380.055 2.595 0 50 GFAA COC(=O)c1cc(C2CN(Cc3ccc(-n4cc(Cl)c(C)n4)cc3)C2)[nH]n1 2325856972 KPAMRGVHNCMGLY-UHFFFAOYSA-N 385.855 2.943 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N3CCC[C@H](CS(C)(=O)=O)C3)cc2)c1C 2356137893 ABBSLOBTMAULRM-INIZCTEOSA-N 387.505 2.657 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(c2noc(-c3ccccc3)n2)CC[C@H]1O 2356155787 MSUCLUJWGXUKPK-DYESRHJHSA-N 379.416 2.621 0 50 GFAA O=C(CCc1cn[nH]c1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356141710 MNCJXQJVBWJPFG-JOCHJYFZSA-N 380.492 2.569 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2Cc2ccc(OCC(N)=O)c(Cl)c2)C1=O 2356168585 JYFKEIVPKCGPOU-HXUWFJFHSA-N 393.915 2.570 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc(C)n1 2356169993 PQDCSHHTYFIJDV-WOIUINJBSA-N 385.508 2.599 0 50 GFAA COCCNC(=O)[C@H](CSCc1ccccc1)N1Cc2ccccc2C1=O 4935061 RENJTWZHTMPQRI-IBGZPJMESA-N 384.501 2.707 0 50 GFAA O=C(O)c1ccc(OCc2nnnn2-c2ccc(Br)cc2)cc1 6759666 WNVNWBYPYUCDLM-UHFFFAOYSA-N 375.182 2.702 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)C[C@H]2CCO)cc(OC)c1 104316409 ANSQCCOWMWJIPI-OAQYLSRUSA-N 384.520 2.815 0 50 GFAA c1ccc([C@@H]2CCCN(CCn3ccnc3-c3cc4n(n3)CCNC4)C2)cc1 72469530 HQPBKZKUWTZHDY-LJQANCHMSA-N 376.508 2.729 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@@H](c1ccc(F)cc1)CC(=O)N2 33271381 WPLWKMYJHXBVAP-CQSZACIVSA-N 377.383 2.540 0 50 GFAA C[C@H](NC(=O)c1cccnc1S)c1cc(F)ccc1N1CCC(O)CC1 128065003 VKFYUCNCVNBWBO-LBPRGKRZSA-N 375.469 2.962 0 50 GFAA O=S(=O)(CCC1Cc2ccccc2C1)N1CCC[C@](O)(C(F)(F)F)CC1 377835678 VUBDAQULPUNFBM-QGZVFWFLSA-N 391.455 2.901 0 50 GFAA CCOc1ccc(C(=O)N2CCN(c3cc(N4CCCCC4)ncn3)CC2)cc1 38528421 DKYXXMDJQRCPMW-UHFFFAOYSA-N 395.507 2.828 0 50 GFAA Cc1cnc(C2CCN(C(=O)N[C@H]3CCCN(c4cccnc4)C3=O)CC2)s1 372978891 JWYPDHWZJJLXJX-KRWDZBQOSA-N 399.520 2.931 0 50 GFAA COc1c[nH]c(C(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1=O 71771288 OFTIAODYAQYYDJ-INIZCTEOSA-N 383.231 2.904 0 50 GFAA Cc1ccc(-c2cc(C(=O)Nn3c(S)nc4ccccc4c3=O)n[nH]2)cc1 13959813 BKTGERNOTFLTJN-UHFFFAOYSA-N 377.429 2.768 0 50 GFAA CC(C)Cn1c(CC2(CC(=O)N3CCNC(=O)C3)CCCC2)nc2cccnc21 77518061 KMVNXWXUAPQPSG-UHFFFAOYSA-N 397.523 2.539 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1 46506907 BVFWQIVKWBKWTK-QGZVFWFLSA-N 375.446 2.900 0 50 GFAA CCOC(=O)[C@@H](Oc1ccccc1OC)[C@@H](O)c1ccc(OC)c(OC)c1 196166516 WXFAFGNQMYMUDX-OALUTQOASA-N 376.405 2.757 0 50 GFAA CC(C)N1CCC[C@H](CNC(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)C1 291112942 XDPXYCQWIJHKGI-KNQAVFIVSA-N 391.531 2.883 0 50 GFAA COc1ccc(S(=O)(=O)NCc2nnc(-c3ccccc3)o2)cc1Cl 41134314 JLYPOMUBEKKBQX-UHFFFAOYSA-N 379.825 2.877 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)C(=O)c1cc(-c2cccc(OC)c2)n[nH]1 91616549 HVXOMDNPPBPTSK-HXUWFJFHSA-N 381.432 2.987 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccc(S(=O)(=O)c2ccccc2)cc1 239165191 NQTONIPXSJDBHR-YXUGBTPSSA-N 379.437 2.831 0 50 GFAA OC[C@@H]1CN(Cc2cccnc2)CCC12CCN(Cc1cccc(O)c1)CC2 97413401 AXAQYMQFULSKDU-NRFANRHFSA-N 381.520 2.884 0 50 GFAA CC(=O)c1ccc(CN2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)cc1 95361470 YCXYWIBXKZMUOQ-IBGZPJMESA-N 378.480 2.642 0 50 GFAA CC(C)c1cc(NC(=O)NCCCN2CCN(C)CC2)n(-c2ccccc2)n1 97797548 NAXHYJFNJQVPKK-UHFFFAOYSA-N 384.528 2.755 0 50 GFAA CCc1nnc(NC(=O)CCN2CC[C@]3(CC(=O)c4ccccc4O3)C2)s1 244763910 OXSPKUKKIAZPPZ-IBGZPJMESA-N 386.477 2.539 0 50 GFAA CCN1CCN(CCCCNC(=O)NCc2nc3ccccc3n2C2CC2)CC1 184768401 BJXSPFPNMAJCPF-UHFFFAOYSA-N 398.555 2.588 0 50 GFAA O=c1c2cc(-c3cccs3)nn2ccn1C[C@@H](O)c1ccc2c(c1)OCO2 263616684 KASBLAKKFUSYMQ-OAHLLOKOSA-N 381.413 2.687 0 50 GFAA O=C(Cn1cnc2ccsc2c1=O)Nc1ccccc1OC[C@H]1CCCO1 827861318 CLXYQJCFXQRENF-CYBMUJFWSA-N 385.445 2.655 0 50 GFAA O=C(N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)NC1(CO)CCCCCC1 584899487 KSBFTSNTIUZROK-CQSZACIVSA-N 379.888 2.830 0 50 GFAA Cc1c(NC2CCN(C[C@@H]3CCOC3)CC2)nn2c(C(F)(F)F)nnc2c1C 269344577 DDIRYTDYGJGMPL-ZDUSSCGKSA-N 398.433 2.673 0 50 GFAA Cc1cc(NC(=O)N(Cc2ccccc2)C[C@]2(O)CN3CCC2CC3)sn1 1875340028 IQWYMVLQJZHRRN-HXUWFJFHSA-N 386.521 2.942 0 50 GFAA Cc1ccc(F)c(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397318 VWKQAHCYEIBFDL-QGZVFWFLSA-N 385.487 2.611 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@H]2CCCN(Cc3noc(CC(C)C)n3)C2)o1 952861836 LDZZJIKCSOKPOO-OAHLLOKOSA-N 375.473 2.515 0 50 GFAA C[C@@H]1C[C@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCO1 271477102 CVTMKIRMQLKVCC-QFUCXCTJSA-N 389.540 2.546 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(CC[C@@H]1CCOC1=O)CC2 276402453 KMDPWPAEVCCAHG-MSOLQXFVSA-N 376.522 2.904 0 50 GFAA Cn1cc([C@H]2C[S@](=O)CCN2C(=O)c2ccc(CCC(F)(F)F)cc2)cn1 277839978 ZWWUHNXIHAFUHR-CHAGWJKLSA-N 399.438 2.861 0 50 GFAA CC(C)(C)c1ccc(Cn2nccc2NC(=O)N2CC[C@@]3(CNC(=O)C3)C2)cc1 278853373 QMRITNFMNIXTDP-JOCHJYFZSA-N 395.507 2.973 0 50 GFAA CCO[C@H]1C[C@](NC(=O)/C=C/c2ccc(NC(C)=O)cc2)(C(=O)OC)C1(C)C 170602671 KJXCXIJMWIZGQE-LWYBDQPUSA-N 388.464 2.521 0 50 GFAA CN(Cc1ccccc1N1CCOCC1)C(=O)c1cc2ccccc2c(=O)o1 280796085 LQCLYFTVGJUFPA-UHFFFAOYSA-N 378.428 2.902 0 50 GFAA O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)c1cc2sccc2[nH]1 192211405 FUMZUHMVLILOLV-UHFFFAOYSA-N 375.475 2.699 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2nnc(-c3ccccc3)o2)CC[C@@H]1O 1529181233 KWFAWAAAJYFUMV-SIKLNZKXSA-N 379.460 2.525 0 50 GFAA CC1=C(CCN2CCCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)C(C)(C)CCC1 1529120326 XBBHEUYPURXRNO-GOSISDBHSA-N 375.557 2.964 0 50 GFAA CNc1nc(C)cc(N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)n1 1704312819 ZUZPYCSZJVGYDR-UHFFFAOYSA-N 384.480 2.912 0 50 GFAA Cc1nnc(NC(=O)Cn2nc(-c3ccc4ccccc4c3)ccc2=O)s1 5399045 CHOCPGUMVUGMGI-UHFFFAOYSA-N 377.429 2.862 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NC[C@H]2C[C@@H]3C=C[C@H]2C3)c1=O 12279218 XCAYTTUMOPDGSJ-OWCLPIDISA-N 383.492 2.655 0 50 GFAA COCCC(=O)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1 12578642 AHTHSHBTIYABAR-FQEVSTJZSA-N 379.589 2.992 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 14950760 LLOHWHMIWGENGS-HXUWFJFHSA-N 389.402 2.916 0 50 GFAA CN(Cc1ccccc1)C1(C(=O)NCCc2cnn(C)c2)Cc2ccccc2C1 14960713 QMBYGNLSODKITB-UHFFFAOYSA-N 388.515 2.748 0 50 GFAA CSc1nnc(CNC(=O)CSc2ccccn2)n1Cc1ccccc1 14995678 PXQGRXJJRHLYCS-UHFFFAOYSA-N 385.518 2.852 0 50 GFAA O=C(CCc1nnc(COc2ccccc2)o1)NCc1ccc2c(c1)OCO2 19224637 FXXZMBWJHMODJR-UHFFFAOYSA-N 381.388 2.626 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCO)CC[C@@H]1Nc1ccc(C(F)(F)F)cn1 1857681913 DQSDAJUDFPKMPE-QEJZJMRPSA-N 389.418 2.585 0 50 GFAA COC(=O)c1cccc(CN2CCc3c(-c4ccccc4)nn(C)c3CC2)n1 1857698149 FUTQKCZHFVWQQI-UHFFFAOYSA-N 376.460 2.870 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)N2CCCN(C)CC2)cc1OC 1857703999 ZEEQHPZFZVLOCI-UHFFFAOYSA-N 399.491 2.733 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cccc3c2CCC3=O)[C@H]1c1ccccc1 1857715551 WVOYMILBICUHLA-VXKWHMMOSA-N 378.472 2.959 0 50 GFAA CC(=O)N1CCN(c2nnc(C3CC3)n2C[C@H]2CCCO2)CC12CCCCC2 328802603 CGEYTMQRLYFTBJ-GOSISDBHSA-N 387.528 2.706 0 50 GFAA CCc1oc2ccccc2c1C(=O)N(CCCN(C)C)[C@@H]1CCS(=O)(=O)C1 155458431 MOEDEMWSFZNQSS-OAHLLOKOSA-N 392.521 2.576 0 50 GFAA O=C1N=CC=C[C@H]1c1noc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)n1 904753337 DOVNOVQDCIPMBX-KRWDZBQOSA-N 397.394 2.746 0 50 GFAA COCCCOc1ccc(C(=O)N=[S@](C)(=O)c2ccc(OC)cc2)cn1 925984348 JARREAVBNJKTCV-AREMUKBSSA-N 378.450 2.803 0 50 GFAA O=C(Nc1cnc(Cc2ccc(F)cc2)nc1)c1coc(C2CCNCC2)n1 2325778365 VPEIBXWUBQHROL-UHFFFAOYSA-N 381.411 2.914 0 50 GFAA CNc1c(C(=O)N2CCN(CCc3cccs3)CC2)sc2nccnc12 2325785022 ZZCWKIRODPCRQG-UHFFFAOYSA-N 387.534 2.795 0 50 GFAA O=C1CC[C@@]2(CCN(C(=O)c3[nH]c(Cl)c(Cl)c3Br)C2)N1 2325805456 JSIPRQJZEJGAGH-LBPRGKRZSA-N 381.057 2.579 0 50 GFAA COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1cccc(OC)c1OC 861524 VXRMRSYIJXUOHL-UHFFFAOYSA-N 375.421 2.627 0 50 GFAA COc1cccc(C(=O)NCCCn2cc(Br)c(C)n2)c1OC 2798916 KBZCVWZSUUHXEZ-UHFFFAOYSA-N 382.258 2.791 0 50 GFAA O=C(O)CCC(=O)Nc1ccc2c(c1)-c1cc(NC(=O)CCC(=O)O)ccc1C2 4595197 CVCXKQOLDRYTSR-UHFFFAOYSA-N 396.399 2.864 0 50 GFAA COc1ccc(N(CC(=O)O)S(=O)(=O)c2cc(C)ccc2OC)cc1Cl 4853059 HRQURWILMCCLDC-UHFFFAOYSA-N 399.852 2.946 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2C)CCCN(C(=O)Cn2nc(C)nc2C)C1 11661742 YNEYPVHREDTHLO-JOCHJYFZSA-N 398.507 2.618 0 50 GFAA CC[C@H]1C(=O)NCCN1C(=O)c1ccc2nc(Cc3ccc(OC)cc3)oc2c1 11661931 UISSLGYICQFDAS-SFHVURJKSA-N 393.443 2.778 0 50 GFAA O=C(NCc1ccon1)[C@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 11933313 ONGNCNHHWPBXRM-FQEVSTJZSA-N 396.535 2.710 0 50 GFAA C[C@@H](CCn1cccn1)NC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12093601 CXIUARVBHJTHLL-ZDUSSCGKSA-N 392.385 2.750 0 50 GFAA O=C(CN1CCOC1=O)NCc1cccnc1Oc1cccc(C(F)(F)F)c1 12308677 BJFGYWSOEJXCNI-UHFFFAOYSA-N 395.337 2.961 0 50 GFAA Cc1ccccc1-n1ncc([C@H](C)NC(=O)c2ccc(-n3cnnn3)cc2)c1C 12468451 YLKXOZWXFRIEAY-HNNXBMFYSA-N 387.447 2.956 0 50 GFAA CCCn1cc(CN2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)c(C)n1 12717821 BJBORDDBAKKFGW-FQEVSTJZSA-N 376.545 2.889 0 50 GFAA CC[C@@H](C(=O)NC[C@H](C)Cn1cccn1)n1nc(C(F)(F)F)c2c1CCC2 20607692 HCIHGYDTZFOJCB-JSGCOSHPSA-N 383.418 2.991 0 50 GFAA CCn1cc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@H](CCO)C2)c(C)n1 39394082 MEGWZDFNTLAYJO-OAQYLSRUSA-N 386.540 2.597 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1CCC[C@@H](Cn2cc(C3CC3)nn2)C1 48139937 NEGIKFSNPAQNRG-CQSZACIVSA-N 378.432 2.814 0 50 GFAA Cc1ccc(C)c(-n2nc(-c3ccccc3)nc2Cn2cc(C)c(=O)[nH]c2=O)c1 63884808 YLMCZGXSXSEFAT-UHFFFAOYSA-N 387.443 2.758 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)cc1 65364469 PCEMMDIJZZFZLI-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA OCCNc1cc(N2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)ncn1 65489381 RZZGSXMLJJFJPH-UHFFFAOYSA-N 382.295 2.510 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 67472803 UGAHXARDNBKQLU-CALCHBBNSA-N 385.512 2.835 0 50 GFAA Cc1nnc(CN(C)C(=O)c2coc(COc3cccc4cnccc34)n2)o1 67743101 RYPZLHIENCTSGJ-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA CC(C)[C@@H]1CN(CCN2CCCC2=O)CCC(=O)N1Cc1ccc(F)cc1 71747832 OCHNOHYFCNYGCT-IBGZPJMESA-N 375.488 2.507 0 50 GFAA CCn1cc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 71775619 KVVMOBZGVVIWRP-LJQANCHMSA-N 386.471 2.941 0 50 GFAA CCC1CCN(C(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCCO3)cc2)CC1 91859219 IPTHENIBMXNVBD-SFHVURJKSA-N 394.537 2.796 0 50 GFAA Cc1cc(CNC(=O)c2cnc(Cc3c(Cl)cccc3Cl)[nH]c2=O)no1 91952239 UFQKJBDKCZWVML-UHFFFAOYSA-N 393.230 2.894 0 50 GFAA CC(=O)NCc1nc(-c2cccnc2)nn1-c1ccc(OC(F)(F)F)cc1 95380273 HGAGVAJYNORDME-UHFFFAOYSA-N 377.326 2.864 0 50 GFAA Cc1ccccc1[C@H](CC(=O)NCCc1nc(O)cc(=O)[nH]1)c1ccccc1 95517406 CHJPHGUXIXHLLS-GOSISDBHSA-N 377.444 2.665 0 50 GFAA CC(C)c1nccn1[C@@H](C)C(=O)NC1CCN(c2ccc(Cl)nn2)CC1 95517418 DQEYNGGQMAIJIV-ZDUSSCGKSA-N 376.892 2.796 0 50 GFAA COc1cc(CN2CCC(C)CC2)ccc1OC[C@@H](O)CN1CCSCC1 95523643 FGJMUSRWRWGSDF-IBGZPJMESA-N 394.581 2.716 0 50 GFAA C[C@H](C(=O)N1CCC[C@H](c2nncn2C)C1)N1CCC(Cc2ccccc2)CC1 110627559 ZBAUGVKVBCALNK-NQIIRXRSSA-N 395.551 2.864 0 50 GFAA Cc1cccc(N2CCC(NC(=O)Cc3cc4ccccc4[nH]c3=O)CC2)n1 116836414 ZWUJPBKXRNAYQV-UHFFFAOYSA-N 376.460 2.559 0 50 GFAA O=S(=O)(c1cnn(-c2ccccc2)c1)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 121592963 LMSBLZKNAGQMAE-OXQOHEQNSA-N 386.521 2.510 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)COc2ccc(C=O)cc2F)CC1 130639364 IFFBZZPQODHABI-UHFFFAOYSA-N 398.434 2.746 0 50 GFAA Cc1c(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cnn1C1CCOCC1 159072864 JQILVAQBMZKJMM-FQEVSTJZSA-N 396.491 2.637 0 50 GFAA Cc1nc(C(=O)N2CCN3CCC[C@@H]3C2)nn1-c1c(Cl)cccc1Cl 170877306 TVOMZESRSFXCOM-GFCCVEGCSA-N 380.279 2.803 0 50 GFAA COc1c(C)cnc(CN2CCC(N(C)C(=O)Cc3c(C)n[nH]c3C)CC2)c1C 171489636 FWZSQMQOESGTIU-UHFFFAOYSA-N 399.539 2.712 0 50 GFAA C[C@H](NC(=O)Nc1ccccc1)C(=O)O[C@@H](C)C(=O)N1[C@@H](C)CCC[C@H]1C 239667631 BQXNELUDWFTVED-FZKCQIBNSA-N 375.469 2.918 0 50 GFAA Fc1ccc([C@@H](CNC(=S)N[C@H]2C[C@H]3CC[C@H]2C3)N2CCOCC2)cc1 242273575 YEABGOAQHOLJOV-OYSPMZIOSA-N 377.529 2.852 0 50 GFAA COc1ccc(CNC(=O)c2ccc3c(c2)[nH]c(=O)n3[C@H]2CC[C@H](O)CC2)cc1 244842295 UOCSXTNYWWGDGY-QAQDUYKDSA-N 395.459 2.744 0 50 GFAA COc1ccccc1CN1C(=O)O[C@H]2CN(Cc3cc(CC(C)C)[nH]n3)C[C@H]21 248204237 YXDZOMRCDUUXNI-QUCCMNQESA-N 384.480 2.822 0 50 GFAA O=C(C[C@H]1N=C(O)N(CCc2c[nH]c3ccccc23)C1=O)NCc1ccccc1 252572566 ZKHLODMTHMFDOD-LJQANCHMSA-N 390.443 2.542 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)N[C@H](CCC(=O)O)Cc2ccccc2)c1 263456445 CFLTYMOOKCYTLN-QGZVFWFLSA-N 394.435 2.568 0 50 GFAA CO[C@H](CNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(C)C 266695027 OHUZXSJAIHZAOM-GOEBONIOSA-N 384.423 2.680 0 50 GFAA O=C(c1cnc(-c2ccco2)s1)N1CCS(=O)(=O)C2(CCCCC2)C1 267996279 RBFZXRQMYOKVQG-UHFFFAOYSA-N 380.491 2.977 0 50 GFAA CCCc1sc(C(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)cc1CC 275709936 NZQKWLLCOWLWAZ-HNNXBMFYSA-N 387.553 2.982 0 50 GFAA Cn1nnc2c1C[C@@H](C(=O)Nc1nc(-c3ccc(F)c(F)c3)cs1)CC2 291073085 FMJQCZJTEAFYDJ-JTQLQIEISA-N 375.404 2.960 0 50 GFAA COc1ccncc1CNCc1ccc(OCCN2CCOCC2)c(Cl)c1 292849104 ZDZLEBNNIYLXSS-UHFFFAOYSA-N 391.899 2.744 0 50 GFAA COC(=O)C1CCN(C2CCN(c3nc(C)c4ccc(OC)cc4n3)CC2)CC1 299759369 RFBWILLWZZQPCE-UHFFFAOYSA-N 398.507 2.801 0 50 GFAA CCc1cc(NC(=O)N2CCCCC[C@@H]2c2noc(-c3cnn(C)c3)n2)n(C)n1 329369444 IHENEGZKXGENPL-OAHLLOKOSA-N 398.471 2.915 0 50 GFAA CN1CCC2(CCCN2C(=O)NCc2nccn2CCc2ccccc2)CC1 363950874 VBSDXMKZZOCJQH-UHFFFAOYSA-N 381.524 2.896 0 50 GFAA O=C(CCC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1)N1CCC(O)CC1 378481809 BNSNLPFFWPBQDT-MRXNPFEDSA-N 376.472 2.685 0 50 GFAA Cc1ccccc1CN(C[C@@H]1CCCO1)C(=O)NCCN1CCCOC1=O 426545525 ZTYSWSBNFKYMPF-SFHVURJKSA-N 375.469 2.528 0 50 GFAA Cc1cccnc1C(F)(F)C(=O)N1CCC[C@@H](CNC(=O)CC(F)(F)F)C1 804201811 HCJUWXUDPGRFAF-LBPRGKRZSA-N 393.356 2.789 0 50 GFAA Cc1ccc([C@H](O)c2ccccn2)cc1NC(=O)C1(N2CCOCC2)CCC1 848041816 IQLQPVPPSCZOCP-FQEVSTJZSA-N 381.476 2.665 0 50 GFAA O=C1C[C@H](CCOC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)CN1 860700526 SCFZPFCFXZYHBX-NSHDSACASA-N 394.353 2.922 0 50 GFAA O=C(NCCc1ccccc1F)[C@H]1CCc2sc(N3CCOCC3)nc2C1 1772804894 DRWCQCWXNFRXOZ-HNNXBMFYSA-N 389.496 2.583 0 50 GFAA CN(C)c1ncccc1C(=O)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)O)C2 1857676687 RDZVCZUAMIQZPL-AQOAWAETSA-N 379.460 2.838 0 50 GFAA O=C(CN1CCC(C2CCN(CCc3ccccc3)CC2)CC1)N1CCOCC1 1857714712 IILSERNTYLSPEI-UHFFFAOYSA-N 399.579 2.512 0 50 GFAA COc1ncccc1CCNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857732479 RYPWKSPPFNHHAY-OAHLLOKOSA-N 395.463 2.592 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4cccc(C)n4)[C@H]4CC[C@]3(C2)O4)c1 1875247228 GLGDVXGJASBRDV-ODULNIPZSA-N 378.476 2.507 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2c(F)cccc2F)C1)C1CC2(C1)C[C@@H]2C(=O)O 1875277553 QLTQYTTVYNVJOV-OIZAJQKKSA-N 378.419 2.546 0 50 GFAA Cc1csc(N2CCC[C@H](C(=O)N3C[C@H]4C[C@H]3C[C@@]4(O)C(F)(F)F)C2)n1 1875392127 BXKSSDCHWDZOOW-ZWUHOBOKSA-N 389.443 2.582 0 50 GFAA CC1(C)C[C@@H](NC(=O)Cn2ncc3ccccc3c2=O)CN1Cc1ccccc1 2325786667 OEMRFWSIQIOHEK-LJQANCHMSA-N 390.487 2.566 0 50 GFAA C[C@]1(NC(=O)c2cn3c(n2)CCCC3)CCN(Cc2cc(-c3ccco3)on2)C1 2325794179 TZRJOUIIMILULD-NRFANRHFSA-N 395.463 2.862 0 50 GFAA C[C@@]1(NC(=O)c2cn3c(n2)CCCC3)CCN(Cc2cc(-c3ccco3)on2)C1 2325794180 TZRJOUIIMILULD-OAQYLSRUSA-N 395.463 2.862 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)Nc2ccc(OC)c(Cl)c2)nc1N 1067896 RDGKKAVNCHAXLS-UHFFFAOYSA-N 396.856 2.628 0 50 GFAA CCOC(=O)c1ccc(NC(=S)NNC(=S)NC2CCCCC2)cc1 1121278 QKFSRNQYRXKVAY-UHFFFAOYSA-N 380.539 2.862 0 50 GFAA O=C(c1ccc(Cl)s1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 6237199 OSZSDMZTVNQOFC-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA O=S(=O)(Nc1ncc(-c2nccn2Cc2ccco2)cn1)c1ccccc1 101771823 JVLIXZYOTCVBKR-UHFFFAOYSA-N 381.417 2.782 0 50 GFAA CC1(C)[C@H](NC(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)[C@@H]2CCO[C@H]21 247077728 UAEUWDAPLZJGIW-IPMKNSEASA-N 385.508 2.925 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](c3[nH]ncc3Cc3ccccc3)C2)nc(N)n1 67771044 JRMYMDIJBWDRHY-INIZCTEOSA-N 376.464 2.701 0 50 GFAA CCSc1ccc(C(=O)NCC2CCN(c3cnn(C)c(=O)c3)CC2)s1 23192953 SIRRYBHEPRBMBR-UHFFFAOYSA-N 392.550 2.600 0 50 GFAA O=C(NC[C@@H]1CCCS1(=O)=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 124477091 ODUBJPLDKHHERO-MAUKXSAKSA-N 375.494 2.982 0 50 GFAA CN(CCc1ccc(F)cc1)C(=O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C 368646446 VCDNTWQMJCMXRH-RXVVDRJESA-N 398.482 2.702 0 50 GFAA O=C(c1ccccc1-n1cncn1)N1CCC([C@H](O)Cc2ccccc2)CC1 77299779 YIPMIBOLOJJIBO-OAQYLSRUSA-N 376.460 2.723 0 50 GFAA C[C@@H]1CN(c2ccc(CNC(=O)N3CCOC4(CCCCC4)C3)cn2)CCO1 175424352 KAFZWNHNWPSJFB-QGZVFWFLSA-N 388.512 2.551 0 50 GFAA O=C1CCCN1CC[C@@H]1CCCCN1C(=O)c1ccc(SCCO)cc1 77393509 ACZCKBMUGZTIII-KRWDZBQOSA-N 376.522 2.778 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)NCc1ccccc1CN1CC[C@@H](O)C1)CCO2 286875868 RQYMYJYTNQOJEW-OAQYLSRUSA-N 395.503 2.666 0 50 GFAA CC1(C)CCC[C@H]1NC(=O)N1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1 176618207 QWXKOFARCGRLNW-CYBMUJFWSA-N 399.479 2.563 0 50 GFAA CCn1nc(C)c(CCNC(=O)c2cnc(-c3cccc(C)c3)[nH]c2=O)c1C 82121619 BPKUZWSNYGDAIY-UHFFFAOYSA-N 379.464 2.551 0 50 GFAA COCCN1CCC[C@@H](CN(C)C(=O)NC(C)(C)c2ccc(OC)cc2)C1 426527609 AKVXNMPFONKUJU-KRWDZBQOSA-N 377.529 2.930 0 50 GFAA C[C@@H](c1ccccc1)N(CCCO)C(=O)Nc1cccc(-c2nnn(C)n2)c1 426641474 VMQAQHJACRGWNP-HNNXBMFYSA-N 380.452 2.855 0 50 GFAA C[C@@](O)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1 179004582 LYOJITPXGSMFIX-JOCHJYFZSA-N 399.466 2.637 0 50 GFAA CCN1CCN(C(=S)SCC(=O)Nc2nc3ccccc3s2)CC1 43214983 ZFEZMRKWXZXNMW-UHFFFAOYSA-N 380.564 2.890 0 50 GFAA O=C(Nc1cnn(CC(F)(F)F)c1)[C@H](c1ccccc1)N1CCC(O)CC1 179506901 QAYHOBROUGVUSW-INIZCTEOSA-N 382.386 2.582 0 50 GFAA O=C(COc1ccccc1Cl)N1C[C@H](CO)[C@H](CN2CCCCCC2)C1 91706392 CPGIAWKPABBDFA-IAGOWNOFSA-N 380.916 2.662 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)n1 92062210 AWYIAPVQYBXTOI-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA Cc1cc(C)c(C(=O)Nc2ccc(N3CCCCS3(=O)=O)cc2)c(O)n1 252495406 OPWGDTWVEQQYBI-UHFFFAOYSA-N 375.450 2.586 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)N[C@@H](c1ccccn1)[C@H]1C[C@H](O)C1 252550813 SYCOTMJKFIZVMZ-ARGWCVDVSA-N 388.851 2.677 0 50 GFAA Cc1cc(=NC(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)[nH]o1 1940197750 OARNFENXWGXIDV-QFIPXVFZSA-N 375.428 2.891 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)NC[C@@H](c1ccc(F)cc1)N1CCCC1 827861863 XEDMVSZDQLVEHS-SFHVURJKSA-N 383.423 2.687 0 50 GFAA CCC(=O)N1CCC2(CC1)CN(C(=O)c1c[nH]nc1C1CCCCC1)CCO2 822529792 ULXJHHYEQJZRDI-UHFFFAOYSA-N 388.512 2.701 0 50 GFAA CN(CC[C@H](O)c1ccccc1)C(=O)NC1CCN(C(=O)C2CCCC2)CC1 584894171 NJEXPEYYZSPYAP-FQEVSTJZSA-N 387.524 2.933 0 50 GFAA O=C1C[C@H](CNS(=O)(=O)c2ccccc2C(F)(F)F)CN1C1CCCC1 670435742 AXTOWSMYTVYTAD-GFCCVEGCSA-N 390.427 2.775 0 50 GFAA Oc1n[nH]c([C@H]2[C@@H](C3CC3)CCN2c2nc(C3CC3)ncc2Br)n1 1875399704 HRAPZHYUAIWKLC-ZYHUDNBSSA-N 391.273 2.918 0 50 GFAA O=C(c1ccc2c(c1)CCCNC2)N1CC[C@H](n2cnc3ccccc3c2=O)C1 1875310728 AAFQHXUBUZWSCL-IBGZPJMESA-N 388.471 2.520 0 50 GFAA Cc1cnc(N2CCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)nc1C(C)C 1875395460 XZTPVEHTAYONEI-LSDHHAIUSA-N 398.511 2.616 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@@H](c2cccc(F)c2)c2cnn(C)c2)CC1 1875370545 SWMOHGPDAAPKNV-FQEVSTJZSA-N 384.455 2.532 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(c2ncnc3ccccc23)C1 1875313447 QRJHMOGYVDICSI-LJQANCHMSA-N 390.443 2.523 0 50 GFAA CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CN1CCN(c3ncccn3)CC1)C2 893870714 ARVGVRRXUYMUCV-ROUUACIJSA-N 387.528 2.777 0 50 GFAA Cn1c(SCc2ccc([Si](C)(C)C)cc2)nnc1[C@@H]1CCS(=O)(=O)C1 170613008 ZXRBUBWKUKLUTB-CQSZACIVSA-N 395.626 2.555 0 50 GFAA O=C(N[C@H]1CCCOC1)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 171613196 MSQLFSKNTWRZOM-KRWDZBQOSA-N 386.521 2.816 0 50 GFAA Cc1cccc(N2CCC(NCCc3ccc(S(N)(=O)=O)cc3)CC2)c1C 1506414277 XKWFKOMBEAJAFO-UHFFFAOYSA-N 387.549 2.752 0 50 GFAA CCOc1ccc([C@@H](C)NS(=O)(=O)c2ccc(C(=O)NC)cc2)cc1F 1506399088 AKANIGXYVXKIGO-GFCCVEGCSA-N 380.441 2.624 0 50 GFAA COc1ccc(C(=O)N2CCCN(C(=O)N[C@H](C)c3ccccc3)CC2)cn1 1775979328 ZZSAOCNNKCGASP-MRXNPFEDSA-N 382.464 2.709 0 50 GFAA COc1cccc(OC)c1-c1cnnc(NCc2cn3nc(C)sc3n2)n1 11819851 IVVRLLDTTKXRGU-UHFFFAOYSA-N 383.437 2.581 0 50 GFAA CCCc1noc(CN(C)C(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)n1 12749640 LTNUYHDCINJXPT-INIZCTEOSA-N 376.501 2.799 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1ccco1)C2 14742038 BSVPVGXQDIQNMI-HNNXBMFYSA-N 388.537 2.722 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@@]1(O)CNCc1ccccc1F 14974669 QMLIJBLJMLZCKM-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA O=C([C@@H]1CC(Cc2cccc(F)c2)=NO1)N1CCC(Oc2cccnc2)CC1 15068138 YKOBPBOPXWAQFR-FQEVSTJZSA-N 383.423 2.978 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3ocnc3C)C2)cc1OC 15069598 PEBRARUCYAXPHE-QGZVFWFLSA-N 387.480 2.779 0 50 GFAA CCOc1cccc(N2C(=O)C[C@H](N3CCN(c4ccccc4)CC3)C2=O)c1 19770791 GANBTVQGIBLVOI-FQEVSTJZSA-N 379.460 2.539 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccco4)ccn3n2)cc1C 169775959 UPGGEKDBDDVOJA-UHFFFAOYSA-N 376.416 2.803 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccc(Cl)cc4)nnc23)n1 169776013 YEJHMPYMBWVOJD-UHFFFAOYSA-N 382.811 2.925 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4ccc(F)c(F)c4)nnc23)n1 169781032 USMBZTUHCDUYNP-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA CCOC(=O)c1ccc(N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)nc1 1857703962 XSZRRWQCGFAQOZ-NRFANRHFSA-N 381.432 2.512 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4ncccc4C)[C@H]4CC[C@]3(C2)O4)o1 1857724786 CQTGNRZRHMQZOE-JZJXAQOMSA-N 381.476 2.701 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccncc3Cl)C[C@]23CC[C@H]1O3)c1ccco1 1857739536 VAJIFRGLTMSELE-DKYLXPRQSA-N 387.867 2.737 0 50 GFAA CC[C@H]1CN(S(=O)(=O)c2cc(Cl)c(OC)cc2C)C[C@@]2(CCOC2)O1 408339780 MEDSJHMJGWRZHS-SUMWQHHRSA-N 389.901 2.616 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CC[C@@]3(CC(=O)c4ccccc4O3)C2)c(O)n1 334028119 IYBSHMNJFWRTAV-OAQYLSRUSA-N 381.432 2.724 0 50 GFAA O=C(c1ccc(O)cc1)N1CCN(Cc2ccn(-c3ccc(F)cc3)n2)CC1 130961692 WNUWXNZJSFEECG-UHFFFAOYSA-N 380.423 2.675 0 50 GFAA COc1ccc([C@@H](CNC(=O)[C@H]2NCCO[C@@H]2C)c2c[nH]c3ccccc23)cc1 261919460 KBGMVWOGHQDMHO-YOMUGFJLSA-N 393.487 2.802 0 50 GFAA COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cc(OC)c(Br)cc1OC 717463 YINBWJOIYPWKCU-CQSZACIVSA-N 399.241 2.609 0 50 GFAA CCOC(=O)c1sc(NC(=O)CN2CCCCC2)c(C(=O)OCC)c1C 625955 QQAZYEXIWOQBRW-UHFFFAOYSA-N 382.482 2.834 0 50 GFAA CCOc1ccc(N[C@H]2CC(=O)N(c3ccc(N4CCOCC4)cc3)C2=O)cc1 2890119 ADSQONFATAPHQG-FQEVSTJZSA-N 395.459 2.666 0 50 GFAA CN1CCc2c(cccc2S(=O)(=O)NCc2ccc(-c3cnn(C)c3)cc2)C1 2325783006 TUSBEYITOPNPRC-UHFFFAOYSA-N 396.516 2.554 0 50 GFAA N=C(O)OCc1cn(CCCCNC(=O)C(F)(F)/C=C/c2ccccc2)nn1 2325870793 PIIGKOBZKKBWMZ-CMDGGOBGSA-N 393.394 2.533 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 784098 ZVRUOOMIMYVPQU-IBGZPJMESA-N 384.457 2.902 0 50 GFAA CCOC(=O)c1c(NC(=O)Cn2cnc3ccccc3c2=O)sc(C)c1C 803059 ONNKLLCDHRURSR-UHFFFAOYSA-N 385.445 2.890 0 50 GFAA CCOc1ccccc1NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 816870 IPLKYVNZFCPTEP-AWEZNQCLSA-N 392.477 2.887 0 50 GFAA CC(C)(C)c1cc(S(N)(=O)=O)c2cc(C(C)(C)C)cc(S(N)(=O)=O)c2c1 834483 HZNFMJIVVBKBNE-UHFFFAOYSA-N 398.550 2.730 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC2CCCCCC2)cc1 1133019 ANSXELQODIDGIY-HNNXBMFYSA-N 382.526 2.981 0 50 GFAA CCCc1nnc(NC(=O)[C@@H](CC)Sc2nnnn2-c2ccccc2)s1 2746268 PQWOMUXOSVFOGG-GFCCVEGCSA-N 389.510 2.976 0 50 GFAA CS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccccc2Br)n1 4839438 CTHAQRRWQIQWGF-UHFFFAOYSA-N 390.646 2.548 0 50 GFAA Cc1cccc(CN(c2c(C)n(C)n(-c3ccccc3)c2=O)S(C)(=O)=O)c1 9426070 YSKYKKRXJSKRJK-UHFFFAOYSA-N 385.489 2.759 0 50 GFAA CCC(=O)[C@H]1CCCN(C(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)C1 11814894 BLFBIXPQOJFXQG-AWEZNQCLSA-N 385.420 2.616 0 50 GFAA O=C(NCCc1cccc(C(F)(F)F)c1)c1cc(CN2CCC[C@@H](O)C2)on1 11843336 FBVWNKKGVHGAAL-OAHLLOKOSA-N 397.397 2.623 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)c3ccccc3C)C2)nn1 11910458 NIDXCUJOYKWCAR-KRWDZBQOSA-N 383.496 2.621 0 50 GFAA COCC1CCN(Cc2cnc(S(=O)(=O)C(C)C)n2CCC(C)C)CC1 11936297 OPVFHGRGRXACPM-UHFFFAOYSA-N 385.574 2.970 0 50 GFAA Cc1ccc(CNC(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2Cl)cc1 12003399 JGUHZQRSJNYVNF-UHFFFAOYSA-N 392.864 2.645 0 50 GFAA Cc1cc(-c2cccc(-c3ccn(CC(=O)NC(C)C)n3)c2)nc(N(C)C)n1 19146696 VWRSURYPKBPLMY-UHFFFAOYSA-N 378.480 2.906 0 50 GFAA Cc1cccc(CN2CCN(Cc3cccn3-c3ccccn3)C[C@@H]2CCO)n1 19866636 NXCBDXYTEBXFTQ-NRFANRHFSA-N 391.519 2.645 0 50 GFAA COc1cc(C(C)=O)ccc1OC[C@@H](O)CN1CCN(c2ccccc2C)CC1 19908936 UXIIGSSKBOZZIV-FQEVSTJZSA-N 398.503 2.768 0 50 GFAA COCc1ncc(-c2cc(C(=O)N3CCCOCC3)c3cc(F)ccc3n2)cn1 20854514 OGXROXIKTZRDDJ-UHFFFAOYSA-N 396.422 2.840 0 50 GFAA Cc1nn(CCO)cc1-c1nc2c(cnn2Cc2ccccc2C(F)(F)F)[nH]1 20859110 BTNPJASPOORNKR-UHFFFAOYSA-N 390.369 2.991 0 50 GFAA COc1cc([C@@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C)C(=S)N32)ccc1O 22204858 GVCLBNUGPADGCM-DNVCBOLYSA-N 393.468 2.955 0 50 GFAA CC(C)Cc1cc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)n[nH]1 22851496 XAYWTQBIUHLTKC-LJQANCHMSA-N 392.494 2.955 0 50 GFAA Cc1nnc(SCCC(=O)N2CCC[C@@H]2c2ccc(C(N)=O)s2)s1 23153458 FIXVRWRPJHGNTD-SNVBAGLBSA-N 382.536 2.853 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3cccc(Cl)c3)C2)CC1 55195773 RSJKHGFHEDZBCR-KRWDZBQOSA-N 379.888 2.719 0 50 GFAA Cc1ncn(-c2cc(NCCNC(=O)c3c(F)cccc3Cl)ncn2)c1C 72115944 HVBQYAJHRILOLG-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@@H]2CC(=O)N(Cc3cccc(F)c3)C2)s1 72132929 MFMPTTPBRSLFEL-CQSZACIVSA-N 376.457 2.553 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)CCn3ccnc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72148451 AJSWBUSWCLMLQZ-MDNUFGMLSA-N 378.520 2.979 0 50 GFAA CN1CCN([C@H]2CCN(c3ccc4ccccc4n3)C[C@H]2CCC(=O)O)CC1 91781662 ASHXAJVIJIUBAA-QUCCMNQESA-N 382.508 2.542 0 50 GFAA CN1CCC[C@@]2(CCN(c3cc(Sc4cccs4)nc(N)n3)C2)C1=O 95376020 AKYSHFDKDXZRKK-KRWDZBQOSA-N 375.523 2.720 0 50 GFAA O=C(CN1CCCC1)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 95512425 IFRDTJNMWCJXBK-UHFFFAOYSA-N 389.927 2.777 0 50 GFAA COc1ccc(C(=O)NC2CCOCC2)cc1OC1CCN(C(C)C)CC1 95523508 XVZGOFXNLZOWPK-UHFFFAOYSA-N 376.497 2.856 0 50 GFAA COc1ccc(C(=O)N(C)CC2CCN(Cc3ccc(C)o3)CC2)c(OC)n1 95527846 IZEMLABDDJMVCY-UHFFFAOYSA-N 387.480 2.984 0 50 GFAA Cc1ccc(C(=O)NC(C)C)cc1NC(=O)N1CCN(c2ccncc2)CC1 96154146 OOTAZJFUQDINMF-UHFFFAOYSA-N 381.480 2.882 0 50 GFAA COc1ccc(NC(=O)NCCN2CCc3ccccc32)cc1C(=O)N(C)C 97773092 ASNOMYXLUCOPLD-UHFFFAOYSA-N 382.464 2.581 0 50 GFAA CCC[C@@H]1CN(C(=O)Nc2cccnc2N2CCCC2)CCN1CCOC 158756267 ODNRKQRVYMAMSK-QGZVFWFLSA-N 375.517 2.646 0 50 GFAA COc1ccc([C@H](C)NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCC4)cc1 169778286 OMMYRJOEWFADNJ-HNNXBMFYSA-N 394.475 2.729 0 50 GFAA CC(C)(C)OC(=O)N1[C@@H](COC(=O)c2cccc(NC(N)=O)c2)COC1(C)C 170609376 BQHOHBJYMPPGMD-AWEZNQCLSA-N 393.440 2.706 0 50 GFAA COCCOc1ccc(N[C@@H]2CCCN(c3ccn(C)n3)C2=O)cc1Cl 170644335 BHDDKPDFKDFZRC-OAHLLOKOSA-N 378.860 2.706 0 50 GFAA CCc1nnc(-c2cccc(NC(=O)CNC(=O)c3ccccc3OC)c2)o1 173438624 NOLVVBKOZXCTMH-UHFFFAOYSA-N 380.404 2.676 0 50 GFAA CC(C)[C@H](NCc1csc(-c2ccccc2F)n1)C(=O)N1CCOCC1 180077209 RGHUBHJNUPVCKV-KRWDZBQOSA-N 377.485 2.922 0 50 GFAA CC(C)(O)CN(Cc1ccccc1)C(=O)c1ccc(=O)n(-c2ccccc2)n1 182857678 PORCVDYMPDCWHC-UHFFFAOYSA-N 377.444 2.646 0 50 GFAA Cc1oc(C(=O)N2CCC[C@@H](c3cc(F)ccc3F)C2)cc1S(N)(=O)=O 190277742 AOFLBJZLJSMCOH-LLVKDONJSA-N 384.404 2.533 0 50 GFAA O=C(Nc1cnn(Cc2ccccn2)c1)c1cccc(CN2CCCC2=O)c1 194932382 HIYIGBMTILGOPE-UHFFFAOYSA-N 375.432 2.701 0 50 GFAA CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1 195460273 FHCCNHRAVVSLSR-IEBWSBKVSA-N 399.535 2.692 0 50 GFAA CCCCOc1c(OC)cc(C(=O)NCC2(N(C)C)CCOCC2)cc1OC 205669492 JQUVQWMHZSYCRQ-UHFFFAOYSA-N 394.512 2.723 0 50 GFAA NC[C@@H]1CCCN1C(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1 237962683 FIZUNCZYRGLJKX-ZJVMWOEPSA-N 387.487 2.956 0 50 GFAA O=C(O)CC[C@@H]1CCCN(C(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)C1 237962773 BTDFASSEYOFPND-BBRMVZONSA-N 378.856 2.796 0 50 GFAA CCOC(=O)[C@@H]1[C@H](c2ccccc2)n2nc(-c3ccccc3)nc2N[C@]1(C)O 239432718 WEMRBBSUMDJKDY-XGHQBKJUSA-N 378.432 2.848 0 50 GFAA Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc2ncc[nH]2)c2ccccc21 253399624 DDOPHDHTHFSDHK-HNNXBMFYSA-N 383.452 2.976 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 363728012 VUWHIYCXTFKJLI-BVPXEZJJSA-N 395.503 2.815 0 50 GFAA CCCN1C[C@H](NC(=O)c2ccc(-c3ccc4c(cnn4C)c3)cc2)CC1=O 426533672 CFHQBYYKDRYSIB-LJQANCHMSA-N 376.460 2.981 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3nc(N4CCCCCC4)nc(O)c32)ccc1O 824596429 RCISBARMEOGGER-ZDUSSCGKSA-N 384.436 2.751 0 50 GFAA Cc1cc(C)nc(SCc2ccc(C(=O)NCc3csc(N)n3)o2)n1 827597802 OWBBEMLJBDRZLF-UHFFFAOYSA-N 375.479 2.947 0 50 GFAA CN1C(=O)COc2ccc(C(=O)N[C@@H]3CCCN(Cc4ccccc4F)C3)cc21 828288809 NWHKWXGXFHYJSN-QGZVFWFLSA-N 397.450 2.575 0 50 GFAA CO[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1 888093168 HCGUNWQVWXBSLS-QGZVFWFLSA-N 396.553 2.968 0 50 GFAA Cc1ccc(N2CCC(NC(=O)N3CCC[C@H](N4CCCC4=O)CC3)CC2)nc1 888102652 ZLXRNQSIXMXZQB-IBGZPJMESA-N 399.539 2.545 0 50 GFAA COc1cccc2ccc(CN(Cc3ccncc3)C[C@@H]3CCC(=O)N3)nc12 952873925 QWOLXVXUKWCCBH-SFHVURJKSA-N 376.460 2.919 0 50 GFAA Fc1ccc(-c2ccnc(C3CCN(Cc4nnc5n4CCOC5)CC3)n2)cc1 952891738 HOUPQORUSAUYHI-UHFFFAOYSA-N 394.454 2.784 0 50 GFAA Cc1ncnc(N2CCN(C3CCN(C(=O)c4cccs4)CC3)CC2)c1C 952975234 CSDCESMXZQDNGG-UHFFFAOYSA-N 385.537 2.582 0 50 GFAA Cn1nc(CN2CCC(=O)N(Cc3cscn3)CC2)c2c(Cl)cccc21 1506425674 DNKDYVRXJQOYPW-UHFFFAOYSA-N 389.912 2.918 0 50 GFAA COc1ccccc1-c1ncc(CN(C)[C@@H]2C[C@@H]3CC(=O)N(C)C[C@@H]3C2)cn1 1704339024 MSVLYYJCSADZCQ-FGTMMUONSA-N 380.492 2.841 0 50 GFAA CO[C@H]1C[C@H](c2nnc(C)o2)N(C(=O)Nc2ccc(OCC(C)C)nc2)C1 1775959403 ZPBQNDZWHIEJBT-LSDHHAIUSA-N 375.429 2.802 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857739811 TZKHNSMLJAHPNZ-QFIPXVFZSA-N 393.443 2.909 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)n1)N1CCC(OCCC(F)(F)F)CC1 1875263258 XOHSVAZMASNPSS-UHFFFAOYSA-N 382.386 2.770 0 50 GFAA COc1ccccc1-c1ccnc(N2CC[C@@H](C3CC3)[C@H]2c2nc(O)n[nH]2)n1 1875399570 CYWSQWOJTVDUEZ-GUYCJALGSA-N 378.436 2.954 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)N1CCN(c2ncnc3ccccc23)CC1 1940193473 WLEXOCAIXGQHQC-UHFFFAOYSA-N 377.448 2.816 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCN(C(=O)c2ccc(-c3cc[nH]n3)s2)CC1 2325746279 NXZUVSHGFYKNAS-UHFFFAOYSA-N 398.463 2.804 0 50 GFAA COc1ccc2c(c1)[C@@H](C)CN(C(=O)c1ccc3c(c1)CC[C@H](N)C(=O)N3)CC2 2325795567 NECJFKIMBDQQSO-XOBRGWDASA-N 393.487 2.709 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccnc(Oc2ccccc2F)c1 2325798938 KFZAFZXAOGKPGT-ZTFGCOKTSA-N 396.422 2.779 0 50 GFAA O=C1O[C@H](CN2CC[C@@](O)(c3cccc(Br)c3)C2)CC12CCC2 2325799469 ALINYJUAMDRPGF-YJBOKZPZSA-N 380.282 2.828 0 50 GFAA O=C(O)c1c(N2C[C@@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2C3)noc1-c1ccccc1 2356140307 DEUREXOVERQMTO-IMJJTQAJSA-N 381.432 2.877 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCC[C@H](c2cc[nH]n2)C1 2356143479 JIZCWYZNIVKNFO-AWEZNQCLSA-N 386.521 2.642 0 50 GFAA O=C(Cc1cccnc1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356148035 DQIHDHOZOXWTLP-HSZRJFAPSA-N 377.488 2.850 0 50 GFAA CCN(CC)C(=O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 816521 CORRPBQJGVICKY-UHFFFAOYSA-N 375.494 2.608 0 50 GFAA COCCNC(=O)c1cc2nc(-c3ccc(OC)cc3)cc(C(F)(F)F)n2n1 2811540 ZNDCOEOKLZDUQV-UHFFFAOYSA-N 394.353 2.800 0 50 GFAA COCCNC(=O)c1ccc(N(Cc2ccccc2Cl)S(C)(=O)=O)cc1 2946148 KAYAZROGVJBIAA-UHFFFAOYSA-N 396.896 2.682 0 50 GFAA COc1ccc(N(CC(=O)NC(C(C)C)C(C)C)S(C)(=O)=O)cc1Cl 2985742 ZLYUDFAYJJGMMJ-UHFFFAOYSA-N 390.933 2.911 0 50 GFAA COCCNC(=O)c1cnn2c1N[C@@H](c1ccc(OC)cc1)C[C@@H]2C(F)(F)F 4952960 DKRZYGJWELFHBV-HUUCEWRRSA-N 398.385 2.928 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1nnc(C2CCCCC2)s1 6730846 SGRDOFNJAXSUBK-UHFFFAOYSA-N 386.525 2.742 0 50 GFAA O=C(NC[C@@H]1Cc2cccc(-c3cnccn3)c2O1)c1ccc2c(c1)OCO2 12133774 XNPVZDLQZFUMEU-HNNXBMFYSA-N 375.384 2.606 0 50 GFAA O=C(NC(=S)Nc1cccc(C(=O)N2CCOCC2)c1)C1CCCCC1 12138732 TYSPAJAZCXSZRW-UHFFFAOYSA-N 375.494 2.552 0 50 GFAA CC(C)c1noc(CNC(=O)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)n1 12713145 VCOZXHZQNDAZON-AWEZNQCLSA-N 390.871 2.901 0 50 GFAA O=C1N(C2Cc3ccccc3C2)C[C@@H]2C[C@@H](c3ccc(CO)o3)N3CCC[C@@]123 12749426 VISJJOHMMWKCEL-NYDSKATKSA-N 378.472 2.677 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCC[C@H](OC)C2)n1CCc1ccccc1 15078657 NJRISOJYZYPJSF-IBGZPJMESA-N 391.537 2.530 0 50 GFAA CC[C@@]1(C)Cc2c(c(N3CCOCC3)nc3sc4c(=O)[nH]cnc4c23)CO1 17056917 IRXSIBLJBNTOAF-IBGZPJMESA-N 386.477 2.611 0 50 GFAA COCCCn1c(=S)[nH]c(=O)c2c(C(F)(F)F)cc(-c3ccn(C)n3)nc21 20605494 NVYPFWCFPGVQNB-UHFFFAOYSA-N 399.398 2.910 0 50 GFAA OCC[C@H]1CN(Cc2cccn2-c2ccccn2)CCN1CCc1ccccc1 22913302 AXBDCKZDHSAWQZ-QFIPXVFZSA-N 390.531 2.984 0 50 GFAA COc1ccc(CNCc2c(C(=O)N3CCCC3)nc3ccccn23)c(OC)c1 23311825 KESUEQWAEZUZKY-UHFFFAOYSA-N 394.475 2.877 0 50 GFAA O=C(c1c(F)cccc1F)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38530718 FEMUSVDPQVWEKL-UHFFFAOYSA-N 387.434 2.708 0 50 GFAA CN1CCN(C[C@@H]2CCOC2)CC12CCN(C(=O)CCC1CCCC1)CC2 67458096 YLSXIWQJVAZXHX-FQEVSTJZSA-N 377.573 2.602 0 50 GFAA C[C@H](CN)C(=O)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67491223 ZBRHLWPOYQXDKC-GFCCVEGCSA-N 383.473 2.985 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3c(C)cccc3C)CC2)C1 67772871 GZKGBPCQKADDCM-FQEVSTJZSA-N 387.568 2.742 0 50 GFAA Fc1ccc(-c2cnnc(N3CCN(CCOc4ccccc4)CC3)n2)cc1 67885236 GGBVMTSEDKBNIH-UHFFFAOYSA-N 379.439 2.879 0 50 GFAA CN1[C@@H](c2ccccc2Cl)[C@@H](C(=O)NCc2ccncc2)C[C@@]1(C)C(=O)O 67895843 DCHGYJRSBGCMBL-KNBMTAEXSA-N 387.867 2.888 0 50 GFAA COc1cccc(C[C@]2(CO)CCCN(C(=O)c3cn4ccsc4n3)C2)c1 67974317 PRXIFGKRPBFMDV-HXUWFJFHSA-N 385.489 2.862 0 50 GFAA COc1c[nH]c(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)cc1=O 71771290 OFTIAODYAQYYDJ-MRXNPFEDSA-N 383.231 2.904 0 50 GFAA c1cn(-c2ccc(OC[C@@H]3CCCO3)cc2)c(-c2cc3n(n2)CCCNC3)n1 72469180 FAOHYMXKWATDQP-IBGZPJMESA-N 379.464 2.787 0 50 GFAA CSCCC(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91433717 FQMCCCDRIWMIPD-UHFFFAOYSA-N 375.538 2.608 0 50 GFAA COc1cccc(-c2cc(C(=O)NCCc3nc(C)c4c(n3)CCC4)[nH]n2)c1 91476174 VZWIFWXOQWZFFZ-UHFFFAOYSA-N 377.448 2.645 0 50 GFAA O=C(NC[C@@H](c1ccncc1)N1CCOCC1)c1c[nH]nc1C1CCCCC1 91690843 QXVMHMYJKQYDKR-IBGZPJMESA-N 383.496 2.656 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1cc(C)nc3c1c(C)nn3C)C2 91894986 KIWVLMZUEYAPHI-AWEZNQCLSA-N 380.448 2.575 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cncc(Cl)c3)CC2)CN1C[C@@H]1CCCO1 95380735 BMBCDSKRLWPGSK-KRWDZBQOSA-N 391.899 2.759 0 50 GFAA CCc1cc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)on1 95381383 YELRQJUGQBVEAP-CEWLAPEOSA-N 381.476 2.948 0 50 GFAA C[C@@H](NC(=O)c1coc(CN2CCOCC2)c1)c1cnn(-c2ccccc2F)c1 95385473 CNQUKDQZHZFYJZ-OAHLLOKOSA-N 398.438 2.928 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1ccccc1N1CCOCC1)C2 95501621 MINCOWMXZNRYRW-INIZCTEOSA-N 382.460 2.513 0 50 GFAA COCCn1cncc1CN1CCC[C@@H](CNC(=O)c2ccccc2Cl)C1 95519042 YXXICICOSANOHV-INIZCTEOSA-N 390.915 2.825 0 50 GFAA COc1cc(C(=O)NC[C@H](C)O)ccc1OC1CCN(C2CCCC2)CC1 95527135 PEHSKDMEFBRALQ-HNNXBMFYSA-N 376.497 2.592 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)Cc2cccc(Cl)c2)CN1C1CCCC1 96151276 LMVQFCZCAYKOQL-WMZOPIPTSA-N 377.916 2.520 0 50 GFAA Cc1nonc1OCCNC(=O)Nc1ccc(Cl)c(C(=O)OC(C)C)c1 96166585 ODLKBZHDXQHYAX-UHFFFAOYSA-N 382.804 2.797 0 50 GFAA CC(C)Cn1c(=O)c(C2=Nc3ccccc3S(=O)(=O)N2)c(O)c2ccccc21 100504347 VYPYSWWKHUDIRT-UHFFFAOYSA-N 397.456 2.733 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C)CC3)[C@H](CCO)C2)c2ccccc12 104628106 OSDJREWNPVEZGY-OAQYLSRUSA-N 397.563 2.811 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)NCc1cccnc1OCC(F)(F)F)CO2 124329457 IAEWOFWAIGQSAC-CQSZACIVSA-N 396.365 2.899 0 50 GFAA COc1ccc(OC)c([C@@H](O)Cn2ccn3nc(-c4cccs4)cc3c2=O)c1 169758081 UISQHGBJRIGYKB-KRWDZBQOSA-N 397.456 2.975 0 50 GFAA O=C(CCn1cc(Br)ccc1=O)NC1C2CC3CC(C2)CC1C3 170626354 NRCKTNLMHKSYRJ-UHFFFAOYSA-N 379.298 2.942 0 50 GFAA CCCOc1ccc(CNC(=O)c2nnn(-c3ccc(OC)cc3)c2C)cn1 170973245 XDMMAOSJEQRCGC-UHFFFAOYSA-N 381.436 2.698 0 50 GFAA Cc1ccc(NC(=O)N2CCC(NC(=O)C3CC3)CC2)cc1C(=O)NC(C)C 171779481 IEKGWJAGFXNTBF-UHFFFAOYSA-N 386.496 2.656 0 50 GFAA CC[C@@H]1CN(S(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)c2ccccc2O1 172902797 ZGQHCGKRLNPDCJ-MRXNPFEDSA-N 386.473 2.962 0 50 GFAA COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cc1OC 179505824 ZEUKYTQWCHRUKZ-ZFWWWQNUSA-N 399.495 2.906 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)nn1 179538792 LSWLHJKRPPSGJG-MRXNPFEDSA-N 394.454 2.629 0 50 GFAA Cn1ncc(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)c1N 183470744 UZQITBUBWDNDIV-AWEZNQCLSA-N 396.278 2.943 0 50 GFAA Cc1nn(C)c(C)c1-c1cc(C(=O)N[C@H](C)c2nc(CC(C)C)no2)n(C)n1 215029953 MLPHWNQGMJDIKD-GFCCVEGCSA-N 385.472 2.510 0 50 GFAA CCn1cc([C@@H]2C[S@@](=O)CCN2c2ncnc3c2oc2ccccc23)cn1 225410336 WLFHPWTUNGNLSJ-QZXCRCNTSA-N 381.461 2.902 0 50 GFAA O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1cnn(Cc2ccccc2Cl)c1 238098031 JMAAQFOKWOEMDM-INIZCTEOSA-N 391.855 2.681 0 50 GFAA C[C@H](OC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)C(=O)c1c[nH]c2ccccc12 248323302 XQCBVNBARHXIGS-NUEKZKHPSA-N 396.443 2.848 0 50 GFAA CN(C(=O)CNC(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 252516920 XWNSEMFEYYFBKI-IUIKQTSFSA-N 385.291 2.995 0 50 GFAA COc1cc(F)ccc1NNC(=O)[C@H]1CCCN1c1ncnc2sccc12 253433323 VPQZMKHHNDFMEN-CQSZACIVSA-N 387.440 2.951 0 50 GFAA Cc1sc(Br)cc1S(=O)(=O)NC[C@@H]1CCn2ccnc2C1 328636902 VTZGYQQXSWNWEP-SNVBAGLBSA-N 390.328 2.556 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)CC1 375937138 DSJNMHDFIGFBCJ-KRWDZBQOSA-N 387.528 2.788 0 50 GFAA COCC(=O)Nc1cc(NC(=O)N(C)Cc2c(C)noc2C)ccc1OC 426701610 MWWUPALPAWVGHV-UHFFFAOYSA-N 376.413 2.549 0 50 GFAA O=C(NCCCSCc1ccccc1)N1CCN(C(=O)C2CCC2)CC1 584888511 NMERDZRCKNLPIF-UHFFFAOYSA-N 375.538 2.964 0 50 GFAA COCCN1CCC[C@H](CNS(=O)(=O)c2cc(Cl)c(Cl)s2)C1 670473319 OSNSDYFREOMTSS-SNVBAGLBSA-N 387.354 2.692 0 50 GFAA COc1cccc2c1OC[C@H](NC(=O)c1c3c(nc4onc(C)c14)CCC3)C2 824804771 LWJJWYRMQVNMQA-CYBMUJFWSA-N 379.416 2.762 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 828003713 XFELZQKXGLHVJY-MBWAJUJLSA-N 390.491 2.951 0 50 GFAA O=C(NCCN1CCC[C@H](CO)C1)c1cccc(OCc2cccc(F)c2)c1 828711161 LWHIKHKOJFAXEO-SFHVURJKSA-N 386.467 2.839 0 50 GFAA C[C@H]1C[C@H](NC(=O)c2ccnc3cc(F)cnc23)c2ccsc2S1(=O)=O 888091003 XVTKQHPYLBUKIK-ZANVPECISA-N 391.449 2.867 0 50 GFAA CCOC(=O)c1ccn(-c2ccc(NC(=O)N(C)[C@@H]3CC[C@@H]3OC)cc2F)n1 932034025 HOQQIOSMPMZHLK-SJORKVTESA-N 390.415 2.829 0 50 GFAA CC1(C)CN(c2nccn3nnnc23)[C@@H]1c1nccn1-c1cccc(Cl)c1 952893565 JFJPXNMHZAHQGE-CQSZACIVSA-N 380.843 2.946 0 50 GFAA NC(=O)COc1cccc(C(=O)Nc2ccc(OC[C@@H]3CCCCO3)cc2)c1 952968831 LUVZJTWQHDZAEJ-IBGZPJMESA-N 384.432 2.751 0 50 GFAA CCCn1cc(S(=O)(=O)N(CC)CCc2nc3cccc(C)c3[nH]2)cn1 952969274 SXCUTWLYXKNSQR-UHFFFAOYSA-N 375.498 2.731 0 50 GFAA Cc1ccc(F)c2[nH]c(C(=O)Nc3cccc([C@]4(C)NC(=O)NC4=O)c3)cc12 1441371469 NLXSFVWGDYEQIS-FQEVSTJZSA-N 380.379 2.922 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCc2c(OC)ccc3ccccc23)C1 1506397985 ZTRXYSXRXFRGOH-HNNXBMFYSA-N 378.494 2.541 0 50 GFAA CCOC(=O)N1CCC(N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)CC1 1529092684 XACRNWBFAOZNFE-DYESRHJHSA-N 383.492 2.691 0 50 GFAA CC[C@H]1CN(C(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)CCO1 1704330821 GSKIBWPWMKMCCZ-ZDUSSCGKSA-N 377.416 2.806 0 50 GFAA CCOc1ccc(CCCC(=O)N2C[C@@H]3COCC[C@]3(C(=O)O)C2)cc1C 1772709575 IDWBYTNEKMNMHQ-UTKZUKDTSA-N 375.465 2.666 0 50 GFAA CN1CCC2(CC1)CN(C(=O)c1ccc(N3CCCC3)c(Cl)c1)CCO2 1772811651 WQLAQYZOYGQHGP-UHFFFAOYSA-N 377.916 2.877 0 50 GFAA CCc1nc(CC(=O)N2[C@H]3CC[C@@H]2C[C@@H]3NC(=O)c2occ3c2CCC3)cs1 1775991693 LZNYVQGVHJCCFJ-PVAVHDDUSA-N 399.516 2.892 0 50 GFAA C[C@H](O)c1cn(CC(=O)N[C@H](CCc2ccccc2)c2cccc(F)c2)nn1 1875312959 LCQGGFGBSVBXOX-HNAYVOBHSA-N 382.439 2.961 0 50 GFAA O=C(N[C@@H]1CC[C@H](CCNc2ncnn3cccc23)C1)[C@]12CC=CCN1CCC2 1875326667 RWLKZIMQLBCDNC-JBYIUTFZSA-N 394.523 2.611 0 50 GFAA CCO[C@@H](CC)C(=O)N1CCC(c2nc(C(F)(F)F)n3c2CNCC3)CC1 1875393534 NUFKIWRCNJWDSS-AWEZNQCLSA-N 388.434 2.526 0 50 GFAA O=C(CN1C(=O)CCCc2ccccc21)NCc1ccc2c(=O)cc[nH]c2c1 2325718817 WMMNIPWSGWMILW-UHFFFAOYSA-N 375.428 2.514 0 50 GFAA CCOCC1(C(=O)NC[C@@H]2CN(C(=O)c3ccc4cc[nH]c4n3)CC[C@H]2C)CC1 2325793628 BAZCSUZHHYIUJK-NVXWUHKLSA-N 398.507 2.594 0 50 GFAA CCN=c1ncc(CN2CCC[C@@]23CCCN(c2ccc(C)cc2)C3=O)c[nH]1 2356136240 LYIABXDEJQNYFX-QFIPXVFZSA-N 379.508 2.800 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(c4cnccn4)C3)[C@@H]3CCCC(=O)N23)c1 2356139907 MDLLUQSYVBMSSN-ZFMNYDKASA-N 392.503 2.934 0 50 GFAA CO[C@H]1C[C@@H](C(=O)NCCc2cccnc2)CC[C@@H]1NC(=O)Nc1ccccc1 2356163550 IKHCXLQTPKZMAP-IHPCNDPISA-N 396.491 2.746 0 50 GFAA COC(=O)C1=NN(C(=O)c2cccc(OC)c2)[C@@](O)(c2ccc(Cl)cc2)C1 1214569 HIWPQVSPQFVUIQ-IBGZPJMESA-N 388.807 2.569 0 50 GFAA COc1cc(OC)cc(C(=O)Nc2ccc(I)cn2)c1 6701480 KPZBBEOAWINKFP-UHFFFAOYSA-N 384.173 2.956 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)[C@H]2C3CCC(CC3)[C@@H]2C(=O)O)CC1 6715186 SLONXHAASRIKPK-PNGKTBNWSA-N 386.492 2.871 0 50 GFAA CCc1noc(C)c1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 6729510 UPZKIGVLVUHWJY-UHFFFAOYSA-N 377.466 2.972 0 50 GFAA O=C(Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1C(=O)Nc2ccccc2[S@@]1=O 6864727 PTUIGLJFYKYTGB-DLUDVSRJSA-N 397.239 2.630 0 50 GFAA Cc1cc(C)cc(N2CCN(C(=O)[C@@H]3CCC(=O)N(C4CCCC4)C3)CC2=O)c1 11703969 UPFNTCPUYWHDAE-GOSISDBHSA-N 397.519 2.660 0 50 GFAA CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCCN(C(=O)CN2CCCC2=O)C1 11818585 RJCSOIYHDHUQRL-ZWPAVUJESA-N 398.503 2.884 0 50 GFAA CCOC(=O)N1CCC(N2CCC[C@@H](CNC(=O)c3cccs3)C2)CC1 11879023 JJMLPRJAFPRYMK-HNNXBMFYSA-N 379.526 2.811 0 50 GFAA COCCOc1ccccc1C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1 12406056 JILCDPJFSOSNAP-SFHVURJKSA-N 398.459 2.873 0 50 GFAA CN(C)C(=O)c1nn(CC2CCCCC2)c2c1C[C@H](NCc1ccon1)CC2 14538347 PYTDIMLGWOAXSR-MRXNPFEDSA-N 385.512 2.800 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OCC)c(Cl)c2)CC1 16490039 SNPHOCUUBOWMTE-UHFFFAOYSA-N 375.874 2.703 0 50 GFAA COc1cc(C)c(CNCc2cccnc2N2CCN(C(C)=O)CC2)cc1C 19338163 MDRHSGDBZDSCNO-UHFFFAOYSA-N 382.508 2.665 0 50 GFAA CC(C)c1cc(I)ccc1NC(=O)CN1CCOCC1 19852621 ISBDUPVEPKXWFK-UHFFFAOYSA-N 388.249 2.685 0 50 GFAA Cc1ccccc1C(=O)N[C@H](N[C@H]1CCCS1(=O)=O)C(Cl)(Cl)Cl 22205064 CBBHITHUVKGANW-YPMHNXCESA-N 399.727 2.545 0 50 GFAA Cc1ccc2c(=O)cc(C(=O)N3CCC(CCN4CCOCC4)CC3)oc2c1C 32593799 XQJBKTZDELEFRD-UHFFFAOYSA-N 398.503 2.984 0 50 GFAA COc1cc(CN2CCN(C3CCCC3)[C@H](CCO)C2)cc(OC)c1OC 39478509 DARFYJFEXIDJBX-GOSISDBHSA-N 378.513 2.524 0 50 GFAA CCn1cc(Cl)c(C(=O)N2CCC(Cc3nnc(SC)n3C)CC2)n1 55226974 NLADGRZASXVADD-UHFFFAOYSA-N 382.921 2.502 0 50 GFAA CN(CC[C@@H]1CCCCO1)S(=O)(=O)c1ccc(N2CCCCC2=O)cc1 62156766 ZUHXWWZFTMAFDU-KRWDZBQOSA-N 380.510 2.783 0 50 GFAA COc1cc(C)ccc1OCc1nc(C(=O)N2CC(N3CCCCC3)C2)co1 67690532 KYWGDQKMXNKYRC-UHFFFAOYSA-N 385.464 2.881 0 50 GFAA C[C@@H](C(=O)N1CCC(n2nccc2NC(=O)C(C)(C)C)CC1)N1CCCC1 67878393 XOGROUCCZJBYAG-HNNXBMFYSA-N 375.517 2.516 0 50 GFAA CC[C@H]1CN(C(=O)c2c(C)cc(C)[nH]c2=O)CCC(=O)N1Cc1ccccc1 71753302 KGOIWEZDSJGBAP-SFHVURJKSA-N 381.476 2.645 0 50 GFAA Cc1c[nH]c(C(=O)N2C[C@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)c1 72143876 LLLXXLHCWJGCDS-MAODMQOUSA-N 379.460 2.754 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1cccc(Cl)c1Cl)CCN2CC1CC1 72481287 KFGHILMCXMQRML-CVEARBPZSA-N 389.348 2.687 0 50 GFAA CC(C)c1cc(C(F)(F)F)nc(N2CCN(C(=O)C3CCOCC3)CC2)n1 82121895 RJACJNXLFGGGHU-UHFFFAOYSA-N 386.418 2.694 0 50 GFAA O=C(NCc1cnc(-c2ccccc2)s1)[C@H](c1cccnc1)N1CCOCC1 91351070 ROPBRQRMPODWFV-IBGZPJMESA-N 394.500 2.895 0 50 GFAA Cc1cc(C(=O)N2CC[C@]3(CCCN(CC4CC4)C3=O)C2)c2c(C)noc2n1 91461029 CDIDYKVZHYTQNQ-OAQYLSRUSA-N 382.464 2.704 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91562808 XLPPCQLKWBHGHB-JOCHJYFZSA-N 380.492 2.508 0 50 GFAA COCC[C@]1(O)CCN(C(=O)c2cc(-n3cccn3)ccc2Cl)C[C@H]1C 91663625 LAIMTXGVVNKJBJ-AUUYWEPGSA-N 377.872 2.775 0 50 GFAA Nc1ccnc(N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C2CC2)C3)n1 92099259 VORNEGLUTQKUOK-SFHVURJKSA-N 377.492 2.824 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2c(C)noc2C)C3)cn1 95387003 OZOKSOPNDRRLIJ-UHFFFAOYSA-N 382.464 2.650 0 50 GFAA Cc1ccc(-c2cc(CN3CCN(C)[C@]4(CCC(=O)N(C)CC4)C3)on2)cc1 95389029 UDZGMWVIMMHHMG-QFIPXVFZSA-N 382.508 2.779 0 50 GFAA O=C(c1ccc(-n2cncn2)nc1)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 109693207 WZQMPONROFCKAS-IBGZPJMESA-N 397.866 2.902 0 50 GFAA Cc1ccc([C@H]2COCCN2C(=O)c2ccc(CN3CCN(C)CC3)cc2)o1 116988286 LYZZUBGQSJEPQD-HXUWFJFHSA-N 383.492 2.549 0 50 GFAA O=C(CN1CCN(C(=O)c2scnc2C2CC2)CC1)Nc1ccccc1F 132023803 NOHJRCOEJFYNBB-UHFFFAOYSA-N 388.468 2.556 0 50 GFAA Cc1cnc(CNC(=O)[C@H]2CC(=O)N(CCOc3ccccc3Cl)C2)s1 156560655 RKRCDSLDCJUJGR-ZDUSSCGKSA-N 393.896 2.649 0 50 GFAA O=C(Nc1cc(Cl)cc(Cl)c1)N[C@@H]1CCO[C@@]2(CCS(=O)(=O)C2)C1 170591905 QEFRMGMUXSBBSS-DOMZBBRYSA-N 393.292 2.851 0 50 GFAA O=S(=O)(c1ccc(F)cc1F)N1CCN(Cc2ccncc2Cl)CC1 173508079 BLYJJHJCDZVWKE-UHFFFAOYSA-N 387.839 2.520 0 50 GFAA CCc1c(C(=O)N2CC[C@@H](CNC)C2)cnn1-c1ccc(Br)cc1 178998478 YHQVJBXHGYEWTI-ZDUSSCGKSA-N 391.313 2.879 0 50 GFAA O=C(N[C@H]1CCCc2occc21)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 229731174 RYOKLFKTRVFXOL-YJBOKZPZSA-N 388.489 2.874 0 50 GFAA CCC[C@H](NC(=O)c1ccc(C(=O)O)cc1)C(=O)N1CCc2sccc2C1 237010750 UIAPKTPJRICGOW-INIZCTEOSA-N 386.473 2.930 0 50 GFAA Cc1c(C(=O)N(CCC(=O)O)C[C@H]2CCCO2)cnn1-c1cccc(Cl)c1 237731334 ABSOSVORBVMJAU-MRXNPFEDSA-N 391.855 2.930 0 50 GFAA CCc1cc(=O)oc2cc(OCC(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)ccc12 238937389 VAINHEDGSJOOKU-CTYIDZIISA-N 387.432 2.741 0 50 GFAA biogenic CCn1cnnc1[C@H]1CN(Cc2nc3ccc(Br)cc3o2)CCO1 241946701 UNGOFVKAXLJETO-CQSZACIVSA-N 392.257 2.775 0 50 GFAA CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CC[C@H](C(=O)O)CC1 245328649 VYQYYGKTJRHTTH-IHRRRGAJSA-N 388.530 2.640 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](c2ccccc2)n2nc(-c3ccccc3)nc2N[C@]1(C)O 248322424 WEMRBBSUMDJKDY-CSODHUTKSA-N 378.432 2.848 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1nc2ccc(Cl)cc2s1 250018436 LBQLWQISRINJQR-PVFTVIPPSA-N 387.848 2.695 0 50 GFAA O=C(O)COc1ccc(S(=O)(=O)Nc2ccc([C@H]3CCOC3)cc2)cc1F 295261477 YDFUULRXBBQOKA-ZDUSSCGKSA-N 395.408 2.594 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NCc1cn2ccsc2n1 298335072 YCDTWBAVTPUEJB-INIZCTEOSA-N 398.488 2.716 0 50 GFAA O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)[C@@H]1COc2ccc(Cl)cc2C1 299035634 PSAQSPRDBPHUCD-AAEUAGOBSA-N 376.806 2.892 0 50 GFAA COc1ccccc1C1(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)CC1 299579646 BOMGYCBLSHQJCX-UHFFFAOYSA-N 379.460 2.543 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2c[nH]nc2C(C)(C)C)CC1 328636182 NXFVTLMYJMKBDO-LJQANCHMSA-N 384.528 2.900 0 50 GFAA CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)N2CCC[C@H](OC)CC2)c1 376282895 SCQSENRCERKUBV-YJBOKZPZSA-N 397.541 2.937 0 50 GFAA Cc1cc(-c2ccc(C(=O)N3CCC(c4nncn4C)CC3)cc2)cnc1N 426373855 RZHSQBOQDDGDRU-UHFFFAOYSA-N 376.464 2.788 0 50 GFAA O=C(NCc1ccccc1Cl)C1CCN(C(=O)NCc2cccnc2)CC1 426612858 OGEBKOTXECHYAE-UHFFFAOYSA-N 386.883 2.973 0 50 GFAA Cc1ccc(C2(CNC(=O)N3CCC(S(N)(=O)=O)CC3)CCCC2)c(C)c1 455071201 JHLOZEBJKZEOJO-UHFFFAOYSA-N 393.553 2.578 0 50 GFAA CCn1c(=O)c2ccccc2n(CC(=O)N[C@@H](C)C(C)(C)c2ccccc2)c1=O 728002834 IQEFWCBHEQIRJM-INIZCTEOSA-N 393.487 2.666 0 50 GFAA CCn1c(=O)c2ccccc2n(CC(=O)N[C@H](c2ccccc2)C2CCC2)c1=O 729380516 VTVUVJQHPFOERV-OAQYLSRUSA-N 391.471 2.841 0 50 GFAA Cc1ccc(C[C@@H](CO)NC(=O)[C@H](NC(=O)OC(C)(C)C)C2CCC2)cc1 817595128 QBRGTWLJNXAGHV-ZWKOTPCHSA-N 376.497 2.708 0 50 GFAA Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)cc1 880985264 USIRVMXVDNGWIH-CYBMUJFWSA-N 387.461 2.946 0 50 GFAA Cc1nc2n(n1)CCN(C(=O)N[C@H]1C[C@H](c3cccc(OC(F)(F)F)c3)C1)C2 888102639 YSCASJVGIHHDTE-HDJSIYSDSA-N 395.385 2.957 0 50 GFAA Cc1cc(C)nc(Nc2ccc(Cl)c(C(=O)N(C)[C@H]3CCN(C)C3=O)c2)n1 906758818 FKUCCBMSGRBPTQ-INIZCTEOSA-N 387.871 2.793 0 50 GFAA Cc1ccc2c(C(=O)N[C@H](CO)CC(F)F)cc(-c3cnn(C)c3)nc2c1C 935649605 UENWZMDZMHVEIJ-AWEZNQCLSA-N 388.418 2.998 0 50 GFAA COc1cccc(OC[C@@H](O)CNC2CCN(c3ccc(F)c(F)c3)CC2)c1 952981440 WRNHDHNKTXRDNH-KRWDZBQOSA-N 392.446 2.972 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857673042 MHKTZAXUNGLFRT-QHCPKHFHSA-N 392.455 2.901 0 50 GFAA CC[C@H](NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1)C(=O)N(C)C 1857736306 OJJCLBJYSWXKJS-AWEZNQCLSA-N 392.887 2.681 0 50 GFAA COC(=O)c1cn(CC(=O)Nc2nc(-c3ccc(C(C)C)cc3)cs2)nn1 1875261891 CRNRFHWKSNJBLP-UHFFFAOYSA-N 385.449 2.950 0 50 GFAA C[C@H]1CCNC(=O)[C@@H]1CNC(=O)NCc1c(F)cc(C(F)(F)F)cc1F 1875313135 HVHWPRGPZGKTOK-WCBMZHEXSA-N 379.329 2.555 0 50 GFAA Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@]45CCCC[C@@H]4C5)C3)CC2)s1 1875328150 BAAKAGVRUFIAHQ-IERDGZPVSA-N 387.549 2.605 0 50 GFAA Cc1ncc[nH]c1=NS(=O)(=O)c1sc2ccccc2c1Br 1875340179 PEKRATQTXANPPN-UHFFFAOYSA-N 384.280 2.985 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccccc2F)o1 1875402549 JANRTGOBEKPIRG-ZTFGCOKTSA-N 399.422 2.764 0 50 GFAA O=S(=O)(c1cnccn1)N1CCC[C@H]1Cc1ccccc1Br 2325776477 QFSCMDSCWNOHQU-ZDUSSCGKSA-N 382.283 2.635 0 50 GFAA O=S(=O)(Cc1ccccn1)N1CCC[C@H]1c1cncc(Br)c1 2325803956 MBEBZTPCSRIZQQ-HNNXBMFYSA-N 382.283 2.906 0 50 GFAA c1ccc(-n2nc(C3CCOCC3)nc2[C@H]2CCCN(C3CCOCC3)C2)nc1 2356145419 AZOHGDLCBQOKNQ-SFHVURJKSA-N 397.523 2.915 0 50 GFAA COC(=O)c1ccc([C@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccc2)cc1 1018649 IYWFOEKDBIBINB-QGZVFWFLSA-N 381.457 2.905 0 50 GFAA Cc1nn(Cc2ccc(C(=O)NC[C@@H]3CCCO3)o2)c(C)c1Br 2780344 XQBXEYJBZIZXJV-LBPRGKRZSA-N 382.258 2.813 0 50 GFAA CCOc1ccc(N2C[C@@H](C(=O)NC3CC(C)(C)NC(C)(C)C3)CC2=O)cc1 4535237 YNBSZGIKYGEORH-HNNXBMFYSA-N 387.524 2.864 0 50 GFAA COc1ccc(NC(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)c(OC)c1 5399290 NNHYKRFWLPEVMY-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA COCCN1CCC(CN(Cc2c(C)nn(C)c2Cl)C[C@@H]2CCCO2)CC1 12835830 WNCZOGKJCJNWEQ-SFHVURJKSA-N 398.979 2.721 0 50 GFAA Cc1c(C(=O)NCCc2ccncc2)sc2ncnc(NC[C@H]3CCCO3)c12 14983859 BPNBJIACNGLHRZ-OAHLLOKOSA-N 397.504 2.958 0 50 GFAA CC(C)Cn1cc(C(=O)NCCc2ccccc2)c(=O)c(C(=O)NC(C)C)c1 15003878 SRDTXMGLZYCJGK-UHFFFAOYSA-N 383.492 2.615 0 50 GFAA Cc1nc(NCCNC(=O)c2cccc(C(F)(F)F)c2)cc(-n2cccn2)n1 23144365 BYLOYEMMRUHBJM-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA COCc1c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC[C@@H]2C)noc1C 55199155 SDCFSRPYRHQWKV-LBPRGKRZSA-N 386.452 2.859 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c(C)c1 67613219 GFZXBCFGASHJGO-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c(F)c1 67894765 QBVFQDFWHVLJRU-KRWDZBQOSA-N 389.515 2.789 0 50 GFAA Cc1cccnc1CN(Cc1ccccc1)C(=O)[C@@H]1CC2(CCNCC2)CN1 72129588 UIFIEJOASRGUDM-FQEVSTJZSA-N 378.520 2.651 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@@H](Nc3ccc4c(c3)OCCO4)C2)cc1 72145039 MWWXWTSJMCXCCJ-MRXNPFEDSA-N 378.436 2.514 0 50 GFAA OCC[C@@H]1CN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CCO1 72476044 APDJBZAZQOZSBY-LJQANCHMSA-N 394.475 2.895 0 50 GFAA CC(C)NS(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NC1CC1)n2C(C)C 77299648 CPBBSWJMAOERFU-UHFFFAOYSA-N 392.525 2.515 0 50 GFAA CN(CCC(N)=O)C(=O)c1ccc2c(c1)n(CC1CC1)c(=O)n2C1CCCCC1 77300428 ZKPJVFDRCSDRSE-UHFFFAOYSA-N 398.507 2.666 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(S(=O)(=O)CCOc2ccc(C)cc2)C1 91460562 ZEIGSZVVGPDJOP-QGZVFWFLSA-N 377.510 2.800 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cc1c[nH]c3ccccc13)C2 95386836 VTIAEDWOARXBNT-FUHWJXTLSA-N 388.471 2.869 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2ccccc2N(C)C)CC1 95388838 YQNVWCGZLMQOHN-UHFFFAOYSA-N 383.540 2.921 0 50 GFAA CCc1cc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)no1 95391904 WLSRQIHUMYVRSK-CEWLAPEOSA-N 381.476 2.948 0 50 GFAA COc1ccc(F)c(F)c1C(=O)N1C[C@@H]2c3ccccc3OC[C@]2(CO)C1 95505312 GUJWITKEMNLHIQ-ZUOKHONESA-N 375.371 2.584 0 50 GFAA Cc1cc(C)n(CCNC(=O)Nc2ccccc2CN2CCCCC2)c(=O)n1 95516595 QGQPBWPBASRQEZ-UHFFFAOYSA-N 383.496 2.668 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2nccc(-c3ccccn3)n2)CC1 96136030 DRJOUEHPUSWHFY-UHFFFAOYSA-N 375.432 2.510 0 50 GFAA O=C1CCc2cc(C(=O)N3CCN(CCc4ccccc4)CC3)c(F)cc2N1 134252379 PCTALQVIGJYFLV-UHFFFAOYSA-N 381.451 2.711 0 50 GFAA CN(CC1(O)CCCC1)C(=O)Nc1ccc2nc(N3CCOCC3)sc2c1 156207419 SNWHYHWMZJHEPQ-UHFFFAOYSA-N 390.509 2.902 0 50 GFAA COc1cc(C)c([C@@H](C)NC(=O)CN2CCOC3(CCCC3)C2)cc1OC 158225854 NSQRVTIOEZNADI-MRXNPFEDSA-N 376.497 2.834 0 50 GFAA CC[C@@H]1CN(C(=O)C2(C)CCN(Cc3ccccc3)CC2)CCN1C[C@@H](C)O 165709035 MGUHGJAJHICLCJ-TZIWHRDSSA-N 387.568 2.592 0 50 GFAA COCC(=O)N1CCc2c(NC(=O)c3ccc(NC(=O)C4CC4)cc3)cccc21 170594686 VOJMOQZZIXYOJE-UHFFFAOYSA-N 393.443 2.823 0 50 GFAA CCc1nsc(N2CCN(C(=O)NC[C@@H](c3cccnc3)C(C)C)CC2)n1 175477846 NFMPXZAXXUYWJJ-MRXNPFEDSA-N 388.541 2.767 0 50 GFAA CCc1nn(C)cc1CN1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1 179759170 WWWYXMKUBZZHGP-MRXNPFEDSA-N 380.496 2.911 0 50 GFAA O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)c1cccnc1OCC(F)(F)F 180960839 WDZFSYISBJMCNE-ZDUSSCGKSA-N 393.365 2.837 0 50 GFAA O=C1C[C@@H](Cc2ccccc2)C(=O)N1C[C@@H](O)COc1cccc2[nH]ccc12 191403146 MFKYYGNFNMMXCC-IAGOWNOFSA-N 378.428 2.525 0 50 GFAA COc1cccc2c1CCN(C(=O)Nc1ccc(N3CCOCC3)nc1C)CC2 193591391 FJBPVRJCSPYPHE-UHFFFAOYSA-N 396.491 2.868 0 50 GFAA COc1cc(C(F)(F)F)ncc1NC(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 252484740 GGDRQVAYWIJESM-LLVKDONJSA-N 398.389 2.633 0 50 GFAA CC(C)(O)[C@@H]1CCCN1c1nc2c(c(N3CCC[C@@H]3C(C)(C)O)n1)SCC2 328852002 ZWKFAEUMRSCVGS-CABCVRRESA-N 392.569 2.604 0 50 GFAA O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 332793294 BRZQQLPVXLDEGU-IWKCEXAMSA-N 375.513 2.567 0 50 GFAA O=C(Cc1ccccc1)N=c1cc(-c2ccccc2)[nH]n1[C@H]1CCS(=O)(=O)C1 334158648 ZEVHGATUNOZSAU-SFHVURJKSA-N 395.484 2.513 0 50 GFAA CNc1cc(-n2nc(C)cc2NC(=O)[C@@H](C)Cc2ccc(OC)cc2)ncn1 410797293 NWLNLHMXQHBPMZ-ZDUSSCGKSA-N 380.452 2.838 0 50 GFAA Cc1ccccc1N1CC[C@@H](CNC(=O)CCn2cnc3ccccc3c2=O)C1 827822508 XQFYVSONGGFAJS-SFHVURJKSA-N 390.487 2.738 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc(Br)cn3)CCN2)cc1 870140629 IVKUZLMKJWUIMT-INIZCTEOSA-N 376.254 2.639 0 50 GFAA CCN(Cc1ccccc1C)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 880984104 BWPAALRVHRVIMW-UHFFFAOYSA-N 387.461 2.775 0 50 GFAA Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@H](CO)[C@@H](O)C1CCCCC1 913048881 LGPYUDUXRFKZLA-AEFFLSMTSA-N 391.899 2.866 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1CCC[C@@H](OCc2ccccn2)C1 952977266 AHUUDUMQFDJRBG-GOSISDBHSA-N 377.444 2.604 0 50 GFAA NC(=O)[C@H](NC(=O)CCc1cc2ccccc2nc1O)c1ccc(Cl)cc1 1348085493 HHTFUEWBVQPOEV-GOSISDBHSA-N 383.835 2.869 0 50 GFAA COc1nccnc1N1CCC[C@H](CNC(=O)Cc2c(C)[nH]c3ccccc23)C1 1506403797 UJIUWJBEXHGPFZ-MRXNPFEDSA-N 393.491 2.850 0 50 GFAA CN(C)c1nc(-c2ccccn2)nc2c1CCN(C(=O)[C@H]1C[C@H]3C=C[C@@H]1C3)C2 1565528303 YGBCMZMIDXCKLF-UXLLHSPISA-N 375.476 2.702 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCC2(CC1)C[C@@](C)(O)CCO2 1704297237 SEKDDUPEEFNUBZ-IBGZPJMESA-N 394.899 2.900 0 50 GFAA CC[C@H](C)S(=O)(=O)N1CCC2(CC1)OCCc1cc(OC)c(OC)cc12 1704338301 QNMXZKBZZPRDBO-AWEZNQCLSA-N 383.510 2.696 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)N1CC[C@@H]2C[C@@H]2C1 1857527647 ZSAJVIGHSYXNOV-LALPHHSUSA-N 383.370 2.742 0 50 GFAA O=C(Cc1ccc(Cl)c2cccnc12)N[C@H]1C[C@@H](Cn2ccnc2)C[C@@H]1O 1857531041 NSQUJEMTVRCHGH-BVGQSLNGSA-N 384.867 2.583 0 50 GFAA Cc1cccc(N2CCN(c3cc(N4CCC(C)(O)CC4)ncn3)C[C@@H]2C)c1 1875267459 NGZJBDPRINSKKF-SFHVURJKSA-N 381.524 2.851 0 50 GFAA O=C1CN(C(=O)N2Cc3cccnc3N3CCC[C@@H]3C2)c2cc(F)c(F)cc2N1 1875317486 ZCRMTNRDQLCOTP-CYBMUJFWSA-N 399.401 2.723 0 50 GFAA COC(=O)c1cccc2sc(N3CCc4c(CC(N)=O)cccc4C3)nc12 1875321151 WJCDVLYHIYEEQV-UHFFFAOYSA-N 381.457 2.673 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N3CCOC[C@@H]3C)c(Cl)c2)C1 1875371319 WWJRNYHYTOLMBX-LSDHHAIUSA-N 391.899 2.928 0 50 GFAA COc1ccc([C@@H](O)C(=O)N2CCCN(c3nc4ccccc4o3)CC2)cc1 2100542609 AQAYJXOUSANRSI-LJQANCHMSA-N 381.432 2.609 0 50 GFAA CCOc1cc(CNC(=O)c2cccc(N=c3ccc(C)n[nH]3)c2)ccc1O 2325733653 YSPFXSXTYIAUNW-UHFFFAOYSA-N 378.432 2.985 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)N[C@@H]3C[C@H]3Cc3ccccc3)CC2=O)cc1 2325872173 LDBWMPBPYCPWTA-MBOZVWFJSA-N 379.460 2.731 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOc3cc(Br)ccc3C2)CC1 2325884557 IHDGHDOEYCVAFL-UHFFFAOYSA-N 393.281 2.595 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N[C@@H]3CCc4ccccc4NC3=O)ccc21 2325889726 NAOICHAYDFCDPQ-LJQANCHMSA-N 389.455 2.835 0 50 GFAA O=C1C[C@H](c2ccccc2)NCCCN(C(=O)c2ccncc2)CCCCN1 2356162899 SNDANTNRWFOCKA-HXUWFJFHSA-N 380.492 2.545 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCC[C@@]34CCCN(C)C4=O)cc2)n1 2356164698 CUCCLAAWIHDIFS-JOCHJYFZSA-N 380.492 2.775 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)N=C(O)N(Cc2ccccc2)C1=O)c1ccccc1 2376892 MEKDUFZIZUOACA-QGZVFWFLSA-N 377.322 2.631 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(OC)ccc1OC 4065369 JNTSNWAKCKBOOY-INIZCTEOSA-N 380.466 2.628 0 50 GFAA Cc1c(N(Cc2ccccc2F)S(C)(=O)=O)c(=O)n(-c2ccccc2)n1C 8041394 VVIFLSZKKYDAAJ-UHFFFAOYSA-N 389.452 2.590 0 50 GFAA CC(=O)Nc1ccnn1C1CCN(C(=O)c2cc(-c3ccccc3)no2)CC1 11662421 OZZMPKJZUXEXHG-UHFFFAOYSA-N 379.420 2.974 0 50 GFAA COC(=O)c1ccc(CNC(=O)c2cn(Cc3ccccc3Cl)nn2)cc1 11842853 RNVXKRIWIIZSBI-UHFFFAOYSA-N 384.823 2.696 0 50 GFAA Cc1cnc(C)c(-c2cc(F)c3c(c2)C[C@@H](CNC(=O)[C@@H]2CCCCN2C)O3)n1 12131416 SGVSYOXJNKMLAO-HKUYNNGSSA-N 398.482 2.804 0 50 GFAA COc1ccc(/C=C/CN2CCC[C@H](n3cc(C(=O)N4CCCC4)nn3)C2)cc1 12510928 ZYADLHCUOHMQJG-OQBYNLHGSA-N 395.507 2.873 0 50 GFAA O=C(c1coc(COc2ccc(F)cc2Cl)n1)N1CCN2CCC[C@@H]2C1 12594357 XREUYGJKRYHPKR-CYBMUJFWSA-N 379.819 2.966 0 50 GFAA COc1ccc(NC(=O)CSc2nc(O)c(Cc3ccccc3)c(=O)[nH]2)cc1 13108287 IHSRCILHIFLPPB-UHFFFAOYSA-N 397.456 2.806 0 50 GFAA C[C@H]1CCCN(C(=O)c2cn(C3CC3)cc(C(=O)NCc3ccccc3)c2=O)C1 14973277 JOQSHJXDHNVNGS-INIZCTEOSA-N 393.487 2.985 0 50 GFAA O=C([C@@H]1C[C@H](n2cnnn2)CN1Cc1ccc(Cl)cc1)N1CCCCCC1 14997218 PQPQIIQKPPEDHM-ROUUACIJSA-N 388.903 2.545 0 50 GFAA O=C(OC[C@H]1CCCN2CCCC[C@@H]12)c1cc2ncc(Br)cn2n1 15319700 JHZKYSMXDNEOKP-DOMZBBRYSA-N 393.285 2.913 0 50 GFAA O=C(Cc1ccc(Cl)cc1)Nc1ccc(NC(=O)CN2CCOCC2)cc1 20028322 CGVMDMZSVXFKSF-UHFFFAOYSA-N 387.867 2.792 0 50 GFAA CC[C@H]1CCCCN1C(=O)C1=CC(c2ccc(C)cc2)=NS(=O)(=O)N1C 20467449 IJLQDURVWSTJJH-INIZCTEOSA-N 375.494 2.649 0 50 GFAA CCn1ncc(CN2CCN(Cc3ccc(OC)c(C)c3)[C@H](CCO)C2)c1C 39541498 OPUNMPATZMCDBX-OAQYLSRUSA-N 386.540 2.597 0 50 GFAA CCCC(=O)Nc1ccc(CC(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1 55413492 FQRBULFZSMAZFO-LJQANCHMSA-N 375.513 2.537 0 50 GFAA COc1cc(C(=O)N2CCC(O)(c3ccc(C)cn3)CC2)cc(OC)c1OC 67974770 GMZVZZQZIZUCLN-UHFFFAOYSA-N 386.448 2.540 0 50 GFAA COc1ccc([C@@H]2CN(Cc3ccc(NC(C)=O)cc3)C[C@H]2NC(C)=O)cc1 91587043 FGPXMWBXKJSMNJ-FCHUYYIVSA-N 381.476 2.758 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N(CCO)Cc3ccc(F)cc3)c(=O)[nH]2)cc1 91694954 NKPYSFQAPJEMSH-UHFFFAOYSA-N 381.407 2.519 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2nn(C)cc2Cl)C3)cc1 95359540 MOGHDASUSIGBJY-JKSUJKDBSA-N 388.899 2.819 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)nc(C)n1 95529860 BBLHLICQPCSQQJ-UHFFFAOYSA-N 376.464 2.753 0 50 GFAA COc1cc2c(cc1CNC(=O)c1nccnc1C(=O)N1CCCCC1)CCC2 97446879 GQUVPMGUANHTSD-UHFFFAOYSA-N 394.475 2.530 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)NCCc2nc(-c3ccccn3)cs2)c1 109879875 JRAYDCCJZWOEKO-UHFFFAOYSA-N 387.486 2.581 0 50 GFAA COc1cc(C(=O)N2CCN(C(=O)Cc3ccc(F)c(F)c3)CC2)ccc1C 122883424 IMHXXJZYSQDWFW-UHFFFAOYSA-N 388.414 2.809 0 50 GFAA COc1ccc([C@@H](O)CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1 134125190 WXAKFKOVVWPKJM-PMACEKPBSA-N 382.460 2.540 0 50 GFAA COc1ccc(-c2ccc3nnc(CNC(=O)/C=C/c4ccco4)n3n2)cc1 169778611 VGKXRTACZIJBSI-DHZHZOJOSA-N 375.388 2.723 0 50 GFAA CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](Cc4ccccc4)C3)cn2)CC1 174846366 SIPWPCZRIOWTLN-FQEVSTJZSA-N 393.535 2.608 0 50 GFAA C[C@H]1CN(C)c2ccccc2CN1CC(=O)Nc1cccc(C(=O)N(C)C)c1 177399099 ULTMQAXKMWETIX-INIZCTEOSA-N 380.492 2.667 0 50 GFAA CC(C)(C)S(=O)(=O)CC(=O)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 183482258 JSKHANVISIRGKY-CQSZACIVSA-N 393.427 2.819 0 50 GFAA COc1ccnc(N2CCN(C(=O)c3nn(-c4ccccc4)cc3C)CC2)c1 185656778 QIOWCWYLJSUYGA-UHFFFAOYSA-N 377.448 2.547 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)NCc3cnn(Cc4ccccc4)c3)C2)n1 194474364 MEJGSMKXVOXCJI-SFHVURJKSA-N 380.452 2.712 0 50 GFAA CC1(C)CCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CCS1(=O)=O 194810500 GLPAKWAJVAXLMJ-CQSZACIVSA-N 392.443 2.769 0 50 GFAA Cc1[nH]c2c(F)cccc2c1CC(=O)N1CCc2nc(-c3cn[nH]c3)[nH]c2C1 215533348 KOPMFYPEPLDZET-UHFFFAOYSA-N 378.411 2.856 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)O)[C@H]21 216627139 ZVMXAIYIRBWSAF-IBGZPJMESA-N 396.399 2.683 0 50 GFAA biogenic CC(C)(CCC(=O)O)NC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O 236836967 HEWQETAZCCGSHH-NSHDSACASA-N 397.269 2.562 0 50 GFAA CCn1c(CO)nnc1[C@H]1C[C@@H](NC(=O)c2oc3cc(OC)ccc3c2C)C1 252536070 HNWUMKVECAJCPL-BETUJISGSA-N 384.436 2.530 0 50 GFAA Cc1c(C(=O)O)cnn1C1CCN(C(=O)CCc2cccc(F)c2F)CC1 263163000 JXIJVGCNFVNBOC-UHFFFAOYSA-N 377.391 2.964 0 50 GFAA COCCn1ccc(=O)c(OCC(=O)Nc2cccc(Br)c2)c1C 263587159 CWLJEAFBVCDEGL-UHFFFAOYSA-N 395.253 2.583 0 50 GFAA O=c1c2c(CO)c(-c3ccccc3)nn2ccn1Cc1noc(-c2ccccc2)n1 263615255 BKQGBYNWSHGPFR-UHFFFAOYSA-N 399.410 2.754 0 50 GFAA Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2C(=O)NCc1ncnn1-c1ccccc1 283493452 YFLYAGIQEPIERA-MSOLQXFVSA-N 389.463 2.531 0 50 GFAA Cc1c(C(=O)N2CC[C@@H](n3cc(Cl)cn3)C2)nnn1Cc1ccc(F)cc1 290730758 NZESILUMCRVRHR-MRXNPFEDSA-N 388.834 2.711 0 50 GFAA CNC[C@@H]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2Br)C1 299739025 JPWKOLYKDUXVGA-QWRGUYRKSA-N 375.694 2.938 0 50 GFAA COc1cc(NC2CCN(C[C@H](O)COCC(F)(F)F)CC2)cc(OC)c1 368390659 BIABJOYFBKDKEC-HNNXBMFYSA-N 392.418 2.520 0 50 GFAA CCN1CC[C@@H](NC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)C1 426465295 RBGQWBWRXQDCLX-OAHLLOKOSA-N 388.537 2.735 0 50 GFAA CN1CC2(CCN(C(=O)N[C@H](c3ccccc3)c3ccncc3)CC2)OC1=O 426510922 YZTNCKUKKYBEOP-GOSISDBHSA-N 380.448 2.797 0 50 GFAA CC(C)N1C[C@H](CNC(=O)N2CCC(c3nc4ccccc4n3C)CC2)CC1=O 426536278 LKQGVGVEGNDZQW-INIZCTEOSA-N 397.523 2.719 0 50 GFAA Cn1cc(-c2noc(-c3cn(-c4ccccc4C(F)(F)F)nn3)n2)ccc1=O 445613042 QGPHAQMTDMXLSL-UHFFFAOYSA-N 388.309 2.702 0 50 GFAA Cc1ccc2nc(CCC(=O)N3CCN(c4ncnc(C)c4C)CC3)[nH]c2c1C 952971418 KACAVKCTMQFQTO-UHFFFAOYSA-N 392.507 2.868 0 50 GFAA O=C(NC[C@H](c1ccccn1)N1CCOCC1)NC12CC3CC(CC(C3)C1)C2 952983727 QQUMUHKELDCGLW-MYZSEDEFSA-N 384.524 2.723 0 50 GFAA CCCCc1nc2ccccc2n1[C@@H](C)C(=O)N(CCO)Cc1nccn1C 952983974 YIWCFEMWYUPNQK-INIZCTEOSA-N 383.496 2.695 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccnn1C1CCCC1)c1cccc(F)c1 1506419720 VTTYGAJAFQVTDD-UHFFFAOYSA-N 380.445 2.542 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCCN(c2nc3ccccc3s2)CC1 1506423196 GDQYZAWQOSARFX-UHFFFAOYSA-N 378.461 2.692 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H](N)c3ccccc3)CC1)OCC2 1704297329 MXGSPTLAWPEVBF-OAQYLSRUSA-N 396.487 2.794 0 50 GFAA O=C(CC1CC1)N1CCCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 1772815656 RGLHBDDWZZVMBN-JOCHJYFZSA-N 385.552 2.612 0 50 GFAA Cc1cncc(CC(=O)N[C@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@@H]2O)c1 1857527546 KENHPSMZKGPIBL-GIVPXCGWSA-N 390.487 2.752 0 50 GFAA CC[C@@]1(C(=O)NCCn2cccn2)C[C@@H]2CC[C@H]1N2Cc1nc2ccccc2[nH]1 1857673340 NYPAYTNKXXQFJI-DKZVUGQWSA-N 392.507 2.709 0 50 GFAA O[C@H](CN1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCNCC1 1857675389 WCWDTFYYVUGDDE-HSZRJFAPSA-N 379.548 2.754 0 50 GFAA CC(C)N[C@@H]1CN2CCCC[C@@]2(C(=O)NCCc2nc3c(s2)CCCC3)C1 1857688427 IYBJEXHLRPCVOB-KKSFZXQISA-N 390.597 2.676 0 50 GFAA Cc1nn(CCC(=O)N2CCO[C@@H](CO)[C@@H]2c2ccccc2Cl)c(C)c1C 1875244016 ILMZMNNQHHHXPH-ICSRJNTNSA-N 391.899 2.813 0 50 GFAA C[C@H]1CCN(C(=O)N[C@H](C)c2ncc(-c3ccc(F)cc3)o2)CCS1(=O)=O 1875301319 FCTUORUQABAOHP-QWHCGFSZSA-N 395.456 2.760 0 50 GFAA Cc1[nH]nc2c1C[C@@H](C(=O)N1CC(Oc3ccc(Br)cc3)C1)CC2 1875302132 AZOCZZOXPSLRFJ-LBPRGKRZSA-N 390.281 2.875 0 50 GFAA Cc1cc(=NC(O)=C2N=NC3=C2CCCCC3)n([C@H]2CCS(=O)(=O)C2)[nH]1 2083730285 NCFOPCPPQGSQNZ-LBPRGKRZSA-N 377.470 2.796 0 50 GFAA COc1cccc(Cl)c1[C@H]1CN(C(=O)c2cncc(-n3ccnn3)c2)CCO1 2325791440 ZMPISQPSSRHPSF-QGZVFWFLSA-N 399.838 2.538 0 50 GFAA N[C@H](CNC(=O)Cc1cn2cc(F)ccc2n1)c1ccccc1Br 2325856221 GIKLSBTVSXNYIU-OAHLLOKOSA-N 391.244 2.595 0 50 GFAA O=C1NCCC[C@@]12CCCN2S(=O)(=O)c1cccc2cccc(Cl)c12 2356135746 RNAOILRZVLOJDJ-GOSISDBHSA-N 378.881 2.927 0 50 GFAA COc1ccc(-c2onc(N3CCC(O)(c4cccnc4)CC3)c2C(=O)O)cc1 2356143750 VPSXTMDZSYNNGU-UHFFFAOYSA-N 395.415 2.931 0 50 GFAA COc1cc(NC(=O)Cn2nnc(-c3ccccc3F)n2)c(OC)cc1Cl 794859 JRONPLMDBYUHFB-UHFFFAOYSA-N 391.790 2.789 0 50 GFAA Cc1c(NC(=S)NC(=O)c2ccc(F)cc2)c(=O)n(-c2ccccc2)n1C 994840 XWTFFLKSJSWTRT-UHFFFAOYSA-N 384.436 2.750 0 50 GFAA COc1ccc(CCNC(=O)[C@@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 2875209 PUVSIOOZKMFXLL-MRXNPFEDSA-N 390.505 2.517 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356170204 ZUABZZVVFISWMB-QFIPXVFZSA-N 378.476 2.891 0 50 GFAA O=C1N[C@H](c2ccc(O)cc2)[C@@H](C(=O)c2ccc(F)cc2)[C@](O)(C(F)(F)F)N1 4898589 MPEPRMHZBVKOIL-VBQJREDUSA-N 398.312 2.635 0 50 GFAA CCc1cccc(OC[C@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)c1 225835647 LJJFQKVVYXDNOJ-VGSWGCGISA-N 381.428 2.809 0 50 GFAA Cc1ccc(Nc2nc(N)nc(CN3CCN(c4ccccc4)CC3)n2)cc1 9245863 DMIFRSNZEOKCMR-UHFFFAOYSA-N 375.480 2.828 0 50 GFAA COc1cc(NC(=O)CN2C[C@H](C)O[C@H](C)C2)ccc1NC(=O)CC(C)C 55088915 VFQHZEWKGFPXBM-GASCZTMLSA-N 377.485 2.728 0 50 GFAA Cc1ccc(C)c(OC[C@@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 22147862 JUCJMPNFIKVJKG-FQEVSTJZSA-N 398.503 2.590 0 50 GFAA CN(C)C(=O)CNc1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cn1 67740547 MGPVPZOAVAQOTH-GOSISDBHSA-N 380.492 2.992 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccccc3Cn3cccn3)C[C@@H]2N1Cc1ccccn1 64040464 YNHBDSSACCSDQY-LEWJYISDSA-N 389.459 2.532 0 50 GFAA CCC(CC)C(=O)N1CCC2(CC1)CN(Cc1c(C)noc1C)CCN2C 67490140 DOKUEESWPMJRJF-UHFFFAOYSA-N 376.545 2.836 0 50 GFAA Cc1onc(C(=O)N2CCC(c3cc(Cc4ccccc4)n[nH]3)CC2)c1CO 67654342 VCFZQPBSSWBRIZ-UHFFFAOYSA-N 380.448 2.809 0 50 GFAA CCN(Cc1ccccn1)C(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1 151442620 OTCRVKQITJAWID-IBGZPJMESA-N 398.507 2.905 0 50 GFAA CCOC(=O)N1CCCn2nc(CN(C)Cc3cnc4ccccn34)cc2C1 72432397 ADMUVQMXCUQEMG-UHFFFAOYSA-N 382.468 2.525 0 50 GFAA O=C([C@@H]1OCCc2ccccc21)N1CCN(c2ncnc3sccc23)CC1 155416378 GBSCEJYYFHJINI-QGZVFWFLSA-N 380.473 2.654 0 50 GFAA O=S(=O)(CCC1CCOCC1)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 333110590 DXDSSCZUBSPYIN-HNNXBMFYSA-N 399.475 2.814 0 50 GFAA O=C(c1ccc(C[C@@H]2CCCNC2)cc1)N1CCCN(c2ccncc2)CC1 72132098 AWCBMUSMOBZXJJ-FQEVSTJZSA-N 378.520 2.976 0 50 GFAA CNC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 374402008 LPXSTZAIOUUOED-DLENHJPASA-N 392.503 2.998 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@]3(CCN(S(=O)(=O)N(C)C)C3)C2)cc1 72157079 OEWSNLRMGPKEBR-HXUWFJFHSA-N 379.570 2.904 0 50 GFAA C[C@@H]1CCc2c(sc3nc(CCC(=O)NCC[C@@H]4CCNC4)nc(O)c23)C1 262571221 HIBWUDCNEHCWDG-OLZOCXBDSA-N 388.537 2.570 0 50 GFAA CC(C)(C)c1nc2ccc(NC(=O)[C@H]3CCCN3S(C)(=O)=O)cc2s1 174569161 OGIDPLTVNKULFG-CYBMUJFWSA-N 381.523 2.956 0 50 GFAA O=C(Cn1c(S)nnc1-c1cccs1)N[C@@H]1CCOC2(CCCC2)C1 159572121 QTAKWQPOADCQHL-GFCCVEGCSA-N 378.523 2.903 0 50 GFAA CCn1cc([C@@H]2CN(C(=O)Nc3cccc(N4CCCC4=O)c3)CCO2)cn1 241173110 KGCPICZPDCIAIT-SFHVURJKSA-N 383.452 2.635 0 50 GFAA C[C@@H](NC(=O)N1CCN(CC2CCCC2)CC1)c1nc(-c2cccnc2)no1 426685243 FAKLFGJKSXLRRU-OAHLLOKOSA-N 384.484 2.710 0 50 GFAA Cc1ccc(-c2ccc(CCC(=O)N3CCN(Cc4nc[nH]n4)CC3)o2)cc1 426715832 GKRXVWONQCLHNH-UHFFFAOYSA-N 379.464 2.650 0 50 GFAA CC(=O)Nc1cccc2c1ccn2CC(=O)N[C@H](C)c1nnc2ccccn12 223216282 ITUGPXKNHSYJGL-CYBMUJFWSA-N 376.420 2.520 0 50 GFAA CCS(=O)(=O)CCNC1CCN(c2nc3ccc(Cl)cc3s2)CC1 95520278 KTFLQPYIQDLPDV-UHFFFAOYSA-N 387.958 2.943 0 50 GFAA COc1cc(CN2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)cc(OC)c1 91793332 BFUDRXJLAOGMCQ-VQIMIIECSA-N 381.476 2.835 0 50 GFAA CC(C)C[C@H](O)C(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91625781 IRBKFVHFDIPDTD-FQEVSTJZSA-N 386.536 2.867 0 50 GFAA CCN1C(=O)[C@@H]2[C@H]3c4ccccc4C=NN3[C@@H](C(=O)c3ccc(C)cc3)[C@@H]2C1=O 248136133 CRRARLBQFDLNJC-MTQWCTHYSA-N 387.439 2.572 0 50 GFAA COc1cncc([C@H](NC(=O)c2cc(O)c3cccc(F)c3n2)[C@H]2C[C@H](O)C2)c1 253534868 MYOAYRIALDOUKP-MJCKAROISA-N 397.406 2.725 0 50 GFAA COc1cccc(CN[C@H]2CNC(=O)c3cc(-c4ccc(C)cc4)nn32)c1OC 263618736 VFZPKHPNJSPPRL-HXUWFJFHSA-N 392.459 2.908 0 50 GFAA COc1cccc(C(=O)N2CCO[C@@H]3CC[C@H](C(=O)N4CCCCC4)C[C@H]32)c1 1940197715 KZDGTSRKWHEMDZ-DFQSSKMNSA-N 386.492 2.717 0 50 GFAA Cn1ccc(-c2noc([C@]3(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C3)n2)n1 864097585 XJRXCDNFBJQPTB-HNNXBMFYSA-N 387.362 2.911 0 50 GFAA CCc1cncc(C(=O)N(C)C[C@@H]2CCCN2C(=O)c2nccc3[nH]ccc23)c1 1875310200 ILXRIAHLYJIKNT-KRWDZBQOSA-N 391.475 2.897 0 50 GFAA CCn1c(N2CCc3cc(N4CCCC4=O)ccc32)nnc1C1(CO)CCC1 1875392293 HZFCXNJFHWKWCJ-UHFFFAOYSA-N 381.480 2.533 0 50 GFAA Cc1ccc([C@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(C)n1 1875397528 CXSMMSGMKZYRBK-ZWKOTPCHSA-N 396.539 2.737 0 50 GFAA NC[C@]1(F)C[C@@H](CNC(=O)c2snnc2-c2ccc(Br)cc2)C1 1875307858 NKGVGJUZTAKOCC-DXPFQBAHSA-N 399.289 2.774 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)Cc1ccc2c(c1)CCCO2 1875401736 QKGKNNSNAURJLD-FXAWDEMLSA-N 396.491 2.871 0 50 GFAA O=C(NCCCc1ccccc1F)[C@]12CNC[C@H]1CN(Cc1ccccc1)C2 1565531033 FWJYUMIOSPRPGO-REWPJTCUSA-N 381.495 2.596 0 50 GFAA OC1CCN([C@H]2CCN(c3ccnc4c(C(F)(F)F)cccc34)C[C@@H]2O)CC1 1565525314 LROMJZDCTPIBKF-ROUUACIJSA-N 395.425 2.650 0 50 GFAA COc1ccc2c(c1)OC[C@@]1(C(=O)O)CN(Cc3cncn3CC(C)C)C[C@@H]21 1565517048 PBHUPJHDUOCWDT-RXVVDRJESA-N 385.464 2.611 0 50 GFAA COC(=O)c1cc(NC2CCN(C(=O)N(C)C)CC2)ccc1Br 170593290 YJEZGZIYUABZNT-UHFFFAOYSA-N 384.274 2.794 0 50 GFAA CC(C)N1C[C@@H](C(=O)Nc2ccc(CN(C)C)c(Br)c2)CC1=O 170604616 MJKXDSCWAQWEDX-ZDUSSCGKSA-N 382.302 2.706 0 50 GFAA Fc1cc([C@H]2CN(Cc3nnc4n3CCOC4)CCO2)c(Cl)cc1Cl 280998852 FVPULZQUGFQVKH-CQSZACIVSA-N 387.242 2.828 0 50 GFAA Cc1cc(CNC(=O)[C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)cnc1C 1529179832 FGGNHDPOODTSFQ-RTWAWAEBSA-N 381.476 2.692 0 50 GFAA O=C([C@H]1CC12CCNCC2)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704300396 SUNYOVDQUQJTBW-GOSISDBHSA-N 379.504 2.948 0 50 GFAA Cc1cc(C(=O)N2CCCN(Cc3ccccc3Cn3cccn3)CC2)no1 1775983942 DTIVCORPDMYCGS-UHFFFAOYSA-N 379.464 2.576 0 50 GFAA O=C(C1CCCCC1)N1CCCN(C(=O)[C@@H](Cc2cnc[nH]2)n2cccc2)CC1 1772704045 BHNNQHPBXUNXLW-HXUWFJFHSA-N 397.523 2.636 0 50 GFAA COc1ccc(CNC(=O)c2cn(Cc3c(F)cccc3F)nn2)cc1OC 11934033 QNXQAUUVDZWMME-UHFFFAOYSA-N 388.374 2.552 0 50 GFAA CN(CCc1ccccc1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 11934874 BHACVWDOYIYDCK-NRFANRHFSA-N 397.563 2.801 0 50 GFAA COc1ccccc1C(=O)[C@@H]1CCCN(C(=O)Cn2nc3ccccc3n2)C1 12112295 UXWIJSALGDSAJQ-OAHLLOKOSA-N 378.432 2.561 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@H]1CCCN(C2Cc3ccccc3C2)C1 12203701 IKBYQXCUZGJCIY-IBGZPJMESA-N 378.472 2.706 0 50 GFAA O=C(NCCCOc1cccnc1)c1nc(N2CCCC2)nc2c1CCCC2 12318929 AIGIDHICBPOAJQ-UHFFFAOYSA-N 381.480 2.550 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]3(CCCN(CCCc4ccccc4)C3=O)C2)n[nH]1 12446523 LGCCKPCISKAGDX-QFIPXVFZSA-N 380.492 2.806 0 50 GFAA CN(C)c1ncc(CN2CCC[C@H]2C(=O)Nc2cccc(-n3cccn3)c2)s1 12589315 NPTRCTOVYJMSIA-SFHVURJKSA-N 396.520 2.998 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)c3cccs3)C2)cc1 12592644 IXLUYJIRMALTHB-CQSZACIVSA-N 394.518 2.587 0 50 GFAA COCCNC(=O)c1sc2ncnc(NCc3cccc(OC)c3)c2c1C 14993156 IBZQBQQDHUTSKT-UHFFFAOYSA-N 386.477 2.997 0 50 GFAA Cc1n[nH]c(C)c1CN(C)C(=O)C1(N2C[C@H](C)O[C@H](C)C2)Cc2ccccc2C1 15041958 XPBWTVRRPFKJTH-IYBDPMFKSA-N 396.535 2.632 0 50 GFAA CCn1c(CN2CCOCC2)nnc1SCC(=O)c1cc(C)n(CC)c1C 19852104 WCZMSPNHBFIIEA-UHFFFAOYSA-N 391.541 2.543 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)N[C@@H]1CCc2ccccc21)CCCC3 169778283 BEKRYBKQQHVXPF-QGZVFWFLSA-N 376.460 2.646 0 50 GFAA COc1ccc(-c2nc(CNC(=O)[C@H]3Cc4ccccc4CN3)c(C)o2)cc1O 1857666817 IJBBOGYCDKHURB-QGZVFWFLSA-N 393.443 2.695 0 50 GFAA COc1cc(Oc2cc(C(=O)N(C)Cc3ncon3)ccc2OC)ccc1CN 1857704150 GETVDCULDOCMGM-UHFFFAOYSA-N 398.419 2.610 0 50 GFAA NCCOc1cccc(CC(=O)N2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)c1 1857713605 RZTCRJVQAIZUHV-FCHUYYIVSA-N 380.488 2.945 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CCc2ncccc2C1 1857727853 CJGZSBXOSMHILM-CQSZACIVSA-N 378.457 2.629 0 50 GFAA COc1ccccc1-c1c(C)nn2c(NCCN3CCOCC3)cc(C)nc12 20548967 XDOZEYVLNAHBAF-UHFFFAOYSA-N 381.480 2.766 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cs1 1704303429 XWSNUUOLKJMENK-FQEVSTJZSA-N 384.505 2.927 0 50 GFAA O=C(NS(=O)(=O)N1CCCc2ccccc21)c1cccc(C(F)(F)F)n1 835123645 KZOBQQQJWCCJNP-UHFFFAOYSA-N 385.367 2.528 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccccc2)o1 2325785718 KIZJGPWHPHDCPN-KFKAGJAMSA-N 381.432 2.625 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@@H](O)c3cccc(F)c3)c2C)cc1 242047905 VRAKPZRJWQOSBY-LJQANCHMSA-N 382.439 2.800 0 50 GFAA Cc1nnc(NC(=O)[C@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)s1 921090 WFGYUMMNQUKCDG-INIZCTEOSA-N 392.440 2.693 0 50 GFAA COC(=O)CCCC[C@@H]1SC[C@@H](NC(=O)c2ccccc2)[C@@H]1OC(C)=O 4661741 PVEAODUKPHUVRQ-RYRKJORJSA-N 379.478 2.566 0 50 GFAA biogenic CCOc1ccccc1CC1(CCc2ccncc2)C(=O)N(C)C(=O)N(C)C1=O 5585923 VHLGWYFTFSPGBI-UHFFFAOYSA-N 395.459 2.692 0 50 GFAA CC(=O)c1cc(CN2CCC[C@H](CCC(=O)N3CCN(C)CC3)C2)cs1 12056297 ARUWSUZODCQKTN-QGZVFWFLSA-N 377.554 2.717 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)CSC)CC1 12198312 VELAWKUXBFPETQ-UHFFFAOYSA-N 388.493 2.671 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1ccc(Cl)s1 12200423 ALYHZUWKYBGIQM-OAHLLOKOSA-N 388.884 2.980 0 50 GFAA Cc1cccc(Cn2c(N[C@@H](C)c3ccccc3)nc3c2c(=O)[nH]c(=O)n3C)c1 12507798 LACRTZFACIWRLB-HNNXBMFYSA-N 389.459 2.953 0 50 GFAA COCCCN1C(=O)N(Cc2ccccc2)C(=O)C12CCN(CC(C)C)CC2 14752418 OPCVAXRBGFBMGB-UHFFFAOYSA-N 387.524 2.978 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)CCC3CCCC3)CC2)C1 15067316 ATKHAMDDYTVNBQ-SFHVURJKSA-N 375.557 2.938 0 50 GFAA O=C(NCc1cccs1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 16648592 JZUAYMRSUDHYOY-UHFFFAOYSA-N 382.482 2.992 0 50 GFAA COCC(=O)N1CCC[C@@H]1c1ccc(C(=O)N(C)CCc2ccccn2)s1 23214900 ULTVFXGJWCRSQU-MRXNPFEDSA-N 387.505 2.768 0 50 GFAA Cc1cc(NC(=O)CN2CCN(C(=O)c3ccco3)CC2)c2ccccc2n1 36054501 AVYJBFCIVKRLMD-UHFFFAOYSA-N 378.432 2.533 0 50 GFAA biogenic COc1cc(C)c(C)cc1S(=O)(=O)N1CCN(C(=O)c2cccs2)CC1 41245562 RNOCGJSZVBGYNG-UHFFFAOYSA-N 394.518 2.520 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 67601799 YXCSLXJDPCFNCG-UHFFFAOYSA-N 392.438 2.646 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@@H](C(=O)NCc4ccccn4)C3)CC2)o1 67805554 OJLHVQUPKUOTCJ-LJQANCHMSA-N 396.535 2.976 0 50 GFAA Cc1cc(NC(=O)N2CCN(C[C@H]3CCCO3)CC2)n(Cc2ccccc2)n1 68578113 LKVWMTQLKFJAHC-LJQANCHMSA-N 383.496 2.568 0 50 GFAA CSc1ccc(C(=O)[C@H]2CCCN(CC(=O)Nc3cn(C)nc3C)C2)cc1 71757005 LINSIRQSKQXLLI-INIZCTEOSA-N 386.521 2.984 0 50 GFAA CC(C)=CCN1CCN(c2nccc(-c3ccc(C)nc3C)n2)C[C@H]1CCO 72447875 VKZNJRAGRLHSRA-LJQANCHMSA-N 381.524 2.995 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3cccnn3)C2)CN1CCc1ccccc1 91475774 ABDPFFVOKQPOMQ-JOCHJYFZSA-N 378.476 2.564 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(c1ncc(Cl)cc1F)CC2 91586665 QNNHFEQPUUITRJ-UHFFFAOYSA-N 377.851 2.888 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)c1cnc(NC(C)C)nc1 91626145 KVUNITNZOKBHCX-AWEZNQCLSA-N 377.452 2.948 0 50 GFAA Cc1cc(C(=O)N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n(C)n1 95375268 DUTSJJJHZGOOBW-CDHQVMDDSA-N 386.446 2.709 0 50 GFAA O=C(Cc1c(F)cccc1Cl)N1CCN(Cc2ccccc2)C[C@@H](O)C1 95520088 HTMXHKKQHCSWOM-MRXNPFEDSA-N 376.859 2.727 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1ccc(OS(=O)(=O)c2ccccc2)cc1 101233150 QZILCGXCVLXCKE-KODHJQJWSA-N 397.452 2.990 0 50 GFAA CC(=O)N1CCC(CNC(=O)N(C)C2CCN(Cc3ccccc3)CC2)CC1 113617800 OWXBWGSSHWSJEM-UHFFFAOYSA-N 386.540 2.551 0 50 GFAA O=S(=O)(C[C@H]1CCCCO1)Nc1ccccc1-c1nnc2n1CCCCC2 150840098 OWHOCWNTSCMPFJ-OAHLLOKOSA-N 390.509 2.982 0 50 GFAA COc1ccccc1[C@@H]1CCN(CC(=O)Nc2cccc(C(=O)N(C)C)c2)C1 158100486 BIUQOVGHKLSHQV-QGZVFWFLSA-N 381.476 2.825 0 50 GFAA C[C@@H](CS(=O)(=O)NC(=O)c1csc([C@H]2CCCO2)n1)c1ccccc1 167003967 GVDJSUAJJODQQL-SWLSCSKDSA-N 380.491 2.858 0 50 GFAA CN1CC[C@@H](NC(=O)c2ccc(Sc3ccccc3Cl)nn2)CC1=O 170606093 NIBIWYAVKIUPLW-LLVKDONJSA-N 376.869 2.632 0 50 GFAA CCCCO[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)C1(C)C 170652254 XDQKDQDJIDTESQ-ROUUACIJSA-N 386.496 2.920 0 50 GFAA CC(=O)Nc1ccc(CNC(=O)N2CCC(NC(=O)c3ccoc3C)CC2)cc1 171154724 KYYNCCNFZRWZCZ-UHFFFAOYSA-N 398.463 2.650 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1ccccc1Cn1cncn1 173816071 VAFUOBBENKXEQV-UHFFFAOYSA-N 376.395 2.581 0 50 GFAA CCC[C@H](NC(=O)c1sc(COc2ccc(F)cc2)nc1C)c1nnn[nH]1 176741613 CTKFEXGYTYFJDR-ZDUSSCGKSA-N 390.444 2.954 0 50 GFAA Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N1CCC(=O)Nc2cc(F)ccc21 182549448 CEFYPAZNGYDMEZ-UHFFFAOYSA-N 394.472 2.833 0 50 GFAA CCn1cc([C@H]2C[S@](=O)CCN2C(=O)Cc2ccc(C(F)(F)F)cc2)cn1 225417558 ADPMENDGTIKJMW-CHAGWJKLSA-N 399.438 2.797 0 50 GFAA CS[C@H](CO)[C@H](C)NC(=O)C(C)(C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 241774186 RNTPJTMFVAQAFE-SOUVJXGZSA-N 388.574 2.888 0 50 GFAA CC[C@H](C)N1C(=O)[C@@H]2[C@@H](C(C)=O)N3c4c(ccc5cccnc45)C=C[C@H]3[C@@H]2C1=O 245255099 FMMIIWJTGVIPNO-VLBPLXHKSA-N 389.455 2.808 0 50 GFAA CCOc1ccc(-c2nc(CN3CCOC[C@H]3c3ncnn3C)cs2)cc1 283942952 AGASTWMHHPQFTN-KRWDZBQOSA-N 385.493 2.911 0 50 GFAA CSc1nnc(CNC(=O)Cc2ccc3c(c2)OCO3)n1-c1ccccc1C 299764665 CGZJYENLMVHDHI-UHFFFAOYSA-N 396.472 2.885 0 50 GFAA Cn1ncc(-c2ccccc2)c1NC(=O)NC1CCN(c2cnccn2)CC1 299800220 UJDMZQCHYGRFMD-UHFFFAOYSA-N 377.452 2.668 0 50 GFAA O=C(NCC1(CN2CCOCC2)CC1)N(Cc1ccc2[nH]ccc2c1)C1CC1 534676817 CHTBXPAPNCRROB-UHFFFAOYSA-N 382.508 2.954 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)c12 747344146 VEYZLGSUCRJDPU-IAGOWNOFSA-N 392.459 2.791 0 50 GFAA Cc1cnc([C@@H](C)N2CCN(C(=O)c3sccc3-n3ccnn3)CC2)s1 888102522 IYDGUSKJDUEFSO-CYBMUJFWSA-N 388.522 2.613 0 50 GFAA O=C(CCC(=O)N1CCC[C@H](c2nnc3ccccn23)C1)Nc1cccc(F)c1 952860602 QJHFYLZGARXHFN-HNNXBMFYSA-N 395.438 2.993 0 50 GFAA CC(C)c1cc(C(=O)N2CCC([C@H](O)c3cccs3)CC2)nc2ncnn12 1506418283 PNNRZPZNDGQPNO-KRWDZBQOSA-N 385.493 2.895 0 50 GFAA Cc1cc(C[C@@H](C)NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n[nH]1 1506424257 ZPFAKZYSAUYPPI-LLVKDONJSA-N 379.511 2.696 0 50 GFAA CC(C)=CCO[C@H]1COCC[C@@H]1NC(=O)c1nn2cc(C)cnc2c1Cl 1565528289 DHPKRIKINPCCDH-KBPBESRZSA-N 378.860 2.561 0 50 GFAA CC1=CC2(CCN(C(=O)[C@@H](C)N(c3ccccc3)S(C)(=O)=O)CC2)OCC1 1704338699 XJJSXRMVNPEFEQ-QGZVFWFLSA-N 392.521 2.569 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(c3ccnc(C)n3)C[C@@]2(CCc2ccccc2)C1 1772815408 LGKXTDNTDSZHPO-REWPJTCUSA-N 394.519 2.719 0 50 GFAA Cc1ccc2oc(CN3CCCN(C(=O)[C@@H]4CCC(=O)NC4)CC3)c(C)c2c1 1775979619 KHBVYQJZUVPUBX-QGZVFWFLSA-N 383.492 2.610 0 50 GFAA Cc1cc(=O)c(O)c(C2(CC(=O)NCc3csc(C)n3)CCSCC2)o1 1776111881 VWEQPJLETSWGGJ-UHFFFAOYSA-N 394.518 2.890 0 50 GFAA COc1c(Cl)cc(C(=O)N2C[C@@H](C(=O)O)C3(CCOCC3)C2)cc1Cl 1800414158 LTILSNONCJWWHF-NSHDSACASA-N 388.247 2.955 0 50 GFAA c1cn(CC[C@@H]2CCCN3CCCC[C@H]23)c(-c2cnc(N3CCOCC3)nc2)n1 1857677589 ITZZTFLVEMIJCV-AZUAARDMSA-N 396.539 2.831 0 50 GFAA C[C@H]1CN2C[C@H](NS(=O)(=O)c3ccc(Oc4ccccc4)cc3)C[C@H]2CO1 1857709237 MIRYYPLLQQMBFJ-BBWFWOEESA-N 388.489 2.619 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3c(-c4ccccc4)nc4ncccn34)C[C@@H]2O)on1 1857713012 RQICKEDIGVQMCV-XLIONFOSSA-N 389.459 2.728 0 50 GFAA CCN(C)CC(=O)NC[C@H]1[C@H]2CN(C3CCCCCCC3)C[C@]23CC[C@H]1O3 1857717073 LWYRCAGFASWPSW-GPQLQYNLSA-N 377.573 2.647 0 50 GFAA N[C@H](C(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)C1CCCCC1 1857723658 PRSSJPDNJXVZSU-WCIQWLHISA-N 391.943 2.878 0 50 GFAA O=C1N[C@H](C(=O)N2CCC(C3CCN(CC4CC4)CC3)CC2)Cc2ccccc21 1857730255 OHLJAYUSTNXWAR-QFIPXVFZSA-N 395.547 2.702 0 50 GFAA Cc1ccc(C(=O)N2CCO[C@@H](CN3CCCCC3)[C@@H]2c2cnn(C)c2)cc1O 1857736661 VPAPOZOMWWLROP-SFTDATJTSA-N 398.507 2.502 0 50 GFAA C[C@H]1OC2(CCN(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)CC2)NC1=O 1875274131 LJDFRCKWIALPAF-LLVKDONJSA-N 396.369 2.582 0 50 GFAA CCOC(=O)[C@@H](CC1CC(F)(F)C1)NC(=O)c1ccc(C2(CN)CCC2)nc1 1875304820 VZHZIEGTSDPCCK-OAHLLOKOSA-N 395.450 2.559 0 50 GFAA O=C(O)[C@@]1(n2cc(CCCO)cn2)CCCc2ccc(Br)cc2C1 1875305507 UJRYZZRQCVVWNB-GOSISDBHSA-N 393.281 2.929 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)Cc1n[nH]c2c1CCCC2 1875401538 KYQXMGXFHHKTPE-IFXJQAMLSA-N 398.511 2.709 0 50 GFAA CN(C[C@@H](O)c1ccc(F)cc1)C(=O)c1nc(N2CCCC2)ncc1Cl 2325708925 HCZKOKCFXYHEDO-OAHLLOKOSA-N 378.835 2.675 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2NCCc3sccc32)cc1-c1ccnn1C 2325810458 LRFTYSWKGXJWIT-INIZCTEOSA-N 382.489 2.774 0 50 GFAA NCc1ccc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)c(O)c1 2325860829 WGZYQZVHURQJCQ-UHFFFAOYSA-N 388.221 2.707 0 50 GFAA COc1cc(C(=O)N2CCC[C@]3(CCc4cnc(C)nc43)C2)cc(OC)c1OC 2356155373 DWYGKZKZMZUXPA-QFIPXVFZSA-N 397.475 2.931 0 50 GFAA O=C(COc1ccc(S(=O)(=O)N2CCCC2)cc1Cl)NC1CCCC1 2871523 WLQXBQXSHZNUDO-UHFFFAOYSA-N 386.901 2.562 0 50 GFAA Cc1ccc(C(=O)Nc2ccc(F)cc2F)cc1S(=O)(=O)N1CCOCC1 3561587 JXFQHAQJOQTZBS-UHFFFAOYSA-N 396.415 2.546 0 50 GFAA Cc1cccc(CN[C@H]2CCc3c(sc4ncn(CCN(C)C)c(=O)c34)C2)c1 12128230 KHRVTKFUHFOXTM-KRWDZBQOSA-N 396.560 2.975 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H]3CCCO3)n1)CCN(C(=O)c1ccc[nH]1)C2 19223070 RFZJZMQEKQYIFW-INIZCTEOSA-N 379.420 2.818 0 50 GFAA CCN1CCN(C2(C(=O)N(C)CC[C@@H]3CCCCO3)Cc3ccccc3C2)CC1 19740984 XLZVUQOSSMSELJ-QFIPXVFZSA-N 399.579 2.579 0 50 GFAA CCOC(=O)N1CCN(C[C@H](O)COc2ccc(C)cc2C(C)(C)C)CC1 19867725 UFIHALQUDZXCST-KRWDZBQOSA-N 378.513 2.806 0 50 GFAA COc1cccc([C@H]2CCN(C(=O)c3cccc(NCC(=O)O)c3)C2)c1OC 55183234 JJZJUVHHVJNVRF-HNNXBMFYSA-N 384.432 2.830 0 50 GFAA CCc1nc(NC(=O)Cn2nc(-c3ccc(OC)cc3)ccc2=O)sc1C 61720754 PXMFDSIZZHJKFN-UHFFFAOYSA-N 384.461 2.885 0 50 GFAA O=C(O)c1nn(CCCc2ccccc2)c2c1CN(C(=O)c1cccnc1)CC2 67880115 GJCPAQAGYPUCTR-UHFFFAOYSA-N 390.443 2.808 0 50 GFAA CO[C@H]1CN(C(=O)c2ccccc2-c2nc(-c3ccccc3)no2)CC[C@H]1N 71439946 LNXWAOXAFZNDKW-MSOLQXFVSA-N 378.432 2.592 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)NCCc1ccc(OCC)cc1 72429108 IUXNFBOJPNDKQC-OAQYLSRUSA-N 387.568 2.940 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(C[C@@]1(c3cccc(F)c3)CCOC1)C2 72431697 MDXUUIKVTTWJER-NRFANRHFSA-N 387.455 2.603 0 50 GFAA COc1ccc(CN2CC[C@@H]3[C@@H](CCC(=O)N3CCc3c[nH]cn3)C2)c(F)c1 72474948 RERWOSHCJHAQDU-OXJNMPFZSA-N 386.471 2.613 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3cnc(-c4cccnc4)nc3)CC2)c1 95368942 XLHKFEURISOZHQ-UHFFFAOYSA-N 389.459 2.505 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CC[C@H](Cc4cccc(C(N)=O)c4)C3)[nH]n2)o1 95378420 ULSOUZHIBCWNFQ-OAHLLOKOSA-N 378.432 2.782 0 50 GFAA CCn1ccc(C(=O)N2C[C@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n1 95518239 BTLLQYMGTGTRIF-CDHQVMDDSA-N 386.446 2.884 0 50 GFAA O=C(Nc1ccc(CN2CCOCC2)cc1)N1CCN[C@@H](c2ccccc2)C1 96141384 SWMKKMVMMXBDMO-OAQYLSRUSA-N 380.492 2.697 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CCN([C@@H]1CC(=O)N(Cc2ccccc2)C1=O)C3 100792210 RSECRWAEPKOIBM-OAQYLSRUSA-N 389.455 2.862 0 50 GFAA biogenic O=C(O)c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1 169818652 LJQYSJNYSWZJQV-UHFFFAOYSA-N 380.519 2.762 0 50 GFAA CC1(C)CC[C@H](CNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)O1 170601113 AYLPSYWXTNUJLI-QWHCGFSZSA-N 395.297 2.876 0 50 GFAA COc1cc(C(=O)N2CCC[C@]23CCOC3=O)ccc1OCc1cscn1 170601333 PPGVRTCTPCUWDU-LJQANCHMSA-N 388.445 2.652 0 50 GFAA CCOC(=O)[C@H](NC(=O)Cc1cccnc1)c1c(C)nn(-c2ccccc2)c1C 170624638 NLUFKVWSWKWQLO-OAQYLSRUSA-N 392.459 2.847 0 50 GFAA NC(=O)CC[C@H]1CCCN(C(=O)c2c[nH]nc2-c2cccc(OC(F)F)c2)C1 173006462 UROSLTGYQLJNPK-GFCCVEGCSA-N 392.406 2.796 0 50 GFAA Cc1cc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)c2cnn(C(C)C)c2n1 176676390 SZOWXXFZDRDRGJ-SFHVURJKSA-N 398.555 2.563 0 50 GFAA Cc1ccc(N2CC[C@@H](Nc3cccc(C(=O)N4CCOCC4)c3C)C2=O)cc1 177162661 PEZIOUBVMRTRAV-OAQYLSRUSA-N 393.487 2.993 0 50 GFAA O=C(Nc1ccc2nncn2c1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 179483966 IFAUQHDLODBVRE-CQSZACIVSA-N 383.839 2.874 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@H]3Cc4cc(C)c(C)cc4O3)CC2)ncn1 183973152 FJCIVNJCDGQJFK-LJQANCHMSA-N 396.491 2.899 0 50 GFAA O=C(CNC(=O)c1scnc1C1CCCC1)Nc1ccc(-n2cncn2)cc1 184581205 KVGGGSOPLPRTBO-UHFFFAOYSA-N 396.476 2.750 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3[C@@H](N)CC[C@H]3C2)cc(C)c1OCC(=O)N1CCCCC1 185178145 ZNUWJMMLNNYPGR-SXLOBPIMSA-N 399.535 2.504 0 50 GFAA O=C(c1cccc(NCc2cc(F)cc3cccnc23)n1)N1CCC[C@@H]1CO 190197137 ZEZSKWWOTDNIOU-QGZVFWFLSA-N 380.423 2.978 0 50 GFAA O=C(NCCN1CCOCC1)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1 200844064 MMHOEKYXCSBRKZ-UHFFFAOYSA-N 379.382 2.829 0 50 GFAA O=C(Nc1nnc(CCc2ccccc2)s1)[C@@H](c1ccccc1)n1cnnn1 211069148 PNHKRRHSWYEVDU-QGZVFWFLSA-N 391.460 2.538 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)NC[C@H]1CCN(c2ccc(F)cc2)C1 215902418 KRMKPSJRYHNKAT-OAHLLOKOSA-N 382.439 2.502 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)NC[C@@H](c1ccccn1)N1CCOCC1 216535865 KKLBSEGGTBLSTR-NRFANRHFSA-N 378.476 2.685 0 50 GFAA COCC1(CNC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)CCNCC1 261626716 AOPXUOPMDHAPDV-UHFFFAOYSA-N 375.513 2.726 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCCN(c3cccnn3)CC2)ncn1 275700882 NMUVZWAVWGEZBA-DYESRHJHSA-N 397.527 2.599 0 50 GFAA CC(C)N1CC[C@@H](N2CCN(c3ccccc3F)CC2)[C@@H](CCC(=O)O)C1 299755503 APTZTXVQULFCPZ-PKOBYXMFSA-N 377.504 2.911 0 50 GFAA COc1ccc([C@H](C)CNC[C@@H]2CC(=O)N(C)[C@H]2c2c(C)nn(C)c2C)cc1 328621538 HUHOQUPROMXEGO-JVJLVOBOSA-N 384.524 2.958 0 50 GFAA CCN1C(=O)CO[C@H](c2nc(-c3ccc(OC)nc3)no2)[C@H]1c1ccccc1 350405428 XHJMUUQNUVFRCM-MSOLQXFVSA-N 380.404 2.801 0 50 GFAA Cc1ccc(-n2nnnc2N2CCC3(CC2)C[C@H]3N(C)Cc2nccs2)cc1 367935294 NHDYHXXOWFJQLM-QGZVFWFLSA-N 395.536 2.918 0 50 GFAA CC[C@@H]1CN(S(=O)(=O)c2cc(Cl)c(OC)cc2C)C[C@]2(CCOC2)O1 408339776 MEDSJHMJGWRZHS-DYVFJYSZSA-N 389.901 2.616 0 50 GFAA Cc1nn(C)c(S(=O)(=O)N[C@@H]2COc3cccc(Cl)c32)c1C(F)F 416487692 MDKHCXIUJZZHOB-SECBINFHSA-N 377.800 2.732 0 50 GFAA CC(C)C(=O)NCC(=O)N1CC[C@]2(CCCN(CCCc3ccccc3)C2)C1 426392637 ATRLCTSMNPRRQC-QHCPKHFHSA-N 385.552 2.706 0 50 GFAA CN(CCCc1nccn1C)C(=O)NCCN1CCC(c2ccccc2)CC1 426399272 SIQOJBNLKINBHD-UHFFFAOYSA-N 383.540 2.874 0 50 GFAA NC(=O)NC(=O)CCNC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 475894247 DADPUTNYKXCLNE-UHFFFAOYSA-N 395.337 2.813 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)COC(=O)CCc1csc(C)n1 733584834 RBWQRHKFTBLWPN-UHFFFAOYSA-N 376.434 2.743 0 50 GFAA Cn1ccc(C(=O)N(Cc2cccnc2)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1 800555212 REWCYSWNLUGHAR-QGZVFWFLSA-N 399.495 2.715 0 50 GFAA O=C(Cc1cccs1)NC[C@@H]1CCCN(CCn2c(=O)oc3ccccc32)C1 827855710 XUSVANTWYBUUNK-INIZCTEOSA-N 399.516 2.727 0 50 GFAA C[C@@H]1CN(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)C[C@@]1(C)CO 888101910 KEPBDPOZULKPLC-KUHUBIRLSA-N 382.526 2.882 0 50 GFAA COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3ccc4c(c3)C[C@@H](C)O4)C2)c1 1439137796 BGBSBMMDRGJXBA-LRTDBIEQSA-N 396.443 2.837 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N2CCC3(CCc4ccccc43)CC2)C1 1506403327 NWHWTRKPRYEEMR-KRWDZBQOSA-N 378.538 2.570 0 50 GFAA Cc1c(NC(=O)CN2CCC(CCC(=O)Nc3ccccc3)CC2)cnn1C 1506406790 ORFKACIIQVUVBV-UHFFFAOYSA-N 383.496 2.798 0 50 GFAA O=S(=O)(c1cccnc1)N1C[C@@H]2CC[C@H]1CN(Cc1ccc(F)cc1)C2 1565514328 NXARFMOMISMOQJ-AEFFLSMTSA-N 375.469 2.506 0 50 GFAA C[C@@H]1CCc2[nH]nc(C(=O)N3CC[C@@H](Nc4ncnc5ccccc45)C3)c2C1 1775987011 SHWFXVGSSVKZGO-ZIAGYGMSSA-N 376.464 2.804 0 50 GFAA CCCCc1nc(CN2C[C@@H]3CC[C@H](C2)[C@H]3NS(=O)(=O)CC)c(Cl)[nH]1 1857671651 NNHLGDSIJLMKQW-YWVIFJGQSA-N 388.965 2.555 0 50 GFAA CCCN1CCC2(CC1)OCCc1sc(C(=O)NC[C@H]3CCCO3)cc12 1857682716 MAYOIOANJPFJLI-OAHLLOKOSA-N 378.538 2.931 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(c3cnc4ccccc4n3)C1)CC2 1857696721 NJWBGSGGRCIRBV-NRFANRHFSA-N 376.464 2.676 0 50 GFAA Cc1cc(N2C[C@@H]3COC[C@]3(C(=O)NCc3cscn3)C2)c2ccccc2n1 1857699836 ZSZBDULPBJZVLM-QVKFZJNVSA-N 394.500 2.769 0 50 GFAA O=C(N[C@@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CC[C@@H]1O)C1CCC1 1857710797 QGDNYCUVSZFCSN-OLZOCXBDSA-N 377.794 2.610 0 50 GFAA O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC[C@@H](c2cnn[nH]2)C1 1875296448 XRKTWLLTYBJXJE-LLVKDONJSA-N 387.241 2.587 0 50 GFAA CC(C)(C)OC(=O)N1CCS[C@@H]1C(=O)NCCC(=O)OC1CCCCC1 1875305760 HDEPCADQOUFFFS-MRXNPFEDSA-N 386.514 2.679 0 50 GFAA CC(=O)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CN1CCOc2ccccc2C1 2100556744 RCNLLTCJUBBFLK-GNLZIIPMSA-N 392.499 2.504 0 50 GFAA CC[C@H](SC)C(=O)NC[C@]1(C)CCN(C(=O)c2ocnc2C(F)(F)F)C1 2325794343 ZAAZDOJDQGXSQK-BONVTDFDSA-N 393.431 2.803 0 50 GFAA COc1cc(C(=O)NC[C@@]2(C)CCN(C)C2)ccc1CNC(=O)OC(C)(C)C 2325810519 OZURWFAQHFBNSU-OAQYLSRUSA-N 391.512 2.792 0 50 GFAA CN1CCN(c2ccc(NC(=O)c3cc4cccn4cn3)c3cnccc23)CC1 2325859346 WJCHZNDWRIJKDQ-UHFFFAOYSA-N 386.459 2.887 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc([C@H](C)NC2=NC[C@H]3CC[C@H](C)CN23)cc1 2325863707 ULYWITCEURDXOG-XYJFISCASA-N 392.569 2.838 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)c1cc2c(s1)CCOC21CCNCC1 2356145420 BAVNPAVFNOBSRI-UHFFFAOYSA-N 388.537 2.602 0 50 GFAA COc1cc(-c2ccc(C(=O)N3[C@H]4CC[C@@H]3CCN(C)C4)cc2)c(=N)[nH]c1C 2356149228 PRWSXPREKIHSAD-MSOLQXFVSA-N 380.492 2.787 0 50 GFAA O=C(c1ccc(Cl)cn1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356169588 DJNBJJOIHZPCDM-FTRWYGJKSA-N 391.899 2.636 0 50 GFAA Cc1cccc2nc(C(=O)N3CCc4nc(Cc5ccccc5)nn4CC3)cn12 2356134688 XZNABKXUGYRSQE-UHFFFAOYSA-N 386.459 2.524 0 50 GFAA O=C(/C=C/c1ccccc1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356139384 QICINYGYZYMJCT-DOAOMJTPSA-N 382.504 2.987 0 50 GFAA COCc1nnc(NC(=O)c2ccccc2I)s1 2818608 SNECQDQMVKPQFG-UHFFFAOYSA-N 375.191 2.541 0 50 GFAA OCCOc1ccccc1CN1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 2356153162 VCTWKYPXMLLYGO-UHFFFAOYSA-N 395.503 2.911 0 50 GFAA COC1(CN(C)C)CCN(S(=O)(=O)c2cc(Cl)c(Cl)s2)CC1 2356154530 ZBUQGAFGCSHYSU-UHFFFAOYSA-N 387.354 2.786 0 50 GFAA COc1cnccc1-c1ccc(C(=O)NC2CCN(c3cnccn3)CC2)cc1 2356159350 WWHLIXOSOPSEAD-UHFFFAOYSA-N 389.459 2.946 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCN(c4ncccn4)CC3)cc2)ccc1O 2356167868 GMOZMLBAKHYNFW-UHFFFAOYSA-N 375.432 2.515 0 50 GFAA CCCN1CCC[C@]2(CCCN2S(=O)(=O)c2cc(C)c(OC)c(C)c2)C1=O 2356167999 LOQGIKMRSSUEMW-FQEVSTJZSA-N 394.537 2.868 0 50 GFAA Cc1cc(C)n(CCC(=O)NCc2c[nH]nc2-c2ccc(Cl)cc2)c(=O)n1 55182489 SFDSZDLHAZQFQK-UHFFFAOYSA-N 385.855 2.610 0 50 GFAA COc1ccc(-n2c(C)nnc2SCC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)cc1 247416610 MWOAIKFSWAPEHF-RPLLJCPNSA-N 384.505 2.837 0 50 GFAA O=C(NC1CCN(C(=O)c2cnccn2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 135567075 QVNZGPJLUKVHMH-DLBZAZTESA-N 384.867 2.655 0 50 GFAA CC(C)N1CCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C[C@H]1C 67676148 RURWTLHYQDTWKI-CQSZACIVSA-N 387.436 2.537 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c1C 65365299 CVCHVUSQWWQPIJ-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA COc1ccsc1S(=O)(=O)N1C[C@H](n2ccnc2)Cc2ccccc21 121739778 GRLJKKQANJXGAV-CQSZACIVSA-N 375.475 2.946 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c3c2NC(=O)C[C@@H]3c2ccc3c(c2)OCO3)n1 35373087 LPPIAKQQPWSUCR-CQSZACIVSA-N 377.404 2.790 0 50 GFAA C[C@H]1CCCC[C@H]1NC(=O)CS(=O)(=O)Cc1nnc(-c2ccccc2)s1 122443079 KRIJZJJOJQFIGB-DZGCQCFKSA-N 393.534 2.815 0 50 GFAA Cc1c(CN2CCC(Oc3ccc4ncccc4c3)(C(=O)O)CC2)cnn1C 77516899 FTZORMOZQRSSCA-UHFFFAOYSA-N 380.448 2.775 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N[C@H]3CCN(c4c(F)cccc4F)C3=O)c2c1 123422233 UYJHGJPCBKKBGT-SFHVURJKSA-N 399.397 2.919 0 50 GFAA C[C@H](Cc1noc(CNc2ccccc2C(N)=O)n1)N(C)C(=O)OC(C)(C)C 253431611 SLHVMPHBPZHFMX-GFCCVEGCSA-N 389.456 2.579 0 50 GFAA CCN1CC2(CCN(C(=O)Cc3nc4cc(Cl)ccc4[nH]3)CC2)OC1=O 77459217 YKAYVLNDMQOXNC-UHFFFAOYSA-N 376.844 2.592 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)c1 127190417 BLTCHMNABJWJHR-LJQANCHMSA-N 397.450 2.843 0 50 GFAA COc1cc2c(cc1OC)CCN(C(=O)c1ccnc(OC(F)F)c1)CC2 448784626 BQQUOAMYRYGLGJ-UHFFFAOYSA-N 378.375 2.941 0 50 GFAA Cc1ccccc1-c1nnc(CN2CCN(C(=O)c3ccc(O)cc3)CC2)o1 131037231 JLPPONMLXWGWQO-UHFFFAOYSA-N 378.432 2.709 0 50 GFAA O=C(O)CCCC(=O)Nc1sc2c(c1C(=O)NCc1ccco1)CCC2 17076956 RBWVFKFFBLJVTO-UHFFFAOYSA-N 376.434 2.953 0 50 GFAA Cc1nc(-c2ncccn2)sc1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 178049444 ACGFVUKTXPFMGB-CQSZACIVSA-N 380.429 2.560 0 50 GFAA N[C@@H]1CCN(C(=O)CSc2cn(Cc3ccccc3)c3ccccc23)C[C@H]1O 82137036 DGYAUUMXNPOHKY-UYAOXDASSA-N 395.528 2.702 0 50 GFAA COc1ccc(C(=O)N2CCN(Cc3ccn(-c4ccccc4)n3)CC2)cc1 195408669 VEDCURMTJNXCDM-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)CSCCN3CCCC3)C2)c1 95367989 GDKDDYDCCWMEEG-SFHVURJKSA-N 376.522 2.920 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)N1CCC[C@H](Cn2ccnc2)C1 426604654 VWRDAGWXKSTCGZ-LJQANCHMSA-N 378.480 2.733 0 50 GFAA N[C@@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)C1CCCCC1 91487143 OZVMTVUMVJGMPW-OAQYLSRUSA-N 398.551 2.720 0 50 GFAA CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@H](S(C)(=O)=O)C1 239722359 CCMADLNTILRFON-KBPBESRZSA-N 396.488 2.591 0 50 GFAA O=C(NCCC(c1ccccc1)c1ccccc1)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)O 239306202 GNMWHBAJTKJJEB-NCYKPQTJSA-N 377.440 2.979 0 50 GFAA CCc1ccccc1OC1CN(C(=O)c2cnc(-c3ccccn3)nc2O)C1 91845687 XPQJWNDKOTZESS-UHFFFAOYSA-N 376.416 2.710 0 50 GFAA Cc1ncsc1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95382076 GPHKCBWAMNYLAZ-KFKAGJAMSA-N 397.500 2.883 0 50 GFAA CC[C@H]1CCCCN1C(=O)c1cccc(S(=O)(=O)NCc2ccon2)c1 95383302 AGWCPWRWCNDSGY-INIZCTEOSA-N 377.466 2.558 0 50 GFAA Nc1ncccc1CN1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91755008 AEXFSGMRJJTHNB-UHFFFAOYSA-N 379.508 2.506 0 50 GFAA O=C(Nc1cccc(Cl)c1)NC1CCN(C2CCS(=O)(=O)CC2)CC1 97553407 YVMMQDBFLHHEJZ-UHFFFAOYSA-N 385.917 2.503 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC[C@H](c3nccn3CCN(C)C)C2)c1C 95526838 FSXZGRQYQBSORA-KRWDZBQOSA-N 385.512 2.612 0 50 GFAA Cc1ccn2c(=O)cc(CN3CCC(Cc4noc(C5CC5)n4)CC3)nc2c1 244626598 FORLQEFKJBZOBP-UHFFFAOYSA-N 379.464 2.718 0 50 GFAA COc1ccc(CNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)cc1C(=O)O 299750412 NKSHXQLMPIRKKN-UHFFFAOYSA-N 385.416 2.759 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2ccc3c(c2)OCC(=O)N3C)N(C)C)cc1 534590160 ACCWLWBIIFOYAN-SFHVURJKSA-N 382.464 2.775 0 50 GFAA COCCN1Cc2cc(C(=O)NCc3cccc(Cl)c3)ccc2OCC1=O 263615233 BHRGQWAPQXWRHT-UHFFFAOYSA-N 388.851 2.637 0 50 GFAA CC[C@@H](C)n1cc(C(=O)NCc2ccco2)c(=O)c(C(=O)NCC(F)(F)F)c1 299797549 BGEBGNHQMRRJTG-LLVKDONJSA-N 399.369 2.634 0 50 GFAA CCn1c(CNC(=O)N2CCN(c3ccncc3C)CC2)nc2ccccc21 584895113 DWVNFENZPIHIDE-UHFFFAOYSA-N 378.480 2.791 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H](CCO)c2cc(Cl)cc(Cl)c2)CC1 1875366286 NYUODWWYKZLXRA-MRXNPFEDSA-N 385.291 2.958 0 50 GFAA Cc1cccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1F 1875397155 NWHOTGGSGDPJQS-QGZVFWFLSA-N 385.487 2.611 0 50 GFAA O=C(NCC12CC(C(=O)O)(C1)[C@@H](c1ccccc1)O2)[C@H]1CC2(CCCC2)CO1 1875404688 QRPILPWZDMMPJG-WZGNDQMWSA-N 385.460 2.827 0 50 GFAA Cc1ccc(N2CCCC2=O)c(C(=O)Nc2cccc(NS(C)(=O)=O)c2)c1 1875261309 CDHJNHCNCBCURC-UHFFFAOYSA-N 387.461 2.746 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@H]4CC(F)(F)[C@@H]4C3)nn2C)cc1OC 1875298013 LWROFPIPSNAVNT-CHWSQXEVSA-N 377.391 2.832 0 50 GFAA COCC[C@@H](NCC(=O)N1CCC(C(=O)N2CCCCCC2)CC1)C(C)(C)C 952845282 PLZIIYNBHFBZPP-LJQANCHMSA-N 395.588 2.668 0 50 GFAA COc1nc(C)c(Br)cc1-c1noc([C@H]2CCCc3nn[nH]c32)n1 952894715 PNNAGNXBJKFCMX-QMMMGPOBSA-N 391.229 2.797 0 50 GFAA CCN(Cc1nc(C(C)C)no1)S(=O)(=O)c1cc(-c2cc[nH]n2)oc1C 952869010 KHXLOMXZVINLOB-UHFFFAOYSA-N 379.442 2.695 0 50 GFAA CCNC(=O)N1CCN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 273475651 PHWCMAZAELUQII-UHFFFAOYSA-N 378.885 2.951 0 50 GFAA O=C1NCCN(C(=O)c2coc(C3CCOCC3)n2)[C@H]1c1ccccc1Cl 170600426 AGFJUIDYNHNAGA-INIZCTEOSA-N 389.839 2.535 0 50 GFAA CN(CCN1CCN(c2ccccc2)CC1)Cc1cc(Br)no1 170610774 INXSRAQCFKEUQW-UHFFFAOYSA-N 379.302 2.691 0 50 GFAA CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1cnn(C(C)(C)C)c1 189046146 DVQVZKZYEDJALH-OAQYLSRUSA-N 385.512 2.739 0 50 GFAA COc1ccc2c(NC(=O)[C@@H]3CCCN3C(=O)Cc3cccs3)n[nH]c2c1 194789869 KNAJBRBUJIGNBH-INIZCTEOSA-N 384.461 2.805 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N1CCCN(Cc2cccs2)CC1 1506409901 UZWWDKNVRNZFNZ-UHFFFAOYSA-N 396.516 2.652 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@H](Cc4cc(C)no4)[C@@H](O)C3)cc2c1 1615734359 WOLDHEBKUUOAMG-YWZLYKJASA-N 383.448 2.671 0 50 GFAA O=C(CSc1ccncc1)N1CCCN(C(=O)Cc2ccsc2)CC1 1772704854 IEVQKEVIKCBITC-UHFFFAOYSA-N 375.519 2.539 0 50 GFAA CCOC(=O)CCNC(=O)N(C)C[C@H]1CCCN(CCc2ccccc2C)C1 11878235 GZHFILAUQHZWSM-LJQANCHMSA-N 389.540 2.844 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCN(c3ccccn3)CC2)c(OC)c1 11934535 BURRZSYZEZQYTC-UHFFFAOYSA-N 379.464 2.811 0 50 GFAA O=C(c1nc2sccn2c1CN1CCC[C@@H](O)C1)N1CCCCCCC1 11936770 NYWGMJOADUFRRD-OAHLLOKOSA-N 376.526 2.759 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1cc(F)cc(F)c1)CC2 12282386 DNIKGETZQKUAJW-QGZVFWFLSA-N 378.419 2.507 0 50 GFAA O=C(Cc1ccccc1)Nc1ccnn1C1CCN(C(=O)c2cscn2)CC1 12386472 GXQCGWVNUVYTPW-UHFFFAOYSA-N 395.488 2.998 0 50 GFAA COc1cccc(CNc2ncnc3sc(C(=O)N[C@H](C)CO)c(C)c23)c1 12571813 UTZMCKFNBJGUAG-LLVKDONJSA-N 386.477 2.731 0 50 GFAA CCCn1cc(CN(CC2CCN(CCOC)CC2)C[C@@H]2CCCO2)c(C)n1 12702564 SUEBWDFOBLUZPK-QFIPXVFZSA-N 392.588 2.941 0 50 GFAA CCOC(=O)[C@@H]1C[C@]2(C(=O)Nc3ccc(Br)cc32)N2CCC[C@@H]12 15022901 OROIOIPZEJZPSI-WHCBVINPSA-N 379.254 2.644 0 50 GFAA COc1cccc(CC(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 169779765 LCQQNJWRTMUJAA-UHFFFAOYSA-N 392.459 2.518 0 50 GFAA Cc1ccccc1OCC(=O)N1CC[C@@]23O[C@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857730027 WQDBBTZRFRDKSH-MZKRTTBSSA-N 392.455 2.675 0 50 GFAA CS(=O)(=O)N1CC[C@@H](CNC(=O)CC(c2ccccc2)c2ccccc2)C1 129893239 WYZHMVBEFUNROH-KRWDZBQOSA-N 386.517 2.606 0 50 GFAA CN[C@@H]1CCCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2C)C1 133503295 QLGHVGHYVFVDEM-CQSZACIVSA-N 377.286 2.767 0 50 GFAA CN(C)c1ncncc1NC(=O)c1cccc(-n2cc(Br)cn2)c1 150707549 ILNOYCVMMCXWEE-UHFFFAOYSA-N 387.241 2.743 0 50 GFAA COc1cc(C)cnc1C(=O)N1CCNC(=O)[C@@H]1c1ccc(C(F)(F)F)cc1 489725345 CTIDGZLQBAEBDX-INIZCTEOSA-N 393.365 2.731 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)[C@H]1Cc3ccccc31)CC2 262867496 WBRMXNVMUZLFMT-ZWKOTPCHSA-N 381.428 2.944 0 50 GFAA Cc1nnc(SCC(=O)Nc2ccc3c(c2)COC3=O)n1-c1ccccc1 1080671 UMLQZNQBQVYNQW-UHFFFAOYSA-N 380.429 2.977 0 50 GFAA COc1ccc([C@H]2NC(=O)[C@H](C3CC(C)(C)C3)NC2=O)cc1Br 2325776894 MBCPNAWGMGKBBG-KGLIPLIRSA-N 381.270 2.550 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2COCC[C@H]2N(CCc2cc(Cl)c3c(c2)OCCCO3)C1 2325797880 FYZYUXNVEOEVPG-BFYDXBDKSA-N 395.883 2.855 0 50 GFAA CN(C)CCC1(C)CN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C1 2325802725 XYZVKSPJRZGJFB-GOSISDBHSA-N 379.495 2.944 0 50 GFAA CCOc1ccc(-c2cn(C3CN(C(=O)CC4CCOCC4)C3)nn2)cc1F 2332239282 CRFXZGFXVPAGIH-UHFFFAOYSA-N 388.443 2.683 0 50 GFAA CC(C)(C)NC(=O)c1ccccc1NC(=O)CCN1C(=O)c2ccccc2C1=O 715858 TZFXQOPDYBDUGX-UHFFFAOYSA-N 393.443 2.840 0 50 GFAA O=C(Nc1ccc(O)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 1136286 IJGZUZQHTQTSCB-UHFFFAOYSA-N 378.425 2.958 0 50 GFAA Cc1nn(C(=O)CCN2C(=O)c3ccccc3C2=O)c(C)c1Br 2224904 UEQKTMFFYVYMHU-UHFFFAOYSA-N 376.210 2.589 0 50 GFAA COC(=O)c1ccc(CNCC[C@@H]2CCC(=O)N2CCCc2ccncc2)cc1 11787664 RLAUTVFSVAEBPP-NRFANRHFSA-N 395.503 2.972 0 50 GFAA O=C(COc1ccccc1)NC[C@@H]1Cc2cc(F)cc(-c3cncnc3)c2O1 11995314 PFLPHMGMDMKBOK-SFHVURJKSA-N 379.391 2.781 0 50 GFAA Cc1nc(CN(C)C[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)cs1 12072441 SBNJWAPFHJMIJT-LJQANCHMSA-N 395.475 2.715 0 50 GFAA O=C(NCCc1ccccn1)[C@@H]1CC12CCN(Cc1ccc3c(c1)CCO3)CC2 12159765 PMGHVOXPERFDNE-NRFANRHFSA-N 391.515 2.978 0 50 GFAA COc1cc(CNCC2(O)CCCCC2)ccc1OC[C@H](O)CN(C)C(C)C 12298331 LTNUXFRRSQHSBJ-LJQANCHMSA-N 394.556 2.560 0 50 GFAA O=C1C[C@H](NC2CCN(Cc3ccccn3)CC2)CN1Cc1cccc(F)c1 12434618 QBLSXVATDRFKPR-NRFANRHFSA-N 382.483 2.576 0 50 GFAA Cc1cccc(C)c1NC(=O)COc1ccc(CN(C)S(C)(=O)=O)cc1 14399456 HCGOMKUKPHNUQN-UHFFFAOYSA-N 376.478 2.712 0 50 GFAA Cc1c(CN2CCc3c(c(C(=O)NC4CCCC4)nn3CC(C)C)C2)cnn1C 14540716 BZYNGZXWXOOZQI-UHFFFAOYSA-N 398.555 2.812 0 50 GFAA CC(=O)N1CCN(c2ccc(-c3nc(Cc4ccc(F)cc4)no3)cn2)CC1 19792677 XJLWGBPRBXEJKR-UHFFFAOYSA-N 381.411 2.530 0 50 GFAA c1ccc(CN2CNC3=N[C@@H](c4ccco4)n4c(nc5ccccc54)N3C2)nc1 20102179 GECLOLVUJSUFOX-LJQANCHMSA-N 385.431 2.768 0 50 GFAA Cc1cccc(C(=O)Nc2ccc3c(c2)nc(CN2CCN(C)CC2)n3C)c1 20706995 AWPKDYGKJDCYJU-UHFFFAOYSA-N 377.492 2.881 0 50 GFAA COc1ccc(C)cc1[C@@H](C(=O)O)N1CCC(N2C[C@H](C)O[C@H](C)C2)CC1 63833560 GSCKMKMGBYZPKT-YRNRMSPPSA-N 376.497 2.703 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)CC1 67613738 YDOIGLCGVFXEMV-KRWDZBQOSA-N 394.537 2.775 0 50 GFAA O=C(c1ccc(Cn2cnnn2)cc1)N1CCO[C@H](c2ccc(Cl)cc2)C1 67673140 TUQUPDVMGWIUCJ-SFHVURJKSA-N 383.839 2.589 0 50 GFAA C[C@H](NC(=O)c1cc(CN2CCC(O)CC2)on1)c1cn(C)c2ccccc12 67741084 LGERYTHRRDGUSG-AWEZNQCLSA-N 382.464 2.614 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)c1cc(=O)[nH]c2cc(F)ccc12 72477357 XVAOHDYNXNPYBA-UHFFFAOYSA-N 378.363 2.989 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)s1 82106202 HEMAGQVMTLKCDR-HXUWFJFHSA-N 384.505 2.892 0 50 GFAA COCCNc1nc2cc(C(=O)NC[C@H]3COc4ccccc4C3)ccc2n1C 91270058 XBVRIBSFCZWIJJ-HNNXBMFYSA-N 394.475 2.613 0 50 GFAA Cc1oncc1S(=O)(=O)N1C[C@H]2CC[C@@H]1CN(CCCc1ccccc1)C2 91625752 VOWWPADRRCNUEQ-RBUKOAKNSA-N 389.521 2.701 0 50 GFAA CC1(C)CN(c2nnc(-c3ccccc3)s2)CC[C@@]1(O)CN1CCOCC1 91756034 VHIHZIVQIUMAST-HXUWFJFHSA-N 388.537 2.505 0 50 GFAA c1ccc(-c2nn(-c3ccccc3)cc2-c2cn(C[C@@H]3CNCCO3)nn2)cc1 95363725 DRWAGVXBEBOZGE-IBGZPJMESA-N 386.459 2.786 0 50 GFAA CN(Cc1nc(-c2ccncc2)no1)C(=O)[C@H]1CCCN(Cc2ccco2)C1 95378844 JHLSWCPYXHMZPN-INIZCTEOSA-N 381.436 2.595 0 50 GFAA O=C(NC[C@@]1(O)CCCNC1)Nc1ccc(SCCc2ccccn2)cc1 97805705 CLAPXWSGGJGTEE-HXUWFJFHSA-N 386.521 2.652 0 50 GFAA O=C1Nc2cc(F)ccc2[C@H]1CC(=O)N1CCC[C@@H](OCc2cccnc2)C1 102512762 WENMNQTXBRSJEW-SJLPKXTDSA-N 383.423 2.854 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)c3csc([C@@H]4CCCO4)n3)CC2)s1 121799463 CITUXOGKRCUFTA-AWEZNQCLSA-N 391.518 2.963 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1 125943931 IWGVSNNVVHOBSF-QUCCMNQESA-N 396.487 2.930 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)c1scnc1C1CC1 126286859 SLRTWSNMZLVWJO-LBPRGKRZSA-N 392.506 2.706 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c(OC)c1 169780829 QWGNFMMFPZGBFR-LLVKDONJSA-N 398.394 2.711 0 50 GFAA O=C(CCS(=O)(=O)C1CCCC1)NC1(c2cccc(F)c2)CCOCC1 173837837 VNKWZPKDHXPRDI-UHFFFAOYSA-N 383.485 2.695 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1=O 177095873 PVFGLRVOPDLALT-LBPRGKRZSA-N 383.429 2.947 0 50 GFAA O=C(CCCc1ccccc1)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 180296104 GESIZVWFPVTCJQ-IBGZPJMESA-N 378.538 2.862 0 50 GFAA O=C(c1cccc(NCc2cc3ccccc3nc2O)n1)N1CCC[C@@H]1CO 190201142 OKOOSRZUTYCNFZ-MRXNPFEDSA-N 378.432 2.544 0 50 GFAA COc1ccc(CN2C(=O)N[C@H](CC(=O)Nc3ccc4[nH]ccc4c3)C2=O)cc1 206235900 XLHUTGRNXPVISC-GOSISDBHSA-N 392.415 2.626 0 50 GFAA CCc1cccc(CC)c1NC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O 239433124 XFZPBVOYCCNMOD-LXJANLPBSA-N 378.472 2.803 0 50 GFAA CCOC(=O)N1CCC(NC(=O)CN2CC[C@@H](C(F)(F)F)C(C)(C)C2)CC1 240551578 GUTMNTILCZNSJO-CQSZACIVSA-N 393.450 2.634 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCc3c(c4ccccc4n3C)C2)cc1 244514569 ZOVFEIYZBBOUGH-MRXNPFEDSA-N 397.500 2.973 0 50 GFAA Cc1cc(F)ccc1NC(=O)CN1CCc2sc(C(=O)N(C)C)cc2C1 244796100 RSVXOCQRGSPCQH-UHFFFAOYSA-N 375.469 2.894 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N2Cc3cnnn3Cc3ccccc32)c1 252484042 FMQWTCIXZJOISA-UHFFFAOYSA-N 375.432 2.627 0 50 GFAA COC[C@H](O)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1Cl 252490487 KUWIBJXTTIERNM-PBHICJAKSA-N 384.904 2.941 0 50 GFAA Cn1cc(-c2csc(CNc3cccnc3N3CCC(CO)CC3)n2)cn1 252527981 DWRMFOVTLCRSPO-UHFFFAOYSA-N 384.509 2.759 0 50 GFAA CC[C@H](C(=O)N1C[C@H](OC)C[C@H]1c1nc(-c2cccnc2)c[nH]1)N(CC)CC 253370529 SAISANLBZVYLDZ-QRQLOZEOSA-N 385.512 2.881 0 50 GFAA CCCCNC(=O)c1nnn2c1CO[C@H](c1ccc(Br)cc1)C2 263615204 BCUGYAKPYJGKOR-AWEZNQCLSA-N 379.258 2.842 0 50 GFAA O=C(c1cccc(N2CCCNC2=O)c1)N1CCC[C@](O)(C(F)(F)F)CC1 287937954 RIDNZQKGGFUZEG-QGZVFWFLSA-N 385.386 2.526 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2C[C@H](CO)c3ccccc32)c(C)c1CC(=O)O 294309288 VSVHTYMDQOORSD-OAHLLOKOSA-N 389.473 2.524 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1)c1ncon1 294626707 QIKHZWAFWABGMX-SNVBAGLBSA-N 375.816 2.958 0 50 GFAA CC1(C)CN(C(=O)NCc2cccc(N3CCOCC3)n2)[C@@H]1c1ccncc1 298525336 XHNSIRRGLVOJJG-LJQANCHMSA-N 381.480 2.606 0 50 GFAA CN1CCN(C(=O)c2ccc(Cl)nc2Cl)C[C@H]1c1nc(C2CC2)no1 370293168 CQJJQWQVESTLLJ-NSHDSACASA-N 382.251 2.778 0 50 GFAA Cc1ccc(N2CCOC2=O)cc1NC(=O)NCc1cccnc1-n1ccnc1 377176777 WDKGXAYOEFHIQJ-UHFFFAOYSA-N 392.419 2.854 0 50 GFAA O=C(CN1CC[C@@]2(CCCN(CC3CCCCC3)C2=O)C1)NCc1ccco1 426387158 WCOJJXKIWFRBLP-QFIPXVFZSA-N 387.524 2.791 0 50 GFAA Cc1cccnc1C[C@@H](C)NC(=O)N1CCN(c2nc3ccccc3o2)CC1 426490340 RXDHVVBHOUOTGD-MRXNPFEDSA-N 379.464 2.994 0 50 GFAA O=C(N[C@H](CCn1cncn1)c1ccccc1)c1ccccc1N1CCOCC1 828182325 NJAMIQUMMFUGPP-HXUWFJFHSA-N 391.475 2.676 0 50 GFAA COc1cc(S(=O)(=O)N(C)CC[C@@H]2CCCCO2)c(OC)cc1Cl 952984096 NWELZSKXYYYXOG-LBPRGKRZSA-N 377.890 2.937 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@H](C)CNC(=O)CCN2CCCCCC2=O)n1 952990723 WMZYQUJDVDTHGV-CYBMUJFWSA-N 388.434 2.755 0 50 GFAA Cc1nn(C)c(C)c1CN(C1CC1)S(=O)(=O)c1cc(C(=O)O)ccc1Cl 1506396309 RETDNHGRPWSCKT-UHFFFAOYSA-N 397.884 2.742 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1CCC([C@@H](O)c2cccs2)CC1 1506427027 KRAUSTSJYVILCQ-GOSISDBHSA-N 375.494 2.765 0 50 GFAA Cn1c(NCC[C@H](c2ccccc2)c2ccco2)nc2c1c(O)nc(=O)n2C 1529188779 COPUTAAGCUTOEN-CQSZACIVSA-N 379.420 2.600 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c(C)c1 1704303469 ZVKVCCHEUQCGGX-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA CC(C)c1nnsc1C(=O)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1704357399 RXTSGTVXHYFPQY-RHSMWYFYSA-N 382.489 2.885 0 50 GFAA O=C(c1ccc(N2CCCC2)c(Cl)c1)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772700491 BWTSUSGDEOKEMP-KUHUBIRLSA-N 378.856 2.504 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)N1C[C@@H]2COCC[C@]2(CO)C1 1772706816 NAXWVKAGGJQDQL-NFBKMPQASA-N 381.472 2.666 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3cccc(C)n3)C[C@]2(CCc2ccccc2)C1 1772808611 VTNCAHMOTLBSCC-ZJSXRUAMSA-N 393.531 2.930 0 50 GFAA O=C(/C=C/c1ccccc1)N1CCC[C@]2(C1)CN(c1ccncc1)CC[C@H]2O 1857688137 VJMANXOIHCITPZ-KVWXWEJBSA-N 377.488 2.975 0 50 GFAA O=C(NC1CCCCC1)[C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857696601 IQQVQXODGZPVBM-OAHLLOKOSA-N 384.505 2.931 0 50 GFAA CCc1nc(O)ccc1C(=O)NCc1nc(-c2ccc(OC)c(O)c2)oc1C 1857702055 XVUZUNLYCSKWJI-UHFFFAOYSA-N 383.404 2.957 0 50 GFAA O=C(c1cnc[nH]1)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NC1CCC1)C2 1857708080 UFXNMJXZQNKBAK-LRXVAGHRSA-N 378.476 2.684 0 50 GFAA CCc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)cc1 1857718841 VPFILAOBEBAKGF-SVFBPWRDSA-N 386.517 2.742 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3[C@H](CNC(=O)C4CC=CC4)[C@H]4CC[C@]3(C2)O4)c(C)o1 1857736460 PXPBMGJHRYPJFZ-JZJXAQOMSA-N 384.476 2.598 0 50 GFAA Cc1cccc(Cn2[nH]cc/c2=N\C(=O)COC(=O)c2c(O)cccc2Cl)c1 1875264367 ALTKEVFEWCYMCS-HAVVHWLPSA-N 399.834 2.816 0 50 GFAA C[C@@H]1C[C@@H](C(=O)NCc2cc3ccccc3n(C)c2=O)N1C(=O)OC(C)(C)C 1875284508 XLPHSPWXKFAQIS-DYVFJYSZSA-N 385.464 2.553 0 50 GFAA Cn1cc(CN[C@H](CCc2c[nH]nc2C(F)(F)F)C(=O)O)c(C2CCCC2)n1 1875291002 LCQZCIBYYFIDLY-CQSZACIVSA-N 399.417 2.995 0 50 GFAA O=C(N[C@@H]1COCCC1(F)F)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1875307881 VEOIYIUBTOCDFA-CYBMUJFWSA-N 393.356 2.857 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)c1cccc3oc(C)cc13)CCO2 1875396073 UYITXCFKPUBRMM-UHFFFAOYSA-N 376.478 2.844 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H]3CCCCCC3(F)F)C2)c1C 1875397885 RRYFRRTXAZWRGR-CVEARBPZSA-N 395.498 2.932 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccncc1Oc1ccccc1 1875401012 QDXLWBKSYRJAII-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA Cc1cc(C(=O)N2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)cc(C)n1 1940193557 VDCUYDFDXZDFEJ-NZQKXSOJSA-N 396.487 2.999 0 50 GFAA CC(C)(C)N1C[C@@H](CN2C(=O)CCN(CC[C@]3(C)CC3(F)F)C2=O)CC1=O 2325779606 RJBUYSQNDOCTHM-FZKQIMNGSA-N 385.455 2.723 0 50 GFAA Cc1ccnc(Oc2ccc(C(=O)N[C@@H]3C[C@H](Cn4cccn4)C[C@H]3O)cc2)c1 2325786003 XUYHFSGQSADKJP-PWIZWCRZSA-N 392.459 2.948 0 50 GFAA Nn1nc(SCC(=O)Nc2cccc(C(F)(F)F)c2)nc1C(F)(F)F 2597921 FACYCNYXVRJYOV-UHFFFAOYSA-N 385.293 2.760 0 50 GFAA O=C1C[C@@H](c2ccccc2)NCCCN(C(=O)c2cccnc2)CCCCN1 2356134362 KGJKXIAJOBWZIO-FQEVSTJZSA-N 380.492 2.545 0 50 GFAA Cc1nnc(SCC(=O)NCc2ccc3c(c2)OCO3)n1-c1ccccc1 2848594 DFKIKVRIDFEQBF-UHFFFAOYSA-N 382.445 2.713 0 50 GFAA CN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc(Br)c2)c1 2868452 NMMKXGVVESOVAB-UHFFFAOYSA-N 383.267 2.952 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)Cn2c(C(C)C)nc3ccccc32)C[C@@H]1O 2356145135 CNCGAPFKSJMXIN-UWJYYQICSA-N 387.480 2.624 0 50 GFAA O=c1c2ccccc2nnn1Cc1ccc(S(=O)(=O)Cc2ccccc2)cc1 4867235 DWYZBJIXWUAXDC-UHFFFAOYSA-N 391.452 2.814 0 50 GFAA COc1ccccc1-n1nc(CSc2nnnn2-c2ccccc2)cc1O 101292807 JHJUOBRZCASNSX-UHFFFAOYSA-N 380.433 2.855 0 50 GFAA O=C1[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)N1c1ccc(OS(=O)(=O)c2ccccc2)cc1 104297175 QZILCGXCVLXCKE-YXUGBTPSSA-N 397.452 2.990 0 50 GFAA CC(C)N(C[C@H]1COc2ccccc2O1)C(=O)c1cccc(NCC(=O)O)c1 55227179 WAWHUBWJTCMGNQ-KRWDZBQOSA-N 384.432 2.874 0 50 GFAA OCC[C@H]1CN(Cc2cccn2-c2cccnc2)CCN1Cc1ccccc1 20998739 SBJDLFQECAKTHI-QFIPXVFZSA-N 376.504 2.941 0 50 GFAA CN1Cc2ccccc2C[C@H]1C(=O)NCCc1csc(-c2cccnc2)n1 65376101 GNTXZHVDODZSJX-IBGZPJMESA-N 378.501 2.921 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNCC3CCCCC3)C2=O)c1OC 67852255 IXXKYMLYKBEDEG-JOCHJYFZSA-N 390.524 2.727 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)C[C@@H]2CCO)cc1C 23375203 CHMMNXLHWLVRNA-QFIPXVFZSA-N 389.584 2.745 0 50 GFAA Cc1ccc(CNc2ncnc3sc(C(=O)N4CCN(C)CC4)c(C)c23)o1 20599259 HNMRHPRMQLCLNQ-UHFFFAOYSA-N 385.493 2.901 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2)CC1 328630569 JNOQRTILIJZEIL-RTWAWAEBSA-N 386.471 2.552 0 50 GFAA Cc1cc2c(N3CCC[C@@H](c4n[nH]cc4CN4CCOCC4)C3)ncnc2s1 328616838 CDBNDWATVZIBOO-OAHLLOKOSA-N 398.536 2.939 0 50 GFAA C[C@H](NCc1cccnc1N1CCC(C(N)=O)CC1)c1nc2ccccc2n1C 154179716 KLVWWRPPLOMNLA-HNNXBMFYSA-N 392.507 2.521 0 50 GFAA COc1ccc(C(=O)Nc2cc(C(=O)N3CCN(C)CC3)ccc2Cl)cc1 71375811 UAELHRVYRGEJOB-UHFFFAOYSA-N 387.867 2.989 0 50 GFAA CC[C@@H](NC(=O)c1cn(CC2(C)COC2)nn1)c1ncc(-c2ccccc2)[nH]1 371956482 XOBDSUZZPLOPMR-OAHLLOKOSA-N 380.452 2.586 0 50 GFAA Cn1cc(N2CCC[C@@H](NC(=O)Nc3ccnn3Cc3ccc(F)cc3)C2)cn1 158034286 SZVQBYKLHISKFN-QGZVFWFLSA-N 397.458 2.595 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1cccc(O)c1)CC2 14743540 UJIMYNZEEGAZLJ-UHFFFAOYSA-N 390.487 2.897 0 50 GFAA COc1ccc(OC)c(N2C[C@H](C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@H]34)CC2=O)c1 245225402 UNOBQMYAIVCNDI-DDAMIAJUSA-N 398.503 2.998 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N1CCC(Cc2cccnc2)CC1 426581272 ORMHKXRQLWXHOE-SFHVURJKSA-N 379.460 2.997 0 50 GFAA CN(C)c1nc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc2ccccc12 41147141 UADOCDUZCWDBQX-UHFFFAOYSA-N 391.475 2.747 0 50 GFAA O=C(Nc1cccc(F)c1)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 82230630 VFXSMJCHPUKKNU-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA Cn1c(CN2CCCC2)nnc1[C@@H]1CCCN(Cc2ccc3c(c2)OCO3)C1 426423841 YDDXSTDKVSTPTD-QGZVFWFLSA-N 383.496 2.519 0 50 GFAA Cc1ccc(-n2nc(NC(=O)N3CCN(c4cnccn4)CC3)cc2C)cc1 180074631 JKEULFVGADACQB-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA O=C(O)C[C@H](NC(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1 265614310 VVONJKITOIPXJF-SFHVURJKSA-N 384.407 2.894 0 50 GFAA O=C(NCc1ccccc1)c1ccc(NC(=O)[C@@H]2[C@H]3C[C@@H]4OC(=O)[C@@H]2[C@H]4C3)cc1 239235489 WBHWYBPZICVMDL-DABHTEOTSA-N 390.439 2.753 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 239331216 KHYKJAGXWMEGEX-RNIPGJKVSA-N 388.895 2.897 0 50 GFAA O=C(Nc1ccnc(O)c1)[C@@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 1940196874 ARODQAUJXADNSR-CYBMUJFWSA-N 398.850 2.952 0 50 GFAA Cc1c(C(=O)N2CCCC2)cnn1-c1nccc(-c2ccc3c(c2)OCO3)n1 299762027 URQUIDYDLXDWKZ-UHFFFAOYSA-N 377.404 2.602 0 50 GFAA Cc1nonc1CN(C)C(=O)c1cc([C@H](C)Cc2ccc3c(c2)OCO3)no1 299782480 GAOMRSTUBXNFES-LLVKDONJSA-N 384.392 2.713 0 50 GFAA COc1ccccc1/C=C(/C(=O)N1CCO[C@@H](CC(=O)O)C1)c1ccccc1 268937738 CRPAFDIJMDTHGO-DYGKOUCMSA-N 381.428 2.938 0 50 GFAA COc1cc(OC)cc([C@@]2(F)CCN(C(=O)[C@H]3CCc4n[nH]c(C)c4C3)C2)c1 1875293715 AFGPFZNMLIXDII-LHSJRXKWSA-N 387.455 2.938 0 50 GFAA Cn1cnc2cc(NC(=O)[C@@H]3C[C@H]3C(=O)Nc3ccc4c(c3)ncn4C)ccc21 1875263115 PZQOIPNDUHLXCO-HUUCEWRRSA-N 388.431 2.673 0 50 GFAA O=C(c1ccn(CCn2cccn2)n1)N1CCC[C@@H](c2cc(O)cc(F)c2)C1 1875299523 NQRGIBNONQKVGO-OAHLLOKOSA-N 383.427 2.644 0 50 GFAA COC(=O)[C@H]1CCCC[C@]1(C)NCC(=O)NC(=O)Nc1cc(C)ccc1C 1875308935 JBQGNHSWHXGREP-QRWLVFNGSA-N 375.469 2.663 0 50 GFAA CCc1nc(=N[C@@H]2CCN(C(=O)c3cncnc3C(C)C)C[C@H]2CC)s[nH]1 1875302147 BMSMXQICDKZPIZ-UKRRQHHQSA-N 388.541 2.789 0 50 GFAA C[C@H](NC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1)[C@H](C)n1cncn1 1875264568 HPJJSHFGZGFWKC-STQMWFEESA-N 397.439 2.889 0 50 GFAA CCc1cc(N2CCN(C(=O)c3ccccc3NC(=O)[C@H](C)CC)CC2)ncn1 952978585 DFBSRFPMPCHGLQ-MRXNPFEDSA-N 395.507 2.986 0 50 GFAA CSc1nc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccn2)C3)cs1 1565514144 MZZSPTZDXQZXEL-OLZOCXBDSA-N 388.518 2.637 0 50 GFAA C[C@H]1CCc2c(sc3nc(CCC(=O)NO[C@H]4CCCCO4)[nH]c(=O)c23)C1 170608054 YADUMATZJGCGGN-ZBEGNZNMSA-N 391.493 2.616 0 50 GFAA O=C(Nc1ncn(Cc2cccnc2)n1)c1cc(Br)cc2nc[nH]c12 1325187756 OLAUTQMTOAQFMC-UHFFFAOYSA-N 398.224 2.613 0 50 GFAA O=C(N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1csc(-c2ccccn2)n1 192220568 LUZCRJWFSYHDPS-MRXNPFEDSA-N 396.447 2.875 0 50 GFAA CC[C@@]12C[C@H]3C[C@@](O)(C1)C[C@@](C(=O)NCCn1ncc4ccccc4c1=O)(C3)C2 1506406721 GGEFWEAXOBVLGG-OVSDDOEQSA-N 395.503 2.624 0 50 GFAA Cn1c([C@@H]2CCCN(C(=O)c3nc(N)nc4c3CCCC4)C2)nc2ccccc21 1506405248 YGYJSFWHEIHCGE-CQSZACIVSA-N 390.491 2.844 0 50 GFAA Cc1cc(C[C@@H]2CN(c3nc(-c4ccccc4)nc4c3CCC4)C[C@H]2O)n[nH]1 1704303382 IOBFRBRQSATBCK-OXQOHEQNSA-N 375.476 2.704 0 50 GFAA CN(CCc1nc2ccccc2[nH]1)C(=O)c1cn(Cc2ccc(F)cc2)nn1 11663519 FRCKMGPJBKIOON-UHFFFAOYSA-N 378.411 2.657 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCc3[nH]nc(-c4ccc(Cl)cc4)c3C2)CC1 12307328 GRANZDLEMYDZKT-UHFFFAOYSA-N 386.883 2.873 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C4CCOCC4)C3)C2=O)c1 12432858 BORWMLURWLKAGM-NRFANRHFSA-N 376.472 2.828 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H](N3CCN(c4ccc(F)cc4)CC3)C2)o1 12443314 PFUHMDNXDJTPOK-SFHVURJKSA-N 387.455 2.854 0 50 GFAA CCc1ccccc1NC(=O)COc1ccc(CN(C)S(C)(=O)=O)cc1 14400274 FRAADVUWTQZXJG-UHFFFAOYSA-N 376.478 2.658 0 50 GFAA O=C(NCc1cccnc1)c1sc(Cl)cc1S(=O)(=O)N1CCCC1 15085150 GJRKBVLXHDHDFS-UHFFFAOYSA-N 385.898 2.511 0 50 GFAA COc1ccc(CN2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 19789201 BJPIPFHEKPGGQN-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA O=S(=O)(CC1CCCC1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857700327 SZLZOQZZFPRNQJ-FQEVSTJZSA-N 391.537 2.859 0 50 GFAA CC(C)=CCN1CC[C@@H](O)[C@]2(CCCN(C(=O)CN3CCCCCC3)C2)C1 1857705648 PDBQLNLZYKEILU-IFMALSPDSA-N 377.573 2.504 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)N3CCC4(CCCCO4)CC3)CC2=O)s1 1857715404 PUEFAWGVBHGMFE-CQSZACIVSA-N 392.525 2.576 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCCN(Cc3ccccc3F)CC2)CC[C@H]1N 1857741351 OPMNPOSQLLNQLR-IOMROCGXSA-N 391.531 2.783 0 50 GFAA CCCC[C@H](NS(=O)(=O)c1ccc(C(=O)N2CCOCC2)cc1)C1CCC1 152787016 HQIURCXBPJOADN-IBGZPJMESA-N 394.537 2.796 0 50 GFAA CC(=O)N(C)c1cccc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c1 266681421 ZNJKSEGBWLUURE-HXUWFJFHSA-N 379.460 2.842 0 50 GFAA CCc1nn(C)c2n[nH]c(NC(=O)c3cnn(C(C)(C)C)c3Br)c12 827962205 GPBPTHKXMRHEPR-UHFFFAOYSA-N 394.277 2.825 0 50 GFAA NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(CN3C(=O)CCC3=O)cc2n1 205664973 XSTBUOHORFUCIB-UHFFFAOYSA-N 377.375 2.789 0 50 GFAA CCOC(=O)C[C@H](NS(=O)(=O)c1ccc(OC)cc1)c1ccc(C)cc1 3620796 DDYZLDOIBUKMPS-SFHVURJKSA-N 377.462 2.976 0 50 GFAA CCn1c(-c2nc[nH]c3ncnc2-3)nnc1N1CCc2cc(Cl)cc(F)c2C1 2325768349 JAFCNXIMMOKVQF-UHFFFAOYSA-N 398.833 2.938 0 50 GFAA CN(Cc1cc(Br)nn1C)C(=O)c1ccc2c(c1)CCCC(=O)N2 2325790583 WOKGGKJBZJRCNJ-UHFFFAOYSA-N 391.269 2.730 0 50 GFAA CN(C)CC1(C(=O)N[C@]2(C)CCN(C[C@@H]3[C@@H](c4ccccc4)C3(F)F)C2)CC1 2325794277 WQCXYBFVCDZXPC-QWFCFKBJSA-N 391.506 2.958 0 50 GFAA Cc1c(-c2nc(-c3ccc(C(F)(F)F)c(F)c3)no2)nnn1[C@H]1CCNC1 854136600 HEMUNNFIWZUQDM-JTQLQIEISA-N 382.321 2.996 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)N[C@H]3C[C@@H]3Cc3ccccc3)CC2=O)cc1 2325872174 LDBWMPBPYCPWTA-QKLQHJQFSA-N 379.460 2.731 0 50 GFAA O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ccc(Cl)c(Cl)c1 810775 WJRMJDQODQRINZ-UHFFFAOYSA-N 385.228 2.777 0 50 GFAA COC(=O)C1=CN(C)C=C(C(=O)OC)C1c1ccc(OC)c(Br)c1 815872 JRFQJZSKUCXZRG-UHFFFAOYSA-N 396.237 2.601 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(OC)c1 862481 YCBIZMWFMPEQCR-LJQANCHMSA-N 397.431 2.979 0 50 GFAA c1ccc(N2CCN(c3nc(N4CCOCC4)c4ccccc4n3)CC2)cc1 909974 BEDAZELQRKFHAL-UHFFFAOYSA-N 375.476 2.793 0 50 GFAA COC(=O)c1sc(NC(=O)c2cc(OC)cc(OC)c2)c(C(=O)OC)c1C 994583 PSWWLJIYHSYOQG-UHFFFAOYSA-N 393.417 2.899 0 50 GFAA Cc1ccc(S(=O)(=O)N2C(=O)CC[C@@H]2C(=O)Nc2ccc(C)c(C)c2)cc1 1117484 LZKBAACBWRLMMT-GOSISDBHSA-N 386.473 2.930 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccn2c(=O)c3c4c(sc3nc12)CCCC4 4971745 URKDAHHOKUMXCD-LBPRGKRZSA-N 383.473 2.697 0 50 GFAA Cc1cccc(N2CCC(N3CCN([C@@H]4CN5CCC4CC5)CC3)CC2)c1C 65381151 JIZCJTOSGCCLLB-XMMPIXPASA-N 382.596 2.984 0 50 GFAA CCCCc1nnc(NC(=O)CN2CCC[C@@H](n3ccnc3CC)C2)s1 137201428 UIBRQGICFVOFBO-CQSZACIVSA-N 376.530 2.915 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)c1cc(-c2ccncc2)[nH]n1 409414184 OOGZCDNDXMFHDM-GHTZIAJQSA-N 397.523 2.825 0 50 GFAA biogenic Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1CN[C@@H]1CCS(=O)(=O)C1 119887305 FABLWXWIQWVLEF-CQSZACIVSA-N 388.320 2.823 0 50 GFAA C[C@@H](C(=O)N1CCc2ccccc2C1)N(c1cccc(F)c1)S(C)(=O)=O 67630153 AQSRAVXXEJVRLZ-AWEZNQCLSA-N 376.453 2.565 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)NCc1ccccc1-n1ccnc1C 65364371 QMSBRMVYNMSERE-UHFFFAOYSA-N 375.425 2.807 0 50 GFAA O=S(=O)(c1ccccc1)n1cccc1CN1CCC[C@H](Cn2ccnc2)C1 67649944 WZBJQGDDRRGNMT-SFHVURJKSA-N 384.505 2.834 0 50 GFAA NC(=O)c1cccc(C[C@H]2CCN(C(=O)CCN3CCc4ccccc43)C2)c1 72128462 YAEUZTOEBJVVGK-GOSISDBHSA-N 377.488 2.629 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)nn1C1CCCCC1 333062669 DLOZCYXLCYJGDJ-LJQANCHMSA-N 394.541 3.129 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1c(F)cccc1Cl)CC(=O)N2 33088112 GIEXNVGVTWXDOH-SNVBAGLBSA-N 397.801 2.885 0 50 GFAA COC(=O)CCCC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71764949 KFFDHNPXUJLBDA-SFHVURJKSA-N 392.471 2.755 0 50 GFAA CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)Nc1ccc(CCC(=O)O)cc1 262169692 NTFFIFLDZAWBKV-HNNXBMFYSA-N 378.494 2.980 0 50 GFAA O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cn(Cc2cccc(F)c2)nn1 130181515 YBEQHRCNVPCXPE-FQEVSTJZSA-N 393.466 2.860 0 50 GFAA Cc1c(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)nnn1-c1ccc(Cl)cc1F 175299441 FWDSGSLQBUOFNE-FUHWJXTLSA-N 386.814 2.756 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)on1 227156554 PLINTVQNCRJXTC-UHFFFAOYSA-N 382.420 2.735 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1CC(=O)N(C(C)C)C1=O 177574990 PVLHOQFAVNRDNH-LBPRGKRZSA-N 393.802 2.708 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N1CC[C@H](n2cc(C)cn2)C1 290927721 KIYYIMCVSYYIBT-PKOBYXMFSA-N 396.491 2.668 0 50 GFAA C[C@@H](c1ccc(F)cc1)N1CC[C@H](N2CCn3c(nnc3C(F)(F)F)C2)C1=O 293048321 KIPSDLLURLFZOI-FZMZJTMJSA-N 397.376 2.614 0 50 GFAA NC(=O)CN1CCC[C@@H](C(=O)Nc2cccc(-c3cc4ccccc4[nH]3)c2)C1 95529300 GOQDTAALCUCYOV-QGZVFWFLSA-N 376.460 2.971 0 50 GFAA Cc1cc(C(=O)N=c2cc(-c3ccccc3)[nH]n2[C@H]2CCS(=O)(=O)C2)c(C)o1 334158514 SMOBYUIGXOTHEO-INIZCTEOSA-N 399.472 2.794 0 50 GFAA O=C(c1ccc2c(c1)ncn2CCO)N1CCC(OCc2ccccc2)CC1 97743274 RQXVWMLQBGHQDF-UHFFFAOYSA-N 379.460 2.850 0 50 GFAA O=C(CCc1ccncc1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91656620 RVAQZVGHCXTQMC-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA COCc1nc(N[C@H]2CCCN(Cc3ccccc3)C2)cc([C@H]2C[C@@H](N)C2)n1 244763814 OVZUVGOCBLZWRA-OTWHNJEPSA-N 381.524 2.904 0 50 GFAA Cc1ccc(C)c([C@@H](C)NC(=O)CN2CCN(C3CCSCC3)CC2)c1 244601847 DSUHHQHVCUPORE-GOSISDBHSA-N 375.582 2.994 0 50 GFAA CC(=O)N1CCC2(CC1)CN(C(=O)c1cccc(-c3ccc(O)cc3)c1)CCO2 828916636 RUDQMHJOCGLJJB-UHFFFAOYSA-N 394.471 2.913 0 50 GFAA COc1ccc(C(=O)N(C)C[C@@H](C)NC(=O)c2ccc3n[nH]cc3c2)c(C)c1 1875350064 ZGWZHIVACKKPIX-CQSZACIVSA-N 380.448 2.770 0 50 GFAA C[C@H]1CN(C(=O)COCc2ccccc2)CC[C@H]1NC(=O)Cc1ccccc1F 1875324784 BANUMZSTFGPSMR-LAUBAEHRSA-N 398.478 2.938 0 50 GFAA CCC[C@@H](C(=O)N[C@H](Cc1cccc(OC)c1)c1ccccc1)S(N)(=O)=O 1875267835 YJNAXABCOQCLOZ-MOPGFXCFSA-N 390.505 2.552 0 50 GFAA O=C(NC[C@@H]1CCCN(C[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)C1)c1ccccc1 1875264931 OZUJIHSLKULLRU-UDVNQTNWSA-N 392.543 2.637 0 50 GFAA CCc1nc(CN2CC[C@](c3nc(-c4cccnc4)no3)(C(F)(F)F)C2)n[nH]1 952894213 XMYBWLBGVDMECK-INIZCTEOSA-N 393.373 2.518 0 50 GFAA CN(C[C@H](O)CN1Cc2cnn(-c3ccc(F)cc3)c2CC(C)(C)C1)C1CC1 952893167 SMERLXGSLXCJOO-FQEVSTJZSA-N 386.515 2.851 0 50 GFAA Cc1ccccc1CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1CCCN1C(N)=O 952869072 HTPWWZRZWRDUHL-SFHVURJKSA-N 395.459 2.796 0 50 GFAA Cn1c(CCCNC(=O)CN2CCOc3ccccc3C2)nc2ccccc21 952983122 ZUTOEURIUNRTSC-UHFFFAOYSA-N 378.476 2.517 0 50 GFAA COc1ccc(Cn2cc(C(=O)NCC(=O)Nc3c(C)cccc3C)cn2)cc1 109202360 NTKIELBWDLDEMU-UHFFFAOYSA-N 392.459 2.925 0 50 GFAA Cc1ccc(S(=O)(=O)C2(C(=O)Nc3nnc4cc(C)ccn34)CCC2)cc1 170659031 IJDNEAUUZLUDRO-UHFFFAOYSA-N 384.461 2.681 0 50 GFAA O=C(CCCN1CCN(c2ccccc2)CC1)N[C@H]1COc2ccccc2C1 171863532 IUZMFSRDTYNLKN-HXUWFJFHSA-N 379.504 2.709 0 50 GFAA CCOc1cnc(C(=O)N2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 187598207 GDUANYGWGMYOHE-OAHLLOKOSA-N 378.436 2.680 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CCCN(Cc2cccc(F)c2)C1 194928173 MTWZCXZERNTIAN-AZUAARDMSA-N 384.451 2.850 0 50 GFAA C[C@@H](CN1CCCC1)CN(C)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506418042 NNKKJPQRSMTLFI-LLVKDONJSA-N 392.880 2.530 0 50 GFAA COc1ccc(Cc2cnc(N3CCOCC3)nc2)c(-n2nc(C)cc2C)c1 1772702589 WWABFIWYIGEFAB-UHFFFAOYSA-N 379.464 2.715 0 50 GFAA CCn1ccc(-c2nc(COc3cccc(OC)c3)nn2[C@H]2CCOC2)cc1=O 1772808090 ZADFEGPROFJWGM-INIZCTEOSA-N 396.447 2.676 0 50 GFAA COc1cc(-c2onc(NC[C@H]3CC(=O)N(C4CC4)C3)c2C(=O)O)ccc1F 1772701396 OBFAWQYEMBXHNA-SNVBAGLBSA-N 389.383 2.610 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)NCC(C)C)Cc2ccccc2)cc1 5006606 NIMZXXMRXKTZRM-UHFFFAOYSA-N 390.505 2.658 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3ccccc3Cl)c2)C1=O 12003862 BGKPQDUFGYHGHG-LLVKDONJSA-N 378.837 2.905 0 50 GFAA Cc1cc(C)cc(-n2ncc3c2CCC[C@H]3NC(=O)CN2CCCCC2=O)c1 12459047 FTBRYFFFKKKWIO-LJQANCHMSA-N 380.492 2.995 0 50 GFAA CCOc1cc(Br)ccc1S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 18187620 SMBZALNWEANWTM-PHIMTYICSA-N 378.288 2.646 0 50 GFAA O=C(c1ccoc1)N1CCC2(CC1)NC(c1cccc(Br)c1)=NO2 169754930 SCSPBQHMKJQRSS-UHFFFAOYSA-N 390.237 2.956 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ccc(F)cc2F)CC12CCN(C(=O)C1CCC1)CC2 1857683450 GTXSAMVXBNWIGU-KRWDZBQOSA-N 392.446 2.890 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)o1 1857716087 VUBZOOWYSBIEQI-SFTDATJTSA-N 382.460 2.626 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCc4c(O)nc(N(C)C)nc43)C2)c(F)c1 1857730507 VCMKGLGVDWGVOU-OAQYLSRUSA-N 386.471 2.876 0 50 GFAA CCCC[C@@H]1CN(C(=O)CCn2cnc3ccccc3c2=O)C[C@H](C2CC2)O1 1857739197 MDAIJERBCTUOJQ-YLJYHZDGSA-N 383.492 2.983 0 50 GFAA Cc1ccc(Cl)c(S(=O)(=O)N2CCCN(c3nc(C)ns3)CC2)c1 127904428 XOWPRWASBFNSEX-UHFFFAOYSA-N 386.930 2.709 0 50 GFAA CCOc1ccc(CN2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)cc1 301190109 VSMLSVDKKPTKQL-UHFFFAOYSA-N 378.480 2.692 0 50 GFAA Cc1ccc(C)c(OC[C@@H](O)Cn2cnc3c(N4CCCC4)ncnc32)c1C 114215524 IVKGVUBXFVLRGG-KRWDZBQOSA-N 381.480 2.792 0 50 GFAA COc1ccccc1-c1cc(C(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)[nH]n1 136469970 PJWJGADDUXTFJY-OAHLLOKOSA-N 382.464 2.606 0 50 GFAA Cc1c(Cc2ccccc2)c(=O)nc2sc(=Cc3ccc(F)cc3)c(=O)n12 254765468 BDNVRUNTYLYCCJ-UHFFFAOYSA-N 378.428 2.702 0 50 GFAA COc1ccc([C@@H](C)NC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1 263829861 MXSOFQUBAHKRGT-GFCCVEGCSA-N 382.424 2.871 0 50 GFAA O=C([C@@H]1CCCc2cccnc21)N1CC(O)(c2ccc(Br)cc2)C1 857337521 MGCVXFFXMUIATM-MRXNPFEDSA-N 387.277 2.994 0 50 GFAA CC(C)c1ccc(C[C@@H](NC(=O)c2ccccc2)C(=O)N[C@H](C)C(=O)O)cc1 4742777 MUBGUUXDHCFYLH-DNVCBOLYSA-N 382.460 2.740 0 50 GFAA O=S(=O)(c1cnc2cccnn12)N1CCC(c2nc3ccccc3s2)CC1 1857800597 IYBICMJSIXVRAZ-UHFFFAOYSA-N 399.501 2.907 0 50 GFAA CCC(=O)N[C@H](NC(=S)Nc1ccc(C(=O)O)cc1)C(Cl)(Cl)Cl 2706977 ZGGJPTVJWJDKKR-LLVKDONJSA-N 398.699 2.894 0 50 GFAA CCCc1nnc(NC(=O)[C@H](CC)Sc2nnnn2-c2ccccc2)s1 2746269 PQWOMUXOSVFOGG-LBPRGKRZSA-N 389.510 2.976 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCOCC)CC[C@@H]1Nc1ncc(C)c(CC)n1 2356153065 PIEFUGIOJOKZOT-WDSOQIARSA-N 392.544 2.876 0 50 GFAA Cc1ncsc1CCN(C)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356161296 OQEVWOJPLYRQNK-UHFFFAOYSA-N 391.562 2.979 0 50 GFAA C[C@@H]1CN(c2ccccc2NC(=O)N2CCO[C@H](C(=O)C3CC3)C2)C[C@@H](C)O1 225681144 HCMLEMXKQCYXDR-CLCXKQKWSA-N 387.480 2.512 0 50 GFAA O=C(NCCOC[C@H]1CCCO1)c1cc(-c2ccc(Br)cc2)n[nH]1 115419462 RVSKWIYONUQSFF-CQSZACIVSA-N 394.269 2.765 0 50 GFAA O=C(c1cccc(CN2CCOCC2)c1)N1CCN(c2ccc(F)cc2)CC1 22514442 RZNUTWHPRGODDY-UHFFFAOYSA-N 383.467 2.620 0 50 GFAA CC(C)Nc1ccnc(N2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)n1 106945486 WTWFKEWOEJQAKM-INIZCTEOSA-N 391.466 2.648 0 50 GFAA COc1ccc([C@H]2[C@H](C(=O)Nc3cnn(C)c3)c3ccccc3C(=O)N2C)cc1 61720677 PEOSYHQRGDORMT-UXHICEINSA-N 390.443 2.978 0 50 GFAA NC(=O)c1cc2c(cc1N1CCCC1)NC(=O)C[C@@H]2c1cccc2nsnc12 65371134 XSBYVWYTWTULMQ-GFCCVEGCSA-N 393.472 2.865 0 50 GFAA C[C@H](NC(=O)CCc1nc(C2CCCC2)no1)c1nnnn1-c1ccccc1 135500378 OSQUVOSNRSXDCN-ZDUSSCGKSA-N 381.440 2.513 0 50 GFAA Cc1cc(C)cc(-n2nc(CC(C)C)nc2CN(C)[C@@H]2CCS(=O)(=O)C2)c1 65407673 XIMFRBTUPVLEAZ-QGZVFWFLSA-N 390.553 2.702 0 50 GFAA CN(CCC(N)=O)c1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)cn1 67885012 MMMSUEDEAOIZGR-SFHVURJKSA-N 380.492 2.803 0 50 GFAA C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)O[C@H]3CCCCC3=O)cc2)C1 252457304 WVLXQYVLORCYKQ-KSSFIOAISA-N 379.478 2.776 0 50 GFAA CN(Cc1cnccn1)C(=O)c1cn(C(c2ccccc2)c2ccccc2)nn1 72150069 FYJQUNBFTSJGED-UHFFFAOYSA-N 384.443 2.978 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)c(OC)c1 39400082 UJYZNKCNCSRQJL-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA CCS(=O)(=O)c1cccc(C(=O)Nc2cccc(-c3nnc(C)n3C)c2)c1 363149395 ZNWQRUUEHDIUTI-UHFFFAOYSA-N 384.461 2.836 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 236828570 OHVSZIBBSYUBAX-RTWAWAEBSA-N 390.439 2.989 0 50 GFAA COc1cc(F)c(NC(=O)N2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)cc1F 363951747 WXRIKLWNLQUCJS-WBMJQRKESA-N 380.395 2.827 0 50 GFAA COc1ccc(CN2CCN(C3CCCC3)[C@H](CCO)C2)c(OC)c1OC 39442175 YNISJVBQUPLRNJ-GOSISDBHSA-N 378.513 2.524 0 50 GFAA COc1cc(CN2CCCCCC2)ccc1OC[C@@H](O)CN1CCSCC1 15065393 MLRPYTAYOQQFIQ-IBGZPJMESA-N 394.581 2.860 0 50 GFAA O=C(c1cn(C2CCNCC2)nn1)N1CCC[C@H]1c1nc2ccccc2s1 237880042 RPGLRYHVJZBCHY-INIZCTEOSA-N 382.493 2.790 0 50 GFAA Cc1ccc(-c2cc(C(=O)N(C)Cc3nc(=O)c4sccc4[nH]3)[nH]n2)cc1 30031362 STCQRYNFTVGYDJ-UHFFFAOYSA-N 379.445 2.955 0 50 GFAA COc1cccc(OC[C@@H]2CCCN(C(=O)Cc3c(C)nc(N)nc3C)C2)c1 72433128 ZVFMTFSKYOAWIT-MRXNPFEDSA-N 384.480 2.544 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)NCc2ccc3[nH]c4c(c3c2)CCCC4)cc1 71523834 FVYXYNPVNABBRN-UHFFFAOYSA-N 383.473 2.624 0 50 GFAA COc1cccc(-c2noc([C@@H](C)NC(=O)N[C@H]3c4ccccc4C[C@H]3O)n2)c1 173520776 SLAXRUIEVXQROQ-PJSAGSTRSA-N 394.431 2.764 0 50 GFAA CN(CCN1CC2(CCN(C[C@H]3CCOC3)CC2)OC1=O)C1CCCCC1 72421261 FCWLQCNGCIPQEU-GOSISDBHSA-N 379.545 2.574 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)c3ccc4cc[nH]c4c3)CC2)C1 71759164 OUAUUPVWFLCTSV-GOSISDBHSA-N 394.519 2.763 0 50 GFAA C[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cccc(-n2ccnc2)c1 175054851 BCFJHZZVDSTNBB-INIZCTEOSA-N 376.464 2.756 0 50 GFAA O=c1cc(-c2ccncc2)nc(-c2ccc(CN3CC(n4cccn4)C3)cc2)[nH]1 48337790 XEYYTQDSYNJHKT-UHFFFAOYSA-N 384.443 2.752 0 50 GFAA CC(C)CCN1CCC(CNC(=O)C2CCN(Cc3nccn3C)CC2)CC1 176543477 KIDUKRHRIZXUHN-UHFFFAOYSA-N 389.588 2.506 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1CCC(c2ccn[nH]2)CC1 221345525 OGLZXUWEJOSQKJ-UHFFFAOYSA-N 384.465 2.743 0 50 GFAA COC(=O)c1ccc(N2CCN(c3nc4ccccc4cc3CO)CC2)cc1 96151178 YHHRDBVGWBEGRU-UHFFFAOYSA-N 377.444 2.840 0 50 GFAA O=C(NCc1csc(N2CCCC2)n1)c1cnc(CN2CCCC2)s1 97475107 WBNDPAHVFFXQIG-UHFFFAOYSA-N 377.539 2.726 0 50 GFAA CNc1ccnc(N2CC[C@@]3(CCCN(Cc4cc(OC)ccc4F)C3)C2)n1 426615367 DZVPCEOBYDUUPU-OAQYLSRUSA-N 385.487 3.159 0 50 GFAA Cc1nc2ccc(C(=O)N3CCNC(=O)[C@@H]3c3cccc(F)c3)cc2nc1C 97632116 VIKGJZDVCLFOQV-IBGZPJMESA-N 378.407 2.699 0 50 GFAA COCCn1nnc2c1CCN(C(=O)c1cc(C)n(Cc3ccccc3)c1C)C2 294263886 HYVWDOLBJVMBLG-UHFFFAOYSA-N 393.491 2.590 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)CC(=O)N(CCCc1ccccc1)C2 91793558 JISGLOYRHMFGJI-UHFFFAOYSA-N 378.538 2.674 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccc(-n3ccnc3)cc2)[C@H]2C[C@@H](O)C2)cn1 244817018 SSWGJGPDPSKUCM-HQRMLTQVSA-N 378.432 2.518 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1c2ccccc2C[C@@H]1O 182348317 IBZGSTYRPJNNLQ-GLZQIGESSA-N 381.398 2.940 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)COC1CCCCC1)CC2 299739428 OGORTEYHPYSKJZ-KRWDZBQOSA-N 391.464 2.954 0 50 GFAA O=C(CC[C@]1(Cc2ccccc2)CCC(=O)N1)NC[C@H]1COc2ccccc2O1 299788388 SCRQRMMRQJALJV-FDDCHVKYSA-N 394.471 2.614 0 50 GFAA CN(c1ccc(C(=O)N2CC[C@H](c3ccc(F)cc3)C2)cc1)S(C)(=O)=O 299765054 ZTXAVIVGDPMLDO-INIZCTEOSA-N 376.453 2.851 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(c2ccccc2F)C[C@H]1C 1875262042 CGGJLQTWPBGFRT-VQIMIIECSA-N 399.466 2.830 0 50 GFAA COc1cccc(C[C@H](NC(=O)N2CC[C@H](C(=O)N3CCCC3)C2)C2CC2)c1 1875257245 KCHJIBBVMCJBEW-ICSRJNTNSA-N 385.508 2.670 0 50 GFAA C[C@H]1CC[C@H](CN)N(C(=O)c2cnc3sc(Cc4ccccc4)cn3c2=O)C1 1875278034 URPYJTUQSINECQ-GOEBONIOSA-N 396.516 2.546 0 50 GFAA CN(C)C/C=C/C(=O)N(CC(F)(F)F)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1875376758 HOGNHQTYRDJGPY-KGXGESDWSA-N 393.450 2.895 0 50 GFAA O=C(c1cc(C(F)(F)F)nn1C1CC1)N1CCC[C@@H](N2CCCCC2=O)C1 1875307012 UCNNGRDSKANKCT-CYBMUJFWSA-N 384.402 2.854 0 50 GFAA Cc1ccc(OCCC(=O)N[C@H]2CNC(=O)CC23CCC3)c(Br)c1 1875345086 RMELAUCBZNDBFT-HNNXBMFYSA-N 395.297 2.701 0 50 GFAA Fc1ccccc1-n1cc(CNC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)cn1 952983195 OTYWQEUXLXTPGM-XBLGPDGASA-N 393.470 2.836 0 50 GFAA C[C@@]1(c2cccc(C(F)(F)F)c2)CCN(CC2(O)CCS(=O)(=O)CC2)C1 886066131 IFGHYWYSNVHTAC-MRXNPFEDSA-N 391.455 2.609 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](C3CCN(C(=O)[C@H]4C[C@@H]4C)CC3)CC2)cnn1C 1775989983 BGUQGXBDPFCCOV-WDYCEAGBSA-N 386.540 2.865 0 50 GFAA Cc1nc2c(O)nc(SCC(=O)Nc3cccc(Cl)c3)nc2nc1O 1776003654 CGUOOUNSBZXAOQ-UHFFFAOYSA-N 377.813 2.524 0 50 GFAA O=C(O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O 170002862 JCTZNKLXPAFATB-VNHYZAJKSA-N 376.840 2.619 0 50 GFAA Cc1csc(-c2ccc(C(=O)NS(=O)(=O)CC3CCOCC3)cc2)n1 170646112 YELCPZPPWPDRTI-UHFFFAOYSA-N 380.491 2.605 0 50 GFAA CCc1cc(=O)[nH]c(SCc2nc3cc(S(=O)(=O)CC)ccc3o2)n1 170601438 STXSRSMDNXRCNJ-UHFFFAOYSA-N 379.463 2.559 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)sc1Cl 188142054 QGJXLXBIRWTMHF-LLVKDONJSA-N 397.909 2.787 0 50 GFAA CC(=O)N1CCN(c2cccc(NC3CCN(Cc4ccncc4)CC3)c2)CC1 188533655 DMYZCQHWHLAWBU-UHFFFAOYSA-N 393.535 2.827 0 50 GFAA CCc1ncnc(N2CCCN(C(=O)c3ccc4c(c3)CCCO4)CC2)c1F 1772808996 IHPSJHGYMIKEEE-UHFFFAOYSA-N 384.455 2.856 0 50 GFAA CCc1ncc(C(=O)N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)cn1 1772808222 JLLRQCWSNZSZAT-UHFFFAOYSA-N 379.386 2.805 0 50 GFAA O=C(NCCc1ccc(F)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1 5465882 XNNPXJDKJNEKPU-UHFFFAOYSA-N 376.453 2.583 0 50 GFAA O=C(CCc1ccco1)N1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2)C1 14949167 XYMURVNORNWZIS-SFHVURJKSA-N 390.505 2.570 0 50 GFAA O=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)CC3CC3)CC2)C1 14960072 ORWDULMDLRLSSL-HXUWFJFHSA-N 383.536 2.806 0 50 GFAA O=C(NC1CCCC1)[C@@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860079 JKZDDIKRGOPDOO-OAHLLOKOSA-N 384.929 2.941 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2ccc(F)cc2)N3)cc1 169764154 LPRUKLOMAYVXHE-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1nc(C2CC2)n2ccccc12 1857527436 JQYFULJDTBHYCA-WMLDXEAASA-N 392.463 2.659 0 50 GFAA Cn1cc(CCNC(=O)C2CCN(c3nc4ccc(Cl)cc4o3)CC2)cn1 1857674184 WDLFFFZNFLKYTE-UHFFFAOYSA-N 387.871 2.790 0 50 GFAA CCc1nc(-c2ccc3nc(CC(C)C)n(CCCN)c3c2)n(C[C@H](C)O)n1 1857677694 MVXITPCPUHJPCO-HNNXBMFYSA-N 384.528 2.785 0 50 GFAA Cc1cc(-c2nccn2-c2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)ccc1O 1857681818 OMWLXKMDMDAEPW-MRXNPFEDSA-N 386.477 2.726 0 50 GFAA CN(C(=O)c1cccnc1-n1cccn1)[C@H]1CCN(c2ccccc2Cl)C1=O 110998543 HGOSAQONOYFCBL-KRWDZBQOSA-N 395.850 2.798 0 50 GFAA O=C(c1n[nH]c2ccccc2c1=O)N1CCC(Oc2ccc(F)cc2F)CC1 111570612 KWFZFNCNWFEWDB-UHFFFAOYSA-N 385.370 2.885 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)CCc1ccc2c(c1)OCO2 247944369 QNHVOKYYXLKVRG-AEFFLSMTSA-N 384.476 2.597 0 50 GFAA CCN(C1CCN(C(=O)c2cncc(-c3ccccc3)c2)CC1)S(C)(=O)=O 135442427 GHJKCYMFTJXMJN-UHFFFAOYSA-N 387.505 2.635 0 50 GFAA CC(C)Cc1nnc(N2CC[C@H](O)[C@@](CO)(Cc3ccc(F)cc3)C2)s1 2100539706 VDZXVHFUQRLMDQ-LPHOPBHVSA-N 379.501 2.668 0 50 GFAA C[C@@H]1[C@H](NC(=O)C23CCC(CC2)C3)CCN1C(=O)c1cc2ccccc2nn1 2325793480 WKWYLILVSHAPRI-OGTMRRRVSA-N 378.476 2.929 0 50 GFAA CC[C@@H](O)c1cn(CC(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)nn1 2325869174 BGDHPLWXZOSUAR-LJQANCHMSA-N 383.427 2.658 0 50 GFAA CCc1csc(-n2cc(C(=O)N3CCN(c4ccncc4)[C@@H](C)C3)cn2)n1 881633288 ULXRKIBJMHPBHJ-AWEZNQCLSA-N 382.493 2.637 0 50 GFAA COc1cc(C=O)cc(Br)c1OCC(=O)NCc1ccccc1 684602 YNJZHBBKWZVLKG-UHFFFAOYSA-N 378.222 2.965 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1)[C@@H]1CCCO1 1054155 PTUYNCICYHCMET-IBGZPJMESA-N 386.473 2.551 0 50 GFAA COC(=O)N1CCCc2cc(Nc3nccc(N4CCC[C@H](O)C4)n3)ccc21 2356164946 MZVCJXCIRASFKO-INIZCTEOSA-N 383.452 2.700 0 50 GFAA NCc1cccc(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)c1 2356170120 VPPJDGHOIMPVFY-QHCPKHFHSA-N 377.488 2.943 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@@H](NCCc3cccc(Cl)c3)C2=O)cc1 4649065 GFAAGKLUEIOOAP-GOSISDBHSA-N 385.851 2.763 0 50 GFAA CN(C)C[C@H](c1ccccc1)N(C)Cc1ccc(-c2nc(CN)cc(=O)[nH]2)cc1 23398545 YGZKTKSUSUPIFE-OAQYLSRUSA-N 391.519 2.630 0 50 GFAA COc1cc(C(=O)N2CCN(C[C@H]3C[C@H]4C=C[C@H]3C4)CC2)cc(OC)c1OC 100573523 QCNAYMQWEXXBLQ-XYJFISCASA-N 386.492 2.682 0 50 GFAA COCCN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CCOC1 470583013 MHDMQKHFXNRPQS-CQSZACIVSA-N 394.269 2.717 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Nc3cc(C)ccc3OC)CC2)n1 67613330 MJMHSBSHEXVHOO-UHFFFAOYSA-N 384.484 2.888 0 50 GFAA O=C(NC1CCCCCC1)C(=O)N1CCc2[nH]nc(-c3ccccc3F)c2C1 67756380 ZVUOSXRBBIJKDX-UHFFFAOYSA-N 384.455 2.940 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCC(O)(c2ccccn2)CC1 1506397121 ZCDPKXCNYODXFW-KRWDZBQOSA-N 376.840 2.853 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCN(C3CCCC3)[C@@H](CCO)C2)cc1 20271569 PJXFCYWFAANCCZ-FQEVSTJZSA-N 384.524 2.897 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)c2snnc2C)CC1 11814044 SPYCDNQYKHNHQQ-UHFFFAOYSA-N 388.537 2.882 0 50 GFAA Cc1nn(C(C)C)c(C)c1NC(=O)CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O 170625745 WTMUEOPPQTVYJM-HNNXBMFYSA-N 387.440 2.513 0 50 GFAA Cn1c([C@H]2CCCN2CCN2C(=O)C3(CCCC3)N=C2O)nc2c1CCCC2 328650655 VQGHEIBTJSQDTO-QGZVFWFLSA-N 385.512 2.505 0 50 GFAA Cc1nn(C[C@@H](C)C(=O)NCc2ccc3c(c2)OCO3)c(C)c1Br 2793989 FTPHDVGWSKHASA-SNVBAGLBSA-N 394.269 2.944 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)N1CCO[C@H]([C@@H]2CCCO2)C1 122950495 KGMBCNYVGZRICZ-NJAFHUGGSA-N 379.888 2.508 0 50 GFAA O=C(Nc1ccc(C(=O)N[C@H]2CCc3[nH]ncc3C2)cc1)OCC(F)(F)F 173446658 JILYSJWLBZUUSG-ZDUSSCGKSA-N 382.342 2.808 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCC2)cc1CCC(=O)N1CCC[C@@H](C)C1 72437618 VUOBDASNYGRCRP-MRXNPFEDSA-N 394.537 2.671 0 50 GFAA CCn1cncc1CN1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72161888 OQCLMSYISSSAHX-VLCRHTCISA-N 380.492 2.694 0 50 GFAA CCOc1ccc2cc(C(=O)N[C@@H]3CCCN(CC(F)(F)F)C3=O)[nH]c2c1 152124385 ICMONPIFYQGXMQ-CYBMUJFWSA-N 383.370 2.850 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCO[C@@H](C2CC2)C1 157030412 XTNREYIMKPIGFL-HUUCEWRRSA-N 392.912 2.961 0 50 GFAA CN1CCC[C@@H](CNC(=O)N2CCc3ccnc(O)c3C2)[C@@H]1c1cccs1 372813420 FWGMMABANZRRTQ-MAUKXSAKSA-N 386.521 3.000 0 50 GFAA CC(C)c1nnc(/C=C/C(=O)N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)o1 376648075 DICIGPMKMVQQLK-KXPUMZMLSA-N 397.479 2.881 0 50 GFAA Cc1cc(-c2cn3cc(C(=O)NCC4CC4)nc3c(=O)n2CC2CC2)c(C)o1 72463771 UZOPBZWSIOGXPH-UHFFFAOYSA-N 380.448 2.923 0 50 GFAA Cc1cc(CN(C)Cc2cc3n(n2)CCCN(Cc2ncccc2F)C3)no1 72132014 OQZFZJXXNDIFOO-UHFFFAOYSA-N 384.459 2.752 0 50 GFAA Cc1cc(NC(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cc(C(N)=O)c1 455833740 KJTAMRHAHZMRLL-LJQANCHMSA-N 394.475 2.910 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)N2CCC[C@H](N(C)CC(=O)O)CC2)C12CCCCC2 263207557 IHSGQJYHVXSOHT-OKZBNKHCSA-N 395.544 2.695 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccc(F)cc3)n2)c(F)c1 44921864 CPUAPRXYEFRRRV-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA O=C(c1ccnn1COc1ccccc1Cl)N1CCN(c2ccccn2)CC1 18166619 DVPMZFVLSMJENU-UHFFFAOYSA-N 397.866 2.930 0 50 GFAA Cc1oc(C(=O)Nc2ccc([C@H](C)N)cc2)cc1S(=O)(=O)N1CCCC1 178198262 DCGBRYLLVUWBES-LBPRGKRZSA-N 377.466 2.645 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1cnc(C(C)C)nc1)CC2 95525725 KPOJIYICYFINHL-UHFFFAOYSA-N 382.512 2.609 0 50 GFAA Cc1cnn(CCC(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)c1 95391035 LXSJCSJANMQYRS-GHTZIAJQSA-N 378.520 2.672 0 50 GFAA CCN(C)C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2Cl)C[C@@H]1CO 91678777 JIHCURFPCXDSIA-VXGBXAGGSA-N 378.822 2.991 0 50 GFAA COc1cc(CN2CCC(C)CC2)ccc1OC[C@H](O)CN1CCSCC1 95523642 FGJMUSRWRWGSDF-LJQANCHMSA-N 394.581 2.716 0 50 GFAA Cc1ccc2cccc(OCCNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)c2n1 91656907 SBNVXLXJNNGHQX-KRWDZBQOSA-N 381.476 2.829 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)C3CCN(Cc4ncon4)CC3)cc2)n1 95521217 RSLNOFRITHNACM-UHFFFAOYSA-N 380.452 2.723 0 50 GFAA O=C(Cn1cc2ccccc2n1)N1C[C@H]2CC[C@@H]1CN(Cc1ccccn1)C2 95371859 CWHNZJURZPPHDP-FXAWDEMLSA-N 375.476 2.554 0 50 GFAA O=C(N[C@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1c[nH]nc1-c1cccc(F)c1 244707767 KHHMIWYMOWOWIO-DKSSEZFCSA-N 380.423 2.723 0 50 GFAA O=C(c1nnn2c1CO[C@H](c1ccccc1)C2)N1CCN(C2CCCCC2)CC1 263616237 HSMVVZMTZFIFCO-FQEVSTJZSA-N 395.507 2.640 0 50 GFAA O=C1CCN(C(=O)c2cn3ccccc3n2)CCN1Cc1ccccc1Cl 299781558 CVQHFYYMRUPLTH-UHFFFAOYSA-N 382.851 2.862 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)c2ccccc2N2CCOCC2)n1 825264565 WUOPLDUCQNVCRN-UHFFFAOYSA-N 380.370 2.570 0 50 GFAA CCC1=NO[C@@H](Cn2cnc3sc(C(=O)N(CC)CC)c(C)c3c2=O)C1 670452320 KWYIWHORJJSWTC-CYBMUJFWSA-N 376.482 2.803 0 50 GFAA Cc1ccc2oc(=O)n(CCC(=O)N[C@H](C)c3nc(-c4ccncc4)no3)c2c1 670449530 ZLBPKBXPZBUHGX-CYBMUJFWSA-N 393.403 2.615 0 50 GFAA C[C@H](C(=O)N1CCC[C@H]1c1cn(C)c2ccccc12)n1cnc2c(N)ncnc21 1875312928 KMPRBNFMNNUDNV-DYVFJYSZSA-N 389.463 2.825 0 50 GFAA C[C@@H]1CN(C(=O)c2cccc3nc[nH]c23)CC[C@H]1NC(=O)c1ncc(F)cc1F 1875338975 RWJYOVLIONYAMR-IAQYHMDHSA-N 399.401 2.517 0 50 GFAA COC(=O)[C@@H]1N(C(=O)[C@@H]2C[C@H]2c2ccnc3ccccc23)CC12CCOCC2 1875295799 QUSSETPRYFDHPL-SCTDSRPQSA-N 380.444 2.519 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CCO[C@@](C)(C(F)F)C2)cc1 888101803 HNXSNRZWLNQFFX-LJQANCHMSA-N 383.439 2.985 0 50 GFAA CCOc1ccc(/C=c2/s/c(=C\C(=O)c3ccc(Cl)cc3)[nH]c2=O)cc1 211276215 YLZMFAMZFHIQQK-MZTKBTAGSA-N 385.872 2.981 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)[C@@H]1CC(=O)N(Cc2ccncc2)C1 1529153383 AVTHFCFQYLYJKJ-GOSISDBHSA-N 389.459 2.778 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCCC2(O)CCCC2)ccc1F 1704325823 SQZIJIXPSQQWGR-UHFFFAOYSA-N 391.443 2.980 0 50 GFAA Cc1ccc(Cn2c(CN3CCC([C@@H](O)CO)CC3)nc3ccccc32)cc1 1772705045 JUTBVGZPWZFBGS-QFIPXVFZSA-N 379.504 2.958 0 50 GFAA O=c1c2ccccc2[nH]c(=S)n1CCN1CCN(Cc2ccccc2)CC1 20154004 TUCFRBUGRXRJLV-UHFFFAOYSA-N 380.517 2.877 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1 5158318 CVIIAOKGVLTYJI-OAHLLOKOSA-N 397.880 2.836 0 50 GFAA CC(=O)N1CCCN(C(=O)c2csc3nc(-c4ccc(F)cc4)cn23)CC1 11819245 UQJKBJCODNSPBF-UHFFFAOYSA-N 386.452 2.896 0 50 GFAA NC(=O)c1cncc(-c2cccc3c2O[C@H](CNC(=O)[C@@H]2CC=CCC2)C3)c1 11975856 IADRQNVMYYYNGS-KDOFPFPSSA-N 377.444 2.624 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)N[C@H](CO)C(C)C)no3)ccc2s1 12001457 SVGFCULBQWXFNF-MRXNPFEDSA-N 375.450 2.918 0 50 GFAA CC(=O)Nc1cccc(NC(=O)CSc2nc3ccccc3c(=O)n2C)c1 12379755 RHGGQLIGAQPLMJ-UHFFFAOYSA-N 382.445 2.623 0 50 GFAA O=C(N[C@H]1CCCN(CCc2ccccc2)C1)C1(N2CCOCC2)CCCCC1 15062772 XYIWWQGLISFPCY-QFIPXVFZSA-N 399.579 2.845 0 50 GFAA COCCN(C)Cc1cnc(S(=O)(=O)Cc2ccccc2)n1CC(C)C 19595381 WUTARFPPWAGPHK-UHFFFAOYSA-N 379.526 2.591 0 50 GFAA Cc1ccc(C(=O)Nc2ccccc2C(=O)NCCCN2CCOCC2)cc1 19831361 FANALSCYCVWSPS-UHFFFAOYSA-N 381.476 2.699 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4cccc5[nH]ccc45)CC3)nn2)n1 169780605 AZPYGNYYSPSVGF-UHFFFAOYSA-N 391.435 2.849 0 50 GFAA COc1ccc(-n2c(=O)nc(O)c3ccc(-c4ccc(OC)cc4O)nc32)cc1 1857526503 JTVBESRADDZZQR-UHFFFAOYSA-N 391.383 2.876 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)Cc2ccc3ccccc3c2)[C@H]1c1cnn(C)c1 1857716534 ABAHVNGSOFSFAS-GMAHTHKFSA-N 392.503 2.646 0 50 GFAA CNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1cc(C(C)=O)cn1C 1857730377 QPAZIGJFHDBBAE-XKCSPQBFSA-N 379.504 2.940 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2ccc(OC(F)F)cc2)C1=O 157419009 ASDIQWKMYIJTOZ-CQSZACIVSA-N 376.359 2.832 0 50 GFAA Cc1ncccc1CCNC(=O)N1CCO[C@H](c2cn3c(C)cccc3n2)C1 2325764752 VYKGXEYXBFHVLG-IBGZPJMESA-N 379.464 2.672 0 50 GFAA C[C@@]12CC3(F)CC(NC(=O)Cc4ccc(-c5nn[nH]n5)nc4)(C1)C[C@](C)(C3)C2 2325807934 KPNPVVLAIUXLRF-VCWRXUFXSA-N 384.459 2.762 0 50 GFAA COc1cccc(OC)c1C(=O)Nc1ccc(N2CCN(C(C)=O)CC2)cc1 812003 MOUVGKXMUKIFCF-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA CCOC(=O)N1CCN(C(=O)COc2ccc(CC)cc2Br)CC1 1148472 CYJNCUGXBQGWRB-UHFFFAOYSA-N 399.285 2.691 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2cccc(Br)c2)C(N)=O)cc1 2998376 YHCFAQRXCFAHAZ-DHDCSXOGSA-N 375.222 2.714 0 50 GFAA COc1ccc(N(CC(=O)NCC(C)C)S(=O)(=O)c2ccc(C)cc2)cc1 2959620 YXVVWPZDAASINU-UHFFFAOYSA-N 390.505 2.971 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2cc(C)nc3ccccc23)C1=O 2356168325 YTULSXSWTNFAQE-QFIPXVFZSA-N 381.476 2.787 0 50 GFAA Cc1nc(NC(=S)NC(=O)c2ccco2)ccc1I 6767169 RBDSGROAUDEMQR-UHFFFAOYSA-N 387.202 2.714 0 50 GFAA O=C(NCc1ccncc1)[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 7367029 IEYHFELYNMFZDF-HXUWFJFHSA-N 395.484 2.704 0 50 GFAA COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2ccc(NC(C)=O)cc2)CC1=O 7598417 UOAOZQFDLUDHAY-HNNXBMFYSA-N 381.432 2.954 0 50 GFAA O=C1C[C@H](c2cccs2)Cc2nc(N3CCN(c4ncccn4)CC3)ncc21 9341162 QSZBFQJPHKWCAN-CQSZACIVSA-N 392.488 2.567 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NC[C@](C)(O)c1ccccc1 114546595 BUGHHVZGBHMNDN-CVDCTZTESA-N 396.487 2.714 0 50 GFAA O=C(NCc1nnc(S)n1C1CC1)C1(c2ccc(F)cc2F)CCOCC1 134286359 TUVHDHWQHARZRF-UHFFFAOYSA-N 394.447 2.545 0 50 GFAA O=C(Nc1cnccc1-n1cccn1)c1ccc(Cl)c(N2CCNC2=O)c1 463788430 JGBPTVJEBOXJMD-UHFFFAOYSA-N 382.811 2.703 0 50 GFAA CCC(=O)N(CCc1ccc(OC)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O 100560720 UJDUXIFJRKTEOJ-LJQANCHMSA-N 398.434 2.948 0 50 GFAA CCOC(=O)c1cn(CCSc2ncn[nH]2)cc(Oc2ccccc2)c1=O 55324924 DLXOYVOKQQWABV-UHFFFAOYSA-N 386.433 2.728 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3CC[C@@H](N)[C@H]3C2)cc(C)c1OCC(=O)N1CCCCC1 248700776 ZNUWJMMLNNYPGR-YSIASYRMSA-N 399.535 2.504 0 50 GFAA O=C(CN1CCC(O)CC1)N1CC[C@@]2(CCCN(CCC3CCCCC3)C2)C1 11814910 RHUSMQWKELXDFP-HSZRJFAPSA-N 391.600 2.728 0 50 GFAA O=C(NCCc1cnccn1)c1cc(COc2cccc3cccnc23)on1 20920081 YTXDOFBOIXRGOI-UHFFFAOYSA-N 375.388 2.564 0 50 GFAA Cc1cc(NC(=O)Cn2cc(-c3ccnc4[nH]ncc34)cn2)n(-c2ccccc2)n1 67771705 GDEYZHGNZJIYBL-UHFFFAOYSA-N 398.430 2.954 0 50 GFAA CCc1cn[nH]c1C1CCN(C(=O)c2ccc(C)c(N3CCNC3=O)c2)CC1 20534433 XHDCGGCQOKGVPX-UHFFFAOYSA-N 381.480 2.830 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)Nc3ccc4c(c3)OCCO4)cnn2c1 67804396 UXCXTVWQZCHBEI-UHFFFAOYSA-N 381.436 2.595 0 50 GFAA C/C(=C\c1ccco1)CN1CCN(C2CCN(C(C)C)CC2)[C@@H](CCO)C1 20351550 OUMKHDZOSQVYDL-DQYQWZCESA-N 375.557 2.924 0 50 GFAA C[C@@H](CN1CCCC1)C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67934475 ODFVABDVZUIFDL-AWEZNQCLSA-N 383.448 2.687 0 50 GFAA CC1(C)C(O)=Nc2ccc(S(=O)(=O)N3CC[C@@H](Oc4cccnc4)C3)cc21 328612273 OFELSGYOEUVSNU-CQSZACIVSA-N 387.461 2.803 0 50 GFAA O=C(Nc1cnns1)c1ccc(CN2CCC[C@@H](Cn3ccnc3)C2)cc1 65452415 YXUFAOOWBPUQGS-MRXNPFEDSA-N 382.493 2.899 0 50 GFAA CCN(Cc1nccn1C)C(=O)c1ccc(-c2ccc3c(c2)OCCO3)nc1 67650475 VHTGCBKMWKWCQI-UHFFFAOYSA-N 378.432 2.916 0 50 GFAA Cc1c(NC(=O)N2CC[C@@H]3OCCN(C)[C@H]3C2)cccc1OCC(F)(F)F 332614768 QNRNFUGFCJAXSO-HOCLYGCPSA-N 387.402 2.873 0 50 GFAA Cc1ccn2cc(Cn3nc([C@@H]4CCCNC4)n(-c4ccccc4)c3=O)nc2c1 71756856 BDUBWXMOGOMUSW-QGZVFWFLSA-N 388.475 2.505 0 50 GFAA CCN1CCN(C(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71715107 LKFPYCDCBCZORL-XMMPIXPASA-N 391.515 2.698 0 50 GFAA C[C@@H]1Cc2ccccc2N1CCNC(=O)NCc1ccnc(-n2ccnc2)c1 363454916 UVVLLQLPMQIGKM-MRXNPFEDSA-N 376.464 2.518 0 50 GFAA CC(=O)N1CC2(CCN(CCOc3ccc(Cl)cc3)CC2)C[C@@H]1C(=O)O 72146350 QTQOOIFWJUQVMJ-QGZVFWFLSA-N 380.872 2.506 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCCn2ccnc2)Cc2ccccc2C1 72161552 ZRNHCSSJAMKZQP-UHFFFAOYSA-N 388.515 2.711 0 50 GFAA Cc1nc2cc(NC(=O)N3CCN(C)[C@H](c4nc(C5CC5)no4)C3)ccc2o1 286069747 UAAWCJTYWFALCW-HNNXBMFYSA-N 382.424 2.917 0 50 GFAA O=C(NCc1nccn1CCc1ccccc1)N[C@@H]1c2ccccc2C[C@H]1O 175922694 IFDVYNGPPJVYFI-TZIWHRDSSA-N 376.460 2.583 0 50 GFAA CO[C@@]12CC[C@H](Oc3ccccn3)C[C@@H]1N(Cc1ccc(C(N)=O)cc1)CC2 426512322 SRJPFIOHQFVAQQ-CNNODRBYSA-N 381.476 2.772 0 50 GFAA CC(C)c1c(C(=O)N2CC[C@@H](C(=O)O)C2)cnn1-c1ccc(C(F)(F)F)cn1 178258916 FGNMIIHSGYNHOD-LLVKDONJSA-N 396.369 2.956 0 50 GFAA O=C(Nc1cccnc1-n1cccn1)N1CCN(c2ccncc2Cl)CC1 178933830 UJASTWNTSMFWHE-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA O=C(c1ccc([C@H]2CCCN2C(=O)Cc2cccnc2)s1)N1CCOCC1 82039313 FODNJIJADSPFTO-MRXNPFEDSA-N 385.489 2.522 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)Cc2ccsc2)CC1 91746380 JFNDTDSPXMESDC-UHFFFAOYSA-N 384.509 2.553 0 50 GFAA O=C1COc2cccc(OCC(=O)N3CCC(Cc4ccccc4)CC3)c2N1 180762003 VNKCQIATOBTUNJ-UHFFFAOYSA-N 380.444 2.878 0 50 GFAA O=C1CC2(CCN(c3ncnc4[nH]cnc34)CC2)CN1Cc1ccc(F)c(F)c1 92064988 OFUBVZAWKINKNA-UHFFFAOYSA-N 398.417 2.650 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)NC[C@@H](CO)Cc2ccco2)cc1Cl 97553250 IYQLSQUDEKZDBV-LBPRGKRZSA-N 379.844 2.608 0 50 GFAA CCCc1nnsc1C(=O)N1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1 91694561 GQAKBAHDZQHYLD-IBGZPJMESA-N 376.526 2.745 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(C(=O)NCCCn3cccc3)CC2)cc1 534656721 LPSLLAOMYVCODA-UHFFFAOYSA-N 382.508 2.925 0 50 GFAA Cn1c(=O)n(C)c2cc(NC(=O)N3CCCC[C@H]3CCn3ccnc3)ccc21 299799938 XSRXFBQLYFBDJJ-INIZCTEOSA-N 382.468 2.550 0 50 GFAA CSc1ncc(CNC(=O)N2CCCN(C3Cc4ccccc4C3)CC2)n1C 824958839 DIOXCUOLMXIOKR-UHFFFAOYSA-N 399.564 2.527 0 50 GFAA CNC(=O)[C@H]1CC[C@H](CNC(=O)N2CC(Oc3cccc(Cl)c3)C2)CC1 670435292 LOPOIKAXVLBQCZ-HDJSIYSDSA-N 379.888 2.665 0 50 GFAA O=C(O)C[C@H]1CCN(C(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)C1 1875277207 DMFVLNZFNOWHIM-APWZRJJASA-N 380.444 2.871 0 50 GFAA Cc1nc([C@@H]2CN(C)CC23CN(C(=O)c2ccc(-c4ccc(F)cc4)o2)C3)n[nH]1 1875269450 OUBSBEBHUJMFHV-INIZCTEOSA-N 395.438 2.684 0 50 GFAA Cc1cccc(-c2ccc(C(=O)N[C@H](C(N)=O)c3ccc(F)cc3)c(O)n2)c1 1875260834 GOEUGBOWNYXADK-SFHVURJKSA-N 379.391 2.858 0 50 GFAA CO[C@H](C)c1noc(CN(C)C(=O)c2cc(=O)c3ccc(Cl)cc3o2)n1 1875359988 VSXIECZYOMMELY-SECBINFHSA-N 377.784 2.809 0 50 GFAA Cn1c(=O)cc(C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)c2ccccc21 952991774 VJFWCLZQYUESJP-UHFFFAOYSA-N 375.428 2.612 0 50 GFAA O=C(c1cccc2[nH]cnc12)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 275732974 UVAHUSCHZHCTAZ-OAHLLOKOSA-N 377.448 2.852 0 50 GFAA Cc1ccc(C(=O)N2CCN(C(=O)NCc3ccc4c(n3)CCCC4)CC2)s1 278346041 HYXRORGQPCYKPS-UHFFFAOYSA-N 398.532 2.998 0 50 GFAA COc1cc(Br)cc(NC(=O)N2CC[S@](=O)CC[C@@H]2C)c1 408041983 JFKPSHIQEQFXBL-CHNSCGDPSA-N 375.288 2.833 0 50 GFAA CC(C)c1nnc2n1C[C@@H](NC(=O)N1CC(C)(C)OC3(CCCC3)C1)CC2 190818049 NKRPMQGNYWTTLA-HNNXBMFYSA-N 375.517 2.850 0 50 GFAA C[C@@H](NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1)c1ccnn1C 192896688 ZPXSPJZSTNUXAF-CQSZACIVSA-N 386.477 2.862 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NC[C@@H]3CN4CCC[C@H]4CO3)c12 747344145 VEYZLGSUCRJDPU-DLBZAZTESA-N 392.459 2.791 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3nn(C)cc3Cl)CC1)OCC2 1704337457 ZSGXSXQHYUHNDV-UHFFFAOYSA-N 375.856 2.786 0 50 GFAA O=C(c1ccc2c[nH]nc2n1)N1CCCN(c2nc3ccccc3s2)CC1 1775977661 LKYLGWPWAFOCJF-UHFFFAOYSA-N 378.461 2.920 0 50 GFAA Cn1c(CNC(=O)c2cc(O)cc(C(=O)O)c2)nc2cc(C(F)(F)F)ccc21 1772703426 DQPZRSYBYULQOF-UHFFFAOYSA-N 393.321 2.926 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cncnc4)C[C@@H]2CN(Cc2ncc[nH]2)C3)cc1 1772809340 TYDRSXCGVHOULL-FYYLOGMGSA-N 388.519 2.767 0 50 GFAA O=C(CC[C@@]1(Cc2ccco2)CCC(=O)N1)NCc1cccc(-n2cccn2)c1 11784109 ADZCSLQFFWAGRK-QFIPXVFZSA-N 392.459 2.753 0 50 GFAA Cc1ncsc1CCCNC(=O)[C@@H]1CCC(=O)N(CCc2ccccc2)C1 12300160 HWEWJJAMKSQSGE-GOSISDBHSA-N 385.533 2.982 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 12304581 RPOQFGZWZXFBEJ-MRXNPFEDSA-N 382.416 2.903 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)c1 12319653 QYBBSODLSKKCEX-HXUWFJFHSA-N 387.524 2.680 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N[C@@H]1CCCN(C2CCN(C)CC2)C1 12588367 LFQDQSKPGLEHAK-QGZVFWFLSA-N 379.932 2.702 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@@H](C(=O)N3CCCCCCC3)C2)CC1 12747146 SJGSICZFIBGPCP-LJQANCHMSA-N 375.557 2.892 0 50 GFAA CCN1CCC(N2CC(=O)N(CC(C)C)C[C@@H](OCc3ccccc3)C2)CC1 14534572 CJNJLVIILFQIKA-QFIPXVFZSA-N 387.568 2.856 0 50 GFAA CN1CCC2(CC1)C(=O)N(Cc1cccnc1)C(=O)N2CCc1ccccc1 14746648 IGHZGSBMRGZGMX-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@@H]2CCCN(C3CCCCCC3)C2)CC1 14966109 IVZXDWOUSMSWNU-GOSISDBHSA-N 378.561 2.683 0 50 GFAA COc1cc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 19549820 CZIZKLRHFAKXRX-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA Cc1ocnc1C(=O)N1CCC2(CC1)c1ccccc1[C@@H](N1CCCC1)[C@@H]2O 19791436 VMAARDGBHXYWDS-UXHICEINSA-N 381.476 2.668 0 50 GFAA COc1ccc(C(=O)NC[C@H]2CCCO2)cc1Oc1cccc(OC)c1CN 1857682725 MGFFETCPDCCURT-OAHLLOKOSA-N 386.448 2.864 0 50 GFAA COCCn1nc(Cc2ccc(OC)c(OC)c2)nc1-c1cccnc1N(C)C 1857701857 SEXZGZDKQVVHFR-UHFFFAOYSA-N 397.479 2.661 0 50 GFAA O=C(c1cncc(Cl)c1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857718143 ANTJXZZCYOSMKF-QKLQHJQFSA-N 383.835 2.650 0 50 GFAA CCCS(=O)(=O)N1CCc2ncc(NC(=O)c3sc(C)nc3C)cc2C1 1875250057 UUYAHCGTKLEWPC-UHFFFAOYSA-N 394.522 2.505 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CNCCc2cn[nH]c2)cc1 23153517 SRIWQDDRINLMQG-JOCHJYFZSA-N 394.519 2.614 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2CCC3(CC2)C[C@](C)(O)CCO3)c(C)c1C 1704326334 VGULTRWJDRHDPC-LJQANCHMSA-N 397.537 2.705 0 50 GFAA COc1ccc(CN(C)C(=O)c2ccc3nnc(-c4cccn4C)n3c2)cc1O 2100482516 FMBIOLMDHNGZBH-UHFFFAOYSA-N 391.431 2.721 0 50 GFAA Nc1cccc(-c2nc(Cn3cc(C4CC4)nn3)n(Cc3ccccc3F)n2)n1 2325841392 RTRWFEHNCMHXSZ-UHFFFAOYSA-N 390.426 2.627 0 50 GFAA COc1ccc(OC)c(NC(=O)c2ccc(CSc3nnnn3C)cc2)c1 624875 VZKOAAOVEKUDNT-UHFFFAOYSA-N 385.449 2.772 0 50 GFAA CCOC(=O)/C(C(N)=O)=C1\Nc2ccccc2N\C1=C/C(=O)c1ccc(C)cc1 792606 HCMRDXMWIXAFIO-QTBWCZOLSA-N 391.427 2.902 0 50 GFAA O=C([C@H]1CC(c2ccc(Cl)c(Cl)c2)=NO1)N1CCC2(CC1)OCCO2 1126241 VCFOJVZSNWAFNN-OAHLLOKOSA-N 385.247 2.852 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)Nc2ccc(F)cc2F)S(C)(=O)=O)cc1 1146490 WWQVXCJAJDKIMT-NSHDSACASA-N 384.404 2.767 0 50 GFAA CCN1C(=O)[C@@H](CC(=O)Nc2ccc(F)cc2)N(Cc2ccco2)C1=S 2728302 UYKOULSNMOLPPC-OAHLLOKOSA-N 375.425 2.765 0 50 GFAA COc1ccc(Cl)cc1NC(=O)C[C@@H](NCCc1ccccc1)C(=O)O 2853081 JERVTSJTZVUUBF-MRXNPFEDSA-N 376.840 2.963 0 50 GFAA Cc1c(-c2ccccc2)n(Cc2ccccc2)c2nc3c(c(=O)n(C)c(=O)n3C)n12 4625497 PKNSFEYBMLALSO-UHFFFAOYSA-N 399.454 2.710 0 50 GFAA COCc1ccc(CN[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)o1 11949010 OYFZQEIPZMXQJB-GOSISDBHSA-N 386.496 2.856 0 50 GFAA CC[C@@H](COC)Nc1ncnc2sc(C(=O)N(CCO)C(C)C)c(C)c12 15002949 RUPCGYPMTNHSFA-ZDUSSCGKSA-N 380.514 2.680 0 50 GFAA COc1ccccc1N1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1 19790793 NDUSJNOYJWUGOE-KRWDZBQOSA-N 376.884 2.911 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCN(C)[C@H](C)C4)nc3)n2)c1OC 39413291 WJEXUZBZQMVNLE-CQSZACIVSA-N 395.463 2.956 0 50 GFAA COc1cccc(-c2cc(C(=O)N3CCC(Oc4ncccn4)CC3)[nH]n2)c1 67855974 FISDLTYFTVBTEQ-UHFFFAOYSA-N 379.420 2.559 0 50 GFAA CN(C)CCN(C)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71745790 RUKUPFXMAJFXJX-QHCPKHFHSA-N 379.504 2.554 0 50 GFAA CC[C@@H]1CN(C(=O)c2cc(C)c(C)[nH]c2=O)CCC(=O)N1Cc1ccccc1 71760207 SNHRVWQEAWKMFU-GOSISDBHSA-N 381.476 2.645 0 50 GFAA CC(C)CCN1C[C@]2(CCCN(c3nnnn3-c3ccccc3)C2)CCC1=O 77488149 GCXVIVOAQXPETB-NRFANRHFSA-N 382.512 2.917 0 50 GFAA Cc1ccc(CN2CCN(C(=O)c3nc4cccc(C)n4c3F)CC2=O)cc1 77505924 VAHRVPVEZIEPMG-UHFFFAOYSA-N 380.423 2.575 0 50 GFAA COc1cccc(N2C[C@@H](Cc3ccccc3)N(C(=O)CCC(C)=O)CC2=O)c1 82133566 OQTAHDBGTROHBS-HXUWFJFHSA-N 394.471 2.851 0 50 GFAA COc1cccc(-c2cc(CNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)no2)c1 91425020 QTNOGKWIMDUYRU-HNNXBMFYSA-N 383.448 2.758 0 50 GFAA COc1cccc(C(=O)N2CCC[C@H](c3nccn3CCCN(C)C)C2)c1O 95391468 LAWVMWJBIRRLBO-INIZCTEOSA-N 386.496 2.569 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N3CC(=O)N[C@@H]4CCCC[C@H]43)ccc12 131163232 DHBSTLIHAMRAEK-IEBWSBKVSA-N 389.459 2.612 0 50 GFAA CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)c1ccc2c(=O)n(C)c(S)nc2c1 133270257 MRXTWPOBAHMLPT-CABCVRRESA-N 375.494 2.546 0 50 GFAA CC(C)CNC(=O)N1CCC[C@H](C(=O)N2CCc3c(F)cc(F)cc3C2)C1 134285107 PNRTUEYAJSXNNO-AWEZNQCLSA-N 379.451 2.927 0 50 GFAA O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)Nc1cc(C2CCCC2)[nH]n1 135692600 QQRDGXHSVSUFIK-UHFFFAOYSA-N 398.435 2.653 0 50 GFAA CC(C)CC(=O)NCCC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 158979917 HUDZGPRNBKZRLA-UHFFFAOYSA-N 379.932 2.973 0 50 GFAA O=C1N[C@H](c2ccccc2F)[C@@H](C(=O)c2ccccc2)[C@](O)(C(F)(F)F)N1 169680924 JKHHWXQVBXGWHG-VBQJREDUSA-N 382.313 2.930 0 50 GFAA CNC(=O)C1CCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)CC1 173001911 DBQLRRZWLHKRQM-UHFFFAOYSA-N 392.809 2.540 0 50 GFAA CNC(=O)[C@H]1CCCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl 173070490 YCPBRZGSNQGFIC-GFCCVEGCSA-N 392.809 2.683 0 50 GFAA Cc1cnc(CCNC(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)s1 173611505 IPEONWGNLYOJCD-UHFFFAOYSA-N 399.442 2.940 0 50 GFAA Cc1cc(C(=O)Nc2cc(CN3CCOCC3)ccc2C)c2cnn(C)c2n1 175728893 VBWNDBQCDKFXFV-UHFFFAOYSA-N 379.464 2.670 0 50 GFAA O=C(N[C@@H]1CCCOCC1)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 192970824 OOXSBZHQCNDKGW-GFCCVEGCSA-N 397.353 2.888 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Nc1ccc(Cl)c(Cl)c1 239415354 UFJHFFHNUULDFO-NRULLWLTSA-N 391.254 2.985 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccc(-n3ccnc3)cc2)[C@H]2C[C@@H](O)C2)cn1 244817019 SSWGJGPDPSKUCM-IMFGXOCKSA-N 378.432 2.518 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 248403342 ONXPFXXHNZWQNQ-CZTZKLFOSA-N 397.563 2.989 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2cccc3nsnc23)[C@@H](c2ccccc2)CO1 248657516 APDTXAYTPTZMRU-IUODEOHRSA-N 375.475 2.842 0 50 GFAA CC1(C)CC(=O)c2cc(C(=O)N3CCNC[C@@H]3c3cccc(F)c3)c(O)nc2C1 261938233 KFGSMHSWKVEXQL-GOSISDBHSA-N 397.450 2.868 0 50 GFAA NC(=O)c1ccc(NC(=O)c2cc3n(n2)C[C@@H](c2ccc(F)cc2)OC3)cc1 263615427 CINCDPBOPJCYNF-SFHVURJKSA-N 380.379 2.645 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1nnn2c1CO[C@@H](c1ccccc1)C2 263615931 GBTCFPAWBAVHGQ-GOSISDBHSA-N 378.388 2.573 0 50 GFAA CCc1nnc(CNC(=O)N2CCCN(Cc3ccc(F)cc3)CC2)s1 291048070 VGNVKMYCOHFPHA-UHFFFAOYSA-N 377.489 2.657 0 50 GFAA CNC[C@@H]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2Br)C1 299739024 JPWKOLYKDUXVGA-MNOVXSKESA-N 375.694 2.938 0 50 GFAA O=C1CSc2ccc(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)O)cc2N1 299746320 WQLUFNBCRYNJQC-INIZCTEOSA-N 395.440 2.638 0 50 GFAA O=C(NC1CC1)c1noc([C@@H]2CCCN2c2ncnc3c2oc2ccccc23)n1 364705397 LHLOGYBYFXBTCW-ZDUSSCGKSA-N 390.403 2.993 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)c2cc(O)nc3cc(F)ccc23)CC1 426429749 HDAVEKHUZLWWMH-UHFFFAOYSA-N 380.423 2.741 0 50 GFAA CCOc1ccc2c(C)c(C(=O)N3CCN4C(=O)OC[C@@H]4C3)oc2c1OCC 426491376 GDZUVZZPUZASNU-ZDUSSCGKSA-N 388.420 2.815 0 50 GFAA COCCN1CC[C@H](CNS(=O)(=O)c2ccc(Cl)c(C)c2Cl)C1 670452818 YJGGAVRMKSXKBT-GFCCVEGCSA-N 381.325 2.548 0 50 GFAA O=C(Nc1cccc(CN2CCCC2)c1)[C@H](c1cccnc1)N1CCOCC1 827654408 BYBBBDKVXJYLQA-NRFANRHFSA-N 380.492 2.689 0 50 GFAA O=S(=O)(NCc1n[nH]c2c1CCCCC2)c1cc(-c2ccno2)cs1 828392575 VBKRSDXDPKXIEV-UHFFFAOYSA-N 378.479 2.874 0 50 GFAA CC1(C)CC(N2CC(=O)N3Cc4[nH]c5ccccc5c4C[C@H]3C2=O)CC(C)(C)N1 951726990 RZFPRAOYRHUQGF-IBGZPJMESA-N 394.519 2.573 0 50 GFAA CCn1ccnc1CN(Cc1ncc(CN(C)C)s1)[C@H]1CC12CCNCC2 952886867 CUQRTBIRDQEKOE-KRWDZBQOSA-N 388.585 2.565 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)Nc1ccc(CC(=O)NC2CC2)cc1 952981519 XQIITDCDRUIRMP-UHFFFAOYSA-N 389.455 2.770 0 50 GFAA COc1ccc(CN(C)c2nccc(N3CCC[C@H](O)C3)n2)c2cccnc12 1529158528 FVEGKWHUCNFUAE-INIZCTEOSA-N 379.464 2.631 0 50 GFAA C[C@H]1C(=O)N2CCC[C@H]2CN1c1nnnn1Cc1ccc(-c2ccccc2)cc1 1772706869 HORNONPLNDFTLK-JXFKEZNVSA-N 388.475 2.588 0 50 GFAA Cc1ncn(CCNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)c1C 1772813449 AWCJVWBCLHMSGG-MRXNPFEDSA-N 381.505 2.940 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)C[C@H]1CCc3ccccc3C1)CCO2 1857528032 XPGUBDNRHDWETL-DWARNDEPSA-N 390.549 2.671 0 50 GFAA c1ccc(Cn2nc([C@H]3CCOC3)nc2-c2ccc(N3CCOCC3)nc2)cc1 1857667756 UTCAFPMCJCRHGH-IBGZPJMESA-N 391.475 2.729 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3-c3cccc(CN(C)CCO)c3)c2n1 1857671964 ABSSCMWPBHFUNS-UHFFFAOYSA-N 376.464 2.623 0 50 GFAA COc1ccc2cc(-c3nccn3CCN3CCCC[C@@H]3CO)c(O)nc2c1 1857692297 XYVHXPHLPCJIGE-MRXNPFEDSA-N 382.464 2.659 0 50 GFAA CCCC(CCC)C(=O)N1CCC2(CC1)CN(Cc1cnc[nH]1)C[C@@H]2C(=O)O 1857692349 AJOJRSVDSBGTGD-GOSISDBHSA-N 390.528 2.751 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2ccc3ncsc3c2)N1CCc1cccnc1 1857696276 UQLRADSVVHUNPI-ROUUACIJSA-N 392.484 2.749 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cccc4cc[nH]c34)C1)CC2 1857698367 NTALFCPGJQLQLI-JOCHJYFZSA-N 391.475 2.850 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C[C@@H](O)C1CCN(C(=O)C2(C)CC2)CC1 1857717877 CRZGFVKBFFSQKM-GOSISDBHSA-N 398.507 2.568 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4cncs4)C[C@]34CC[C@H]2O4)s1 1857718539 JSUXCPQXNZCDSP-WFXMFSGNSA-N 389.546 2.922 0 50 GFAA O=C(CC1CCCC1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857719630 QIHXIPUVUJJKDJ-GMAHTHKFSA-N 386.536 2.992 0 50 GFAA CN(C)c1cccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1 1857723236 WYJOPMYENONIEB-MZKRTTBSSA-N 391.471 2.667 0 50 GFAA CN1CC[C@H](NC(=O)CN2CC[C@H](c3ccccc3)NC2=O)c2ccccc21 1875267741 BRGPCFKDPKRCBH-MOPGFXCFSA-N 378.476 2.840 0 50 GFAA C[C@H]1CC(CO)(CO)CN1C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)F 1875297055 ASCMVCZTYZPNLJ-GXFFZTMASA-N 396.356 2.786 0 50 GFAA C[C@@H]1CC(CO)(CO)CN1C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)F 1875297056 ASCMVCZTYZPNLJ-MFKMUULPSA-N 396.356 2.786 0 50 GFAA Cc1nn(CC(F)(F)F)cc1C(=O)N1CC[C@@H](CC(=O)O)C(F)(F)CC1 1875300396 BLOJIVUOUHNMDM-JTQLQIEISA-N 383.317 2.716 0 50 GFAA C=CC(=O)NCC(=O)N[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 1875301689 PVKOLZXHGVXZSI-QAPCUYQASA-N 381.879 2.811 0 50 GFAA CNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)c2ccccc12 1875313516 ONXYAGVEESNTTE-LJQANCHMSA-N 382.485 2.784 0 50 GFAA C[C@@H]1CN(C(=O)COCc2ccccc2)CC[C@@H]1NC(=O)Cc1ccccc1F 1875324785 BANUMZSTFGPSMR-UTKZUKDTSA-N 398.478 2.938 0 50 GFAA O=C(NCCc1sccc1Br)c1ncoc1[C@H]1[C@H]2CN[C@H]1C2 1875393055 FBFDBHMAHRDJSP-QRTLGDNMSA-N 382.283 2.546 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@H](C)c3ccc(F)cc3)C2)c1C 1875396832 FFCPYOJOGFDYIJ-CRAIPNDOSA-N 385.487 2.864 0 50 GFAA OCc1ccc(CN[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)cc1 1875398910 ISQIVRWTRGOPGD-KSEOMHKRSA-N 377.488 2.972 0 50 GFAA Cc1nn[nH]c1C(=O)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100482886 FCDBUQXRHLGYLJ-FQEVSTJZSA-N 391.475 2.691 0 50 GFAA O=C1O[C@@H](CN2CC[C@@](O)(c3cccc(Br)c3)C2)CC12CCC2 2325799468 ALINYJUAMDRPGF-QAPCUYQASA-N 380.282 2.828 0 50 GFAA CC[C@@H](C)n1ncc2cc(C(=O)NCc3nnc(O)c4ccccc34)cnc21 2325806357 KJPBITIHXMWWKZ-GFCCVEGCSA-N 376.420 2.981 0 50 GFAA CC[C@@H](O)c1cn(-c2cccc(CNC(=O)c3c[nH]c4ncccc34)c2)nn1 2325869288 HBJSCXPYBYELTK-GOSISDBHSA-N 376.420 2.517 0 50 GFAA O=C1N([C@H]2CC[C@H](O)CC2)CCC[C@@]12CCCN2CCOc1ccc(F)cc1 2356148406 UVSLEJYAAGHOEP-IPJJNNNSSA-N 390.499 2.965 0 50 GFAA COc1ccc(CN2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc1C(=O)O 2356156787 QZGZOCBIQVKKLV-QFIPXVFZSA-N 396.491 2.729 0 50 GFAA COc1ccc(N2C[C@H](C(=O)Nc3ccc4nn(C)nc4c3)CC2=O)cc1Cl 2356166993 QQEBBKBIBYPCDC-LLVKDONJSA-N 399.838 2.622 0 50 GFAA CCc1ccc(C2C(C(=O)OC)=CN(C[C@@H]3CCCO3)C=C2C(=O)OC)cc1 1184471 NPSFKKFXNVWBLX-KRWDZBQOSA-N 385.460 2.941 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2cc(Cl)c(OC)c(OC)c2)C1=O 2356135382 BPWSWFHWXOQYSU-FQEVSTJZSA-N 396.915 2.961 0 50 GFAA CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O 2564502 XINBRUNUJFZFGH-RBUKOAKNSA-N 398.459 2.750 0 50 GFAA COc1cc(-c2onc(N3C[C@@H]4C[C@@H]5COC[C@@H]5[C@@H]4C3)c2C(=O)O)ccc1F 2356145587 DTWDENRPDUOZHV-DGAVXFQQSA-N 388.395 2.906 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)o1 2356162966 NHCZPDPPLYTGQJ-QFIPXVFZSA-N 380.444 2.746 0 50 GFAA Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(OCC(N)=O)cc1)CC(=O)N2 9165199 OIKOLZZTMJYSMV-KRWDZBQOSA-N 376.416 2.519 0 50 GFAA COc1ccc(-c2nc3ncc4c(=O)n(Cc5cccnc5)ccc4n3n2)cc1 20102148 ICMQAOURUYRDPC-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1 20481979 SWSMQKYOSSSMNS-UHFFFAOYSA-N 381.476 2.620 0 50 GFAA CC[C@@H](Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1ccc(C)o1 100033051 RXIUEIPPLAFSDF-CYBMUJFWSA-N 397.431 2.898 0 50 GFAA investigational CC1=C(C(=O)N(C)Cc2cnccn2)[C@@H](c2c(F)cccc2Cl)NC(=O)N1 67642395 VECOAGHMJNRNCM-INIZCTEOSA-N 389.818 2.556 0 50 GFAA O=C(N[C@@H]1CCCN(C2Cc3ccccc3C2)C1)c1cccc(-n2cnnc2)c1 12436303 ZRKUSSKSKPZHQT-HXUWFJFHSA-N 387.487 2.629 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)CCNC(=O)[C@@H]3C[C@H]3C)cc2)C1 229757592 YOKOGEWFEQKVJU-BMQTXXJKSA-N 385.552 2.943 0 50 GFAA O=C1N[C@H](C(=O)NCc2cccnc2Oc2cccc(C(F)(F)F)c2)CO1 67967245 JZGCJBNCKKDDTK-ZDUSSCGKSA-N 381.310 2.617 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCN4C(=O)N=C(O)[C@@H]4C3)sc2C)cc1 328936792 JPPJXBAKDPVQIJ-HNNXBMFYSA-N 385.445 2.949 0 50 GFAA O=C1N(Cc2ccccc2F)CCC[C@@]1(O)CNCc1c(F)cccc1F 12836260 BBWFBRHMXUUCNV-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3cccs3)[C@H](CCO)C2)c1 39467394 YESGYCDXEGRRIY-QGZVFWFLSA-N 376.522 2.834 0 50 GFAA CCCN(C(=O)c1nnn(C2CCNCC2)c1C)[C@H]1C[C@H](OCC)C1(C)C 236754646 QXFYXUPEBFPCLM-IRXDYDNUSA-N 377.533 2.567 0 50 GFAA CN1CC[C@H](CNC(=O)NC[C@@H]2CCC[C@@H]2O)[C@@H]1c1ccc(Cl)c(F)c1 153544732 XDWVCJMKMKGYIB-DACLVMHWSA-N 383.895 2.932 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@H]2CCO)c(F)c1 39500677 YHLRAWAGUFXWGY-MRXNPFEDSA-N 379.501 2.668 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2CCCC[C@@H]2C)c1C(=O)OC(C)C 17077996 KIUYQOZYNHWHAJ-NSHDSACASA-N 381.498 2.534 0 50 GFAA O=C(N[C@H]1C[C@@H]1C1CCCCC1)N1CCC(S(=O)(=O)N2CCCC2)CC1 369108005 YPGPDAYTFYOIGU-MSOLQXFVSA-N 383.558 2.555 0 50 GFAA C[C@]1(CNC(=O)CCn2c(S)nnc2-c2cccs2)CCCC[C@@H]1O 129923755 LLEIHDPQRYREGH-SUMWQHHRSA-N 380.539 2.743 0 50 GFAA COC(=O)[C@@H]1CCCN1C(=O)c1cc(COc2cccc3cccnc23)on1 14966305 YFPHMYJHLLGOAG-INIZCTEOSA-N 381.388 2.579 0 50 GFAA Cc1ccc(C)c(OCc2cc(C(=O)N3CCC(N4CCOCC4)CC3)no2)c1 19228174 WHQWTEXZGMEWTQ-UHFFFAOYSA-N 399.491 2.807 0 50 GFAA Cc1cnc(C)c(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95374494 IRRRUZBAAQESIQ-IOMROCGXSA-N 378.476 2.889 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)[C@H](F)c1ccccc1)CC2 91643866 KRTKMRRJTSBLLD-LJQANCHMSA-N 376.472 2.965 0 50 GFAA COc1ccc(Cl)cc1NC(=O)N1CCC[C@@H](CN2CCN(C)CC2)C1 96136428 XFLXRWOLBOWKBG-HNNXBMFYSA-N 380.920 2.840 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3cccc(F)c3)C2)CN1CCc1c[nH]cn1 91486856 CCJPBKGRJTXEBB-NRFANRHFSA-N 384.455 2.636 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@H]2CC[C@@H]1CN(Cc1[nH]cnc1C)C2 91858299 AFROMZAGHXRHBY-LSDHHAIUSA-N 376.936 2.764 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cnc(-c3ccco3)nc2)C1)c1cccnc1 95501868 IPGCNWHWOMYAIQ-MRXNPFEDSA-N 377.448 2.774 0 50 GFAA COc1ccc(Cl)c2c1N(C(=O)c1cn(CC3(C)COC3)nn1)CCC2 184665827 SLQNPQRDMNPRNT-UHFFFAOYSA-N 376.844 2.570 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC3(CCc4c(O)nc(C(C)(C)C)nc43)CC2)[nH]1 1940197222 AIMNPDPPDTYVAU-UHFFFAOYSA-N 396.491 2.597 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)c2ccc(CN3CCCC3)o2)n1 825264420 GROMYXPIGQXVST-UHFFFAOYSA-N 382.386 2.965 0 50 GFAA C[C@H](c1noc(-c2cc(Br)cc3nc(O)[nH]c23)n1)n1ccnc1 1875270674 MXBFOVJCGZOURD-SSDOTTSWSA-N 375.186 2.887 0 50 GFAA CC(C)Cn1ccc2cc(NC(=O)C(=O)NC[C@@]3(CO)C[C@H]4C=C[C@H]3C4)ccc21 1875316669 FZBFHLYIWIPQHC-TXBYWVTISA-N 395.503 2.927 0 50 GFAA Cn1ccnc1[C@H]1CCCN(C(=O)Nc2cccc([C@@]3(C)COC(=O)N3)c2)C1 881105825 KAWMKAOTLUFNLR-VBKZILBWSA-N 383.452 2.787 0 50 GFAA O=C(COc1ccc(F)cc1)NCC1CCN(c2ncc(Cl)cn2)CC1 952984443 UCGPVVRAFNHYLX-UHFFFAOYSA-N 378.835 2.681 0 50 GFAA O=C(c1cnoc1-c1ccccc1)N1C[C@@H]2CC[C@H]1CN(c1ncccn1)C2 1565514575 DLSOWHKZGFGNDI-WBVHZDCISA-N 375.432 2.873 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CCC2(CC1)OCCc1ccsc12 1319916880 FSFBRGARXQYOJQ-UHFFFAOYSA-N 384.457 2.747 0 50 GFAA O=C(NCc1cccc(N2CCCS2(=O)=O)c1)N(C1CCCC1)C1CC1 185632219 VBGUITVMDMYBCQ-UHFFFAOYSA-N 377.510 2.843 0 50 GFAA O=C(CSCc1ccccn1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 275712309 SJIUJTMWGOXMBW-SFHVURJKSA-N 398.532 2.990 0 50 GFAA Cc1cc(Br)ccc1S(=O)(=O)N1CCC(=O)Nc2cccnc21 170600118 FDAVTZOGUYVNNW-UHFFFAOYSA-N 396.266 2.690 0 50 GFAA C[C@H](NC(=O)NC(C)(C)C)[C@H]1CCCN(c2ncc(Br)cn2)C1 170634100 OKQNLQSJAURHRV-RYUDHWBXSA-N 384.322 2.942 0 50 GFAA Cc1nn(C)c(C)c1C(=O)Nc1ncnc2c1c(C)c(C)n2C[C@@H]1CCCO1 189898739 ZRRFITZYPKZZOH-HNNXBMFYSA-N 382.468 2.830 0 50 GFAA Cn1nc(CCNS(=O)(=O)c2cccc3c2OC(C)(C)C3)c2ccccc21 192650069 OCWJVDSBSDOZQY-UHFFFAOYSA-N 385.489 2.808 0 50 GFAA Cc1ccc(CC(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)cc1F 1704311648 DXXPOEZLGVDXSW-DENIHFKCSA-N 385.435 2.584 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCC2(CCN(Cc3ccc4nsnc4c3)CC2)O1 11964476 CTLOVLIYYFDYHC-INIZCTEOSA-N 388.537 2.977 0 50 GFAA CN1CCC[C@@]2(CCCN(C(=O)c3cn(Cc4ccc(Cl)cc4)nn3)C2)C1 12429868 FGNXCMXCVOPSKI-HXUWFJFHSA-N 387.915 2.928 0 50 GFAA COCCCNc1nc2nonc2nc1N(C)[C@H](C)c1nc(C)sc1C 12439737 ZDFOTIVFZLDVRD-SECBINFHSA-N 377.474 2.732 0 50 GFAA COc1cccc(-c2cc(=O)[nH]c(N3CCN(Cc4ccccc4)CC3)n2)c1 13550563 DMRXUCVRCSMMLX-UHFFFAOYSA-N 376.460 2.768 0 50 GFAA COCCCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)CN(CC(C)C)C1 14539571 WLZAOMBBSLLKLO-ZWKOTPCHSA-N 380.504 2.951 0 50 GFAA CCOC(=O)Oc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)OCC)cc1OC 18094122 ZZLOGCRMHKLKPO-OAHLLOKOSA-N 394.449 2.586 0 50 GFAA O=C1C=C(N2CCN(Cc3ccccc3)CC2)C(=O)N1c1ccc(Cl)cc1 19335924 VFDDXZADSBOYKX-UHFFFAOYSA-N 381.863 2.915 0 50 GFAA CN(C)C(=O)c1ccc(N2CCc3c(-c4ccccc4)nn(C)c3CC2)nc1 1857667381 PWFWOECMPZBVRW-UHFFFAOYSA-N 375.476 2.789 0 50 GFAA O=S(=O)(N[C@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1cc(Cl)ccc1Cl 1857713237 MKYIHIWGRZCHRW-KCQAQPDRSA-N 391.320 2.523 0 50 GFAA CC(C)[C@H](CNC(=O)NCc1ccc(S(N)(=O)=O)s1)Cc1ccccc1 252572630 ZOSNGAJPPLJEHT-HNNXBMFYSA-N 395.550 2.710 0 50 GFAA C[C@H]1CN(c2ncc(Cn3cc(Br)cn3)s2)C[C@]2(CCOC2)O1 366487943 DQUJSGKGFCEMDF-NHYWBVRUSA-N 399.314 2.535 0 50 GFAA Cn1cc(N2C[C@H](C(=O)N3CCC(c4cc5ccccc5[nH]4)CC3)CC2=O)cn1 858852787 KQAGBASWMZENPO-QGZVFWFLSA-N 391.475 2.661 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N3CCN(Cc4ccccc4)CC3)C2=O)cc1 96569061 BFGBMJMTVMCUTJ-OAQYLSRUSA-N 393.487 2.535 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2cn(C)nc2C)CC[C@H]1NC1CCCC1 2100478190 YHZXIPPRJOOGGF-PWIZWCRZSA-N 376.545 2.841 0 50 GFAA COCCn1c(N)c(S(=O)(=O)c2ccc(C)cc2)c2nc3ccccc3nc21 2422123 DKSPUBUXDBLFJK-UHFFFAOYSA-N 396.472 2.954 0 50 GFAA CN1C[C@@H]2CN(C(=O)NCCc3cccc(-c4ccccc4)c3)CCN2C1=O 2325744655 CCURBJUTWKGEHH-HXUWFJFHSA-N 378.476 2.657 0 50 GFAA FC(F)(F)Cn1ccc(Cc2noc([C@@H]3CC(C4CCOCC4)=NO3)n2)n1 2325789968 ZFLSTSZZUPKQKT-ZDUSSCGKSA-N 385.346 2.663 0 50 GFAA O=C(c1cc(Br)ccc1Br)N1CCN[C@H](CF)C1 2325792162 HIGJBXIOAXBWHX-SECBINFHSA-N 380.055 2.595 0 50 GFAA O=C(NCC1(NC(=O)[C@@H]2C[C@H]2F)CC1)c1cccc(Cl)c1Br 2325829799 SMQHCWMXZLYUMA-MWLCHTKSSA-N 389.652 2.839 0 50 GFAA COc1ccc(C(N)=O)cc1C(=O)NCCc1nc(-c2ccccc2)oc1C 2325864483 PYIRTDZZXZIOCC-UHFFFAOYSA-N 379.416 2.730 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)c(OC)c1 1203378 XWPPCXGVIGBIRR-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA O=C(C1CCN(Cc2cccc3ncnn23)CC1)N1CCc2ccccc2C1 2356154093 HVOUUVNVHDLNCB-UHFFFAOYSA-N 375.476 2.526 0 50 GFAA O=C(CCn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O)N1CCOCC1 2841084 ATLUOLYVTWADSY-UHFFFAOYSA-N 397.862 2.966 0 50 GFAA COc1ccc(NC(=O)N[C@@H]2c3ccccc3O[C@@H]2C)cc1S(C)(=O)=O 417350843 QRZFJDDGYAXNTO-DIFFPNOSSA-N 376.434 2.742 0 50 GFAA CC(=O)Nc1ccc(N2C[C@H](C(=O)N3CCc4ccccc4C3)CC2=O)cc1 9197444 XCTBQKDCDVLDBF-GOSISDBHSA-N 377.444 2.583 0 50 GFAA COc1ccc(CCN(C)CCC(=O)Nc2ccc3c(c2)OCO3)cc1OC 22239151 VTZSEPKXKBNIII-UHFFFAOYSA-N 386.448 2.936 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1cccc(F)c1)CC2)C1CCCCC1 20910868 ASNCQOKERFBGAR-UHFFFAOYSA-N 399.514 2.715 0 50 GFAA CCn1c([C@H]2CCCN(C(=O)c3sc(C(C)C)nc3C)C2)nn(C)c1=O 67841467 OIIIOIPMSANJLH-ZDUSSCGKSA-N 377.514 2.510 0 50 GFAA COCCN(C)Cc1cnc(S(=O)(=O)CC2CC2)n1CC1CCCCC1 20541585 VAUUAJSHCWZMKG-UHFFFAOYSA-N 383.558 2.725 0 50 GFAA CCN(C(=O)CNC(=O)c1ccc(OC)c(OC)c1)c1ccc2[nH]ccc2c1 252484036 FMNNLVPGRHMESC-UHFFFAOYSA-N 381.432 2.968 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCc3ccccc3F)C2=O)c1 67643561 PGHVFWKJTMQCBU-NRFANRHFSA-N 390.430 2.617 0 50 GFAA CC[C@H]1C[C@@H](C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)CCO1 328616397 BPBDHUYLOZFACW-QGZVKYPTSA-N 376.545 2.857 0 50 GFAA CC(=O)N1CCc2c(nc(-c3cccnc3)nc2N[C@H](CO)c2ccccc2)C1 71760667 PVEHFNULKKOHQR-HXUWFJFHSA-N 389.459 2.589 0 50 GFAA COc1ccc(CN2C(=O)COc3nc(I)ccc32)cc1 38534146 LBZVLEPWTWGEBF-UHFFFAOYSA-N 396.184 2.620 0 50 GFAA COc1ccccc1[C@H]1CN(c2cccc(C(=O)O)n2)[C@@H]2C3CCN(CC3)[C@H]12 72163396 JKEZQOVZVSKYII-MAODMQOUSA-N 379.460 2.855 0 50 GFAA O=C(Nc1ccn(Cc2ccncc2)n1)C1CCN(C(=O)c2ccccc2)CC1 172921468 USBDYLBDZZQHIJ-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA CN1CCN(c2ccc(NC(=O)c3ccc(N4CCOCC4)cc3)cc2)CC1 72434260 DYPJOEONKKKVHD-UHFFFAOYSA-N 380.492 2.527 0 50 GFAA Cn1cc(N2CCC[C@H](NC(=O)Nc3ccnn3Cc3ccc(F)cc3)C2)cn1 158034135 SZVQBYKLHISKFN-KRWDZBQOSA-N 397.458 2.595 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)CCO1 262419346 PYYGEWYVHLBGFR-AWEZNQCLSA-N 399.230 2.893 0 50 GFAA CC(C)(C)OC(=O)N1CCC(OC[C@H](O)CN2CCc3ccccc3C2)CC1 219738639 UUOQXUZXSPUQJL-LJQANCHMSA-N 390.524 2.822 0 50 GFAA COc1ccc(CN(C)C(=O)c2ccc(-c3nnn(C)n3)cc2)c2cccnc12 215198119 HOVXGUWRSRBNKU-UHFFFAOYSA-N 388.431 2.706 0 50 GFAA CN(C)CCCn1ccc2c(nnc3c(-c4ccc(Cl)cc4)cnn32)c1=O 40392350 IDRDNDPMDWIFLL-UHFFFAOYSA-N 382.855 2.711 0 50 GFAA CCCOc1ccc(C(=O)N2CCN(C[C@H]3CCOC3)CC2)cc1OCC 178094658 KNLPYRRKMVPZDZ-QGZVFWFLSA-N 376.497 2.668 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccccc3)CC2)cc(-n2cnc(C)c2C)n1 82230722 NEAQAWNJUURHDG-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA Cn1ccnc1[C@H](O)c1cc2n(n1)CCN(Cc1ccc(F)cc1Cl)C2 221357231 WKIMOSRVUNAAEY-QGZVFWFLSA-N 375.835 2.507 0 50 GFAA COc1cccc([C@H](O)C(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)c1 161642195 GCRHFHSUWOQXQD-NRFANRHFSA-N 394.471 2.557 0 50 GFAA COCC1(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)CCC1 82099076 UQTSSBKLFNNRGO-NRFANRHFSA-N 385.508 2.630 0 50 GFAA O=C(NC1CCN(c2cnccn2)CC1)c1csc(Cc2ccccc2)n1 82096889 SMDUOACBCXTURS-UHFFFAOYSA-N 379.489 2.923 0 50 GFAA CN1CCc2n[nH]c(C(=O)N3CCC[C@@](C)(Cc4ccc5c(c4)OCO5)C3)c2C1 95508050 ZADBGFIQFFRTEL-QFIPXVFZSA-N 396.491 2.611 0 50 GFAA CC(C)[C@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H]1O[C@H](n2cc(F)c(N)nc2=O)CS1 143416558 AUTCQXVTOIJYOT-WRHHYAMVSA-N 399.488 2.557 0 50 GFAA CCC[C@@H](NC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)c1nnn[nH]1 180136513 FPHXCMATWGWEAC-LLVKDONJSA-N 380.239 2.963 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC(c3nncn3C(C)C)CC2)cc1 182340675 DRPUEQYGQLGMEU-UHFFFAOYSA-N 378.498 2.826 0 50 GFAA COc1cnc(C(=O)N[C@@H](c2cnc3ccccc3c2)[C@H]2C[C@@H](O)C2)cc1O 253535681 LSNBGUDOYGDPLC-IAMHBRQHSA-N 379.416 2.586 0 50 GFAA Cn1nc(C(F)(F)F)c(NC(=O)c2ccnc(O[C@@H]3CCOC3)c2)c1Cl 953099087 RGWYQUAIAWLLOI-SECBINFHSA-N 390.749 2.907 0 50 GFAA C[C@H]1C[C@H](c2ccccc2)N(C(=O)Cn2cc(-c3cncc(C(=O)O)c3)nn2)C1 1875355201 CVSNJJKGJMYVEI-IFXJQAMLSA-N 391.431 2.648 0 50 GFAA NS(=O)(=O)CCNC(=O)NCc1ccc(-c2ccc3ccccc3c2)cc1 1875333367 PYXKXLQJDRNSPS-UHFFFAOYSA-N 383.473 2.595 0 50 GFAA O=C(Cc1noc2ccccc12)N1C[C@@H]2CN(C3CCCCC3)C[C@]2(C(=O)O)C1 1565505918 APXJYKQGKYVPLQ-NYHFZMIOSA-N 397.475 2.548 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@H](C)CN4CCN(C)CC4)CC3)oc12 188586972 PGVGNTAKKFKTAC-QGZVFWFLSA-N 399.539 2.661 0 50 GFAA CN(C)C(=O)Cc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2)cc1 193336541 CUXOPTFCPWKMAS-LJQANCHMSA-N 379.460 2.561 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C3CCN(c4ccc(F)c(F)c4)CC3)C[C@@H]12 1529133085 APTJDGJXHJUDGY-CTNGQTDRSA-N 393.478 2.805 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2cnn(-c3ccc(Cl)cc3)c2)C[C@H]1O 1704324668 CURHOOLYWIGTDI-MJGOQNOKSA-N 377.872 2.963 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)CSc3ccccc3)CC[C@@H]21 222143085 FJXNDHVUXPRPOL-AEFFLSMTSA-N 376.522 2.655 0 50 GFAA Cn1c(CCNC(=O)/C=C/c2cccc(F)c2)nnc1SC[C@H]1CCCO1 12245905 OUMSIFIHABJTPJ-KXPUMZMLSA-N 390.484 2.597 0 50 GFAA COc1ccccc1-c1cn2c(C(=O)N[C@H](CO)CCSC)csc2n1 12433353 DRVVWMIEMDBJHD-LBPRGKRZSA-N 391.518 2.915 0 50 GFAA COc1ccc(N2C(=O)CN(C(=O)Cn3cnc4ccccc43)CC2(C)C)cc1 12508985 OZHKCSGNFJOHDI-UHFFFAOYSA-N 392.459 2.699 0 50 GFAA COc1ccc(CNC(=O)c2ccc3c(c2)N(C)[C@H]2CCCN2C3=O)c(OC)c1 169765958 KBOJRKZDYWFHCK-HXUWFJFHSA-N 395.459 2.646 0 50 GFAA COc1ccc(CNC(=O)c2cc3c(N4CCCC4)nc(C)cn3n2)c(OC)c1 169768710 KMPFVIFPOZAQQE-UHFFFAOYSA-N 395.463 2.585 0 50 GFAA CC[C@@](C)(CO)C(=O)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1857527918 GMTPDHBGHWLALT-DIQZNMANSA-N 394.537 2.586 0 50 GFAA CCOc1ccc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3cnc(C)nc3)C2)cc1 1857684016 VXDJRKJFWDBGPI-QZTJIDSGSA-N 382.464 2.655 0 50 GFAA CC(C)(C)CCC(=O)N1C[C@@H]2[C@H](CNC(=O)c3cccnc3)[C@H]3CC[C@]2(C1)O3 1857735316 CKLZXMKYWCTOAD-KCXPTXFHSA-N 385.508 2.644 0 50 GFAA Cc1cc(CC(=O)N2CCC[C@]3(CCc4c(N5CCCC5)nc(C)nc43)C2)on1 1875251293 WIFDZXRLAZFAJC-QFIPXVFZSA-N 395.507 2.731 0 50 GFAA CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)c2ccc3c(c2)C(C)(C)CO3)c1 810331179 GKATYNPGIDCLQB-CYBMUJFWSA-N 388.489 2.756 0 50 GFAA CCOc1ccc(Br)cc1S(=O)(=O)n1nnc2ccccc21 644466 CJGJGTOWXRDBLI-UHFFFAOYSA-N 382.239 2.830 0 50 GFAA Cc1nc(-c2ccccc2)c(NC(=O)C2CCN(C(=O)[C@@H]3CCCO3)CC2)n1C 2100545171 IMANYPICSOGLEC-SFHVURJKSA-N 396.491 2.752 0 50 GFAA CSCCN1C(=O)N[C@@H](c2cnoc2C(C)(C)C)C(C(=O)N(C)C)=C1C 2325778421 YSMPRXQLMGZXBM-AWEZNQCLSA-N 380.514 2.764 0 50 GFAA CN1CCc2ccc(NC(=O)C(=O)Nc3cc(Cc4ccccc4)[nH]n3)cc2C1 2325859136 PJCFVLLOWBDWHY-UHFFFAOYSA-N 389.459 2.566 0 50 GFAA CCN1CCN(c2cc(CN=c3[nH]ccn4nc(C5CCC5)cc34)ccn2)CC1 2325870818 QTFBGGFAVJOUIG-UHFFFAOYSA-N 391.523 2.568 0 50 GFAA O=C(CNS(=O)(=O)c1ccccc1)Nc1ccc(Br)cc1F 663816 JKPRFOWZPSLSHK-UHFFFAOYSA-N 387.230 2.505 0 50 GFAA COc1ccc(C(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(OC)c1 789866 QXGLLFQAFMICPX-UHFFFAOYSA-N 390.461 2.741 0 50 GFAA Cc1c(NS(=O)(=O)c2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C 822930 DLXVSVNBDFPTBO-UHFFFAOYSA-N 377.853 2.939 0 50 GFAA COCCCNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2)c1 2864292 BTAYICGHHCXPOG-UHFFFAOYSA-N 382.869 2.907 0 50 GFAA Cc1cc(=O)oc2ccc(OC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc12 2865705 SVLWRRMCTHOWAX-UHFFFAOYSA-N 387.413 2.571 0 50 GFAA CCOC(=O)c1cc(NS(=O)(=O)c2ccccc2)cc(C(=O)OCC)c1 7050644 DOVBQWPZXYTIRS-UHFFFAOYSA-N 377.418 2.841 0 50 GFAA O=C(NCc1ccncc1)C1CCC(Cn2cnc3ccccc3c2=O)CC1 9061115 FHMCHJDKTWAQOW-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA COc1ccccc1C[C@@H](C)N1CCC(n2cc(C(=O)NCC(C)C)nn2)CC1 11840327 DDWODBWLGCCKTN-QGZVFWFLSA-N 399.539 2.941 0 50 GFAA COc1ccccc1CNc1ncnc2sc(C(=O)N[C@H](C)CO)c(C)c12 12122643 FHLWRGJGQZTQCS-LLVKDONJSA-N 386.477 2.731 0 50 GFAA CN(C)c1ncc(CN2CCC(CCC(=O)NCc3cccnc3)CC2)s1 12435854 POCXMIXMCHDNER-UHFFFAOYSA-N 387.553 2.913 0 50 GFAA COc1ccc2cc(C(=O)[C@@H]3CCCN(C(=O)CN4CCOC4=O)C3)ccc2c1 12458528 UMZLKQDNYXKLHM-GOSISDBHSA-N 396.443 2.722 0 50 GFAA O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc2oc(CCCc3ccccc3)nc2c1 12590029 DMFWUIPJGUQOFH-QGZVFWFLSA-N 398.484 2.920 0 50 GFAA CCN(CCn1cccn1)C(=O)CCc1nnc(CCc2ccccc2OC)o1 12590897 FOOJTGGYLRVDMF-UHFFFAOYSA-N 397.479 2.541 0 50 GFAA OC1CCN([C@@H]2CCN(Cc3cccc4c3oc3ccccc34)C[C@H]2O)CC1 12597007 QRZPLYGJIJECIF-NHCUHLMSSA-N 380.488 2.978 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)NCc1cccnc1N1CCC[C@H](O)C1 12754592 JADUOIRFPUSENS-SFHVURJKSA-N 378.476 2.773 0 50 GFAA COc1ccc(CCNC(=O)c2cc3cccc(OC)c3oc2=N)cc1OC 17078067 NCVIDUAKDWVSPS-UHFFFAOYSA-N 382.416 2.911 0 50 GFAA COc1ccc(CNc2nc3nc(-c4ccccc4)cc(=O)n3[nH]2)cc1OC 18178261 SHCIDPYJQUEIER-UHFFFAOYSA-N 377.404 2.714 0 50 GFAA COc1ccc(NC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c(OC)c1 20247493 AZBGRNSGNAYAMM-UHFFFAOYSA-N 399.447 2.782 0 50 GFAA Cc1nc(-c2cccc(CN3CC[C@H](O)C3)c2)[nH]c(=O)c1Cc1ccccc1 23619277 XSRQURFLGNGIGI-FQEVSTJZSA-N 375.472 2.903 0 50 GFAA Cc1ccc([C@@H](NC(=O)C2CCN(S(=O)(=O)N(C)C)CC2)C(C)C)c(C)c1 72437627 VLEHGCKFCCXIRX-IBGZPJMESA-N 395.569 2.635 0 50 GFAA Cc1nc(NCCNC(=O)c2sc(C)nc2C)cc(-n2cnc(C)c2C)n1 72437860 BQZSBSXEVCNCOG-UHFFFAOYSA-N 385.497 2.503 0 50 GFAA OCCOc1cccc(CN2CCN(CC3CCCCC3)[C@@H](CCO)C2)c1 107100691 BBNZZRSPGCNOGL-NRFANRHFSA-N 376.541 2.507 0 50 GFAA CCC[C@@H]1CN(Cc2nc3ccc(Cl)cc3c(=O)[nH]2)CCN1CCOC 121767942 QJUWNKKPRMRBNM-OAHLLOKOSA-N 378.904 2.509 0 50 GFAA O=C(Nc1cccnc1OCC(F)F)N1CCN(c2ccccc2O)CC1 123618881 DOZWDXWWWAZJTI-UHFFFAOYSA-N 378.379 2.785 0 50 GFAA O=C(NCc1ccc(CN2CCCC2=O)cc1)Nc1cnn(C[C@H]2CCCO2)c1 127843135 WRDMMLKLTVRYPB-LJQANCHMSA-N 397.479 2.506 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O 130976754 BPBYQTBJUCKEMZ-GFCCVEGCSA-N 379.482 2.734 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@@H](CO)OC[C@H]1C 154165721 LXIUWVDQQKTXQO-ABAIWWIYSA-N 396.896 2.906 0 50 GFAA O=S(=O)(CC1CCCCC1)N1CCN(c2ncnc3ccsc23)CC1 173298188 BOAXVSZIALZFRR-UHFFFAOYSA-N 380.539 2.723 0 50 GFAA Cc1cc2nc(C)c(CCC(=O)N[C@@H](C[S@](C)=O)c3ccccc3)c(C)n2n1 174317184 WWCHRWAGILMWDA-VKGTZQKMSA-N 398.532 2.823 0 50 GFAA CO[C@@H](CNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C(C)(C)C 174645376 MZLHLIFZSHPYSG-SFHVURJKSA-N 375.513 2.960 0 50 GFAA COCc1cc(CNC(=O)N2CCN(c3cc(C4CC4)n[nH]3)CC2)ccc1F 186610971 AQLAOQNWXIOQGI-UHFFFAOYSA-N 387.459 2.604 0 50 GFAA CCCCn1nc(C)c(/C=C/C(=O)N(CC(=O)O)C2CCOCC2)c1Cl 236731515 BDJKDVONEFQGCY-AATRIKPKSA-N 383.876 2.750 0 50 GFAA O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@H]1CCOc2ccccc21 237938627 QSPPYEOQIHMNSL-WMZOPIPTSA-N 382.391 2.985 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)CCCCc2ccc(Br)cc2)CCO1 238046849 PLDSMIJSQJOJCW-HNNXBMFYSA-N 384.270 2.864 0 50 GFAA CN(Cc1nccs1)[C@@H]1CC12CCN(C(=O)c1ccc3nc[nH]c3n1)CC2 275653656 KTDPLBOZKJAOGE-OAHLLOKOSA-N 382.493 2.541 0 50 GFAA CC(C)[C@H](Cc1ccccc1)C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1 276532808 RBHMAZWUMZYAFU-OALUTQOASA-N 381.524 2.606 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)c3ccc(-c4ccc5c(c4)OCCO5)s3)C2)CN1 278985109 QHABYBUQQZRAAY-FQEVSTJZSA-N 384.457 2.539 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(OC[C@@H]3CCCO3)c2)c1 298465579 XXTOOKIYYBRVEM-IBGZPJMESA-N 379.420 2.781 0 50 GFAA CCc1noc(CCNC(=O)Nc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2)n1 299793238 HTKHVQAMXVSOOP-CQSZACIVSA-N 385.468 2.868 0 50 GFAA CC(=O)N1CCCC[C@H]1C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 329115690 SXJARLTVHHTXFF-ZJOUEHCJSA-N 397.519 2.682 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N2C[C@H](C3CC3)[C@@H]2C2CC2)s1 333969018 UGNAMSDTFMFGSK-NUJGCVRESA-N 394.562 2.857 0 50 GFAA CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1cccnc1OCC(F)(F)F 363634494 MIIHXZQISRIYEH-INIZCTEOSA-N 393.365 2.617 0 50 GFAA Nc1cc(C(=O)N2CCOC[C@H]2c2nnc(-c3ccccc3)o2)cc(Cl)n1 375935894 UAMHHGDVXOYTMU-ZDUSSCGKSA-N 385.811 2.581 0 50 GFAA CN(Cc1nc2ccccc2n1C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 426374420 SOFGJKMHMGNSSU-SFHVURJKSA-N 377.492 2.989 0 50 GFAA Cc1ncsc1CCCNC(=O)N(C)C[C@@H]1CC(=O)N(C2CCCC2)C1 426573163 NUHHXSNBAIIWJA-HNNXBMFYSA-N 378.542 2.817 0 50 GFAA CC(C)c1noc([C@@H](C)NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)n1 670457262 RDTUEIRRTOAVEU-MRVPVSSYSA-N 392.765 2.904 0 50 GFAA O=S(=O)(N[C@@H]1CCCN(Cc2cccs2)C1)c1ccc2oc(O)nc2c1 828414753 FRBDKQKTBFIQJG-GFCCVEGCSA-N 393.490 2.538 0 50 GFAA Cc1nc(C[C@H]2CCCN(C(=O)[C@H](N)c3ccccc3C(F)(F)F)C2)no1 884125948 MUDANGYMNYNILQ-MLGOLLRUSA-N 382.386 2.878 0 50 GFAA O=C(CCCc1ccc2nc(O)[nH]c2c1)N1CCOc2ccccc2[C@@H]1CO 887109937 WZDJRPLTKJZEGG-SFHVURJKSA-N 381.432 2.546 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1nc(-c2ncccc2Cl)ns1)C(C)C 888097056 XCECHOUGTZJPFX-SNVBAGLBSA-N 376.891 2.666 0 50 GFAA Cc1nn(Cc2ccc(F)cc2)c(Cl)c1CN[C@@H](Cc1cnc[nH]1)C(=O)O 1332018219 WIJAKLZBKCOHBS-INIZCTEOSA-N 391.834 2.541 0 50 GFAA Cc1cc(N2CCC3(CC2)C[C@](C)(O)[C@@H](O)CO3)nc2cc3c(cc12)CCC3 1772706351 QCLQNNLOSQVKEF-UNMCSNQZSA-N 382.504 2.903 0 50 GFAA Cc1cc2n(n1)CCN(C(=O)[C@@H]1CCc3sc(-c4ccncc4)nc3C1)C2 1772816727 TXXHOVSDKAGWSV-OAHLLOKOSA-N 379.489 2.857 0 50 GFAA O=C(NC1(C2CCN(C(=O)C3(C4CCCCC4)CC3)CC2)CC1)c1cnn[nH]1 1775990223 FAESCGKVCUZVPW-UHFFFAOYSA-N 385.512 2.666 0 50 GFAA CN(C)Cc1ccc([C@H]2CCCN2C(=O)c2cc(N3CCOCC3)no2)cc1 1857706883 ADSMJKJZLFYZDV-GOSISDBHSA-N 384.480 2.550 0 50 GFAA CCOCCN1[C@H]2CC[C@@H]1[C@@H]1CN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]12 1857712195 SSWAGKPAIPQZOM-LVYXFOGZSA-N 388.899 2.559 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)N1CCNC(=O)[C@H]1c1cccc(F)c1 1857728811 NCGBROBDEXURAR-LJQANCHMSA-N 378.407 2.838 0 50 GFAA CCCc1cnc(N2C[C@@H]3[C@H](CNC(=O)c4occc4C)[C@H]4CC[C@]3(C2)O4)nc1 1857735248 OAWNMMVGJXZDFY-KCXPTXFHSA-N 396.491 2.744 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cccc(-n4cnnc4)c3)CC2)O1 1875251305 WZSSXSGYABHZEG-RTBURBONSA-N 398.507 2.828 0 50 GFAA O=C(N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1)[C@]1(F)CNCC12CCC2 1875292794 SVIHXEZFPTZIAQ-CXAGYDPISA-N 397.376 2.511 0 50 GFAA Cn1ccc(C(=O)Nc2ccc([C@@H]3CN(C(=O)c4ccn(C)c4)CCO3)cc2)c1 1875297142 DPRRNGAMKNVDLY-FQEVSTJZSA-N 392.459 2.830 0 50 GFAA C[C@@H]1CN(C(=O)N[C@H](C)c2ncc(-c3ccc(F)cc3)o2)CCS(=O)(=O)C1 1875301137 BGYVCNGPSVCJFA-CHWSQXEVSA-N 395.456 2.618 0 50 GFAA COc1cncc(NC(=O)c2cn3c4c(c(F)c(F)cc4c2=O)OC[C@@H]3C)c1 1875327089 ZBIZYTZXIPATDN-VIFPVBQESA-N 387.342 2.889 0 50 GFAA CCc1ccccc1-n1nc(CCn2ccnc2)nc1-c1cnn2ncccc12 1875341512 WEDGVRDZBYBOCY-UHFFFAOYSA-N 384.447 2.979 0 50 GFAA Cn1ncc2ncc(C(=O)N3CCCN(c4nc5ccccc5s4)CC3)cc21 1940194909 BUWDEAWACPMLGM-UHFFFAOYSA-N 392.488 2.931 0 50 GFAA O=C(CCc1ccc(OCc2ccccc2)cc1)NC1CC(Cc2nn[nH]n2)C1 2325809090 DXJKJQMCFBHHPW-UHFFFAOYSA-N 391.475 2.849 0 50 GFAA CN1CCN(CCN2c3cccc4cccc(c34)S2(=O)=O)c2cnccc21 2325858823 BXXZOEIYYBJQHY-UHFFFAOYSA-N 380.473 2.700 0 50 GFAA NC[C@H](CC(=O)N=c1cc2ccccn2[nH]1)c1ccc(Br)s1 2325862445 UQAYVRFAEAOYAM-JTQLQIEISA-N 379.283 2.651 0 50 GFAA Cc1nc2ccnn2c(N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1C 2356157530 JYCGKKPMNITEHN-NRFANRHFSA-N 377.448 2.600 0 50 GFAA c1ccc(-c2nnc(N3CCc4nc(C5CCOCC5)nn4CC3)s2)cc1 2356167888 HTTVDYANBIYNLV-UHFFFAOYSA-N 382.493 2.753 0 50 GFAA Cc1ccc(NC(=O)c2cc(N3C(=O)CCC3=O)ccc2N2CCOCC2)cc1 794601 RZVLLFSIWDSSFF-UHFFFAOYSA-N 393.443 2.737 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c1 1162888 ZHVYFIRBMIRFRL-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA O=C(CSc1nnnn1-c1cccc(C(F)(F)F)c1)Nc1nccs1 4487953 MNJRESMSMSEQRA-UHFFFAOYSA-N 386.384 2.868 0 50 GFAA CCc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N3CCOCC3)c2)cc1 6706832 ZUAQWNMERICUPX-UHFFFAOYSA-N 388.489 2.831 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CCCN4CCOCC4)C3)C2)c1 11818718 VORCEGZNKJEZEB-DEOSSOPVSA-N 399.579 2.922 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@@H](C(=O)c2cc(C)c(OC)c(C)c2)C1 11873311 PBDBLPKLANMBTA-MRXNPFEDSA-N 390.480 2.870 0 50 GFAA O=C1C[C@H](NS(=O)(=O)c2ccsc2)CN1Cc1cccc2ccccc12 12075683 BNCONBRNDBYRFB-INIZCTEOSA-N 386.498 2.981 0 50 GFAA COc1ccc(NC(=O)CNC(=O)N2CCc3c([nH]c4ccccc34)C2)cc1 12296588 HTJODKOMHPJLQF-UHFFFAOYSA-N 378.432 2.883 0 50 GFAA biogenic Cn1ccnc1SCCNC(=O)[C@H]1CCC(=O)N(C2CCCCCC2)C1 12447143 ROTKEMNTRXUKKE-HNNXBMFYSA-N 378.542 2.590 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2cccc(-n3cccn3)c2)cn1 14976590 UXXPGFUYVVZFRN-IBGZPJMESA-N 375.432 2.819 0 50 GFAA O=C(C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1)N1CCCC1 24613321 QONNQNGQEMTIBD-UHFFFAOYSA-N 388.892 2.643 0 50 GFAA Cn1nc(C2CCN(C(=O)CCC(F)(F)F)CC2)n(-c2ccccc2)c1=O 67446932 FQSOKEQQNLYMDX-UHFFFAOYSA-N 382.386 2.620 0 50 GFAA COc1cc2c(cc1-c1nccn1Cc1ccc(S(N)(=O)=O)cc1)CCC2 71765452 MWWNTCRTLVJHDX-UHFFFAOYSA-N 383.473 2.743 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(c3cnccn3)CC2)C1 71776000 OVSMLUUOTLXYHR-FQEVSTJZSA-N 393.535 2.516 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC[C@]2(C1)C(=O)Nc1ccccc12 72125240 GPDWIAFOPGIEFP-OAQYLSRUSA-N 376.416 2.651 0 50 GFAA C[C@H](CO)NC(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 95496825 ZLEUNTKEUZKCSP-GOSISDBHSA-N 382.504 2.883 0 50 GFAA CCc1nn(C)c(NC(=O)N2CCC[C@]3(C2)C(=O)N(C)c2ccccc23)c1C 96149177 CEUUJYOXALWCOH-OAQYLSRUSA-N 381.480 2.833 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3cnn(C4CCOCC4)c3C)CCO2)c1 120408904 RYJXUDBSEHGDPH-HXUWFJFHSA-N 385.464 2.765 0 50 GFAA O[C@H](COc1c(Cl)cccc1Cl)CN1CCOC2(CCOCC2)C1 135585200 CKKFZGLJUQLMBH-ZDUSSCGKSA-N 376.280 2.615 0 50 GFAA CC[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)c(=O)n2CC)c1cc(F)ccc1F 155036970 DDXJZEJRAFXFTC-OAHLLOKOSA-N 387.386 2.869 0 50 GFAA Cc1ccc(-n2cc(C)cn2)c(NC(=O)N2CCO[C@H](Cn3cc(C)cn3)C2)c1 158448050 HNPSWLJLXAIVQM-SFHVURJKSA-N 394.479 2.927 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4ccc(C)c(F)c4)CC3)nn2)n1 169780303 FGELLLKDWXALNW-UHFFFAOYSA-N 384.415 2.815 0 50 GFAA CCOCN(C(=O)Cn1nc(-c2ccco2)oc1=O)c1c(C)cccc1CC 170598600 FFDQCAUXHSKYFB-UHFFFAOYSA-N 385.420 2.994 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ccncc2)c(C)o1 175664108 HZUKIRVLQVZOSG-INIZCTEOSA-N 377.466 2.649 0 50 GFAA CCc1nn(C)c(OC)c1CNC(=O)N1CCC(Nc2ccccc2F)CC1 179706523 BZBQBNAGGIURIZ-UHFFFAOYSA-N 389.475 2.916 0 50 GFAA CN1CC[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)[C@@H]1c1ccccc1 180145823 LNTGZZQIHWMBNG-ACRUOGEOSA-N 377.488 2.853 0 50 GFAA CCn1ccnc1[C@H]1OCCC[C@@H]1N[C@H](C)Cn1cc(Br)cn1 190432555 BLHDQDSGHLCOHG-SNPRPXQTSA-N 382.306 2.760 0 50 GFAA CCn1cc([C@@H]2CN(Cc3nc(-c4ccc(C)c(OC)c4)no3)CCO2)cn1 190819377 DUIIZFYYXLQILV-SFHVURJKSA-N 383.452 2.844 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1Cc1ccc(I)cc1 229994706 OEDCLHKPZZFZSE-DDHJSBNISA-N 393.224 2.988 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccs1)C(=O)O 236793672 KEWCHWPSYSGGAG-JKSUJKDBSA-N 388.489 2.705 0 50 GFAA CC(C)CN1CC[C@H](C(=O)N2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)C1 252512691 UTBBBJFCODTSID-XSLAGTTESA-N 379.545 2.726 0 50 GFAA CC(C)NC(=O)C[C@@H](C)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 253428268 JCQBMZBAHZETHD-SNVBAGLBSA-N 384.358 2.788 0 50 GFAA COc1cc(CNC(=O)N2CCCC3(CCOCC3)C2)cc(OC)c1OC 266688308 LCCDUYGTCNDZRF-UHFFFAOYSA-N 378.469 2.815 0 50 GFAA CCc1nnc(CNC(=O)N[C@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)s1 291088435 SETJLBSBNUGAHH-ZWNOBZJWSA-N 389.481 2.770 0 50 GFAA COC(C)(C)CS(=O)(=O)Nc1ccc(C)c(I)c1 328596088 RVBRYMORBVXVHF-UHFFFAOYSA-N 383.251 2.766 0 50 GFAA COc1ccc2c(c1)C[C@@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1c(C)nn(C)c1C)CC2 328622242 IIGVZZDFWLMODG-SFYKDHMMSA-N 396.535 2.712 0 50 GFAA Cc1c(C(=O)N[C@H](CC(C)C)c2nnc3ccccn23)sc2[nH]cnc(=O)c12 334160706 KQHCDEGGHRBECM-GFCCVEGCSA-N 396.476 2.853 0 50 GFAA CC[C@H]1CCCCN1C(=O)[C@@H](C)N1CCCN(Cc2nc(C)c(C)o2)CC1 370812319 VBXQGDPXKIHVBE-MJGOQNOKSA-N 376.545 2.979 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2ccccc2[C@H](O)C1 584903960 HJSCZHSCUFNKKM-HXUWFJFHSA-N 379.460 2.681 0 50 GFAA O=C(N[C@H](CO)C(=O)OCc1ccccc1)c1c[nH]nc1-c1cccc(Cl)c1 1320248916 LJBHPUAEJJDTDN-QGZVFWFLSA-N 399.834 2.564 0 50 GFAA CC[C@@H](c1ccc(OC)cc1)N(C)S(=O)(=O)c1ccc(C(=O)NC)cc1 1505795104 FPEIDKBBYSRKKT-SFHVURJKSA-N 376.478 2.827 0 50 GFAA COc1cc(OC)c(C(=O)N(C)[C@@H]2C[C@@H]3C[C@H](N(C)C)C[C@@H]3C2)cc1OC 1529120583 DNHJOUVAZBHOAP-GEEKYZPCSA-N 376.497 2.903 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3cccc(O)n3)CC1)OCC2 1704299565 RPUAWHXEUMQMGQ-UHFFFAOYSA-N 384.432 2.509 0 50 GFAA COc1ccc(C2(C(=O)N(CCO)Cc3[nH]cnc3C)CCCC2)cc1OC 1704308366 OUEQOKYQDBJTOF-UHFFFAOYSA-N 387.480 2.568 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3c(C)noc3C)C[C@@]2(CCc2ccccc2)C1 1772705150 WYKYZFBFJQXKCI-REWPJTCUSA-N 397.519 2.831 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857709293 PJBKGFURLUHAOC-QHCPKHFHSA-N 393.487 2.601 0 50 GFAA O=C(CCc1ccccc1)NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3 1875246343 MOBBOZSWODHHNO-DZCCDHAISA-N 377.488 2.814 0 50 GFAA O=C(NC1CCC1)[C@H]1CC[C@H]2OCCN(C(=O)CCOc3ccccc3)[C@@H]2C1 1875249586 GAQNTGBSYWWLNN-PWIZWCRZSA-N 386.492 2.520 0 50 GFAA O=C(c1cnc2c(=O)[nH]ccc2c1)N1CCC(N2CCCc3ccccc32)CC1 1875283122 GYNWWQRIHQPDLD-UHFFFAOYSA-N 388.471 2.981 0 50 GFAA Cc1cc(F)ccc1-n1nc(CC2CCC2)nc1-c1cnn2c1OC[C@H](O)C2 1875331030 MAQLTMWIELSMLD-OAHLLOKOSA-N 383.427 2.674 0 50 GFAA O=C(O)c1cc2n(n1)CCN(C[C@H](c1ccc(Cl)cc1)N1CCCC1)C2=O 1940198126 PFUUNEWQVPUYCY-QGZVFWFLSA-N 388.855 2.528 0 50 GFAA COc1cc2c(cc1OC)C(C)(C)N(C(=O)c1cnn3ccc(CN)cc13)CC2 2325787794 XAXKJFWCGXSGSB-UHFFFAOYSA-N 394.475 2.744 0 50 GFAA O=C1CC[C@H](Cc2nc(COc3cccc(F)c3)nn2Cc2ccccc2)N1 2356138102 HPXVIFNKZJZREE-QGZVFWFLSA-N 380.423 2.866 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(N1CCCCC1)n2Cc1cccc2ccccc12 796276 DTWCTLAHJUZMMR-UHFFFAOYSA-N 389.459 2.615 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1CCN(C(=O)c2cccc(F)c2)CC1 893077 JQEXRGUZPCIGFF-UHFFFAOYSA-N 376.815 2.843 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccc(Cl)c2)S(C)(=O)=O)c(OC)c1 1168099 NNBPFEJCZVAMDQ-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA Nc1nc(SCC(=O)NCc2cccnc2)nc2sc3c(c12)CCCC3 1818671 FTGBMBXMPWTKII-UHFFFAOYSA-N 385.518 2.956 0 50 GFAA COCc1cc(C)nc2sc3c(=O)n(N)c(-c4ccc(OC)cc4)nc3c12 4710267 BQILQZCYBRYBJD-UHFFFAOYSA-N 382.445 2.850 0 50 GFAA CN(C[C@H](O)COc1ccccc1CNCCc1c[nH]cn1)C1CCCCC1 11935575 GQEITRZCGSXUMW-NRFANRHFSA-N 386.540 2.746 0 50 GFAA CS(=O)(=O)c1ccc(-c2cccc3c2O[C@@H](CNC(=O)C2CCC2)C3)cc1 12040071 HXRQGKIBRGBMNE-QGZVFWFLSA-N 385.485 2.977 0 50 GFAA Cc1nnc(SCC(=O)N[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)o1 12094060 APOAFTZWPCSUBG-OAHLLOKOSA-N 380.901 2.904 0 50 GFAA O=C(NCc1nccs1)c1nn(CC2CC2)c2c1CN(Cc1ccco1)CC2 14741120 KCWPTOPXAJKPTE-UHFFFAOYSA-N 397.504 2.831 0 50 GFAA COc1cc(OC)cc(N2CCN(CCNC(=O)Nc3ccccc3)CC2)c1 16487888 RDKDZQITOSBRHQ-UHFFFAOYSA-N 384.480 2.648 0 50 GFAA NS(=O)(=O)c1ccc(-n2c(S)nnc2CSCc2ccccc2)cc1 17080241 DACUXMBDRQVEBT-UHFFFAOYSA-N 392.531 2.637 0 50 GFAA C[C@H]1CCC[C@H](C)N1C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 17081365 KSZZWHZFRCYRAH-GJZGRUSLSA-N 397.566 2.667 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)CN3CC4(CCCC4)CC3=O)C2)n1 20295021 VBCFXPKQZGJJCN-INIZCTEOSA-N 388.512 2.767 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(F)F)cc(-c3cnn(C)c3C)nc21 20604567 LBOOQMKGJLVJGI-UHFFFAOYSA-N 381.408 2.747 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)N(C)Cc3ccccc3)n2)cc1OC 44917092 YTMUVRAUQHJILP-UHFFFAOYSA-N 393.443 2.586 0 50 GFAA CCN1CCC[C@H]1Cn1c(=O)n(C[C@@H]2CCCCO2)c2cc(C(=O)O)ccc21 55283501 YOIJEDREJXBJAM-IRXDYDNUSA-N 387.480 2.555 0 50 GFAA Cc1ccccc1CCNC(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71662547 PKOGAOWOSKWZTB-OAQYLSRUSA-N 397.563 2.767 0 50 GFAA CN(CCCC(=O)O)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71761322 QYTYQQPDUDJTCV-QHCPKHFHSA-N 394.471 2.857 0 50 GFAA CCS(=O)(=O)N1C[C@@H]2C[C@H]1C(=O)N2c1cc(-c2ccccc2)ccc1OC 77300903 BKVFPCUKYNGYQT-WMZOPIPTSA-N 386.473 2.501 0 50 GFAA CC(C)n1cc(C(=O)N2CCN(c3nccc(-c4ccccc4)n3)CC2)cn1 77353356 XZINTSMAZMEGPH-UHFFFAOYSA-N 376.464 2.883 0 50 GFAA CCSCCC(=O)N1CCC[C@]2(CCC(=O)N(Cc3cnc(C)cn3)C2)C1 91625409 PYIAICVNDYAYIA-FQEVSTJZSA-N 390.553 2.659 0 50 GFAA COc1ccc(OC)c([C@@H]2CCN(C(=O)c3ccccc3-n3cncn3)C2)c1 91725350 WNTUPDKEEAWYPN-OAHLLOKOSA-N 378.432 2.914 0 50 GFAA CN(C[C@@H]1CCCCO1)C(=O)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91746003 RDAJUIMYQUGJCF-ATFGOMPUSA-N 385.508 2.879 0 50 GFAA O=C1CC[C@]2(CCCN(C3Cc4ccccc4C3)C2)CN1CCc1c[nH]cn1 92019853 IGQPGICBQXPKCB-QHCPKHFHSA-N 378.520 2.824 0 50 GFAA Cc1cccc(Cn2nc([C@H](O)c3ccccc3)nc2CN2CCOC2=O)c1 95496585 LWOSJGXFTDMOBR-LJQANCHMSA-N 378.432 2.669 0 50 GFAA CCN(CC)CCCNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@H](C)CC3 100663165 JVKBVLNPPVEOHA-CYBMUJFWSA-N 389.471 2.815 0 50 GFAA COc1cccc([C@@H](O)C(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)c1 161642314 GCRHFHSUWOQXQD-OAQYLSRUSA-N 394.471 2.557 0 50 GFAA Cc1ccc(OCC(=O)N2CCC(Cc3nc(-c4cnccn4)no3)CC2)cc1 169754922 GLIPIJSQMXPFBG-UHFFFAOYSA-N 393.447 2.695 0 50 GFAA O=C(CCn1ccn2nc3c(c2c1=O)CCCC3)NCc1cccc(Cl)c1 169760134 ARENVVHDMIUCBL-UHFFFAOYSA-N 384.867 2.735 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CC1)NC(=O)N(c1cccc(F)c1)N2 169764157 PXFQODGWXRHKCI-UHFFFAOYSA-N 382.439 2.730 0 50 GFAA CCOc1ccccc1C(=O)NCc1nnc2cc(-c3nc(CC)no3)ccn12 169776181 WOPHDEYHIHNFJB-UHFFFAOYSA-N 392.419 2.670 0 50 GFAA CC1(C)CC(=O)C(C(=O)Nc2cccc(Cl)c2N2CCOCC2)C(=O)C1 170625062 VEVIRLYLITWVIX-UHFFFAOYSA-N 378.856 2.690 0 50 GFAA C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1ccc(C(N)=O)cc1 186273924 CYMJKYMAOPJVPO-OAHLLOKOSA-N 387.505 2.518 0 50 GFAA C[C@H]1CCN(C(=O)NCc2csc(-c3ccccc3)n2)CCS1(=O)=O 190432083 UZTINLWYFXZCFQ-ZDUSSCGKSA-N 379.507 2.529 0 50 GFAA O=C1O[C@@H](C(=O)N2CCC(O)(c3ccccc3Cl)CC2)Cc2ccccc21 192403095 MNGJHNBZTCKGAK-GOSISDBHSA-N 385.847 2.932 0 50 GFAA CCN(C[C@@H]1COc2ccccc2O1)C(=O)CCc1nc(-c2ccccn2)no1 192509782 OPEKLJILLJNVBC-OAHLLOKOSA-N 394.431 2.753 0 50 GFAA Cc1cc(/C=c2/s/c(=C\C(=O)c3ccc(Cl)cc3)[nH]c2=O)cc(C)c1O 211277813 MGJJEJSBJYXLDZ-XXGRXQMWSA-N 385.872 2.904 0 50 GFAA Cc1nnc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2ccccc12 225394328 FYDWCGKBGKISSG-UHFFFAOYSA-N 382.445 2.969 0 50 GFAA CC[C@@H]1CN(C(=O)CN2CCC[C@H]2[C@@H]2CCCN2Cc2ccccc2)CCO1 251859385 SPLJZHGLYWNQBJ-FSSWDIPSSA-N 385.552 2.753 0 50 GFAA Cc1ccc2c(c1)CCN(C(=O)Nc1cccc(N3CCS(=O)(=O)CC3)c1)C2 252500150 SNTSROQWOLGNJL-UHFFFAOYSA-N 399.516 2.820 0 50 GFAA O=C([C@@H]1C[C@H]2CC[C@H]1N2C(=O)C1CCC(F)(F)CC1)N1CC[C@]2(CCOC2)C1 253418936 FTLLIGJJQXZSGM-VIPLHTEESA-N 396.478 2.830 0 50 GFAA Oc1nc(CN2CCc3nnc(-c4ccccc4)n3CC2)nc2ccsc12 253536416 QALJBXSBCZSREF-UHFFFAOYSA-N 378.461 2.714 0 50 GFAA O=C(NCc1ccc(F)cc1F)c1nnn2c1CO[C@H](c1ccc(F)cc1)C2 263615477 CQAWPHYZZQQBLP-KRWDZBQOSA-N 388.349 2.897 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 268950738 SQBGNDLRKANEHL-WPGHFRTFSA-N 391.855 2.728 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCN(C(=O)c3ccco3)CC2)ncn1 275561083 FSXKPDLTMGLVNZ-UZLBHIALSA-N 399.495 2.648 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)NCC1(C)COC1)CC2 275600151 HWKZIEYREYINHI-KRWDZBQOSA-N 391.537 2.697 0 50 GFAA CCc1cc(C)c(C(=O)N2CCC[C@@H](N(Cc3cncnc3)C(C)=O)CC2)o1 328629748 IPWRKRVPXQSKCO-GOSISDBHSA-N 384.480 2.984 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)nn1 376572391 GGKKGHZEFHCWJJ-KURKYZTESA-N 382.464 3.300 0 50 GFAA O=C(Nc1cccc(C(=O)N[C@@H]2COc3ccccc3[C@@H]2O)c1)c1cccnc1 378142012 WPRPDLJNZZPMEE-QUCCMNQESA-N 389.411 2.558 0 50 GFAA Cn1ccnc1[C@H]1CCN(C(=O)c2cccc(NC(=O)c3cccnc3)c2)C1 378267719 MBKTUVNIJNHPOS-KRWDZBQOSA-N 375.432 2.697 0 50 GFAA C[C@@H]1C[C@H](N)CCN1C(=O)CCC[S@](=O)c1ccc(Br)cc1 408519186 PSWDBAMFNDVVNK-OQQHHNTDSA-N 387.343 2.675 0 50 GFAA COc1ccc(CN2CCN(C(=O)NC[C@H](C)c3ccccc3)CC2=O)cc1 426518854 VONWKIBRSIYGIL-KRWDZBQOSA-N 381.476 2.853 0 50 GFAA O=C(CN1CCC(Nc2ccnc(N3CCCCC3)n2)CC1)Nc1ccccc1 498910183 YNNAPTBOWFAMHI-UHFFFAOYSA-N 394.523 2.982 0 50 GFAA COc1ccccc1-n1cc([C@@H](C)NC(=O)N(C)CCn2ccnc2C)cn1 534645481 UBKNHTQJECZSLI-OAHLLOKOSA-N 382.468 2.788 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1 823764727 BIWZMJVIFLNOEB-UHFFFAOYSA-N 392.459 2.659 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCN(C(=O)c2ccc[nH]2)CC1 952860547 PWWPSVKHUIZHHD-UHFFFAOYSA-N 388.855 2.615 0 50 GFAA CC1=C(c2ccccc2)[C@H]1C(=O)NCC1CCN(C(=O)c2ccc(CO)o2)CC1 952862667 PJKIVFQQZTXBBD-NRFANRHFSA-N 394.471 2.844 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)c3ccc4c(=O)n(C)cnc4c3)C2)n1 952981444 IKAGVZUUTWFZEM-HNNXBMFYSA-N 395.463 2.535 0 50 GFAA Cc1nc(N2CCCN(C(=O)c3cn(-c4ccccc4)nn3)CC2)sc1C 1772808724 ZNVPRDQGCIFESX-UHFFFAOYSA-N 382.493 2.693 0 50 GFAA Cc1nc2c(c(=NC[C@H]3CCOC3)[nH]1)CCC21CCN(c2ncccc2F)CC1 1857685222 DUZWTEIPTYMHRD-MRXNPFEDSA-N 397.498 2.674 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2-c2ccc(-n3cccn3)cc2C)cn1 1857686716 DFRBQSXYVCQQHT-UHFFFAOYSA-N 389.463 2.756 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1CCO[C@@H]2C[C@H](CO)C[C@@H]21 1857698488 UGLZHTPSQWTJBD-KAGYGMCKSA-N 381.472 2.920 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cn(-c4ccccc4)nn3)CC2)O1 1857700241 PDFPFOHMBBUYAW-IEBWSBKVSA-N 398.507 2.828 0 50 GFAA O=C1CCOC2(CCN(Cc3cccc(OCc4ccccn4)c3)CC2)CN1 1857720308 OHLYNRCNPNSXJV-UHFFFAOYSA-N 381.476 2.532 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)NCCS(=O)(=O)c1ccc(F)cc1 1857727418 RRHLZAFHOGWXOI-UHFFFAOYSA-N 387.436 2.728 0 50 GFAA O=C(CCCn1cccn1)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857729466 CBNLXPCKPBMSKF-WOJBJXKFSA-N 383.492 2.937 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(c2ccc(CN3CCCC3)cn2)CC[C@@H]1O 1875246060 HHRXMVGBGZHKHL-GMAHTHKFSA-N 399.510 2.609 0 50 GFAA COC(=O)c1ccc2c(c1)CC[C@@H](NC(=O)OC(C)(C)C)CN2C(=O)C(F)F 1875339436 JRHTZOCDSOBRTA-CYBMUJFWSA-N 398.406 2.911 0 50 GFAA C[C@H](NC(=O)c1cc(-c2ccco2)n2cnc(C(N)=O)c2n1)c1cccc(F)c1 1875350611 ULAAWZPEUBCARR-NSHDSACASA-N 393.378 2.718 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C)cc2O3)cc1Cl 1875394801 XEWLJZLSLYVEHW-OAHLLOKOSA-N 375.856 2.873 0 50 GFAA COc1ccc(C(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)cc1C 2356143138 WFVCPYNVNXTITD-DENIHFKCSA-N 383.444 2.524 0 50 GFAA COc1ccc(-c2onc(N3CCCN(C(=O)C4CCC4)CC3)c2C(=O)O)cc1 2356144415 WRDYFDJCNVHQGJ-UHFFFAOYSA-N 399.447 2.887 0 50 GFAA CCOc1ccccc1NC(=O)N[C@@H]1CC[C@H](C(=O)N(C)CC)C[C@H]1OC 2356149254 QUWWICRZXUNRBK-YXJHDRRASA-N 377.485 2.869 0 50 GFAA CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OC)c3ccccc23)C1 1119208 RWSKQQUCTXWYDW-CQSZACIVSA-N 377.462 2.812 0 50 GFAA COc1ccc(NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)c(OC)c1 1144715 KBWSOWDVPPRBQR-UHFFFAOYSA-N 392.477 2.546 0 50 GFAA COc1ccccc1Nc1nc(N)nc(CN2CCN(c3ccccc3)CC2)n1 2359911 NKJNSZPPIVCXKQ-UHFFFAOYSA-N 391.479 2.528 0 50 GFAA Cc1ccc(-n2c(-c3ccccc3)cn3c4c(=O)n(C)c(=O)n(C)c4nc23)cc1C 2426851 XOYKDQUEXXEGJR-UHFFFAOYSA-N 399.454 2.959 0 50 GFAA COc1ccc(Cl)cc1N([C@H](C)C(=O)Nc1cccnc1)S(C)(=O)=O 6710025 UMPJMQYPCRAPPW-LLVKDONJSA-N 383.857 2.537 0 50 GFAA COc1ccccc1-c1cc(=O)[nH]c(N2CCN(c3ccccc3F)CC2)n1 9421862 OSZMCEVPYJZBEG-UHFFFAOYSA-N 380.423 2.911 0 50 GFAA Cc1ccc(NC(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2Cl)cc1 12004020 PBINOAJOLOIOGY-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA O=C(NCCCn1nnc2ccccc21)c1cn(C/C=C/c2ccccc2)nn1 12025997 SPFKVEBNCIQOIC-UXBLZVDNSA-N 387.447 2.556 0 50 GFAA Cc1nnc(CNC(=O)Cc2c3c(n(CC(C)C)c2C)CC(C)(C)CC3=O)[nH]1 12459237 QNMQVTVTQUYJOM-UHFFFAOYSA-N 385.512 2.893 0 50 GFAA Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@@H](NCc1ccco1)C2 14744699 WMVYWLYIJLAOEY-GOSISDBHSA-N 390.487 2.859 0 50 GFAA O=C(NCc1cccnc1N1CCN(c2ccccn2)CC1)c1cccs1 15063015 PQOGIZIMBPZZOD-UHFFFAOYSA-N 379.489 2.795 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3cccc(N4CCOCC4)c3)n1)CCNC2 19145380 OVNGBDMMKROAPV-UHFFFAOYSA-N 377.448 2.589 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cc(-c3cn[nH]c3)nc3ccccc23)CC1 20857269 LJNLKNLYKLFMDX-UHFFFAOYSA-N 379.420 2.539 0 50 GFAA CN(Cc1nc(-c2cccnc2)no1)Cc1c[nH]nc1-c1ccc2c(c1)OCO2 20996136 IFBFMUZSFZXZTK-UHFFFAOYSA-N 390.403 2.882 0 50 GFAA CCc1nn2c(nnc3c(=O)n([C@H](C)C(=O)O)ccc32)c1-c1ccc(Cl)cc1 40395917 OZOSLSFSGKAJAQ-SNVBAGLBSA-N 397.822 2.968 0 50 GFAA COc1ccc(CCNC(=O)Cn2nc(-c3ccccc3Cl)ccc2=O)cc1 61720096 YUNGCIMSJXKFFH-UHFFFAOYSA-N 397.862 2.931 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)COc2ccc3c(c2)OCO3)C[C@H]1O 67818445 JWYACNDLMQAMKP-HUUCEWRRSA-N 375.446 2.541 0 50 GFAA CCN1C[C@@H](CCN2CCOCC2)[C@](c2ccccc2)(c2cccnc2)C1=O 71769365 DHPMSMRUUUKJSL-GGAORHGYSA-N 379.504 2.568 0 50 GFAA COC(=O)CCn1cc(CN2CCN(c3ccc4ccccc4c3)CC2)cn1 72168063 VLVFLUXMJGAIBI-UHFFFAOYSA-N 378.476 2.922 0 50 GFAA CCOCc1nc([C@H]2CC(=O)OC23CCCCC3)n(C2CCN(C)CC2)n1 95509734 GVPDCPNRSFGADA-MRXNPFEDSA-N 376.501 2.815 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1C[C@@H](C(=O)O)[C@H](c2ccccn2)C1 97347145 XSGAYKFDHWRNFV-HZPDHXFCSA-N 376.416 2.721 0 50 GFAA Cc1cc(C(=O)N(C)C)ccc1NC(=O)N1CCC(Oc2ncccn2)CC1 97694659 IKBSVNYYJFEHHI-UHFFFAOYSA-N 383.452 2.562 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1 124781977 NEIBYMAAPAYWOK-HNNXBMFYSA-N 386.477 2.526 0 50 GFAA O=C(C1=Cc2ccccc2OC1)N1CCN(c2ncnc3ccsc23)CC1 126584079 IIWKENSVSHQZNT-UHFFFAOYSA-N 378.457 2.816 0 50 GFAA CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCOC2(CCOCC2)C1 135600620 FXLFZYVNIKZDIH-GOSISDBHSA-N 376.497 2.534 0 50 GFAA O=C1[C@H](N2CCCN(c3cccnn3)CC2)CCN1c1ccc(Cl)c(F)c1 156963964 YGNKRGNDAWJNAW-QGZVFWFLSA-N 389.862 2.587 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@H](OC1CCCC1)c1ccccc1 170620475 CDQCBQDLOFCMMF-MRXNPFEDSA-N 378.450 2.797 0 50 GFAA Cc1occc1-c1nnc(SC[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1N 170635884 VFOCUMVERAONJB-LBPRGKRZSA-N 379.486 2.909 0 50 GFAA O=C(NCc1ccccc1CN1CCOCC1)c1cnc(-c2ccccn2)s1 170777638 IPQNWYNFVXINSM-UHFFFAOYSA-N 394.500 2.967 0 50 GFAA O=C(NCCc1nnc2n1CCCCC2)N1CCO[C@H](CCc2ccccc2)C1 182899466 PSBOXQAELVXXKJ-LJQANCHMSA-N 397.523 2.590 0 50 GFAA CCOC1CC(CNC(=O)CCSc2ccccc2F)(N2CCOCC2)C1 195191189 XCSXTNBLGRKOKL-UHFFFAOYSA-N 396.528 2.694 0 50 GFAA O=C(CCc1ccsc1)N[C@@H]1COCC[C@H]1Oc1ccc(C(=O)O)cc1 223128435 ZQFPPXRVTIGNES-IAGOWNOFSA-N 375.446 2.732 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N(CCC(=O)O)C[C@@H]3CCCO3)cc2)n1 237659731 HFOLNDGPMNKHFH-IBGZPJMESA-N 385.464 2.644 0 50 GFAA Cc1ccc(C(=O)COC(=O)[C@H](C(C)C)N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 239235550 WDTQHPVAXAGVJS-UFHDJZAFSA-N 395.455 2.553 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)[C@@H]3C[C@H]3c3cccnc3)cc(Cl)c2O1 242339245 ZGEQMSSRRRYPOO-WKPIXPDZSA-N 392.864 2.667 0 50 GFAA CC(=O)Oc1cccc(C=c2sc3nc(-c4ccc(C)cc4)nn3c2=O)c1 254302851 QIPVOGIXQOVZBC-UHFFFAOYSA-N 377.425 2.599 0 50 GFAA Cc1c(C(=O)N(CC(=O)O)Cc2ccc(Cl)cc2)cnn1C1CCOCC1 262840854 ZRLVMMHKDFZUIJ-UHFFFAOYSA-N 391.855 2.923 0 50 GFAA O=C(N[C@H]1CCc2nc[nH]c2C1)c1cnn(-c2ccccc2F)c1-n1cccc1 378199228 IPRLCRFZEPMBKC-AWEZNQCLSA-N 390.422 2.813 0 50 GFAA CN1CCC(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)(c2ccccc2)CC1 426599473 CNSDDCFAWUNQPC-FQEVSTJZSA-N 378.472 2.688 0 50 GFAA CCN1CCC[C@@H](CNC(=O)N2CCCN(Cc3cccc(F)c3)CC2)C1 426722696 UBTHRANQTJFDAB-IBGZPJMESA-N 376.520 2.775 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)NCc1n[nH]c2c1CCCCC2 670444349 PLCBCUSQJBFEEV-UHFFFAOYSA-N 375.856 2.962 0 50 GFAA Cc1nc(C[C@H]2CCCN(C(=O)[C@@H](N)c3ccccc3C(F)(F)F)C2)no1 884125949 MUDANGYMNYNILQ-WBMJQRKESA-N 382.386 2.878 0 50 GFAA C[C@@H]1[C@H](N2CCOCC2)CCN1C(=O)c1csc(-c2ncccc2Cl)n1 952846172 OSUTWGCDWBHEDB-IUODEOHRSA-N 392.912 2.794 0 50 GFAA CCN(Cc1cnn(CC)c1)C(=O)C12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 952868472 PNZZOSOEXVOKJM-AGXSTUJCSA-N 382.512 2.839 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1ccccc1)c1cc(=O)c2ccccc2o1 1565507083 FTWQHHGNXIHUCC-UWJYYQICSA-N 379.412 2.897 0 50 GFAA CCc1nccn1CCC(=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1616068128 GNDSRHROYLTGPZ-XLIONFOSSA-N 378.476 2.758 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)[nH]1 1704300488 WRYILMVNSGEIJN-UHFFFAOYSA-N 377.444 2.869 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)NCCn1nccc1C)C2 1772804358 NFZXPZIGZKUXKS-AWEZNQCLSA-N 385.493 2.841 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@]2(CCc2ccccc2)C1 1772811168 QSVBPKSYJANCLK-DENIHFKCSA-N 399.560 2.991 0 50 GFAA CC[C@@H](C(=O)N[C@H]1CC[C@H](NC(=O)[C@H](CC(C)C)OC)CC1)N(CC)CC 1775986882 NIYLAKDBPFDGFB-VJANTYMQSA-N 383.577 2.712 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CCC(C4CCNCC4)CC3)cc2n1 1857666735 OXSIBECDMTWOLH-UHFFFAOYSA-N 395.429 2.908 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3CC[C@@]45OCCN4C(=O)C[C@@H]35)c2)cc1 1857726976 GSSJRLOLKIGJDI-KNQAVFIVSA-N 378.428 2.536 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CCC(c2cc[nH]n2)CC1 1857736674 WBOAIXNYEVQJCW-CQSZACIVSA-N 395.488 2.779 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N(C)Cc2c(C)noc2C)CC[C@H]1NC(=O)CC 1875250133 AMGKASAETVIXGE-CGTJXYLNSA-N 379.501 2.740 0 50 GFAA Cc1cc(=N)[nH]cc1C1CCN(C(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)CC1 1875314662 KZXNUNCQDIOZMU-KGLIPLIRSA-N 383.496 2.578 0 50 GFAA CC(=O)Nc1ccc(-c2ccc([C@@H](C)C(=O)NS(C)(=O)=O)cc2F)cc1F 1875325080 QHYZAQLIFLIREU-SNVBAGLBSA-N 396.415 2.770 0 50 GFAA CO[C@H]1C[C@@H](CN)N(c2cc(NCc3csc(C(F)(F)F)c3)ncn2)C1 1875392029 BYRDZJDKIQTGDG-RYUDHWBXSA-N 387.431 2.721 0 50 GFAA Cc1ccc([C@H](O)[C@H](C)NC(=O)CCn2cc(Br)cn2)cc1F 2325800235 YZTUBTBCLWFHOU-MEDUHNTESA-N 384.249 2.722 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)nn1C 2325819166 XPPBYHWGMAMIKX-UHFFFAOYSA-N 398.655 2.968 0 50 GFAA O=C(NS(=O)(=O)c1cc[nH]n1)c1cc2c(C(F)(F)F)cccc2s1 2325876957 FUEWUTLQGFGYIK-UHFFFAOYSA-N 375.353 2.762 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(Cc2ccc(OCC(N)=O)cc2)CC1 2356142097 DENAKCLLURRINQ-UHFFFAOYSA-N 396.487 2.623 0 50 GFAA NC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCC2 665918 AKMKGYGXXSQXDP-LBPRGKRZSA-N 383.473 2.717 0 50 GFAA O=C(CSc1nnnn1-c1ccc(Cl)cc1)Nc1ccc(C(=O)O)cc1 1282763 XCVSBUSZMRFZHL-UHFFFAOYSA-N 389.824 2.745 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1 1298604 FGHRRWRJGPNMLW-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA Cc1ccn([C@H](C)C(=O)Nn2c(C)nc3sc4c(c3c2=O)CC[C@@H](C)C4)n1 2778076 NNVRSXKIALPPSB-ZYHUDNBSSA-N 385.493 2.727 0 50 GFAA Cc1ccc(S(=O)(=O)Oc2ccccc2C(=S)N2CCOCC2)cc1 2947545 OJMLGHQZGMURTN-UHFFFAOYSA-N 377.487 2.770 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)CCc2nnc(-c3ccccc3)o2)C1 12301997 YDSPFAAIEFETKK-MRXNPFEDSA-N 393.447 2.524 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1ncoc1C1CC1 15074162 QYGQQDBWMGFLOY-UHFFFAOYSA-N 377.448 2.951 0 50 GFAA O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1 16294362 QADZZZIOWJHBAT-ZIAGYGMSSA-N 394.855 2.642 0 50 GFAA Cc1nnc(-c2cccc(-c3cnn(CC(=O)Nc4ccnn4C)c3)c2)s1 23250334 AIKGWBFUMGKDGX-UHFFFAOYSA-N 379.449 2.749 0 50 GFAA CCOc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)cc1 39468275 MCFOOHKBCRHZNV-JOCHJYFZSA-N 389.584 2.827 0 50 GFAA CC(C)Cc1cn(C[C@H]2CCCN(C(=O)c3cnc4ccccc4n3)C2)nn1 48302703 CLKZHSDDCMINOX-INIZCTEOSA-N 378.480 2.972 0 50 GFAA CC(=O)Nc1cc(NC(=O)CN2CCN(c3ccccc3F)CC2)ccc1C 55564323 BJMORZZKOIXAPG-UHFFFAOYSA-N 384.455 2.853 0 50 GFAA CC(C)c1cncnc1N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71712159 GUAXSIXJKBJDDM-GOSISDBHSA-N 385.556 2.903 0 50 GFAA C[C@H](CN1CCc2ccccc2C1)NC(=O)c1cn(Cc2ccccc2F)nn1 72146671 NLMRTLOXNMPOKG-MRXNPFEDSA-N 393.466 2.642 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CC4(CCNCC4)C[C@@H]3C(=O)O)o2)cc1 72168215 QKVUUCKAWYIQOG-MRXNPFEDSA-N 384.432 2.624 0 50 GFAA c1ccc(-c2nc3c(c(NCc4ccc5c(c4)OCO5)n2)CCNCC3)nc1 72448172 ARFLDUHHDFUCTM-UHFFFAOYSA-N 375.432 2.568 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccccc3O)CC2)CN1Cc1ccccn1 91817629 IXAOCVWLADAWOR-UHFFFAOYSA-N 379.460 2.832 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ncccc3O)CC2)CN1Cc1ccccc1 91846168 CWSQYUKIXABMLM-UHFFFAOYSA-N 379.460 2.832 0 50 GFAA COCCN1C(=O)[C@H]2CC[C@@H]1CN(Cc1nc(-c3cccs3)oc1C)C2 91951867 NIROUPFDNKYAHV-LSDHHAIUSA-N 375.494 2.781 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(C(=O)CCc1nc3ccc(C)c(C)c3[nH]1)C2 95371316 VNKBNQPBUUMZRT-QZTJIDSGSA-N 384.524 2.682 0 50 GFAA CCCCSc1nc(N)cc(NCC2(N3CCN(C)CC3)CCCC2)n1 95373861 UCUVYDYWOFXGFE-UHFFFAOYSA-N 378.590 2.923 0 50 GFAA Cc1nccn1CCC(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95506227 YIUNPRZDSFRFQT-UHFFFAOYSA-N 378.480 2.628 0 50 GFAA Cc1cccc(N2CCC(NC(=O)Nc3ccc(-n4cnnn4)cc3)CC2)c1 95507329 WVPHZCOXKSZCEO-UHFFFAOYSA-N 377.452 2.761 0 50 GFAA CNc1ncc(-c2nc(CCc3ccccc3)nn2C2CCN(C)CC2)cn1 96138380 WCOZBGIIASLQSG-UHFFFAOYSA-N 377.496 2.829 0 50 GFAA O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)N1[C@H]2CC[C@@H]1C[C@H](O)C2 102620863 UEYVSFRTLAWOFK-PIIMJCKOSA-N 389.455 2.578 0 50 GFAA Cc1ccc(N2CCC(NC(=O)Cc3cc4ccccc4[nH]c3=O)CC2)nc1 124190865 LBESHWQRSKNZLM-UHFFFAOYSA-N 376.460 2.559 0 50 GFAA Cc1cc(O)cc(=O)n1CC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 128103627 NTBLBVLGIKAXSB-AWEZNQCLSA-N 387.505 2.604 0 50 GFAA O=S(=O)(c1ccc(-c2ccccc2)cc1)N1CCN(C2CCOCC2)CC1 175465611 KMYPQAISSLHBFP-UHFFFAOYSA-N 386.517 2.839 0 50 GFAA O=S(=O)(c1cnn(C2CCOCC2)c1)N1CCC[C@@H]1c1cccc(F)c1 178784016 NYSAFFWCTAGQMB-GOSISDBHSA-N 379.457 2.900 0 50 GFAA Cc1cc(C)cc(-n2nc(NC(=O)N3CCN(c4cnn(C)c4)CC3)cc2C)c1 180188125 LWONERPNJUQVDD-UHFFFAOYSA-N 393.495 2.885 0 50 GFAA CC(C)CN1CCO[C@H](CNC(=O)N[C@@H]2CCCOc3c(F)cccc32)C1 182120709 OUZSFSQCJJWNQX-CRAIPNDOSA-N 379.476 2.695 0 50 GFAA C[C@@H](c1nnnn1C1CC1)N1CCO[C@H](c2cccc(Br)c2)C1 191975828 KCTJIHDMCDYKOH-NHYWBVRUSA-N 378.274 2.905 0 50 GFAA CS(=O)(=O)c1ccc(CN2CCC(Cc3noc(C4CC4)n3)CC2)cc1 216482784 XLECHVVAZNCCNR-UHFFFAOYSA-N 375.494 2.805 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccccc1 253413024 SUGLCWZRPYGOGR-GPQLQYNLSA-N 383.536 2.929 0 50 GFAA biogenic Cc1ccc2c(c1)CN(C(=O)Nc1ccc(C[C@H]3CC(=O)NC3=O)cc1)CCO2 287242865 SWIQLKIIDBLXDH-INIZCTEOSA-N 393.443 2.627 0 50 GFAA COc1ccc(-c2ocnc2C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 288329886 LNOQJGPFXLQSHW-GFCCVEGCSA-N 383.370 2.964 0 50 GFAA CC(C)(C)[C@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C[C@@H]1O 298844693 IFDHTCWZFQDKJK-IRXDYDNUSA-N 381.480 2.750 0 50 GFAA CN1C(=O)C[C@@H](C(=O)NC2CCC(C(=O)O)CC2)[C@H]1c1cccc(Cl)c1 299746117 VJVVBLXLRGWOMZ-LJRFZVOVSA-N 378.856 2.619 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)O)C2)c(O)n1 426361050 BTUZJTFJUXFHKL-QYWGDWMGSA-N 381.432 2.601 0 50 GFAA O=C(NCc1cccs1)c1ccc(-c2nccc(N3CC[C@@H](O)C3)n2)cc1 426429130 ZHMBFUMQALCTAO-MRXNPFEDSA-N 380.473 2.706 0 50 GFAA O=C(NCC1(N2CCOCC2)CCOCC1)Nc1c2c(cc3c1CCC3)CCC2 459580119 KHECXIMYKZADQM-UHFFFAOYSA-N 399.535 2.667 0 50 GFAA Cc1ccc(NC(=O)c2cc(O)nc3ccccc23)cc1C(=O)N1CCOCC1 470442674 TWOQWTOZGHKPOX-UHFFFAOYSA-N 391.427 2.974 0 50 GFAA COc1cc2c(cc1CN1CCC(CNC(=O)Cn3ccnc3C)CC1)CCC2 824616738 UEYUORUYYZVNAK-UHFFFAOYSA-N 396.535 2.717 0 50 GFAA CCN1Cc2ccccc2C[C@@H]1C(=O)NCCc1csc(-c2ncccn2)n1 952872266 LPGVHHMHHYCVIK-GOSISDBHSA-N 393.516 2.706 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)c2cccc(Cn3cccn3)c2)n1 952966217 FCZBRFLOKXNOLS-SFHVURJKSA-N 395.463 2.871 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3cc(C4CC4)nc4ccccc34)C[C@H]2O)n[nH]1 1529120391 YXDJQDSLYZJAOK-QVKFZJNVSA-N 376.460 2.819 0 50 GFAA O=C(c1cccc(C(F)(F)F)c1)N1CCCN(C(=O)C2CCOCC2)CC1 1772706372 NTMPCTABTFIVLN-UHFFFAOYSA-N 384.398 2.807 0 50 GFAA COc1cccc(CN2C[C@H]3CN(C(=O)CN)C[C@]3(CCc3ccccc3)C2)c1 1772806587 BQYONTHBXZJGPV-URXFXBBRSA-N 393.531 2.547 0 50 GFAA Cn1c(CNC(=O)c2cc3c(s2)CCOC32CCNCC2)nc2ccccc21 1857685670 OSFNLGZHXXUJOO-UHFFFAOYSA-N 396.516 2.716 0 50 GFAA O=C(O)[C@H]1CN(Cc2cnn(-c3ccccc3Cl)c2)CC12CCOCC2 1857693875 QJEUDXHEWGCRNA-OAHLLOKOSA-N 375.856 2.839 0 50 GFAA CCc1noc(CNC(=O)C[C@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)n1 1857701526 MOWXPBWASOTLFV-CYBMUJFWSA-N 399.451 2.705 0 50 GFAA Cc1sc2nc(-c3cccnc3)nc(N(C)CCS(C)(=O)=O)c2c1C 1875254229 RTKHNSVKXNYGIP-UHFFFAOYSA-N 376.507 2.851 0 50 GFAA COc1ccc([C@H]2C[C@@H](C)N(S(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1 1875260151 VECIRGWFAYAGPU-CJNGLKHVSA-N 375.446 2.960 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCN(C(=O)C3(c4ccccc4F)CCC3)C2)ccn1 1875305714 ZEMOKKFKQGYRIP-QGZVFWFLSA-N 381.451 2.982 0 50 GFAA CCc1cncc(C(=O)N2CCC[C@@H](CCN=c3ccc4ncc[nH]c-4n3)C2)c1 1875327252 RQEUQODVOGOLFB-KRWDZBQOSA-N 390.491 2.710 0 50 GFAA CNC(=O)c1cc2cc(NC(=O)Cc3cnn(Cc4ccccc4)c3)ccc2[nH]1 1875334643 XPWJZQZUMLGDIP-UHFFFAOYSA-N 387.443 2.954 0 50 GFAA CS(=O)(=O)NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 1875390683 JRYHOGQUJBJPIT-UHFFFAOYSA-N 377.809 2.746 0 50 GFAA CNC(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)CCc1ccc3ccccc3n1)C2 1875394689 SGHSPFUICRCNTF-POZUXBRTSA-N 390.443 2.530 0 50 GFAA CCN(CC)c1ncc(Cl)c(C(=O)N(C)C[C@H](O)c2ccc(F)cc2)n1 2325708920 DGUSMLHCEYUZMP-HNNXBMFYSA-N 380.851 2.921 0 50 GFAA COCCn1c([C@H]2C[C@@H]2C)nnc1N1CCN(c2ncc(C)c(C(C)C)n2)CC1 2325769230 ZJBNVMYPKLFKTA-RDJZCZTQSA-N 399.543 2.596 0 50 GFAA O=C(Nc1cccc2c1CNCC2)[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 2325774682 IONOVEYAJYVDLW-MRXNPFEDSA-N 391.450 2.931 0 50 GFAA O=C1O[C@H]2C[C@@H](C(=O)N(CCn3ccnc3)Cc3cccc(Cl)c3)C[C@H]2O1 2325799284 FKJOCEDSFNHWLY-ACHSLPGTSA-N 389.839 2.879 0 50 GFAA CN1CCN(c2cccc(NS(=O)(=O)c3cnc(C(C)(C)C)o3)c2)C1=O 2325801886 ZJOGBTGKQAXTPZ-UHFFFAOYSA-N 378.454 2.645 0 50 GFAA O=C([C@H]1CCC[C@@H](CC(F)(F)F)C1)N(CCc1nn[nH]n1)Cc1cccnc1 2325808220 GKIDLLFPAPUTRI-HIFRSBDPSA-N 396.417 2.925 0 50 GFAA CCCn1cc(C(=O)N2CC(NC(=O)C3(c4ccccc4)CC(C)C3)C2)cn1 2325829613 NWERVHZNRDQGLK-UHFFFAOYSA-N 380.492 2.602 0 50 GFAA CCOC(=O)c1cn(CC)[nH]c1=NC(=O)NCc1ccc(-c2ccncc2)cc1 2325840168 RTGVLQUEBXGAPP-UHFFFAOYSA-N 393.447 2.885 0 50 GFAA O=C(N[C@H](CCO)C1CCC(F)(F)CC1)c1nnc2c(F)cccc2c1O 2325842477 ZTYJOICKMCNJMA-CYBMUJFWSA-N 383.370 2.781 0 50 GFAA CCn1ncc(CN(C)C(=O)c2ccc3nnc(-c4cccn4C)n3c2)c1C 2356134171 BUZJHHGBMNGCCQ-UHFFFAOYSA-N 377.452 2.532 0 50 GFAA C[C@@]1(O)CCOC2(CCN(Cc3cc(F)ccc3C(F)(F)F)CC2)[C@H]1O 2356147427 VUJVERHNIIKQSS-JKSUJKDBSA-N 377.378 2.711 0 50 GFAA O=C1C[C@H](c2ccccc2)NCCCCN(C(=O)c2ccncc2)CCCN1 2356161031 CRVHEBNPTWDZDS-HXUWFJFHSA-N 380.492 2.545 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 1049630 LUUXBTARIQADGH-UHFFFAOYSA-N 387.255 2.981 0 50 GFAA COc1c(C)cnc(CN(c2cccc(-n3cccn3)c2)S(C)(=O)=O)c1C 2356137717 WXFAFEBNFSOZHH-UHFFFAOYSA-N 386.477 2.859 0 50 GFAA O=C([C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12)N1CCc2ccccc2C1 2356141753 OIMLYSNFAGUIEP-WWEVIYMKSA-N 387.483 2.903 0 50 GFAA COc1cc(-c2ccc(C(=O)NC[C@@H](O)c3ccccc3)cc2)c(=N)[nH]c1C 2356165113 UBINXXGSHWZCIP-LJQANCHMSA-N 377.444 2.942 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2ccc(N3CCOCC3)cc2)C1=O 2356165427 IEAAKEFOIYIWCV-JOCHJYFZSA-N 385.508 2.529 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)N3CCC(C(=O)NC(C)(C)C)CC3)CC2=O)cc1 4731778 VPRQAFALQBRLEN-KRWDZBQOSA-N 385.508 2.501 0 50 GFAA COc1cc(CNC(=O)CC(=O)Nc2cc(C)ccc2C)cc(OC)c1OC 55370123 MUGZCFXBAIGPDE-UHFFFAOYSA-N 386.448 2.974 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)N(C)CCc2nc3ccccc3[nH]2)cc1 55393429 KCAGNXJBWVQGQK-UHFFFAOYSA-N 380.448 2.991 0 50 GFAA CC[C@H](CO)N(Cc1ccc(C)s1)C(=O)c1cccnc1N1CCOCC1 55242533 UITMULQDMJAHST-MRXNPFEDSA-N 389.521 2.701 0 50 GFAA CC(C)[C@@H](CO)NC(=O)c1cc(CN2CCC(Cc3ccccc3)CC2)on1 67712969 MEZMZHPCFXNURW-OAQYLSRUSA-N 385.508 2.876 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2cccc3nsnc23)[C@@H](c2ccccc2)CO1 248657519 APDTXAYTPTZMRU-SWLSCSKDSA-N 375.475 2.842 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CN3CCC(C)(C)CC3)C2=O)c1OC 67675566 DJHSRIHXJQEWHT-QFIPXVFZSA-N 390.524 2.679 0 50 GFAA CN(Cc1ccc2nonc2c1)C[C@@]1(O)CCCN(CC2CCCCC2)C1=O 67947506 UNUBWVSBKYPYOU-NRFANRHFSA-N 386.496 2.588 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@H](C)N[C@@H]1CCC[C@@H](C)[C@@H]1C 229587627 PVPXYCFOCWRKHO-GRZALLJUSA-N 395.569 2.987 0 50 GFAA C[C@H]1CN(c2ccccc2F)CCN1C(=O)Nc1ccc2c(c1)OCC(=O)N2 252481789 CRYZGFHECJJKLX-ZDUSSCGKSA-N 384.411 2.899 0 50 GFAA O=C(Cn1ccc(C(F)(F)F)n1)NCC1CCN(Cc2cccs2)CC1 145800990 KWGQEEWUXZXIDQ-UHFFFAOYSA-N 386.443 2.992 0 50 GFAA CN(CCCC1CCCC1)C(=O)C[C@@H]1C(=O)NCCN1CCc1ccccc1 12057564 UQHPIERXHPDDOD-OAQYLSRUSA-N 385.552 2.848 0 50 GFAA COc1ccccc1C[C@@H]1CCCN1C(=O)C1CCN(c2cnccn2)CC1 124207189 DKVUIXXQGCNCLH-IBGZPJMESA-N 380.492 2.935 0 50 GFAA Cc1cc(C)c2c(C(=O)N3CC4(CCNCC4)C[C@H]3C(=O)O)cc(C)nc2c1 72161801 KYUOSCPNOBGVMC-SFHVURJKSA-N 381.476 2.829 0 50 GFAA O=C(CN1CCCN(C(=O)c2cccc(Cl)c2)CC1)N1CCCCCC1 72031672 LUGXWUMABCWDFZ-UHFFFAOYSA-N 377.916 2.891 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@@H]2CCc3nc(C(C)C)nn3C2)CC1 375724809 NDWIUAMVJDHNHI-MRXNPFEDSA-N 398.511 2.673 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N2C[C@H](C3CC3)[C@H]2C2CC2)s1 333969015 UGNAMSDTFMFGSK-JFIYKMOQSA-N 394.562 2.857 0 50 GFAA COc1nc2c(cc1CN1CCO[C@H](Cc3ccccc3)C1)C(=O)N(C(C)C)C2 71771062 GCPPHWBUOITRKC-LJQANCHMSA-N 395.503 2.898 0 50 GFAA C[C@H]1CN(Cc2c(C(=O)N(C)Cc3ccccc3)nc3ccccn23)CCN1C 71440551 VSKYVHVYBJDLOZ-SFHVURJKSA-N 391.519 2.742 0 50 GFAA O=C(O)c1cc2cc(NC(=O)[C@@H]3CC34CCS(=O)(=O)CC4)ccc2s1 263288950 QLTVLOBNCPIKOK-LBPRGKRZSA-N 379.459 2.753 0 50 GFAA Cc1nc2c(c(C)c1CCC(=O)N1CCC[C@@H](C(F)(F)F)C1)c(=O)[nH]n2C 173783123 ZZDULYDADCDIJL-GFCCVEGCSA-N 384.402 2.612 0 50 GFAA CCc1nc(N)sc1C(=O)N1CCC2(CC1)CN(CCC(C)C)C(=O)O2 77302536 XGAXYWVOHRKLPM-UHFFFAOYSA-N 380.514 2.761 0 50 GFAA CCN1CCO[C@@H](CNC(=O)Nc2cc3n(n2)CCCC3)[C@@H]1c1ccccc1 287455678 VCOFBTWUMNEZDG-ICSRJNTNSA-N 383.496 2.803 0 50 GFAA COC(=O)c1ccc(NC(=O)N2CCN(Cc3csc(C)n3)CC2)c(C)c1 48116040 BJRMQJARWGPZCK-UHFFFAOYSA-N 388.493 2.896 0 50 GFAA N=c1cc[nH]cc1-c1cccc(C(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)c1 426506651 LUEPLHLNAUJXAS-GOSISDBHSA-N 378.476 2.636 0 50 GFAA CC1(C)[C@@H]2CC[C@H](CNC(=O)N(Cc3ccncc3)C[C@@H]3CCC(=O)N3)[C@H]1C2 426381453 NCRLXEOMAZYFBS-AKHDSKFASA-N 384.524 2.944 0 50 GFAA CCc1c(C(=O)NC[C@@H](c2ccccn2)N2CCOCC2)[nH]c2ccccc12 426669155 RXEUZEYNSLZJLW-FQEVSTJZSA-N 378.476 2.929 0 50 GFAA Cc1ccc2cccc(OCCNC(=O)c3cnc(C(C)(C)C)[nH]c3=O)c2n1 91894624 KWIAMEMSIGWGTK-UHFFFAOYSA-N 380.448 2.733 0 50 GFAA CN1CCC[C@]2(CCN(c3cc(Sc4cccs4)nc(N)n3)C2)C1=O 95376019 AKYSHFDKDXZRKK-QGZVFWFLSA-N 375.523 2.720 0 50 GFAA CC(=O)N1CCCN([C@@H](C(=O)O)c2ccc(OCc3ccccc3)cc2)CC1 95371770 ZBPXBUFAWQJWAJ-OAQYLSRUSA-N 382.460 2.946 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1cn3cc(Cl)ccc3n1)C2 91914723 QGTGMWOYBUHJNA-XJKSGUPXSA-N 386.883 2.851 0 50 GFAA CCc1noc(CN(CC)C(=O)[C@@H]2CCC(=O)N(Cc3ccccc3F)C2)n1 91441208 VOSGDPGLSDPGOA-OAHLLOKOSA-N 388.443 2.558 0 50 GFAA O=C(CCN1CCN(CC2CC2)[C@H](CCO)C1)Nc1cccc2ccccc12 244817021 SSXBSOVBYKLSGS-HXUWFJFHSA-N 381.520 2.947 0 50 GFAA CCc1nnc(NC(=O)CCN2CCCOc3c(cccc3OC)C2)s1 244701220 KCIGPKJZZYVIHI-UHFFFAOYSA-N 376.482 2.722 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)COc2ccccc2C=O)CC1 298822320 ZKSJPXZEHUCJOS-UHFFFAOYSA-N 380.444 2.607 0 50 GFAA COc1cccc(CCN(Cc2cccc(C)c2)C(=O)N[C@@H]2CCNC2=O)c1 534577321 YDBLGRUAKZILGJ-HXUWFJFHSA-N 381.476 2.646 0 50 GFAA NC(=O)C1(N2CCCCC2)CCN(C(=O)CC23CC4CC(CC(C4)C2)C3)CC1 827909584 MALNRAUJAWLMAR-UHFFFAOYSA-N 387.568 2.925 0 50 GFAA O=C(CCCc1cccs1)N[C@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3 670437242 RKSPKQVHLCYYPH-PHBIXPCASA-N 395.572 2.755 0 50 GFAA Cc1nncc(CNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)c1C 1875258905 CRMBTLLELVMZQO-UHFFFAOYSA-N 376.342 2.623 0 50 GFAA O=C(O)[C@H](CC1CC(F)(F)C1)NC(=O)[C@@H](c1ccccc1)N1CCCCC1=O 1875305555 FDFQTRXQFWGSAN-DOTOQJQBSA-N 394.418 2.745 0 50 GFAA O=S1(=O)CC[C@]2(C(F)(F)F)CN(Cc3csc([C@H]4CCCO4)n3)C[C@@H]21 1875392802 UWJPLDFGVKAKPE-DYEKYZERSA-N 396.456 2.546 0 50 GFAA COCCC1(c2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)CCC1 952893873 LHCPARLIGFUFIV-AWEZNQCLSA-N 387.484 2.743 0 50 GFAA O=C(Cc1cccnc1)NC[C@@H]1CCCN(C(=O)c2cccc3cc[nH]c23)C1 952970464 ISFGYOYJWFJKJC-KRWDZBQOSA-N 376.460 2.774 0 50 GFAA Cc1cc(NC(=O)CS(=O)(=O)Cc2ccccc2)n(-c2ccc(F)cc2)n1 1459140365 PENWGOITAPHOAE-UHFFFAOYSA-N 387.436 2.873 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)N[C@H]1CCc2c(nnn2C)C1 888093951 NWUGYKFPFYUYPZ-RZQQEMMASA-N 383.496 2.670 0 50 GFAA O=C(NC[C@H]1CN(c2ccnc3ccsc23)CCCO1)c1ccc(F)cn1 888103445 HMCKECRJWNWDNJ-AWEZNQCLSA-N 386.452 2.856 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(C(=O)[C@H]3C[C@H]4C=C[C@@H]3C4)CC2)CC1=O 1565526579 JXPIKLCWPLXUCQ-KSZLIROESA-N 383.492 2.845 0 50 GFAA Cc1cccc(Cl)c1C(=O)NC[C@@H]1CCCN(CC(=O)N2CCCC2)C1 1506406636 FFJALVXKVDFVHD-INIZCTEOSA-N 377.916 2.713 0 50 GFAA COc1cccc(OCC(=O)N2CCCN(Cc3ccc(C(=O)O)cc3)CC2)c1 1529109489 AQKOPUIBPWIRTN-UHFFFAOYSA-N 398.459 2.507 0 50 GFAA O=C(c1ccnc(N2CCCN(C3Cc4ccccc4C3)CC2)c1)N1CCCC1 1529151132 FNYXPQKOYSKYHD-UHFFFAOYSA-N 390.531 2.997 0 50 GFAA O[C@H]1CN(c2nc3c(c(C(F)(F)F)n2)CCCC3)C[C@H]1Cc1ccncc1 1704306214 SRTBVBPSELOPTP-CJNGLKHVSA-N 378.398 2.809 0 50 GFAA O=C(c1cccnc1N1CCC(c2nnc3ccccn23)CC1)N1CCCC1 1704336818 QMMVFHTYXHYKJC-UHFFFAOYSA-N 376.464 2.744 0 50 GFAA COCC(=O)N1C[C@H]2CN(c3ncccc3F)C[C@]2(CCc2ccccc2)C1 1772819357 SFPLOAQUZQURBW-AVRDEDQJSA-N 383.467 2.765 0 50 GFAA CCNC(=O)[C@@]12CCCN(C(=O)c3ccc(F)cc3Cl)[C@H]1CN(C)CC2 1775984447 URLWXUUITQPEQZ-QFBILLFUSA-N 381.879 2.542 0 50 GFAA OCCN1CCN(C2CCN(c3nc(-c4ccc(F)cc4)cs3)CC2)CC1 1772701239 KOXLSZVFFKZPHY-UHFFFAOYSA-N 390.528 2.528 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@H](Nc3ccc4c(c3)OCCO4)C2)n1 11820829 JZCTWJKVVLUBQG-SFHVURJKSA-N 384.480 2.764 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@@H](C(=O)NCCc4ccccc4)C3)CC2)CC1 12074452 UKZGPLUFDJEYBD-HXUWFJFHSA-N 397.563 2.848 0 50 GFAA COc1ccc2cc(C(=O)[C@@H]3CCCN(S(=O)(=O)N(C)C)C3)ccc2c1 12437369 AWRIJRJNRKRHNO-QGZVFWFLSA-N 376.478 2.550 0 50 GFAA COc1cc(C(=O)Nc2ccccc2C)c(N(C)S(C)(=O)=O)cc1OC 13582551 NKVVPPNWHOPHGB-UHFFFAOYSA-N 378.450 2.660 0 50 GFAA C[C@H]1CCCN(C(=O)[C@@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)C1 15067022 DTCYGQKHTLNRBP-AAEUAGOBSA-N 375.494 2.885 0 50 GFAA CCOC(=O)C1CCN(c2cc(C)nc3nc(Cc4ccccc4)nn23)CC1 16490127 VLXHHOXLDMICBE-UHFFFAOYSA-N 379.464 2.803 0 50 GFAA CC[C@]1(C)CC2=C(CO1)S[C@@H]1N=NN(CC(=O)NCc3ccco3)C(=O)[C@@H]21 169680215 MZTMBVBBWFQEPU-XYJFISCASA-N 390.465 2.637 0 50 GFAA COc1ccc(C(=O)N2CCC(n3cc(-c4nc(C5CC5)no4)nn3)CC2)cc1 169777450 XQSWXZHZQLZTIO-UHFFFAOYSA-N 394.435 2.691 0 50 GFAA CNC(=O)Cc1nc([C@]2(c3ccccc3F)CC2(C)C)n(CC(F)(F)F)n1 1857680195 DUPSNEJVWDFUGN-QGZVFWFLSA-N 384.377 2.984 0 50 GFAA COc1cc2c(cc1CN1CC[C@@]3(C1)Cn1c(nnc1C1CC1)CO3)CCC2 1857682503 LMOAOJYVYRJJQD-JOCHJYFZSA-N 380.492 2.828 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(Cc3nc(-c4ccco4)no3)CCN12 1857682664 LKMIEGKZBGOGJR-FQEVSTJZSA-N 380.404 2.579 0 50 GFAA CN1CCN(C(=O)NCC2(c3ccc(F)cc3)CC2)C[C@@H]1c1nc(C2CC2)no1 375496602 RCPAPSYZAYSWPB-QGZVFWFLSA-N 399.470 2.816 0 50 GFAA O=C1N[C@H]2CN(C(=O)c3ncoc3-c3cccc(C(F)(F)F)c3)CC[C@@H]2CO1 844121240 DPELCHJIDNYAOJ-YPMHNXCESA-N 395.337 2.931 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccccc2NCc2ccccn2)CC[C@H]1O 2100545314 ONPQWKIAWOBYJV-DENIHFKCSA-N 397.475 2.772 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)NC(=O)N[C@@H]1c1ccc(Cl)cc1 20500933 LLBMGSFAONGESO-MRXNPFEDSA-N 395.912 2.560 0 50 GFAA CC(C)N1C[C@H](NC(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)CC1=O 1477970104 MZYHDEZVSYBOKY-CQSZACIVSA-N 399.322 2.834 0 50 GFAA CCOc1ccc(N(CC(=O)Nc2cccc(C(C)=O)c2)S(C)(=O)=O)cc1 835386 ZTRFSJCKFDVNNM-UHFFFAOYSA-N 390.461 2.693 0 50 GFAA CCC[C@H]1[C@H]2C[C@H](CN(C(=O)c3nc4ncccc4[nH]3)C2)c2cccc(=O)n21 2356158942 FVSMFSMAFPZDDD-LZWOXQAQSA-N 377.448 2.720 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc4cc[nH]c4n3)C1)CC2 2356163142 ZHSPVHFKDVPQEM-OAQYLSRUSA-N 376.464 2.539 0 50 GFAA COc1ccc(CCC(=O)NCCNC(=O)CCc2ccc(OC)cc2)cc1 4892597 WLJDMSNLNPXAKX-UHFFFAOYSA-N 384.476 2.502 0 50 GFAA O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCOCC1 7000972 ZZPGGMIFDQKTPM-UHFFFAOYSA-N 397.456 2.508 0 50 GFAA COc1cc(F)ccc1N1CCN([C@H](C)C(=O)N2CCc3ccccc3C2)CC1 115739452 VXUNIMZPBCGPKF-QGZVFWFLSA-N 397.494 2.930 0 50 GFAA COc1ccc(-n2ccnc2CN2CCN(CC=C(C)C)[C@H](CCO)C2)cc1 104631141 NPUQZVKCLXRXJJ-HXUWFJFHSA-N 384.524 2.716 0 50 GFAA CCc1oc(C(N)=O)cc1CN1CC=C(c2cnn(-c3ccccn3)c2)CC1 65396727 RFXGSDBWLNDEST-UHFFFAOYSA-N 377.448 2.811 0 50 GFAA CCCn1nc2c(c1C)[C@H](c1ccc(OCC(N)=O)c(Cl)c1)CC(=O)N2 65406235 LFOJNLIWXBVZBM-LBPRGKRZSA-N 376.844 2.593 0 50 GFAA Cc1[nH]c2c(C(=O)N3CCC[C@H](Cn4cc(C(=O)O)nn4)C3)cccc2c1C 67769672 PWGWTNRQOFNISF-AWEZNQCLSA-N 381.436 2.627 0 50 GFAA O=C(c1ccccc1-c1nc[nH]n1)N1CCC(CO)(Cc2ccccc2)CC1 67804432 GOSNTECSWSXPND-UHFFFAOYSA-N 376.460 2.929 0 50 GFAA CS(=O)(=O)Cc1cccc(C(=O)N2CCc3c(cnn3-c3ccccc3)C2)c1 479342661 KGXFXVMNUOFTGA-UHFFFAOYSA-N 395.484 2.615 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@@H](C)Oc4cc(F)ccc43)ccc21 172897468 IUBLCVDGPFVNMS-GFCCVEGCSA-N 390.436 2.711 0 50 GFAA Cc1cc(C)c(CNC(=O)N2CCN([C@@H](C(N)=O)c3ccccc3)CC2)c(C)c1 125109491 CJVOSWWGTAGIDT-OAQYLSRUSA-N 394.519 2.666 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(Cc3ccoc3)CC2)C1 71730322 NXVAORJKCLSEJE-HXUWFJFHSA-N 382.508 2.667 0 50 GFAA CN(CCc1ccc(F)cc1)C(=O)[C@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C 368646444 VCDNTWQMJCMXRH-GHTZIAJQSA-N 398.482 2.702 0 50 GFAA O=C(O)[C@@H]1CC2(CCNCC2)CN1C(=O)C(c1ccccc1)c1ccccc1 72166313 QLICXCFZDXIXEJ-IBGZPJMESA-N 378.472 2.874 0 50 GFAA Cc1cccc(C)c1OCCC(=O)N1CCC[C@@H]1c1nc(C(=O)NC2CC2)no1 372795354 HNOVRVFVDUTWRY-MRXNPFEDSA-N 398.463 2.711 0 50 GFAA O=C(O)CN(Cc1ccc(F)cc1)C(=O)c1ccc(CN2CCCC2=O)cc1 262917361 KBHAGXAGVMYNGY-UHFFFAOYSA-N 384.407 2.675 0 50 GFAA O[C@H]1C[C@@H]2CN(Cc3cnc(-c4cccc5ccccc45)nc3)C[C@@H]2C[C@H]1O 72162903 UJONANRBAULLJG-MTIDIVMFSA-N 375.472 2.860 0 50 GFAA Cc1ccc(Sc2cc(N3CCC[C@]4(CN(C)C(=O)O4)C3)nc(N)n2)cc1 72479265 ARDMQOBWWXBNED-IBGZPJMESA-N 385.493 2.939 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cc1 378597557 QSVBLURWGZJNOM-QGZVFWFLSA-N 380.423 2.767 0 50 GFAA CCOC(=O)CN1CCC2(CC1)CCN(C(=O)c1cccc(F)c1F)CC2 72158777 QHRJPPYVPSTGNK-UHFFFAOYSA-N 380.435 2.846 0 50 GFAA CC(=O)N1CCCN(Cc2cccc(S(=O)(=O)N(C)C)c2)c2ccccc21 174866853 AXTLUNFRAHCPAT-UHFFFAOYSA-N 387.505 2.700 0 50 GFAA CS(=O)(=O)C1CCC(NC(=O)N2CC=C(c3ccc(O)cc3)CC2)CC1 175486944 MWXSLDCZYKWRCP-UHFFFAOYSA-N 378.494 2.547 0 50 GFAA CCc1cc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4cccnc4)C3)C2)no1 82171059 GVWAIEDSBKNBSE-NRFANRHFSA-N 382.464 2.677 0 50 GFAA CC(C)N1CCC[C@H](CNC(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)C1 291112939 XDPXYCQWIJHKGI-DENIHFKCSA-N 391.531 2.883 0 50 GFAA O=C(c1ccc(-c2nc3ccccc3n2CCO)cc1)N1CCCC[C@H]1CO 426425497 TWCOFEVTTUTRLX-SFHVURJKSA-N 379.460 2.683 0 50 GFAA COc1ccc(N2CCN(C(=O)NCc3ccc4c(c3)CCO4)[C@H](C)C2=O)cc1 426698514 XFIZZZIAHFWSEL-OAHLLOKOSA-N 395.459 2.577 0 50 GFAA CCn1ncc(NC(=O)Cn2cc(-c3nc4cc(C)ccc4cc3C)cn2)n1 23506894 FEYZFBFNKBWITJ-UHFFFAOYSA-N 375.436 2.965 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1nc(Cc2ccccc2)cs1 184493455 YSBAMVRVMGXBQT-UHFFFAOYSA-N 393.516 2.890 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N(C)C[C@@H]2CCCC[C@H]2O)CC1 182533799 JOYYZWQZVQLUFQ-QFBILLFUSA-N 375.513 2.857 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(N2C(=O)CCC2=O)c1 298442178 VUNYTNIKTLGLNT-IBGZPJMESA-N 391.471 2.734 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CCC[C@]3(CCNC3)C2)s1 1506428206 YEWLVRBBTBECMU-QGZVFWFLSA-N 381.523 2.784 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)c2cccc(-n3cc(Br)cn3)c2)C1 299743580 LLRNMUVJQXFMFM-MRXNPFEDSA-N 378.226 2.572 0 50 GFAA CN(C(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)[C@@H]1CCNC1 299738660 DVLOZGITXQEKMR-CQSZACIVSA-N 379.386 2.597 0 50 GFAA COc1ccc(-c2noc(CNC(=O)c3cc(C)n(C(F)F)n3)n2)cc1OC 1940193578 CZOCZKCIGPJLPO-UHFFFAOYSA-N 393.350 2.584 0 50 GFAA Cc1nc([C@@H](C)N(C)C(=O)NCCn2ncc3ccccc3c2=O)c(C)s1 584899731 FJKYGRMRFOZZRT-GFCCVEGCSA-N 385.493 2.872 0 50 GFAA C[C@H](NC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1)[C@@H](C)n1cncn1 1875264567 HPJJSHFGZGFWKC-QWHCGFSZSA-N 397.439 2.889 0 50 GFAA O=C(NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)NC[C@@H]1CC(F)(F)CO1 1875301749 SHKFOZXLALOQSR-JSGCOSHPSA-N 396.356 2.580 0 50 GFAA O=C1N[C@H](Cc2c[nH]c3cccc(F)c23)C(=O)N[C@H]1Cc1cc2ccccc2o1 1875320243 MLAUQOJSGGLQLU-MSOLQXFVSA-N 391.402 2.822 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(Cc3ccccc3)CC3(O)CCOCC3)n[nH]c21 1875394172 XAJXNSYSCVMXKG-CVEARBPZSA-N 399.491 2.616 0 50 GFAA O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NN1CCc2ccccc2C1 1875341657 BFOXPKHXLXMBMA-UHFFFAOYSA-N 381.520 2.799 0 50 GFAA Cc1nc(CCC(=O)N2C[C@H]3C[C@H](c4ccccc4)CC[C@@]3(C(=O)O)C2)n[nH]1 1565529463 DSATUIOGBFCMOT-CBGDNZLLSA-N 382.464 2.543 0 50 GFAA O=C1C[C@H](C(=O)N2C[C@@H](O)C[C@@H]2c2ccc(F)cc2)CN1c1ccc(F)cc1 770185809 FHZTYZYUJCROEE-ZOCIIQOWSA-N 386.398 2.652 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)c2cc(O)nc3c(F)cc(C)cc23)C1 779853867 JXBLUHZFIFSPAZ-IAQYHMDHSA-N 386.383 2.682 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)[C@H]3CC(=O)OC34CCCC4)CC1)OCC2 1704337417 WYIXMCYHKLBHTO-QGZVFWFLSA-N 399.487 2.962 0 50 GFAA C[C@]1(O)CCOC2(CCN(C3CCN(C(=O)c4cccs4)CC3)CC2)C1 1704304471 FFEMGDTWNFVSIH-IBGZPJMESA-N 378.538 2.749 0 50 GFAA COc1ccc2ccc(OC)c(CN3C[C@H](Cc4cnccn4)[C@@H](O)C3)c2c1 1616078130 WTWBMUFRYROUAP-KKSFZXQISA-N 379.460 2.682 0 50 GFAA CN(C)C[C@]12CN(C(=O)C3CCC3)C[C@H]1CN(c1ccc3ccccc3n1)C2 1772804351 NAYFIFPAGAMKHA-XXBNENTESA-N 378.520 2.861 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N1CCN(S(=O)(=O)c2ccccc2)CC1 5392588 FSFLQDXFBVUABB-UHFFFAOYSA-N 397.500 2.634 0 50 GFAA CC(C)OCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14531593 VSTDNIXWEADEOI-GOSISDBHSA-N 384.524 2.564 0 50 GFAA O=C(NCc1cccs1)[C@@H]1CNC[C@H](C(=O)Nc2ccc3c(c2)CCC3)C1 14745978 NECFLGGFEPFHJL-DLBZAZTESA-N 383.517 2.717 0 50 GFAA COc1ccc(C(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c(C)c1 19144893 IRJJKHFMYWDPCZ-HNNXBMFYSA-N 391.493 2.627 0 50 GFAA CCOc1ccc(C(=O)NCCNc2ccc(-n3nc(C)cc3C)nn2)cc1 19924231 JVSFHOFLHRDINP-UHFFFAOYSA-N 380.452 2.520 0 50 GFAA COc1ccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccc(C)cc3)CC2)cc1 169779802 SZFXYCVSTXHKHS-UHFFFAOYSA-N 392.459 2.897 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cc(F)cc(Cl)c3)C[C@]23CC[C@H]1O3)C1CC1 1857722881 RKRNOYZXWQXWBM-JRBPQWBISA-N 378.875 2.985 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)c1ccc(Cl)c(Cl)c1 104255665 YEFCTMCIJSAHED-AJABAVSMSA-N 377.227 2.691 0 50 GFAA C[C@H]1C[C@@H](O)CN1C(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 408295636 VSFQCOJZEOQZDC-SMDDNHRTSA-N 390.281 2.719 0 50 GFAA O=C(NCc1cccc(NC(=O)C2CCC2)c1)N[C@H]1c2ccccc2C[C@@H]1O 123560767 GNTDEOMXSAEEIX-PMACEKPBSA-N 379.460 2.883 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3CC(C)(C)Oc4ccccc43)CC2)n1 124694954 YGXYZUJMMHTAEB-UHFFFAOYSA-N 382.464 2.906 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N(CCC(=O)O)C3CCOCC3)cc2)n1 237659687 RLWLSVWPFXNTQC-UHFFFAOYSA-N 385.464 2.644 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CCNC2)cc1S(=O)(=O)Nc1cccc(Cl)c1 150689304 MNZOHVHQONUPJG-CYBMUJFWSA-N 393.896 2.997 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCNC[C@H]2c2cccc(Cl)c2)c1C 261636597 DFBZBLUJWCKTRH-INIZCTEOSA-N 379.913 2.743 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2ccc(N3CCCC3)c(F)c2)C1=O 163795405 KJIYZENCICNZSB-QGZVFWFLSA-N 397.450 2.970 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CC[C@]2(C[C@H](O)c3ccccc3O2)C1 818410065 XZYGRDZQYNIXAO-ICPLQIHGSA-N 392.455 2.527 0 50 GFAA C=CC(=O)N(C)CC(=O)N[C@H]1CC2(CCC2)Oc2ccc(Br)cc21 928929671 TYWNTRJJQDUAQB-AWEZNQCLSA-N 393.281 2.956 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)NS(=O)(=O)Cc1cccc(F)c1F 842872709 GSRLKLKDEXVZCB-MRXNPFEDSA-N 381.400 2.615 0 50 GFAA COc1ccccc1N1CCN(S(=O)(=O)c2ccc(SC)cc2)CC1 716296 UGNHXSVEYAADJK-UHFFFAOYSA-N 378.519 2.928 0 50 GFAA O=C(C[C@@H]1CC1(Cl)Cl)NC[C@@H]1C[C@H](F)CN1C(=O)[C@@H]1CC=CCC1 2325823037 CKATZHZMZYLFBI-MQYQWHSLSA-N 377.287 2.982 0 50 GFAA O=C1NCc2cccc(C(=O)N3CC[C@]4(CCN(Cc5ccccc5)C4)C3)c21 2325887734 ODHUBZKZUQCIEM-QHCPKHFHSA-N 375.472 2.668 0 50 GFAA Cc1cc(C)nc(N2CCN(C(=O)c3cccc(Br)c3)CC2)n1 758010 JMCLEYQENQYBGE-UHFFFAOYSA-N 375.270 2.818 0 50 GFAA COC(=O)c1ccccc1NC(=O)[C@@H](C(C)C)N1C(=O)c2ccccc2C1=O 1134194 XFXPTUAXCNPABR-QGZVFWFLSA-N 380.400 2.733 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccccc2OC)S(C)(=O)=O)cc1Cl 1136998 WXWFTBIHKHDJDK-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC(OC(F)(F)F)CC1 2356154936 QHUAPBCVTRDVQH-UHFFFAOYSA-N 381.372 2.537 0 50 GFAA CCn1c(SCC(=O)Nc2nncs2)nnc1-c1ccc(OC)cc1 4816356 WHZFLSGPRAGGDP-UHFFFAOYSA-N 376.467 2.556 0 50 GFAA CCn1cc(Br)c(C(=O)NC(=S)Nc2ccc(C(C)=O)cc2)n1 1002754 OCAXOEITFRVWGY-UHFFFAOYSA-N 395.282 2.995 0 50 GFAA CC(C)C[C@@H](NC(=O)c1cccnc1)c1nnc2n1CCN(CC(C)C)CC2 20542900 XKTVQZNAVJIKQO-GOSISDBHSA-N 384.528 2.704 0 50 GFAA Cc1nc2cc(N3C[C@H](C(=O)Nc4ccccc4C(N)=O)CC3=O)ccc2s1 170564219 BFBAXKRCQAVUIF-GFCCVEGCSA-N 394.456 2.695 0 50 GFAA CCN1C[C@H](NC(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)CC1=O 67588587 SIIHIHOIEDGTNZ-GFCCVEGCSA-N 397.353 2.623 0 50 GFAA O=c1oc2ccccc2n1CCN1CCc2nc[nH]c2[C@H]1c1cccc(O)c1 67919719 OHWQSCLVTUXQAO-HXUWFJFHSA-N 376.416 2.671 0 50 GFAA C[C@@H]1C[C@H]1[C@@H](NC(=O)Cn1nc2n(c1=O)CCCCC2)c1ccc(Cl)cc1 230218811 AEVLHFKWGHQRGH-NRXGSXMXSA-N 388.899 2.938 0 50 GFAA CCCn1ncc(-c2ccnc(N3CCN(c4ccccc4)C(=O)C3)n2)c1C 63855559 ISWWUKJPQKOQMB-UHFFFAOYSA-N 376.464 2.912 0 50 GFAA COC(=O)[C@H]([C@@H](C)O)N(Cc1ccccc1)C(=O)[C@@H](C)Sc1ccccn1 328596477 ULIMKDYRBNAYJV-RKVPGOIHSA-N 388.489 2.513 0 50 GFAA COc1ccc(Cc2nnc(-c3nn(C)cc3I)o2)cc1 2803008 RXZGXSBNWGSZFM-UHFFFAOYSA-N 396.188 2.674 0 50 GFAA COc1cccc(C(=O)NCCNC(=O)Nc2cccc(-c3nccn3C)c2)c1 150872043 ZNFRQBCWNASQGO-UHFFFAOYSA-N 393.447 2.647 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)cc1 39515491 XEGZQQJQKKAJME-JOCHJYFZSA-N 385.483 2.853 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)c2cccc(CCC(C)(C)O)c2)C1 72481117 FKKPWSNELIFPJK-SFHVURJKSA-N 383.492 2.859 0 50 GFAA CSc1ccc([C@@H]2CC(=O)Nc3c2c(C)nn3-c2ccc3nncn3n2)cc1 33011408 MDRUAPFDMLCGNA-AWEZNQCLSA-N 391.460 2.814 0 50 GFAA C[C@@H](C(=O)N1CCc2sccc2C1)N1CCc2c(nnn2-c2ccccc2)C1 366602350 NDNWYOZINKWWBH-HNNXBMFYSA-N 393.516 2.660 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1ccc(F)c(C(=O)O)c1 218288134 RABJTDWCRGLIBA-AWEZNQCLSA-N 389.335 2.781 0 50 GFAA CC(C)c1noc(CCC(=O)N2CCC(O)(Cc3ccccc3F)CC2)n1 373350255 LVHJEGNDSAHITB-UHFFFAOYSA-N 375.444 2.861 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)[C@@H](Oc2ccc(F)c(F)c2)c2ccccc2)CCO1 262465258 XIHGBRYFZUBVNF-BEFAXECRSA-N 391.370 2.787 0 50 GFAA O=c1n(Cc2ccc(F)c(F)c2)nc(C2CCNCC2)n1Cc1ccccc1 71614312 QUWSJCNYOBIGQR-UHFFFAOYSA-N 384.430 2.887 0 50 GFAA COc1ccc(N2CCN(C(=O)N[C@H](C)c3cc(F)ccc3OC)CC2)nc1 454281884 QVAPRANGHAPXOL-CQSZACIVSA-N 388.443 2.831 0 50 GFAA CC(C)[C@@H](CNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1)Cc1ccccc1 240407386 FLWJJAQKJOWVJK-QGZVFWFLSA-N 395.546 2.883 0 50 GFAA C[C@@H]1CN(C(=O)C2(N(C)CCc3ccccc3)Cc3ccccc3C2)CCN1 72163969 GEFWOZBUHRNWLR-LJQANCHMSA-N 377.532 2.519 0 50 GFAA COCC(COC)NC(=O)[C@H]1CCCc2sc(Nc3ccccc3)nc21 456234201 ZSEOPHGGJRRBHJ-HNNXBMFYSA-N 375.494 3.084 0 50 GFAA COc1ccc(Cl)cc1C(=O)NCc1cc2n(n1)CCN(CC(C)C)C2 82126761 VVHAWUFOABNKOL-UHFFFAOYSA-N 376.888 2.947 0 50 GFAA Cn1nncc1CNC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2 288572247 JZKLMSNUAQVNKU-UHFFFAOYSA-N 391.262 2.726 0 50 GFAA CSCC[C@@H](NC(=O)c1n[nH]c2c1CCCCC2)c1nnc2ccccn12 190302736 DMVKHPGXSPAIAI-OAHLLOKOSA-N 384.509 2.946 0 50 GFAA Cc1cc(C)n(C[C@H](C)CNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)n1 20607538 BZZPNKQXTOPWPM-LLVKDONJSA-N 383.418 2.656 0 50 GFAA CCCC[C@H]1CN(c2ccc(Cl)cc2)C(=O)CN1C(=O)CCNC(C)=O 82087425 WQKGPTRDUYDISO-KRWDZBQOSA-N 379.888 2.600 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)N(C)[C@H](C)c2ccc3c(c2)OCCO3)cc1 426445683 VDBZHCNNDLXYKY-CQSZACIVSA-N 393.447 2.504 0 50 GFAA O=C(c1cn(CC(=O)N2CCC(c3nc[nH]n3)CC2)c2ccccc12)C1CC1 426674302 SAVITLXSLLAUIK-UHFFFAOYSA-N 377.448 2.758 0 50 GFAA COc1ccc(-n2nc(-c3ccncc3)nc2CCN2CCCCC2=O)cc1 96153525 JXAPSTNAWIGNLT-UHFFFAOYSA-N 377.448 2.893 0 50 GFAA COCCCN1CC2(CCN(C(=O)c3cn(C)c4ccccc34)CC2)CC1=O 95387658 LKMOJLLWBVNJGB-UHFFFAOYSA-N 383.492 2.670 0 50 GFAA CN(CC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)C1CCC1)C2)Cc1ccc(F)cc1 91877064 DZDGKZOEJVYBFU-FXAWDEMLSA-N 387.499 2.507 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)c2cnc(COc3ccccc3)[nH]c2=O)on1 91689926 FTMMYOCRRUKQOK-INIZCTEOSA-N 380.404 2.623 0 50 GFAA CCN(Cc1ccncc1)C(=O)[C@H]1CNC[C@@H](C(=O)Nc2ccc(C)cc2)C1 91755576 RVLPXDDVKSOCLX-RBUKOAKNSA-N 380.492 2.603 0 50 GFAA CCOC(=O)[C@H]1CCCN(CC2=CC(C)(C)N3C(=O)C(=O)c4c(C)ccc2c43)C1 334160857 NQIFOPXGLVIVLQ-HNNXBMFYSA-N 396.487 2.975 0 50 GFAA Cc1nccn1[C@H](C)C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2CC(C)C 95519148 GBZCSQRPPFCURN-MRXNPFEDSA-N 384.528 2.508 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)[C@H]2CCC[C@H](O)C2)CC1 1940196968 INOCSXIGEIZTMU-GJZGRUSLSA-N 387.524 2.837 0 50 GFAA COc1ccc(OC)c([C@@H](C)NC(=O)N2CCN(C3CCCCC3)C(=O)C2)c1 584892010 PBOHCPQJRZFXMM-OAHLLOKOSA-N 389.496 2.951 0 50 GFAA OC[C@@H]1CN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C1CCOCC1 1875307648 HRZYJTWMWBJBOX-UHOSZYNNSA-N 387.442 2.576 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)c3csc(N4CCNCC4)n3)cc2)c1C 1875357247 YIEPGPOYVPBMMB-UHFFFAOYSA-N 382.493 2.608 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)s1 952966991 GHXBBRDWJWLTOT-OAHLLOKOSA-N 393.534 2.591 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)c3ccccc3-n3cncn3)cc2)CC1 952978706 STBIQCJHNLNRQU-UHFFFAOYSA-N 377.448 2.993 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(Cc3ccc(-c4cc[nH]n4)o3)C2)N1Cc1ccccn1 1565526681 VIRQXSUSKNZZJL-WBVHZDCISA-N 377.448 2.688 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@H](n3cc(C(=O)O)cn3)C2)sc1Cl 276479686 IBIKCHJQQHCSMT-NSHDSACASA-N 389.886 2.630 0 50 GFAA CCCN(Cc1ccc(F)cc1)C(=O)c1cnn2c1C[C@@H](CNC(C)=O)CC2 276964418 PNRJLRITASYHBL-KRWDZBQOSA-N 386.471 2.773 0 50 GFAA C[C@H](NC(=O)c1cccs1)C(=O)N[C@H](CC(=O)O)c1ccc(Cl)c(F)c1 170592129 JPXTYANJFCGXMN-TVQRCGJNSA-N 398.843 2.991 0 50 GFAA CCc1nnc(N2CCC(CNC(=O)CCc3nc4ccccc4[nH]3)CC2)s1 1506415397 XVETULMPELAMJZ-UHFFFAOYSA-N 398.536 2.942 0 50 GFAA Cc1cccc(CNS(=O)(=O)c2ccc(-c3cc(C(F)(F)F)n[nH]3)o2)n1 1506422187 OWQUEKSNFZBVGJ-UHFFFAOYSA-N 386.355 2.870 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529167993 SVYOZMXZVQVFEH-IFMALSPDSA-N 391.471 2.875 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)CCN1C 1704326063 VJMHGGRSBQQHTG-CQSZACIVSA-N 390.459 2.722 0 50 GFAA Cc1ccn2cc(C(=O)N3CCCN(C(=O)c4sc(C)nc4C)CC3)nc2c1 1772700579 AQZUHYOMDCTFQG-UHFFFAOYSA-N 397.504 2.704 0 50 GFAA CN(CCCC1CCCC1)Cc1cnc(S(C)(=O)=O)n1C[C@H]1CCCO1 11936031 GUGADLZVHBRRDL-GOSISDBHSA-N 383.558 2.868 0 50 GFAA CC(=O)c1ccccc1-c1ccc2c(c1)C[C@H](CNC(=O)c1ccc[n+]([O-])c1)O2 11973835 ASQUQTRPEHOCIU-LJQANCHMSA-N 388.423 2.923 0 50 GFAA COc1ccccc1N1CCN(c2ncccc2CNc2cnccn2)CC1 15074281 PXFLHPWCJXMSHT-UHFFFAOYSA-N 376.464 2.819 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4cc(C)ccc4C)nnc23)n1 169776216 AXONTQBXFAZVTA-UHFFFAOYSA-N 376.420 2.889 0 50 GFAA O=C(O)Cc1ccc(CN2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cc1 1857689524 RQZFCTAXQMYDPU-QFIPXVFZSA-N 380.444 2.563 0 50 GFAA Cc1ccc(CN2CC3(CCN(C(=O)c4ccccn4)CC3)OCCC2=O)cc1 1857723269 XTRIAVXQCKRTRG-UHFFFAOYSA-N 393.487 2.814 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)N[C@H]1C[C@H]2CO[C@@H](CCO)CN2C1 1857731277 NLZQHUUXZOPCEP-WFXMLNOXSA-N 397.475 2.825 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857735840 CIIZLSCLMSTJFF-GMAHTHKFSA-N 399.462 2.579 0 50 GFAA COc1cc2nc(N3CCN4[C@@H](C5CC5)COC[C@H]4C3)cc(C)c2cc1OC 1875241018 LNDGUOSXUWUIAH-VQIMIIECSA-N 383.492 2.860 0 50 GFAA CSCCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(C)s3)C[C@]23CC[C@H]1O3 1875242410 RANBOVHCXBMHPJ-DODZYUBVSA-N 380.579 2.905 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cccc(N3CCCC3=O)c2)C[C@@H]1c1ccccc1 219418252 QJTNACQIHVKZBU-RTBURBONSA-N 378.428 2.754 0 50 GFAA Cc1nc(C2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(N3CCNC3=O)ccc2F)no1 828811365 MUPITEYAPYTNDW-LQDVMPOASA-N 399.426 2.598 0 50 GFAA O=C(NCC1CCN(c2ncnc3[nH]ccc23)CC1)c1cc(C(F)(F)F)no1 2325803701 WMHLPKFGNWHRBF-UHFFFAOYSA-N 394.357 2.611 0 50 GFAA O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)N[C@H]1COC[C@H]1O 2325822984 AOHVHHDDFFSGLB-RBUKOAKNSA-N 386.398 2.922 0 50 GFAA CNc1cncc(-c2noc(-c3cccc(S(=O)(=O)NC(C)(C)C)c3)n2)c1 2325850333 VABRMSFHRVXVKB-UHFFFAOYSA-N 387.465 2.917 0 50 GFAA CCN1C=C(C(=O)OC)C(c2cc3c(cc2Cl)OCO3)C(C(=O)OC)=C1 1170734 MFUUCXXGXNZRGQ-UHFFFAOYSA-N 379.796 2.602 0 50 GFAA COc1ccc(C(=O)N(Cc2ccc(F)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 4855523 RIGOGORIHFLUFS-QGZVFWFLSA-N 377.437 2.664 0 50 GFAA CC(C)NC(=O)C1CCN(C2CCN(Cc3cc(C(C)C)[nH]n3)CC2)CC1 11664729 WRWTVXXXQLWRRS-UHFFFAOYSA-N 375.561 2.734 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3ccon3)n[nH]2)c(Cl)c1 12316632 DTGDIDXVCAHNML-UHFFFAOYSA-N 376.800 2.911 0 50 GFAA CC(C)c1ccc(/C=c2\sc3nc(=O)c(Cc4ccccc4)nn3c2=O)cc1 13750659 POZQTWYQUZJTRN-UYRXBGFRSA-N 389.480 2.773 0 50 GFAA Cc1ccn2c(=O)c(C(=O)N3CCCC[C@@H]3CCn3ccnc3C)cnc2c1 19113953 BRRJAEIRSITFDU-QGZVFWFLSA-N 379.464 2.593 0 50 GFAA OCC[C@H]1CN(Cc2ccc3nonc3c2)CCN1CCCc1ccccc1 20203635 XUYSSIKSRHIGFI-FQEVSTJZSA-N 380.492 2.724 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)NC(=O)N[C@H]1c1ccc(Cl)cc1 20500935 LLBMGSFAONGESO-INIZCTEOSA-N 395.912 2.560 0 50 GFAA OCC[C@H]1CN(Cc2cccc3nonc23)CCN1CCCc1ccccc1 20598455 BHNQPJPMOXMXMT-FQEVSTJZSA-N 380.492 2.724 0 50 GFAA COCCN1CC[C@H](C(=O)Nc2cccc(NC(=O)Cc3ccccc3)c2)C1 55359004 ONFJMJAEQDXAKH-SFHVURJKSA-N 381.476 2.775 0 50 GFAA O=C1C[C@H](NC(=O)c2cc(Cn3cnc4ccccc43)on2)c2ccccc2N1 67855693 WKJLDWBXDZZJGM-KRWDZBQOSA-N 387.399 2.886 0 50 GFAA O=C(NCCc1ccco1)[C@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71736189 HXRRIPPUOGGUJJ-FQEVSTJZSA-N 396.535 2.710 0 50 GFAA O=C([C@H]1CCCN1)N1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 91574379 ULVWEFZNXKUALN-HXUWFJFHSA-N 385.458 2.950 0 50 GFAA CC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(Cl)c(C)c1)CC2 91643324 HBDKVPRPLVAQHL-UHFFFAOYSA-N 386.883 2.908 0 50 GFAA COc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4cccnc4)C3)CC2)ccn1 91997400 CBLUJCWLPXBQQC-UHFFFAOYSA-N 394.475 2.530 0 50 GFAA Cc1cc(C)c2[nH]c(C)c(CC(=O)NCc3nc(-c4ncccn4)no3)c2c1 92037559 APZXCSXJPISXRV-UHFFFAOYSA-N 376.420 2.792 0 50 GFAA COc1cccc(NC(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)c1 95379011 ZFAYTPMIGHQNFE-MAUKXSAKSA-N 380.448 2.859 0 50 GFAA CC(=O)N[C@@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)C[C@H]1c1ccc(C)o1 95512517 TYOJMCZRDVNXBE-CRAIPNDOSA-N 380.448 2.528 0 50 GFAA O=c1cc(CSc2ncccn2)[nH]c2nc(SCc3ccccc3)nn12 100071775 AUYSIYZKIDDVHQ-UHFFFAOYSA-N 382.474 2.792 0 50 GFAA Fc1ccc2c(c1)N(Cc1nnnn1-c1ccc(OC(F)F)cc1)CCO2 131626537 MLOLNDAUHKKDQP-UHFFFAOYSA-N 377.326 2.802 0 50 GFAA N[C@H]1CCCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 157988846 PYHKHZSFPXRWLA-LBPRGKRZSA-N 378.270 2.986 0 50 GFAA CCCCOCCOCCOCCS(=O)(=O)N(C)c1cc(F)ccc1F 170595644 JRISRHPICSOESX-UHFFFAOYSA-N 395.468 2.581 0 50 GFAA Cc1nc(-c2ncccn2)sc1C(=O)N1Cc2ccccc2C[C@H]1C(=O)O 178049454 ACGFVUKTXPFMGB-AWEZNQCLSA-N 380.429 2.560 0 50 GFAA COc1ccc(OC)c(CN(c2cc(N3CCC[C@H](CO)C3)ncn2)C2CC2)c1 178328065 AOMGWHKYVBJOJE-INIZCTEOSA-N 398.507 2.872 0 50 GFAA C[C@@H]1CN(c2ccccc2F)CCN1C(=O)c1cn(-c2ccc(F)cc2)nn1 190241538 ZUAXUHLTLYAONZ-CQSZACIVSA-N 383.402 2.896 0 50 GFAA CN1CCCc2ccc(S(=O)(=O)NCc3noc(-c4ccccc4)n3)cc21 193705470 IZNNFGNVXVFRBG-UHFFFAOYSA-N 384.461 2.598 0 50 GFAA Cc1ccc(Cl)cc1N1CCN([C@H](C)C(=O)N2C[C@H](C)O[C@@H](C)C2)CC1 229586149 YDYXVCGLRIZPBF-YESZJQIVSA-N 379.932 2.795 0 50 GFAA C[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)C1 229711741 DKEYPSKULQUOPY-HOTGVXAUSA-N 389.562 2.542 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 239038974 FFFCLQNIVMMTCY-QBPKDAKJSA-N 385.851 2.868 0 50 GFAA COc1cccc(C(=O)N2CCN(Cc3cc(-c4ccncc4)no3)CC2)c1 244795666 RLHQBAVRSDNVIG-UHFFFAOYSA-N 378.432 2.703 0 50 GFAA O=C(N[C@@H](C(=O)O)[C@@H]1CCCOC1)c1ccc(COc2ccc(F)cc2)o1 262697264 ABYSFXPMDMJYBR-SJKOYZFVSA-N 377.368 2.607 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263615400 CEZPJYMCNHADPB-UHFFFAOYSA-N 379.439 2.710 0 50 GFAA COc1ccc([C@@H]2Cn3cnc(C(=O)NCCc4c(C)noc4C)c3CO2)cc1 263616923 LFKFZRQXFJXQGE-IBGZPJMESA-N 396.447 2.741 0 50 GFAA Cn1c(O)ncc(C(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)c1=O 286387203 QNTUOKOIVSBCBZ-LBPRGKRZSA-N 381.354 2.525 0 50 GFAA CSc1nnc(CNS(=O)(=O)c2ccc(F)cc2)n1-c1ccccc1C 299778868 OZGMKDPNANUPQU-UHFFFAOYSA-N 392.481 2.915 0 50 GFAA COc1nnc(N2C(=O)CN([C@@H](C)c3cccc(Br)c3)C2=O)s1 328595484 WFLKLCQAIOIXMO-QMMMGPOBSA-N 397.254 2.839 0 50 GFAA O=S(=O)(CC1CC(F)(F)C1)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 333442801 PYZVWLAOHVXANK-JTQLQIEISA-N 387.374 2.983 0 50 GFAA CC(C)c1ccc(C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)nc1 368667472 RWFLXYGMJGGKMB-IRXDYDNUSA-N 379.460 2.854 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@H](CO)C3)csc2C1 426503428 REMUIJFHPGKKLX-HNNXBMFYSA-N 389.521 2.756 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)Nc2ccc(C(N)=O)c(F)c2)C1 454730878 YXCKHZKZKWCTCH-OAHLLOKOSA-N 384.455 2.910 0 50 GFAA CCC(=O)N1CCC[C@H](C(=O)Nc2ccc(OCC(=O)O)c3ccccc23)C1 486045427 AFYRUJDNYBMBKO-AWEZNQCLSA-N 384.432 2.890 0 50 GFAA O=C(NCC1([C@H](O)c2ccccc2)CC1)c1cc(F)ccc1N1CCOCC1 752351859 NDDIYUVIBHKWIO-HXUWFJFHSA-N 384.451 2.906 0 50 GFAA CC(C)C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F)C(=O)N1CCOCC1 888100115 LOKGRYJJWRGOQV-JYJNAYRXSA-N 399.482 2.622 0 50 GFAA Cc1cc(NC(=O)CN[C@@H]2CN(Cc3ccccc3)C[C@H]2C(F)(F)F)on1 932067349 OZZBBMKJFOGHGB-HUUCEWRRSA-N 382.386 2.574 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)N(C)C)C2 1073250312 QSXOTFJXFQEWAL-WBVHZDCISA-N 381.480 2.603 0 50 GFAA CN1CCN(C(=O)NCCc2cn(C)c3ncccc23)[C@@H](Cc2ccccc2)C1 1479144636 HZDRKRXTDZITJP-FQEVSTJZSA-N 391.519 2.684 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)NC[C@@H](C)N2CCN(C)CC2)c1C 1506400331 CRPZDPAYMVWALW-MRXNPFEDSA-N 381.586 2.515 0 50 GFAA COCCCCCC(=O)N1C[C@H](C(=O)O)C2(CCN(CCC(C)C)CC2)C1 1857687418 WYWYEJXZTPBCTP-GOSISDBHSA-N 382.545 2.865 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(c2nc(-c3ccccc3)no2)CC[C@@H]1O 1857711919 INGOINXFUQRALW-RXVVDRJESA-N 383.423 2.668 0 50 GFAA CC1CCN(c2cc(N[C@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)CC1 1857797771 OTBMMRFFKXLDJE-INIZCTEOSA-N 379.464 2.597 0 50 GFAA COCC(=O)N1CCC[C@]2(CCc3c2nc(C(C)(C)C)[nH]c3=NC2CCC2)C1 1875243285 ZMHKBNALEQQXBA-QFIPXVFZSA-N 386.540 2.613 0 50 GFAA NC(=O)NC[C@H]1CCN(C(=O)NCC(Cc2ccccc2)Cc2ccccc2)C1 1875258196 JMKYTXKGRDRGTH-HXUWFJFHSA-N 394.519 2.788 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCCCc3nc4ccccc4[nH]3)cn12 2100483371 OSPKJOLVOFDSDW-LJQANCHMSA-N 392.463 2.658 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCc3ccc(O)nn3)C2=O)cc1 2100534520 MDNWQIYCPHXEGX-JOCHJYFZSA-N 394.475 2.611 0 50 GFAA Nc1ncccc1CN1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 2100539684 UBJHTEMQOKZJRR-UHFFFAOYSA-N 388.475 2.701 0 50 GFAA COC(=O)c1coc(C2CN(C(=O)CO[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)C2)n1 2325811016 XTPQJVBVEUWBPZ-FRFSOERESA-N 378.469 2.864 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Br)c(OC)c(OC)c1 707546 NRLLGGFVNSBKIJ-ZDUSSCGKSA-N 399.241 2.657 0 50 GFAA COc1ccccc1NC(=O)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 1178040 WFAOMKATHYJMGW-CQSZACIVSA-N 380.400 2.723 0 50 GFAA NC(=O)c1ccccc1NC(=S)NC(=O)c1cccc(Br)c1 2830735 LRZTXAUWCRRGQS-UHFFFAOYSA-N 378.251 2.675 0 50 GFAA COC(=O)CCC(=O)N1CC[C@]2(CCCN(CCC3CCCCC3)C2=O)C1 12049135 UMAYGXAFZASJQN-OAQYLSRUSA-N 378.513 2.751 0 50 GFAA COc1ccc(/C=C/CN2CC[C@H]3[C@H](CCC(=O)N3CCCN(C)C)C2)cc1 12100183 FITOHRIIUKFYHG-JJLHHEJBSA-N 385.552 2.973 0 50 GFAA C[C@@H](CCn1cccn1)NC(=O)c1cc(COc2cncc(Cl)c2)on1 12475265 DWMUPECKICMYCL-LBPRGKRZSA-N 375.816 2.707 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4ccccc4Cl)CC3)nn2)n1 13009081 NORHQEBXGGFPDU-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA O=C1N[C@@H](CC2CCCCC2)C(=O)N2C[C@@H](NCc3ccccc3Cl)C[C@@H]12 14744901 MNSJXSTUCKLKNX-WDSOQIARSA-N 389.927 2.868 0 50 GFAA CN(Cc1nccs1)C(=O)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 15074151 AAUBOJRIJCOYFX-OAHLLOKOSA-N 375.469 2.722 0 50 GFAA CCOc1cc(/C=C2\SC(=S)N=C2O)ccc1OCc1c(C)no[n+]1[O-] 15724110 CZAKWAFMTNOZOC-AUWJEWJLSA-N 393.446 2.923 0 50 GFAA Cn1c(=O)n(C)c2cc(/C=C3/NC(=O)N(c4cccc(Cl)c4)C3=O)ccc21 16996270 GVJVTZCVESVMGE-RIYZIHGNSA-N 382.807 2.628 0 50 GFAA O=C(c1cn2c3c(cccc3c1=O)CC2)N1CCN(c2ccccc2F)CC1 19782373 IDFDXPJLBLHMHZ-UHFFFAOYSA-N 377.419 2.659 0 50 GFAA CN(Cc1ccc2ccccc2n1)C(=O)c1ccc(N2CCC[C@H](O)C2)nc1 19811973 AAUPTVYPSNPTPW-IBGZPJMESA-N 376.460 2.863 0 50 GFAA CC(=O)N1CCC(N2CCc3ccc(NC(=O)c4ccncc4)cc3C2)CC1 20537349 WWGNKFNZNMRGFX-UHFFFAOYSA-N 378.476 2.703 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)NC[C@H]2OCCc3ccccc32)[nH]n1 67654334 JIXXQETXOWXMNF-LJQANCHMSA-N 379.464 2.822 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc3[nH]c(=O)[nH]c3c2)CCC(=O)N1Cc1ccccc1 71614711 HFFMRRFQUPQZBY-KRWDZBQOSA-N 392.459 2.510 0 50 GFAA CCOC(=O)c1coc(N2C[C@H](c3ccccc3OC)[C@@H]3[C@H]2C2CCN3CC2)n1 72126510 AFXASWZZMNGNGX-NSISKUIASA-N 397.475 2.927 0 50 GFAA COCCN(C)C[C@H]1C[C@H](CO)CN(C(=O)c2cc3ccccc3s2)C1 91847181 FNLYXCUJRLJBTL-CVEARBPZSA-N 376.522 2.550 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)c2cn(C)c3ccccc23)C1 95380802 NMSPHGQLCFCROJ-QGZVFWFLSA-N 379.508 2.956 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)c(C)n1 95387612 KSRAMPRTJXFRNM-PWRODBHTSA-N 378.476 2.501 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CCN(c4ccccc4)CC3)n2)c1 96101564 KXHRNPWEMBOHEF-UHFFFAOYSA-N 375.480 2.828 0 50 GFAA COc1ccc(-c2ccccc2)cc1NC(=O)N1CCN2CCN(C)C[C@@H]2C1 108405757 KKBFWOZCKQXXEE-LJQANCHMSA-N 380.492 2.826 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2cc(C3CCC3)nn2C)N2CCOCC2)o1 153609449 VEEBQOJPMWMRTF-KRWDZBQOSA-N 387.484 2.784 0 50 GFAA O=C1CC[C@@]2(C(=O)N3CCC(O)(C(F)(F)F)CC3)Sc3ccccc3N12 157264283 PDXRNMHHLFMCQS-INIZCTEOSA-N 386.395 2.531 0 50 GFAA O=C(NCc1cccs1)c1cc2n(n1)C[C@@H](c1ccc3c(c1)OCO3)OC2 169771900 YSOIFCIMEGVCAB-SFHVURJKSA-N 383.429 2.875 0 50 GFAA O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CCc2ccc(F)cc21 171781543 DVAQNGBGMAJQFP-HXUWFJFHSA-N 383.467 2.841 0 50 GFAA O=S(=O)(c1ccc(Cl)s1)N1CCN(Cc2ccncc2Cl)CC1 173510235 HZPGUAYQTXDGEU-UHFFFAOYSA-N 392.333 2.956 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2CC(=O)c2ccccc2)cc1-n1cnnn1 183245513 PUONBKVUXLYZDQ-KRWDZBQOSA-N 391.431 2.549 0 50 GFAA COc1ccccc1CCNC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCOCC1 225764118 XSKNEFCAUUNSIR-SFHVURJKSA-N 392.496 2.674 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CC(=O)O)C1CCOCC1 237728365 HLSKQLFGPMYLIR-UHFFFAOYSA-N 377.828 2.540 0 50 GFAA COc1ccc(CNC(=O)C2CCN(CCn3cc(Cl)cn3)CC2)cc1 244716333 LNFSJZGWFWUDHQ-UHFFFAOYSA-N 376.888 2.574 0 50 GFAA C[C@H](O)C[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 246512241 ILCQCVGMEDDINB-OFQRWUPVSA-N 396.434 2.655 0 50 GFAA C[C@@H]1CCCCN1CC(=O)N1CCc2[nH]c(-c3cccc(C(=O)O)c3)nc2C1 299798176 WDTFKJSGQWSERC-CQSZACIVSA-N 382.464 2.534 0 50 GFAA c1ccc(-c2noc([C@@]34CCC[C@@H]3CN(CCCN3CCOCC3)C4)n2)cc1 328603541 GJWTZQAUGKQVFO-DENIHFKCSA-N 382.508 2.812 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3cnc4ccccn34)CC2)cn1 328628862 HRDHBLOJZLELHW-INIZCTEOSA-N 378.480 2.902 0 50 GFAA CN(C[C@@H](O)COc1ccccc1)C[C@H]1CCc2nc(C(F)(F)F)cn2C1 328634359 MQYOQIMFXCIGFB-HUUCEWRRSA-N 383.414 2.836 0 50 GFAA CN(C(=O)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1)C1CCCC1 328806481 NJRSPQNIRDXUSI-SFHVURJKSA-N 391.537 2.838 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)c(=O)n1 426550365 FONGBLBRXXCAMV-MRXNPFEDSA-N 379.464 2.533 0 50 GFAA O=S(=O)(Cc1cccc(F)c1)Nc1nnc([C@H]2COc3ccccc3O2)o1 446765967 CBZOLAPYCWQMAI-OAHLLOKOSA-N 391.380 2.663 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)CCc2ccccn2)(c2ccccc2)CC1 847398524 CRGXVXNHVIOVKK-UHFFFAOYSA-N 377.488 2.829 0 50 GFAA NC(=O)c1cccc(Cc2noc([C@@H]3CCc4nnn(C5CCCC5)c4C3)n2)c1 952893784 KHEAJLHWSPNHMJ-OAHLLOKOSA-N 392.463 2.738 0 50 GFAA COc1ccc(NC2(C(=O)NCCc3nc(C)cc(O)n3)CCCCC2)cc1 952967378 JLXZWMPIVAJNMB-UHFFFAOYSA-N 384.480 2.973 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC2CCN(C(=O)c3cccnc3)CC2)n1 1506396518 BYODSNBRDBLTQA-UHFFFAOYSA-N 379.386 2.593 0 50 GFAA Cc1cc(CC(=O)N2CCCN(C[C@H](C)Cc3ccc4c(c3)OCO4)CC2)on1 1529181045 PGUMODIVRRFYHF-MRXNPFEDSA-N 399.491 2.667 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CCN2[C@H](COC[C@H]2c2ccccc2)C1 1616068796 APJIHFUCEJWRAX-ROUUACIJSA-N 381.432 2.705 0 50 GFAA O=C1COc2cc(C(=O)N3C[C@H]4CCC[C@](O)(c5ccccc5)[C@H]4C3)ccc2N1 1704298493 GKMPCHKMBGRLKY-QSAZIKIQSA-N 392.455 2.777 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3nn(C)c4ccccc34)C1)CC2 1704345007 ZFLDEGZNDJWLGU-JOCHJYFZSA-N 390.491 2.550 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)c3cccc(-c4ccc(O)cc4)c3)C[C@@H]12 1704358378 JGAZSSFLHTTZJM-FYYLOGMGSA-N 380.488 2.978 0 50 GFAA NC(=O)CN1C[C@@H]2CN(Cc3c(F)cccc3F)C[C@]2(CCc2ccccc2)C1 1772805084 YGFVMLRSODWZPK-FDDCHVKYSA-N 399.485 2.817 0 50 GFAA CCCN1CCC[C@@H](c2nc(COc3cccc(OC)c3)nn2CCO)CC1 1772813775 SPWUIHKFBKNPTD-QGZVFWFLSA-N 388.512 2.838 0 50 GFAA Cc1cc(C(=O)N2CC[C@H](CN(Cc3scnc3C)C(=O)C(C)C)C2)n[nH]1 1775990239 WHIRTLGUJPCGAM-HNNXBMFYSA-N 389.525 2.630 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCc2[nH]nc(C3CC3)c2CC1 1857670151 WVUZLPWWWVZIOK-FQEVSTJZSA-N 392.503 2.909 0 50 GFAA CCCc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cc(C)on4)[C@H]4CC[C@]3(C2)O4)o1 1857725513 ZOKXYSURYJVQRM-XHYAQGIWSA-N 399.491 2.938 0 50 GFAA COc1ccc(-c2nccn2[C@@H](CO)c2ccc(F)cc2)c(C(=O)O)c1OC 1875245446 AEWQAQLQDFIQIO-HNNXBMFYSA-N 386.379 2.986 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1C[C@@H]2[C@H](CN(C)C)[C@H]3CC[C@]2(C1)O3 1875251440 LDSLORTYGSLOSE-KCXPTXFHSA-N 380.492 2.566 0 50 GFAA Cn1c(N2CCN(C(=O)CCOc3ccccc3)CC2)nc2c(F)cccc21 1875257872 FWTFUUDAGSCSES-UHFFFAOYSA-N 382.439 2.830 0 50 GFAA Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N[C@@]34CCCN(CC3)C4)c12 1875284856 QJAIWXIEUQMZBW-QFIPXVFZSA-N 375.476 2.912 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CCC[C@@]2(C[C@H]2C(=O)O)C1 1875304801 VNLYPOWHWFWNCS-SIMVJXQJSA-N 387.402 2.879 0 50 GFAA COCCN(C(=O)[C@H](O)CN1CCCC1)[C@@H](C)c1cccc(C(F)(F)F)c1 1875308802 YHCPLVVCHKRMMN-WMLDXEAASA-N 388.430 2.698 0 50 GFAA CC(C)[C@H](Oc1ccc(Br)cc1)c1noc(-c2nnn(C)n2)n1 1875317143 OZAAYFJYHFCIJE-NSHDSACASA-N 379.218 2.799 0 50 GFAA Cc1ccc(OCn2ccc(C(=O)NS(=O)(=O)c3ccc(C)cc3)n2)cc1 1875328300 KJNGBMQFZNUVKO-UHFFFAOYSA-N 385.445 2.655 0 50 GFAA C[C@H]1NCC[C@H]1C(=O)N(Cc1ccccc1)Cc1nc(O)c2sccc2n1 2325738420 SYOXXLVYTSYLQH-UKRRQHHQSA-N 382.489 2.924 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nn2cnc3sc(C)c(C)c3c2=O)cc1 2325889745 PNXNXWGSBIMTIO-UHFFFAOYSA-N 382.445 2.608 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2ccc(OCC)c(CN(C)C)c2)CC[C@@H]1O 2356145836 KGKKVMCMBQFNIC-PZJWPPBQSA-N 378.513 2.585 0 50 GFAA O=C1C[C@@H](c2ccccc2)NCCCCN(C(=O)c2ccccn2)CCCN1 2356162261 FETJWIFIFTYUCN-FQEVSTJZSA-N 380.492 2.545 0 50 GFAA COC(=O)C1=CN(C2CCCC2)C=C(C(=O)OC)C1c1ccc(OC)c(O)c1 1140611 MJRIGCNTQGKLMO-UHFFFAOYSA-N 387.432 2.856 0 50 GFAA CCOC(=O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 2840196 CLFNWXLKMQBOMN-UHFFFAOYSA-N 394.424 2.908 0 50 GFAA COc1ccccc1OCC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1 11842755 JCBCJSSBXRGPGW-OAHLLOKOSA-N 388.851 2.645 0 50 GFAA O=C(NCCN1Cc2ccccc2O[C@@H](c2ccccc2)C1)c1cc[n+]([O-])cc1 12078422 ZLTSEVNYRUURKH-JOCHJYFZSA-N 389.455 2.686 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCCCO2)n1CCCc1ccccc1 12298013 SMKRMMPNZSKIJE-UHFFFAOYSA-N 377.510 2.837 0 50 GFAA Cc1c(CC(=O)N2CCC[C@H]2CO)c2c(n1Cc1ccccc1)CCCC2=O 12438923 FQPNFYKWLABYSK-SFHVURJKSA-N 380.488 2.890 0 50 GFAA COc1cc(CNC[C@H]2CCCO2)ccc1Oc1nnnn1-c1ccccc1 13845283 IBILLJXSWPAQQX-QGZVFWFLSA-N 381.436 2.732 0 50 GFAA C[C@H]1CN(C2(C(=O)N(C)CCCN3CCCC3)Cc3ccccc3C2)C[C@@H](C)O1 15073203 QDDZBRXVUQTSTA-BGYRXZFFSA-N 399.579 2.578 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ncccc2I)CC1 19851393 VTPURUZXLYMJMM-UHFFFAOYSA-N 389.237 2.743 0 50 GFAA in-vitro CCCn1cnnc1Cn1cc(Oc2ccccc2)c(=O)c(C(=O)OCC)c1 55284567 DEYVEXUJTBSWNY-UHFFFAOYSA-N 382.420 2.867 0 50 GFAA CCc1nccn1CCCNC(=O)[C@H]1CCC(=O)N(Cc2cccc(F)c2)C1 67675166 WLCHDUXXRXFUAS-KRWDZBQOSA-N 386.471 2.530 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cnccc1C)C(=O)N(C1CCCC1)C2 71758885 FOOWOEPXZZUJTQ-UHFFFAOYSA-N 380.448 2.622 0 50 GFAA N[C@@H]1c2ccccc2C2(CCN(C(=O)Cc3ccc(O)c(Cl)c3)CC2)[C@H]1O 72147137 XDSSHADRKAOPPO-UXHICEINSA-N 386.879 2.523 0 50 GFAA COc1ccc(C2(C(=O)N3CC[C@@H](Cc4cccc(C(N)=O)c4)C3)CC2)cc1 72154720 IGFRZRSVIBNKAB-KRWDZBQOSA-N 378.472 2.917 0 50 GFAA O=c1cc(CNCCc2csc(-c3ncccn3)n2)[nH]c2ccc(F)cc12 95385314 RNXHEGUTRMDFBY-UHFFFAOYSA-N 381.436 2.913 0 50 GFAA Cc1ccc2nc(CN3CC[C@@]4(O)CCN(C(=O)C5CCCC5)C[C@H]4C3)[nH]c2c1 95390508 UBUVSXAWUZXICK-WZONZLPQSA-N 396.535 2.847 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC(c3nc([C@@H]4CCOC4)no3)CC2)c1 96151172 VHYTUYNDOHLVOX-CQSZACIVSA-N 387.436 2.611 0 50 GFAA C/C(=C\c1ccco1)CN1CCN(C2CCN(C(C)C)CC2)[C@H](CCO)C1 105281236 OUMKHDZOSQVYDL-JENJNIGESA-N 375.557 2.924 0 50 GFAA CCc1cc(N2CCC[C@@H](NC(=O)NCc3ccc(OC)c(F)c3)C2)ncn1 112506877 JAUGBSSSKJQMMU-MRXNPFEDSA-N 387.459 2.655 0 50 GFAA O=C(NO[C@@H]1CCCCO1)c1nn(Cc2ccccc2)c(=O)c2ccccc12 120232092 OTXNQEYIEJOCFM-GOSISDBHSA-N 379.416 2.633 0 50 GFAA O=C(Cc1c[nH]c2ncccc12)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 121258636 GTGYNRNRZBYPDT-UHFFFAOYSA-N 382.851 2.630 0 50 GFAA Nc1nc(N)nc(CN2CCC(COc3cc(Cl)cc(Cl)c3)CC2)n1 125667543 AFVTZYBASTVPQW-UHFFFAOYSA-N 383.283 2.634 0 50 GFAA COCCn1nc(C)c(NC(=O)c2cnn(-c3ccc(F)cc3F)c2)c1C 127592624 AZGUVJYLQJPENJ-UHFFFAOYSA-N 375.379 2.863 0 50 GFAA CN(Cc1nc2ccsc2c(=O)[nH]1)C[C@@H](O)c1ccc(Br)cc1 131831023 ISVMPATWSVBSPA-CYBMUJFWSA-N 394.294 2.913 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)N[C@@H]1CCN(c2ccccc2OC)C1 156653749 KOXNTMDWUIRSAD-MRXNPFEDSA-N 377.444 2.517 0 50 GFAA O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@@H]1C[C@@H]1C1CCCCC1 159101181 HQRSASTTYSUHMY-HZPDHXFCSA-N 375.450 2.758 0 50 GFAA Cc1c(C(=O)NCc2cccnc2N(C)C)nnn1-c1ccc(Cl)cc1F 173091453 YREUABLSELYYAG-UHFFFAOYSA-N 388.834 2.759 0 50 GFAA O=S(=O)(Nc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccc(F)cc1 183177602 PLAMEAWMLCBQMT-UHFFFAOYSA-N 383.344 2.920 0 50 GFAA O=C(O)c1ccc(CCC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cc1 191647760 FPLACMDAQPBDSS-SFHVURJKSA-N 386.835 2.671 0 50 GFAA CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)N1CCO[C@@H](c3ccc(F)cc3)C1)C(=O)C2 229682613 UYVMBQLLWINXEL-XAUMDUMWSA-N 395.496 2.924 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCc1c(C)nc2c3c(F)cccc3nn2c1O 252522887 BIWJHTPQZMKHKZ-AWEZNQCLSA-N 399.470 2.569 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(Cl)c(F)c1)c1ccc(-c2ncon2)cc1 252537267 KVCGFOFQFJLPKO-UHFFFAOYSA-N 395.799 2.789 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)Cn2c(COc3ccccc3)nc3ccccc32)C1 269181842 LMNRQMBFKVEXBH-OAHLLOKOSA-N 379.416 2.548 0 50 GFAA CON(C[C@H]1CCC[C@@H](C)C1)C(=O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 290353454 JMTODSXCTFLSNB-NEPJUHHUSA-N 381.860 2.594 0 50 GFAA NC(=O)c1ccc(CNC(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)cc1 290857104 DMZCYUXOMYZEHL-HXUWFJFHSA-N 394.519 2.887 0 50 GFAA O=C(O)CN(C(=O)CCc1ccc(OC(F)(F)F)cc1)C1CCOCC1 299753099 WVPOCEUKHJYCAW-UHFFFAOYSA-N 375.343 2.610 0 50 GFAA CCn1cc(CNC(=O)c2cccc(-c3cc(N4CCCC4)cnn3)c2)cn1 299783929 RJNAZEWHQHOIGI-UHFFFAOYSA-N 376.464 2.890 0 50 GFAA COc1cccc(CN2CC[C@@H](N3CCCC3)[C@@H](CCC(=O)O)C2)c1OC 299789910 ADRHKSMYJHDUOB-FUHWJXTLSA-N 376.497 2.855 0 50 GFAA Cc1nccc(-c2cccc(NC(=O)NCCS(=O)(=O)CC(C)C)c2)n1 299795133 KPIVGEAHQXPFCC-UHFFFAOYSA-N 376.482 2.644 0 50 GFAA Oc1n[nH]c([C@H]2CCCCN2Cc2cc(Br)c3c(c2)OCO3)n1 333631604 AKEDGSVATKSQSG-LLVKDONJSA-N 381.230 2.729 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1Cn1cncn1 363678279 LFRXNPHRLVDVGJ-FQEVSTJZSA-N 389.503 2.968 0 50 GFAA C[C@H]1[C@@H](NC(=O)c2cccc(NC(=O)C3CC3)c2)CC(=O)N1Cc1ccccc1 390832873 IXIDUKNOWMOFER-YWZLYKJASA-N 391.471 2.955 0 50 GFAA Cc1ccc(OCCN)c(C(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3)C2)c1 426379585 ALOMMTYDTYRBNW-LJQANCHMSA-N 385.483 2.866 0 50 GFAA NC[C@H]1CCCN(C(=O)c2cccc(-c3nc4ccccc4n3CCO)c2)C1 426597321 YXWSJDZZCCUFHC-MRXNPFEDSA-N 378.476 2.507 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)Nc1cccc(C(=O)N(C)C)c1C 824801337 LZOXNGIJFZMYBF-OAHLLOKOSA-N 381.432 2.770 0 50 GFAA O=C1C[C@@H](CCOC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)CN1 860700524 SCFZPFCFXZYHBX-LLVKDONJSA-N 394.353 2.922 0 50 GFAA FC(F)Cn1ncnc1CN1CC[C@](c2nc(C3CC3)no2)(C(F)(F)F)C1 952891118 AGVRMTPRLWEDIY-AWEZNQCLSA-N 392.332 2.510 0 50 GFAA CCCn1c(C)nc2cc(NC(=O)C3CCN(C(=O)COCC)CC3)ccc21 952978034 WQQIUQAEMBEFPP-UHFFFAOYSA-N 386.496 2.968 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N(C)Cc2cccc(C(F)(F)F)c2)C1 952989538 SKMUXBUZNPHCDG-AWEZNQCLSA-N 380.432 2.740 0 50 GFAA COCC1(C(=O)NCC2(NC(=O)Cc3ccc(F)cn3)CCCCC2)CCC1 1775996738 GRZZFSPRYDTJHR-UHFFFAOYSA-N 391.487 2.515 0 50 GFAA Cc1c(-n2ccnc2-c2ccccc2OCC(=O)N2CCCCC2)cnn1C 1857704479 TWWWBPANYQOBCC-UHFFFAOYSA-N 379.464 2.973 0 50 GFAA O=C(c1ccccc1C(F)(F)F)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857721622 YPBNHIUCYRDJIO-AJYBTWMASA-N 391.389 2.914 0 50 GFAA CSc1ccc2c(C)cc(-n3nc(CC(N)=O)nc3[C@H]3CCCO3)nc2c1 1875247856 QXZXRPZRNGNLAR-OAHLLOKOSA-N 383.477 2.725 0 50 GFAA C[C@@H](C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccc1Cl 1875294828 OJKMUWMPOLUUBE-SNVBAGLBSA-N 398.834 2.874 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1Nc1ncc(Br)c2cccnc12 1875399111 OZMAKZWUFINHBM-NILFDRSVSA-N 388.269 2.840 0 50 GFAA CC(C)(C)c1ccc([C@H]2CNCCN2C(=O)c2cncc(-n3ccnc3)n2)cc1 2325780348 ZSYRAPSIKOFYBM-LJQANCHMSA-N 390.491 2.747 0 50 GFAA O=C1NCCC[C@@]12CCCN2CCCN1CCN(c2cccc(Cl)c2)CC1 2356134174 BWPBMPGTIMZNEH-OAQYLSRUSA-N 390.959 2.597 0 50 GFAA COc1ccccc1O[C@H](C)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 1103673 QNDSFIGEWQDEEJ-OAHLLOKOSA-N 381.432 2.899 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)c2ccc(Br)cc2)nc1N 4956632 QQKHOEDWSRZGOV-UHFFFAOYSA-N 396.266 2.973 0 50 GFAA CN1CCN(C(=O)c2ccccc2NC(=O)COc2ccccc2Cl)CC1 6703806 QIQSBEXXAQEMBM-UHFFFAOYSA-N 387.867 2.745 0 50 GFAA COC(=O)c1cccc(NS(=O)(=O)c2ccc(N3CCCCC3=O)cc2)c1 11906600 HYFQUVNBRQUVIE-UHFFFAOYSA-N 388.445 2.791 0 50 GFAA Cc1ccc([C@@H](C)CCN(C)CCn2cc(C(=O)NCc3ccncc3)nn2)o1 11913184 DOTXEZPYRVCMAA-INIZCTEOSA-N 396.495 2.630 0 50 GFAA Cc1nonc1CC(=O)N1CCC(CCC(=O)N(C)Cc2ccccc2)CC1 12430526 FIJGEBOVWLYMKU-UHFFFAOYSA-N 384.480 2.598 0 50 GFAA COc1ccc(CN2CCC(OC)CC2)cc1OC[C@H](O)CN1CCCCC1 12706770 MHLOVTWMRJIZBV-LJQANCHMSA-N 392.540 2.532 0 50 GFAA CCCN(CC1CC1)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl 15069945 FSIDJLPDLUHXOM-GOSISDBHSA-N 395.906 2.818 0 50 GFAA Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N3CCc4ccccc4C3)cc2)no1 16605166 OYJPSVSSBXVVDF-UHFFFAOYSA-N 397.456 2.982 0 50 GFAA CCN(C)C(=O)c1ccc([C@@H]2CCCN2C(=O)CCCn2cncn2)s1 19953114 OOMXLDIEFUVYEL-AWEZNQCLSA-N 375.498 2.575 0 50 GFAA COc1cccc(OC[C@H](O)CN2CCN(c3cccc(Cl)c3)CC2)c1 20109771 WOKHVZIZCODFAG-GOSISDBHSA-N 376.884 2.911 0 50 GFAA O=C(CN1CCN(Cc2ccc3c(c2)OCO3)CC1)Nc1ccccc1Cl 20508042 BHQVUFWAXQWKJF-UHFFFAOYSA-N 387.867 2.825 0 50 GFAA CN(C[C@@H]1CCCCO1)C(=O)c1cccc(Nc2ncnc3c2cnn3C)c1 20999124 FFUKOTQPSZGZMH-INIZCTEOSA-N 380.452 2.748 0 50 GFAA Cc1ncccc1C(=O)N1CCC[C@H](CCC(=O)N(C)C2CCN(C)CC2)C1 20999813 HCRPPKDAOXUFSG-GOSISDBHSA-N 386.540 2.575 0 50 GFAA O=C(Nc1ccc(F)cc1F)N1CCN(c2ccnc(N3CCCC3)n2)CC1 72116030 POCLJZQPPUJNQP-UHFFFAOYSA-N 388.422 2.709 0 50 GFAA CC(=O)N1CCC2(CC1)C[C@H](C(=O)O)N(C(=O)c1ccc(Cl)cc1C)C2 72412307 RDOMLEJZBFXCFY-MRXNPFEDSA-N 378.856 2.576 0 50 GFAA COc1ccccc1CN1CCN(Cc2cc(=O)c3cccc(F)c3[nH]2)CC1 91585802 QCYNPDFCFJZDIS-UHFFFAOYSA-N 381.451 2.994 0 50 GFAA N[C@H]1CCC[C@@H](C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)C1 91966049 JKXGBGYFLRPUQJ-RTWAWAEBSA-N 397.563 2.978 0 50 GFAA COCCCN1CC2(CCN(C(=O)c3cc(Cl)ccc3OC)CC2)CC1=O 95388979 FYLVARIWDHPJIG-UHFFFAOYSA-N 394.899 2.840 0 50 GFAA O=C(Cc1ccccc1O)N1CCC(c2nccn2Cc2cccnc2)CC1 95517389 GWTUBIXANOMAAB-UHFFFAOYSA-N 376.460 2.981 0 50 GFAA CC(=O)C(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@H]1CCCO1 95528281 MPBXQEBXLTYVDX-LJQANCHMSA-N 376.472 2.634 0 50 GFAA O[C@H]1CN(Cc2ccccc2)CCN(C2CCN(c3ccccc3F)CC2)C1 108265915 PXNAEJYLMYDWPM-NRFANRHFSA-N 383.511 2.973 0 50 GFAA Cc1sc2nc(S[C@H]3CCN(CC(F)(F)F)C3=O)n(C)c(=O)c2c1C 109714705 XNKQOEYTJXRJMX-VIFPVBQESA-N 391.440 2.867 0 50 GFAA O=C1CN(C(=O)CN2CC[C@H](Oc3cccc(Cl)c3)C2)c2ccccc2N1 120269099 VXFGGIZHFMGIMB-INIZCTEOSA-N 385.851 2.778 0 50 GFAA C[C@@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)c(Br)s2)CCN1C 123818312 GERDQMKLTKEWJC-SFYZADRCSA-N 387.752 2.925 0 50 GFAA C[C@@H]1Cc2ccccc2N1C(=O)CN1CCC(c2nnc3ccccn23)CC1 171128351 JNTUVUTZHZVWMU-MRXNPFEDSA-N 375.476 2.887 0 50 GFAA O=C(CNC(=O)c1cc2ccccc2[nH]1)NCc1ccc(-n2ccnc2)c(F)c1 173815978 QVEVVVUDRFXPKQ-UHFFFAOYSA-N 391.406 2.539 0 50 GFAA Cc1ccc(N2CCC(NC(=O)c3nn(-c4ccccc4)cc3O)CC2)nc1 174442239 YXMKYKPWGORUCQ-UHFFFAOYSA-N 377.448 2.680 0 50 GFAA C[C@@H]1CN(C(=O)CCC[S@@](=O)c2ccc(Br)cc2)C[C@@H](C)N1 179162108 OWVHGOAAYZVWDP-GIYNXVAASA-N 387.343 2.546 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)CCc2ccccc2Br)CC1 186663640 PUWQREZIJZFYBW-OAHLLOKOSA-N 397.313 2.779 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CCc2cnccc21 190755476 FCEFMMZPOCWUCT-LBPRGKRZSA-N 382.869 2.900 0 50 GFAA COc1ccc(CN2CCC[C@@](O)(CO)C2)cc1OCc1ccccc1F 215632961 YKKWWDKIDWPDTM-NRFANRHFSA-N 375.440 2.733 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@@H](C)CN(C)C[C@@H]1C)c1ccc2c(c1)OCCCO2 221982454 SEVCPFYAKYBLMP-HOIFWPIMSA-N 389.540 2.686 0 50 GFAA CC[C@H]1CN(C(=O)c2cc(NC(C)=O)ccc2F)[C@@H](CC)CN1CC(C)(C)O 230148484 RIBVUFGMGYEQJI-IRXDYDNUSA-N 393.503 2.870 0 50 GFAA C[C@H](NC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 248379420 MUQIIKSIIFLPGA-AWEZNQCLSA-N 379.932 2.971 0 50 GFAA Cc1nc(NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)nc(N(C)C)n1 253428044 GRUUIQBVPJYUPA-UHFFFAOYSA-N 393.416 2.659 0 50 GFAA O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCNC[C@H]1c1cccnc1 261890665 ZPYHJEVPFKLRKU-FPOVZHCZSA-N 382.483 2.606 0 50 GFAA Cc1nc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)ccc1C(=O)O 263360339 TXQGJTAQQKSNJT-MRXNPFEDSA-N 381.432 2.513 0 50 GFAA Cc1ccc([C@@H]2Cn3nc(C(=O)Nc4ccc(C(N)=O)cc4)cc3CO2)cc1 263617298 NBXMHAYVGTZCEW-IBGZPJMESA-N 376.416 2.814 0 50 GFAA COc1ccc([C@H](C)NC(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cc1 263829865 MXSOFQUBAHKRGT-LBPRGKRZSA-N 382.424 2.871 0 50 GFAA Cn1c([C@@H]2CCCN2Cc2cn(Cc3cccnc3)nn2)nc2c1CCCC2 275423445 DSMWAHUHPLPHKI-FQEVSTJZSA-N 377.496 2.671 0 50 GFAA CN(C)c1nc(O)cc(CN(C)[C@@H]2CCN(Cc3cc4ccccc4o3)C2)n1 328642123 QVYZSPUPIDETPC-QGZVFWFLSA-N 381.480 2.701 0 50 GFAA COc1cc(Br)cc(NC(=O)N2CC[S@](=O)CC[C@H]2C)c1 408041987 JFKPSHIQEQFXBL-LADRHHBVSA-N 375.288 2.833 0 50 GFAA CCC[C@H](C)c1cc(NS(=O)(=O)c2ccc(C(=O)OC)c(OC)c2)n[nH]1 410385062 VGWRKFNNLSQCDT-NSHDSACASA-N 381.454 2.909 0 50 GFAA C[C@H]1CCc2n[nH]cc2[C@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 878590707 WIPDQZAKWVKRSM-XOBRGWDASA-N 391.475 2.542 0 50 GFAA O=C(CCc1cc(Cl)no1)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529099989 KUAUHZQHSLLLIY-KDOFPFPSSA-N 385.851 2.871 0 50 GFAA C[C@H]1C[C@@H]1C(=O)N1CC2(CCN(C(=O)c3cnc4ccccn34)CC2)C[C@H]1C 1775997027 QVOIAZAVSXDKPD-BBWFWOEESA-N 380.492 2.834 0 50 GFAA COc1ccc2c(c1OC)CCN(CC(=O)Nc1ccc3c(c1)OCCCO3)C2 1857527433 JQDTWVAEVYOCCC-UHFFFAOYSA-N 398.459 2.862 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3n[nH]cc3Cl)C1)CC2 1857699903 CUKNUSPKIHVSJN-LJQANCHMSA-N 389.887 2.976 0 50 GFAA Cc1cc(C)c(CNC(=O)[C@@H]2CC(=O)N(c3nc4ccccc4s3)C2)cn1 1857722311 GSQDTYLFVKXNJU-CQSZACIVSA-N 380.473 2.977 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)/C=C/c3ccccc3)C1)CC2 1857729240 BAFZIJPBQPOOSM-DGSRBQDKSA-N 378.476 2.768 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cc(Cl)ccc3F)C[C@]23CC[C@H]1O3)C1CC1 1857735006 CJIINXVNICJFRY-IXIUHKBRSA-N 378.875 2.985 0 50 GFAA Cc1cccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC[C@@H](C)C3)n2)c1 1857797713 CWCJUMWWFLNQMZ-NVXWUHKLSA-N 393.491 2.905 0 50 GFAA CC(C)(C)n1nccc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCCC1 1875275894 KPNDBLKLEZBJBI-GOSISDBHSA-N 382.508 2.992 0 50 GFAA CCc1cccc(C)c1N1C[C@H](C(=O)N(C)[C@H]2C[C@H]3C[C@@H](O)C[C@H]3C2)CC1=O 2100539594 PEOQJAKSFDHMAH-IVDHNXQLSA-N 384.520 2.918 0 50 GFAA CC(C)(C)OC(=O)c1ccc(-c2nc(-c3cccc(-n4cnnn4)c3)no2)nc1 2325776626 CXTYSASBQNFLFF-UHFFFAOYSA-N 391.391 2.730 0 50 GFAA Cc1ncc(Cc2noc(-c3cccc(S(=O)(=O)NC(C)(C)C)c3)n2)o1 2325850270 RXLGGSLFKKCQCE-UHFFFAOYSA-N 376.438 2.701 0 50 GFAA N[C@]1(c2ccccc2)CCN(C(=O)C(=O)NCCc2csc3ccccc23)C1 2325857532 FOPRKBIMULZVSY-JOCHJYFZSA-N 393.512 2.647 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356146880 YTBXBNDKCLMPOE-FTRWYGJKSA-N 393.915 2.579 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)s1 2356148508 BSIFUSJWFFIDER-JXXFODFXSA-N 391.537 2.661 0 50 GFAA COc1cccc([C@H]2NC(=O)NC(C)=C2C(=O)Nc2cc(OC)ccc2OC)c1 909913 FTQLJJVFTDMHST-LJQANCHMSA-N 397.431 2.979 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)cc1 943613 FXUZAVKZMBMCQL-CYBMUJFWSA-N 380.400 2.875 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 1057389 QXIIVOAZLIZDLW-CQSZACIVSA-N 390.461 2.575 0 50 GFAA O=C(c1cnccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1[C@H]2Cc1ccccc1 2356158846 BSLHOBWUTREPRX-LQWHRVPQSA-N 386.455 2.682 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2ccc(Cl)cc2OC)C1=O 2356164282 NFUZQSSDHMVDOE-IBGZPJMESA-N 380.872 2.592 0 50 GFAA COC(=O)c1cc(NCc2ccc(OC)c(OC)c2)ccc1N1CCOCC1 4386329 XVXOXMWJCOBPAN-UHFFFAOYSA-N 386.448 2.939 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3ncc(C)s3)n2C)cc1 4949322 QWYOAEZKYIOFPA-UHFFFAOYSA-N 375.479 2.986 0 50 GFAA O=Cc1ccc(OC(=O)C2CCC(N3C(=O)[C@H]4CC=CC[C@H]4C3=O)CC2)cc1 101069271 JKJHXBIRNCTKRD-JVPGXQPFSA-N 381.428 2.915 0 50 GFAA O=C(NCCN1CCCC1)[C@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 20534973 QMNRCNFCHUPVFM-INIZCTEOSA-N 397.441 2.656 0 50 GFAA COc1ccc(-c2ncc(CN3CCN(C4CCCC4)[C@@H](CCO)C3)cn2)cc1 20455158 FZCUAIFMUVDLOT-NRFANRHFSA-N 396.535 2.963 0 50 GFAA CCS(=O)(=O)CCn1ccc(NC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)n1 252478180 AFEGVPMTVVJBMF-NSHDSACASA-N 396.435 2.513 0 50 GFAA NC(=O)C1CCN(c2ccccc2NC(=O)c2ccnc(OC3CCC3)c2)CC1 124750868 PPESOPIPVJGQQS-UHFFFAOYSA-N 394.475 2.967 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)n1 147964784 RIIOQKCNSIOQCB-MRXNPFEDSA-N 381.436 2.817 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)c1cccc(O)c1)C2 72142176 RVXWQPVIAIKIJV-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA Cc1ccc(-c2nc(C(=O)N3CCC[C@H](CN4CCOCC4)C3)cs2)o1 282538186 WAGCGWMLILCAST-OAHLLOKOSA-N 375.494 2.896 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2cnn(CC(C)C)c2)CC1 328645589 SDHFYLBLFIHWQM-OAQYLSRUSA-N 384.528 2.732 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCC(NC(=O)C3CC3)CC2)ncn1 435344186 SYNWMJRSRCKZRZ-FXAWDEMLSA-N 387.528 2.587 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@H](c3cccc(F)c3)N(C)C)CC2)cs1 219910052 LMKCSDCCFXVYDB-SFHVURJKSA-N 376.501 2.538 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O)c1ccc(C)cc1 236690167 YLPJKYNZZUJIBR-PMACEKPBSA-N 380.444 2.600 0 50 GFAA C[C@H]1CCCc2ccccc2[C@H]1NC(=O)NC1CCC2(CC1)NC(=O)NC2=O 376888446 PWHRRCZSGIUDSW-FFIVFUDGSA-N 384.480 2.520 0 50 GFAA C[C@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1c2ccccc2C[C@H]1C 456625622 JYFQUMWOOVDHSJ-IIYDPXPESA-N 395.434 2.734 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)N2CCC[C@H](C(=O)c3ccccc3)C2)cc1 77440442 VBOXZCXACHQHPB-IBGZPJMESA-N 389.459 2.635 0 50 GFAA Cc1c(NC(=O)c2ccnc(OC(F)F)c2)cccc1C(=O)N1CCOCC1 448776579 YARZIACSGDKKDM-UHFFFAOYSA-N 391.374 2.716 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3cnc4cccc(C)n4c3=O)CC2)cc1 77541708 KAXBEHNKDSITIL-UHFFFAOYSA-N 377.444 2.995 0 50 GFAA Cc1ncccc1OC1(C(=O)N2CCC[C@H]2c2nc(C(C)C)no2)CCNCC1 77540557 GPFRKVHIXFYHRA-INIZCTEOSA-N 399.495 2.761 0 50 GFAA CC(C)N1C[C@@H](CNC(=O)N2CCC(c3nc4ccccc4n3C)CC2)CC1=O 426536279 LKQGVGVEGNDZQW-MRXNPFEDSA-N 397.523 2.719 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CN2CCC(O)CC2)cc1 95503107 PTUSJGBWUORZDP-QFIPXVFZSA-N 384.520 2.515 0 50 GFAA CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)Cn1ccnc1-c1ccccc1 95504131 SDPKELOGJNCVAG-UHFFFAOYSA-N 379.445 2.507 0 50 GFAA Cc1cc(O)c2cccc(C(=O)N3CCC([C@@H](O)c4nccn4C)CC3)c2n1 426478156 SBGOBWUKISWVIE-LJQANCHMSA-N 380.448 2.568 0 50 GFAA C[C@H](N)C(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95513252 ONYSXBPQXPLEQQ-ZDUSSCGKSA-N 393.915 2.729 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cn1 95363509 OWQNCUZQOVYFPU-VLCRHTCISA-N 391.471 2.821 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)NCCCSc1nnc(C)s1 97137452 JFPNCYDYAGYXBZ-LBPRGKRZSA-N 392.506 2.580 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3cccc4c3ccn4C)C2)CCC1=O 92019365 SJRZTXOTMZAKBA-JOCHJYFZSA-N 383.492 2.670 0 50 GFAA CCc1nnsc1C(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95390349 DMNJZSDRGCUEMG-WMLDXEAASA-N 382.533 2.804 0 50 GFAA CCCNC(=O)c1cc(NC(=O)NCCN2CCCCC2=O)ccc1Cl 97179331 QAPFICGCNZGYJH-UHFFFAOYSA-N 380.876 2.614 0 50 GFAA O=C(Nc1ccnn1Cc1ccccc1)N[C@@H]1CCCN(c2ncccn2)C1 299789900 AQUFTGBTIGJXPQ-QGZVFWFLSA-N 377.452 2.512 0 50 GFAA COC(=O)c1c(-c2cccc(C(=O)NCCc3cscn3)c2)c(C)nn1C 299802892 RVHLTRVHZHAEIC-UHFFFAOYSA-N 384.461 2.611 0 50 GFAA Cc1nnc(CN(C)C(=O)c2cccc(-c3nccnc3N3CCCC3)c2)o1 299793071 JJEDUPPSQGJLJY-UHFFFAOYSA-N 378.436 2.707 0 50 GFAA O=C1COc2cc(NC(=O)NCCN3CC[C@H](c4ccccc4)C3)ccc2N1 299799017 UIXFPRJZZZNINA-INIZCTEOSA-N 380.448 2.629 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCC(n3c(O)nc4ccccc43)CC2)n[nH]1 828211453 FGYJHGCWNUWCIY-UHFFFAOYSA-N 390.447 2.948 0 50 GFAA CN1CCN(Cc2cccc(C(=O)Nc3ccc(Cn4ccnc4)cc3)c2)CC1 1875261235 ASEGZWFOXQCSFG-UHFFFAOYSA-N 389.503 2.931 0 50 GFAA CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC1CC(n2cccn2)C1 1875320426 CNLIVAODCARDFL-UHYCVJNDSA-N 393.491 2.568 0 50 GFAA CC(=O)N[C@H](CC(=O)Nc1ncc([C@@H]2CCCCN2)cn1)c1ccc(C)cc1 1875325883 WOWQSOKRPRQSIM-RBUKOAKNSA-N 381.480 2.806 0 50 GFAA FC(F)c1nnc2n1C[C@@H](CN=c1cc(Cl)nc([C@H]3CCCO3)[nH]1)CC2 1875395080 KEFVQHZXVQMKLQ-NXEZZACHSA-N 384.818 2.607 0 50 GFAA CNC(=O)c1cccc(OCC(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)c1 1875390225 ABNPMMHIZPYHGE-MRXNPFEDSA-N 388.851 2.758 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CCn2c(=O)oc3ccc(C)cc32)c1C 952979237 GNCDMZCFUVDABE-UHFFFAOYSA-N 381.432 2.990 0 50 GFAA COc1csc(-c2cc(NC(=O)N3CCCc4c(cnn4C)C3)n(C)n2)c1 886093431 PFELQQBRPUBRQC-UHFFFAOYSA-N 386.481 2.871 0 50 GFAA COc1ccc(CN(C(=O)[C@H]2C[C@H]2C(=O)O)c2ccc3c(c2)OCO3)c(OC)c1 1775965307 SQSIMGNPNDHDOI-JKSUJKDBSA-N 399.399 2.686 0 50 GFAA Cn1nc(C(=O)N2CCC([C@H]3C[C@@H](N)CCO3)CC2)cc1-c1ccc(F)cc1 1343670375 AOUWWFZETPNJLL-FXAWDEMLSA-N 386.471 2.585 0 50 GFAA CCNS(=O)(=O)[C@H]1CCN(C(=O)Nc2cc(C(F)F)ccc2Cl)C1 271330777 LWQPOTGFGIIJPP-JTQLQIEISA-N 381.832 2.823 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)/C=C/c3ccccc3Cl)CCO2)cn1 275339272 RHXMVYVEGFKKQO-JEJOPICUSA-N 381.885 2.930 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)N1CCCC[C@H](N2CCCC2)C1 186731801 RXMOSGYGADJRIS-KRWDZBQOSA-N 390.494 2.921 0 50 GFAA CC(C)(C)c1ccc(Cn2nccc2NC(=O)N2CC[C@]3(CNC(=O)C3)C2)cc1 278853380 QMRITNFMNIXTDP-QFIPXVFZSA-N 395.507 2.973 0 50 GFAA O=C1CO[C@H](C(=O)N2CCC(Cc3ccccc3)CC2)[C@@H](c2ccccc2)N1 1529167288 IDDUMMSJXGONLQ-YADHBBJMSA-N 378.472 2.724 0 50 GFAA O=C(c1cn(Cc2ccc(F)cc2Cl)nn1)N1CCCC[C@H]1CCCO 11711431 LOFDOJYVXGLEKW-HNNXBMFYSA-N 380.851 2.886 0 50 GFAA CCc1csc(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(OC)c3)C2)n1 11718581 CGWXVXDBRDMHTO-HNNXBMFYSA-N 387.505 2.769 0 50 GFAA C[C@@H]1CCCCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 11934624 MCVQNPSFXFLYLG-OAHLLOKOSA-N 380.510 2.504 0 50 GFAA CS(=O)(=O)c1ccc(-c2cccc3c2O[C@H](CNC(=O)C2CCC2)C3)cc1 12040070 HXRQGKIBRGBMNE-KRWDZBQOSA-N 385.485 2.977 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2nc3ccccc3[nH]2)C1)c1ccc2c(c1)OCO2 12300652 YVJNFEKIKVYGBJ-OAHLLOKOSA-N 392.459 2.934 0 50 GFAA O=C(NCC[C@H]1CCCCO1)c1cc(COc2ccc(-n3cncn3)cc2)on1 12314102 LOCRJXBPNAEPEH-MRXNPFEDSA-N 397.435 2.523 0 50 GFAA CCc1ccc(CN2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)o1 15071734 HUZLWCBXDRWMDR-FGZHOGPDSA-N 387.499 2.739 0 50 GFAA CC1=NS(=O)(=O)c2cc(C(=O)NCc3cccnc3)ccc2N1CC(C)C 15867685 BIEYPFCILDIBSF-UHFFFAOYSA-N 386.477 2.595 0 50 GFAA CSc1ccccc1NC(=O)N1CCC(n2cc(C[C@H](C)O)nn2)CC1 19731739 RFUAZWQUFHUFDE-ZDUSSCGKSA-N 375.498 2.792 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccncc3)n1)CCN(C(=O)[C@H]1CCCO1)C2 19837964 DHSSKDIEVZXBBY-QGZVFWFLSA-N 391.431 2.566 0 50 GFAA CC(=O)NCCC(=O)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1857710198 LJOXTCJDYSINLZ-LEWJYISDSA-N 396.443 2.583 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1cnc2c(c1)CCCC2 1857716257 DQDBCAUKGBANQR-RZUBCFFCSA-N 377.488 2.905 0 50 GFAA Cc1cc(C)nc(CCNC(=O)C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857716923 JEJSSMRTVUTQJZ-INIZCTEOSA-N 394.479 2.595 0 50 GFAA COCC1(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)CCC1 1857740644 SBOKGTRJHQKKNE-DZCCDHAISA-N 384.520 2.599 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(c4ccccn4)C[C@]34CC[C@H]2O4)cc(C)n1 1875246182 KBVQQPLCBPVWMF-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(OC)cc3F)C[C@]23CC[C@H]1O3 1875249222 LWBQCFZZKISDJJ-GMLUQMLDSA-N 376.472 2.730 0 50 GFAA CN(C)C[C@@H]1C[C@H](CO)CN(C(=O)Cc2ccc3[nH]c4ccccc4c3c2)C1 248021844 RMENKOIIZDQHCN-ROUUACIJSA-N 379.504 2.882 0 50 GFAA O=C1CN(C(=O)CN[C@H](CC(F)(F)F)c2cc(Cl)cc(Cl)c2)CCN1 2325827049 UCQFYDGBIXPKIT-GFCCVEGCSA-N 398.212 2.535 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@H]2c3cc(Cl)cc(Cl)c3C[C@@H]2O)CC1 2325883984 PIQAGJZHWXCZHR-WMZOPIPTSA-N 397.302 2.835 0 50 GFAA CC[C@@H]1SC2=NC(C)=C(C(=O)OC)[C@H](c3ccc(OC(C)=O)cc3)N2C1=O 2695625 OJZBJKXWRMCKQR-HOCLYGCPSA-N 388.445 2.824 0 50 GFAA O=C1CCCN1CCCNC(=S)Nc1cnn(Cc2ccccc2Cl)c1 2802134 DZKYPDNJNMENLQ-UHFFFAOYSA-N 391.928 2.884 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1c(C)nn(Cc2ccccc2F)c1C 2804860 FYZXQDAPCZVZIO-UHFFFAOYSA-N 377.445 2.530 0 50 GFAA CSc1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 6698163 XVSYQRUXLDPXDR-UHFFFAOYSA-N 376.503 2.555 0 50 GFAA CCn1ccnc1CN(C)Cc1ccc(OC[C@H](O)CN2CCCCC2)cc1 11819315 CCCUCYKVMIBYQH-HXUWFJFHSA-N 386.540 2.761 0 50 GFAA CCOC(=O)CN(C)C(=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 12454791 JKPQWDOMSGPPKU-UHFFFAOYSA-N 386.326 2.908 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2CCCN(c3ccccn3)C2)CC1)N1CCCC1 12589355 IBDXMBJAULFTSJ-FQEVSTJZSA-N 398.551 2.939 0 50 GFAA CC(C)CN1C[C@H](OCc2cccc(F)c2)CN(C2CCN(C)CC2)CC1=O 14537985 HJNUYZMWEDPHDO-OAQYLSRUSA-N 391.531 2.605 0 50 GFAA Cc1ccccc1[C@H](CC(=O)N1CCN(CCC(N)=O)CC1)c1ccccc1 15065756 VKZCJZBEKHHDMG-OAQYLSRUSA-N 379.504 2.537 0 50 GFAA CCc1nc(C)c(CN2CCc3c(c(C(=O)NCc4ccccc4)nn3C)C2)[nH]1 19223306 XBCQVYXDJBCYNB-UHFFFAOYSA-N 392.507 2.502 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 21005586 INIVRCKFVCEOOY-INIZCTEOSA-N 378.425 2.535 0 50 GFAA OCC[C@@H]1CN(Cc2cnc(N3CCCC3)s2)CCN1Cc1ccsc1 23373130 QIPKLXALSUPTHB-QGZVFWFLSA-N 392.594 2.874 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccccc3Cl)CC2)cc(-n2cccn2)n1 35597324 FSYQXXBIYZUDOQ-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)cc1 36385632 DTEXRXDZTXQYBR-HSZRJFAPSA-N 381.520 2.756 0 50 GFAA CCOc1nc2ccccc2nc1N1CCC[C@@H](C(=O)N2CCSCC2)C1 44803589 BMVNVQMKAIXELO-OAHLLOKOSA-N 386.521 2.820 0 50 GFAA COc1ccccc1/C=C/CN1CCNC(=O)[C@@H]1CC(=O)NC1CCCCCC1 55211797 GHVFHKXARCHJNP-MFUYTVRRSA-N 399.535 2.738 0 50 GFAA CC(C)c1cc(C(=O)N2CCn3nc(C(=O)Nc4ccccc4)cc3C2)no1 65405282 LGQLFBJNDUIRBT-UHFFFAOYSA-N 379.420 2.903 0 50 GFAA O=C1C[C@H](c2ccc(OCCCN3CCOCC3)cc2)c2ccc(O)cc2N1 65435732 QVEZQSVHXCDCJI-HXUWFJFHSA-N 382.460 2.967 0 50 GFAA COC1CCN(c2ccc(C(=O)NCCCn3ccnc3C(C)C)cn2)CC1 67675572 HJCXCKWCDCYNHD-UHFFFAOYSA-N 385.512 2.837 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CCC[C@@H](c4ccn[nH]4)C3)cc2n1 67786807 PEKNAIKVILZFAQ-LLVKDONJSA-N 378.358 2.799 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)NCCC(C)C)c2=O)cc1 77322287 STXKIOUPKFYVQM-UHFFFAOYSA-N 394.475 2.872 0 50 GFAA CCC[C@@]1(CO)CCCN(Cc2ccc(-c3nc(COC)cc(=O)[nH]3)cc2)C1 82039444 UFQQSTYOCDPKOK-JOCHJYFZSA-N 385.508 2.958 0 50 GFAA CC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1c[nH]nc1-c1cccc(F)c1 91416550 IFUGORCLCKTGIP-UYAOXDASSA-N 378.407 2.748 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(-c3noc(C4CCC4)n3)[nH]c2C1 95357271 VYORWYVLWRPZNT-LBPRGKRZSA-N 379.420 2.806 0 50 GFAA CCNC(=O)c1ccc(N2CCC(NCc3nc4ccc(C)cc4[nH]3)CC2)nc1 95372019 IJNTXYVNGRDGBC-UHFFFAOYSA-N 392.507 2.775 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)ccn1 95387691 POSALGGOJWJJBG-GOSISDBHSA-N 377.448 2.750 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N(C)CCCc2cnn(C)c2)cc1Cl 95512468 FBJRNSNFXFJHMJ-UHFFFAOYSA-N 377.876 2.920 0 50 GFAA Cc1cc([C@@H]2CCCCN2C(=O)Nc2cc(S(N)(=O)=O)ccc2C)no1 95513325 WKQBOJGIGUJELY-INIZCTEOSA-N 378.454 2.698 0 50 GFAA COc1ccc(-c2ccccc2NC(=O)NC[C@H]2CN(C(C)=O)CCO2)cc1 95516483 WNVHEBPQELKVIW-SFHVURJKSA-N 383.448 2.731 0 50 GFAA Cn1nc(-c2nc(C3(c4ccccc4)CC3)nn2CC(F)(F)F)ccc1=O 96137640 VBOZKCBLKHMZJN-UHFFFAOYSA-N 375.354 2.681 0 50 GFAA O=C(c1cnn2cc(CCO)cnc12)N(Cc1cccnc1)C1CCCCC1 97272477 LJJBNFDGAIZTOI-UHFFFAOYSA-N 379.464 2.634 0 50 GFAA Cc1c(C(=O)N2CCCC[C@@H]2CN2CCOCC2)cnn1-c1ccc(F)cc1 110954339 ATLVAQJNRZXFEY-LJQANCHMSA-N 386.471 2.647 0 50 GFAA C[C@@H](c1ccccc1)N1C[C@@H](C(=O)N2CCC(c3ccnn3C)CC2)CC1=O 124354946 HKFAMGOWBOMOIE-LPHOPBHVSA-N 380.492 2.736 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCNC[C@H]3C)cc2Br)on1 125327932 VXROIPMLSSDKJP-GFCCVEGCSA-N 394.269 2.758 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCNC[C@@H]3C)cc2Br)on1 126421594 VXROIPMLSSDKJP-LBPRGKRZSA-N 394.269 2.758 0 50 GFAA COCCc1noc(CN(C)C(=O)c2cnn(-c3ccccc3Cl)c2C)n1 152583465 DJYQAJBQHVPHNB-UHFFFAOYSA-N 389.843 2.678 0 50 GFAA COC[C@@H](O)CN1CCC(Nc2nc3ccccc3nc2N2CCCCC2)CC1 153005516 ZKJVSCIIDIOQSZ-SFHVURJKSA-N 399.539 2.504 0 50 GFAA Cc1nn(C)c(C)c1CN1CCN(C(=O)c2cnn(CC(C)C)c2C2CC2)CC1 156930179 JVOJLFOTCFVCJV-UHFFFAOYSA-N 398.555 2.725 0 50 GFAA O=C1C[C@@H](Cc2ccc(C(=O)Nc3csc(-c4ccncc4)n3)cc2)C(=O)N1 170596475 SIDUDTZKDQQWFF-OAHLLOKOSA-N 392.440 2.663 0 50 GFAA O=C1[C@@H](N2CCCN(C3CC3)CC2)CCCN1c1ccc(OC(F)F)cc1 173407342 GYLDFWLTFWOVSN-SFHVURJKSA-N 379.451 2.954 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(CNC(=O)CC[C@@H]2CCCCN2C)cc1 225470320 GOGJZLZZQPYDAS-SFHVURJKSA-N 395.569 2.598 0 50 GFAA CN(Cc1c(F)cccc1Cl)C(=O)c1ccc(CN2CCOCC2)cn1 225797770 AKIKTBWRLLLHGO-UHFFFAOYSA-N 377.847 2.979 0 50 GFAA CCCc1c(C(=O)N2CCC(C(=O)O)CC2)nnn1-c1cccc(Cl)c1 236885498 WBYNTMMNSSZEAN-UHFFFAOYSA-N 376.844 2.810 0 50 GFAA O=C(NCc1nc(-c2cccc(F)c2)no1)Nc1nc2c(s1)COCC2 278894354 QSZFROMQMHTEEO-UHFFFAOYSA-N 375.385 2.727 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@H]3CCS(=O)(=O)c4ccccc43)CC2)c1C 283846297 MDYRTJNEOMJGDZ-IBGZPJMESA-N 398.528 2.913 0 50 GFAA Cc1cccc(N2C[C@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)c1C 299724745 ZNRLFSFVZMWJHI-GOSISDBHSA-N 389.459 2.935 0 50 GFAA Cc1ccc(-c2nnc(-c3ccc(C(=O)N4CCOC[C@H]4C(=O)O)cc3)o2)cc1 299753877 ZPYDCBMBXQEVOP-KRWDZBQOSA-N 393.399 2.638 0 50 GFAA Cc1nn(C)c(C)c1[C@H](C)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl 299781327 HQKSCBMNEXBXSR-VIFPVBQESA-N 383.279 2.951 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)C1 328646983 SZQUXPBUGUQDCE-MRXNPFEDSA-N 395.438 2.804 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@@H]2NC(=O)N1CCC2(C1)Oc1ccccc1O2 367470727 VSGCJYGMTWABLP-AWEZNQCLSA-N 383.452 2.819 0 50 GFAA COc1ccc(NC(=O)N[C@H]2c3ccccc3O[C@@H]2C)cc1S(C)(=O)=O 417350846 QRZFJDDGYAXNTO-PIGZYNQJSA-N 376.434 2.742 0 50 GFAA CCN1CC[C@H](NC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)C1 426465293 RBGQWBWRXQDCLX-HNNXBMFYSA-N 388.537 2.735 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)N2CCC[C@]3(CN(C)C(=O)O3)C2)n1 426470874 OTHOJWWLWBSVJW-NRFANRHFSA-N 398.463 2.811 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCN(C)CC4)csc3C2)nc1 426470883 SLTKOWQBXJPZNQ-UHFFFAOYSA-N 384.549 2.651 0 50 GFAA COc1cccc([C@H]2CCCCN2C(=O)NCCCN2CCC(O)CC2)c1 426477343 GSKYJPUXQRBPEF-HXUWFJFHSA-N 375.513 2.779 0 50 GFAA O=C(NCC1CCOCC1)c1ccc(-c2nc3ccccc3n2CCO)cc1 426493315 VLMAFUKITWSSOQ-UHFFFAOYSA-N 379.460 2.852 0 50 GFAA Cc1nnc(CNC(=O)c2ccc(-c3cc(N4CCCCC4)ncn3)cc2)o1 426494433 NHQMNMIJTLDREO-UHFFFAOYSA-N 378.436 2.755 0 50 GFAA CCCOc1ccc(-c2cccc(C(=O)N[C@H]3CCCNC3=O)c2)cc1CO 426549907 KDBNJEVROXZMLK-IBGZPJMESA-N 382.460 2.643 0 50 GFAA O=C(NCCNC(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccc(F)cc1 471753591 AAXLCQMBDNXOPR-UHFFFAOYSA-N 394.328 2.652 0 50 GFAA O=C(c1cccc(-c2ccc(Cn3ccnc3)cn2)c1)N1CCCC[C@@H]1CO 534646037 DSPKXNAGRJLRCS-HXUWFJFHSA-N 376.460 2.980 0 50 GFAA CCN(C(=O)c1cccc(-c2ccc(-c3cnc[nH]3)cc2)c1)[C@H]1COC[C@@H]1O 584895331 DVDGMSJJOWKRFE-SFTDATJTSA-N 377.444 2.966 0 50 GFAA CC(=O)Nc1cccc(S(=O)(=O)NC2CCN(Cc3cccs3)CC2)c1 820593136 PNRJTSVAORJHME-UHFFFAOYSA-N 393.534 2.649 0 50 GFAA Cc1ccc(N2CCC(NC(=O)N3CCC[C@@H](N4CCCC4=O)CC3)CC2)nc1 888102653 ZLXRNQSIXMXZQB-LJQANCHMSA-N 399.539 2.545 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(C(=O)[C@H]3C[C@@]34CCNC4)CC2)n1 952894508 NNAZHTLNCAOPIW-WZONZLPQSA-N 392.503 2.858 0 50 GFAA O=C(Nc1cccc(-c2cnc[nH]2)c1)C1CCN(C(=O)c2ccccn2)CC1 952975438 ZHALCFFPKINBCK-UHFFFAOYSA-N 375.432 2.963 0 50 GFAA C[C@H](NC(=O)c1cnc2ccccn2c1=O)c1cnn(-c2ccccc2F)c1 952989340 TZENGPDLMLPSQJ-ZDUSSCGKSA-N 377.379 2.510 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@@H]2CCCC[C@H]2O)ccc1F 1704313644 LDJVHPCRWQTOCP-ZIAGYGMSSA-N 377.416 2.589 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@H]2CCC[C@@H](CO)C2)ccc1F 1704315548 JULYYFZQBRFNAI-OCCSQVGLSA-N 391.443 2.836 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)CCOC21CCN(Cc2cncnc2)CC1 1857691981 JJLXTWPUUZNTRH-UHFFFAOYSA-N 386.521 2.740 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccnnc1)C(=O)N1CC[C@H]1Cc1ccccc1 2325763841 ILQCZLAWQOFPIG-RBUKOAKNSA-N 396.491 2.756 0 50 GFAA CN(C(=O)C1CC1)c1ccc(NC(=O)C2(c3ccc(C(N)=O)cc3)CC2)cc1 2325806391 PFTFUPKYAJUCCS-UHFFFAOYSA-N 377.444 2.829 0 50 GFAA CC(=O)N1CCc2cc(-c3cn(Cc4cccc(CN(C)C)c4)nn3)ccc21 2325809196 ONZJLBIUPAYBIA-UHFFFAOYSA-N 375.476 2.964 0 50 GFAA NCC1(c2ccccc2)CCN(C(=O)Nc2ccc3[nH]c(C(N)=O)cc3c2)CC1 2325859887 OMLRPSRWTOMMOV-UHFFFAOYSA-N 391.475 2.791 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3ccc(O)nn3)C2)c2cccc(=O)n21 2356143044 SDJPRGOCKCDHTB-VKJFTORMSA-N 382.464 2.581 0 50 GFAA COc1cc(C)ccc1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356160125 DXTUBMBHTUKXEC-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA CCOC(=O)CCc1c(C(=O)OCC)[nH]c(C)c1I 638643 ZHYPDXAYOQBJHI-UHFFFAOYSA-N 379.194 2.600 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)cc1 711977 UMPSYXKQERCAFQ-FQEVSTJZSA-N 397.450 2.679 0 50 GFAA COC(=O)c1c(NC(=O)c2cccc(OC)c2)sc2c1[C@@H](C(=O)OC)CC2 944930 MUVHBANWNVPFTC-LBPRGKRZSA-N 389.429 2.998 0 50 GFAA COc1ccc(NC(=S)NC(=O)c2c(Br)c(C)nn2C)cc1 2797226 YLSCQLPJKYKJLK-UHFFFAOYSA-N 383.271 2.626 0 50 GFAA O=C(Cn1ncc2c3ccccc3n(Cc3ccccc3F)c2c1=O)NC1CC1 4917605 XFVKZRVCQDORPZ-UHFFFAOYSA-N 390.418 2.817 0 50 GFAA CCOC(=O)N1CCC(NC(=O)[C@@H]2CCC(=O)N(C3CCCCCC3)C2)CC1 12051484 NENMWOMEOVATSE-MRXNPFEDSA-N 393.528 2.685 0 50 GFAA O=C(NC[C@H]1Cc2cccc(-c3cnccn3)c2O1)c1ccc2c(c1)OCO2 12133780 XNPVZDLQZFUMEU-OAHLLOKOSA-N 375.384 2.606 0 50 GFAA O=C(NCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)C3CCC3)CC2)C1 12199018 SICZXBHLQDTSLE-FQEVSTJZSA-N 383.536 2.806 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)c2cc(C)n(C)n2)C1 14957879 PVXLWTSPUQPJAH-NRFANRHFSA-N 387.455 2.896 0 50 GFAA CCc1c(C)sc(NC(=O)COCC(=O)O)c1C(=O)NCc1ccccc1 17079639 BNFVDAJHESFEIB-UHFFFAOYSA-N 390.461 2.589 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2cc(C)c(OC)cc2C)CN1Cc1ccccc1 23359368 LVAMNLHKWWAKPH-RTWAWAEBSA-N 381.520 2.791 0 50 GFAA Cc1nnsc1CN(C)C[C@]1(O)CCCN(CCC2CCCCC2)C1=O 67842940 HBWMQMUMERAVJA-LJQANCHMSA-N 380.558 2.602 0 50 GFAA COc1ccc(-c2cc(=O)c3c(o2)-c2ccccc2S(=O)(=O)N3C)cc1O 71769130 GDNMIIHRQDIYCC-UHFFFAOYSA-N 385.397 2.827 0 50 GFAA Cc1nccn1-c1cc(NCCNC(=O)c2ccccc2C(F)(F)F)ncn1 72433955 BWYJLFODDOWFRD-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA CC(C)NC(=O)CCc1nc2cc(S(=O)(=O)NC(C)C)ccc2n1C(C)C 77564627 ACBIIEZCGGQZQH-UHFFFAOYSA-N 394.541 2.761 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91440269 QLXPUWSNKORXBA-UHFFFAOYSA-N 395.507 2.651 0 50 GFAA Cc1nc(C)c(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)o1 95368378 HZNSJZOSYSILER-PWIZWCRZSA-N 395.459 2.723 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2ccnc(OC)c2)C3)cc1 95381219 ALBMETOMZJPZOW-PKOBYXMFSA-N 381.476 2.835 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cccn1C(C)C)CC2 95506148 VQXJGAGKRSAZGE-UHFFFAOYSA-N 383.496 2.718 0 50 GFAA CCOC(=O)c1c(N)sc2c1C[C@H]1C(=O)N(C3CCCCC3)C(=O)[C@H]1C2 100589650 IVTNTJZTVUXIDR-NEPJUHHUSA-N 376.478 2.540 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3CCOc4c(Cl)cccc43)CC2)n1 158282051 PPASTKTYLZXHIR-UHFFFAOYSA-N 388.855 2.781 0 50 GFAA COc1ccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)cc1 169780727 ONVYFGZEHBBEFJ-UHFFFAOYSA-N 378.432 2.589 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)NCC(F)(F)CO)[C@H]1c1ccccc1OC 170597370 IWOFWSFAIXMDDZ-MAUKXSAKSA-N 398.450 2.519 0 50 GFAA COc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2noc3c2CCCC3)cc1 170623456 GRBGRJZDIBUIPP-OAHLLOKOSA-N 387.461 2.716 0 50 GFAA Cn1nnc2cc(C(=O)N3CCC[C@H](n4ccc(C(F)(F)F)n4)C3)ccc21 182865007 DVMAGBMCBPEMHG-LBPRGKRZSA-N 378.358 2.661 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)c1cnc3sc(C)c(C)n3c1=O)CC2 183493314 SBWDIQCTWFFSOZ-UHFFFAOYSA-N 399.472 2.589 0 50 GFAA CN(C)CCn1ccc2ccc(NC(=O)[C@@H]3COCCN3CC3CCC3)cc21 185704193 DOBDJQAHZQPSNN-NRFANRHFSA-N 384.524 2.642 0 50 GFAA O=C(Cc1cccc(F)c1F)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccn1 216746785 LIAFUEAFDCUZIG-WBVHZDCISA-N 385.414 2.552 0 50 GFAA Nc1nc(O)cc([C@H]2C[C@@H](NC(=O)CSCc3ccccc3Cl)C2)n1 240228053 KFHAQHFUQJBPCU-TXEJJXNPSA-N 378.885 2.713 0 50 GFAA Cc1nc2ccc(C(=O)N[C@H](Cc3ccccn3)[C@H]3C[C@@H](O)C3)cc2nc1C 244691710 JHVMCNSNYLSOOS-IMFGXOCKSA-N 376.460 2.754 0 50 GFAA CCN(C)C(=O)[C@@H](C)NC(=O)NCCc1ccc(OCc2ccccc2)cc1 252510889 ZQSUTVZBVHUVGV-QGZVFWFLSA-N 383.492 2.974 0 50 GFAA O=C(Cn1cnc2sccc2c1=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 267501990 UQMAWGOFVMTJPJ-CYBMUJFWSA-N 388.880 2.507 0 50 GFAA CCOc1cc(C(=O)N[C@@H]2C[C@@H](OCC)C23CCC3)ccc1OCC(=O)O 268939135 IRPYGNMPBMJQTN-IAGOWNOFSA-N 377.437 2.626 0 50 GFAA C[C@]1(O)CCCC[C@H]1[C@H]1CCCN1c1cc(S(=O)(=O)N2CCCC2)ccn1 284512700 DXCDCXKMAIRJNU-NSHGMRRFSA-N 393.553 2.776 0 50 GFAA Cc1cc(C)n(CC2(CNC(=O)c3cccc(-c4cc(O)ncn4)c3)CC2)n1 299777972 PSUXXBLXFVJEDV-UHFFFAOYSA-N 377.448 2.873 0 50 GFAA CO[C@H]1C[C@H](c2nc(C3CC3)no2)N(S(=O)(=O)c2ccc3c(c2)CCC3)C1 328639631 WXHWXUWQZHSSMS-DOTOQJQBSA-N 389.477 2.586 0 50 GFAA CC(=O)N1C[C@H](O)C[C@@H]1C(=O)Nc1cnn(-c2ccccc2Cl)c1C(C)C 373590874 CLMVLWAQRINRKJ-CXAGYDPISA-N 390.871 2.569 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cnoc2-c2ccccc2)CC1=O 426378311 ZXWZRAROLWRJIJ-UHFFFAOYSA-N 377.400 2.839 0 50 GFAA Cc1cc(-c2ccc(C(=O)N3CCN(CCO)CC3)cc2)c2ccccc2n1 426412390 LAICHPLGYFIPRR-UHFFFAOYSA-N 375.472 2.960 0 50 GFAA O=C1OCC2(CCN(C(=O)NCc3cc(-c4ccc(F)cc4)no3)CC2)O1 584901990 HGVXAVDWTMAYPB-UHFFFAOYSA-N 375.356 2.692 0 50 GFAA Cc1cccc2ncc(C(=O)NCCCc3nc4ccc(Cl)cc4[nH]3)c(=O)n12 670448118 HTANLBSUMPMUSM-UHFFFAOYSA-N 395.850 2.895 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC3(CCc4ccccc43)CC2)CN1Cc1cccnc1 952860311 LWIXOSXUKRHKET-HXUWFJFHSA-N 389.499 2.937 0 50 GFAA CC(=O)N1CC[C@@H](OC(=O)Cc2nnc(O)c3ccccc23)c2ccccc21 1462109289 ONWDNBFQIRTYOC-LJQANCHMSA-N 377.400 2.919 0 50 GFAA CCc1nc(C)sc1C(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccn1)C2 1565508173 SUXHRBFFIGOXLX-CABCVRRESA-N 384.505 2.786 0 50 GFAA O=C(O)CCNC(=O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704313326 LCQRZIYIHKTBLO-OAQYLSRUSA-N 380.448 2.608 0 50 GFAA CCCSc1nnc(NC(=O)[C@H](CC)Sc2nnc(N)s2)s1 1772493171 OFYQOTFFENARQK-LURJTMIESA-N 376.558 2.983 0 50 GFAA O=C(c1cc[nH]n1)N1CC[C@@H]2[C@H](CCCN2C(=O)CC2(C(F)(F)F)CC2)C1 1775993201 XGLPBSFBTQGBAV-TZMCWYRMSA-N 384.402 2.595 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(C1CCN(c3ccccc3F)CC1)C[C@H]2O 1857717602 PQNOLMGOPFIGLX-OTUUDDROSA-N 396.506 2.863 0 50 GFAA CC(C)NC(=O)[C@H](C)NC(=O)N=c1[nH]nc(-c2ccc(C(C)C)cc2)s1 1875266159 CKZYWXLETXWOGW-LBPRGKRZSA-N 375.498 2.785 0 50 GFAA O=C(NCCc1ccccc1Cl)N1CC[C@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401772 RJGGXYWMHMKFAA-HIFRSBDPSA-N 375.860 2.889 0 50 GFAA CCc1cccc(S(=O)(=O)NC(=O)[C@H]2[C@H]3CC[C@@]2(c2cncs2)C3)c1 1875404432 IQSXLGRVKWRLLT-XCRHUMRWSA-N 376.503 2.878 0 50 GFAA CN1CCc2nc(C(=O)N(Cc3cnn(C)c3)c3ccc(F)cc3)sc2C1 2325822196 ITPHALOUVSBJAY-UHFFFAOYSA-N 385.468 2.851 0 50 GFAA COC[C@@]12COC[C@@H]1CN(S(=O)(=O)c1ccc(Cl)c(C)c1Cl)C2 2356151773 YPTZXOBMWRKKSM-NHYWBVRUSA-N 380.293 2.585 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)N1CCN(c2ccc(F)cc2)CC1 5303682 KNDIFIFKVOERMM-UHFFFAOYSA-N 394.450 2.665 0 50 GFAA COc1cc(CN2CCCCO2)ccc1OC[C@H](O)CN1CCCCCC1 11953797 UVLMTSIBHBDIAR-LJQANCHMSA-N 378.513 2.838 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@@H]2CCC(=O)N(CCCc3ccccc3)C2)n1 12057160 FJRLFHDXHFFGHS-OAQYLSRUSA-N 396.535 2.878 0 50 GFAA CCNC(=O)c1cn(CCc2ccccc2)cc(C(=O)N2CCCC[C@H]2C)c1=O 12135741 FTOCMZYSELTHFJ-QGZVFWFLSA-N 395.503 2.855 0 50 GFAA COCCN1CC[C@H](N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)CCC1=O 20911659 AUHWOJGCQSCVAQ-LOIQHOORSA-N 389.584 2.600 0 50 GFAA Cc1ccc(NC(=O)CC(=O)N2CCc3nc[nH]c3[C@H]2c2ccccn2)cc1 55359293 PKRHMUCYBLUFRI-OAQYLSRUSA-N 375.432 2.616 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)c1 65364822 ZGOVQWCBAJPDGB-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA Cc1cccc(-c2cn[nH]c2C2CCN(C(=O)[C@H]3CCCN3C(N)=O)CC2)c1 67473401 WZCAKWNXYRVMJL-GOSISDBHSA-N 381.480 2.634 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c1 67604383 HNSYPBDAMWUOBO-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA COc1ccc2cc(C(=O)[C@@H]3CCCN(CCn4cc[nH]c4=O)C3)ccc2c1 71524309 UQLWDCGIUQWQRA-LJQANCHMSA-N 379.460 2.933 0 50 GFAA COc1ccccc1C(=O)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71747999 KWQUUFRWOIWKAR-GOSISDBHSA-N 399.535 2.634 0 50 GFAA CC(C)N(C)S(=O)(=O)c1ccc2c(c1)CN(C(=O)c1ccc(O)cc1)CC2 77356188 MLMKODHCEJGSDT-UHFFFAOYSA-N 388.489 2.620 0 50 GFAA C[C@@H](C(=O)O)N1CC2(CCC1=O)CCN(C(=O)c1ccccc1Cl)CC2 91680662 OAYXOHXQBSYARW-ZDUSSCGKSA-N 378.856 2.658 0 50 GFAA Cc1cc(N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)c2ccccc2n1 91694053 OBLVOSUCDFSRDI-XLIONFOSSA-N 383.492 2.935 0 50 GFAA O=C1N(CC2CC2)CCC[C@@]12CCN(Cc1cnc(-c3ccccn3)nc1)C2 92097205 HLGQMMJLPGTLQD-QFIPXVFZSA-N 377.492 2.763 0 50 GFAA CN1CC[C@@]2(CCC1=O)CN(Cc1cnc(C3CCCCC3)nc1)CCN2C 95374133 HZRJOVJOOCOTMM-QFIPXVFZSA-N 385.556 2.653 0 50 GFAA COC(=O)c1ccc(OC)c(NC(=O)NC[C@H](c2ccc(C)o2)N(C)C)c1 96132596 KFPKMFOLXGMHAZ-OAHLLOKOSA-N 375.425 2.808 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](NC(=O)C2CCCC2)CN1Cc1cccs1 96149478 RGUGMBKREBIILX-WMZOPIPTSA-N 377.554 2.866 0 50 GFAA Cc1cccc(NC(=O)CNc2ccccc2C(=O)N2CCC[C@@H]2CO)c1C 109745653 YCGADRPQCIBQKA-QGZVFWFLSA-N 381.476 2.951 0 50 GFAA COc1ccnc(N2CCN([C@H]3CCN(c4ccccc4Cl)C3=O)CC2)c1 111226403 IKWDYSIBFZGWAC-SFHVURJKSA-N 386.883 2.671 0 50 GFAA Cc1cc(Br)cc2cc(C(=O)NCCc3nnc(S)n3C)oc12 156030303 BUPYNJCMNDXXNO-UHFFFAOYSA-N 395.282 2.893 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4c(F)cccc4F)nnc23)n1 169776221 KISXRCPYTIBUJZ-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA COc1ccccc1N1CCC(NC(=O)NC[C@@](C)(O)c2ccsc2)CC1 172615408 PFTARXABZBJQCG-HXUWFJFHSA-N 389.521 2.932 0 50 GFAA Cn1cnc(-c2ccc(C(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)cc2)n1 183649817 ZIXLGNOIIUOJEM-IBGZPJMESA-N 389.503 2.777 0 50 GFAA CCN1CCN(c2ccc(C(=O)Nc3cncnc3N3CCCC3)cc2F)CC1 186235126 HNKGVPRBZRPGAS-UHFFFAOYSA-N 398.486 2.610 0 50 GFAA Cn1c(CN2CCC[C@@H](C(=O)NCC3CC3)C2)nnc1-c1ccc(Cl)cc1 186277845 OGQXUDQDZFDIMD-MRXNPFEDSA-N 387.915 2.874 0 50 GFAA CCn1cc([C@H]2C[S@@](=O)CCN2C(=O)Cc2ccc(C(F)(F)F)cc2)cn1 225417473 ADPMENDGTIKJMW-JWIGPWBQSA-N 399.438 2.797 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccs1)C(=O)O 236784093 KEWCHWPSYSGGAG-HZPDHXFCSA-N 388.489 2.705 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1 237960905 PTUGXVVFWKSSJS-WMZOPIPTSA-N 384.407 2.506 0 50 GFAA O=C(O)CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)C1CCOCC1 238115137 NVLYPEPMOCLUDA-UHFFFAOYSA-N 398.246 2.885 0 50 GFAA CCOC(=O)c1ncc(C(=O)Nc2ccc(N3C(=O)CCC3=O)c(C)c2)s1 241961237 UQNPXRUIOQALJP-UHFFFAOYSA-N 387.417 2.534 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)CCC(=O)N2CCc3sccc3C2)Cc2ccccc21 262189054 QWQIWMUCLUKJRC-QGZVFWFLSA-N 398.484 2.624 0 50 GFAA O=C(Nc1cc(Cl)ccc1OC(F)(F)F)N1CCOC[C@H]1c1nc[nH]n1 297155354 GNDFTBPUDSYCGE-JTQLQIEISA-N 391.737 2.962 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)sc1Br 328625912 LCZDHKDELMZCPT-JTQLQIEISA-N 390.328 2.556 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(Cc1nnnn1C(C)C)CC2 328650558 VNVHOAQOPXLVSQ-QGZVFWFLSA-N 388.541 2.719 0 50 GFAA CC(=O)N(C[C@@H]1CCCN1S(=O)(=O)c1cccc2c1OC(C)(C)C2)C1CC1 328854976 XOCNSDOQHJCZBB-KRWDZBQOSA-N 392.521 2.564 0 50 GFAA O=C(N1CCCC1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nc3c([nH]2)CCCC3)C1 329056816 YAYBTAYBGKUSLH-VQIMIIECSA-N 399.539 2.880 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 363233679 MKJRSHNMQVIHIX-OXQOHEQNSA-N 386.471 2.996 0 50 GFAA CS(=O)(=O)Cc1noc(CN2CCC3(CC2)C2CC4CC(C2)CC3C4)n1 364535811 JIJCBRGUSZTSKE-UHFFFAOYSA-N 379.526 2.653 0 50 GFAA CC(C)(C)NC(=O)CN1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2=O)C1 426419941 ATPBWWYTBQBJMI-NRFANRHFSA-N 375.488 2.555 0 50 GFAA Cc1cc(N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)n2ncnc2n1 475732316 PRMDLLRJWQQVAB-LBPRGKRZSA-N 376.342 2.669 0 50 GFAA Cc1sc2ncn([C@@H]3CCNC[C@H]3O)c(=O)c2c1-c1cccc(Cl)c1 670440137 IUUNCBYABTVODG-ZIAGYGMSSA-N 375.881 2.982 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)NCc1nc2ccc(Cl)cc2[nH]1 670459249 BJUJSMZUPBMNCB-AWEZNQCLSA-N 382.851 2.849 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N(Cc2ccccn2)C[C@H]2CCCO2)c1C 952962465 DRGDCFRQZHBNGM-LJQANCHMSA-N 384.480 2.695 0 50 GFAA COc1ccc2c(c1)C=C(CNC[C@H](c1ccccn1)N1CCOCC1)CO2 952968083 JLJPALHNDWEOIQ-OAQYLSRUSA-N 381.476 2.529 0 50 GFAA O=C(NCCCC(F)F)N1CCCN(c2nnc(C(F)(F)F)s2)CC1 1343828899 KEQRYUNTEFIDNP-UHFFFAOYSA-N 387.378 2.824 0 50 GFAA Cc1noc(C)c1CN1CCC(=O)N(Cc2noc(-c3ccccc3)n2)CC1 1506416419 BBCXHGBOGJDTAU-UHFFFAOYSA-N 381.436 2.576 0 50 GFAA O=C(CNc1ccc(F)cc1)N1CCCN(C(=O)COCc2ccccc2)CC1 1529190702 MTLBGEKFIXBUFY-UHFFFAOYSA-N 399.466 2.515 0 50 GFAA CN(C)[C@@H]1[C@H]2OCC[C@H]2[C@H]1NC(=O)Cc1ccccc1OCc1ccccc1 1565526887 WPJYTOITDVWNTA-AWDZXFJFSA-N 380.488 2.642 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)CC3CCN(Cc4ccccc4)CC3)C[C@@H]12 1704297865 FASXGDAYAWGANQ-ISKFKSNPSA-N 399.579 2.594 0 50 GFAA CCC[C@H]1C[C@H]1C(=O)N1CCCN(c2ncccc2C(=O)N2CCCC2)CC1 1772814492 CDHBMAYJLHOTCU-PKOBYXMFSA-N 384.524 2.793 0 50 GFAA COc1cccc(CN2C[C@@H]3CN(C(=O)Nc4ccccc4C)C[C@]3(CO)C2)c1 1772816575 VTXKEJKZFYDPOF-XXBNENTESA-N 395.503 2.962 0 50 GFAA Cc1cc(=O)c(O)c(C(C)(C)CC(=O)N[C@H](Cc2ccccc2)c2nc[nH]n2)o1 1857526886 IFJOFDBYIQKSKN-OAHLLOKOSA-N 396.447 2.540 0 50 GFAA O=C(c1ccncc1Cl)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857729028 RRJWOXPYQVGMRI-HLIPFELVSA-N 383.835 2.650 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(Cc2ccc(-n3ccnc3)cc2)C[C@H]1O 1875246267 DDGVGKNQWPTRMH-FYYLOGMGSA-N 391.471 2.753 0 50 GFAA Oc1n[nH]c([C@@H]2[C@H](C3CC3)CCN2c2nc(C3CC3)ncc2Br)n1 1875399702 HRAPZHYUAIWKLC-JQWIXIFHSA-N 391.273 2.918 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1CCC[C@]12CCCN(CCO)C2=O 2356138648 PUEKUEJTPRBJOF-QHCPKHFHSA-N 397.519 2.612 0 50 GFAA Cc1cc(C)n(CCCNC(=O)c2cc3c(s2)CCOC32CCNCC2)n1 2356144654 HMAPBDIUFLDOQB-UHFFFAOYSA-N 388.537 2.533 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356146881 YTBXBNDKCLMPOE-JXXFODFXSA-N 393.915 2.579 0 50 GFAA COC(=O)c1ccc(N2C(=O)c3ccc(Br)cc3C2=O)cc1O 820922 ZALRDLVKVWVFPE-UHFFFAOYSA-N 376.162 2.742 0 50 GFAA CC(=O)N[C@@H](CC(=O)NCCCN1CCCO[C@H](C)C1)c1ccc(Cl)cc1 225462129 DZCRISVAEFNDDJ-BEFAXECRSA-N 395.931 2.524 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)N(C)C[C@H]2CCN(CC(C)C)C2)cc1 55120058 XCVXEGXEQWBKIP-QGZVFWFLSA-N 375.513 2.850 0 50 GFAA COC[C@@H](C)NC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 64609998 CWENEJXHEOFTHA-LJQANCHMSA-N 387.568 2.823 0 50 GFAA CCOc1ccccc1CN(CC)C(=O)Cc1ccc(-n2nnnc2C)cc1 55392974 VKMYHKMHMJGMIV-UHFFFAOYSA-N 379.464 2.961 0 50 GFAA COc1ccc(C(=O)N[C@H]2CCN(c3cnn(C)c3)C2=O)cc1-c1ccccc1 117696834 MONRMNCQSWSKLK-IBGZPJMESA-N 390.443 2.631 0 50 GFAA CCNc1cc(N2CCN(C(=O)Nc3ccc(OC)cc3C)CC2)nc(C)n1 67629563 ZEEPSBZXIKKRGB-UHFFFAOYSA-N 384.484 2.888 0 50 GFAA Nc1nc2c(s1)[C@H](c1ccccc1OCCCn1ccnc1)CC(=O)NC2 65454022 PFAFLKJZLKAFSQ-AWEZNQCLSA-N 383.477 2.543 0 50 GFAA COc1cc(CN2CCN(Cc3ccccc3C)[C@@H](CCO)C2)cc2c1OCO2 23375433 NQFVLZGHMFHKNR-FQEVSTJZSA-N 398.503 2.801 0 50 GFAA Cc1nnc(CN2CCC(CNC(=O)CCc3c[nH]c4ccccc34)CC2)o1 1506430626 BOCYHZZBLWUKGZ-UHFFFAOYSA-N 381.480 2.820 0 50 GFAA O=C(Nc1ccccc1)C1=C(NC[C@H]2CCCO2)c2ccccc2S1(=O)=O 20725338 OYIJXJZZMFOZAN-OAHLLOKOSA-N 384.457 2.550 0 50 GFAA CCNc1cc(C)nc(N2CCN(C(=O)Nc3cc(C)ccc3OC)CC2)n1 67621508 FZQYCOOMDFVKPV-UHFFFAOYSA-N 384.484 2.888 0 50 GFAA Brc1c(OCCNCCN2CCOCC2)ccc2ccccc12 20482207 FQXAJOXVWVCBTM-UHFFFAOYSA-N 379.298 2.903 0 50 GFAA C[C@@H](NC(=O)c1cccs1)C(=O)NCC1CCN(Cc2cccs2)CC1 145757613 MZKVNQLGWJVCLR-CQSZACIVSA-N 391.562 2.956 0 50 GFAA CC1(C)C[C@@]2(N=C(O)N(CC(=O)Nc3ccc4c(c3)CCC4)C2=O)C(C)(C)O1 330056392 VUKSFQZYFMQAEW-NRFANRHFSA-N 385.464 2.586 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1CCc2ccc(NC(=O)[C@@H]3CCCO3)cc2C1 12204449 YWSGNNPDKKZMFE-FQEVSTJZSA-N 396.491 2.662 0 50 GFAA CN(C)CCCNC(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71758828 QLKNLRRBAKJXET-HSZRJFAPSA-N 379.504 2.602 0 50 GFAA COCC1(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)CCC1 71747826 MJYHOPTWMATUST-PWRODBHTSA-N 384.520 2.901 0 50 GFAA O=C(NCC1(CN2CCOCC2)CCCCC1)N[C@@H]1CCc2c(O)cccc21 333205511 AONASIQZEMGENZ-LJQANCHMSA-N 387.524 2.961 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NC(=O)c1oc2c(c1C)C(=O)CC(C)(C)C2 155380992 QMSNJUOBQVAUFB-GFCCVEGCSA-N 386.452 2.746 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)C1 130425168 VLHGUGLVRLTOKI-HKUYNNGSSA-N 380.444 2.747 0 50 GFAA Cc1cc(CN2CCOC[C@H]2c2ncnn2C)cc(C)c1OCc1ccccn1 284364989 NGQSFQGYJWZSNW-FQEVSTJZSA-N 393.491 2.979 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C[C@@H]2CN(c3ccc(F)cc3)C(=O)O2)CC1 221540634 BISZYWQYJMNIOL-MRXNPFEDSA-N 379.432 2.704 0 50 GFAA O=C1Cc2cc(CCCC(=O)N3CCC[C@](O)(C(F)(F)F)CC3)ccc2N1 287775289 IFIDTDXNBKQXJW-GOSISDBHSA-N 384.398 2.810 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2CCN([C@@H]3CCNC3)CC2)cc1OCC 289343385 XDSYYVMZQIJQSA-MRXNPFEDSA-N 395.931 2.647 0 50 GFAA O=C(NCc1sc2ccccc2c1Cl)N1C[C@H](O)[C@@H](N2CCCC2)C1 426707538 XEQDKGFOJYHSRK-KBPBESRZSA-N 379.913 2.905 0 50 GFAA Cc1ccc(NC(=O)c2scnc2C(F)(F)F)cc1S(=O)(=O)N(C)C 291507644 PYRFUYGJFKGHCD-UHFFFAOYSA-N 393.412 2.973 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 95388891 WMVZIDFZBCYWJN-QGZVFWFLSA-N 379.508 2.875 0 50 GFAA O=C(c1cccnc1)N1C[C@@H]2CC[C@H](C1)N(C(=O)NCc1ccc(F)cc1)C2 91461707 KFPKKTFXCPOXRI-QFBILLFUSA-N 382.439 2.667 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4ccccc4O)C3)CCC2=O)cn1 91664920 KQJHCVJJHNVZSL-JOCHJYFZSA-N 394.475 2.536 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@H](CCC(=O)N(C)CCc3ccccn3)C2)cn1 95509659 XHCBNGPEYNINRT-SFHVURJKSA-N 395.507 2.514 0 50 GFAA COc1ccccc1Cc1nc(-c2ccc(=O)n(C)c2)n(CC(F)(F)F)n1 96180032 GHMQIMGXYVQPSV-UHFFFAOYSA-N 378.354 2.806 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Oc3ccc(Cl)cc3)[C@@H]3OC(C)(C)O[C@H]3[C@H]2O1 239235673 WLUSHOBOGRNGTN-SSZWKKLZSA-N 384.812 2.642 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1cccn1C 95498695 CKBKSLDPHADYSX-LJQANCHMSA-N 395.547 2.993 0 50 GFAA Cc1cc(N2CCC(NCCCn3ccnn3)CC2)nc(-c2ccccc2)n1 96180557 FIVIGPRGWPQLPR-UHFFFAOYSA-N 377.496 2.692 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1ccccc1 299750072 MPAFTLQPLOIQLY-MRXNPFEDSA-N 387.823 2.815 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@@H](c1ncnn1C)C(C)C 299786144 MCJCHHUZKIEJOL-QGZVFWFLSA-N 384.484 2.878 0 50 GFAA O=C(N[C@H]1CC[C@H]1c1ccc(F)cc1F)N1CCS(=O)(=O)C[C@@H]1C1CCC1 1875404899 ZWIAEYOKDMSBDO-RYQLBKOJSA-N 398.475 2.820 0 50 GFAA COc1cccc([C@@H](CN2C(=O)N3CC(F)(F)C[C@]3(C)C2=O)N2CCCC2)c1 1875291240 SACOLVNKRXRPGO-VQIMIIECSA-N 393.434 2.894 0 50 GFAA Cc1cc(C)cc(OCC(=O)N[C@H]2CCN(C(=O)c3cccc4nc[nH]c34)C2)c1 1875310523 SXLAPJFNRUWNKN-INIZCTEOSA-N 392.459 2.589 0 50 GFAA Cc1cc(S(=O)(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)cc(C)c1F 186308681 ZXVSXORCHSEGEG-UHFFFAOYSA-N 385.505 2.693 0 50 GFAA CC(C)c1ccc(-n2cc(O)c(C(=O)NCCc3cn4c(n3)SCC4)n2)cc1 170597364 GJLXIACWXCSCED-UHFFFAOYSA-N 397.504 2.976 0 50 GFAA COc1ccc2c(CC(=O)NS(=O)(=O)c3sc(C)nc3C)coc2c1 170650494 GJOZQRBCXGSMBI-UHFFFAOYSA-N 380.447 2.562 0 50 GFAA O=C(CCCNC(=O)c1ccsc1)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 170602572 CFFRRLDQGGQIDR-CJNGLKHVSA-N 392.443 2.858 0 50 GFAA COc1cc(CN(CCc2ccccc2)C(=O)c2cc(N)n[nH]2)cc(OC)c1 1506408803 QCTSQMMAJMPGGC-UHFFFAOYSA-N 380.448 2.894 0 50 GFAA Cc1nc(N2CCCC2)nc(N2CCC(C(=O)NCc3ccccn3)CC2)c1C 1529161237 DRJIRYQMUQYBFH-UHFFFAOYSA-N 394.523 2.621 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1704300116 VITVDYHBSBWUIW-DYESRHJHSA-N 378.476 2.881 0 50 GFAA CC[C@]1(O)CCCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704303729 BAEJFMQLRWCVOM-NRFANRHFSA-N 385.464 2.555 0 50 GFAA Cc1cc(NCCS(=O)(=O)c2ccc(F)cc2)nc(N2CCCCC2)n1 1704303048 HZHGZJLGFWTKQT-UHFFFAOYSA-N 378.473 2.800 0 50 GFAA CCCOc1ccc(C(=O)N2C[C@@H](O)[C@H](Cc3cnccn3)C2)cc1Cl 1704356598 GRKCCUVNAUMTCG-RHSMWYFYSA-N 375.856 2.594 0 50 GFAA OC[C@@]12CN(Cc3cc[nH]n3)C[C@@H]1CN(Cc1ccc(-c3ccccc3F)o1)C2 1772701682 ORTVFXOJZYLEJM-ZHRRBRCNSA-N 396.466 2.735 0 50 GFAA O=C(Cc1nc2ccc(Cl)cc2[nH]c1=O)C(=O)Nc1ccc(Cl)cc1 5401352 OPFKVGXECNGSKO-UHFFFAOYSA-N 376.199 2.980 0 50 GFAA COc1ccc(OC)c(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 5701774 OHZFCVSNRXZZSN-UHFFFAOYSA-N 390.461 2.741 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CCCC[C@@H]2COC)n1Cc1ccccc1 11663387 IZYAASWBOQZZAN-GOSISDBHSA-N 391.537 2.726 0 50 GFAA CCCCNC(=O)N1CCC[C@H](CNC(=O)c2cc(OC)cc(OC)c2)C1 11944270 UWMRFTOZPZNAJA-OAHLLOKOSA-N 377.485 2.655 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccn(C)c2)cc1 12305099 OKHWYVOXECNJRG-FQEVSTJZSA-N 391.475 2.691 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2)CCCN(C(=O)CCN2CCCO2)C1 12439866 AFNHXHJWCQGSFT-OAQYLSRUSA-N 392.471 2.568 0 50 GFAA COc1cccc(N2C[C@H](C(=O)Nc3nnc(C(F)(F)F)s3)CC2=O)c1 13944101 KCOFOPZNOGWHGI-MRVPVSSYSA-N 386.355 2.557 0 50 GFAA CCOC(=O)c1nn(Cc2ccccn2)c2c1CN(Cc1cccc(O)c1)CC2 14745438 MMJHGDFCEKCYCI-UHFFFAOYSA-N 392.459 2.767 0 50 GFAA CCOC(=O)C1(CCOc2ccccc2)CCN(C(=O)c2csnn2)CC1 14961337 UUVWNQMZTCSHRZ-UHFFFAOYSA-N 389.477 2.793 0 50 GFAA C[C@H](NC(=O)CCc1ccccc1)c1nnc2n1CCN(Cc1ccco1)CC2 14987152 SLMOEJIZVPFBGG-KRWDZBQOSA-N 393.491 2.739 0 50 GFAA COc1ccc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c(OC)c1 169780830 QWGNFMMFPZGBFR-NSHDSACASA-N 398.394 2.711 0 50 GFAA CCOc1ccc2[nH]c(=O)c(-c3nccn3CCCN3CCOCC3)cc2c1 1857684875 IKDRCMMFVJJGRV-UHFFFAOYSA-N 382.464 2.513 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@@]3(CN(Cc4ncc(C)[nH]4)CC[C@H]3O)C2)c1 1857685099 CCZIBEGARVLNHO-DENIHFKCSA-N 382.508 2.516 0 50 GFAA c1c[nH]c(CN2CCO[C@@]3(C[C@@H]4CC[C@H](C3)N4Cc3ccc4c(c3)CCO4)C2)n1 1857701253 JRFOMJCSPBMDDE-NPHXMPSESA-N 394.519 2.743 0 50 GFAA O=C(C1Cc2ccccc2C1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857732362 NCPRROOAHJUMLM-IMSXRSKXSA-N 388.467 2.702 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCO[C@@H](C(=O)O)C1 263016737 SBSPVDMVEOHXSI-CYBMUJFWSA-N 396.852 2.610 0 50 GFAA CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N1CCC[C@H]1c1cccc2c1OCCO2 263857209 GSEBYPACXOOUJX-LZWOXQAQSA-N 375.469 2.608 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccccc3Cl)CC2)C(=O)N1c1cccc(F)c1 1109985 KWWYLBZSERMXHT-GOSISDBHSA-N 387.842 2.933 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)Nc1cc(-c2cccnc2)nn1C 2100482257 MBDURAFLCYSFPN-AWEZNQCLSA-N 377.404 2.555 0 50 GFAA COc1ccc(C(=O)N=c2[nH][nH]cc2-c2cccc(F)c2)cc1N1CCOCC1 2100534379 FTWQFGSQMIHHAC-UHFFFAOYSA-N 396.422 2.735 0 50 GFAA O=C(N[C@H]1C[C@H](NC(=O)c2ccc(C(F)F)o2)C12CCC2)C1=CCOCC1 2325794993 ZCKKRACGJJSEHY-GJZGRUSLSA-N 380.391 2.721 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1 904080 BYSQXYQCIQKQSU-CQSZACIVSA-N 381.475 2.816 0 50 GFAA O=C1c2ccccc2C(=O)N1CCc1nc2ccccc2c(=O)n1-c1cccnc1 978518 FYXBCSJPUDMRQF-UHFFFAOYSA-N 396.406 2.619 0 50 GFAA CCCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccccc1Cl 1901695 RKKJBTXDHZLSKU-UHFFFAOYSA-N 378.885 2.638 0 50 GFAA CC(C)c1nc(O)ccc1C(=O)N1CCc2nc(-c3ccccc3)nn2CC1 2356147654 HVNNGRACYFVILK-UHFFFAOYSA-N 377.448 2.868 0 50 GFAA COC(=O)c1ccccc1NC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 2859151 PINBTEPZDMIVPO-UHFFFAOYSA-N 383.404 2.590 0 50 GFAA COc1ccc(Cc2nnc(S[C@@H](C)C(=O)Nc3nccs3)n2C)cc1 4944049 LUOMSALYIUQCIK-NSHDSACASA-N 389.506 2.990 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1c(O)c2cccc3c2n(c1=O)CCC3 100662862 JFUJSAYQAKAURW-UHFFFAOYSA-N 378.384 2.692 0 50 GFAA biogenic Cc1cnc2c(C(=O)N3CCc4[nH]nc(-c5ccccc5F)c4C3)cnn2c1 67714005 RNHTXDDZVJLDJX-UHFFFAOYSA-N 376.395 2.765 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCN(c3ccc(Cl)cn3)CC2)CC1 1506405944 DNVNIMDUPLSAOA-UHFFFAOYSA-N 385.899 2.557 0 50 GFAA CN(C)CCNC(=O)[C@@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 67805055 VQTONSCHSMQMJY-GOSISDBHSA-N 393.535 2.527 0 50 GFAA O=C(O)c1ccnc(-c2ccnc(N3CCC[C@@H](C(=O)c4cccnc4)C3)n2)c1 72423400 HKMNQBTVPOGXPW-MRXNPFEDSA-N 389.415 2.731 0 50 GFAA O=C(c1ccc(Oc2cccc(Cl)c2)cc1)N1CCO[C@H](c2nn[nH]n2)C1 370860346 JPIPERPGSYBZKP-INIZCTEOSA-N 385.811 2.859 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)c3nc4ccccn4c3F)cn2)c1 72428400 GGJWKVICARECCC-UHFFFAOYSA-N 379.395 2.940 0 50 GFAA CC(C)n1cc([C@]2(O)CCN(C(=O)Nc3cccc(COCC4CC4)c3)C2)nn1 375418979 BGOHDAJRSJRPKR-NRFANRHFSA-N 399.495 2.911 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3ccc4c(c3)OCO4)CC2)C1)N1CCCC1 71757152 GIWHUPLZGNOIGA-IBGZPJMESA-N 399.535 2.714 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CCN2CCC(O)CC2)c2ccccc2)cc1 130689808 RJLRCOQKLMUPBN-OAQYLSRUSA-N 388.533 2.861 0 50 GFAA O=C(NC[C@H]1CCCS(=O)(=O)C1)c1cc(Oc2ccccc2)ccc1O 288381808 XRFWRHGCQLQLTD-CQSZACIVSA-N 375.446 2.739 0 50 GFAA CC(C)O[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91906367 SVNSKDWYTCVFAY-GOSISDBHSA-N 387.524 2.669 0 50 GFAA Cc1ccc2nc(O)c(CN3CCC[C@@H](c4ccnn4CC(=O)O)C3)cc2c1 426368273 KDBYGDSECSSVJC-OAHLLOKOSA-N 380.448 2.910 0 50 GFAA CC(C)c1noc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)n1 91562861 VBWVKYARVVHLSV-UHFFFAOYSA-N 383.496 2.993 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95527593 WYERVOBPPBDHEG-KRWDZBQOSA-N 377.448 2.750 0 50 GFAA CC(C)c1cc(C(=O)N[C@@H](C)c2ccccc2-n2cccn2)nc2ncnn12 91288873 SXHQFBCSVBSOMO-AWEZNQCLSA-N 375.436 2.924 0 50 GFAA CCN1CC[C@@H](c2nc(C3CCOCC3)nn2-c2cnc3ccccc3n2)C1 96164164 UIYYWUDTLJIHJR-MRXNPFEDSA-N 378.480 2.914 0 50 GFAA CNc1ncc(C(=O)N2C[C@@H](c3ccc(C)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95379198 VFWLVRWPVKKRFA-XUVXKRRUSA-N 377.492 2.529 0 50 GFAA CCOc1ccc(S(=O)(=O)N2C[C@@H](n3ccnc3)Cc3ccccc32)cn1 181057371 NVPZVDGSCYBUMO-INIZCTEOSA-N 384.461 2.670 0 50 GFAA CNc1ncc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)cn1 92107125 ZZYHOVHADBJVCD-KRWDZBQOSA-N 381.480 2.653 0 50 GFAA COc1ccc(NC(=O)N[C@@H](C)CCc2ccco2)cc1NS(C)(=O)=O 96133297 ATOJXDGSYZQMKO-LBPRGKRZSA-N 381.454 2.803 0 50 GFAA FC(F)(F)c1cc(N2CCO[C@H](CCc3ccccc3)C2)n2ncnc2n1 182654126 OAONNZRYZIBJIG-CQSZACIVSA-N 377.370 2.981 0 50 GFAA Cn1cc(-c2ccnc(NC(=O)[C@@H]3CCN(c4ccccc4Cl)C3)n2)cn1 297735260 KQWOJNWNBNTBSN-CYBMUJFWSA-N 382.855 2.996 0 50 GFAA CC(=O)Nc1cc(NC(=O)N2CCC[C@@H](CN3CCCC3=O)C2)ccc1F 299770824 RVDBAROIYFWORM-AWEZNQCLSA-N 376.432 2.650 0 50 GFAA COCCn1cncc1CNC(=O)c1cccc(N2Cc3ccccc3C2)c1 299797982 PWQSVKHDRGXQIM-UHFFFAOYSA-N 376.460 2.980 0 50 GFAA Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)N[C@@H](C)CCO)cc1 864097598 YEGJROFIKRQTHU-HNNXBMFYSA-N 391.493 2.997 0 50 GFAA O=C(c1cnc(OCC(F)F)cn1)N1CCC[C@@H](c2cc(O)cc(F)c2)C1 1875299416 KDYJNIKINDTBPC-LLVKDONJSA-N 381.354 2.985 0 50 GFAA O=C(Nc1ccc2nnc(C3CC3)n2c1)[C@H](c1ccccc1F)N1CCOCC1 1875265137 KCBFWJQCAZFRLH-IBGZPJMESA-N 395.438 2.758 0 50 GFAA O=C(NCCc1ccc(OC(F)(F)F)cc1)c1ncoc1[C@H]1[C@H]2CN[C@H]1C2 1875392949 AOSATOXYRYMPSQ-XBFCOCLRSA-N 381.354 2.621 0 50 GFAA C[C@H](CCc1cccc(F)c1)C(=O)N1CCOC2(CCS(=N)(=O)CC2)C1 1875396143 WZWKBLZNCLQBKJ-GTNZPDLFSA-N 382.501 2.833 0 50 GFAA O=C1NC(=O)[C@@]2(CCCC[C@@H]2NC(=O)c2ccc(OC3CCC3)cc2Cl)N1 1875328622 CCKWLHZWMKDTFP-KXBFYZLASA-N 391.855 2.522 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccccc1Oc1cccnc1 1875402748 MKGVWOITRDPANQ-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)CCn2cnc3ccccc32)C1)c1ccoc1 952990720 YLHXEJANOMAVON-INIZCTEOSA-N 380.448 2.688 0 50 GFAA COc1cc(C(=O)NCCc2nc(Cc3ccccc3)no2)cc(OC)c1C 1337573115 BFTFJQWPFZVUMK-UHFFFAOYSA-N 381.432 2.959 0 50 GFAA C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NCc2ccc(CN3CCOCC3)o2)c1 170595046 FJTNXWLLSIWFJC-YWZLYKJASA-N 397.475 2.636 0 50 GFAA Cc1ccc2c(c1)CC[C@H](C(=O)Nc1ccc(F)cc1NS(C)(=O)=O)O2 281218655 OFDTXZMXKUTNHR-QGZVFWFLSA-N 378.425 2.838 0 50 GFAA CCCc1c(NC(=O)NC[C@]2(CCO)CCOC2)cnn1-c1ccc(F)cc1 191955387 VVUKQGRIBPBYHW-FQEVSTJZSA-N 390.459 2.875 0 50 GFAA CCc1nnc(-c2cccc(NC(=O)C3=C(C)N(C)c4ncnn4[C@H]3C)c2)o1 195291105 GERIAJYYUNQBPL-LBPRGKRZSA-N 379.424 2.814 0 50 GFAA COc1cc(S(=O)(=O)N(Cc2ccccn2)C(C)(C)CO)c(C)cc1C 1529100696 WFMWOKDDNCNBOW-UHFFFAOYSA-N 378.494 2.669 0 50 GFAA CC(C)(O)CCc1ccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1 1529180668 HORUQPQDPLYUQV-NHCUHLMSSA-N 383.488 2.965 0 50 GFAA CCCN1C[C@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)C[C@]2(CCC(=O)O)C1 1772819346 KBPSDTRIUGXMRZ-AOMKIAJQSA-N 398.507 2.531 0 50 GFAA CC[C@@H](NC(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1)c1ccncc1 12302358 VLICDJGGFMCZAD-MRXNPFEDSA-N 380.404 2.994 0 50 GFAA O=C(CC1c2ccccc2CCc2ccccc21)NCCN1CCC[C@@H](O)C1 15065693 GLIRTJXBKJNVFX-HXUWFJFHSA-N 378.516 2.880 0 50 GFAA CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc(C(=O)OCC)cc2)n1 18006642 BWOBEIZDMVATRB-UHFFFAOYSA-N 375.450 2.630 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)N2CCN(c3ccc(F)cn3)[C@@H](C)C2)c1C 1857670358 JGQATJKKLXKESV-LBPRGKRZSA-N 388.443 2.693 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)CCc2ccccc2)cn1 1857685608 ZPBJFBSICVGURM-GMAHTHKFSA-N 396.535 2.807 0 50 GFAA O=C(N[C@@H]1C[C@@H](C(=O)NCCCc2ccccc2)CC[C@H]1O)c1ccccc1 1875243882 CATLBKOHRMRIBZ-PWRODBHTSA-N 380.488 2.695 0 50 GFAA COc1cccc(-c2cnc(NC(=O)CCc3c(C)nc4ncnn4c3C)[nH]2)c1 1875248212 DEQUMXHAPQHYIS-UHFFFAOYSA-N 391.435 2.711 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)s1 333719268 JMESCHVAFFIGDC-MRXNPFEDSA-N 398.550 2.642 0 50 GFAA C[C@@H](CCCc1ccccc1)C(=O)NCc1ccc(S(=O)(=O)CCO)cc1 252496298 PGFDUFSURVYUTI-KRWDZBQOSA-N 389.517 2.728 0 50 GFAA COC(=O)c1c(NC(=O)CSc2nnc3ccccn23)sc2c1CCC2 952476 UXTJPNMMZYVMIC-UHFFFAOYSA-N 388.474 2.797 0 50 GFAA Cc1c(C(=O)OCc2nc3ccc(Cl)nc3[nH]2)nnn1-c1ccc(F)cc1 2325703727 ROUKHCSFSNARFC-UHFFFAOYSA-N 386.774 2.997 0 50 GFAA C[C@@H](NC(=O)c1cn(CC2CC(N)C2)nn1)C1(c2ccc(Cl)cc2)CCC1 2325793160 IZVAFYQKFHDHLK-TUBUQKNSSA-N 387.915 2.909 0 50 GFAA NC[C@@H](CC(=O)N=c1cc2n([nH]1)CCCC2)c1ccc(Br)s1 2325795709 UQIBMWHIUCVBTD-SNVBAGLBSA-N 383.315 2.536 0 50 GFAA Cc1c(C(=O)NCc2cccc3ncn(C)c23)cnn1CCO[C@@H]1CCCCO1 2325803142 SKMUUPTTXOOOMS-LJQANCHMSA-N 397.479 2.551 0 50 GFAA CCCC(CCC)C(=O)N[C@H]1CCCCN(C(=O)[C@H]2CCC(=O)N(CC)C2)C1 2325863955 BAGNVQWQNGBJHD-OALUTQOASA-N 393.572 2.959 0 50 GFAA O=C(OCCc1ccc2c(c1)CCO2)[C@H]1CSCN1C(=O)c1ccccc1 2325870769 OAZUZIZLWHGGCY-GOSISDBHSA-N 383.469 2.923 0 50 GFAA COc1ccc(NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)c(OC)c1 817268 HGVXIVCOABFYBZ-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CCCCN1C[C@H](C(=O)Nc2ccc(C(=O)Nc3ccncc3)cc2)CC1=O 10343586 XNBOZFHPXUGZDV-MRXNPFEDSA-N 380.448 2.921 0 50 GFAA O=C(NCc1ccncc1)c1ccc(OC2CCN(C[C@@H]3CCOC3)CC2)cc1 11937713 KOCLEEJVSHTNRB-IBGZPJMESA-N 395.503 2.891 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCCc1cccc(F)c1)C2 14531487 NEWKNCMITHBGAF-GOSISDBHSA-N 384.499 2.968 0 50 GFAA Cc1nonc1CC(=O)N(C)C[C@H]1CCCN(CCc2ccc(Cl)cc2)C1 14950135 NLZMZYODLBSGJT-QGZVFWFLSA-N 390.915 2.987 0 50 GFAA O=C(CCc1nnc(CCCCc2ccccc2)o1)NCCCn1ccnc1 15075013 KGPJUQRCXPGWRE-UHFFFAOYSA-N 381.480 2.971 0 50 GFAA O=C(OC[C@@H]1CCCN2CCCC[C@@H]12)c1cc2ncc(Br)cn2n1 15319697 JHZKYSMXDNEOKP-WFASDCNBSA-N 393.285 2.913 0 50 GFAA CC[C@H]1CCCCN1C(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 16211364 SNGMROJSXOCMPC-INIZCTEOSA-N 397.566 2.669 0 50 GFAA COc1cc(OC)c(C(=O)N2CCN(Cc3ccc(C)cc3)CC2)cc1OC 16605678 BBEABGNMXYQOPM-UHFFFAOYSA-N 384.476 2.979 0 50 GFAA COc1cccc(CN2CCC[C@H](NCC(C)(C)CN3CCOCC3)C2)c1 23373150 MKOWBGCIUWBFDJ-FQEVSTJZSA-N 375.557 2.608 0 50 GFAA CCCCn1cnc2sc3c(c2c1=O)CC[C@@H](NCc1cn(C)nc1C)C3 23581471 FSQHMZZOAFRUCM-OAHLLOKOSA-N 385.537 2.947 0 50 GFAA NCCc1nc(N2CCC(Cc3noc(C4CC4)n3)CC2)c2ccccc2n1 65535308 SBTSLOPFKCWVNE-UHFFFAOYSA-N 378.480 2.851 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](N(C)Cc1cc(-c3cccnc3)no1)C2 71278809 FWDKJACTMCBGKA-CQSZACIVSA-N 381.436 2.641 0 50 GFAA COc1ccc(-c2cn3cc(C(=O)N(C)C)nc3c(=O)n2CC=C(C)C)cc1 72422528 DXIVOCSVKNLYNS-UHFFFAOYSA-N 380.448 2.840 0 50 GFAA CCCCN1CCN([C@@H](C(=O)N2CCCCCC2)c2ccccc2)C(=O)C1=O 77354188 RIKACBCYPQXTAR-LJQANCHMSA-N 385.508 2.601 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC3(CC2)CN(CCOc2ccccc2)C(=O)O3)o1 77408183 HPXQNAQZUOVHRF-UHFFFAOYSA-N 399.447 2.797 0 50 GFAA O=C(Cc1ccccn1)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95383432 RVAVZXJPSZEUHP-ZPMCFJSWSA-N 383.442 2.991 0 50 GFAA COc1ccc(CN(C)C2CCOCC2)cc1OC[C@H](O)CN1CCCCC1 95525082 RBSPHDIFBJMERX-HXUWFJFHSA-N 392.540 2.532 0 50 GFAA CCN1CC[C@H](c2nc(C3CCOCC3)nn2-c2cnc3ccccc3n2)C1 96164163 UIYYWUDTLJIHJR-INIZCTEOSA-N 378.480 2.914 0 50 GFAA CCCN(C)C(=O)c1cccc(S(=O)(=O)NCCc2cccc(F)c2)c1 97568998 ARDBJUMICYKYRP-UHFFFAOYSA-N 378.469 2.829 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)F 123761365 HLUUQBKJUOVPKI-NEPJUHHUSA-N 386.376 2.501 0 50 GFAA Cc1cc(CC(=O)NCCSCCOc2cccc(Br)c2)n[nH]1 154110686 VCTJYDFYBSXPCE-UHFFFAOYSA-N 398.326 2.952 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C[C@@H]1CCCCO1 154489589 ZSGJKWMWMMQSDP-KRWDZBQOSA-N 394.537 2.956 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(CNC(N)=O)cc1 155240152 RPZKXVQMKMLPRS-QGZVFWFLSA-N 380.492 2.592 0 50 GFAA CO[C@H]1CCCN(C(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)C1 171121034 CHTKAZHKXQVWKJ-SFHVURJKSA-N 377.444 2.945 0 50 GFAA CCCC(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1nc(-c2cccc(OC)c2)no1 174656560 AJVBFVUFRKQBTH-CZUORRHYSA-N 386.452 2.714 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NC[C@H]2CCCN2)cc1 178775638 RITHHXIRNUGXHM-LJQANCHMSA-N 390.487 2.959 0 50 GFAA CC(C)c1nnc2ccc(NC(=O)[C@@H]3CCCN3C(=O)c3ccccc3O)cn12 189091846 ZDISCIOUKIYFSJ-INIZCTEOSA-N 393.447 2.802 0 50 GFAA CC(C)[C@@H](NC(=O)c1cnc2sccn2c1=O)c1nc2ccccc2n1C 223231084 DJDUBKWPSKMHJH-OAHLLOKOSA-N 381.461 2.770 0 50 GFAA Cc1nc(C(=O)N2CCC[C@H](CCC(=O)O)C2)nn1-c1ccccc1Cl 237827352 CAIVADIFEMSQKK-CYBMUJFWSA-N 376.844 2.946 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccnc(-n2ccnc2)c1 267482496 VELUGSFGGNTOHP-PXNSSMCTSA-N 375.476 2.908 0 50 GFAA O=C(Nc1ccccc1Cn1cncn1)N1CCCN2c3ccccc3C[C@@H]2C1 290392605 LOSSUSFYYKXKGF-LJQANCHMSA-N 388.475 2.995 0 50 GFAA CC1(C)CN(c2ccc(Cl)cc2)CCN1C(=O)C[C@H]1CCCS(=O)(=O)C1 294153244 VEKVCRAAPMJFRU-OAHLLOKOSA-N 398.956 2.982 0 50 GFAA C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N(CCC(=O)O)C1CCOCC1 299751329 QKAVOYUUMMZFNS-LBPRGKRZSA-N 389.370 2.955 0 50 GFAA c1cc2c(cc1CN1CCC[C@@H](c3n[nH]cc3CN3CCOCC3)C1)CCO2 328632534 LJTFCYXPSQBKQS-LJQANCHMSA-N 382.508 2.556 0 50 GFAA Cc1cccc(C)c1NC(=O)CN(C)C(=O)Nc1cnn(C[C@H]2CCCO2)c1 363299538 NPYSAJGNBMYWBZ-QGZVFWFLSA-N 385.468 2.781 0 50 GFAA CNC(=O)c1cccc(NC(=O)N2CC[C@@](O)(Cc3cccc(Cl)c3)C2)c1 363952140 ZAHMGNKKVMGLMZ-HXUWFJFHSA-N 387.867 2.911 0 50 GFAA CCCc1c(NC(=O)N2C[C@H](C)O[C@]3(CCOC3)C2)cnn1-c1cc(C)ccn1 373937203 VYOAEUPBQUZCDZ-HRAATJIYSA-N 399.495 2.940 0 50 GFAA C[C@H]1C[C@H](N2CCOCC2)CN1C(=O)NCc1cccc(-c2cccnc2)c1 376492230 QXLJHQXHGUNHBR-UWJYYQICSA-N 380.492 2.753 0 50 GFAA CCc1nc(CN2CCC[C@H](NC(=O)[C@H](C)Cc3ccc(OC)cc3)C2)no1 378275178 UNKHPZDEFZEQTN-WBVHZDCISA-N 386.496 2.600 0 50 GFAA Cc1cccc(C)c1OC[C@H](C)NC(=O)N1CCC(N2CCOCC2)CC1 426420039 URRCPJPJPMMNDP-SFHVURJKSA-N 375.513 2.577 0 50 GFAA CCn1cc(S(=O)(=O)N2CCN(c3ccc(Cl)cc3)CC2(C)C)cn1 490628620 RXSGFBYKNJFALQ-UHFFFAOYSA-N 382.917 2.846 0 50 GFAA Cc1cc(C(=O)OCc2cc(Cl)cc(S(N)(=O)=O)c2)cc(Cl)n1 798652535 CXOQSQWYOKNZAZ-UHFFFAOYSA-N 375.233 2.701 0 50 GFAA CSCCC(=O)N1CCC2(CC1)CN(Cc1ccc3c(c1)CCO3)CCO2 824892223 ZIKARMKTONISIU-UHFFFAOYSA-N 390.549 2.568 0 50 GFAA O=S(=O)(CCOc1ccccc1)N[C@@H]1CCCN(Cc2ccccc2F)C1 826626750 WHDWFCYKHSLQKT-GOSISDBHSA-N 392.496 2.789 0 50 GFAA C[C@H](O)C[C@@H](C)NC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)ccc1F 831995628 JANSWPOMHOALPJ-NEPJUHHUSA-N 398.431 2.655 0 50 GFAA C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)N1CCC(c2ccncn2)CC1 886074533 LVOFVDDOGSJNCE-FXAWDEMLSA-N 394.523 2.671 0 50 GFAA Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@@H](CO)[C@@H](O)C1CCCCC1 913048884 LGPYUDUXRFKZLA-WMZOPIPTSA-N 391.899 2.866 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCCN(C(=O)c2ccco2)CC1 1506398780 TVVMCEJUCSSXDX-QGZVFWFLSA-N 392.839 2.915 0 50 GFAA COc1ccc(OC)c([C@@H](C(=O)O)N2CCC(c3nnc4ccccn34)CC2)c1 1506420226 YYUQLFVWLMLFAO-IBGZPJMESA-N 396.447 2.752 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@@H]1CC(=O)Nc1ccnn1C1CCCC1 1529180066 IEROXNFAZYUMEA-IBGZPJMESA-N 395.507 2.636 0 50 GFAA COc1ccc2c(c1)OC[C@@]1(C(=O)O)CN(Cc3cc(C(C)(C)C)n[nH]3)C[C@@H]21 1565507444 XUASZYXWWHQWJT-KKSFZXQISA-N 385.464 2.779 0 50 GFAA Cc1cc2cccc(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3cnn(C)c3)c2o1 1857714459 AVOBLGPJDPWTFR-OALUTQOASA-N 382.464 2.619 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1cc(F)ccc1-n1cccn1)C[C@H]2O 1857716902 GESFARNIWNAOLL-JMJGKCIBSA-N 393.462 2.580 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc(C)n1 1857731136 LOGLZJGVZUNPSL-KNKQGSTJSA-N 377.444 2.613 0 50 GFAA O=C(c1cccc(F)c1F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857740414 IEKJRERYSKHNSV-LZJOCLMNSA-N 384.382 2.879 0 50 GFAA COc1cc(CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)cc(OC)c1 1875243226 XIESTCBMKGOEJU-IFMALSPDSA-N 385.460 2.584 0 50 GFAA NCC1(c2ccc(C(=O)N3CCOC[C@H]3c3cc(F)cc(F)c3)cn2)CCC1 1875276671 OCGCNTHVGCRNDU-SFHVURJKSA-N 387.430 2.954 0 50 GFAA C[C@@H](NC(=O)[C@@H](O)CN1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1875308680 RLLTZTZEFWETBJ-QRWLVFNGSA-N 399.466 2.712 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(COc2ccc(F)cc2)o1 2325785768 MPTVEKCMULOZKP-NIKGAXFTSA-N 399.422 2.764 0 50 GFAA CCc1[nH]c(-c2ccccc2)cc1C(=O)N1C[C@H](C(=O)O)Cc2c1cnn2C 2325803220 YNBZPGPLWVPWLH-CQSZACIVSA-N 378.432 2.881 0 50 GFAA Cc1cc(C(=O)N(Cc2nn[nH]n2)C2CCCC2)c(C)n1Cc1ccncc1 2325807851 XYNUDZRVMFFBLK-UHFFFAOYSA-N 379.468 2.646 0 50 GFAA Cc1nc([C@@H](NC(=O)c2cnc3ccnn3c2C)c2ccc(Cl)cc2)no1 2325819855 SHWCISWSIZAHAW-INIZCTEOSA-N 382.811 2.902 0 50 GFAA CN1CCN(c2ccc(NC(=O)c3cccc4cncn34)c3cnccc23)CC1 2325825487 RGKHAAJLGVMPBM-UHFFFAOYSA-N 386.459 2.887 0 50 GFAA COC(=O)c1cc(OC)cc(C(=O)N2CCC[C@@]3(CCc4cnc(C)nc43)C2)c1 2356154739 HYVCUBIUMABJMW-JOCHJYFZSA-N 395.459 2.700 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2nc(-c3ccc(Cl)cc3)no2)CC[C@@H]1O 2356160094 CVTWHIKJBONZNO-KBXCAEBGSA-N 379.844 2.828 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CCCCC3)CC2)cc1 6702430 ZBIRMUVUFNBZKQ-UHFFFAOYSA-N 394.537 2.935 0 50 GFAA COc1ccc(-n2ncc(C(=O)Nc3cc(F)ccc3O)c2C(F)(F)F)nn1 225450897 FIDHRECPGDKICJ-UHFFFAOYSA-N 397.288 2.787 0 50 GFAA CC(C)C(=O)Nc1ccc2nc(SCC(=O)N3CCOCC3)sc2c1 8673796 KSCXHZIVYCOYDF-UHFFFAOYSA-N 379.507 2.842 0 50 GFAA O[C@H]1[C@H](N2CCC(O)(c3ccccc3)CC2)c2ccccc2C12CCNCC2 23544090 OSYMZKQUSCPIIY-YADHBBJMSA-N 378.516 2.707 0 50 GFAA Cc1nc2sccc2c(=O)n1CC(=O)N1CCC[C@H](OCc2ccccc2)C1 20859264 OUJQMYQGBCMENC-KRWDZBQOSA-N 397.500 2.974 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1NC(C)=O 363732743 CLROHVCWPCMCCX-UHFFFAOYSA-N 398.467 2.608 0 50 GFAA O=C(Nc1cc(F)ccc1Oc1ccccc1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252538017 MNRZNQHIYYFCGT-HNNXBMFYSA-N 394.406 2.953 0 50 GFAA Cc1ccc(Oc2ccc(NC(=O)C(=O)N[C@@H]3CCc4cn[nH]c4C3)cn2)cc1 252569022 VUAOSZSJYVWGDD-OAHLLOKOSA-N 391.431 2.518 0 50 GFAA CC1(C)[C@@H](O)C[C@H]1NC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 426075613 HCKDGCRSYCVAEM-CABCVRRESA-N 386.477 2.976 0 50 GFAA CC1(C)[C@@H](NC(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)C[C@H]1O 426075618 HCKDGCRSYCVAEM-LSDHHAIUSA-N 386.477 2.976 0 50 GFAA CCN1CCN(Cc2cc(C(=O)N(C)[C@H]3CCCc4ccccc43)no2)CC1 67885029 UOKOQSXWCYWZAK-NRFANRHFSA-N 382.508 2.962 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCCN(C(=O)c2ccco2)CC1 1506398778 TVVMCEJUCSSXDX-KRWDZBQOSA-N 392.839 2.915 0 50 GFAA CCOC(=O)c1cc(-c2oc(=O)c(NC(=O)c3ccccc3)cc2C(C)=O)on1 1387727 ONYRFKCTSMWYDN-UHFFFAOYSA-N 396.355 2.926 0 50 GFAA COc1cc(C(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)ccc1OC(F)F 6490561 KWSMXDAEDNRVIZ-AWEZNQCLSA-N 386.248 2.717 0 50 GFAA Cc1nc2cc(O)nn2c(C)c1CNC(=O)c1ccc(F)cc1OC(F)F 487046829 NNSLLVUHLIVOST-UHFFFAOYSA-N 380.326 2.722 0 50 GFAA C[C@H]1CN(c2ccc(NCc3cnc(N4CCOCC4)nc3)cc2)C[C@@H](C)O1 124845015 GDFGYAXIEFAAJB-CALCHBBNSA-N 383.496 2.539 0 50 GFAA CN1CC[C@@H](NC(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1ccc(F)c(F)c1 245671488 CXFIBYZPQSXPIB-RTBURBONSA-N 383.402 2.721 0 50 GFAA O=S1(=O)CCN(Cc2ccccc2OCCCCN2CCCCC2)CC1 216047776 HJACHRIKNPNWEE-UHFFFAOYSA-N 380.554 2.562 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)c1ccc(CN2CCOCC2)cc1 72434184 ASDJGLDBDVQJOG-UHFFFAOYSA-N 392.459 2.841 0 50 GFAA O=C(Cn1nc(-c2ccc(F)cc2)ccc1=O)NCCc1c[nH]c2ccccc12 44893637 NUTBPAUIWYESAG-UHFFFAOYSA-N 390.418 2.890 0 50 GFAA O=C1CC[C@@]2(CCCN(C3CSCCSC3)C2)CN1CCc1c[nH]cn1 82116220 UXXWMYHBZXGWON-LJQANCHMSA-N 394.610 2.505 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)Oc1cccc2cccnc12 195439091 JNZQRBWGCFZPOE-DEGRCIOYSA-N 388.423 2.583 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@@H]2CC(=O)OC23CCCC3)CC1(C)C 82146650 ILHMPMFGTIMWLR-INIZCTEOSA-N 386.492 2.998 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC(O)CC4)csc3C2)nc1 426668310 KZQPGLMYRKGAGK-UHFFFAOYSA-N 385.533 2.861 0 50 GFAA CC(C)CN1CC2(CCN(Cc3ccc(S(C)(=O)=O)cc3)CC2)CC1=O 95382151 HWXICZNLWYWAMU-UHFFFAOYSA-N 378.538 2.561 0 50 GFAA O=C(NC[C@H]1CCCCO1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 95496713 NGIADQASJLGYTO-HXUWFJFHSA-N 386.492 2.765 0 50 GFAA CC[C@]1(C)CC(=O)c2cc(NC(=O)NCCSc3cn[nH]n3)ccc2O1 97436821 WBPRNEDZJRYQKB-QGZVFWFLSA-N 375.454 2.852 0 50 GFAA CC(C)C[C@H]1C(=O)NCCCN1C(=O)c1cccc(NC(=O)c2cccnc2)c1 294013935 WBHLWHWPVSJIJZ-IBGZPJMESA-N 394.475 2.711 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)N[C@@H]3CCCN(c4cnccn4)C3)cc2)o1 95512395 RLGSOSXXWYWOPN-MRXNPFEDSA-N 379.424 2.626 0 50 GFAA Cc1noc(CN2CCC(CCC(=O)N3CCN(c4ccccc4)CC3)CC2)n1 95527325 HFJVJZMOSQPFBL-UHFFFAOYSA-N 397.523 2.719 0 50 GFAA CC(C)[C@@]12O[C@H]3[C@H]4C[C@@H]([C@H](C(=O)N1c1ccc(Br)cc1)[C@@H]42)[C@H]3O 238900251 IFAYFRXLRHFRHC-LRMMUPRLSA-N 378.266 2.790 0 50 GFAA CC(=O)N[C@H]1C[C@H](c2nnc(CN(C)Cc3[nH]c4ccccc4c3C)n2C)C1 244874962 XKDVCLUOZNOQCR-WKILWMFISA-N 380.496 2.619 0 50 GFAA CCN1CCC[C@H]1CNC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1 252511249 FIYSNFKLNQPDMP-FHWLQOOXSA-N 396.535 2.803 0 50 GFAA CC(C)(C)OC(=O)NS(=O)(=O)NCc1ncc(C(F)(F)F)cc1Cl 263639902 NVCANPMVJDXLSM-UHFFFAOYSA-N 389.783 2.613 0 50 GFAA Cc1cc(C(=O)N2CCN(c3nc(-c4ccccc4)nc4c3CCC4)CC2)[nH]n1 67804185 VLATZJZULXZJCU-UHFFFAOYSA-N 388.475 2.626 0 50 GFAA C[C@@H](O)CN1CCN(C[C@H](CN(C)Cc2ccccc2)c2ccccc2)CC1 864097580 XCCOOLFQKFXATP-QPPBQGQZSA-N 381.564 2.901 0 50 GFAA O=C(O)[C@H]1CC2(CCCC2)CN1C(=O)c1ccc(S(=O)(=O)C(F)F)cc1 1875286228 LJIXIIVGCBJTRV-CYBMUJFWSA-N 387.404 2.542 0 50 GFAA Cc1cncc(C(=O)NC[C@H]2CCCN(c3ncc(F)c(N4CCCC4)n3)C2)c1 952976086 UWIGDNIHLFBBJE-MRXNPFEDSA-N 398.486 2.566 0 50 GFAA Cc1nc(O)cc(CN2CCC(CNC(=O)C[C@@H]3CCc4ccccc43)CC2)n1 952968753 DCHWYOWDSRNVLE-IBGZPJMESA-N 394.519 2.939 0 50 GFAA O=C(Cc1ccc(C(F)(F)F)nc1)N[C@@H]1CCS(=O)(=O)c2ccccc21 888092829 UPLRSHOOCFGOHS-CYBMUJFWSA-N 384.379 2.678 0 50 GFAA O=C(c1c[nH]nc1[C@@H]1CCNC1)N1CCC2(CCc3ccccc3C2=O)CC1 888102051 WGSHWCTZEAAVGJ-MRXNPFEDSA-N 378.476 2.538 0 50 GFAA CC[C@H](C(=O)N[C@H]1CC[C@H](NC(=O)[C@H](CC(C)C)OC)CC1)N(CC)CC 1775986880 NIYLAKDBPFDGFB-MKXGPGLRSA-N 383.577 2.712 0 50 GFAA Cc1ccccc1C(=O)N1CCC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)O)C1 1775997265 YZVOEWNUSBDPKF-ICSRJNTNSA-N 394.471 2.659 0 50 GFAA CCOC(=O)C1=C(CP(=O)(OCC)OCC)NC(=O)N[C@@H]1c1ccco1 1776004201 MREPVSPUQDXHGT-CQSZACIVSA-N 386.341 2.717 0 50 GFAA NC(=O)[C@H]1CC(C(=O)NCc2cccc3ccccc23)=NN1c1ccc(F)cc1 170596988 RWGTYEOCNJHZCF-HXUWFJFHSA-N 390.418 2.715 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CCN1Cc1ccccc1 170600282 PZYWCRGXMSPFJE-OIISXLGYSA-N 397.441 2.709 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@@H](c3cccc(OC)c3)C2)c1 170615371 RDAIBNGPXMAUAH-LJQANCHMSA-N 390.461 2.823 0 50 GFAA CC[C@@](C)(OC)C(=O)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 280037902 AOHQISIFLKGISM-LJQANCHMSA-N 392.477 2.709 0 50 GFAA COc1ccc([C@@H](O)C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1 1506395906 JOHWCWWXFZKLJS-JOCHJYFZSA-N 382.504 2.896 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CCC(OCc3ccccn3)CC2)CC1 1506425842 RYUQSSQNXBVHRJ-UHFFFAOYSA-N 380.492 2.762 0 50 GFAA CN(CC(=O)Nc1nnc([C@H]2CCCO2)s1)Cc1c[nH]nc1-c1ccccc1 1506420634 JBMMFYVTYIKQIA-OAHLLOKOSA-N 398.492 2.850 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N(Cc1ccncc1)C[C@@H]1CCC(=O)N1 1506416025 GLJIQUGPWOAPJM-SFHVURJKSA-N 389.459 2.701 0 50 GFAA CCn1c(C)cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCOC)C2)c1C 216719730 LOUAXBZTVLDCER-MJGOQNOKSA-N 375.513 2.614 0 50 GFAA Cc1ncc(CN(CCN(C)C)C(=O)c2csc(Cc3ccccc3)n2)[nH]1 1704311685 QCXYLNJKZIINFF-UHFFFAOYSA-N 383.521 2.969 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3nc(CO)cs3)CC1)OCC2 1704330984 MOAUSIUKBOHLJV-UHFFFAOYSA-N 376.478 2.721 0 50 GFAA COc1ccc(CCN2C(=O)O[C@@H]3CN(C(=O)NCc4ccccc4)C[C@@H]32)cc1 11957229 MSYWUKOEOWKGOJ-VQTJNVASSA-N 395.459 2.653 0 50 GFAA CC(C)N1CCN(c2ccc(C(=O)NCCCc3ccccn3)cn2)C[C@@H]1C 12308230 WCGHVKMAWHXFRA-SFHVURJKSA-N 381.524 2.758 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCCN(C(=O)[C@@H](C)Oc2ccccc2)CC1 14643485 ZFWHFIKEVJKILW-KDURUIRLSA-N 396.487 2.982 0 50 GFAA C[C@H]1CCCN(C(=O)[C@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)C1 15067026 DTCYGQKHTLNRBP-WCQYABFASA-N 375.494 2.885 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N1CCC(C(=O)NC(C)(C)C)CC1 16624527 SEMSIHMVSMYVCC-UHFFFAOYSA-N 388.917 2.664 0 50 GFAA COc1cccc(CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1OC 19211555 KIJXESRLBHIXIG-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA COc1ccc(Cn2c(C3CCN(C(=O)c4cccs4)CC3)n[nH]c2=O)cc1 169770669 FHZLSOSNNOFSOG-UHFFFAOYSA-N 398.488 2.710 0 50 GFAA O=C(CCCOc1ccccc1)N1CC[C@H]2[C@@H]1CC(=O)N2Cc1cccnc1 1857689277 MDDFWDZLODPHHA-PMACEKPBSA-N 379.460 2.643 0 50 GFAA O=C(COc1ccc(-c2nccn2C2CCOCC2)cc1)NC[C@H]1CCCO1 1857709810 SKXGKVUXAUFFTD-LJQANCHMSA-N 385.464 2.576 0 50 GFAA Cc1[nH]c2ccc(C(=O)N3C[C@H](O)[C@]4(C3)[C@H](c3ccccc3)[C@H]4CO)cc2c1C 1857720270 MGMHTXQUGUFHTK-NQRVTCLYSA-N 390.483 2.994 0 50 GFAA O=C(Cc1noc2ccccc12)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1857724996 IKJKWZNHLBGTGI-IERDGZPVSA-N 387.439 2.981 0 50 GFAA CNC(=O)c1cccc(CN2CCN(C(=O)c3ccc(Cl)cc3F)CC2)c1 113931718 MBESKJSZZODMNF-UHFFFAOYSA-N 389.858 2.797 0 50 GFAA NC[C@H](NC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)C1CC1 237900078 AWUOLYCQEQMCCF-VQTJNVASSA-N 397.906 2.761 0 50 GFAA CCCOc1ccc(C(=O)N2CCN([C@@H]3CCCN(C)C3)CC2)cc1OCC 363424043 ONDNYVCDXHMHKD-LJQANCHMSA-N 389.540 2.726 0 50 GFAA C[C@@]1(O)N(CCN2C(=O)OC3(CCCCC3)[C@]2(C)O)C(=O)OC12CCCCC2 1025045 HICUHVBHPGWBEU-ROUUACIJSA-N 396.484 2.714 0 50 GFAA O=C(COc1nsnc1N1CCOCC1)Nc1cccc(Cl)c1Cl 4594211 QKTQHRICRBMPEE-UHFFFAOYSA-N 389.264 2.699 0 50 GFAA COC(=O)c1ccc(Cl)c(NC(=O)c2ccc(NS(C)(=O)=O)cc2)c1 1058329 VMDMEWWJMPWMKF-UHFFFAOYSA-N 382.825 2.750 0 50 GFAA NC(=O)c1ccc(-n2nnnc2SCc2cccc(Br)c2)cc1 1261230 DAAXOVHLVPLKDH-UHFFFAOYSA-N 390.266 2.816 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)n1C(F)F 2356140501 LIYWZMCFORKTKL-OXQOHEQNSA-N 392.402 2.712 0 50 GFAA Cc1nc(CNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)sc1C 2356142388 QAGZEUSRKLCDRA-ZJTDPSCFSA-N 396.516 2.708 0 50 GFAA COc1cccc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1OC 2356154586 AZHKZJDPLOIHNV-JOCHJYFZSA-N 396.491 2.680 0 50 GFAA CCOc1ccccc1N(CC(=O)N[C@H](C)c1ccccc1)S(C)(=O)=O 2959321 OEYZGFHIYVTSQY-OAHLLOKOSA-N 376.478 2.729 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCO[C@@H]4C[C@H](CO)C[C@@H]43)ncnc21 2356166021 TYISECWXAHUCCA-BPQIPLTHSA-N 387.528 2.801 0 50 GFAA CN1CCC[C@@]2(CCCN2S(=O)(=O)c2ccc(Cl)cc2Cl)C1=O 2356167921 IXNRBQDVNNJWNG-OAHLLOKOSA-N 377.293 2.769 0 50 GFAA CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)OC 4764313 WGEUGAFHOWNSBM-DLBZAZTESA-N 378.469 2.785 0 50 GFAA CC(C)C[C@H](NC(=O)/C(=C\c1ccc(F)cc1)NC(=O)c1ccco1)C(=O)O 4976811 WPBSOYMJPUMBJM-SFKKXYGYSA-N 388.395 2.805 0 50 GFAA C[C@@H]1CCCCN1c1ccc(C(N)=O)cc1NC(=O)C(=O)Nc1cccc(F)c1 55155052 BMVVMHLQKWZLDT-CYBMUJFWSA-N 398.438 2.881 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1cccc(Cl)c1Cl 55060375 LFDFNEDJNPRFHE-UHFFFAOYSA-N 382.247 2.983 0 50 GFAA COc1ccccc1NC(=O)CSc1nc(O)cc(=O)n1-c1ccccc1C 8575268 KVUREDOEDYDZLS-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3c[nH]c4c(C)cccc4c3=O)CC2)nc1 67490586 VAYREVLHVSZRIX-UHFFFAOYSA-N 377.444 2.664 0 50 GFAA Cc1c(CC(=O)NCCc2cn[nH]c2)c2c(n1Cc1ccccc1)CCCC2=O 11662627 KEMURQJTLGTZJV-UHFFFAOYSA-N 390.487 2.988 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N[C@H]2c3ccccc3C[C@H]2O)CC1 123565699 ZWFUSNQMHGZIRH-YADHBBJMSA-N 379.504 2.917 0 50 GFAA CCOc1cc2c(cc1NC(=O)CN1CCN(c3ccccn3)CC1)O[C@H](C)C2 121235162 FJYGBAKPISFRKU-MRXNPFEDSA-N 396.491 2.564 0 50 GFAA O=C(Nc1ncc(Cc2ccccc2)s1)N1CC[C@@H](CN2CCOCC2)C1 173230268 IQYFJODBRBTDDR-KRWDZBQOSA-N 386.521 2.920 0 50 GFAA Cc1ccc2c(c1)CC[C@H](C(=O)Nc1cccnc1N1CCC(CO)CC1)O2 366859304 SVOCXTOJZBPXNT-HXUWFJFHSA-N 381.476 2.931 0 50 GFAA O=C(NCCc1ccc(OCC(F)(F)F)nc1)N1CC[C@@]2(CCCOC2)C1 368496407 OIQZWTPQEPNSOT-KRWDZBQOSA-N 387.402 2.777 0 50 GFAA COc1ccc([C@H](NC(=O)CCCN2CCCCCC2)C2CC(O)C2)cn1 219940430 NGJXNIABVLIJPJ-NGICGMGXSA-N 375.513 2.675 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2ccc(OCC(=O)O)c3ccccc23)CC1 262561832 ZZSDYIHCBZXQAA-UHFFFAOYSA-N 399.447 2.635 0 50 GFAA COc1cc(-c2nccn2[C@H]2CCCN(c3ncccn3)C2)cc2c1OCO2 77564100 NUMXBRZNVJBMMI-HNNXBMFYSA-N 379.420 2.919 0 50 GFAA O=C(O)c1ccnc(-c2ccnc(N3CCC[C@H](C(=O)c4cccnc4)C3)n2)c1 72423401 HKMNQBTVPOGXPW-INIZCTEOSA-N 389.415 2.731 0 50 GFAA CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N2[C@H](C)CCC[C@H]2C)C1=O 242106153 WHISVUQPWXWRJH-ARGWCVDVSA-N 375.444 2.772 0 50 GFAA Cc1ccccc1N1CCN(C(=O)CCn2c(C)nc3ccccc32)CC1=O 82145852 DSCSPMMKNQANAU-UHFFFAOYSA-N 376.460 2.919 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCC(=O)Nc1ccccc1)CC2 176985754 NDMWPLVWCXLSDU-LBPRGKRZSA-N 392.381 2.664 0 50 GFAA OCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1 19632628 URKOMYMAXPYINW-UHFFFAOYSA-N 383.517 2.856 0 50 GFAA biogenic,fda O=C(N[C@H]1CCCN(c2cnccn2)C1)c1cc(-c2ccc(Cl)cc2)[nH]n1 426489814 WVQRBHGTDUPLTQ-HNNXBMFYSA-N 382.855 2.919 0 50 GFAA O=C(NCCCc1ccccn1)c1ccc2c(c1)nc(O)n2[C@H]1CC[C@H](O)CC1 426404254 OBWXVRSVUKRRGH-IYARVYRRSA-N 394.475 2.976 0 50 GFAA Cc1ccc(CN2CCC(CNC(=O)c3ccccc3-n3cnnc3)CC2)o1 426484368 BIZKPGWKLMWYSN-UHFFFAOYSA-N 379.464 2.811 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@H]([C@H]2C(=O)N1CN(C(=O)C(F)(F)F)c1ccccc1)[C@@H]1C[C@@H]31 239046273 FMKSDXUBMCDTLT-OJFNHCPVSA-N 390.361 2.593 0 50 GFAA COc1cc(OC)nc(-c2cccc(C(=O)N(C)[C@H](C)c3ccncn3)c2)n1 426575089 WTONCSIHQHQGAS-CYBMUJFWSA-N 379.420 2.784 0 50 GFAA Cc1ccn(CCC(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)n1 95357006 LQAOPUYJZRXUPX-KSEOMHKRSA-N 382.483 2.810 0 50 GFAA O=C(Cc1ccc(O)cc1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91906501 UAFUTEGZNGKFLC-UHFFFAOYSA-N 393.487 2.761 0 50 GFAA O=C1CCC2(CCN(C(=O)[C@H](O)C3CCCCC3)CC2)CN1Cc1ccncc1 92065205 HBPIWVWXMOJIAN-OAQYLSRUSA-N 399.535 2.754 0 50 GFAA C[C@H]1CCC(=O)N1c1cccc(NC(=O)NCCCOC2CCN(C)CC2)c1 97243705 GAPNQDNEKGCTHO-INIZCTEOSA-N 388.512 2.824 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(Cc1cccc(OC(F)F)c1)CCN2C 91873189 YNBXFRZVRLKKGK-HXUWFJFHSA-N 381.467 2.807 0 50 GFAA CC(C)(C)n1nc(-c2cccnc2)nc1[C@@H](c1cccnc1)N1CCOCC1 95527869 HKFFYJGZCJHUFJ-GOSISDBHSA-N 378.480 2.912 0 50 GFAA Cc1ccn2ncc(C(=O)NCc3ccccc3CN3CCC[C@H]3CO)c2c1 295666748 JGILKFOBKRWMRG-IBGZPJMESA-N 378.476 2.529 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCCc1ccccn1 253496518 KJEROGPCMCNTDI-UHFFFAOYSA-N 393.422 2.722 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(c2ccc(OC)c(F)c2)=NO3)cc1 263619171 XHXNSZGRJLHBTK-UHFFFAOYSA-N 399.422 2.757 0 50 GFAA COC(=O)c1ccc(-c2cccc(C(=O)NC[C@]3(C)CCCO3)c2)c(CO)c1 584904212 XTCOBZHGXZRUNU-QFIPXVFZSA-N 383.444 2.931 0 50 GFAA COCCn1cnnc1[C@@H](C)NC(=O)c1ccc(N2CCCC2)c(Cl)c1 824466623 YKGMXSVGIDJNEN-CYBMUJFWSA-N 377.876 2.669 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)CCCn1cnc2ccccc21 1875401676 OMDXTOYTQJGULN-KXBFYZLASA-N 394.479 2.650 0 50 GFAA O=C(c1ccccc1)N1CCC(NCc2nncn2CCc2ccccc2)CC1 952970057 QHMPNSVMBJILMU-UHFFFAOYSA-N 389.503 2.915 0 50 GFAA Cc1cc(N2C[C@H](c3cnn(C)c3)[C@@H](C(N)=O)C2)c2cc(Cl)cc(C)c2n1 956755304 TUOAVWDDPSLWHL-SJORKVTESA-N 383.883 2.944 0 50 GFAA CCn1cccc1C(=O)N[C@H]1CCCCCN(C(=O)C[C@@H]2CCCOC2)C1 1775991560 LBNIBEUJXAVTSX-ROUUACIJSA-N 375.513 2.826 0 50 GFAA OC[C@@H]1CCCN1c1cc(NCc2cccc(COC3CCOCC3)c2)ncn1 110603211 MBIJDTUUSZTBMK-IBGZPJMESA-N 398.507 2.745 0 50 GFAA COCN1C(=O)CCc2cc(NC(=O)c3cc(C)nc4onc(C)c34)ccc21 191326666 SKCRRELQEMLLFT-UHFFFAOYSA-N 380.404 2.975 0 50 GFAA COCC(=O)N1CCc2c(NC(=O)C(F)(F)c3ncccc3C)cccc21 192828013 ZLZZTHZSDHDCAR-UHFFFAOYSA-N 375.375 2.656 0 50 GFAA CC(=O)N1CCc2ccc(S(=O)(=O)N3CC=C(c4ccccc4)C3)cc2CC1 790254954 MXDNSRWRPJGMAB-UHFFFAOYSA-N 396.512 2.722 0 50 GFAA CC[C@@H](C(=O)Nc1c(N2CCCC2)nn(C)c1C)N1Cc2ccccc2C1=O 1506415246 WXACPZIAGAYXRP-KRWDZBQOSA-N 381.480 2.702 0 50 GFAA Cc1cc(C)n(CCC(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)n1 1529115126 YPPHBEIZVQUXEJ-NQIIRXRSSA-N 378.476 2.812 0 50 GFAA Fc1ccc(N2CCN(Cc3nnc4n3Cc3ccccc3OC4)CC2)cc1 1772808884 DKIMEGIKFXSUNX-UHFFFAOYSA-N 379.439 2.680 0 50 GFAA Cn1c(=O)c(-c2nc(C3CCOCC3)nn2[C@@H]2CCOC2)cc2ccccc21 1772819986 ZJKQOSRVVBSUST-MRXNPFEDSA-N 380.448 2.652 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)C3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2)n1 12020504 PQWVWQUKMUIOJI-FQEVSTJZSA-N 396.491 2.845 0 50 GFAA CC(=O)Nc1ccc2c(c1)nc(CCN1CCN(c3ccccc3)CC1)n2C 12379733 CYBPMHHQQKIFIB-UHFFFAOYSA-N 377.492 2.896 0 50 GFAA CC(=O)Nc1ncc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)s1 12379779 VOJLAENAGXHXTD-UHFFFAOYSA-N 379.507 2.745 0 50 GFAA Cc1cc(C)n(CCN(C)C(=O)c2coc(Cn3cnc4ccccc43)n2)n1 12432421 KSWSJXWTGDGXHU-UHFFFAOYSA-N 378.436 2.658 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1cccc(-c2ccc(F)cc2)c1 12717722 WANJZLONUVUPCJ-IBGZPJMESA-N 383.423 2.558 0 50 GFAA Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1c[nH]c3ccccc13)C2 14751040 MJMHSWDORCDHRX-UHFFFAOYSA-N 391.475 2.772 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@H]2CCC(=O)N(Cc3cccc(F)c3)CC2)C1 14958095 RKPPZEBBFMRDRW-MJGOQNOKSA-N 376.472 2.982 0 50 GFAA Cc1ccc(CNc2ccc(C(=O)N3CCCN(c4ncccn4)CC3)cn2)o1 15073388 VKBKWTAYTKJDAQ-UHFFFAOYSA-N 392.463 2.738 0 50 GFAA O=C1N(CN2CCN(c3ccccc3F)CC2)c2ccccc2C12OCCCO2 19866232 SFQOUYXJVOBFCJ-UHFFFAOYSA-N 397.450 2.542 0 50 GFAA Cc1ccc(C)c(OCC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 19999239 PJJFGMJQPBTZAR-UHFFFAOYSA-N 382.460 2.755 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)N1CCC(c2cccnc2)CC1 1857528784 VQQVUINOFSRCOP-AVCGJXAMSA-N 394.519 2.998 0 50 GFAA O=C(O)[C@]12COCC[C@H]1CN(Cc1ccccc1OCCCCn1ccnc1)C2 1857668993 HOTIUKKJFPNRHM-SIKLNZKXSA-N 399.491 2.665 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccncc4)C[C@]34CC[C@H]2O4)cc1 1857710142 JLJWGCCDLHJRMZ-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(c3nnc(C)c4ccccc34)C[C@]23CC[C@H]1O3 1857712764 GZWYVQHDEVPZCV-JZJXAQOMSA-N 380.492 2.838 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857730244 NVYMGUWNIIXDBG-OAQYLSRUSA-N 389.496 2.629 0 50 GFAA O=C(c1ccc(Cl)cn1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857733352 GOOWTJRKWQTOCA-QKLQHJQFSA-N 383.835 2.650 0 50 GFAA CN(C)C(=O)c1cc2cc(NC(=O)[C@H]3CC[C@H]4OCCN[C@@H]4C3)ccc2s1 1857735029 DHRIMQHOYQKVGD-APHBMKBZSA-N 387.505 2.699 0 50 GFAA O=C(c1ccc(N2CCOCC2)nc1)N1C[C@H](C2CC2)O[C@H](c2ccccc2)C1 1857735063 FORUFWOXSKNLJX-LEWJYISDSA-N 393.487 2.911 0 50 GFAA C[C@H]1CC[C@@H](C)N1C(=O)[C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857738275 ZRAHSRFGGOMKDQ-LZWOXQAQSA-N 384.505 2.881 0 50 GFAA O=C(NC[C@H]1CCCNC1)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1875247198 FHBWWJVLZCXPGQ-ZDUSSCGKSA-N 376.888 2.813 0 50 GFAA Cc1nc(N2CCc3nocc3C2)c2c(n1)[C@]1(CCCN(C(=O)C3CC3)C1)CC2 1875249114 IPJUTWHWJQYEQJ-JOCHJYFZSA-N 393.491 2.552 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)O)CC2)nn1-c1ccc(Br)cc1 237677102 RCLIKHSLZRTZKL-UHFFFAOYSA-N 392.253 2.880 0 50 GFAA Cc1cc(F)cc2c1S(=O)(=O)N(CC13CC(C(=O)OC(C)(C)C)(C1)C3)C2=O 2325772616 GPNFVEIKMFOLCF-UHFFFAOYSA-N 395.452 2.791 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1nc(-c2ccccc2)ncc1Cl 2325797098 JHAIQUVRZTUVEI-KBRIMQKVSA-N 397.866 2.563 0 50 GFAA CC1(CCC(=O)N2CC3(C[C@@H](NC(=O)Cc4ccccc4)c4nccn43)C2)CC1 2332237878 PSBGAQCMDUZTDY-GOSISDBHSA-N 392.503 2.805 0 50 GFAA O=C1c2ccccc2C(=O)N1Cc1nc2ccc(Br)cc2c(=O)o1 712458 UMFSKWFWODNSME-UHFFFAOYSA-N 385.173 2.747 0 50 GFAA COc1ccc(OCn2ccc(C(=O)Nc3ccc4c(c3)OCCO4)n2)cc1 2800462 DSXRSESYAZIQGN-UHFFFAOYSA-N 381.388 2.952 0 50 GFAA O=S(=O)(c1cc(Cl)cc(S(=O)(=O)C(F)(F)F)c1)C(F)(F)F 2846455 KEYZUVOZHBJDNN-UHFFFAOYSA-N 376.683 2.927 0 50 GFAA CCCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccccc2OCC)n1 4867956 ZRFCWBDSECDNLP-UHFFFAOYSA-N 383.857 2.965 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccn2)cc1C(=O)N1CCCCC1 6706890 YMAZNNSEXWJDCM-UHFFFAOYSA-N 375.450 2.517 0 50 GFAA O=C(O)[C@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 6726487 NXXBTQPXCGPQEY-FHEXOWRHSA-N 382.504 2.981 0 50 GFAA O=C1C[C@@H](c2cccs2)Cc2nc(N3CCN(c4ncccn4)CC3)ncc21 9341164 QSZBFQJPHKWCAN-AWEZNQCLSA-N 392.488 2.567 0 50 GFAA NC(=O)[C@H]1CCCN(Cc2nc(C(c3ccccc3)c3ccccc3)no2)C1 11753969 LYDLEXGWWZYMNU-SFHVURJKSA-N 376.460 2.947 0 50 GFAA O=C1[C@H]2CCCC[C@H]2C(=O)N1c1nonc1NC(=O)C12CC3CC(CC(C3)C1)C2 12363280 QQXLRZUIQVMITI-DWWXVXEVSA-N 398.463 2.904 0 50 GFAA O[C@@H]1CN(Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@H]1N1CCOCC1 20210083 YMRCCOOCUUKYNW-RTBURBONSA-N 376.884 2.867 0 50 GFAA CC(C)Cc1cn(C[C@@H]2CCCN(C(=O)c3cnc4ccccc4n3)C2)nn1 48302701 CLKZHSDDCMINOX-MRXNPFEDSA-N 378.480 2.972 0 50 GFAA Cc1nn(C)cc1NC(=O)CN1CC=C(c2cnn(-c3ccccc3)c2)CC1 65455109 GWWWSJPILVXVFJ-UHFFFAOYSA-N 376.464 2.642 0 50 GFAA O=C1CCCN1CCN1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67772369 DJGAKIYFYFGYJS-UHFFFAOYSA-N 387.867 2.924 0 50 GFAA Cc1c(CN(C)C[C@@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)cnn1C 67804703 YGNYRSBNSJFUCL-QHCPKHFHSA-N 398.551 2.837 0 50 GFAA CCCCc1nc(CN2CCO[C@@H](C(=O)Nc3cnccc3C)C2)c(Cl)[nH]1 72459196 FMYVCKKXNNQZNV-MRXNPFEDSA-N 391.903 2.949 0 50 GFAA O=C(O)c1ccc(C[C@@H]2CCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)C2)cc1 72478615 XVITVZWNFUCZJQ-HNNXBMFYSA-N 376.416 2.875 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)C1 95500628 ZTXOINBSDYJCJN-INIZCTEOSA-N 381.480 2.745 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N[C@@H](c2ncnn2C)C(C)C)cc1Cl 95502468 FRCWDTDLQUCJJX-CQSZACIVSA-N 378.864 2.737 0 50 GFAA Cc1cc2oc(=O)cc(C)c2cc1NC(=O)NCc1noc([C@@H]2CCCO2)n1 97772865 QLKMAVPPVNFDFZ-AWEZNQCLSA-N 384.392 2.966 0 50 GFAA Cn1c(CCCNC(=O)c2ccccc2N2CCOCC2)nc2ccccc21 172513172 IDKTVNMAJOAWNI-UHFFFAOYSA-N 378.476 2.773 0 50 GFAA CCOc1ccc(S(=O)(=O)N2C[C@H](n3ccnc3)Cc3ccccc32)cn1 181057348 NVPZVDGSCYBUMO-MRXNPFEDSA-N 384.461 2.670 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)[C@@H]1CCCN(C2CCC2)C1 181681328 ONXPFXXHNZWQNQ-DWLFOUALSA-N 397.563 2.989 0 50 GFAA Cn1nnc2ccc(C(=O)N3CCN(c4cccc(C(F)(F)F)c4)CC3)cc21 182227875 PTHMDXULTKWGLD-UHFFFAOYSA-N 389.381 2.950 0 50 GFAA O=C(O)[C@]12CN(Cc3cccnc3)C[C@H]1CN(Cc1ccnc3ccccc13)C2 215651657 OTPICKKAQHLGTO-CVDCTZTESA-N 388.471 2.648 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NCCNC1CC1)c1ccc(Cl)cc1 237866935 JBEAIKPIANFEHD-IBGZPJMESA-N 385.895 2.549 0 50 GFAA O=C(NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1cnc(OCC2CC2)c(Cl)c1 242263444 XZEXWJRVTHPPNJ-YOEHRIQHSA-N 394.899 2.821 0 50 GFAA CC(C)N(C)C(=O)N1CCn2c(Cc3cccc(Br)c3)nnc2C1 253420121 UFUVFNIQMYRNCE-UHFFFAOYSA-N 392.301 2.907 0 50 GFAA CS(=O)(=O)N1CC[C@H](CSc2ncnc3sc4c(c23)CCCC4)C1 253426509 VTWBTLMPUYIZQE-NSHDSACASA-N 383.564 2.944 0 50 GFAA CC(C)[C@@H](NC(=O)CCc1nnc(O)nc1O)c1nc2ccccc2n1C(C)C 253609802 YSCZOWXBCLDNLC-QGZVFWFLSA-N 398.467 2.660 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 268890017 JHZAPNACRUYFMX-UXHICEINSA-N 378.428 2.984 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N[C@H]3CCCO[C@@H]3c3cnn(C)c3)cn2)n1 275652184 YSYCAMRFCGLBOR-PKOBYXMFSA-N 395.467 2.659 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)Nc3ccncc3Br)C2)n(C)n1 278094368 IOYLPWGEMCYIDP-GFCCVEGCSA-N 393.289 2.677 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C[C@@H]21 284157184 QRGPMMVJCMCWCJ-IRXDYDNUSA-N 395.290 2.724 0 50 GFAA CCOC(=O)c1csc(CSc2nc(=O)cc(O)n2C2CCCC2)n1 292671128 OCZGBWQRGWVUMN-UHFFFAOYSA-N 381.479 2.990 0 50 GFAA CC(C)C[C@H]1C(=O)NCCCN1C(=O)c1ccc(-n2cnc3ccccc32)nc1 293886463 KEGBLSQDFFPHQE-IBGZPJMESA-N 391.475 2.797 0 50 GFAA O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 332917730 ZJQFYOHHICYFQM-UKRRQHHQSA-N 398.429 2.903 0 50 GFAA C[C@@H]1CN(C(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)CC2(CCOCC2)O1 333223732 SICVDFFILSYWCG-KURKYZTESA-N 379.545 2.619 0 50 GFAA Cc1cc(-c2noc([C@H](C)NC(=O)NCC3CCN(C)CC3)n2)ccc1F 363853303 JUIZBSXGXVWPOD-ZDUSSCGKSA-N 375.448 2.886 0 50 GFAA Cc1nc([C@H]2CCCOC2)sc1C(=O)N(CCC(N)=O)Cc1ccccc1 366349110 OHXIIMVKKPPZKG-INIZCTEOSA-N 387.505 2.863 0 50 GFAA Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N1C[C@H]2[C@@H](C1)OCCN2C 368096403 AKDQJKQUMBSHJS-LSDHHAIUSA-N 379.432 2.552 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)c3ccc4c(c3)nc(C(F)F)n4C)CC2)CCO1 407951710 GNWWEKGNISNUJB-ZDUSSCGKSA-N 392.450 2.836 0 50 GFAA C[C@@H]1O[C@H](C)C[C@@H]1CNc1ncnc2ccc(I)cc12 413526815 CRIJGJRTLLMLJF-OUAUKWLOSA-N 383.233 3.460 0 50 GFAA O=C(COc1ccccc1Cl)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 426490463 ONQKMOUSZAKROK-HXUWFJFHSA-N 376.884 2.970 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCC[C@@H](COc4ccccc4F)C3)nc2n1 426518835 RXBNEEAUDSIBLY-OAHLLOKOSA-N 383.427 2.811 0 50 GFAA O=C1NCC2(CCN(C(=O)c3cccc(-c4ccc5nc[nH]c5c4)c3)CC2)O1 426606738 LMAPGZQAEVITBM-UHFFFAOYSA-N 376.416 2.945 0 50 GFAA CCOCCCn1c(Cc2ccccn2)nnc1N1C[C@H](C)N(CC)C[C@H]1C 460688754 DLIISTKNZIWILW-ZWKOTPCHSA-N 386.544 2.609 0 50 GFAA CC(C)Oc1ccc(CNC(=S)NCCS(C)(=O)=O)c(C(F)(F)F)c1 729159480 SCEQQCGITHRSLW-UHFFFAOYSA-N 398.472 2.501 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cnccc1C 788412537 FCVQZDNDPKOXMM-LBPRGKRZSA-N 398.868 2.576 0 50 GFAA Cc1ccc(CN2CC[C@](O)(c3nc(C4CC4)no3)C2)c(-c2ccnn2C)c1 809761101 UDAHQMJOXXYBBY-OAQYLSRUSA-N 379.464 2.749 0 50 GFAA Cc1ccc2nc(CNC(=O)CCCc3nc(-c4cccnc4)no3)[nH]c2c1 828032418 VRLJJWVBNOPNEX-UHFFFAOYSA-N 376.420 2.955 0 50 GFAA CO[C@H]1C[C@@H](CNC(=O)c2cc3ccc(F)cc3s2)N(c2ccncn2)C1 864336051 DWUIOJHLMBCWHL-GJZGRUSLSA-N 386.452 2.854 0 50 GFAA Cc1ccc(CN2CC[C@H](NC(=O)CCn3cc(Br)cn3)C2)cc1 1471314765 LHSPRZQFKFLSMC-KRWDZBQOSA-N 391.313 2.735 0 50 GFAA CN(CC12CC3CC(CC(C3)C1)C2)C(=O)[C@H]1OCC(=O)N[C@@H]1c1ccccc1 1529167054 DTRHIBPPCXELAZ-CQAHELDESA-N 382.504 2.918 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)C1=Cc2ccccc2OC=C1 1529191684 BSLTWQZWRWVSRJ-KRWDZBQOSA-N 399.472 2.788 0 50 GFAA CCn1nc(C)cc1C(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565515037 YJMJIUFIVDIWGI-XLIONFOSSA-N 378.520 2.915 0 50 GFAA CCn1cccc1C(=O)N[C@@H]1CCCCCN(C(=O)C[C@H]2CCCOC2)C1 1775991559 LBNIBEUJXAVTSX-QZTJIDSGSA-N 375.513 2.826 0 50 GFAA Cc1nn(C)c2c1[C@@H](NC(=O)CCCc1nc(-c3cccnc3)no1)CCC2 1857680217 IIWVOPLUIDFXOY-HNNXBMFYSA-N 380.452 2.690 0 50 GFAA O=C(N1CCOCC1)[C@@]12CCCCN1C[C@@H](Nc1nccc3ccccc13)C2 1857693752 KXZRREXUWAGJDU-AVRDEDQJSA-N 380.492 2.503 0 50 GFAA CCN1CC[C@@H]2C[C@@H](N3CCOCC3)CC[C@@]2(C(=O)N(C)Cc2ccccc2)C1 1857704201 IFJRIHVVTWWXAR-AOHZBQACSA-N 399.579 2.858 0 50 GFAA CC1(C(=O)N2C[C@H](C(=O)O)C3(CCN(Cc4ccncc4)CC3)C2)CCCC1 1857704759 FEVTVKSJTWBICR-GOSISDBHSA-N 385.508 2.787 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccccc3OCc3ccccc3)CC2)OCCN1 1857707528 VSRRQGHDDAZFMR-UHFFFAOYSA-N 394.471 2.777 0 50 GFAA O=C1N[C@@H](C(=O)N2CCC(C3CCN(CC4CC4)CC3)CC2)Cc2ccccc21 1857730254 OHLJAYUSTNXWAR-JOCHJYFZSA-N 395.547 2.702 0 50 GFAA COc1ccc([C@H](NC(=O)[C@H](C)Oc2ccc3c(c2)CCC3)C(=O)O)cc1O 1875322798 IMFBMTLMOIYNSY-BUXKBTBVSA-N 385.416 2.599 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1ncc(Cc2ccccc2)o1 1875401646 NNUMUWNDAFCJSV-SJORKVTESA-N 393.447 2.713 0 50 GFAA COC(=O)c1cnc(C(=O)Nc2ccc(Oc3ccccc3OC)nc2)cn1 2100473602 JURJPPPBYWNQIN-UHFFFAOYSA-N 380.360 2.711 0 50 GFAA CN(CCc1ccccn1)C[C@@H]1CCC[C@@H](NC(=O)c2n[nH]c3c2CCC3)C1 2100478193 YIYIYTSAHNVNSE-SJLPKXTDSA-N 381.524 2.757 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)c2cccc3c2COC3)CCCCN1 2100532939 NGCUYMCXHMZCKB-IBGZPJMESA-N 399.535 2.704 0 50 GFAA CN(C1CCN(Cc2ccncc2)CC1)S(=O)(=O)c1ccc2ccn(C)c2c1 2325760137 SVOHSBXFLPDGAN-UHFFFAOYSA-N 398.532 2.858 0 50 GFAA Cc1ccn(C)c1C(=O)N(C)C[C@H](C)NC(=O)[C@H](C)OCc1ccc(F)cc1 2325793413 STXJWKOLDFBYHQ-HOTGVXAUSA-N 389.471 2.655 0 50 GFAA Cn1nc(Br)c2ccc(NC(=O)c3csc(CCN)n3)cc21 2325856986 LERARCBXJFQJMA-UHFFFAOYSA-N 380.271 2.546 0 50 GFAA CN(C)Cc1nc2ccc(NC(=O)c3cc4ccccc4c(=O)n3C)cc2[nH]1 2325857640 JVJFQSJXHLDYJZ-UHFFFAOYSA-N 375.432 2.729 0 50 GFAA CCN(CC(=O)NCc1cccnc1)S(=O)(=O)c1ccc2ccccc2c1 1051416 ZCOHBVKMSQONTQ-UHFFFAOYSA-N 383.473 2.562 0 50 GFAA Cc1ccc(C(=O)N[C@]2(C(F)(F)F)N=C(c3ccccc3F)NC2=O)cc1 2863644 SZBQOQOLJQMUFK-QGZVFWFLSA-N 379.313 2.699 0 50 GFAA COc1cc([C@H]2CC(=O)Oc3c2c(=O)[nH]c2ccccc32)cc(OC)c1OC 4387091 SIINJJJKTOQKEM-CYBMUJFWSA-N 381.384 2.995 0 50 GFAA O=C(O)c1cn(C2CC2)c2c(F)c(N3C[C@@H]4CCCN[C@@H]4C3)c(F)cc2c1=O 5932777 WEXQOLCYKFJAJZ-ZUZCIYMTSA-N 389.402 2.501 0 50 GFAA in-vitro Cc1cccc(NC(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1 6730280 NUHCDXCUXRDOTJ-UHFFFAOYSA-N 377.441 2.673 0 50 GFAA Nc1cc(=O)[nH]c(SCC(=O)N2c3ccccc3CCc3ccccc32)n1 10861758 CCTKPRYIOLNOCX-UHFFFAOYSA-N 378.457 2.908 0 50 GFAA Cc1c(CC(=O)NCCc2ccco2)c2c(n1C[C@H]1CCCO1)CCCC2=O 11841311 UGGUSEDWJPDCHJ-QGZVFWFLSA-N 384.476 2.989 0 50 GFAA CC[C@@H](C)CN1CCc2c(C(=O)OC)c(OCc3cccnc3)cc(=O)n2CC1 11968382 RSHDRCBQFAFJGT-MRXNPFEDSA-N 399.491 2.513 0 50 GFAA Cn1nnnc1SCCNC(=O)c1ccc2nc(C3CCCCC3)oc2c1 12209945 CGRCNHBLYUFNSY-UHFFFAOYSA-N 386.481 2.921 0 50 GFAA O=C(c1nc2ccccn2c1CNCCCc1ccccc1)N1CCOCC1 12314509 PYEPHHSNKSJPRK-UHFFFAOYSA-N 378.476 2.529 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2F)CN(C2CCN(C)CC2)CC1=O 14744590 UEJAEABRGAHIIF-HXUWFJFHSA-N 391.531 2.605 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-n2cccn2)c1 15068847 AJBDMQOMLDFGSC-QGZVFWFLSA-N 379.420 2.720 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)Nc1ccc(-c2ccccc2)cn1 20109985 KEBRVJCVRFZPIE-UHFFFAOYSA-N 375.432 2.544 0 50 GFAA CCN(CC)CCN(C)[C@H]1CCC(=O)N(CCOc2ccc(F)cc2)CC1 22912271 PCSYDQAPGDQVBJ-IBGZPJMESA-N 379.520 2.859 0 50 GFAA CC(C)C[C@@]1(C(=O)O)C[C@H](C(=O)NCc2ccoc2)[C@H](c2cccnc2)N1C 67725601 AHRJMIFRTFQJLA-WFXMLNOXSA-N 385.464 2.853 0 50 GFAA Cc1cccc2[nH]c([C@H]3CCCN(C(=O)c4[nH]nc5c4CN(C)CC5)C3)nc12 77406649 NSQKFQUUAMZTMW-AWEZNQCLSA-N 378.480 2.602 0 50 GFAA C[C@@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)Cc1ccc(O)c(F)c1 82092834 OBZOEDQWJIUBEF-GFCCVEGCSA-N 376.815 2.991 0 50 GFAA CN(C)C[C@H]1C[C@@H](CO)CN(C(=O)Cc2ccc3[nH]c4ccccc4c3c2)C1 91635996 RMENKOIIZDQHCN-QZTJIDSGSA-N 379.504 2.882 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N1CCCC[C@H]1CCn1cccn1 91769889 GPZPDJYOBXSWHK-INIZCTEOSA-N 379.464 2.524 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 91807762 QEDWLNXBGGPBDO-QFIPXVFZSA-N 380.492 2.806 0 50 GFAA Cc1nc(C)c(CC(=O)N[C@@H](C)c2cnn(-c3ccccc3C)c2C)c(=O)[nH]1 92077836 UDAQPWIMXYKHSS-AWEZNQCLSA-N 379.464 2.609 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)c1 95390418 DMFJNMGWELDHAU-QGZVFWFLSA-N 378.480 2.697 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@H]1CCCN(CCN2CCOCC2)C1 95499947 VDICDXYKIGSEFM-IBGZPJMESA-N 383.492 2.929 0 50 GFAA CC[C@H](C(=O)N1CCC(c2nccn2Cc2cccnc2)CC1)n1cccn1 95500755 LFWYCAGYDVWQKX-LJQANCHMSA-N 378.480 2.880 0 50 GFAA Cn1nnnc1-c1cccc(NC(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)c1 155698567 QFYIEKNSQKZJLO-AWEZNQCLSA-N 378.219 2.856 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2cccc(F)c2)N3)cc1 169764173 LFTHZMAHEOMPHJ-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA COc1ccc(CN2CC[C@H](NC(=O)c3cc4nc(C)ccc4o3)C2=O)cc1 172265864 ZUDUVGHWALARKB-INIZCTEOSA-N 379.416 2.676 0 50 GFAA CNC(=O)[C@@H]1CCCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl 173070483 YCPBRZGSNQGFIC-LBPRGKRZSA-N 392.809 2.683 0 50 GFAA CN(C)CCN1C[C@@H](C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CC1=O 181518090 HIYSVMDIOWFOGS-IBGZPJMESA-N 393.487 2.637 0 50 GFAA CC(=O)c1ccc(NC(=O)N[C@H](CC(C)C)c2nc(-c3nnc[nH]3)no2)cc1 182600833 JGPWIPUWEIGBSH-CQSZACIVSA-N 383.412 2.966 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@@H]1CCOC[C@H]1OCc1ccccc1 220738048 NRJPHFRKVWNBIT-TZIWHRDSSA-N 379.460 2.917 0 50 GFAA CC(C)[C@H](CNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccnn1C 252496435 PICQXLFZYNEEHG-HNNXBMFYSA-N 396.488 2.665 0 50 GFAA Cc1ncc(CNC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)s1 252502399 UPVDDPKFJLNZMX-UHFFFAOYSA-N 394.522 2.994 0 50 GFAA O=C(NCc1ccncc1)[C@@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263616598 JQDRNEDIGPLIQX-QGZVFWFLSA-N 390.491 2.536 0 50 GFAA Cc1oc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1C(=O)O 299750891 OQHBMPZHQUWRRZ-WBVHZDCISA-N 390.823 2.775 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)NC[C@@H]2CCn3ccnc3C2)cc1Cl 328626919 MELYMSMRYDTHHJ-SNVBAGLBSA-N 390.292 2.739 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)Nc1ccccc1CN1CCOCC1)C2 371537580 BNNNUMDWLLVIGL-GOSISDBHSA-N 382.460 2.717 0 50 GFAA C[C@@H]1CCCN1C(=O)c1cccc(-c2ccc3ncnc(NCCO)c3c2)c1 426409428 PDCNGFFDNTUVJA-OAHLLOKOSA-N 376.460 3.326 0 50 GFAA CCc1nccc(CN2CCC[C@H](c3nnc(CN4CCCCC4)n3C)C2)n1 426551045 HGDNDURYVFNHPY-KRWDZBQOSA-N 383.544 2.533 0 50 GFAA COCCN(Cc1ccsc1)C(=O)Nc1cc2c(cc1C)n(C)c(=O)n2C 426689851 KGERLFZKYUVIQA-UHFFFAOYSA-N 388.493 2.927 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)CC1 534586393 IFBFWOTZOZHAEJ-HXUWFJFHSA-N 381.524 2.888 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)N[C@@H]1CCCN(Cc2cccs2)C1 584888919 NCLVRWTVACVJSB-MRXNPFEDSA-N 375.542 2.904 0 50 GFAA Cc1ccc2nc(CNS(=O)(=O)c3cc(C(=O)O)c(Cl)cc3F)[nH]c2c1 825206856 JYVAJRLMBCAVQR-UHFFFAOYSA-N 397.815 2.841 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@@H]2CCCc3c2[nH]c2ccccc32)cc1 827755342 QZBJAVJQLRZTLX-QGZVFWFLSA-N 383.473 2.552 0 50 GFAA Cc1cccc2nc([C@@H]3CCCN3C(=O)CCC(=O)Nc3nncs3)[nH]c12 828084684 CRWPWWVCOLHBBJ-ZDUSSCGKSA-N 384.465 2.805 0 50 GFAA O=C(Nc1cc2nc(O)[nH]c2cc1N1CCCC1)c1ccccc1-n1cncn1 952990020 ZUEJYINMKNINNC-UHFFFAOYSA-N 389.419 2.702 0 50 GFAA OCCN1CCN(C2CCN(Cc3cccc(-c4ccccc4)c3)CC2)CC1 1529161355 FUTSKJHUIUMISS-UHFFFAOYSA-N 379.548 2.928 0 50 GFAA Cc1noc([C@H]2COCCN2C(=O)[C@@H]2C[C@@]23CCOc2ccc(Cl)cc23)n1 1857531750 WUJRGGQQMZSTTE-QMTMVMCOSA-N 389.839 2.672 0 50 GFAA Cc1cccnc1NCCNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857708128 GPNYPWUBDNIJGK-MRXNPFEDSA-N 394.479 2.761 0 50 GFAA CCc1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)no1 1857731998 XKZPAHSKAQPFGU-XHYAQGIWSA-N 381.476 2.646 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(c4ccc(C)nn4)C[C@]34CC[C@H]2O4)cc1 1857735408 CMJSXFIGJXVVHN-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(CCCc4ccccc4)C[C@]34CC[C@H]2O4)on1 1857736542 LXGDZQJLVWEVBS-DZCCDHAISA-N 395.503 2.825 0 50 GFAA NC[C@@H]1Cc2cc(F)ccc2N(C(=O)COCc2nc(-c3ccccc3)no2)C1 1875314926 AKRJHMAQYULFOD-AWEZNQCLSA-N 396.422 2.557 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnc(C2CC2)o1 1875403032 PDYKZSQIIJQRML-BMGDILEWSA-N 392.459 2.985 0 50 GFAA COC(=O)c1cncc2c(N3CCN([C@@H](C)c4cccnc4)CC3)nccc12 2325802265 VHFFDQLKUJJNQK-HNNXBMFYSA-N 377.448 2.695 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N3CCC[C@@H](CS(C)(=O)=O)C3)cc2)c1C 2356137895 ABBSLOBTMAULRM-MRXNPFEDSA-N 387.505 2.657 0 50 GFAA CCCN(Cc1nccn1C)C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356154109 IJIPMNYLJIHUGO-UHFFFAOYSA-N 388.537 2.685 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2csc(-c3ncccn3)n2)C1=O 2356167934 JKDJRVHISWLYNT-LJQANCHMSA-N 385.493 2.606 0 50 GFAA Cc1cc(C)n(CCC(=O)N[C@H](CCn2ccnc2C)c2ccccc2)c(=O)n1 55568633 OVRGNEKLCVPRHH-HXUWFJFHSA-N 393.491 2.703 0 50 GFAA CC1(C)[C@H](NC(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)[C@H]2CCO[C@H]21 247077711 UAEUWDAPLZJGIW-GUDVDZBRSA-N 385.508 2.925 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(C/C=C/c3ccccc3)CC2)C1)N1CCOCC1 67878154 QJECUACMGYWSIW-YKNILIKBSA-N 397.563 2.735 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)C1 71681219 CRPLIDFERHFFLC-SFHVURJKSA-N 394.519 2.763 0 50 GFAA O[C@@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)cn1 252488152 ILVGFILWSLNOHJ-RHSMWYFYSA-N 385.302 2.538 0 50 GFAA Cc1cc(C)c(-n2cccn2)c([C@@H]2CC(=O)Nc3c2c(C)nn3CC(=O)O)c1 65526882 GUKACXAYTSVNGG-AWEZNQCLSA-N 379.420 2.553 0 50 GFAA CS(=O)(=O)N1CC[C@@H](CSc2ncnc3sc4c(c23)CCCC4)C1 253426503 VTWBTLMPUYIZQE-LLVKDONJSA-N 383.564 2.944 0 50 GFAA COc1c(C)cc(C(=O)N[C@@H]2c3ccccc3C3(CCNCC3)[C@H]2O)cc1C 72165916 GEQRJHJTBGMHMM-CTNGQTDRSA-N 380.488 2.779 0 50 GFAA Cc1cccc(CNC(=O)CCn2cnc3sc4c(c3c2=O)CCCC4)n1 130428163 MUMBPEUAVRRTAY-UHFFFAOYSA-N 382.489 2.747 0 50 GFAA Cc1cc(C)nc(NC(=O)c2cn(C)nc2C(=O)Nc2cc(C)cc(C)n2)c1 20616773 CYJQLLYGHBCKQL-UHFFFAOYSA-N 378.436 2.948 0 50 GFAA CCn1nc(CNC(=O)[C@H](c2ccc3c(c2)OCO3)N(C)C)c2ccccc21 426432147 XSFKTYCKQFNPPP-FQEVSTJZSA-N 380.448 2.704 0 50 GFAA Cc1nncn1CCN1CCC[C@H](CNC(=O)c2cccc3ccccc23)C1 95524427 CTVMGPSDZVYHMO-GOSISDBHSA-N 377.492 2.882 0 50 GFAA Cc1cc(N2CCC([C@@H](O)c3nccn3C)CC2)nc(Nc2cccc(O)c2)n1 92107432 LNVPFGQVQMCODJ-LJQANCHMSA-N 394.479 2.918 0 50 GFAA Cc1ccc(CNC(=O)N2CC[C@H](Oc3ccc(Cl)cc3)C2)c(=O)n1C 296725610 FGZOGFHXRBCKGH-KRWDZBQOSA-N 375.856 2.710 0 50 GFAA CNC(=O)Cc1ccc(NC(=O)NC[C@H]2CCN(c3ccccc3C)C2)cc1 97610105 AHTSNASJJOVIGX-GOSISDBHSA-N 380.492 2.932 0 50 GFAA CC(=O)Nc1ccc(CN2C[C@@H](C(=O)O)[C@H](c3ccc4c(c3)OCO4)C2)cc1 91663928 GACDBHFVAZXPKZ-ZWKOTPCHSA-N 382.416 2.674 0 50 GFAA CCc1cc(C(=O)N2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)on1 91708010 MLJIFXIXHWTLFP-UHFFFAOYSA-N 396.491 2.720 0 50 GFAA CCCc1nnsc1C(=O)N1CCC[C@H](CNC(=O)c2cccs2)C1 95508387 GGZDHQWMDFIPIH-GFCCVEGCSA-N 378.523 2.834 0 50 GFAA Cc1ccc([C@@H](CCO)NC(=O)c2cnc(-c3cccc(C)c3)[nH]c2=O)cc1 91679169 FZDIDFQNVCWHBY-LJQANCHMSA-N 377.444 2.907 0 50 GFAA CN(CC(=O)N1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1)c1ccccc1 91365175 WRGJYGXWMQILJK-HXUWFJFHSA-N 399.535 2.533 0 50 GFAA COc1cc(CN2CCN(Cc3cccs3)[C@H](CCO)C2)cc(OC)c1 96794709 WMRCBGJMSHWMIY-QGZVFWFLSA-N 376.522 2.834 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cc(F)ccc1C)CC2 95506160 QAYQMBHLXXTQSA-UHFFFAOYSA-N 384.455 2.783 0 50 GFAA OC[C@]12COc3ccccc3[C@H]1CN(C1CCN(Cc3ccccn3)CC1)C2 95370321 FKLYYXGDOLQOAM-FYYLOGMGSA-N 379.504 2.517 0 50 GFAA Cc1cccc(-n2cc(CN3CCC4(CC3)c3[nH]cnc3CCN4C)cn2)c1 91493844 YICFOAOTHZTDOI-UHFFFAOYSA-N 376.508 2.883 0 50 GFAA O=C(CN1CCC[C@@]2(C3=CCOCC3)COCC[C@H]12)NCc1cccs1 244707792 KHQHJGJXRLYLBV-ICSRJNTNSA-N 376.522 2.582 0 50 GFAA Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 184498034 HIGGDDDSYRGEKN-IBGZPJMESA-N 394.475 2.626 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(CCCc2ccccc2)c2ncc(N)cc12 299785051 JKAIFWHRTWOJGL-UHFFFAOYSA-N 396.447 2.623 0 50 GFAA C[C@H](NC(=O)[C@H]1COc2ccc(O)cc2O1)[C@H](O)c1c(F)cccc1Cl 866791172 WJVILMIOUZMVMW-UMPCLBKJSA-N 381.787 2.563 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cccc(CS(=O)(=O)C(C)(C)C)c2)CC1 1875365789 ZDJBNJKNVFRCFR-UHFFFAOYSA-N 392.521 2.763 0 50 GFAA CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCc2c(O)nc(O)nc2C1 1875304094 ZUYCCYNXXQTQHE-KDOFPFPSSA-N 382.464 2.915 0 50 GFAA CN(C(=O)c1ccccc1OC[C@@H]1C[N@@]1Cc1cnn(C)c1)c1ccccc1 1875385098 MRAGOCZAWOMNAB-AFMDSPMNSA-N 376.460 2.960 0 50 GFAA O=C(N[C@@H]1CC[C@@H](CCNc2ncnn3cccc23)C1)[C@]12CC=CCN1CCC2 1875326669 RWLKZIMQLBCDNC-NJNPRVFISA-N 394.523 2.611 0 50 GFAA COCCn1nc(C(=O)NCc2ccc(OC)cc2C)c2c1[C@H](C)O[C@H](C)C2 1875402784 LMCQMHRANJYRHO-CABCVRRESA-N 387.480 2.799 0 50 GFAA COc1cc(NC(=O)[C@@H]2CCCCN2Cc2ccccc2)cc(-n2cnnn2)c1 952965963 GETYEMGMJLHAOX-FQEVSTJZSA-N 392.463 2.664 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)c1nnn([C@@H]2CCNC2)c1C 888102060 WPVCVIOKQSGQAK-ZIFCJYIRSA-N 383.496 2.549 0 50 GFAA Cc1cc(C)c2c(OCC(=O)N[C@H]3C[C@H]3c3ccc(F)cc3F)nn(C)c2n1 170626420 WFIDQCXZSKRFEZ-HOCLYGCPSA-N 386.402 2.914 0 50 GFAA Cc1cc(F)ccc1-n1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)n1 190734298 SPWUBYWBRRPULL-IBGZPJMESA-N 379.391 2.972 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 192145063 WMALQYKDBDMBAN-OAHLLOKOSA-N 375.856 2.899 0 50 GFAA O=C(CCC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)no1)Nc1nncs1 1506419877 ZEONDYLTEIPVGI-ZDUSSCGKSA-N 398.448 2.671 0 50 GFAA Cc1ccc(-c2csc(NC(=O)C[C@H]3C(=O)NCCN3C(C)C)n2)s1 1529191715 CYNGBGPXIYOTGY-ZDUSSCGKSA-N 378.523 2.717 0 50 GFAA O=C(Nc1ccc(Cl)nc1)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210087130 MLVDETXXFXHDRS-KGLIPLIRSA-N 375.812 2.846 0 50 GFAA CCc1ccc(CN2C[C@H](C(=O)Nc3c4c(nn3C)CSC4)CC2=O)cc1 1529155305 QPHPOZIKXGQHMA-OAHLLOKOSA-N 384.505 2.717 0 50 GFAA COc1cccc(F)c1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 1704312526 SUYMBKDDXYVLPR-NRFANRHFSA-N 384.455 2.811 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H](CO)C(C)C)ccc1F 1704306501 NQFZXTPLSVMKCY-ZDUSSCGKSA-N 379.432 2.550 0 50 GFAA C[C@@H](CN1CCc2nnc(CCNC(=O)c3ccoc3)n2CC1)c1ccccc1 12002403 FSMXPQYXAAULFD-KRWDZBQOSA-N 393.491 2.505 0 50 GFAA COCCNc1ncnc2sc(C(=O)NCCCc3ccncc3)c(C)c12 14880118 YNYQMYNZPLGSIN-UHFFFAOYSA-N 385.493 2.816 0 50 GFAA O=C1C[C@H](N2CCC(Oc3ccc4c(c3)OCO4)CC2)C(=O)N1c1ccccc1 18088162 ZPWYLVIFBYSQDN-SFHVURJKSA-N 394.427 2.591 0 50 GFAA O=C(c1cnccn1)N1CCCN(c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 169752991 CNRMOXHWKJPVFN-UHFFFAOYSA-N 382.855 2.873 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)NC(c2ccc(C)cc2)=NO3)cc1OC 169754994 KAEYOKAPNMAAQA-UHFFFAOYSA-N 395.459 2.926 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccccn4)ccn3n2)cc1C 169775957 ASSCUPYTHWHIJA-UHFFFAOYSA-N 387.443 2.605 0 50 GFAA O=C(N[C@H]1CC[C@@H](NC(=O)c2cccc3c2CCC3=O)C1)c1cccc(O)c1 1857666860 FNNIHGZBDITDQL-LSDHHAIUSA-N 378.428 2.602 0 50 GFAA OCc1csc(N2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)n1 1857695360 GKYWBTKDODIOFD-FQEVSTJZSA-N 395.488 2.677 0 50 GFAA COCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc4ccccc4c3)C[C@]23CC[C@H]1O3 1857711957 AKAZAIUIGGLSEM-ZZLPTCMGSA-N 380.488 2.582 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCN(CC(F)(F)F)C2)nnn1Cc1cccc(F)c1 225697121 PPHPORXEUVYDQZ-AWEZNQCLSA-N 399.392 2.987 0 50 GFAA CN(C)S(=O)(=O)c1cccnc1C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 2325752365 LMOXCKSKBCHUJY-CTYIDZIISA-N 393.896 2.661 0 50 GFAA O=C1NCCN1CCN1CCN(C2=Nc3ccccc3Oc3ccccc32)CC1 2325760095 PJSIRNOCLQXUJS-UHFFFAOYSA-N 391.475 2.513 0 50 GFAA Cc1cnc2c(C(=O)Nc3cccc(CCN4CCN(C)CC4)c3)cccn12 2325792944 XKNYIQAGCHOSNW-UHFFFAOYSA-N 377.492 2.685 0 50 GFAA Cc1ccc(CNC(=O)[C@]23CCCC(=O)N2CCC3)c(OC[C@@H]2CCOC2)c1 2325808414 XXENOPPDKNPYBN-VGOFRKELSA-N 386.492 2.572 0 50 GFAA O=C1N[C@H](c2ccc(OCc3ccccc3)cc2)C(=O)N2CC3(CCC3)OC[C@@H]12 2325808996 PIXRPUUEAZDNSD-VQTJNVASSA-N 392.455 2.587 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H]2COc3cc(F)c(Br)cc32)CC1 2325881969 BTQKVZRSKBLRRY-CQSZACIVSA-N 397.244 2.563 0 50 GFAA O=C(NCc1ccco1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 715400 LETUQHBGUBCUTE-UHFFFAOYSA-N 382.869 2.650 0 50 GFAA Cc1cccc(NS(=O)(=O)c2cc(C(=O)N3CCOCC3)ccc2Cl)c1 1073290 FFWPLBKUQHCCQZ-UHFFFAOYSA-N 394.880 2.922 0 50 GFAA O=C(COC(=O)CN1C(=O)c2ccccc2C1=O)Nc1cccc2ccccc12 1936145 QDLAVRRCQRHVQH-UHFFFAOYSA-N 388.379 2.618 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N[C@@H]3CCCN(Cc4cccnc4)C3)cc2)n1 2356135349 ADJNJTAEOAVXOT-LJQANCHMSA-N 388.475 2.515 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1cccc(F)c1 2502899 QSMKBMMSRKNZES-INIZCTEOSA-N 378.425 2.666 0 50 GFAA CN(C)c1ccc(-c2ccnc(N3CCc4nc(C5CC5)nn4CC3)n2)cc1 2356150838 BREGXOJPUQEDSU-UHFFFAOYSA-N 375.480 2.741 0 50 GFAA Cc1cc(O)nc(SCC(=O)N2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)n1 2356165892 JTTKKQHLTVXAIV-LUQKVYGDSA-N 399.516 2.729 0 50 GFAA CC(=O)c1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1 4844940 HADHSGCVNKDSEW-UHFFFAOYSA-N 386.473 2.929 0 50 GFAA Cc1ccc(CN(C(=O)COc2cccc(C)c2C)[C@@H]2CCS(=O)(=O)C2)o1 4867205 WLUOPACLUMPSFZ-QGZVFWFLSA-N 391.489 2.800 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@H]32)o1 248179757 XURXPNLCGDDBRJ-ARILJUKYSA-N 380.510 2.911 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CNC[C@H](O)c2ccccc2Cl)cc1 65380555 SXYPDHVSZIMLSI-SFHVURJKSA-N 375.856 2.584 0 50 GFAA CCCNC(=O)c1cccc(C(=O)NC2CCN(Cc3ccncc3)CC2)c1 172831172 GRGGZROVBJOZQZ-UHFFFAOYSA-N 380.492 2.616 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccc4nonc34)C[C@H]2CCO)cc1 36385810 NVRQJRPXXHOVTD-LJQANCHMSA-N 396.491 2.690 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CCCn3cncc3C2)nc2cccnc21 77319708 ZWWLNDQAHKTHMU-INIZCTEOSA-N 396.495 2.590 0 50 GFAA Cc1nnc(-c2cccc(C(=O)N3CCN(Cc4cccc(F)c4)C(=O)C3)c2)o1 173242285 LYCWPIYGQYSVLC-UHFFFAOYSA-N 394.406 2.669 0 50 GFAA CCN(CC)C(=O)c1ccc(NC(=O)c2cnc(C(=O)O)cn2)cc1Cl 439914007 UIEZYZYNFCTVOP-UHFFFAOYSA-N 376.800 2.563 0 50 GFAA CN(CC(=O)NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)c1cccs1 363384799 PTQPBIFQXYUAFK-UHFFFAOYSA-N 389.496 2.740 0 50 GFAA CNC(=O)c1cccc(NC(=O)N2CC[C@](O)(Cc3cccc(Cl)c3)C2)c1 363952139 ZAHMGNKKVMGLMZ-FQEVSTJZSA-N 387.867 2.911 0 50 GFAA Cn1cc(NC(=O)N2CCC[C@H](CS(C)(=O)=O)C2)c(C2CCCCC2)n1 333654187 LALOZXUAVIBGEF-AWEZNQCLSA-N 382.530 2.756 0 50 GFAA Cn1ccc(NC(=O)C(=O)NCCc2ccc(Oc3ccc(F)cc3)cc2)n1 128675782 XSSVSMXJEXOYAV-UHFFFAOYSA-N 382.395 2.649 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnn(CC)c2C)C[C@H]1CCO 39541944 ITLMIEHTMDEJOW-OAQYLSRUSA-N 386.540 2.679 0 50 GFAA Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)n1 174515289 RQIYGKSINZYHQJ-CYBMUJFWSA-N 389.887 2.667 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(-c2ncon2)cc1 129952077 PJVPTFSLZPVOMH-SFHVURJKSA-N 376.416 2.658 0 50 GFAA O=C(c1ccccc1F)N1CCCN(C(=O)c2cc3nccnc3cc2F)CC1 373441889 ITEQBYBVKBXKHT-UHFFFAOYSA-N 396.397 2.896 0 50 GFAA CCn1nc(C)c(CCNc2nc(-c3cccnc3)nc3c2cnn3C)c1C 72431821 IKEWJZLIMMUNJT-UHFFFAOYSA-N 376.468 2.913 0 50 GFAA O=C(Cc1ccccc1)NCCC(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1 174846932 IUCSJHXEQGSJSE-RTWAWAEBSA-N 380.488 2.850 0 50 GFAA COCCn1c(SCCCNC(=O)OC(C)(C)C)nnc1-c1ccncc1 241446971 NQCGFKHFCLVZTK-UHFFFAOYSA-N 393.513 2.993 0 50 GFAA COc1cccc(-c2c3c(=O)n(Cc4cccnc4)ccc3nc3ncnn23)c1 40398270 CVUKVQPNLLKYCZ-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA CC[C@@H]1[C@H](CO)CCN1C(=O)Nc1ccc(Cl)c(F)c1N1CCOCC1 455426958 ZRGBQEWWLGPHTM-SWLSCSKDSA-N 385.867 2.940 0 50 GFAA O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NCc1nc(O)n[nH]1 426389255 LFWYOBYKMVZQDE-UHFFFAOYSA-N 388.431 2.747 0 50 GFAA Cn1cc(C(=O)NCc2ccc(F)cc2)c(C(=O)NCc2ccc(F)cc2)n1 20616895 VLNZNEKHUCEODU-UHFFFAOYSA-N 384.386 2.558 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H](CO)C(C)C)csc2C1 426690206 AUMIWJIKRCVQRD-QGZVFWFLSA-N 377.510 2.658 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)c1 180289192 XFMVATTZHAOOQF-LJQANCHMSA-N 378.538 2.699 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)N1CCCC[C@H]1CN1CCCC1 426566845 GEWHBSSLRFUOCN-INIZCTEOSA-N 379.526 2.881 0 50 GFAA O=C(c1cc[nH]n1)N(CCN1CCCCC1)C[C@@H]1CCCN(C2CCCC2)C1 95511590 LJGRBYZAWCVSPW-LJQANCHMSA-N 387.572 2.992 0 50 GFAA Cc1cc(N2CCC(NCCn3ccnc3)CC2)nc(-c2ccccc2O)n1 95520292 RVTNPRGFKIPOIH-UHFFFAOYSA-N 378.480 2.613 0 50 GFAA CSc1ccccc1N1C(=O)C[C@H](Nc2ccc(N3CCOCC3)cc2)C1=O 95481368 OJGVXXJLTOFANI-KRWDZBQOSA-N 397.500 2.989 0 50 GFAA O=C(Cn1nnc2ccccc21)N1CCC(n2ccc(C(F)(F)F)n2)CC1 181462945 KTPNBONLOBLQEH-UHFFFAOYSA-N 378.358 2.510 0 50 GFAA O=C(CSCC1CC1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91644734 NGXRIAVOUJQUDY-UHFFFAOYSA-N 387.549 2.956 0 50 GFAA O=C1CC[C@H](c2nc(-c3ccc4nc[nH]c4c3)no2)CN1CCc1ccccn1 91586794 AYSQVWLFJADKKG-HNNXBMFYSA-N 388.431 2.957 0 50 GFAA Cc1noc(CC2CCN(C(=O)C3CCN(C(=O)C4CCCC4)CC3)CC2)n1 95366620 QHNVIRBEIRSGKB-UHFFFAOYSA-N 388.512 2.588 0 50 GFAA CCc1nc([C@@H](C)NCc2nnc3n(C)c(=O)c4cc(C)ccc4n23)cs1 184721480 PRBHVAGYTNSQGO-GFCCVEGCSA-N 382.493 2.759 0 50 GFAA COC(=O)Cn1cc(CN[C@H]2COc3c(cccc3OC)C2)c2ccccc21 39360030 AXGDFXIKTARJCZ-QGZVFWFLSA-N 380.444 2.916 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(C)cc2)CN1Cc1ccc(F)c(F)c1 299757273 JUNCWUKNQFLADO-APWZRJJASA-N 388.414 2.819 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](c2nnc3sc(-c4ccccc4Cl)nn23)C1 825598285 QTIFFRTZCQAOBC-SNVBAGLBSA-N 397.913 2.645 0 50 GFAA Cc1cc(C)c2nonc2c1S(=O)(=O)NCCN1CCCc2ccccc21 670451157 OYMOPCNYDUDRGR-UHFFFAOYSA-N 386.477 2.571 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2CCc2ccccn2)cc1 1506415114 KZZSAMHIUZHRQU-SFHVURJKSA-N 387.505 2.617 0 50 GFAA C=CC(=O)N(C)CC(=O)N(C)C1CCN(c2ccccc2C(F)(F)F)CC1 1875268738 CKEFNZDPZDJGJM-UHFFFAOYSA-N 383.414 2.777 0 50 GFAA O=C1N[C@H](c2ccccc2)CCN1Cc1nc(-c2n[nH]c3c2CCCC3)no1 1875286193 NWSCEZBJGWJYQR-HNNXBMFYSA-N 378.436 2.995 0 50 GFAA Cc1nc([C@@H](C)OC(=O)[C@@H]2CC(=O)Nc3ccc(Br)cc32)no1 1875260200 QUUIJMZFEPNCKE-RDDDGLTNSA-N 380.198 2.871 0 50 GFAA CC(C)(C)OC(=O)N1CCO[C@@H](c2noc(-c3cccc4nc(O)[nH]c34)n2)C1 1875267043 MTCOZSFCHZIUMI-GFCCVEGCSA-N 387.396 2.627 0 50 GFAA O=C(Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)NC12CC(C(=O)O)(C1)C2 1875279334 SDTFMYNGDAGQAW-IPPDQLOFSA-N 380.828 2.884 0 50 GFAA Cc1ccc([C@H](C)C(=O)NC2(CNC(=O)Cn3cc(C)cn3)CCCC2)cc1 1875307096 KBBQMRKEFGWLIB-SFHVURJKSA-N 382.508 2.849 0 50 GFAA O=C(N1CCC(c2nc(C(F)(F)F)n3c2CNCC3)CC1)[C@@]12CCC[C@@H]1C2 1875393372 LVDXFAPDJMMLCS-FZKQIMNGSA-N 382.430 2.901 0 50 GFAA CN(c1ncnc(SCc2ccncc2)n1)C1CN(C(=O)OC(C)(C)C)C1 1875313766 TZHSHJDMEWVPIR-UHFFFAOYSA-N 388.497 2.614 0 50 GFAA CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(N(C)C)cc1Cl 1875321022 RBNLZDGDVFYVDG-SFHVURJKSA-N 375.856 2.798 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)c1C 952869045 LQESELAJXCTQGR-UHFFFAOYSA-N 382.464 2.886 0 50 GFAA CC(C)Cn1cccc(C(=O)N[C@H](CO)c2ccccc2C(F)(F)F)c1=O 886571052 HDPGBCSAVCNCKK-MRXNPFEDSA-N 382.382 2.987 0 50 GFAA C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1cn(Cc2ccccc2)nn1 170609559 PXQNPBGOKLNHQK-KRWDZBQOSA-N 378.480 2.968 0 50 GFAA O=C(CN1CCN(c2ncnc3sccc23)CC1)Nc1ccc(Cl)cn1 192553953 AXSXXTAQKZPQBL-UHFFFAOYSA-N 388.884 2.500 0 50 GFAA CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCc1ccc(Oc2ccc(F)cc2)c(C)c1 193000489 AHLUHGNUVODCCM-IEBWSBKVSA-N 386.423 2.524 0 50 GFAA CN(C)CCc1nnc(NC(=O)CCSc2ccc3c(c2)OCCO3)s1 1506431392 DTSNYVZUCXHZAV-UHFFFAOYSA-N 394.522 2.534 0 50 GFAA Cc1ccc(C(C)C)c(OC(C)(C)C(=O)N2C[C@]3(C(=O)O)C[C@]3(C(=O)O)C2)c1 1704337762 ZBTUZJOSGRBHJU-OYRHEFFESA-N 389.448 2.664 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2ccc3nonc3c2)C1)c1n[nH]c2ccccc12 12317081 DTCYUHLQOZINCE-HNNXBMFYSA-N 390.447 2.741 0 50 GFAA CN(C)S(=O)(=O)NC[C@H]1CCCN(Cc2ccc(-c3ccccc3)cc2)C1 12454577 FSZPVDMIPVWMIO-LJQANCHMSA-N 387.549 2.962 0 50 GFAA COCCN1C(=O)N(Cc2cccc3ccccc23)C(=O)C12CCN(C)CC2 14742303 LBOPJSXOSIRNKB-UHFFFAOYSA-N 381.476 2.715 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2ccc(F)cc2)N3)cc1 169764155 HQXKHOZGOJIVMY-UHFFFAOYSA-N 397.454 2.558 0 50 GFAA CCn1ccnc1CN1CCC2(CC1)CN(Cc1ccccc1)C[C@@H]2C(=O)O 1857686160 KGGRGNYMSMHLBF-LJQANCHMSA-N 382.508 2.702 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(c2ncccn2)CC1)N1CCCC1 1857693046 FZBQGVKQVGBYGJ-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA NCC1CCN(C(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CC1 1857730360 NVMHOJAAEZBXPP-AWEZNQCLSA-N 376.888 2.895 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCC(=O)N(C3CC3)[C@@H]2c2ccnn2C)ccc1F 366367175 XGHZFVNDUUZKRR-JXFKEZNVSA-N 384.455 2.626 0 50 GFAA COc1cc(OC)cc([C@H](O)CNC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1 265417385 DVIQAQYEJXIRKK-KPZWWZAWSA-N 384.436 2.674 0 50 GFAA CCOc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCSCC)ccc1O 4113723 NTINEAMBSYUYRG-INIZCTEOSA-N 380.466 2.715 0 50 GFAA CCC(CC)[C@@H]1CCN(C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)C1 2325761181 WGNQMQVZCPOEIW-CYBMUJFWSA-N 379.482 2.702 0 50 GFAA CCCc1nc(C(C)(C)NC(=O)N[C@@H]2C[C@H]2c2cccc3c2OCCO3)no1 2325776225 BSHXSSGOYCFYHM-UONOGXRCSA-N 386.452 2.884 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nnnn2-c2ccc(C)c(C)c2)cc1 1122136 JTVPOLHMIRMYLS-UHFFFAOYSA-N 397.460 2.797 0 50 GFAA O=C(CNC(=O)c1ccc(Br)cc1)OCC(=O)c1ccccc1 1837911 CXDWLGGHCCZNJM-UHFFFAOYSA-N 376.206 2.605 0 50 GFAA CCC(=O)N[C@@H](NC(=S)Nc1ccc(C(=O)O)cc1)C(Cl)(Cl)Cl 2706980 ZGGJPTVJWJDKKR-NSHDSACASA-N 398.699 2.894 0 50 GFAA OCCN(Cc1ccccc1)C[C@@H](O)COc1ccc(Br)cc1 2818423 AZAQEODUJOBDSQ-QGZVFWFLSA-N 380.282 2.683 0 50 GFAA COC(=O)[C@@H](NC(=O)CSc1nc(C)c(CCSC)[nH]1)c1ccccc1 4632327 NPHOFPLLBMKYQL-INIZCTEOSA-N 393.534 2.746 0 50 GFAA CCS(=O)(=O)n1nc(-c2ccc(OC)cc2)nc1NCc1cccs1 4808957 HJOUJCUMGNOIMJ-UHFFFAOYSA-N 378.479 2.825 0 50 GFAA O=C(c1ccccc1Br)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1 4866941 WATSJNQAQPQMFM-GFCCVEGCSA-N 398.278 2.872 0 50 GFAA O=C(NCCCOc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1 12039792 PUZSNHNRODJDPF-UHFFFAOYSA-N 394.519 2.699 0 50 GFAA CCOC(=O)N1CCN(C(=O)C[C@@H](c2ccc(O)cc2)c2cccc(O)c2)CC1 12197644 LCBBLEKCEDBPBU-FQEVSTJZSA-N 398.459 2.921 0 50 GFAA COc1ccc2[nH]c(C(=O)N3CCC[C@@H](CCC(=O)N4CCOCC4)C3)cc2c1 12717869 FENFAXOOMGAXSJ-INIZCTEOSA-N 399.491 2.668 0 50 GFAA CSCC(=O)NC[C@H]1Cc2cccc(-c3ccc(S(C)(=O)=O)cc3)c2O1 15071846 RLWWRXGVEWQJSY-OAHLLOKOSA-N 391.514 2.540 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2F)CCCN(S(=O)(=O)CC)C1 15073689 YFGHWBKLFIJNCO-QGZVFWFLSA-N 375.437 2.502 0 50 GFAA CC1CCN(c2ccc(S(=O)(=O)N3CCC(C)CC3)c3nonc23)CC1 17077446 WCKIMBBBGRNEES-UHFFFAOYSA-N 378.498 2.880 0 50 GFAA Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)CN(C)Cc2ccncc2)C1 19812845 SHKCBEUFROCPHN-QHCPKHFHSA-N 381.520 2.666 0 50 GFAA O=C(O)c1cccnc1S[C@H]1CC(=O)N(c2ccc(OC(F)F)cc2)C1=O 19878608 NTXUOUQVJJRNGM-LBPRGKRZSA-N 394.355 2.805 0 50 GFAA CC(=O)N1CCN(Cc2ccc3c(c2)CN(C(=O)CC2CCCC2)CCO3)CC1 20908105 FIUWGHIURQKVBX-UHFFFAOYSA-N 399.535 2.652 0 50 GFAA CCOc1ccccc1N(Cc1ccc(C(=O)N(C)C)cc1)S(C)(=O)=O 67601909 CTRYHFUJFXMZJW-UHFFFAOYSA-N 376.478 2.753 0 50 GFAA CCc1oncc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 72151324 UVXGMZSCXPPZPW-GFCCVEGCSA-N 381.354 2.787 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)c2cnc(N)nc2-c2ccccc2)CC1 72412311 WEZZHHORJOBJJR-UHFFFAOYSA-N 387.487 2.992 0 50 GFAA COc1ccc(N2CCN(C(=O)c3c(C)[nH]c(C(C)=O)c3C)[C@H](C)C2=O)cc1 82096330 LVJRBFWKTKZREV-CQSZACIVSA-N 383.448 2.720 0 50 GFAA COCCN(Cc1ccncc1)C(=O)[C@@H]1CCC(=O)N(CC2CCCCC2)C1 91624948 KIQJYFRSJJDCDF-HXUWFJFHSA-N 387.524 2.876 0 50 GFAA N[C@H](C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1)c1ccccc1 91706674 AALQUVXVNPNPGJ-FQEVSTJZSA-N 375.476 2.732 0 50 GFAA COc1cc2c(cc1CNC(=O)c1ccc([C@@H]3CCCNC3)cc1)OCCO2 95358823 XXBSIDSWNPLWTC-QGZVFWFLSA-N 382.460 2.863 0 50 GFAA O=C(NCc1ccon1)c1cccc(S(=O)(=O)N2CCCCCCC2)c1 95359676 KRCQFFKOOUGETD-UHFFFAOYSA-N 377.466 2.559 0 50 GFAA COc1c[nH]c(CN(C)C[C@@H]2CCCN(CCc3ccccc3F)C2)cc1=O 95509260 HWJRMWDPSXFKPL-KRWDZBQOSA-N 387.499 2.909 0 50 GFAA COc1ccc(OC2CCN(C(C)=O)CC2)c(C(=O)NCCc2ccco2)c1 95516379 VIVSFXPWEFJCLU-UHFFFAOYSA-N 386.448 2.650 0 50 GFAA Cc1nccn1[C@@H](C)C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95527561 PRHPGMHOZFXZHH-INIZCTEOSA-N 378.480 2.799 0 50 GFAA CCc1ncc(CN2CCC3(CC2)CCN(Cc2ccoc2)C[C@H]3CO)cn1 97527796 CVBPYJLKCVOCQF-FQEVSTJZSA-N 384.524 2.729 0 50 GFAA COc1ccc(CNC(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)cc1OC 100662796 ISGPCMHPCCYEAX-UHFFFAOYSA-N 394.427 2.601 0 50 GFAA biogenic O=C(CNc1cccc(Cl)c1)N[C@@H]1CCCN(c2ncnc3[nH]ccc23)C1 116450174 SPSNKQVUYDXOGY-OAHLLOKOSA-N 384.871 2.808 0 50 GFAA Cc1c(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)cnn1C1CCCC1 120540300 CKBPUCIBMWQGRQ-GOSISDBHSA-N 375.494 2.822 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 154509706 GYGHBWABXYSNGH-BNOWGMLFSA-N 385.386 2.880 0 50 GFAA Brc1cnc2c(NC[C@H]3COC4(CCOCC4)O3)ccnc2c1 158384370 LTFATKNSXZVAKM-LBPRGKRZSA-N 380.242 2.726 0 50 GFAA Cn1cc(NC(=O)CCCc2ccc3c(c2)-c2ccccc2C3)c(=O)n(C)c1=O 170640315 LGGOVHYKBWGCFT-UHFFFAOYSA-N 389.455 2.617 0 50 GFAA CN1CC[C@H](NC(=O)NC2CCN(Cc3ccncc3)CC2)[C@@H]1c1ccccc1 179113283 YJFPBKJERAXYDO-VXKWHMMOSA-N 393.535 2.791 0 50 GFAA CCOc1ccccc1N1C[C@H](C(=O)Nc2nncn2-c2ccccc2)CC1=O 181122167 UKLPIYVXATWTEX-OAHLLOKOSA-N 391.431 2.658 0 50 GFAA CC(C)[C@@H](CNS(=O)(=O)c1cnn(CC(F)(F)F)c1)c1cccnc1 185099677 IBMFUEYFGHKWML-CQSZACIVSA-N 376.404 2.559 0 50 GFAA COc1cccc([C@H]2CCN(Cc3cnc(-c4ccccn4)nc3)C[C@@H]2O)c1 209834338 QQHFUYVFRDPCQA-CTNGQTDRSA-N 376.460 2.898 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)CCc1ccccc1F 247794851 BWYHRVWYSMKWAB-AEFFLSMTSA-N 381.451 2.917 0 50 GFAA O=C([C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)N1CCC[C@@H](N2CCNCC2=O)C1 249108651 ANAYRIZGINRFFV-FVQBIDKESA-N 396.318 2.520 0 50 GFAA CCNC(=O)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 253423137 ODKFIINBTSSEHM-QGZVFWFLSA-N 398.507 2.966 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@@H](NCc2ccc(F)cc2F)CNC3=O)c1 263616841 KUZZDKHPLGCQOZ-LJQANCHMSA-N 384.386 2.869 0 50 GFAA COc1ccc(CN2CCC(CNC(=O)CNC(=O)CCC(C)C)CC2)cc1 263858342 GWVDYRKUSABHAE-UHFFFAOYSA-N 389.540 2.576 0 50 GFAA O=C(Cn1cnc2sccc2c1=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 267501991 UQMAWGOFVMTJPJ-ZDUSSCGKSA-N 388.880 2.507 0 50 GFAA Cc1c(NC(=O)N2CCN(c3cnn(C)c3)CC2)noc1-c1ccccc1F 278921075 IMIMKWYSSZOSQO-UHFFFAOYSA-N 384.415 2.877 0 50 GFAA CN(C)C[C@H]1COCCN(C(=O)c2cccc(N3Cc4ccccc4C3)c2)C1 299789516 WJGNUUFQZWVMDX-GOSISDBHSA-N 379.504 2.857 0 50 GFAA Cc1cc(-c2ccc(C(=O)NC[C@@H](O)CO)cc2)nc2cc3c(cc12)CCC3 426722717 VXYPJARWUJXRDR-LJQANCHMSA-N 376.456 2.782 0 50 GFAA O=C(Cc1ccc(O)c(Cl)c1)NC[C@@H]1CN(Cc2ccccc2)CCCO1 632760780 VQOFIOBOUKSCBO-GOSISDBHSA-N 388.895 2.995 0 50 GFAA CC(=O)c1cccc(NC(=O)N2CCC(CO)(NC(=O)OC(C)(C)C)CC2)c1 836231173 XGKODZJACZPALA-UHFFFAOYSA-N 391.468 2.773 0 50 GFAA CO[C@H](CS(=O)(=O)Nc1cc(Cl)ccc1C(=O)[C@H]1CCOC1)C1CC1 952832853 AUYVRNAJZBKVOY-BLLLJJGKSA-N 387.885 2.726 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N3CCC[C@@H](c4cc[nH]n4)C3)o2)c1C 1506406898 HHHWQIDPUGWIMN-CYBMUJFWSA-N 376.438 2.843 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc4[nH]c5c(c4c3)CCCC5)C[C@H]2O)n[nH]1 1529098593 IUNJPVHLUCZIJS-QVKFZJNVSA-N 378.476 2.754 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2ccnc(C(C)C)n2)cc1OC 1529153186 RWROAHQMERWVRC-WOJBJXKFSA-N 387.480 2.552 0 50 GFAA O=C(CCCc1ccccc1)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1 1704339390 RVNQJMAVVDGXPQ-NZQKXSOJSA-N 381.472 2.916 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)Cc3ccncc3)CC1)OCC2 1704348129 DCWZCXOPIHBBGD-UHFFFAOYSA-N 382.460 2.732 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@H](c2nc3ccccc3o2)C1 1772810141 CLRCUGAZULUENT-AWEZNQCLSA-N 382.420 2.672 0 50 GFAA CCN1CC[C@@H]2C[C@@H](N3CCOCC3)CC[C@@]2(C(=O)NCc2cccc(C)c2)C1 1857694093 AENSHJODZBOXMV-AOHZBQACSA-N 399.579 2.824 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3n[nH]cc3Cl)C1)CC2 1857699902 CUKNUSPKIHVSJN-IBGZPJMESA-N 389.887 2.976 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3ccc4sc(=N)[nH]c4c3)CC2)O1 1857701107 MJPYRYRDNBDTDL-KGLIPLIRSA-N 375.494 2.634 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(Cc3cc(-c4cccnc4)no3)CCN12 1857703946 XGXHDIJMDACJPA-QFIPXVFZSA-N 390.443 2.986 0 50 GFAA Cc1nc(C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n(-c2ccncc2)n1 1857708258 YLHGQUBUJGFUHC-HNNXBMFYSA-N 375.436 2.966 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCC1(Cn2cccn2)CC1 1857709349 SDNGGFOFYSTYQH-MRXNPFEDSA-N 394.479 2.622 0 50 GFAA Cc1nn(C(C)C)c(C)c1C(=O)N1CC[C@@H](O)[C@@](CO)(Cc2ccccc2)C1 1857721733 CXPMAUJZBKZZHX-KNQAVFIVSA-N 385.508 2.509 0 50 GFAA COc1ccc(-n2ccnc2-c2nccn2C[C@@H]2CC(=O)N(C3CC3)C2)cc1 1857732436 QOXFCJFDQJLBKN-HNNXBMFYSA-N 377.448 2.755 0 50 GFAA CC(C)[C@@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H]1c2ccccc2C[C@@H]1O 1875254432 JUHPQLPRUQEULB-KSEOMHKRSA-N 380.488 2.535 0 50 GFAA COc1cc(C[C@@H](CO)CN=c2ccnc(-c3cccc(O)c3)[nH]2)cc(OC)c1 1875265989 IKNPGMMBXMXTNL-MRXNPFEDSA-N 395.459 2.551 0 50 GFAA CCOc1cc(C(=O)N[C@@H](Cc2c[nH]c3cccc(F)c23)C(=O)OC)ccn1 1875316380 MOSYPEKTYFJQCO-INIZCTEOSA-N 385.395 2.615 0 50 GFAA N[C@H]1CCc2nc(C(=O)Nc3nccc4ccc(Br)cc34)cn2C1 2325857265 VNZXJEDMXFNRTF-LBPRGKRZSA-N 386.253 2.720 0 50 GFAA COc1ccc(Nc2nc(NC(C)(C)C)nc(N3CCOCC3)n2)c(OC)c1 818585 BTGJNQZJPRUNAF-UHFFFAOYSA-N 388.472 2.679 0 50 GFAA Cc1no[n+]([O-])c1COc1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1 2939930 ZFQOKILLWXQDFU-BOPFTXTBSA-N 377.356 2.540 0 50 GFAA Cn1c(SCC(=O)Nc2cccc3nsnc23)nnc1-c1ccncc1 8715431 AOUNPIQRVMGIDF-UHFFFAOYSA-N 383.462 2.613 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)[C@@H]2CC(Cc3cccc(F)c3)=NO2)C1 11787859 NZKWDACZBCHERY-APWZRJJASA-N 389.471 2.620 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)[C@H]1CCC(=O)N(Cc2ccccn2)C1 11938132 VLOCQQJFHVGBOX-KRWDZBQOSA-N 390.443 2.792 0 50 GFAA COCC(=O)NC[C@H]1CCC2(CCN(Cc3ccc4cccnc4c3)CC2)O1 11982419 PZUHPKCMXZYQIY-LJQANCHMSA-N 383.492 2.511 0 50 GFAA O=C1CC[C@H](CCNCc2ccc(Cl)cc2)N1CCCN1CCOCC1 12131067 PIPSRTVOECEWAX-LJQANCHMSA-N 379.932 2.533 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@@H]3CN(C(=O)c4ccncc4)CC[C@H]32)[nH]n1 12151479 LIRXVSVGNHUXDS-YLJYHZDGSA-N 395.507 2.770 0 50 GFAA c1csc(CNc2nc3nonc3nc2N2CCN(C3CCCC3)CC2)c1 12592937 RAMWRQKWIAJJSI-UHFFFAOYSA-N 385.497 2.751 0 50 GFAA COCCN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(CC(C)C)CC2 14746337 XSVVXRAISPKYBN-UHFFFAOYSA-N 387.524 2.630 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C2CCCC2)[C@@H](CCO)C1 20388010 FNMIWRGRNVOHQN-SFHVURJKSA-N 378.513 2.524 0 50 GFAA Cc1ccc(CN2CCN(Cc3cnn(-c4ccc(F)cc4)c3)C[C@@H]2CCO)o1 22926155 YRKXFTRGRQQKEJ-NRFANRHFSA-N 398.482 2.982 0 50 GFAA O=C(NC1CCCCCC1)[C@@H]1C[C@H](n2cnnn2)CN1C/C=C/c1ccccc1 64057892 GIGBNVFRKGTQAI-GEDDFEBSSA-N 394.523 2.841 0 50 GFAA CC(=O)N1CCCn2nc(C(=O)N[C@H](c3ccccc3)c3ccco3)cc2C1 65387673 NGYAQYLVTRLPSH-HXUWFJFHSA-N 378.432 2.748 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCC4(CCO4)CC3)C2=O)cc1 67819153 IYYLLAITJJJRNH-HSZRJFAPSA-N 386.536 2.918 0 50 GFAA Cc1cncc(C(=O)N2C[C@H]3[C@@H](C2)OC(=O)N3CCc2cccc(Cl)c2)c1 67910022 YQXHQVUFIVCELH-ZWKOTPCHSA-N 385.851 2.931 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCCC3CCCC3)C2=O)c1 67946478 GASWREOAAPDFMD-OAQYLSRUSA-N 378.488 2.858 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 71745625 PSFKVURVOBMRPD-GMKZXUHWSA-N 376.500 2.810 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cnc3ccccc3c2)c1 72162874 MBVPMKFTAYCQDU-UHFFFAOYSA-N 386.429 2.525 0 50 GFAA COc1ccc(CCNS(=O)(=O)c2cc(C)c(C)cc2OC)cc1OC 72414460 VJJWZERJTJCVDE-UHFFFAOYSA-N 379.478 2.850 0 50 GFAA CCCCN1CCN([C@H](C(=O)N(C)C2CCCCC2)c2ccccc2)C(=O)C1=O 77406793 KFTIKOLPCQPOFK-FQEVSTJZSA-N 399.535 2.990 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)N2CCC[C@@H](C(=O)c3ccccc3)C2)cc1 77440445 VBOXZCXACHQHPB-LJQANCHMSA-N 389.459 2.635 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1ccnn1C(F)F 82108507 DPZIUIGLHHSPHT-UHFFFAOYSA-N 378.427 2.553 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1cc3c(cc1C)OCO3)CC2 91644912 CJCVXXYJQYTSDI-UHFFFAOYSA-N 388.508 2.965 0 50 GFAA CN(C)CCN1C[C@]2(CCCN(C(=O)c3ccc4c(c3)CCC4)C2)CCC1=O 91779201 XBRUZLIRAVFBRP-QHCPKHFHSA-N 383.536 2.582 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccccc3F)C2)CN1CCc1c[nH]cn1 91794571 ZFHCQYPETCXABO-OAQYLSRUSA-N 384.455 2.636 0 50 GFAA O=C(CCC(=O)N1C[C@H]2COc3ccccc3C[C@@]2(CO)C1)c1ccccc1 95370950 GMJRPBRPKZGPTM-CVDCTZTESA-N 379.456 2.722 0 50 GFAA Cc1cccc(NC(=O)CNc2ccccc2C(=O)N2CCC[C@H]2CO)c1C 109745656 YCGADRPQCIBQKA-KRWDZBQOSA-N 381.476 2.951 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1cnc(Cc3ccc(F)cc3)s1)CC2 114867939 MQENZNHSJCBCDI-AWEZNQCLSA-N 385.468 2.772 0 50 GFAA Cc1nc(N2CCN(C(=O)COc3ccc(F)cc3)CC2)cc(C(F)(F)F)n1 169772308 FLSNAFMONSECLO-UHFFFAOYSA-N 398.360 2.671 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)Cc4ccc(C)cc4)CC3)nn2)n1 169777332 AXBZQIWCZMQVCM-UHFFFAOYSA-N 380.452 2.605 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)CN(Cc1ccccn1)C1CC1)CC2 181367144 OSVLSBPVOCQXGN-UHFFFAOYSA-N 381.476 2.648 0 50 GFAA Cn1cc(N2CC[C@H](N3CCO[C@H](c4ccccc4C(F)(F)F)C3)C2=O)cn1 184024177 CCWDEVSRABLSKR-IRXDYDNUSA-N 394.397 2.618 0 50 GFAA CC(=O)N(CCc1ccccc1)CC(=O)N1CC[C@]2(C1)OCc1ccccc12 186937781 FOOTUIUTWIQLLN-HSZRJFAPSA-N 378.472 2.736 0 50 GFAA O=C(Nc1ccccc1)C1CCN(C(=O)c2nn[nH]c2-c2ccccc2)CC1 189009202 DNDHDYAOQBMOQT-UHFFFAOYSA-N 375.432 2.963 0 50 GFAA C[C@@H](NC(=O)c1ccnc(-n2ccnc2)c1)C1CCN(CC(F)(F)F)CC1 189675785 TVKYPIKLSOFTNT-CYBMUJFWSA-N 381.402 2.660 0 50 GFAA O=C(CN1C(=O)[C@H]2CCCN2C(=O)c2ccccc21)Nc1cc(Cl)ccc1O 212516202 JZPDHGOLQPQPGJ-MRXNPFEDSA-N 399.834 2.636 0 50 GFAA C[C@H](C(=O)N(C)CC(=O)Nc1cccc(Oc2ccccn2)c1)n1cccn1 225426240 BVAJCIJVTBEHEL-OAHLLOKOSA-N 379.420 2.729 0 50 GFAA NC(=O)[C@H](NC(=O)c1cc2c(s1)CCOC2)c1cccc(Br)c1 264004478 MABSICPZRBIWHN-CQSZACIVSA-N 395.278 2.540 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@@H](c2cccc(Br)c2)N2CCCC2)C1 299742821 KSNHMXBOGXHBJH-DZGCQCFKSA-N 381.270 2.519 0 50 GFAA COc1ccccc1Cn1nccc1NC(=O)N1CCC[C@H]1Cn1cccn1 299774325 HBAXQEDWVGUMOS-KRWDZBQOSA-N 380.452 2.833 0 50 GFAA CCCCN1CCn2nc(CNC(=O)c3c(F)cc(OC)cc3F)cc2C1 299780285 PPBMWYLIRWQBDY-UHFFFAOYSA-N 378.423 2.716 0 50 GFAA CCS(=O)(=O)C[C@H](C)N(C)C(=O)[C@H]1C[C@@]12CC(C)(C)Oc1ccccc12 328605432 NPHRZOKNKKOMMX-NBQZKYEYSA-N 379.522 2.787 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)N[C@@H]3CCc4nc(C(C)(C)C)cn4C3)cn21 333191573 SGFMQWCYKPVBPD-UONOGXRCSA-N 391.541 2.568 0 50 GFAA O=C(Cc1nc2ncccn2n1)N1CCC[C@]2(CCCCc3ccccc32)C1 363949405 MCUMHVDHZSPXBB-JOCHJYFZSA-N 375.476 2.954 0 50 GFAA CC(C)C(=O)N1CCC(NC(=O)N2CC[C@@H](n3cc4ccccc4n3)C2)CC1 367991138 UOAGLKSGWDAURB-GOSISDBHSA-N 383.496 2.640 0 50 GFAA O=C(Nc1cccc(NC(=O)C2(N3CCOCC3)CCC2)c1)c1ccncc1 378371008 MZFDKKOIRXBAKQ-UHFFFAOYSA-N 380.448 2.527 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)C(=O)N3CC4(CCC4)c4c(F)cccc43)C2)n1 407987913 FWYYWYXPRLSISN-CQSZACIVSA-N 398.438 2.692 0 50 GFAA Cc1c[nH]ccc1=NCCNC(=O)N1CCC[C@@H]1c1ccc(CN(C)C)cc1 426501750 ITMNORAAJRHGNV-OAQYLSRUSA-N 381.524 2.832 0 50 GFAA O=C(NCCC1CCN(C2CCCC2)CC1)NC[C@H](O)c1cccc(O)c1 426502837 DRKDWRAGWUZUHM-FQEVSTJZSA-N 375.513 2.770 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H]2CCCN(C(=O)C(C)C)C2)c(Cl)cc1F 827927020 QHZQISPTMXXKKS-LBPRGKRZSA-N 376.881 2.713 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1c(O)cc(Br)cc1Cl)C1CC1 864096664 ACQIKPXJBNWHCF-NSHDSACASA-N 384.679 2.975 0 50 GFAA CN1CCN(C(=O)c2ccc(-c3noc(-c4onc5c4CCCC5)n3)cc2)CC1 903983153 FEAPCAMXGVNYFV-UHFFFAOYSA-N 393.447 2.658 0 50 GFAA FC(F)(F)[C@]1(c2nc(-c3cccnc3)no2)CCN(Cc2cnns2)C1 952893528 UKUKPPNWVYWWFD-CQSZACIVSA-N 382.371 2.689 0 50 GFAA COCCc1nsc(N2CC[C@](c3nc(C4CC4)no3)(C(F)(F)F)C2)n1 952894893 RMIBSFXBQQCDFK-AWEZNQCLSA-N 389.403 2.698 0 50 GFAA O=C([C@@H](Cc1ccccc1)n1cnnn1)N1CCOc2ccc(Cl)cc2C1 1506405978 PBCULNORDKXIPE-QGZVFWFLSA-N 383.839 2.532 0 50 GFAA CC(C)=CCN1CCC2(CC[C@H](CNC(=O)CSc3nnc(C)o3)O2)CC1 1506408826 QJDDQPUGMKKLOM-MRXNPFEDSA-N 394.541 2.566 0 50 GFAA CNCCN1C(=O)CC[C@@H]2CN(Cc3cc(F)ccc3C(F)(F)F)CC[C@@H]21 1565511777 QHYUXJPBIAUFIA-DYVFJYSZSA-N 387.421 2.877 0 50 GFAA Cn1cc(CC(=O)N2CCC[C@@]3(CCc4cnc(N)nc43)C2)c2ccccc21 1704300906 BFHUFKULYURHPP-JOCHJYFZSA-N 375.476 2.600 0 50 GFAA O=C(c1ccccc1OC(F)(F)C(F)F)N1C[C@@H](O)[C@H](Cc2ccncc2)C1 1704349676 UENLSGJDRYNTSK-UKRRQHHQSA-N 398.356 2.994 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(c1nc(C)ncc1Cl)C2 1772707433 ZSIQAICTCIVXDY-HLIPFELVSA-N 394.947 2.782 0 50 GFAA C[C@@H]1C(=O)N2CCC[C@@H]2CN1Cc1ccccc1OCCCCn1ccnc1 1772809399 VYVLLZPBSPSTBU-UYAOXDASSA-N 382.508 2.937 0 50 GFAA Cc1cc(CC(=O)N[C@H]2CCC[C@@H](CNC(=O)C3Cc4ccccc4C3)C2)on1 1857692690 PQUXJURZOXJEAS-UZLBHIALSA-N 395.503 2.732 0 50 GFAA Cc1ccccc1[C@H](CNC(=O)c1cn2c(n1)CCNCC2)N1CCC(C)CC1 1857724439 DTOCMXWCRAPUIS-NRFANRHFSA-N 395.551 2.540 0 50 GFAA CCc1ccc(-c2cc(C(=O)N[C@H]3C[C@H]4CO[C@H](C(C)C)CN4C3)n[nH]2)cc1 1857728914 FNDPWVLLSPAWBS-WFXMLNOXSA-N 382.508 2.867 0 50 GFAA Cc1c(C(=O)N[C@H](C(N)=O)c2ccccc2F)cnn1-c1cccc(Cl)c1 1875259216 DFRPTHABORKOJU-KRWDZBQOSA-N 386.814 2.930 0 50 GFAA Cc1ncnc2c1C[C@H](C(=O)N1CCN(C/C=C/c3ccccc3)CC1)CC2 1875290449 GKOYMQRTVWLPHV-MUPIXQSSSA-N 376.504 2.748 0 50 GFAA C[C@@H](CCNC(=O)c1ccc2[nH]nc(C(=O)O)c2c1)N(C)Cc1ccccc1 1875299918 AUMFGOCYLZWXED-AWEZNQCLSA-N 380.448 2.902 0 50 GFAA CCc1nnc(N2C[C@H](C)[C@H](CNC(=O)C3(C)CC(F)(F)C3)C2)nc1CC 2325793920 LOMGWFGPRSCNAF-QWHCGFSZSA-N 381.471 2.620 0 50 GFAA COC(=O)c1ccc(C(=O)N2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)nc1 2356151109 RVVSAZOJVANSDT-AQOAWAETSA-N 380.444 2.628 0 50 GFAA CC[C@]1(O)CCC[C@H]2CN(Cc3cc4c(nc3OC)CN(C(C)C)C4=O)C[C@H]21 2356154395 UJSRJBKETMVUIC-REDKUUPNSA-N 387.524 2.827 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCc3cc(O)no3)C2=O)cc1 2356167259 LGZSPDOFFHLNIU-NRFANRHFSA-N 383.448 2.809 0 50 GFAA Cn1c(=O)c2c(nc(SCc3ccccc3)n2Cc2ccccc2)n(C)c1=O 623235 QBUQZNOQPKSBGQ-UHFFFAOYSA-N 392.484 2.774 0 50 GFAA COc1cc2nc(NS(=O)(=O)c3ccc(N)cc3)sc2c(OC)c1OC 629725 DXHDEWBZEVEUIR-UHFFFAOYSA-N 395.462 2.705 0 50 GFAA Cn1c(COc2ccccc2)nnc1SCC(=O)Nc1ccc2c(c1)OCO2 912381 HHTUHEBEHDKNTP-UHFFFAOYSA-N 398.444 2.854 0 50 GFAA COc1cccc(OC)c1C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1 1109981 SWJWJVKOFQNUGU-INIZCTEOSA-N 384.432 2.865 0 50 GFAA CCOC(=O)c1ccc(NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 1149981 CIWKQBWRHOCXOD-CQSZACIVSA-N 390.461 2.657 0 50 GFAA Cc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)N[C@@H](C(=O)O)C(C)C)cc1 2827365 ZFKAXWWHOZVLRG-HJDVLLJCSA-N 380.444 2.991 0 50 GFAA C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(c2ncccn2)CC1 6251431 WQCDVHFKRPYLQQ-GFCCVEGCSA-N 381.263 2.900 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N[C@@H]1CCCN(Cc3ccccn3)C1)n2C 11662419 PFPRSZPKCKZKPQ-GOSISDBHSA-N 378.476 2.976 0 50 GFAA COC(=O)CCCC(=O)N(CC1CCN(C2CCCC2)CC1)C[C@@H]1CCCO1 12020970 MGUPTVRBVXSOBH-FQEVSTJZSA-N 394.556 2.992 0 50 GFAA Cc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)o1 12581614 YEXNTDNBBJUXOU-QGZVFWFLSA-N 386.496 2.589 0 50 GFAA Cc1scc(C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1C 13331451 RDSJUYDZJYAOKY-UHFFFAOYSA-N 382.482 2.651 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 13470222 FAPQZCFUFGJPFI-UEAHRUCRSA-N 390.476 2.542 0 50 GFAA in-vitro CCOC(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1nc(C)c[nH]1)CC2 14753048 DWIRESZYLDNZGX-UHFFFAOYSA-N 379.464 2.698 0 50 GFAA Cc1cc(C)c2nc(-c3cnc(N)nc3)cc(C(=O)N(C)CCN(C)C)c2c1 63869788 OSKXGGQCTJLLCF-UHFFFAOYSA-N 378.480 2.524 0 50 GFAA CNc1ncccc1C(=O)N1CCOc2c(O)cc(-c3cccnc3)cc2C1 67691335 RFQVBKWBORZQGL-UHFFFAOYSA-N 376.416 2.926 0 50 GFAA CC(CO)(CO)NC(=O)c1csc2nc(-c3cccc(C(F)(F)F)c3)cn12 67881822 VALIWIZWIQFNRC-UHFFFAOYSA-N 399.394 2.555 0 50 GFAA O=S(=O)(NCc1ccccc1)NC[C@H](c1ccc(F)cc1)N1CCCC1 71746857 RLTMTBOFPQASIK-LJQANCHMSA-N 377.485 2.587 0 50 GFAA Cn1nc(NC(=O)COc2ccc(F)cc2)c2c(N3CCOCC3)cccc21 72421388 KFKYKKZGLVJIAK-UHFFFAOYSA-N 384.411 2.567 0 50 GFAA O=C(NCc1ccccc1CN1CCOCC1)c1ccc(Cn2ccnc2)cc1 72437357 DFKQHPXZVQBVNG-UHFFFAOYSA-N 390.487 2.694 0 50 GFAA COc1ncccc1C(=O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 91779570 RFHWEJZMSBPCMI-UHFFFAOYSA-N 383.496 2.755 0 50 GFAA CC(C)c1nnc(N2CCC3(CCC(=O)N(CCCN(C)C)C3)CC2)s1 91906614 SWBPRJSXDINNPV-UHFFFAOYSA-N 379.574 2.822 0 50 GFAA CN(CC1CCN(CCc2cccc(C(F)(F)F)c2)CC1)C(=O)[C@@H]1C=CCN1 95513189 RDSQBEHPQBIXQN-IBGZPJMESA-N 395.469 2.946 0 50 GFAA CN(C)CCOc1cc(CNC(=O)[C@H]2COc3ccc(Cl)cc3C2)ccn1 123993706 LALDIXOMQZAOCK-MRXNPFEDSA-N 389.883 2.543 0 50 GFAA O=C(c1cc(N2CCCC2=O)ccc1F)N1CCN(Cc2ccccc2)CC1 128027038 GYPLSJZUICBRNX-UHFFFAOYSA-N 381.451 2.911 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(N2CCCC2=O)c1 130020343 AKOCGTDBJMMPCK-FQEVSTJZSA-N 391.471 2.734 0 50 GFAA O=C(COc1ccccc1-c1nnco1)Nc1ccc(N2CCOCC2)cc1 131061232 YTUHJVJBYRJCIS-UHFFFAOYSA-N 380.404 2.591 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@]2(CCc3ccccc32)C1 155414478 FKFILCBSCFLCND-LADGPHEKSA-N 390.483 2.660 0 50 GFAA COc1ccc(-c2cc(N3CCC[C@@H](NC(=O)c4cccn4C)C3)[nH]n2)cc1 169753645 FRCZBJCNXDPXBW-MRXNPFEDSA-N 379.464 2.823 0 50 GFAA Cc1ccccc1C1(C(=O)Nc2ncn(CC(=O)NCc3ccccc3)n2)CC1 170707235 BHLVCJWAVPAESI-UHFFFAOYSA-N 389.459 2.573 0 50 GFAA CCc1nsc(N2CCN(CC(=O)N(C)[C@H]3CCCc4ccccc43)CC2)n1 174322670 ODPPMAVQBBHAKY-SFHVURJKSA-N 399.564 2.759 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)c3cc(C4CC4)[nH]c(=O)c3)CC2)cc1 185285629 CFUPEVSGRQFSGE-UHFFFAOYSA-N 379.460 2.595 0 50 GFAA COCCC1(CNC(=O)N2CCN([C@H](C)c3nc(C)no3)CC2)CCCCC1 186283651 WICJLYACIMQDOQ-MRXNPFEDSA-N 393.532 2.753 0 50 GFAA O=C(CN[C@@H]1CCCc2c(O)cccc21)NCc1ccccc1Cn1cccn1 192357464 ZCTRTCYIPFZZQD-OAQYLSRUSA-N 390.487 2.920 0 50 GFAA Cc1cnc2c(Cl)c(C(=O)N3CCN(Cc4cccs4)CC3)nn2c1 216144601 GSBKHCWHZPHNKG-UHFFFAOYSA-N 375.885 2.711 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@H]2OCCN(C(=O)CSc3ccccc3)[C@@H]2C1 253393347 YHVUJBGMLFHEAA-CVEARBPZSA-N 378.494 2.625 0 50 GFAA CCn1cnnc1C1CCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)CC1 264395634 MTQCUNKRPKIVNU-FQEVSTJZSA-N 381.524 2.916 0 50 GFAA CNC(=O)c1cc(OC)ccc1NC(=O)C1CCN(C(=O)c2ccccc2)CC1 266061208 QBTBMKNALQZZFG-UHFFFAOYSA-N 395.459 2.546 0 50 GFAA COCc1cc(Cl)cc(S(=O)(=O)NCc2ncc(C(F)(F)F)cn2)c1 295566700 UKXQTMOWMOVWFS-UHFFFAOYSA-N 395.790 2.774 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)Nc2nccs2)c1)N1CCC[C@H]1CF 296786366 IAVHXCLDBIUTNT-LBPRGKRZSA-N 384.458 2.910 0 50 GFAA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)[C@@H]1COc2ccc(Cl)cc2C1 299035648 PSAQSPRDBPHUCD-YPMHNXCESA-N 376.806 2.892 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC(O)(C(F)(F)F)CC2)ncn1 328628831 HPMOADCQDLVBFL-BBRMVZONSA-N 388.434 2.986 0 50 GFAA O=S1(=O)CCC[C@H](CS(=O)(=O)N2CCC[C@H]2CCC2CCCCC2)C1 333375404 DUITZYXTVRHPOW-ROUUACIJSA-N 391.599 2.966 0 50 GFAA Cc1cccc(CC2(O)CCN(C(=O)N[C@H](C)c3nnc4n3CCCC4)CC2)c1 366321476 WLRJWAMKAHTMDQ-QGZVFWFLSA-N 397.523 2.763 0 50 GFAA O=C(C1CCN(C2CCOCC2)CC1)N1CCC([C@H](O)c2cccs2)CC1 426398980 FGOMKUNAVIRQGU-FQEVSTJZSA-N 392.565 2.911 0 50 GFAA CCCn1ccnc1CN1CCC[C@H](CNC(=O)Cc2csc(C)n2)C1 823031042 QNRYBXNLAHSLOM-MRXNPFEDSA-N 375.542 2.629 0 50 GFAA CC(C)(C)n1cnc(NC(=O)N2CC(O)(c3cccc(Br)c3)C2)n1 856856696 XXUCCOPTVRUDFH-UHFFFAOYSA-N 394.273 2.531 0 50 GFAA NC(=O)c1cccc2c1CCN(C(=O)Nc1ccccc1N1CCCCC1=O)C2 888102186 GITRHWPXEKVPAD-UHFFFAOYSA-N 392.459 2.893 0 50 GFAA C[C@H](NC(=O)c1cnn2c(-c3cccnc3)ccnc12)c1cc2n(n1)CCCC2 898388194 LOUBHZFZIWSUSX-AWEZNQCLSA-N 387.447 2.815 0 50 GFAA CC(C)Cn1nnc2c1C[C@@H](c1nc(-c3cccc(-n4cccn4)n3)no1)CC2 952892716 GOXSVEUPBLSSGO-AWEZNQCLSA-N 390.451 2.837 0 50 GFAA c1cncc(-c2nnc(CN3CCN([C@H]4CCc5ccccc5C4)CC3)o2)c1 1506407346 NBMWJEJEWWYVPR-FQEVSTJZSA-N 375.476 2.807 0 50 GFAA COCc1ncc(CN2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)cn1 1565516786 OQLXFDHHFVTLHC-UWJYYQICSA-N 378.520 2.687 0 50 GFAA COc1cc(N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)nc(OC)n1 1857709856 VGNRIZXGLSQYMQ-IAGOWNOFSA-N 385.464 2.745 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)cn1 1857713780 NOBRCYQTAOMCCC-OAQYLSRUSA-N 380.448 2.583 0 50 GFAA NC(=O)[C@@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccccc1F 1875262022 SGUIHBOWHZBTEY-KRWDZBQOSA-N 387.411 2.969 0 50 GFAA CN(CC1CC1)C[C@H]1CCN(C(=O)Nc2ccc(F)c(N3CCOCC3)c2)C1 1875271531 LSUFEHYHHMKZEF-QGZVFWFLSA-N 390.503 2.858 0 50 GFAA O=C(O)CC1(CC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)CC1 1875279262 KFBABCNFYVEFKG-CQSZACIVSA-N 382.254 2.994 0 50 GFAA Cc1nc(C[C@H]2CCNC2)sc1C(=O)N1CCCCC[C@H]1c1ncon1 1875315303 ORHFPFMQBZYVQE-KGLIPLIRSA-N 375.498 2.744 0 50 GFAA CC(C)(C)OC(=O)c1cc2c(NCC(C)(C)[C@]3(O)CCCOC3)ncnc2[nH]1 1875327602 BIZIEHSBSLJFJB-FQEVSTJZSA-N 390.484 2.893 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2ccc(Cn3cccn3)cc2)C1=O 2100555118 MJGPYIGZRILTFA-JOCHJYFZSA-N 382.508 2.535 0 50 GFAA Cc1ccc(O[C@H](C)C(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c(C)c1 2325772365 GUVRZMKLGLOKID-HUUCEWRRSA-N 376.478 2.596 0 50 GFAA Cc1ccn(C)c1C(=O)N(C)C[C@@H](C)NC(=O)[C@H](C)OCc1ccc(F)cc1 2325793412 STXJWKOLDFBYHQ-CVEARBPZSA-N 389.471 2.655 0 50 GFAA CCn1cc(C(=O)N[C@@]2(CNC(=O)CCC(C)(F)F)CCCC[C@H]2C)nn1 2325794279 WTJYTLJWMSUZBJ-FZKQIMNGSA-N 385.459 2.528 0 50 GFAA Cc1ncnc2c1CN(C(=O)c1ccc3nc(O)n(CC(F)(F)F)c3c1)CC2 2325802521 MBPSEJHKIUGGML-UHFFFAOYSA-N 391.353 2.601 0 50 GFAA Cc1[nH]ccc(=NCC2(S(=O)(=O)NC(C)(C)C)CCC2)c1Br 2325861451 QBJVAQQUBWMUKU-UHFFFAOYSA-N 390.347 2.627 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1 2325889692 JHJUMJOEGNYPLD-LJQANCHMSA-N 377.444 2.539 0 50 GFAA C=CC(=O)Nc1ccc(CC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1 2325894310 QZMGAFKXVPDKIC-QGZVFWFLSA-N 376.815 2.996 0 50 GFAA Cc1c(CN2CCC3(CCc4c(O)nc(-c5cccnc5)nc43)CC2)cnn1C 2356133874 JCXOQYXUZWNXRX-UHFFFAOYSA-N 390.491 2.766 0 50 GFAA Cn1nccc1CCC(=O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356138646 OFLYPVGYULDUEP-JOCHJYFZSA-N 380.492 2.537 0 50 GFAA COc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)ccc1C 2356140409 HXIMJYCQDYSWPB-QFIPXVFZSA-N 380.492 2.980 0 50 GFAA O=C(NCCc1ccc(F)cc1)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356143773 WJJMMBOSHMVZBH-FHJLPGHOSA-N 393.462 2.816 0 50 GFAA O=C1C[C@H](c2ccccc2)NCCCCN(C(=O)c2cccnc2)CCCN1 2356161539 ZFYUROYIPSSYAU-HXUWFJFHSA-N 380.492 2.545 0 50 GFAA COc1ccc(C(=O)C[C@]2(O)C(=O)N(C)c3ccc(Cl)cc32)cc1OC 1068809 CRQFZKZFZAKPGG-LJQANCHMSA-N 375.808 2.794 0 50 GFAA CC[C@H](C)NC(=O)c1ccccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 1076674 JGVWDRJCUJGSHY-ZDUSSCGKSA-N 389.477 2.839 0 50 GFAA O=C(NCc1ccc2c(c1)CCO2)c1cc2c(s1)CCOC21CCNCC1 2356143068 TZQQNXZVCZETSQ-UHFFFAOYSA-N 384.501 2.764 0 50 GFAA O=C(Cc1ccc(-c2ccccc2)cc1)N1CCC[C@]12CCCN(CCO)C2=O 2356167538 RNDRZGZLYCAKOS-DEOSSOPVSA-N 392.499 2.872 0 50 GFAA CCOc1c(F)cccc1C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1OC 1439671710 AIYFLKYYPSLETA-HUUCEWRRSA-N 382.432 2.589 0 50 GFAA CCOc1ccc(CN(C(=O)c2cccs2)[C@@H]2CCS(=O)(=O)C2)cc1 4840068 MLFGWYJQINCZTH-OAHLLOKOSA-N 379.503 2.976 0 50 GFAA Cc1ccc(CN(C(=O)COc2cccc(C)c2C)[C@H]2CCS(=O)(=O)C2)o1 4867210 WLUOPACLUMPSFZ-KRWDZBQOSA-N 391.489 2.800 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccc(=O)[nH]c3)n1)CCN(c1ccncc1)C2 20911520 LNMAAMJVVJQKER-UHFFFAOYSA-N 386.415 2.753 0 50 GFAA O=C(NCCc1nnc2n1CCCCC2)c1ccccc1COC1CCOCC1 134528795 WHRDEXIBQZGINJ-UHFFFAOYSA-N 398.507 2.673 0 50 GFAA COc1ccccc1C(=O)Nc1cccc(NC(=O)CCc2nncn2C)c1 55254080 WBJBYGSIYYEMFV-UHFFFAOYSA-N 379.420 2.647 0 50 GFAA COc1ccc(C(=O)N2CCCN(C(=O)NCCc3ccccc3)CC2)cc1 139529490 LZDBVYOOFBEUPW-UHFFFAOYSA-N 381.476 2.795 0 50 GFAA COc1cccc([C@@H]2C[C@@H](O)CN2C(=O)NCc2ccc3c(c2)OCCCO3)c1 282117264 GBODIUOQNHDLKX-MJGOQNOKSA-N 398.459 2.874 0 50 GFAA O=C(NC1CCCCC1)C1CCN(S(=O)(=O)Cc2ccc(F)cc2)CC1 24609652 UTQMJNFEMCDOTF-UHFFFAOYSA-N 382.501 2.816 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cnc(-c2ccccc2)nc1 252490978 LGXKBSOHLGBJHN-IBGZPJMESA-N 390.418 2.814 0 50 GFAA Cc1c([C@@H](C)NS(=O)(=O)CC2CCOCC2)cnn1-c1ccc(F)cc1 173011805 XAUVTEODSXYIFG-CYBMUJFWSA-N 381.473 2.727 0 50 GFAA Cc1cc(OC[C@@H](O)CN2CCN(c3ccccn3)CC2)cc(C)c1Cl 2674809 QNKKBPVCPAIMBM-KRWDZBQOSA-N 375.900 2.914 0 50 GFAA CCCc1cncnc1N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71405645 FSBDTPFOIBVYJX-IBGZPJMESA-N 385.556 2.732 0 50 GFAA COc1ccccc1[C@@H]1CN(c2cccc(C(=O)O)n2)[C@@H]2C3CCN(CC3)[C@H]12 72174642 JKEZQOVZVSKYII-ZLGUVYLKSA-N 379.460 2.855 0 50 GFAA COCC1(C(=O)N2C[C@@H](c3ccccc3OC)[C@@H]3[C@H]2C2CCN3CC2)CCC1 72148229 VRYRTSLIEBDQEH-CEWLAPEOSA-N 384.520 2.901 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2CCc3c(nc(-c4ccccn4)[nH]c3=O)C2)c1 71551652 NYIIHINRFBMMFV-UHFFFAOYSA-N 380.835 2.992 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCc1nc(-c2ccsc2)no1 238027782 NXYMNPMZMWOGSA-OAHLLOKOSA-N 383.429 2.769 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)c2nn(-c3ccc(F)cc3)cc2O)CC1 176966506 PFZKWJPFXCWHPW-UHFFFAOYSA-N 394.450 2.983 0 50 GFAA Cc1ccc2[nH]c(=O)cc(C(=O)N3CCC(Cn4cc(C5CC5)nn4)CC3)c2c1 48205509 GBAFLQQQNQWFAL-UHFFFAOYSA-N 391.475 2.858 0 50 GFAA C[C@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)Cc1ccc(O)c(F)c1 82092835 OBZOEDQWJIUBEF-LBPRGKRZSA-N 376.815 2.991 0 50 GFAA Cc1ccc(F)c(CN2CCCn3nc(CNC(=O)N(C)C)cc3C2)c1F 82121020 GDTOIGQKBOFLKN-UHFFFAOYSA-N 377.439 2.647 0 50 GFAA CC(C)NC(=O)CCN1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426412279 MJQKEBLVKWLLOX-NRFANRHFSA-N 393.478 2.694 0 50 GFAA O=C1C[C@H](CNC(=O)N2CCC[C@H]2c2ccncc2)CN1Cc1ccccc1 179304243 AIMYLUDYWKDEGE-QUCCMNQESA-N 378.476 2.977 0 50 GFAA COc1ccc(CN2CCN(c3ccncc3C)CC2)cc1Cn1cccn1 97604197 YXCKAFWNBJGOBP-UHFFFAOYSA-N 377.492 2.966 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)CCc1ccccc1F)C2 91965244 BWYHRVWYSMKWAB-FUHWJXTLSA-N 381.451 2.917 0 50 GFAA CCS[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91486882 CGTDEOZUJDVSSK-KRWDZBQOSA-N 389.565 2.997 0 50 GFAA CCCCN1CCc2[nH]cnc2C12CCN(C(=O)c1ccnc(NC)c1)CC2 91964839 WOMOVZBTNKZGON-UHFFFAOYSA-N 382.512 2.636 0 50 GFAA O=C(COC[C@@H]1CCCCO1)N1CCC(c2nccn2CC2CCC2)CC1 95530865 OAUYWLYDEKIQKO-IBGZPJMESA-N 375.513 2.975 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1ccc(C(F)(F)F)nc1 182023280 JVBANTJSWWWTIR-AWEZNQCLSA-N 399.438 2.995 0 50 GFAA Cc1c(CC(=O)Nc2ccc3ncnc(O)c3c2)c(=O)oc2cc(O)ccc12 253623904 SHZYCRAHUQBUQU-UHFFFAOYSA-N 377.356 2.637 0 50 GFAA biogenic CCn1c(NC(=O)C2=NN(c3ccccc3)C(=O)[C@@H](C)N2)nc2cc(C)ccc21 182463239 DDHVRGNELWTMFL-CQSZACIVSA-N 390.447 2.642 0 50 GFAA FC(F)(F)c1cc(N2CCO[C@@H](CCc3ccccc3)C2)n2ncnc2n1 182654143 OAONNZRYZIBJIG-AWEZNQCLSA-N 377.370 2.981 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)CCO1 299752611 UTUSSHLZFYBDQD-AABGKKOBSA-N 381.428 2.681 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)cc1 299748657 HVDMAHDPLVHWPV-OIISXLGYSA-N 379.478 2.728 0 50 GFAA COC(=O)c1c(-c2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2)cnn1C 534637686 OEVWPFBBBRRTJA-UHFFFAOYSA-N 398.507 2.913 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)N[C@H](C)c2ccccc2-n2cccn2)cc1 828157806 VUPITCZAPDEOFP-OAHLLOKOSA-N 387.447 2.707 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCO2)cccc1C(=O)NCCCc1csc(N)n1 827753274 ZCMDITCKJMYOSF-MRXNPFEDSA-N 388.493 2.514 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](N[C@@H]3CCCC(F)(F)CC3)C2)n1 1875397515 CONROPOWRHMJOI-HUUCEWRRSA-N 381.471 2.589 0 50 GFAA CCc1cncc(C(=O)N(C)C[C@H]2CCCN2C(=O)c2nccc3[nH]ccc23)c1 1875310201 ILXRIAHLYJIKNT-QGZVFWFLSA-N 391.475 2.897 0 50 GFAA Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N[C@H]3C[C@H](CC(=O)O)C3)c12 1875305845 KCOXHGPFXDQDHW-HAQNSBGRSA-N 384.461 2.988 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2ccc(F)cc2)nc1 1875403367 UUNVQVNPEMUJNM-NIKGAXFTSA-N 396.422 2.779 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCC(=O)N4)C2)n1 952974641 ONRHHHONLTVNRP-CQSZACIVSA-N 384.436 2.619 0 50 GFAA Cn1nc(C(=O)N2CCC([C@@H]3C[C@H](N)CCO3)CC2)cc1-c1ccc(F)cc1 1343670387 AOUWWFZETPNJLL-XLIONFOSSA-N 386.471 2.585 0 50 GFAA Cc1cccc(OCC(=O)N[C@H]2CCOC[C@@H]2OCc2cscn2)c1C 1565515480 UMRSUSKQVPTFRY-WMZOPIPTSA-N 376.478 2.629 0 50 GFAA Cc1cc2c(cc1C)O[C@@H](C(=O)N[C@H](Cc1c[nH]c3ccccc13)C(=O)O)C2 170044537 XBPXMDYPJVIXSF-UYAOXDASSA-N 378.428 2.900 0 50 GFAA NC(=O)c1ccc(NC(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 171811665 JGXSXENPDFTTKS-HNNXBMFYSA-N 388.418 2.850 0 50 GFAA CCc1csc([C@H]2CCCN(C(=O)c3c(C)nn(C)c3-n3cccn3)C2)n1 189528027 CVPKRDKCZQQFPW-AWEZNQCLSA-N 384.509 2.953 0 50 GFAA CCCn1cc(C(=O)N2CCC(C(=O)NCc3ccc(OC)cc3)CC2)c(C)n1 1506425474 BCTGGDHORXPQTB-UHFFFAOYSA-N 398.507 2.779 0 50 GFAA CCOc1ccc2nc(O)c(CN3CC[C@@]4(C(=O)O)CCCN(C)[C@@H]4C3)cc2c1 1529133688 VTSCLFPBALNXOH-KNQAVFIVSA-N 399.491 2.710 0 50 GFAA O=C(Cc1ccsc1)N1CCCN(Cc2cnc(-c3ccccn3)nc2)CC1 1529104361 OIQZKULPBZUDDX-UHFFFAOYSA-N 393.516 2.877 0 50 GFAA NCC(=O)N1C[C@@H]2CN(C(=O)CCC3CCCC3)C[C@]2(CCc2ccccc2)C1 1772701048 MDAZQHYEDXHXLE-XUZZJYLKSA-N 397.563 2.835 0 50 GFAA CC[C@@H](C)NC(=O)c1cn(C2CCCC2)cc(C(=O)NCCOC(C)C)c1=O 12150040 ODOALPAQVKTXKG-OAHLLOKOSA-N 391.512 2.647 0 50 GFAA O=C(CCc1nnc(-c2ccc3c(c2)OCO3)o1)NC1Cc2ccccc2C1 12718914 XDIHSYCPOFQOSJ-UHFFFAOYSA-N 377.400 2.682 0 50 GFAA CC(C)OCCCN[C@H]1CCc2c(c(C(=O)NCc3cccs3)nn2C)C1 14541177 SUMGPLDFLHDMTI-HNNXBMFYSA-N 390.553 2.674 0 50 GFAA Cc1noc(C)c1CO[C@@H]1CN(Cc2cccnc2)CC(=O)N(CC(C)C)C1 14747713 UTGZPNTVRMYWSL-LJQANCHMSA-N 386.496 2.572 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N1CCN(c2ccc(F)cc2)CC1 16651775 PAWOKKFPOQCBFN-UHFFFAOYSA-N 390.480 2.972 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(c3ncccc3C(N)=O)C2)c1 19225798 JHCNTFHHEREBKR-INIZCTEOSA-N 396.491 2.502 0 50 GFAA COc1cccc(C2=NO[C@@H](C(=O)N3CCN(Cc4ccccc4)CC3)C2)c1 19894437 WQVKGPVLSOMPIP-OAQYLSRUSA-N 379.460 2.533 0 50 GFAA Cc1nnc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)CC4CCCC4)C3)C2)s1 1857690204 FMPKDHBCDLZLMZ-APWZRJJASA-N 378.542 2.607 0 50 GFAA Cc1ccoc1C(=O)NC[C@H]1[C@H]2CN(Cc3cccc(O)c3)C[C@]23CC[C@H]1O3 1857715902 NLWBKANEPMSZFI-JZJXAQOMSA-N 382.460 2.703 0 50 GFAA Cn1ccnc1CN1CCO[C@@]2(C[C@@H]3CC[C@H](C2)N3CCc2ccc(O)cc2)C1 1857723724 SKGWEVVKMZICJZ-NPHXMPSESA-N 396.535 2.566 0 50 GFAA CNc1ncccc1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857724254 RPKIIRPPEWZZTM-PMACEKPBSA-N 380.492 2.801 0 50 GFAA CCc1ocnc1C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857725505 ZGXFMIRBONHAIP-YQQAZPJKSA-N 375.856 2.835 0 50 GFAA CCc1nnsc1C(=O)N1CCC(Nc2cc(OC)cc(OC)c2)CC1 124622239 UPZWZRZTSOPBOI-UHFFFAOYSA-N 376.482 2.834 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2C[C@@H](C)OC[C@H]2c2ccccc2)c1 245445767 KPWQVMJOTSWKSS-UZLBHIALSA-N 381.476 2.837 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)c2cccc3c2COC3)CCCCN1 2100532940 NGCUYMCXHMZCKB-LJQANCHMSA-N 399.535 2.704 0 50 GFAA COC(=O)c1ccc2c(c1)C[C@@H](NC(=O)c1cnn(C)c1Cc1ccccc1)C2 2325792694 FODSCTNJAGOGNG-IBGZPJMESA-N 389.455 2.695 0 50 GFAA O=C(c1ccc(=O)n(-c2cccc(Cl)c2)c1)N1CCNC[C@H]1c1ccncc1 2325858457 OEZDNSXVJBUBOO-IBGZPJMESA-N 394.862 2.673 0 50 GFAA Nc1cc(-c2ccccc2)nn1CC(=O)Nc1cccc(C2(N)CCOCC2)c1 2325859548 AJTSKUYCLYOQKY-UHFFFAOYSA-N 391.475 2.735 0 50 GFAA CCN(CC)CCn1c(=N)n(C[C@H](O)c2ccc3c(c2)OCO3)c2ccccc21 780169 LUISFFOEAJFISL-IBGZPJMESA-N 396.491 2.726 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1C(=O)c2ccccc2S1(=O)=O 1145575 JXCCSUSOLRXHQZ-UHFFFAOYSA-N 394.836 2.522 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccn(Cc2c(F)cccc2Cl)n1 2804851 KGYYKIUQWKOKJS-UHFFFAOYSA-N 383.836 2.865 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OC(C)C)[C@H]1c1ccc(F)cc1 4142456 XJTOZJAEUQGOBW-OOSNJVJTSA-N 394.439 2.769 0 50 GFAA COC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCc2cc(OC)c(OC)cc2C1 8764492 IVGSSVDZXWHDSJ-SFHVURJKSA-N 398.459 2.556 0 50 GFAA biogenic Cn1cnnc1SCCNC(=O)c1csc2nc(-c3ccccc3)cn12 11664350 QYGXRKPYPXKWLU-UHFFFAOYSA-N 384.490 2.713 0 50 GFAA CCn1cc(CN2CC[C@]3(CCCN(Cc4cccc(OC)c4)C3=O)C2)cn1 11839104 ZFIKICLXNWVUOM-JOCHJYFZSA-N 382.508 2.926 0 50 GFAA COc1cccc(CCNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(OC)c3)C2)c1 11873552 YNLNLJHXGGACPG-LJQANCHMSA-N 396.487 2.801 0 50 GFAA CCn1nc(-c2ccccc2)c(-c2ccccc2)c(C(=O)NCCOC)c1=O 12016385 ZJPKJCIBHSCJKN-UHFFFAOYSA-N 377.444 2.973 0 50 GFAA Cc1ccc(NC(=O)C[C@@H]2C(=O)NCCN2C(=S)Nc2ccccc2)c(C)c1 13483345 SHUKGFKSOARXNZ-GOSISDBHSA-N 396.516 2.829 0 50 GFAA Cc1ccc(N2C[C@@H](c3nnc(NC(=O)[C@H]4CCCO4)s3)CC2=O)cc1C 16624817 YHRQQZAGTRGURR-DZGCQCFKSA-N 386.477 2.793 0 50 GFAA CCn1cc(S(=O)(=O)N2CCN(Cc3ccc(C(C)(C)C)cc3)CC2)cn1 17079784 NAYUFZDOQIUMLT-UHFFFAOYSA-N 390.553 2.707 0 50 GFAA COc1ccc(C(=O)[C@@H]2CCCN(S(=O)(=O)CC(F)(F)F)C2)c(C)c1 19842001 ARNWWIOXRCMRTN-GFCCVEGCSA-N 379.400 2.790 0 50 GFAA CSc1nc2ncc3c(=O)n(CCc4c[nH]c5ccccc45)ccc3n2n1 20102163 BWQVLBMWOKXBLT-UHFFFAOYSA-N 376.445 2.885 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NCc2sccc2C)CN1C1Cc2ccccc2C1 20599018 UVDUDMBJHMVBJP-QUCCMNQESA-N 383.561 2.893 0 50 GFAA COc1cccc(NC(=O)c2cn(C)nc2C(=O)Nc2cccc(OC)c2)c1 20617128 SULOPGJIGIWNRP-UHFFFAOYSA-N 380.404 2.942 0 50 GFAA COC(=O)c1c(NC(=O)CN2CCN(c3ccccc3)CC2)sc(C)c1C 35898028 CVBQGTVIWUBKQU-UHFFFAOYSA-N 387.505 2.912 0 50 GFAA Cc1c(C(=O)N(Cc2ccccc2)C[C@@H](C)CO)nnn1Cc1ccccc1 55283791 ZMTCCGRYRMWWRN-QGZVFWFLSA-N 378.476 2.906 0 50 GFAA O=C1COc2cc3c(cc2N1)[C@H](c1cc(F)ccc1-n1cccn1)CC(=O)N3 65422855 HMMYSFDOYLJEPL-GFCCVEGCSA-N 378.363 2.816 0 50 GFAA Cc1cc(CNC[C@]2(O)CCCN(CCCc3ccccc3)C2=O)cc(C)n1 67727024 HMXPXGCEWLVCON-HSZRJFAPSA-N 381.520 2.774 0 50 GFAA O=C1CCC2(CCN1)CCN(C(=O)c1cnc(Nc3ccccc3)nc1)CC2 67847837 ZHLWWBLNNWNIRH-UHFFFAOYSA-N 379.464 2.743 0 50 GFAA O=C(c1ccsc1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71681612 MPEVUVCHEUPPOI-MRXNPFEDSA-N 375.538 2.687 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCC[C@@H]1c1nn2c(C3CC3)nnc2s1 71747701 VGPPNIZDRNGANW-CYBMUJFWSA-N 393.469 2.728 0 50 GFAA Cc1nc(N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c2ccsc2n1 71774686 GTXINIHSUXBSSF-HNNXBMFYSA-N 399.564 2.959 0 50 GFAA Cc1cc(N2CCN(c3nnc(C4CC4)o3)CC2)nc(-c2ccccc2O)n1 95365424 FZLQDRHHCZDELL-UHFFFAOYSA-N 378.436 2.745 0 50 GFAA O=C1CCC2(CCN(CCn3cnc4ccccc43)CC2)CN1C[C@H]1CCCO1 95370814 MJUDNDGYVRFUJU-LJQANCHMSA-N 396.535 2.920 0 50 GFAA COc1ccc(C(=O)N2CCc3n[nH]cc3C2)cc1OC1CCN(C(C)C)CC1 95505917 KVBFPYXGZLCGDQ-UHFFFAOYSA-N 398.507 2.868 0 50 GFAA Cn1cnnc1CN1CCC(CCC(=O)NCc2cccc(Cl)c2)CC1 95528366 CWGLMBRGNSGKQQ-UHFFFAOYSA-N 375.904 2.777 0 50 GFAA Cn1nc(-c2ccccc2)cc1NC(=O)N[C@@H]1CCCN(c2cnccn2)C1 95529648 HSVMQZOOCRYIIM-MRXNPFEDSA-N 377.452 2.668 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)C2CCN(c3cnccn3)CC2)C[C@H](C)O1 122190077 MLONAFNTHWGOFL-IRXDYDNUSA-N 395.507 2.945 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cc(F)cc2nccnc12 129944206 GBXMMXPUQBVORT-QGZVFWFLSA-N 378.407 2.690 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@@]2(CCc3ccccc32)C1 155414697 FKFILCBSCFLCND-UPVQGACJSA-N 390.483 2.660 0 50 GFAA O=C(N[C@H]1CCN(c2cc(-c3cccs3)n[nH]2)C1)c1ccc2c(c1)OCO2 169755709 JHHNYKAAPBHIHZ-ZDUSSCGKSA-N 382.445 2.876 0 50 GFAA Cc1nc2ccccc2c(C)c1CC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 186669042 IAPHAUOZFXFVGM-KRWDZBQOSA-N 383.492 2.792 0 50 GFAA Cn1ccc2ccc(NC(=O)CC[C@H]3NC(=O)c4ccccc4NC3=O)cc21 206249355 JLYGUQXSFPPNDH-QGZVFWFLSA-N 376.416 2.648 0 50 GFAA Cn1c(C(=O)N2CCN(Cc3ccco3)[C@@H](CCO)C2)cc2cc(F)ccc21 215060149 YMBRGVWJNVWGMB-KRWDZBQOSA-N 385.439 2.619 0 50 GFAA COc1ccccc1CCNC(=O)[C@H](NC(=O)OC(C)(C)C)C1CCOCC1 225764093 XSKNEFCAUUNSIR-GOSISDBHSA-N 392.496 2.674 0 50 GFAA O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1ccn(Cc2c(Cl)cccc2Cl)n1 226393891 NOOZLSAWAGEZOY-XOUADPBQSA-N 392.242 2.905 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NC[C@H](Cc1ccccc1)C(=O)O 236583758 WOGXYBGPCYOVSG-FPOVZHCZSA-N 394.471 2.582 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237509498 MOYFLEUMNBMJNY-QWHCGFSZSA-N 377.286 2.834 0 50 GFAA C[C@H](O)CN1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3s2)[C@@H](C)C1 240465970 GBTOFXCRADURRN-MELADBBJSA-N 379.551 2.690 0 50 GFAA CC[C@H](CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccccc1 252503905 VHBQFIVEXSGPMV-QGZVFWFLSA-N 375.490 2.653 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCOC[C@@H]1C(=O)O 262553786 XSIRWKAUWATUSY-CYBMUJFWSA-N 396.852 2.610 0 50 GFAA Cc1c(NC2CCN(C[C@H]3CCOC3)CC2)nn2c(C(F)(F)F)nnc2c1C 269344574 DDIRYTDYGJGMPL-CYBMUJFWSA-N 398.433 2.673 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2cccc(C(F)(F)F)c2F)CC1 275587011 HCWPKKOBXQRORJ-UHFFFAOYSA-N 376.350 2.856 0 50 GFAA CNC(=O)c1ccn([C@@H]2CCCN(C(=O)Cc3ccc4ccccc4c3)C2)n1 277926163 RRVBNBWEJGZBJX-LJQANCHMSA-N 376.460 2.802 0 50 GFAA NCC1CCN(C(=O)C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)CC1 423453691 JRWUPYDOPSJSRI-UHFFFAOYSA-N 397.441 2.609 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)N2CCC[C@@H](n3nc(C)cc3C)C2)cc1 746024925 YQWPJTUXNZTOOT-GOSISDBHSA-N 385.468 2.954 0 50 GFAA O=C(O)c1cccc(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 908419941 FLWCHXXPMNPGQQ-FGTMMUONSA-N 379.460 2.810 0 50 GFAA Cn1c([C@@H]2CCCN2C(=O)CCC(=O)Nc2nncs2)nc2ccccc21 952988579 OMFRXXVRXZIMTA-AWEZNQCLSA-N 384.465 2.507 0 50 GFAA CCc1nc(CN2CCC[C@H](CNC(=O)c3ccc4scnc4c3)C2)no1 1506408728 WLOWUILVWWLXHA-CYBMUJFWSA-N 385.493 2.884 0 50 GFAA CCCC(=O)N1CCC(N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)CC1 1529095209 OCLCQCOWQOEXRL-XMSQKQJNSA-N 381.520 2.861 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(c3nc(-c4ccccc4)no3)C2)N1Cc1ccccn1 1565513353 ROXSXCGEDBVOKP-AEFFLSMTSA-N 375.432 2.759 0 50 GFAA CO[C@H]1CN(C(=O)c2nc3ccc(Cl)cn3c2F)C[C@H]1Cc1cc(C)no1 1704351670 QGWWBXKGBJABFI-RISCZKNCSA-N 392.818 2.753 0 50 GFAA COc1cccc(-c2nccn2-c2ccc3c(c2)nnn3C)c1O[C@H](C)C(=O)O 1775980681 HFBADTDWGDCXCF-GFCCVEGCSA-N 393.403 2.682 0 50 GFAA Cc1ccc(C(=O)N[C@@]23CCC[C@@H]2N(C(=O)[C@@H](C(C)C)N(C)C)CC3)s1 1775993395 ZUFWYMJLJXUDEF-SQGPQFPESA-N 377.554 2.896 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)O)C3(CCN(Cc4[nH]cnc4C)CC3)C2)cc1 1857690510 LNHUKVZSNHOUDA-LJQANCHMSA-N 382.508 2.825 0 50 GFAA COc1ccnc(CN2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1OC 1857694833 JZOZEOQGWZVPJY-JOCHJYFZSA-N 396.491 2.952 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4cnc[nH]4)C3)nc2c1 1857711876 OTKWJXFDOTUVLV-AWEZNQCLSA-N 383.452 2.525 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2cc(NC(=O)OC)cc(C(F)(F)F)c2)[C@@H](C)C1 1875381241 OEOLOBVGLBIGLL-NSHDSACASA-N 399.369 2.743 0 50 GFAA C=CC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)C2=NO[C@H](C(C)(C)C)C2)C1 1875383479 WKFDPPGQUQLFAF-SGXKBVARSA-N 383.492 2.696 0 50 GFAA COc1ccc(C)cc1CCNC(=O)N1CCC[C@]12CCC[S@@](=N)(=O)C2 1875393793 SWLAQFKJKMTTAX-NIYFSFCBSA-N 379.526 2.931 0 50 GFAA O=C(Cc1ccc2cccnc2c1)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 1875403061 PBZJUOCZLSYASX-GDIGMMSISA-N 384.867 2.583 0 50 GFAA CCCN1C(=O)[C@@]2(CCN(C(=O)Cc3ccc4c(c3)OCO4)C2)c2ccccc21 2100477894 HWDTUWGRGFWMMU-HSZRJFAPSA-N 392.455 2.885 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)c2ccc(Cn3nc(C)cc3C)cc2)C[C@@H]1O 2356169041 SVGAFTWLHSGNRJ-UGKGYDQZSA-N 399.491 2.626 0 50 GFAA COC(=O)COc1cc(OCC(=O)OC)c2c(=O)cc(-c3ccccc3)oc2c1 626104 DKAWPFHBHCHXDQ-UHFFFAOYSA-N 398.367 2.564 0 50 GFAA biogenic O=C(Cn1cnc2ccc(Br)cc2c1=O)Nc1ccccc1F 638846 DFZPIFQGQXGZJG-UHFFFAOYSA-N 376.185 2.937 0 50 GFAA CCOc1ccc([C@@H]2C(C(=O)OC)=C(C)N=C3SCCC(=O)N32)cc1OC 799367 BEKXNWLDZJFGMA-QGZVFWFLSA-N 390.461 2.917 0 50 GFAA COc1cccc(N(CC(=O)Nc2ccc(F)c(Cl)c2)S(C)(=O)=O)c1 1147316 VWELFWARCUBXPO-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA O=C(C1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCc2ccccc2C1 1158165 BOHLNOLDNOPIQZ-UHFFFAOYSA-N 384.501 2.672 0 50 GFAA CCOc1ccc(NC(=O)CSc2nnc(-c3cnccn3)n2CC)cc1 2522896 OBSKENUQLJHPBW-UHFFFAOYSA-N 384.465 2.885 0 50 GFAA CCN(CCNC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccc1 4057600 HGEUSZSCXVEQEH-HXUWFJFHSA-N 379.504 2.720 0 50 GFAA Nc1cc(=O)nc(SCC(=O)Nc2ccccc2)n1CCc1ccccc1 6658561 RPOOCXMYAIVDDT-UHFFFAOYSA-N 380.473 2.799 0 50 GFAA COc1cccc(NC(=O)N2CCN(c3ccc(N4CCCCC4)nn3)CC2)c1 6701320 OXXREYXODYQNGZ-UHFFFAOYSA-N 396.495 2.830 0 50 GFAA CC[C@H](C(=O)N1CCN(c2ccccc2)CC1)n1cnc2ccccc2c1=O 9422105 UVQYGHVZDMYCTN-HXUWFJFHSA-N 376.460 2.696 0 50 GFAA NC(=O)C1(C(=O)N2CCC([C@@H]3CCN(Cc4ccc(Cl)cc4)C3)CC2)CC1 11844620 PJYXHLRAKYNSBU-QGZVFWFLSA-N 389.927 2.666 0 50 GFAA CSCC(=O)N1CCC(Oc2cccc(C(=O)NCc3ccccn3)c2)CC1 11934424 VGEODAWQEUMCKB-UHFFFAOYSA-N 399.516 2.744 0 50 GFAA O=C(COc1ccccc1Br)N1CCN(c2ccccn2)CC1 13324205 HSQZCTRZAWZGFR-UHFFFAOYSA-N 376.254 2.572 0 50 GFAA CCOc1ccc(/C=C(/NC(=O)c2ccc(C)cc2)C(=O)N[C@@H](C)C(=O)O)cc1 16675731 NHXVYPWNHGXYKX-SJPXOZHESA-N 396.443 2.754 0 50 GFAA O=C([C@@H]1CCN(c2ccccc2)C1=O)N1CCN(C/C=C/c2ccccc2)CC1 20776492 HMBJDONOLCTCMF-FNNXTJRKSA-N 389.499 2.897 0 50 GFAA COCC(=O)N1CCC(Oc2ccc(C(=O)NCc3ccsc3)cc2)CC1 20910541 PFTWYYZTXCZUER-UHFFFAOYSA-N 388.489 2.694 0 50 GFAA O=C(NCCN1CCOCC1)c1cc(-c2ccccc2)nn1-c1ccccc1 23053311 XAIFINIQHDWGIQ-UHFFFAOYSA-N 376.460 2.601 0 50 GFAA COc1cc2ncn(Cc3cnn(-c4ccccc4OC)c3)c(=O)c2cc1OC 32578102 IPPKDMITCHQKKH-UHFFFAOYSA-N 392.415 2.656 0 50 GFAA CC(C)CN1C[C@@H](NCc2cccnc2)C[C@H]1C(=O)NCCc1ccccc1F 32582093 HLRVLAMIJXUEAL-UNMCSNQZSA-N 398.526 2.768 0 50 GFAA O=C(Nc1cccnn1)N1CCN(c2nccc(-c3ccc(F)c(F)c3)n2)CC1 43203994 JCWVFSJNIBAGQN-UHFFFAOYSA-N 397.389 2.566 0 50 GFAA in-vitro COc1cccc(-n2cc(CN(C)C(=O)c3nn(C)c4c3CCCC4)cn2)c1 65374775 HIKUBXVRABQFSF-UHFFFAOYSA-N 379.464 2.765 0 50 GFAA CC[C@@H](CO)NC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 71748474 JWJDUMKEENJZNM-NRFANRHFSA-N 387.568 2.559 0 50 GFAA Oc1c(I)cc(F)c(F)c1I 85221539 CCJXITPNMWRFFR-UHFFFAOYSA-N 381.885 2.880 0 50 GFAA in-vitro Cc1ccccc1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91664613 BIQNEJZBHMYXIJ-JOCHJYFZSA-N 380.492 2.806 0 50 GFAA Cc1ccc2[nH]c(CCC(=O)N3CC[C@H](N(C)C)[C@H](CCCO)C3)nc2c1C 91943357 JLVWIHNZHZEMAA-MJGOQNOKSA-N 386.540 2.664 0 50 GFAA CCn1ccnc1CN1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95357860 YFJFQFYABYVRPD-MTNREXPMSA-N 380.492 2.694 0 50 GFAA COC(=O)c1ccc(NC(=O)N2CCN(C3CCSCC3)CC2)c(C)c1 95516733 BYQOCXBWHUJFOK-UHFFFAOYSA-N 377.510 2.827 0 50 GFAA Cc1nn(C)c2nc(N3CCC(C(=O)NCCc4ccccc4)CC3)sc12 95526065 GHBPVVDEWMEQRM-UHFFFAOYSA-N 383.521 2.914 0 50 GFAA COCCN(Cc1nnc(C)o1)C[C@@H]1CCCN(C2Cc3ccccc3C2)C1 95526492 ASPCHXQHRPYZHY-SFHVURJKSA-N 384.524 2.706 0 50 GFAA Cc1ocnc1C(=O)N1CCC(c2nnc(CN3CCCCCC3)n2C)CC1 96152449 YIOZYVBSHABYOG-UHFFFAOYSA-N 386.500 2.507 0 50 GFAA CSCC(=O)N1CCC2(CCN(CCc3ccccc3)CC2)[C@H](CO)C1 97156027 ZFKRXXBEKONQEJ-IBGZPJMESA-N 376.566 2.515 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)N[C@H](CC(C)C)c2cccnc2)c1 97785134 NLYGLEDYJMUMFI-QGZVFWFLSA-N 376.482 2.899 0 50 GFAA CN(C(=O)c1n[nH]c(=O)c2ccccc12)C1CCN(Cc2ccccc2)CC1 113208072 VQTVNAXOFCYGMX-UHFFFAOYSA-N 376.460 2.660 0 50 GFAA O=C(Nc1ccn(-c2ncccc2C(F)(F)F)n1)N[C@@H]1CCc2[nH]ncc2C1 164441165 AETKGYRBILSFBW-LLVKDONJSA-N 391.357 2.688 0 50 GFAA COc1ccc(C(=O)NCc2nnc3c(-c4nc(C(C)C)no4)cccn23)cc1 169776111 RQNLZPRNMJWRQZ-UHFFFAOYSA-N 392.419 2.841 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)Cc4ccc(F)cc4)C3)nn2)n1 169778131 LIELNQZFOYSXFI-HNNXBMFYSA-N 384.415 2.607 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(Cl)nc1)[C@@H]1SCCc2ccccc21 170645633 KCLXCSXWKOVQDQ-OAHLLOKOSA-N 382.894 2.712 0 50 GFAA O=S(=O)(C[C@@H]1CCCO1)Nc1cccc(-c2nnc3n2CCCCC3)c1 171806009 IIDOEIRSNSNNHH-INIZCTEOSA-N 376.482 2.592 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CCC[C@H](n3cc(C)cn3)C2)c1 173446722 ALNHBVNJAIJCPT-KRWDZBQOSA-N 380.456 2.734 0 50 GFAA C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1CCN(c2cc(C3CC3)n[nH]2)CC1 189681906 UVCAZVACYZGLDV-OAHLLOKOSA-N 385.487 2.768 0 50 GFAA Cc1cc(F)ccc1-n1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)n1 190734281 SPWUBYWBRRPULL-LJQANCHMSA-N 379.391 2.972 0 50 GFAA Cc1noc(CCCC(=O)N2CC[C@H]3CCN(C(=O)OC(C)(C)C)[C@H]3C2)n1 225445821 NZXVXANQTJDFDQ-GJZGRUSLSA-N 378.473 2.559 0 50 GFAA Cc1c(C(=O)N[C@@H](CN)C2CCCCC2)nnn1-c1ccc2ncccc2c1 237824932 JSCRADBDPBUPEE-IBGZPJMESA-N 378.480 2.761 0 50 GFAA CC(C)c1ccc(-n2cnnc2SCC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)cc1 249628240 UNRBRRQYWANZOD-QHOFPYNOSA-N 398.532 2.711 0 50 GFAA CC(C)NC(=O)c1nnc(N2CCC(c3ccccc3)CC2)n1C[C@H]1CCCO1 253397783 KWAAJQWUXHMSNS-LJQANCHMSA-N 397.523 2.979 0 50 GFAA CN1C(=O)N[C@@]2(CCN(C(=O)Nc3cc(F)ccc3Oc3ccccc3)C2)C1=O 269615937 QLQZKPQIOJNCRP-HXUWFJFHSA-N 398.394 2.776 0 50 GFAA C[C@@H]1CCN(C(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)CC12CCC2 271332977 LVKOVLIOJOMMNZ-OAHLLOKOSA-N 389.521 2.620 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2cccc3c[nH]nc23)CC1 328631307 KHFMPOXNKLJGRQ-HXUWFJFHSA-N 378.480 2.756 0 50 GFAA Cc1sc(Br)cc1S(=O)(=O)NC[C@H]1CCc2nccn2C1 328633386 SOXLCJIISQJVQH-SNVBAGLBSA-N 390.328 2.556 0 50 GFAA C[C@H]1CN(C(=O)Cn2cc(NC(=O)NC(C)(C)c3ccccc3)cn2)C[C@@H](C)O1 363311463 XHRAOGOZBCFRMP-IYBDPMFKSA-N 399.495 2.576 0 50 GFAA NC(=O)c1c(NC(=O)c2cc3n(n2)CCO3)sc2c1-c1ccccc1CCC2 365876335 ICXCETYNTDRBCR-UHFFFAOYSA-N 394.456 2.844 0 50 GFAA NC(=O)c1ccc(-c2nc(CN3CCN(c4ccc(F)cn4)CC3)cs2)cc1 367749208 LVKGJVDHSRWRLM-UHFFFAOYSA-N 397.479 2.765 0 50 GFAA CC(C)(CCCO)CNC(=O)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 372529868 GEHCFPPEDYLASI-QGZVFWFLSA-N 390.528 2.643 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)CCCc1nc(-c2cccnc2)no1 426518325 MYWHHWLEZBZJRD-UHFFFAOYSA-N 380.452 2.715 0 50 GFAA COCCN1CCC[C@H](CN(C)C(=O)NC(C)(C)c2ccc(OC)cc2)C1 426527611 AKVXNMPFONKUJU-QGZVFWFLSA-N 377.529 2.930 0 50 GFAA CO[C@H](CNC(=O)N1CCC(CCN2CCCC2=O)CC1)c1cccs1 426548804 PFIMCEMQNORJNW-MRXNPFEDSA-N 379.526 2.870 0 50 GFAA COc1ccc(Cn2cc(C(=O)N3CCC[C@@H](c4ncc[nH]4)C3)cn2)cc1OC 427132127 ZGWQAVUHFTXTOT-MRXNPFEDSA-N 395.463 2.692 0 50 GFAA Cc1nc2cc(O)nn2c(C)c1CNC(=O)Cc1ccc(OC(F)F)c(F)c1 449890432 GZDCSNMTVMONMN-UHFFFAOYSA-N 394.353 2.651 0 50 GFAA CCN(CCc1nc2ccccc2[nH]1)C(=O)NC1CCN(C(=O)C2CC2)CC1 584901105 CMURMMOIVMCVKE-UHFFFAOYSA-N 383.496 2.538 0 50 GFAA CC(C)CCOc1cccc(CCNC(=O)N2CCC[C@](O)(CO)CC2)c1 584901345 YRYXZHPEYGFJCS-OAQYLSRUSA-N 378.513 2.573 0 50 GFAA CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)N2CC[C@@H](O)C(F)(F)C2)cc1 888101932 PPEBQZMCXKJYTD-CQSZACIVSA-N 390.452 2.634 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)N1CCC(CNC(=O)c3ccoc3)CC1)C2 952964219 CDNHNBWAQRHFNH-GOSISDBHSA-N 398.459 2.508 0 50 GFAA O=S(=O)(CCOc1ccccc1)N1CCCN(Cc2cccs2)CC1 952964974 PLNLROPARKVZML-UHFFFAOYSA-N 380.535 2.665 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@H]2CC(=O)N(c3cccc(Cl)c3)C2)CC1 1506421518 HTDAAWMBZRQHQP-SFHVURJKSA-N 398.894 2.735 0 50 GFAA O=C(c1cccnc1N1CCN(c2ncnc3ccccc23)CC1)N1CCCC1 1529141533 PIJGVTYZUXVLGN-UHFFFAOYSA-N 388.475 2.587 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1615735435 MILHXUBEJUZUKO-PXNSSMCTSA-N 390.439 2.880 0 50 GFAA COc1cc(CN2C[C@H]3CNC[C@@]3(CO)C2)ccc1OCc1cccc(C)c1 1772711365 BMXPNSUHIDDAOK-OFNKIYASSA-N 382.504 2.596 0 50 GFAA CCCS(=O)(=O)NC1CC(Nc2nc(C(F)(F)F)nc3ccccc23)C1 1775988459 FYONBECOASLTMW-UHFFFAOYSA-N 388.415 2.921 0 50 GFAA Cc1nn(C)c2c1[C@@H](NC(=O)Cc1cc3c(cc1Cl)OCCO3)CCC2 1857674426 HSSXBIFRLOJVNN-AWEZNQCLSA-N 375.856 2.889 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)[C@H]2CC[C@H](c3ccccc3)N2)CC1 1857713094 XREZHMNULVOVPM-RTBURBONSA-N 392.503 2.790 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@]2(Cc3ccc(Cl)cc3)CCOC2)CC1 1875252317 OYGXSOHTMRSXKV-FQEVSTJZSA-N 376.884 2.582 0 50 GFAA C[C@H](C(=O)Nc1nc2n(c1C(=O)O)CCOC2)c1ccccc1C(F)(F)F 1875300623 KUEJPIBYTPSIKH-VIFPVBQESA-N 383.326 2.873 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3[nH]nc(C(F)(F)F)c3C2)cc1 1875373631 IUIKTTFDGVESDF-UHFFFAOYSA-N 378.354 2.776 0 50 GFAA O=C(Cc1ccc(Cl)c2cccnc12)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875402964 NSQUJEMTVRCHGH-FSPWUOQZSA-N 384.867 2.583 0 50 GFAA CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NC(=O)c2ccc(Cl)c(N3CCCC3)n2)C1 1875404534 LTZFXQWBLBHCSG-ZMSDIMECSA-N 390.915 2.712 0 50 GFAA O=C(c1cccnc1O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100540039 AOFPOLHFWVLRCP-JOCHJYFZSA-N 379.460 2.627 0 50 GFAA O=C(C[C@@H]1CN(C(=O)c2ccccc2)C2(CCC2)CO1)N1CC[C@]2(CCCO2)C1 2325785299 PAWUENTUBNVIPI-AUSIDOKSSA-N 398.503 2.622 0 50 GFAA Cn1nc(CNc2cccc(C(=O)N3CCOCC3)c2)nc1-c1ccccc1 2325807034 VRLNLSLGSDWJNL-UHFFFAOYSA-N 377.448 2.567 0 50 GFAA O=C1NCCN(Cc2cc(-c3ccc4ccccc4c3)on2)C12CCNCC2 2325807922 IUUINVQDUGWQMO-UHFFFAOYSA-N 376.460 2.549 0 50 GFAA Cc1ccc(-n2c(SC[C@H]3OC(=O)C[C@@H]3O)nc3ccccc3c2=O)c(C)c1 2325852825 UXZNGERLRLGGNK-ZWKOTPCHSA-N 396.468 2.771 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(c4ccncn4)C3)[C@@H]3CCCC(=O)N23)c1 2356161264 NBNXZPQUCUYQEU-ZFMNYDKASA-N 392.503 2.934 0 50 GFAA Cc1ccc2c(c1)c1c(n2C[C@H](O)Cn2c(C)cc(C)nc2=O)C(=O)CCC1 795442 XYQKRXJUPAPPOL-MRXNPFEDSA-N 379.460 2.703 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)NCCc3ccccc3)n2C)cc1 912291 ZFJZUNPWKSWFJH-UHFFFAOYSA-N 382.489 2.942 0 50 GFAA Cc1ccc(Nc2nc(N)nc(CSc3nnnn3-c3ccccc3)n2)cc1 1257991 KDHSAWQWGCUYHU-UHFFFAOYSA-N 391.464 2.774 0 50 GFAA O=C1c2sc3nnc(-c4cccs4)c(=O)n3c2C(=O)N1c1ccccc1 2310869 MYWHUVBRTKIWHE-UHFFFAOYSA-N 380.410 2.680 0 50 GFAA O=S1(=O)N=C(Nc2ccc(I)cc2)c2ccccc21 2848176 WRASCMKEOPUYNZ-UHFFFAOYSA-N 384.198 2.852 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C(=O)Cc2nc(-c3ccccc3)oc2C)C[C@H]1O 2356147569 CJPVXWSOOGGCKW-UTKZUKDTSA-N 386.448 2.657 0 50 GFAA Cc1nc2nc(C)c(NC(=O)c3ccccc3OC(F)(F)C(F)F)c(=O)n2[nH]1 2356164005 AIEDGBZVZSEQSE-UHFFFAOYSA-N 399.304 2.523 0 50 GFAA O=C(NCCc1cn[nH]c1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1 462134784 FEAAMMCZCNEKPB-IBGZPJMESA-N 377.448 2.501 0 50 GFAA Cc1cc(C)n(S(=O)(=O)c2ccc(I)cc2C)n1 4749129 YDJMEELBLRAYPP-UHFFFAOYSA-N 376.219 2.650 0 50 GFAA COc1ccc(C)cc1N1C[C@H](C(=O)Nc2ccc3c(c2)OCCO3)CC1=O 7598933 WZUZNNBMJDMSFX-CQSZACIVSA-N 382.416 2.766 0 50 GFAA COCCc1nsc(NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)n1 225739516 BZMOUNZFQHNIAW-ZDUSSCGKSA-N 390.465 2.867 0 50 GFAA CC(C)CN1CCNC(=O)[C@H]1CC(=O)NCC1(c2ccccc2)CCCCC1 23128927 FXKGRXKDYUZEEW-HXUWFJFHSA-N 385.552 2.851 0 50 GFAA CSCC(=O)N1CCC[C@H]1c1ccc(C(=O)NCCCn2cccn2)s1 20917021 CVGGDMXZBGZWCQ-AWEZNQCLSA-N 392.550 2.791 0 50 GFAA CN(C[C@@]1(c2ccccc2)CC1(C)C)C(=O)c1cc(CN2CCOCC2)on1 67446856 DXTTWLYCANTOIX-JOCHJYFZSA-N 383.492 2.947 0 50 GFAA CC(C)CCN1CCC[C@@H]1c1ccc(C(=O)N2CCS(=O)(=O)CC2)s1 23581652 CIMVBRLBGAAONU-OAHLLOKOSA-N 384.567 2.802 0 50 GFAA O=S(=O)(CCN1CC=C(c2cnn(-c3ccccn3)c2)CC1)c1ccccc1 65406732 FYOKHQFQBMJJBB-UHFFFAOYSA-N 394.500 2.830 0 50 GFAA CC[C@@]1(C)CN(C(=O)NCc2ccc(C)nc2-n2cc(Cl)cn2)CCO1 252550193 SFLNHZUHDMSVFE-SFHVURJKSA-N 377.876 2.940 0 50 GFAA C[C@@H](c1ccccc1)N1CC[C@@H](NS(=O)(=O)CCn2cnc3ccccc32)C1 229623903 WDILYIXRQIWVAJ-PKOBYXMFSA-N 398.532 2.791 0 50 GFAA O=C(Nc1ccc(F)cc1)[C@@H]1CN(Cc2c(Cl)cncc2Cl)CCN1 72158355 FPZUWOCCTCSVDV-INIZCTEOSA-N 383.254 2.940 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)C[C@@H]1C(=O)NCCN1CC(C)(C)C 72172980 RFWCRGKSSDPSNG-GOSISDBHSA-N 388.487 2.502 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(-c2ncn[nH]2)c1 125099317 WURVUENGGWJBGW-SFHVURJKSA-N 375.476 2.766 0 50 GFAA Cc1cc(C(=O)N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)cs1 71763624 JHQZNRMNXKPLPI-OAHLLOKOSA-N 375.538 2.652 0 50 GFAA CN(C(=O)c1ccc2[nH]nnc2c1)[C@H]1CCCN(C2Cc3ccccc3C2)C1 72166074 QXIPLFJGWQHGBG-SFHVURJKSA-N 375.476 2.662 0 50 GFAA CCn1ncc(NC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1C(F)(F)F 439888330 NJZTWHLWOFEIAM-GFCCVEGCSA-N 389.422 2.639 0 50 GFAA O=C(CN1CCOc2ccc(Cl)cc21)Nc1ccn(Cc2ccncc2)n1 174428166 XZZVRSJYTVRMMX-UHFFFAOYSA-N 383.839 2.817 0 50 GFAA CC[C@@H](C)NC(=O)Cn1c(Cc2ccccc2)nn(-c2ccccc2OC)c1=O 77339872 XQDDPESNQWSCCU-MRXNPFEDSA-N 394.475 2.548 0 50 GFAA O=C([C@@H]1CCCN1Cc1ccccc1)N1CCn2c(nnc2-c2ccccc2)C1 175557367 XDFYNOOYKNJZJZ-FQEVSTJZSA-N 387.487 2.952 0 50 GFAA C[S@](=O)CCNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1 239352454 ACFXYGRIOXBXJW-UCDGGBORSA-N 396.940 2.608 0 50 GFAA C[C@H]1CN(c2ccccc2F)CCN1C(=O)c1cccc(NS(C)(=O)=O)c1 241911248 UAXCLHWLGMEYKS-AWEZNQCLSA-N 391.468 2.548 0 50 GFAA CN1CCN(CC2(CNC(=O)c3ccc(-c4ccccc4O)cc3)CC2)CC1 426386902 MZOAOYMMYGFMEK-UHFFFAOYSA-N 379.504 2.817 0 50 GFAA COc1ccc2c(c1)CCN2C(=O)CCc1c(C)nc(-c2cccnc2)[nH]c1=O 194610481 HKALLOJRIWQGKX-UHFFFAOYSA-N 390.443 2.671 0 50 GFAA O=C1CCC2(CCN(C(=O)N[C@@H](c3ccncc3)c3ccc(F)cc3)CC2)N1 426387609 GRPFJJPMYYVUPK-LJQANCHMSA-N 382.439 2.764 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCCc3ncc[nH]3)csc2C1 426488285 PYOIFTROSKVYCP-UHFFFAOYSA-N 399.520 2.997 0 50 GFAA Cn1ccnc1CCN1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91434349 WTRIFSIUSSOXJS-UHFFFAOYSA-N 380.536 2.910 0 50 GFAA CCN(C(=O)c1ccoc1COc1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1 91846000 VHCYSQZVTAWWLL-HNNXBMFYSA-N 377.462 2.816 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)c3ccc4c(c3)ncn4CCO)C2)cc1 95372148 CZJJYQFTLYOKEL-GOSISDBHSA-N 393.443 2.747 0 50 GFAA Cc1nc(-c2ncc(C(=O)NCCn3ccc4ccccc43)c(O)n2)cs1 91914856 VOTKACYPMQSBBJ-UHFFFAOYSA-N 379.445 2.999 0 50 GFAA O=C(O)[C@H](c1ccsc1)N1CCN(c2nnc(C(F)(F)F)s2)CC1 95383935 LIPICXBVOLDXHZ-VIFPVBQESA-N 378.401 2.566 0 50 GFAA O=C(NCc1cc2n(n1)CCCN(C1CCCCC1)C2)[C@H](O)C1CCCCC1 92081477 IXQIXMRHOMGKFS-OAQYLSRUSA-N 388.556 2.979 0 50 GFAA CN(C)[C@@H](C(=O)NC1CCN(Cc2cccc(O)c2)CC1)c1cccc(F)c1 95383471 PWZXAKNQNZNSOL-OAQYLSRUSA-N 385.483 2.915 0 50 GFAA COCc1nnc(NC(=O)[C@@H]2N3C(=O)c4ccccc4[C@H]3SC2(C)C)s1 253414579 XWPFPLCLEDAUJE-SWLSCSKDSA-N 390.490 2.672 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCCN(C(=O)[C@@H]2CCCO2)CC1 368911073 OJTIEIKOFXPOJN-SFHVURJKSA-N 399.516 2.587 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)[C@H]2CCCN2c2nc(C)c3ccccc3n2)C1 299784765 HLUUTIVYPMHBQQ-VQIMIIECSA-N 396.491 2.709 0 50 GFAA COc1ccccc1-c1cc(CNC(=O)N2CCC(c3ncon3)CC2)on1 584894853 LKFQGYVEUXUAIZ-UHFFFAOYSA-N 383.408 2.822 0 50 GFAA C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@H](CCC(=O)O)c2ccccc2)C1=O 268889910 IXSNPVPWPQDZIH-DOTOQJQBSA-N 396.443 2.913 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCC2(c3ccccc3Cl)CCOCC2)CC1 1875264790 ZBKVTSJHMZZWKI-UHFFFAOYSA-N 390.911 2.929 0 50 GFAA O=C(c1cccc2ncnc(O)c12)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 1875280447 KIVDKQTVFIIDIB-INIZCTEOSA-N 394.475 2.590 0 50 GFAA O=C(O[C@H]1CCN([C@H]2CCCc3ccccc32)C1=O)c1nc[nH]c2nccc1-2 1875267226 VZOXWKRAHHUJOZ-IRXDYDNUSA-N 376.416 2.745 0 50 GFAA Cc1cccc(-c2c(C)[nH][nH]c2=NC(=O)c2cccc(N3CCN(C)CC3)n2)c1 1875296995 YHHFTMUFZPQWCI-UHFFFAOYSA-N 390.491 2.515 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)c1ccc(-c2ncon2)cc1 1875371112 PHCQZAOEINIMAG-IBGZPJMESA-N 388.427 2.606 0 50 GFAA CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cccc2c1nc(O)n2C 1875321618 OLZWYWLZHZEQRR-UHFFFAOYSA-N 380.448 2.643 0 50 GFAA Cc1cccc(N2CCN(S(=O)(=O)c3onc(C4CC4)c3Cl)[C@@H](C)C2)n1 1875392071 ZZQWSDVJZDWDNL-LBPRGKRZSA-N 396.900 2.808 0 50 GFAA Cc1noc(COCC(=O)N2CCC(c3nccc(-c4ccccc4)n3)CC2)n1 952894295 YXORTUMBDSBUIO-UHFFFAOYSA-N 393.447 2.758 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@@H]1COCCN1C(=O)C(=O)C(C)(C)C 952887472 PPTJWXBQHJEHBQ-LBPRGKRZSA-N 375.391 2.577 0 50 GFAA COc1cc(NC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)nn1C 170599491 RCDJNGDETHKMRR-CYBMUJFWSA-N 397.262 2.979 0 50 GFAA CCn1cc(C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)c(C(F)(F)F)n1 280619715 RKIILCVRRGIGKS-LBPRGKRZSA-N 387.383 2.570 0 50 GFAA COc1cc(C(=O)N2CCc3c(cccc3C(C)C)C2)sc1S(N)(=O)=O 190669496 IGXKMACDPJUDBP-UHFFFAOYSA-N 394.518 2.726 0 50 GFAA CCCc1cnc(N2CCC[C@H](CNC(=O)Cn3nc(C)c(CC)c3C)C2)nc1 1506427474 WEVGEURNHZZXGM-LJQANCHMSA-N 398.555 2.838 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)COc3ccc4ccccc4c3)C[C@@H]12 1704303075 WNSMYFPGWDUGGY-KNQAVFIVSA-N 382.460 2.616 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cc[nH]n4)C[C@@H]2CN(C2CCOCC2)C3)cc1 1772811802 ZPKYABWOCNYDPH-NFBKMPQASA-N 380.536 2.955 0 50 GFAA O=S(=O)(CC1CC1)c1ncc(CN2CCCCCC2)n1C[C@@H]1CCCO1 11818897 PRUIBQXUQHSCTC-SFHVURJKSA-N 381.542 2.622 0 50 GFAA COc1ccc(-c2cccc3c2O[C@H](CNC(=O)Cc2cccs2)C3)nn1 12149246 DLLIYXCGMZBDPN-AWEZNQCLSA-N 381.457 2.876 0 50 GFAA O=C1CCC(CCC(=O)N2CCC[C@@H](C(=O)c3ccc(Cl)cc3)C2)=NN1 12204048 IXRYOIUUTNEDEA-CQSZACIVSA-N 375.856 2.808 0 50 GFAA COC(=O)c1cccc(CN2CCN(C(=O)CCc3ccccc3)CCC2=O)c1 12245936 BSOPFKZTZNDKDG-UHFFFAOYSA-N 394.471 2.667 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(Cc3nccn3C)CC2)c1 12434102 OEBCOCIXPCJQAM-UHFFFAOYSA-N 398.507 2.708 0 50 GFAA O=C(NCc1cccnc1N1CCN(c2ccccn2)CC1)C1CCCCC1 12718371 ZOEYYWLQAGIQIB-UHFFFAOYSA-N 379.508 3.000 0 50 GFAA O=C(N=c1ccn(Cc2cccc3cccnc23)[nH]1)Nc1ncnc2ncccc12 1857528150 IEEPLNCIDKQDLU-UHFFFAOYSA-N 396.414 2.884 0 50 GFAA Cc1nc[nH]c1CC(=O)N[C@@H]1CCC[C@@H](NC(=O)c2ccc3ccccc3n2)C1 1857693050 GCFHHSXYYVJAGU-IAGOWNOFSA-N 391.475 2.666 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)c2ccc(F)cc2)cn1 1857730831 ZCPRAKLDTXXJJO-PMACEKPBSA-N 386.471 2.627 0 50 GFAA CO[C@@H]1CC[C@H](c2nc(COc3cccc(F)c3)nn2-c2ccccn2)C[C@H]1N 1857736972 SLBQCQMREBJRPU-BMGDILEWSA-N 397.454 2.990 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CCN(C4CC4)C[C@H]3C)c2)o1 2100482333 RHDRMOUQTQIROF-CQSZACIVSA-N 375.494 2.816 0 50 GFAA Cc1nc2c([nH]1)C[C@@H](NC(=O)Cc1cn3cc(Cl)cc(Cl)c3n1)CC2 2325781362 IIULOAQKLLFKDE-NSHDSACASA-N 378.263 2.889 0 50 GFAA CC1(C)C[C@H](NC(=O)Cn2ncc3ccccc3c2=O)CN1Cc1ccccc1 2325786666 OEMRFWSIQIOHEK-IBGZPJMESA-N 390.487 2.566 0 50 GFAA CN(c1ccnc(NCc2nc3cc(F)c(F)cc3[nH]2)n1)[C@@H]1CCCNCC1 2325806038 NTVXYQVZUGOJIC-GFCCVEGCSA-N 387.438 2.822 0 50 GFAA OCc1nc2ccccc2n1C[C@H](O)COc1ccc(Br)cc1 888818 OHUKUWCSWOJBPX-ZDUSSCGKSA-N 377.238 2.731 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)nc1C 4731573 LARWMAJWJVLZQJ-ZDUSSCGKSA-N 387.461 2.928 0 50 GFAA O=C1c2ccccc2C(=O)N1c1cccc(S(=O)(=O)NCc2ccccc2)c1 5683181 CNOZMJKXBGTANW-UHFFFAOYSA-N 392.436 2.966 0 50 GFAA CCN(CC)C(=O)CSc1nc2ccc(Br)cc2c(=O)n1C 6700643 KGRYIWNDNGPYHT-UHFFFAOYSA-N 384.299 2.657 0 50 GFAA CC[C@@H]1C(=O)NCCN1C(=O)c1ccc2nc(Cc3ccc(OC)cc3)oc2c1 11661930 UISSLGYICQFDAS-GOSISDBHSA-N 393.443 2.778 0 50 GFAA CC[C@@H](O)CNC(=O)c1sc2ncnc(NCCc3ccccn3)c2c1C 11782528 GSFDKVVFRNEGQC-CQSZACIVSA-N 385.493 2.550 0 50 GFAA COc1cc(CNCc2ccccc2F)ccc1OC[C@@H](O)CN1CCCC1 12029937 LGPJXXJPGDCWLA-IBGZPJMESA-N 388.483 2.960 0 50 GFAA O=C([C@@H]1C[C@H](n2cnnn2)CN1C1C2CC3CC(C2)CC1C3)N1CCCCCC1 12219294 UFWBPKLAKWZRLV-LFEHMJROSA-N 398.555 2.516 0 50 GFAA O=C(CCCn1cncn1)N1CCC[C@@](CO)(Cc2cccc(Cl)c2)C1 12583283 ZSPZPEGAINKTRT-LJQANCHMSA-N 376.888 2.556 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H]3CCCN3C)n1)CCN(C(=O)NC(C)C)C2 19850446 BNHZEBCWQPMXLH-MRXNPFEDSA-N 384.484 2.683 0 50 GFAA Cc1cccn2c(CN3CCc4sccc4C3)c(C(=O)N3CCOCC3)nc12 20996722 UBEGFRUIYBOBBA-UHFFFAOYSA-N 396.516 2.735 0 50 GFAA CC1(C)[C@H](C(N)=O)C(=N)NC(=O)[C@@H]1c1nc(-c2ccc(Cl)cc2)cs1 22478424 SXZYKFGMBRQJHI-NWDGAFQWSA-N 376.869 2.782 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3Cc4ccccc4S3)CC2)cc1 31132883 BOCCDCPINDXHMO-IBGZPJMESA-N 382.485 2.697 0 50 GFAA O=C1NCCN(Cc2ccc(F)cc2Cl)[C@@H]1CC(=O)N1CCCCCC1 55153398 ZMQYUZWHZFHPPV-QGZVFWFLSA-N 381.879 2.572 0 50 GFAA CN(Cc1ccc(C(=O)NCc2ccncc2)cc1)S(=O)(=O)c1ccccc1 65364633 OVTCEJTXBLATKL-UHFFFAOYSA-N 395.484 2.832 0 50 GFAA CN1C(=O)[C@@](CCC(=O)NC2CCNCC2)(Cc2ccccc2)c2ccccc21 71751375 VUEYJENQZBEZQM-DEOSSOPVSA-N 391.515 2.792 0 50 GFAA COc1cccc(NC(=O)Cn2ncc(N3CCCCC3)c(Cl)c2=O)c1 72116102 YPBBWKNNQJWSGN-UHFFFAOYSA-N 376.844 2.534 0 50 GFAA CC(C)N1C[C@@]2(CCCN(CC(=O)NCc3ccccc3F)C2)CCC1=O 77380298 NRVTWLCXQNCECD-NRFANRHFSA-N 375.488 2.555 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)[C@@H]3CC34CCNCC4)CC2)OC1=O 77406049 FTTRCVZOQKEKLZ-KRWDZBQOSA-N 377.529 2.626 0 50 GFAA Cc1ccc(CN2CC[C@@]3(O)CCN(C(=O)C4CCC4)C[C@H]3C2)c(F)c1F 91819487 NRMQGAAHXICUAD-DYESRHJHSA-N 378.463 2.859 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2ccco2)C1)c1cc(=O)c2cccc(F)c2[nH]1 97117297 CYUAGSVEWMTXTO-AWEZNQCLSA-N 383.423 2.902 0 50 GFAA COC(=O)c1c(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2CC[C@H]3O2)sc2c1CCCCCC2 101709545 JDLSIIZPYMLWOH-CZPYZCIJSA-N 389.473 2.861 0 50 GFAA COc1cccc(-c2cc(C(=O)N[C@H]3CCN(C(=O)C4CCCC4)C3)[nH]n2)c1 127188285 KHTYAKMSLOWQBO-INIZCTEOSA-N 382.464 2.606 0 50 GFAA Cc1ccc(-n2nccc2NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)nn1 155702265 HSEZNNDUBQVLNM-QGZVFWFLSA-N 379.420 2.781 0 50 GFAA CCOc1ccc(OCC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)cc1 170601427 MENYCGLKMOSKRU-HSZRJFAPSA-N 398.503 2.560 0 50 GFAA CCOc1ccc(-n2c(SCc3nnn(C)n3)nc3ccccc3c2=O)cc1 170617555 LAENUXZKEPAQJZ-UHFFFAOYSA-N 394.460 2.600 0 50 GFAA CN(C)Cc1ccc(N2CCN(c3cncc(OCC4CCCC4)n3)CC2)nc1 185376776 BHMAKDCITPUAJX-UHFFFAOYSA-N 396.539 2.829 0 50 GFAA O=C(c1cccc(NCc2cc(F)cc3cccnc23)n1)N1CCC[C@H]1CO 190197156 ZEZSKWWOTDNIOU-KRWDZBQOSA-N 380.423 2.978 0 50 GFAA CCCc1c(N[C@H]2CCN(c3cnn(C)c3)C2=O)cnn1-c1ccc(F)cc1 192766972 MPCYRHGFVBPJLW-KRWDZBQOSA-N 382.443 2.915 0 50 GFAA O=C(O)C1CCC(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)CC1 194442469 RYXLULNVCANATG-QKFMDRJYSA-N 382.819 2.592 0 50 GFAA COc1cccc([C@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@@H]2C(=O)O)c1OC 220259487 HTPPWOYFGGFPHN-SJORKVTESA-N 387.407 2.712 0 50 GFAA C[C@H]1COCCN1CC(=O)N(C)[C@@]1(c2ccccc2Cl)CCCCC1=O 229380895 DFBKVXLOOSRNEX-MGPUTAFESA-N 378.900 2.858 0 50 GFAA CCS[C@H](C)c1noc(CN2C[C@@H](C(=O)N(C)C)Oc3ccccc32)n1 229892914 ROUITSMQDHAZPD-DOMZBBRYSA-N 376.482 2.740 0 50 GFAA COC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC[C@@H]2c2ccnn2C)c1 241466008 NTUZDIKCZVSPBD-OAHLLOKOSA-N 397.884 2.776 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cc(N3CCNC3=O)ccc2Cl)Cc2ccccc21 262173754 LRVZBZKLMRFONY-MRXNPFEDSA-N 399.834 2.694 0 50 GFAA Cc1nc(C(=O)NC2(c3ccc(F)cc3F)CCOCC2)ccc1C(=O)O 263359990 TWYRCJGUJUNWPW-UHFFFAOYSA-N 376.359 2.802 0 50 GFAA Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)Nc1cc2n(n1)CCCC2 287071718 HKSJYAUQJNAVMT-KRWDZBQOSA-N 383.452 2.781 0 50 GFAA O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@]2(CN=C(O)C2)C1 329886922 WUKKSOFYBMADRS-GTJYNNIXSA-N 399.535 2.773 0 50 GFAA CC(=O)c1cccc(-c2cccc(C(=O)NC[C@H]3CCCN(CCO)C3)c2)c1 426497120 GCLKKCWXFLFWMH-GOSISDBHSA-N 380.488 2.990 0 50 GFAA COc1ccc2cc(NC(=O)[C@@H]3OCC(=O)N(C)[C@@H]3c3ccccc3)ccc2n1 435736896 CICCPNCWDGGDRF-NHCUHLMSSA-N 391.427 2.780 0 50 GFAA CN1CCC2(CCN(C(=O)N[C@@H]3CCN(c4ccc(Cl)cc4)C3)CC2)C1=O 445091341 LEKXBBAMQZVGKL-MRXNPFEDSA-N 390.915 2.573 0 50 GFAA O=C(Cc1cc2ccccc2c(O)n1)N1CCN(CCc2cccs2)CC1 448785142 VSGIGUWQFXINJG-UHFFFAOYSA-N 381.501 2.931 0 50 GFAA CCC(CC)C(=O)N1CCC[C@H](n2cc(CNC(=O)OC(C)(C)C)nn2)C1 837244200 QUWGHVAQPVHAKO-INIZCTEOSA-N 379.505 2.903 0 50 GFAA Cc1ccc2[nH]cc(CCNC(=O)C[C@H]3CS(=O)(=O)c4ccccc4O3)c2c1 1336758701 CANWZOOUNPFJRF-INIZCTEOSA-N 398.484 2.760 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC(c2nnc3ccccn23)CC1 1506403469 PFVVRUJQCYFBJX-UHFFFAOYSA-N 378.480 2.670 0 50 GFAA COc1ccc(-c2cc(CNC(=O)c3cc(CC(C)C)nc(O)n3)no2)cc1 1506415387 BJCALNNNKKGTAS-UHFFFAOYSA-N 382.420 2.974 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2cnccn2)C3)cc1Cl 1565509498 QJSVRWOOOXMLNV-ZBFHGGJFSA-N 384.867 2.815 0 50 GFAA CCCNC(=O)N1C[C@@H]2CN(Cc3ncc[nH]3)C[C@]2(CCc2ccccc2)C1 1772810640 NONSMIYTOLYTCV-SIKLNZKXSA-N 381.524 2.896 0 50 GFAA Cc1cc(CC(=O)N2CCC([C@@H]3CCCN(c4ncccn4)CC3)CC2)n(C)n1 1775993059 XHZGPDQQHQEMTQ-GOSISDBHSA-N 396.539 2.606 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCc3nccn3CC)sc12 1857689998 RMGIXTRHVFAUDD-UHFFFAOYSA-N 388.537 2.778 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCCC23CCN(Cc2cccnc2N)CC3)cc(O)n1 1857700350 ACBCNOAPMUSXMZ-SFHVURJKSA-N 395.507 2.638 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)Cn2cc(C(=O)C3CC3)c3ccccc32)CC[C@@H]1O 1857722172 DQLCVYGOJDSMNK-REWPJTCUSA-N 398.503 2.606 0 50 GFAA Cc1cnccc1N1C[C@@H]2[C@H](CNC(=O)c3ccc(F)cc3)[C@H]3CC[C@]2(C1)O3 1857725216 NNIFXOYDGKPGEB-XHYAQGIWSA-N 381.451 2.943 0 50 GFAA O=C(COc1ccccc1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857734299 HXUYXAZUYKATOA-JOCHJYFZSA-N 379.460 2.945 0 50 GFAA Cc1cccnc1C(=O)N1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1875248344 LRWOGUDCRDRHKB-PGRDOPGGSA-N 382.460 2.691 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1occc1COc1ccccc1 1875403484 VAGXVSPGZKYTQD-KFKAGJAMSA-N 381.432 2.625 0 50 GFAA CCCN1CCC[C@@]2(CCCN(C(=O)c3nnc4n3CCCCC4)[C@H]2C)C1=O 2100542909 JTVBPIMPNRJLAQ-KKSFZXQISA-N 387.528 2.648 0 50 GFAA O=c1nc(O)ccn1[C@H]1CCCN(c2nc3ccc(Cl)cc3n3cncc23)C1 2325792908 UJJFWBAQERPCTA-ZDUSSCGKSA-N 396.838 2.640 0 50 GFAA CC(=O)Nc1ccc(C(=O)N(C)[C@H]2C[C@H]3CC(=O)N(C)C[C@H]3C2)c(Cl)c1 2356170166 YEPWGIACILVHPL-GUTXKFCHSA-N 377.872 2.627 0 50 GFAA CCN1C=C(C(=O)OC)C(c2cccc(Br)c2)C(C(=O)OC)=C1 816039 OLKRADZIGRLXNA-UHFFFAOYSA-N 380.238 2.982 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)Cc2ccccc2)cc1 854547 WUBVEQDFVGFESY-UHFFFAOYSA-N 388.489 2.509 0 50 GFAA O=C(NCCc1ccccc1)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 1156496 ZANMADQIRCRQQI-UHFFFAOYSA-N 390.480 2.585 0 50 GFAA CC(C)CC(=O)N1CCC(O)(CS(=O)(=O)Cc2ccccc2Cl)CC1 1386603 HULVKBYGIHERNK-UHFFFAOYSA-N 387.929 2.654 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2nnc(N)s2)sc2c1CCCC2 2695025 IWZSTEWXADCZQC-UHFFFAOYSA-N 398.535 2.968 0 50 GFAA CN(CC1CCN(CCc2cccc(F)c2)CC1)C(=O)CCc1cnn(C)c1 12028939 HEZGEUUVWUWDOC-UHFFFAOYSA-N 386.515 2.905 0 50 GFAA Cc1cccnc1CN(C)C[C@]1(O)CCCN(Cc2ccc(F)c(F)c2)C1=O 12306429 YXNGZDIXJGJHGI-OAQYLSRUSA-N 389.446 2.654 0 50 GFAA CN(Cc1ccon1)c1ccc(C(=O)NCC[C@@H]2COc3ccccc3O2)cn1 19794398 IVKCUFDHPAXYRD-QGZVFWFLSA-N 394.431 2.666 0 50 GFAA O=C(C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)N1CCCCC1 20325197 SKLDWAUSKIFYKB-UHFFFAOYSA-N 391.515 2.933 0 50 GFAA CC(=O)N1CCCN(c2ccc(-c3nc(-c4ccccc4F)no3)cn2)CC1 20598820 DKLDEMCBLSGDIN-UHFFFAOYSA-N 381.411 2.996 0 50 GFAA COC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2c1c(=O)[nH]c(=S)n2C1CC1 20603294 NGNUZOBSIUYYAR-UHFFFAOYSA-N 397.412 2.971 0 50 GFAA CCN(Cc1noc(CC(C)C)n1)C(=O)COCc1nc2ccc(F)cc2[nH]1 55183035 DIOQGWWRVBIENA-UHFFFAOYSA-N 389.431 2.849 0 50 GFAA CCCS(=O)(=O)N1CCN(c2cc(C)nc(Nc3ccc(C)cc3)n2)CC1 64800593 CSBRSIPSQWVOGI-UHFFFAOYSA-N 389.525 2.699 0 50 GFAA COc1cc2c(cc1NS(C)(=O)=O)[C@H](COCc1ccccc1)CC(=O)N2 65451362 QZWFYKKMOFKGOU-AWEZNQCLSA-N 390.461 2.709 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNC3CCCCCC3)C2=O)c1OC 67725749 YILDLYNMXHTJBI-QFIPXVFZSA-N 390.524 2.870 0 50 GFAA Cc1nc2ncccn2c1C(=O)N(C)[C@H]1CCCN(C2Cc3ccccc3C2)C1 67742650 VTDQIVSYQQWAFA-IBGZPJMESA-N 389.503 2.742 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)c2ccc3ccn(C)c3c2)cc1 95353564 HQYHNFSEHMNOPS-UHFFFAOYSA-N 385.489 2.585 0 50 GFAA O=C(NCc1noc(Cc2ccccc2)n1)[C@H](c1cccnc1)N1CCCC1 95363022 VSFQRHQJCORBCB-FQEVSTJZSA-N 377.448 2.509 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3cccc(O)c3)C2)CN1CCc1ccccn1 95503089 YMEZNTPSRJUBMG-HSZRJFAPSA-N 393.487 2.875 0 50 GFAA COc1ccc(NC(=O)CC[C@H]2CCCN(S(=O)(=O)C3CC3)C2)c(C)c1 95510159 NTJHLWRJRJXMKQ-OAHLLOKOSA-N 380.510 2.927 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(C(=O)c2cccc(F)c2)CC1 96150861 UBUAWPZLRJEQMY-UHFFFAOYSA-N 382.443 2.702 0 50 GFAA CC(C)C[C@@H](CNC(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1CCOCC1 132237676 UAIMQLSFXVOVLC-MOPGFXCFSA-N 381.561 2.914 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4ccccc4F)nnc3c2)n1 169776209 SLAYSAHKPRYTFA-UHFFFAOYSA-N 380.383 2.801 0 50 GFAA C[C@@H](C(=O)NC[C@](C)(O)C1CCCC1)n1c(S)nnc1-c1cccs1 170645158 GIGWDTAJFXDCRU-GTNSWQLSSA-N 380.539 2.914 0 50 GFAA CS(=O)(=O)C1CCC(NC(=O)N2CC=C(c3ccc(F)cc3)CC2)CC1 175484270 ZEGVUCSAKVZLID-UHFFFAOYSA-N 380.485 2.980 0 50 GFAA O=C(c1cc2ccccc2o1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 180302368 UHIRSOIXDPNEOB-MRXNPFEDSA-N 376.478 2.899 0 50 GFAA Cc1ccc2[nH]c([C@@H]3CCCN(S(=O)(=O)c4c(C)nn(C)c4C)C3)nc2c1 182496785 LOODGXVKSFKUPF-OAHLLOKOSA-N 387.509 2.790 0 50 GFAA O=C(Cn1c(=O)[nH]c2ccccc21)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 184249881 JKBSYQXGYUDKSX-QGZVFWFLSA-N 389.814 2.722 0 50 GFAA Cc1n[nH]nc1C(=O)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F 189176450 YKDOJQWKWPQMOU-HNNXBMFYSA-N 381.402 2.640 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)N2CCCN(c3ccccc3)CC2)CC1=O 193524959 AENJVQMHMVNTDW-SFHVURJKSA-N 393.487 2.787 0 50 GFAA C[C@@H](CNC(=O)c1cccc(CN(C)Cc2ccccc2)c1)c1nncn1C 194249560 CHEJGRFIWLXCNH-KRWDZBQOSA-N 377.492 2.981 0 50 GFAA C[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)C(=O)Nc1cccc(N2CCCC2)c1 195356168 KOPTVWOSZKYJAR-QRWLVFNGSA-N 379.460 2.734 0 50 GFAA O=C(Nc1ccccc1)Nc1ccc(C(=O)N2CC(=O)N(CC3CC3)C2)cc1 225724303 XQHAUFQBOUSHLD-UHFFFAOYSA-N 378.432 2.983 0 50 GFAA CCc1cccc(OC[C@@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)c1 225835701 LJJFQKVVYXDNOJ-HTAPYJJXSA-N 381.428 2.809 0 50 GFAA O=c1c2ccccc2ncn1C[C@H]1CC[C@H](C(=O)NCCc2ccccn2)CC1 252517175 BIZRJVAKTBUNHJ-IYARVYRRSA-N 390.487 2.957 0 50 GFAA CC1(c2ccc(Cl)cc2)CCN(C(=O)NCc2cc(C(N)=O)no2)CC1 281041561 XDSQXXLGQXBQST-UHFFFAOYSA-N 376.844 2.690 0 50 GFAA Cc1ccccc1C1CC(N(C(=O)C2CCN(S(C)(=O)=O)CC2)C2CC2)C1 329734105 RDVNRFDDWWCGFG-UHFFFAOYSA-N 390.549 2.904 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCc4c(c(CO)nn4C)C3)cc2)c(C)n1 426574719 LDWCNWHOTDCBQG-UHFFFAOYSA-N 376.460 2.790 0 50 GFAA C[C@@H]1CN(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)CC[S@](=O)C1 458368144 QODLDHXCCBYVTO-ASHKIFAZSA-N 391.468 2.923 0 50 GFAA CC(C)n1cnnc1CN(C)C(=O)NCCc1csc(-c2cccnc2)n1 534583085 IOVBZNQTQLTXDX-UHFFFAOYSA-N 385.497 2.762 0 50 GFAA COc1cc2c(cc1CNC(=O)c1cccc(-c3ccc(=O)n(C)n3)c1)CCC2 534673697 WQIRWPWMHANTNL-UHFFFAOYSA-N 389.455 2.875 0 50 GFAA CCN(CCN1CCCCCC1)C(=O)NC[C@@H]1CC(=O)N(c2ccccc2)C1 584899057 NLOYLXBPJGGXIG-IBGZPJMESA-N 386.540 2.947 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1-c1cccc(C(=O)N[C@H](C)Cn2cncn2)c1 584899947 XWDSSHPAMOODTI-SNVBAGLBSA-N 378.358 2.814 0 50 GFAA CCOc1ccccc1-c1cc(-c2c(C)nn(C)c2C)nc(CC(=O)NC)n1 823399326 DAZKVFVLKHDNFJ-UHFFFAOYSA-N 379.464 2.848 0 50 GFAA CC(C)(C)c1nnc2n1CCN(C(=O)[C@H](O)c1cccc(C(F)(F)F)c1)C2 856364969 FSEYXNMGDJWKEJ-CQSZACIVSA-N 382.386 2.670 0 50 GFAA Cn1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C3)n2)n1 864097586 XJRXCDNFBJQPTB-OAHLLOKOSA-N 387.362 2.911 0 50 GFAA O=C(Cc1noc([C@@H]2CCc3nnn(C4CCCC4)c3C2)n1)N1CCCCC1 952892773 CXGMQEKLOOBWTH-CQSZACIVSA-N 384.484 2.604 0 50 GFAA CN(CCN(C)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F)C1CCCC1 1506418449 IDJBJAPNOVWBIM-UHFFFAOYSA-N 392.880 2.672 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2ccnc(OC)c2)cc1 1565526502 ALBMETOMZJPZOW-MJGOQNOKSA-N 381.476 2.835 0 50 GFAA CN1CCC[C@]2(CO)CCN(c3nc(-c4ccccc4)ccc3C(=O)O)C[C@@H]12 1704302699 ANVFVAGLXPEBEL-DENIHFKCSA-N 381.476 2.730 0 50 GFAA COc1ccccc1-c1noc(CCCC(=O)N2CCC(C3(O)CC3)CC2)n1 1772811310 VRWQNYZPDDQWGY-UHFFFAOYSA-N 385.464 2.831 0 50 GFAA CN(CCc1ccccn1)C(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857667537 CVXCJPWKRIPOAC-MRXNPFEDSA-N 379.464 2.925 0 50 GFAA COc1cc(-c2nccn2CC[C@@H]2CCCOC2)cc(Cl)c1OCC(N)=O 1857702070 YPKNRPIQGBDLDZ-ZDUSSCGKSA-N 393.871 2.893 0 50 GFAA C=CC(=O)NCCC[C@H]1[C@@H](C)CCCN1C(=O)Cc1ccc2c(cnn2C)c1 1875386271 MCIXONNVEBNHKD-LPHOPBHVSA-N 382.508 2.825 0 50 GFAA O=C(N[C@H]1C[C@@H](C(=O)NCCCOc2ccncc2)C1)OCc1ccccc1 2325755209 HAUCOKZLEQJMCG-HDICACEKSA-N 383.448 2.672 0 50 GFAA O=C(N=c1ccn(-c2ccccc2Cl)[nH]1)NC[C@H]1NCCc2ccccc21 2325857277 VVUMJANSZYHYFD-QGZVFWFLSA-N 381.867 2.956 0 50 GFAA C[C@H]1C(=O)N(CCc2ccccc2)Cc2nnc(CCc3ccccc3O)n21 2356161480 XAJDDRNOPHLTQV-INIZCTEOSA-N 376.460 2.915 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC4(CC3)CNC(=O)C4)ncnc21 2356166063 NGAQBSOEZWNNSY-UHFFFAOYSA-N 384.528 2.931 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)c1ccc2nnc([C@@H](O)C(C)C)n2c1 2356166138 PIKXNIJTZPMYEG-KRWDZBQOSA-N 398.467 2.732 0 50 GFAA Cc1nc(CCC(=O)N2CCc3nc(Cc4ccccc4)nn3CC2)cs1 2356168424 CVLYLOPWQYXUHN-UHFFFAOYSA-N 381.505 2.651 0 50 GFAA CCN(CC)C(=S)NC(=O)c1ccc(C)c(I)c1 1128858 OPLVQRGMNDWEDF-UHFFFAOYSA-N 376.263 2.956 0 50 GFAA CCN(CC)C(=O)Nc1ccc(OC[C@@H](O)CNC(C)(C)C)c(C(C)=O)c1 2001884 JOATXPAWOHTVSZ-INIZCTEOSA-N 379.501 2.891 0 50 GFAA biogenic,world Cc1ccc(NC(=O)CSc2nnnn2-c2cccc(C(=O)O)c2)cc1C 2848433 BCHAEGIRGHBJRT-UHFFFAOYSA-N 383.433 2.708 0 50 GFAA COc1ccc2oc(=O)c(C(=O)NCCc3ccc(OC)c(OC)c3)cc2c1 2883074 PACJODMVRPKESR-UHFFFAOYSA-N 383.400 2.791 0 50 GFAA biogenic C[C@H]1CCCN(C(=S)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)C1 6368676 NECVLXJLTKVCDJ-ZDUSSCGKSA-N 391.522 2.706 0 50 GFAA COCCN[C@H]1CCc2c(sc3ncn(Cc4ccc(F)cc4)c(=O)c23)C1 11872043 RARUXQZHGCQNAR-HNNXBMFYSA-N 387.480 2.739 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1cccc(NC(=S)NC(=O)c2ccccc2)c1 12138753 NMTQQFCKGVSXJE-KRWDZBQOSA-N 383.473 2.722 0 50 GFAA Cc1nccn1CCCNC(=O)[C@@H]1CCC(=O)N(CCCc2ccccc2)C1 12198891 JGHHTBSDJRHCPV-HXUWFJFHSA-N 382.508 2.569 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCCCc3ccncc3)CCC2=O)cc1 12307875 WKUWESRCSFMFHJ-HXUWFJFHSA-N 395.503 2.620 0 50 GFAA O=C1C[C@H](NCc2ccccc2Cn2cccn2)CN1Cc1ccc(F)cc1 12581302 AXFXAIFQPMCKMO-NRFANRHFSA-N 378.451 2.961 0 50 GFAA O=C(c1ccc2ccccc2c1)N1CCN(c2ccc(-n3cccn3)nn2)CC1 13008841 OZHOQWIVUZGCNP-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA CN1CCN(S(=O)(=O)c2cccc(C(=O)Nc3ccccc3Cl)c2)CC1 14373358 CDZXQZOFHMNCMZ-UHFFFAOYSA-N 393.896 2.528 0 50 GFAA O=c1c2cnc(N3CCOCC3)nc2ccn1-c1ccc(Cl)cc1Cl 19958792 LOLJUWWJRQYPBX-UHFFFAOYSA-N 377.231 2.924 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ccc(I)cn2)CC1 20230842 RJHWOWJRQNENIC-UHFFFAOYSA-N 389.237 2.743 0 50 GFAA in-vitro COc1cc(/C=C/CN2CCN(Cc3ccccc3)[C@@H](CCO)C2)ccc1O 20351090 RQRRXNZSFSKRMN-FERLCFGISA-N 382.504 2.983 0 50 GFAA COc1ccccc1N1CCN(CC(=O)N2N=CC[C@@H]2c2ccccc2)CC1 35851843 GESMSPMOADOPTA-LJQANCHMSA-N 378.476 2.777 0 50 GFAA c1ccc(CN(C[C@H]2CCCO2)c2ncnc3sc4c(c23)CCNC4)nc1 65372693 PIBVBWMDWRLLKQ-OAHLLOKOSA-N 381.505 2.918 0 50 GFAA Cc1cccc(-c2c[nH]nc2C2CCN(C(=O)CN3CCC[C@@H](O)C3)CC2)c1 67723758 NIEMRSZXDIYIAT-LJQANCHMSA-N 382.508 2.548 0 50 GFAA Cc1noc(C)c1CC(=O)NCc1cccnc1N(C)CCc1ccccn1 67757393 BQMKKUPUOAUPGP-UHFFFAOYSA-N 379.464 2.619 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N(C)CC(C)C)c2=O)cc1 77287282 PBUMKCJJEGONOS-UHFFFAOYSA-N 394.475 2.824 0 50 GFAA Cc1nc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)cs1 82114405 MCSWBXQTLFXKII-HXUWFJFHSA-N 384.505 2.892 0 50 GFAA CCOc1ccc(CN2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)cc1 91713534 QLYMVCZFOYPABE-QHCPKHFHSA-N 385.552 2.994 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)C1 91964932 YYHWZCWHUKMGIR-AWEZNQCLSA-N 387.436 2.539 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccc(O)cc3)C2)CN1Cc1ccncc1 92028223 OBJRSMLAXHURRL-JOCHJYFZSA-N 379.460 2.832 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCC(C(=O)N2CCCC2)CC1 95382741 WVNNJFOIQYVURB-QGZVFWFLSA-N 380.872 2.809 0 50 GFAA CNc1ncc(-c2nc(Cc3ccccc3OC)nn2CC(F)(F)F)cn1 96159686 XFHIYFCWGZSNLE-UHFFFAOYSA-N 378.358 2.939 0 50 GFAA Cc1c(C(=O)N(Cc2ccncc2)C[C@@H]2CCC(=O)N2)[nH]c2ccc(F)cc12 97610209 DKFAQQGHEKJGOV-INIZCTEOSA-N 380.423 2.931 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCN([C@@H](C)c2cccnc2)CC1 115387251 YJJFHWDASVCPDL-HNNXBMFYSA-N 396.520 2.766 0 50 GFAA COc1ccccc1-c1cc(C(=O)N[C@@H]2CCN(C(=O)C3CCCCC3)C2)[nH]n1 153214632 YQASPYSZZWBVNI-MRXNPFEDSA-N 396.491 2.996 0 50 GFAA O=C(NS(=O)(=O)C[C@@H]1CCCCO1)c1ncoc1-c1ccccc1Cl 170645650 FGZUFUCHEIFDEB-NSHDSACASA-N 384.841 2.624 0 50 GFAA COc1ccc(-c2ncc(C(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)s2)cc1 173352442 OSONCMHGOYRHIM-LBPRGKRZSA-N 399.394 2.712 0 50 GFAA CCC[C@]1(C)C(=O)NCCN1C(=O)c1cnc(-c2ccc3c(c2)CCO3)s1 189866326 ANLBLAXHKOXZIG-HXUWFJFHSA-N 385.489 2.876 0 50 GFAA O=c1[nH]c(N2CC=C(c3cncc(F)c3)CC2)nc2c1cnn2-c1ccccc1 225567465 WGMZVUSXINJABP-UHFFFAOYSA-N 388.406 2.937 0 50 GFAA Cc1cc(=O)c(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)nn1-c1ccccc1F 237834547 VMACGRPJWUFOTK-QRTARXTBSA-N 399.422 2.538 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CN[C@H]2CC[C@H](O)CC2)cc1 244659839 HJTZNDZNKBAPTP-VABKMULXSA-N 398.547 2.951 0 50 GFAA CC(C)[C@H](CNC(=O)Cc1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 252492628 MQXZRYARAVTSNK-AWEZNQCLSA-N 377.872 2.943 0 50 GFAA COc1ccc(S(=O)(=O)N2CC[C@@]3(C)[C@H](C2)C3(Cl)Cl)cc1C(=O)O 284113325 SRBNOXFEFFCHNR-JSGCOSHPSA-N 394.276 2.598 0 50 GFAA COc1ccc(-c2ccccc2NC(=O)N2CCN3CCN(C)C[C@H]3C2)cc1 299775406 JEICTXHFPIELAZ-SFHVURJKSA-N 380.492 2.826 0 50 GFAA Cn1cc(C(=O)NC[C@H]2CC(Cc3ccc(F)cc3)=NO2)c(=O)c2ccccc21 299796680 PFPNTLYTIATYCB-QGZVFWFLSA-N 393.418 2.795 0 50 GFAA CC(C)C(=O)NC[C@@H]1CCCN(C(=O)Nc2c[nH]nc2-c2nccs2)C1 333293093 ATVMOWFKTSSAPU-LBPRGKRZSA-N 376.486 2.549 0 50 GFAA C[C@H]1C[C@@H]1c1nnc2ccc(N3CCC(NC(=O)NC4CCCCC4)CC3)nn12 333620545 YIHNCMIIWIYUTM-YOEHRIQHSA-N 397.527 2.848 0 50 GFAA O=C(Cc1cn2ccccc2n1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 364661014 IMRIWUFMCCCBBY-GOSISDBHSA-N 391.475 2.552 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)C[C@H]1N 418930141 AZPGTSHFZARFLM-ZMYBRWDISA-N 385.895 2.546 0 50 GFAA Cc1c(Cl)c(C(=O)N2CCC[C@H](N(C)Cc3ccccn3)CC2)nn1C 421877981 UMEXOHUAQMLSLA-INIZCTEOSA-N 375.904 2.904 0 50 GFAA CN1Cc2cc(NS(=O)(=O)c3ccc(Br)o3)ccc2NC1=O 479576994 VMASNLDJWIACBJ-UHFFFAOYSA-N 386.227 2.820 0 50 GFAA Cn1c(SCc2cc(C(N)=O)oc2C(C)(C)C)nnc1[C@@H]1CCCNC1 534637735 IYOWCKAVSAFBLD-LLVKDONJSA-N 377.514 2.564 0 50 GFAA CCCCc1nc(-c2cccc(Cn3cccn3)c2)n(C[C@H]2COCCO2)n1 822886123 VITOGABMAXHKMC-IBGZPJMESA-N 381.480 2.948 0 50 GFAA C[C@@H]1C[C@H](C(=O)N[C@@H](c2c[nH]c3cccc(F)c23)C(F)(F)F)O[C@H]1C(=O)O 911771627 BNHXRUVSXFVPAU-BUUDBDSUSA-N 388.317 2.905 0 50 GFAA O=C(N[C@@H]1CCCc2c(F)cc(F)cc21)N1CCC[C@@H](c2nc(O)n[nH]2)C1 922649138 SNAUJARVOVIHSF-MEBBXXQBSA-N 377.395 2.755 0 50 GFAA CCCC[C@@H]1CN(C(=O)Cc2nn(C)c(=O)c3ccccc23)C[C@H](C2CC2)O1 1529191886 HZGMZFXGUIEEQQ-OXQOHEQNSA-N 383.492 2.672 0 50 GFAA O[C@@H]1CCCN(c2ccnc(NCCc3csc(-c4cccnc4)n3)n2)C1 1704337899 HMLGVEMIOBGSGA-MRXNPFEDSA-N 382.493 2.611 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@H]1COC[C@H]1Cc1ccncc1 1704339344 JBUWGHJYTKGMSQ-MSOLQXFVSA-N 390.505 2.750 0 50 GFAA CC(C)[C@H]1CN2C[C@@H](NS(=O)(=O)c3cc(Cl)c(Cl)s3)C[C@H]2CO1 1857709719 NJKVDEDOACNPCP-JBLDHEPKSA-N 399.365 2.831 0 50 GFAA COc1ccccc1Cn1nc(-c2cccc(F)c2)nc1[C@H]1C[C@H](N)[C@@H](O)C1 1857719042 CYHIJGCGOVJOST-SZMVWBNQSA-N 382.439 2.707 0 50 GFAA CCOC1CCN(C(=O)[C@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)CC1 1857732198 HEYYQHKTLLLSLV-AWEZNQCLSA-N 387.505 2.985 0 50 GFAA Cn1c(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)cc2ccccc21 1875249817 CTOMBFGXQITFQX-NFBKMPQASA-N 392.455 2.699 0 50 GFAA Cc1ccc(COc2ccc(C[C@H](C)NC(=O)[C@]3(C(=O)O)CCNC3)cc2)cc1 1875267005 PJHGDMSRTFHOBH-SBUREZEXSA-N 396.487 2.686 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1)N1C[C@H]2[C@@H](O)C[C@H]2C1 1875269559 YWTXDGWBZURJKA-QGTPRVQTSA-N 378.407 2.526 0 50 GFAA O=C(O)[C@@H]1COCC[C@@H]1C1CCN(C(=O)Cc2ccccc2OC(F)F)CC1 1875291845 NLLWGWSEXATVHI-HZPDHXFCSA-N 397.418 2.806 0 50 GFAA C[C@@H]1CN(C(=O)c2cccc3c[nH]nc23)C[C@@H]1NC(=O)c1coc(C2CCC2)n1 1875333907 PIMBGNUBQWUJQV-WBMJQRKESA-N 393.447 2.709 0 50 GFAA O=C(CCc1cccc(Cl)c1)N[C@@H]1C[C@H](C(=O)N2CCCCC2)C[C@H]1O 1940193415 ATALUXOCSYQFQR-CGTJXYLNSA-N 378.900 2.541 0 50 GFAA CN(C[C@H](O)CN1CCc2ccccc2CC1)C(=O)NCC(F)(F)C(C)(C)C 2325757090 FMLFLASGQHNJJU-SFHVURJKSA-N 397.510 2.771 0 50 GFAA CN(C(=O)c1ccc(Sc2nnc(-c3ccccc3)o2)nn1)C1CCNCC1 2325796593 ZYSGUPFYEWQTAF-UHFFFAOYSA-N 396.476 2.502 0 50 GFAA CN1CC[C@@]2(CCN(C(=O)c3ccc4c(c3)nc(O)n4Cc3ccccc3)C2)C1 2325816019 DQLSFJVSKPIUSK-HSZRJFAPSA-N 390.487 2.958 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)CCCc2ccc(OC)cc2)C1=O 2356144623 GKERGIKTGASSGU-QFIPXVFZSA-N 388.508 2.648 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2ccc(N3CCOCC3)cc2)C1=O 2356165428 IEAAKEFOIYIWCV-QFIPXVFZSA-N 385.508 2.529 0 50 GFAA O=C1C[C@@H](Sc2nnnn2-c2ccccc2)C(=O)N1c1cccc(Cl)c1 1109721 GCLCRIOQVGXDQE-CQSZACIVSA-N 385.836 2.740 0 50 GFAA COc1cc(C(=O)NC(=S)Nc2ccc(C(=O)O)cc2)cc(OC)c1OC 1159310 XURBQSRZOTYJCC-UHFFFAOYSA-N 390.417 2.537 0 50 GFAA COCCNC(=O)c1cnn2c1N[C@H](c1ccc(OC)cc1)C[C@@H]2C(F)(F)F 4952959 DKRZYGJWELFHBV-LSDHHAIUSA-N 398.385 2.928 0 50 GFAA Cc1ccc([C@H](C)CCN(C)CCn2cc(C(=O)NCc3ccncc3)nn2)o1 11913185 DOTXEZPYRVCMAA-MRXNPFEDSA-N 396.495 2.630 0 50 GFAA COC(=O)CCCNC(=O)c1ccc(OC)c(OC2CCN(C(C)C)CC2)c1 15074737 GCNNHUVPOSSLMT-UHFFFAOYSA-N 392.496 2.630 0 50 GFAA O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1 16294360 QADZZZIOWJHBAT-KBPBESRZSA-N 394.855 2.642 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1 18116922 RLHHFQYPQCJASJ-GOSISDBHSA-N 399.878 2.803 0 50 GFAA O=C(CCCC(=O)N1CCN(c2cccc(Cl)c2)CC1)Nc1nncs1 40267026 RHVSOCLVNGMZDI-UHFFFAOYSA-N 393.900 2.649 0 50 GFAA CCc1nc(NC(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)nn1C 48428278 IMNGYDAMBBGDCZ-UHFFFAOYSA-N 381.440 2.839 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N[C@@H]3CCCN(C)C3)nc2)cc1 67727318 XWPBJZZUQLRFOK-LJQANCHMSA-N 382.508 2.959 0 50 GFAA COc1ccccc1OCc1cc(C(=O)N2CC(N3CCCC[C@@H]3C)C2)n[nH]1 67789667 JNZUNTUYMWJXGA-HNNXBMFYSA-N 384.480 2.696 0 50 GFAA CN1C(=O)[C@@](CCC(=O)N2CCC(N)CC2)(Cc2ccccc2)c2ccccc21 71589510 JEVDJXZMQSFLDP-DEOSSOPVSA-N 391.515 2.873 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2ccc([C@@H](C)OC)cc2)c1 71771466 VQVYWMRPCHQABQ-CYBMUJFWSA-N 393.461 2.684 0 50 GFAA O=C(C[C@H]1COCCN1Cc1ccc2occc2c1)NCCc1ccccn1 72407218 IPCSCUQFOFFFFY-FQEVSTJZSA-N 379.460 2.778 0 50 GFAA CC[C@H]1CCCCN1CC(=O)NCc1cc2n(n1)CCCN(CC(C)C)C2 82107904 CIDFLLIAZMVLJX-IBGZPJMESA-N 375.561 2.626 0 50 GFAA Cn1ncnc1[C@H](NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)C1CC1 95360187 PFGKNGVUYSLGKU-MRXNPFEDSA-N 380.418 2.939 0 50 GFAA Ic1nc(I)n2ccsc12 95642846 UCCJIFDYNVNNHW-UHFFFAOYSA-N 375.960 2.605 0 50 GFAA CCCCn1nc(-c2ccco2)nc1-c1cc(S(N)(=O)=O)ccc1OC 96138472 QPKMURAUKCSVFE-UHFFFAOYSA-N 376.438 2.661 0 50 GFAA O=C(c1cc[nH]c1)N1CCC2(CCN(CCc3ccccc3)CC2)[C@H](CO)C1 97447095 KDQDYTUXGZXKKG-NRFANRHFSA-N 381.520 2.794 0 50 GFAA CN(Cc1nc2ccccc2n1C)C(=O)c1ccc(N2CCOCC2)c(F)c1 111096845 GUHJQCAAASVFCT-UHFFFAOYSA-N 382.439 2.821 0 50 GFAA CC(=O)NC1(C(=O)NCC2(N3CCSCC3)CCCCC2)CCCCC1 112186881 HQRSSIZKHZKZKF-UHFFFAOYSA-N 381.586 2.693 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N3CC(=O)N[C@@H]4CCCC[C@@H]43)ccc12 131162824 DHBSTLIHAMRAEK-MJGOQNOKSA-N 389.459 2.612 0 50 GFAA C[C@@H](NC(=O)c1cccs1)C(=O)N1CCC[C@H]1CN1CCc2ccccc21 140395945 XLZYGPLMODREGA-WBVHZDCISA-N 383.517 2.920 0 50 GFAA O=C(NCC(=O)c1cccc2c1OCCO2)c1ccc(C(=O)c2cc[nH]c2)cc1 170597634 UGDMSRLYHKJXDA-UHFFFAOYSA-N 390.395 2.630 0 50 GFAA CC1CCC(N2C[C@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)CC1 170998574 ZGTOPUPLUFCXRY-URSIVYNOSA-N 381.480 2.692 0 50 GFAA Cc1nc(-c2ccccc2)ncc1C(=O)N(C)c1ccc(N2CCOCC2)nc1 182988609 GIFODRIUARHARA-UHFFFAOYSA-N 389.459 2.960 0 50 GFAA CCOc1ncccc1CNC(=O)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 193338740 RPIOLECHULHJMX-UHFFFAOYSA-N 395.463 2.670 0 50 GFAA CCn1cc(CNC(=O)c2cn(CC)c3c(F)c(F)c(F)cc3c2=O)cn1 221222410 PWSRGDNOFJWNLE-UHFFFAOYSA-N 378.354 2.585 0 50 GFAA C[C@H](N1CCN(C[C@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1)C(F)(F)F 240555617 GWQAPVMHOQGERQ-LEUOFYLZSA-N 390.490 2.925 0 50 GFAA C[C@@H]1CCC[C@@H]2CCCN(C(=O)CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)[C@H]12 248333785 KNCPRYOJDOYNGA-OYSWKTHDSA-N 395.503 2.807 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N[C@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252527712 DESAFWQTYPEIAN-KGVIQGDOSA-N 383.492 2.533 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c(F)c1 262490274 ZIXWECPOWWWOPQ-UHFFFAOYSA-N 388.370 2.698 0 50 GFAA CN(C)CCn1cnc2cc(NC(=O)CC3(n4cccc4)CCOCC3)ccc21 263588725 XTFDPEHGUKXBPU-UHFFFAOYSA-N 395.507 2.934 0 50 GFAA CCCNC(=O)C1CCN(C(=O)c2ncn3c2CO[C@H](c2ccccc2)C3)CC1 263619106 WYLXCXQNPFUEQU-IBGZPJMESA-N 396.491 2.533 0 50 GFAA O=C(NCCN1CCN(c2ccc(F)cc2)CC1)c1cc2c(s1)CCOC2 264058725 CJQZCPSDYKTCRD-UHFFFAOYSA-N 389.496 2.512 0 50 GFAA O=C(O)C[C@H]1CCCN(S(=O)(=O)CCc2ccccc2Br)C1 290901880 FDCYERAVXNWQID-GFCCVEGCSA-N 390.299 2.508 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)CCO1 299745594 RHCUKNSLFJQNEW-NSHDSACASA-N 388.367 2.560 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2Nc2ccnc(Cc3ccccc3)n2)cn1 328619694 GCOXNZLXKURATI-UTKZUKDTSA-N 376.464 3.556 0 50 GFAA CC1(C)CN(C(=O)CSc2nccn2C(C)(C)C)C[C@@]2(CCCOC2)O1 333304855 UGOZKMZVTDEWTJ-LJQANCHMSA-N 381.542 2.917 0 50 GFAA C[C@@H](NC(=O)C1CCCC1)C(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 333740009 LHRIMKHYEVFVRV-UKRRQHHQSA-N 390.446 2.889 0 50 GFAA Cc1ccc2nc(CNC(=O)N3CCCN(c4ccncc4C)CC3)[nH]c2c1 426408886 DGUQNLMRGSWAMM-UHFFFAOYSA-N 378.480 2.997 0 50 GFAA COc1ccccc1COc1ccccc1-c1nc(N2CCOCC2)n(C)n1 426669144 QDMAIEMCFQQNOR-UHFFFAOYSA-N 380.448 2.906 0 50 GFAA COc1ccnc(-c2ccc(C(=O)N3CCC[C@@H](Cn4ccnc4)C3)cc2)n1 426683805 LPKROLCNKSCDIO-INIZCTEOSA-N 377.448 2.901 0 50 GFAA O=C(Nc1ccc2ccn(Cc3ccc(CO)cc3)c2c1)[C@H]1CCS(=O)(=O)C1 871425564 UBTHDXUTBAAELM-SFHVURJKSA-N 398.484 2.555 0 50 GFAA O=C(c1ccco1)N1CCN(C2CCN(c3ccc(F)c(F)c3)CC2)CC1 952971228 CSZHPYAYWJKMDE-UHFFFAOYSA-N 375.419 2.985 0 50 GFAA O=C1[C@H](NS(=O)(=O)c2ccccc2)CCN1c1ccccc1C(F)(F)F 1309411825 RPJCFWNCXZTYMF-CQSZACIVSA-N 384.379 2.789 0 50 GFAA CSCC[C@H](C(=O)Nc1cccc(F)c1O)N1C(=O)c2ccccc2C1=O 1471166562 LQFKAMXTCSNIFA-OAHLLOKOSA-N 388.420 2.888 0 50 GFAA CC(C)Nc1ncc(CN2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)cn1 1529155683 YSXXCWMYMBENHF-WIYYLYMNSA-N 377.492 2.881 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1ccccn1)C1(N2CCCCC2)CCCCC1 1565514109 VJRQLLISRZBSNJ-OALUTQOASA-N 387.524 2.923 0 50 GFAA CSCc1noc(CN2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)n1 1565526218 BOXKMEJLRBWMIY-QAPCUYQASA-N 384.549 2.996 0 50 GFAA Cn1nc(-c2ccccc2)cc1C(=O)N1CCC[C@@]2(CCc3cnc(N)nc32)C1 1704337594 AWWWFUASQYTVPC-JOCHJYFZSA-N 388.475 2.580 0 50 GFAA O=C(O)CC[C@@]12CN(Cc3cccnc3)C[C@@H]1CN(C1Cc3ccccc3C1)C2 1772711917 LPDJGMJCHVBEKG-QPPBQGQZSA-N 391.515 2.848 0 50 GFAA COCCn1nc(-c2ccc(F)c(F)c2)nc1[C@H]1CCCN(CC(=O)O)CC1 1772814803 BUMJGPKFSBTJFP-ZDUSSCGKSA-N 394.422 2.524 0 50 GFAA CO[C@H]1C[C@H](c2nnc(C)o2)N(C(=O)C2=Cc3cc(Cl)ccc3OC2)C1 1775959236 PPMNBMDHRLRMAC-LSDHHAIUSA-N 375.812 2.796 0 50 GFAA CC[C@@]1(C(=O)NCc2nccn2C)C[C@@H]2CC[C@H]1N2C(=O)CCC(F)(F)F 1857675784 JBXAKRCWFVLQFN-OGHNNQOOSA-N 386.418 2.539 0 50 GFAA Cc1nccc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)CCc4ccccc4)C3)C2)n1 1857688412 ICXJXYZNMUSVKX-NFBKMPQASA-N 394.519 2.598 0 50 GFAA CC(=O)N1CCC(C2CCN(C(=O)c3cccc(-n4cccn4)c3)CC2)CC1 1857714591 XNLHAHLJZWGJFI-UHFFFAOYSA-N 380.492 2.983 0 50 GFAA Fc1ccc(-n2cnc3c2CCN(c2cc(OC4CCOCC4)ncn2)C3)cc1 1875286969 PBMWAEYNPRMHSI-UHFFFAOYSA-N 395.438 2.922 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCC2(CC1)C[C@H](N)c1ccccc1O2)c1ccccc1 1875301343 GGLBUSCSHDPYDH-PZJWPPBQSA-N 393.487 2.708 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCC2(CC1)C[C@@H](N)c1ccccc1O2)c1ccccc1 1875301344 GGLBUSCSHDPYDH-TZIWHRDSSA-N 393.487 2.708 0 50 GFAA O=C(Cc1cc(Cl)c2c(c1)OCO2)Nc1ccccc1CN1CCNC1=O 1875325590 PYTYOUFDODFNEI-UHFFFAOYSA-N 387.823 2.775 0 50 GFAA Cn1cc(NC(=O)N2CCN(C(=O)Nc3cccc(C(F)(F)F)c3)CC2)cn1 1875339456 KJPZIEASAWAQBP-UHFFFAOYSA-N 396.373 2.821 0 50 GFAA O=C(c1ccc2c(c1)NS(=O)(=O)C2)N1CC2(CC(OCc3ccccc3)C2)C1 1875404787 UXHODLVLEYBKOO-UHFFFAOYSA-N 398.484 2.763 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCOCC2)CC[C@H]1NC(=O)Nc1ccccc1 2100555151 MPKVICAQWPVBPD-QXAKKESOSA-N 389.496 2.631 0 50 GFAA O=C(N[C@H](CNC(=O)[C@H]1CCCC12CC2)C1CCCC1)c1cnn2ncccc12 2325794431 BJFJBHMBBPWFBE-QZTJIDSGSA-N 395.507 2.714 0 50 GFAA COc1ccc(-c2onc(N3CCO[C@@]4(C[C@@H]5CC[C@H](C4)N5)C3)c2C(=O)O)cc1 2356142586 YUZUQISZKIHYFN-PBFBIOBFSA-N 399.447 2.538 0 50 GFAA CCOC(=O)c1nc2sc3c(c2c(=O)n1[C@H](C)C(=O)OCC)CCCC3 957820 RIZVEGIITHUUPF-SNVBAGLBSA-N 378.450 2.638 0 50 GFAA CC(=O)c1cccc(N(CC(=O)NCc2ccccc2Cl)S(C)(=O)=O)c1 1062810 RVQQDVYPLCNLPZ-UHFFFAOYSA-N 394.880 2.625 0 50 GFAA CCCCCCn1c(N(C)Cc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C 1832104 IAELRKLFBHTZSK-UHFFFAOYSA-N 383.496 2.650 0 50 GFAA O=C(CSc1nnc(-c2ccncc2)o1)N1CCN(c2ccccc2)CC1 4330988 LPTICHOZPSPGFH-UHFFFAOYSA-N 381.461 2.573 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc2ccccc2o1 4941290 IYXRQERGQMXUSW-UHFFFAOYSA-N 386.429 2.706 0 50 GFAA CCOC(=O)N1CCN(C(=O)C2CCN(C[C@@H](C)c3ccccc3)CC2)CC1 5672622 SUCJWCZZDVTGRN-GOSISDBHSA-N 387.524 2.803 0 50 GFAA O=S(=O)(NCCCN1CCCCCC1)c1ccc(Br)cc1 10111248 GTYHYLAHZJELGG-UHFFFAOYSA-N 375.332 2.994 0 50 GFAA CCN1CCN(C(=O)c2csc3nc(-c4cccc(F)c4)cn23)[C@@H](C)C1=O 11664798 SHFATFWSIHDOIH-LBPRGKRZSA-N 386.452 2.895 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)c2cnn(CC)c2)CC1 11817119 SJJQTUFBNOGKJF-UHFFFAOYSA-N 399.491 2.940 0 50 GFAA CC(C)(C)[C@H](Cn1ccnc1)NC(=O)c1cn(CCCc2ccccc2)nn1 11820047 PUGHILRAMBUGBZ-IBGZPJMESA-N 380.496 2.952 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@@H]1CCCN(C(=O)CN2CCOC2=O)C1 11934337 VGERFIPSFOZNNN-MRXNPFEDSA-N 397.431 2.576 0 50 GFAA NC(=O)[C@H]1CCCN(Cc2ccc3c(c2)CN(Cc2ccccc2)CCO3)C1 11970406 WCRJLQLCMSFPIL-FQEVSTJZSA-N 379.504 2.779 0 50 GFAA C[C@@H](NC(=O)c1ccco1)c1nnc2n1CCN(Cc1cccc(F)c1)CC2 12020583 MJZNPHGLDSSYIC-CQSZACIVSA-N 383.427 2.560 0 50 GFAA O=C(CCc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 12138113 GHCLIZVMVLSQTN-SFHVURJKSA-N 388.489 2.715 0 50 GFAA CN(C)CC(=O)N[C@H]1CC(C)(C)Cc2nc(N(C)Cc3ccccc3)ncc21 12470678 MYXCJQZYVYHFAT-SFHVURJKSA-N 381.524 2.804 0 50 GFAA CCN(CC)C(=O)c1cn([C@H]2CCCN(Cc3c(F)cccc3F)C2)nn1 12509015 WTJAGMBXNQJJLZ-AWEZNQCLSA-N 377.439 2.875 0 50 GFAA CCOC(=O)C1CCN(C(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)CC1 12596306 FITZRBIBDFKXJI-SFHVURJKSA-N 378.513 2.607 0 50 GFAA Cc1noc2nc(-c3cccs3)cc(C(=O)N[C@H](C)CN3CCOCC3)c12 13642073 XRHXTLQVVRSHHW-GFCCVEGCSA-N 386.477 2.710 0 50 GFAA CC[C@H](C(=O)N1CCN(Cc2ccccc2)CC1)n1cnc2ccccc2c1=O 13686347 JFZFZPGYXSQNKZ-OAQYLSRUSA-N 390.487 2.692 0 50 GFAA CCCCNC(=O)[C@@H]1C[C@H](COc2ccc(C)nc2)CN(Cc2nccn2C)C1 14755442 XYPLIIJMRXTMTQ-RBUKOAKNSA-N 399.539 2.557 0 50 GFAA CCOc1ccc(/C=C2/SC(=O)N(CN3CCOCC3)C2=O)c(OCC)c1 16667963 DRXFRFTXOCTIOB-GZTJUZNOSA-N 392.477 2.810 0 50 GFAA CN1CCc2nc3sc(C(=O)Nc4ccc5c(c4)OCO5)c(N)c3cc2C1 19683213 OGJUZDYLPOGBRJ-UHFFFAOYSA-N 382.445 2.847 0 50 GFAA Cc1cccc(CN2CCN(C3CCN(Cc4ccco4)CC3)C[C@@H]2CCO)n1 20272859 SQTBQJKUNWOLDG-QFIPXVFZSA-N 398.551 2.516 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CCC(c4nc5ccccc5o4)CC3)nc2n1 23534447 VZGGDMJDQWLNIW-UHFFFAOYSA-N 376.420 2.902 0 50 GFAA O=C1C[C@@H](c2cccnc2N2CCOCC2)c2cnn(-c3ccccc3)c2N1 65394201 MAJCJTBBAHRVBF-KRWDZBQOSA-N 375.432 2.578 0 50 GFAA Cc1ccc2nc3c(n2c1)[C@@H](c1ccccc1OCCN(C)C)CC(=O)NC3 65531427 VLDPRQLIUUOOSR-QGZVFWFLSA-N 378.476 2.735 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccc(Cl)cc4)CC3)ncn2)n1 72119287 CJAIAMFBEWCEMY-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA Cc1nc2cc(C(=O)N[C@H]3CC(=O)N(CCCc4ccccc4)C3)ccc2[nH]1 72174130 BQTWCMLZQLEUJC-SFHVURJKSA-N 376.460 2.835 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H](c3nnc(CN4CCCCC4)n3C)C2)cn1 72427803 KDDUISSDMUOVQI-GOSISDBHSA-N 382.512 2.524 0 50 GFAA CC1(C)C[C@@H](c2nccn2C2CCN(C(=O)N3CCOCC3)CC2)CCO1 82106479 AHTLFQBCVUIXGE-INIZCTEOSA-N 376.501 2.645 0 50 GFAA O=C(c1cc(-c2ccncc2)n[nH]1)N1CCC2(CC1)Nc1ccccc1NC2=O 92045803 XPASIWRLAKIZIQ-UHFFFAOYSA-N 388.431 2.511 0 50 GFAA O=C(c1cc(-c2ccccc2O)n[nH]1)N1CCC(OCc2cccnc2)CC1 95386289 ATRCJXKFKCEOJN-UHFFFAOYSA-N 378.432 2.999 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)c2ccc3c(=O)n(C)cnc3c2)CC1 95506056 AMEDWMNFVXOQCA-UHFFFAOYSA-N 393.491 2.950 0 50 GFAA CCc1ncc(C(=O)N2CCC(c3nccn3Cc3cccnc3)CC2)cn1 95511077 MFZNNRLUSKOLJG-UHFFFAOYSA-N 376.464 2.699 0 50 GFAA COCC(=O)N1CCC(Oc2ccccc2C(=O)N(C)Cc2ccoc2)CC1 95511961 YVEBIDCHFARTQC-UHFFFAOYSA-N 386.448 2.568 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc(NC(=O)N2CC(c3cccnc3)C2)cc1 95517088 VNRDNVZWOIAFQX-LJQANCHMSA-N 380.448 2.622 0 50 GFAA Cc1cc2c(cc1NC(=O)N1CCN(C3CCCCC3)CC1)n(C)c(=O)n2C 96137717 RJWHXSZZPRMERI-UHFFFAOYSA-N 385.512 2.668 0 50 GFAA Cc1nc(C(C)(C)Oc2ccc3c(c2)CCC3)n([C@@H]2CCS(=O)(=O)C2)n1 96139361 WYJCKLATSIMHNT-MRXNPFEDSA-N 375.494 2.749 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)Nc1cccc(Cn2cncn2)c1 96165083 WWIHDUFYAMZDKT-UHFFFAOYSA-N 380.456 2.745 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)CSc1ccncc1)C[C@@H]2CO 97675407 XHRUMVHAELHMKL-QGZVFWFLSA-N 377.554 2.507 0 50 GFAA CN(C)CCn1ccc2ccc(NC(=O)c3ccc(N4CCNC4=O)cc3)cc21 153362936 KAYJRUGLEMJOBC-UHFFFAOYSA-N 391.475 2.985 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ccc1C 170598317 JAJCZQXZAYSHGL-FOIQADDNSA-N 389.521 2.923 0 50 GFAA COC(=O)C[C@@](C)(NC(=O)CCC(=O)NC1CCCC1)c1ccc(F)cc1 170609981 BKVAZNNDTSEROP-HXUWFJFHSA-N 378.444 2.559 0 50 GFAA C[C@@H](NC(=O)NC(C)(C)C)[C@H]1CCCN(c2ncc(Br)cn2)C1 170634102 OKQNLQSJAURHRV-NEPJUHHUSA-N 384.322 2.942 0 50 GFAA C[C@@H](C(=O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1)C1CC1 178390060 MLGDMKCRDBRONJ-CQSZACIVSA-N 386.883 2.581 0 50 GFAA O=S(=O)(Cc1ccc(F)c(Cl)c1)N1CCC(Nc2cccnn2)CC1 178998017 MNNVCEYBFMVJMU-UHFFFAOYSA-N 384.864 2.675 0 50 GFAA O=C(N[C@@]1(CO)CCOC1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 185273955 AYZXQCASWRUBBP-QGZVFWFLSA-N 382.338 2.774 0 50 GFAA COC[C@@H](NC(=O)c1ccc(-n2nc(C)c(CCC(=O)O)c2C)cc1)C1CC1 191610992 OZMXLHULIYZLFP-LJQANCHMSA-N 385.464 2.661 0 50 GFAA C[C@@H](C(=O)O)[C@@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1 237684932 OIKRWSKRYDJDAW-IUODEOHRSA-N 388.855 2.922 0 50 GFAA C[C@@H](N1CCN(C[C@@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1)C(F)(F)F 240555610 GWQAPVMHOQGERQ-BZZMCLGOSA-N 390.490 2.925 0 50 GFAA Cc1coc(CC(=O)O)c1C(=O)Nc1cc(C(N)=O)ccc1N1CCCCC1 263426544 MHTQYZVTJDKJPK-UHFFFAOYSA-N 385.420 2.557 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCc3nccn3C2)c(Cl)c1Cl 275289073 LHLNWUAVMQSTSA-SNVBAGLBSA-N 390.292 2.739 0 50 GFAA Cc1nc2ccc(C(=O)Nc3cccc(C(=O)N4CCC[C@H](O)C4)c3)cc2o1 280238223 HUPXTYGKLUEORB-KRWDZBQOSA-N 379.416 2.985 0 50 GFAA O=C(NCC1(c2cccs2)CCCCC1)N1CCOC[C@@H]1c1nc[nH]n1 297207854 LDPMGZCEQKMGNK-CQSZACIVSA-N 375.498 2.851 0 50 GFAA O=C(Nc1cccc(-n2cnnc2)c1)N1CCN(C2Cc3ccccc3C2)CC1 299755259 DTZSIPVGGLHWKA-UHFFFAOYSA-N 388.475 2.584 0 50 GFAA COc1ccc(C)nc1-c1cccc(C(=O)NCCCN2CCC[C@H](O)C2)c1 299762849 CBBIENIQUZTOOD-IBGZPJMESA-N 383.492 2.642 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@H](C)c2nnc3n2CCCC3)CC1 373134752 DMMDFPBLCXAMLC-OAHLLOKOSA-N 384.484 2.632 0 50 GFAA COc1cc(C)c(Br)cc1S(=O)(=O)N1CC[C@@]2(CCOC2)C1 408252546 SIZDUTNOSOOWSE-OAHLLOKOSA-N 390.299 2.567 0 50 GFAA Cc1c(NS(=O)(=O)c2ccc(C(=O)O)cc2Cl)cnn1C1CCOCC1 451065432 AHRLOKBSUXJTGF-UHFFFAOYSA-N 399.856 2.695 0 50 GFAA COC(=O)c1ccc(N2CCN(C(=O)Nc3ccn4ccnc4c3)CC2)s1 455330148 SICUXSGTUAIPSL-UHFFFAOYSA-N 385.449 2.537 0 50 GFAA O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N[C@H]1CCCN(c2ccccc2)C1 474823282 SVMMQRZSZARLJF-KRWDZBQOSA-N 396.882 2.779 0 50 GFAA O=C(NC[C@]1(O)CCCNC1)c1cccc(-c2ccc(-c3ccno3)cc2)c1 584903263 AFWPUSXDOUPWSK-QFIPXVFZSA-N 377.444 2.853 0 50 GFAA CCN(C)c1cccc(NC(=O)N2CCC(S(=O)(=O)N3CCCC3)CC2)c1 888102248 HBQYOROPPFOGAK-UHFFFAOYSA-N 394.541 2.565 0 50 GFAA CN1CCC(n2nnc3c2C[C@@H](c2nc(Cc4cccc(F)c4)no2)CC3)CC1 952893272 HIGYONDFCHQDML-HNNXBMFYSA-N 396.470 2.930 0 50 GFAA CN(C[C@@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1ccccc1-c1nccn1C 952980870 AWZXFNMAXSOKGD-INIZCTEOSA-N 380.492 2.950 0 50 GFAA O=C(Nc1cc2nc(O)[nH]c2cc1N1CCCC1)c1ccccc1-c1nc[nH]n1 952984274 YKADNZHHBAIGNF-UHFFFAOYSA-N 389.419 2.906 0 50 GFAA COCCN1CCC[C@H](C(=O)Nc2c(-c3ccc(OC)cc3)c(C)nn2C)C1 1529196725 FSAQYJSAAAWONJ-KRWDZBQOSA-N 386.496 2.701 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N3CC(=O)N[C@@H](Cc4ccccc4)C3)o2)CC1 1772705394 MOBNLEATBLUNDC-IBGZPJMESA-N 395.503 2.695 0 50 GFAA O=C(c1ccno1)N1CCC[C@@H](c2ncnn2-c2cnc3ccccc3n2)CC1 1772818509 SKBQRVFTVUCQNQ-CQSZACIVSA-N 389.419 2.608 0 50 GFAA COc1ccc(-c2oc3c(OC)cc(-c4nn[nH]n4)cc3c2CC(=O)O)cc1 1776111339 PVCCAZGFCWHIMG-UHFFFAOYSA-N 380.360 2.924 0 50 GFAA Cc1csc(CN2CCOC3(CCN(c4nccs4)CC3)CC2=O)n1 1857693800 NGUVFWHZZUCCDP-UHFFFAOYSA-N 378.523 2.696 0 50 GFAA Cc1ccc(S(=O)(=O)c2nc(-c3cccnc3)oc2N2CCOCC2)cc1 1857800234 QZIGUKSRHPQDNI-UHFFFAOYSA-N 385.445 2.714 0 50 GFAA Cc1cccc([C@H](CC(=O)Nc2n[nH]c(-c3ccncc3)c2C)NC(N)=O)c1 1875254333 BMMJNNYSFCSCHO-INIZCTEOSA-N 378.436 2.827 0 50 GFAA O=C(Nc1cccc(C(=O)OC2CCNCC2)c1)c1ccc2c(c1)COCC2 1875287464 LHLFESSFBZGWDV-UHFFFAOYSA-N 380.444 2.920 0 50 GFAA CN(C(=O)c1cccc(C(=O)N=S2(=O)CCC(CN)CC2)c1)c1ccccc1 1875292375 GEIDLSQBJYOHHP-UHFFFAOYSA-N 399.516 2.940 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N[C@H]2Cc3n[nH]cc3[C@H](C(F)(F)F)C2)c1 1875367542 MMDUWGSGEUMHOA-TZMCWYRMSA-N 378.354 2.925 0 50 GFAA CC(C)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)c1 1875399024 LZPQMGYRUJHUCQ-IAOVAPTHSA-N 397.928 2.778 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)N1CC3(COc4ccccc4C3)C1)CC(=O)N2 2100539659 SBKMWTYQZXVGTK-QGZVFWFLSA-N 378.428 2.585 0 50 GFAA CN(C)c1c[nH]ccc1=NC(=O)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 2325703562 NQTDLSZKLGBTEV-UHFFFAOYSA-N 391.479 2.766 0 50 GFAA CN(C[C@@H](O)CN1CCc2ccccc2CC1)C(=O)NCC(F)(F)C(C)(C)C 2325757089 FMLFLASGQHNJJU-GOSISDBHSA-N 397.510 2.771 0 50 GFAA COCc1nnc(-c2cccc(C(=O)NCC3CC(OC)(C(F)(F)F)C3)c2)o1 2325800251 ZZYJVJFZZVYNFD-UHFFFAOYSA-N 399.369 2.970 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCN(c2cccc(C)c2C)CC1 1067255 LMCJROWTGKKLFH-UHFFFAOYSA-N 378.469 2.962 0 50 GFAA O=C(CCc1ccccc1)Nc1nnc(SCC(=O)N2CCCC2)s1 2218558 UHYBLTHPAXHTAM-UHFFFAOYSA-N 376.507 2.824 0 50 GFAA O=C(NCCCCN1CCCC1)c1cc2c(s1)CCOC21CCNCC1 2356139791 YHPKZWGWQCWNEQ-UHFFFAOYSA-N 377.554 2.505 0 50 GFAA Cc1cc(N2CCC3(CC2)C[C@](C)(O)[C@@H](O)CO3)c2cc(F)cc(F)c2n1 2356143687 SCPOANGPKKULCG-HKUYNNGSSA-N 378.419 2.693 0 50 GFAA Cc1noc([C@@H]2CCCN2C(=O)c2c(OCc3ccccc3)c(=O)ccn2C)n1 2356152283 WZGAQTVJRXMGBO-INIZCTEOSA-N 394.431 2.633 0 50 GFAA CCCOc1ccc(C2C(C(=O)OC)=CN(CCOC)C=C2C(=O)OC)cc1 2805653 XKSZUJVLXLFQJO-UHFFFAOYSA-N 389.448 2.635 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2cnn(Cc3ccccc3)c2)CC[C@H]1O 2356167861 GGCDGZDCBHPDOQ-DENIHFKCSA-N 399.491 2.645 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1ccncc1)c1cccc(Cl)c1 4973703 IPAIZHYNEFDASI-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA COC(=O)c1ccc(O)c(NC(=O)[C@@H](c2ccccc2)N2CCSCC2)c1 225737435 OJKFHACFVBPXJE-GOSISDBHSA-N 386.473 2.907 0 50 GFAA O=C1Nc2cc(F)ccc2[C@H]1CC(=O)N1CCC[C@H](OCc2cccnc2)C1 102512767 WENMNQTXBRSJEW-FUHWJXTLSA-N 383.423 2.854 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1csc(Cc3ccc(F)cc3)n1)CC2 114867932 QLHFTGFJSOAICJ-AWEZNQCLSA-N 385.468 2.772 0 50 GFAA O=C(c1ccc2cc[nH]c2c1)N1CCCn2nc(C(=O)N3CCCC3)cc2C1 67654683 HOJJGENGZATGJA-UHFFFAOYSA-N 377.448 2.647 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3ccc(N(C)c4ccccc4)cc3)C[C@H]2O)CC1 20920088 HGQRCIHTMMIJAW-DNQXCXABSA-N 394.563 2.637 0 50 GFAA OCC1CCN(c2ncc3c(n2)CCC[C@@H]3NC2Cc3ccccc3C2)CC1 23338609 JVQUFTZZTJLFAC-NRFANRHFSA-N 378.520 2.820 0 50 GFAA CCCNC(=O)N1CCC(n2cc(CN3CCC[C@@H]3c3ccccn3)nn2)CC1 23398826 GJPZHYYLHROGPN-HXUWFJFHSA-N 397.527 2.767 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(NCC(C)(C)CO)nc2)C1 67587784 UGPKJSFJHVGHLR-KRWDZBQOSA-N 375.513 2.979 0 50 GFAA COc1ccc([C@@H](C)NC(=O)c2cc3ncc(Br)cn3n2)cc1 2794507 DHWACCWQLJYRRY-SNVBAGLBSA-N 375.226 2.991 0 50 GFAA COc1ccc(CN2CCN(c3noc(C(C)C)n3)C[C@@H]2CCO)c(C)c1C 72412006 UBTZSEVITBSTTQ-SFHVURJKSA-N 388.512 2.892 0 50 GFAA COc1cc(S(=O)(=O)Nc2onc(C)c2C)c(OC)cc1Br 153512348 TXRFNXYQJKDEIP-UHFFFAOYSA-N 391.243 2.872 0 50 GFAA CC(C)N1CCC(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)CC1 73095419 BOYJMECZBZPQTO-UHFFFAOYSA-N 378.561 2.730 0 50 GFAA CN1CCCC[C@H]1CCNC(=O)C1(c2ccc(S(C)(=O)=O)cc2)CCC1 219970890 RRAXXMMJAMIYDJ-KRWDZBQOSA-N 378.538 2.502 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)N1CC[C@@H]2CNC[C@@H]2C1 333081809 AVEFQMUWQBVYSZ-RTBURBONSA-N 390.487 2.963 0 50 GFAA Cc1cc2c(SCC(=O)N[C@H]3CCOC4(CCOCC4)C3)ncnc2s1 77518070 HDEWAROUSLTPLD-ZDUSSCGKSA-N 393.534 2.936 0 50 GFAA C[C@](NC(=O)C1C[C@@H]2CCC[C@H](C1)C2N)(C(N)=O)c1cccc(C(F)(F)F)c1 262569412 SEXMIEGNTHZQLD-XSNNXGJASA-N 397.441 2.676 0 50 GFAA Cc1ccc(Oc2ccc(NC(=O)c3cn(C4CCNCC4)nn3)cn2)cc1 237955269 ILFIGUCVWMSBRB-UHFFFAOYSA-N 378.436 2.951 0 50 GFAA O=S(=O)(N[C@@H]1CCN(c2ccccn2)C1)c1ccccc1OC(F)(F)F 159349681 IWBPKFNDMAVERN-GFCCVEGCSA-N 387.383 2.537 0 50 GFAA COc1ccc(N2CCN(Cc3cnc(-c4ccco4)nc3)[C@H](C)C2=O)cc1 72167496 NQUVUUUPCFGJDU-OAHLLOKOSA-N 378.432 2.983 0 50 GFAA CN1C(=O)[C@](CC(=O)N2CCC(CO)CC2)(Cc2ccccc2)c2ccccc21 71751594 FGKDZHXGHLGZRS-DEOSSOPVSA-N 392.499 2.765 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC[C@@]2(C1)C(=O)Nc1ccccc12 72125239 GPDWIAFOPGIEFP-NRFANRHFSA-N 376.416 2.651 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@H](Cn3cc(-c4ccccc4)nn3)C2)cn1 48284521 XJVHLHYNWKUHMW-INIZCTEOSA-N 376.464 2.850 0 50 GFAA CC(C)[C@@H](NC(=O)Cn1nc2c(cc1=O)CCCC2)c1nc2ccccc2[nH]1 223228953 CYUBDDSJVXCRKZ-HXUWFJFHSA-N 379.464 2.512 0 50 GFAA Cc1ccc(F)cc1C1(c2noc(-c3cnc4c(c3)c(=O)nc(O)n4C)n2)CC1 289200527 SSRISPQGJMUAAG-UHFFFAOYSA-N 393.378 2.612 0 50 GFAA COc1cc(C(=O)NCC(=O)N2CCC[C@@H](C3CC3)C2)ccc1OC(F)F 290791676 DQYDPYKIEDCQLV-CQSZACIVSA-N 382.407 2.675 0 50 GFAA Cc1cc(C)c2[nH]c(C)c(CC(=O)N3CCN(CC4CC4)[C@@H](CCO)C3)c2c1 91985969 GBYMQZLBIPTGSD-IBGZPJMESA-N 383.536 2.941 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 95517388 YNGPWBGUOQSQAD-UHFFFAOYSA-N 392.503 2.573 0 50 GFAA O=C(NCCCCN1CCCC1)[C@H]1CCC(=O)N(Cc2ccccc2F)C1 91381726 FAHPWUGGMNZGQG-SFHVURJKSA-N 375.488 2.557 0 50 GFAA Cc1nc(CN2CCN(C(=O)Nc3ccc4occc(=O)c4c3)CC2)cs1 96161673 MAIDNYWTHRZNIH-UHFFFAOYSA-N 384.461 2.908 0 50 GFAA CCN1CCN(Cc2ccc(OC[C@H](O)CN(C)Cc3ccccc3)cc2)CC1 95509166 JJRFDXPKJYWVSD-HSZRJFAPSA-N 397.563 2.696 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)N2CCN(c3ccccc3)C[C@H]2C)c1 96160003 YPPWMKAWQMATTC-OAHLLOKOSA-N 377.452 2.713 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC[C@@H](c3nccn3CCN(C)C)C2)c1C 95526839 FSXZGRQYQBSORA-QGZVFWFLSA-N 385.512 2.612 0 50 GFAA C[C@@]1(C(=O)Nc2nc3ccc(S(=O)(=O)N4CCCC4)cc3s2)CCCO1 267951424 MKCBIAHHEPHWOO-KRWDZBQOSA-N 395.506 2.588 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N[C@H]2CC[C@@H](N)CC2)nc1 240824875 QLQDNBZUGGDLGC-HDICACEKSA-N 384.528 2.903 0 50 GFAA COc1cncc([C@H](NS(=O)(=O)c2cc(C)sc2C)[C@H]2C[C@@H](O)C2)c1 244899608 ZMSUUCHGFVXLKM-HACGYAERSA-N 382.507 2.559 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1 534644150 NWJMKOJGLWAWTC-HNNXBMFYSA-N 380.452 2.898 0 50 GFAA NC(=O)Cn1ncc(N2CCC[C@@H]2c2cc(F)ccc2Cl)c(Cl)c1=O 1875294153 BRVMQOUUDPIYQB-GFCCVEGCSA-N 385.226 2.516 0 50 GFAA CC(C)C(=O)N1CCN(C(=O)NCc2cc(-c3ccc(F)cc3F)on2)CC1 873217738 QQJDYDOGODVOFU-UHFFFAOYSA-N 392.406 2.630 0 50 GFAA COc1ccccc1C(=O)N1CC[C@@H](C)[C@@H](CNC(=O)C23CCC(CC2)O3)C1 1875315183 KOQYWIAJXCSCOY-GEUKWPSDSA-N 386.492 2.621 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(Cc4ccc(F)cc4)CC3)n[nH]c21 1875394058 SXCMLYDXPSVEAK-KGLIPLIRSA-N 387.455 2.781 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)C1=NO[C@@H](c2ccccc2)C1 1875389514 QYLFLQCJIMFJAO-PZJWPPBQSA-N 389.455 2.760 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@H]1[C@@H]2CN(Cc3nc(C(F)F)no3)C[C@@H]21 1875311745 MAHJNEDPMQQMPW-YABSGUDNSA-N 398.797 2.529 0 50 GFAA C=CC(=O)N(Cc1cc(Cl)c2c(c1)OCCCO2)[C@@H]1CCCCNC1=O 1875383797 FCMQFHLIQRWTPO-OAHLLOKOSA-N 378.856 2.685 0 50 GFAA O=C(O)C1(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)COC1 1875309840 PYMIPAZWLXZYDJ-UHFFFAOYSA-N 377.444 2.789 0 50 GFAA C[C@@H](CC(=O)N[C@](C)(CNC(=O)c1cc(C2CC2)[nH]n1)C1CC1)c1ccncc1 1775997167 XHKCZWFAJMQCHF-RCDICMHDSA-N 395.507 2.891 0 50 GFAA CC(C)c1noc([C@H](C)N2CCN(C(=O)C3CC3)C3(CCOCC3)CC2)n1 1775962745 BNWHRLBYOCOUHR-HNNXBMFYSA-N 376.501 2.748 0 50 GFAA CN1CCc2[nH]nc(C(=O)N3CC[C@H](c4ccc5ccccc5c4)[C@@H](O)C3)c2C1 1565527020 BRCSLJHOTZGTHM-NQIIRXRSSA-N 390.487 2.541 0 50 GFAA CC(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCCC[C@@H]1NS(C)(=O)=O 170085055 XWFUAFXVIYPJLR-MOPGFXCFSA-N 390.553 2.946 0 50 GFAA COC(=O)c1cccc(OC)c1N(C)C(=O)C1=NN(c2ccccc2)C(=O)CC1 170603863 UHRGYVCSZKYTMV-UHFFFAOYSA-N 395.415 2.628 0 50 GFAA O=S(=O)(C[C@@H]1CCCO1)Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1 171806577 MILAQEMBNDHNLU-AWEZNQCLSA-N 394.472 2.731 0 50 GFAA O=C(Nc1ccccc1-c1nn[nH]n1)c1nn(-c2ccccc2F)c2c1CCC2 738192646 UJUYVOMASXLJSK-UHFFFAOYSA-N 389.394 2.933 0 50 GFAA CCc1ccccc1CC(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 188578546 DKFPZEQNPPRKAQ-IBGZPJMESA-N 378.538 2.645 0 50 GFAA CC(C)(C)n1cc(CNc2cccc(Cn3nc4ccccn4c3=O)c2)nn1 191392918 CLDNJBASPKEQAE-UHFFFAOYSA-N 377.452 2.503 0 50 GFAA C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)Cc1ccc(S(C)(=O)=O)cc1 1506430407 ZEOFIMTXJSNTKJ-AWEZNQCLSA-N 389.473 2.623 0 50 GFAA C[C@H]1C(=O)N2CCC[C@@H]2CN1c1nnnn1Cc1ccc(-c2ccccc2)cc1 1772706136 HORNONPLNDFTLK-OXJNMPFZSA-N 388.475 2.588 0 50 GFAA CCOCCCNC(=O)c1sc2ncnc(N[C@H](CC)COC)c2c1C 11782455 JWOUIBJGKZSJOZ-CYBMUJFWSA-N 380.514 2.993 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)c1cnccn1 12213881 DTKHCFZHTDGRNX-FQEVSTJZSA-N 394.519 2.853 0 50 GFAA CC1(C)Cc2cc(CNC(=O)[C@@H]3CCC(=O)N(Cc4ccccn4)C3)ccc2O1 12448529 GHQDRTMUIBYJOR-QGZVFWFLSA-N 393.487 2.850 0 50 GFAA CN(C)C1(CNC(=O)[C@@H]2CCC(=O)N(CCc3ccccc3)C2)CCCCC1 12582962 NWHGLFWCKRVKFW-HXUWFJFHSA-N 385.552 2.848 0 50 GFAA O=C1CC2(CCN(Cc3cccc(O)c3)CC2)OCCN1C[C@H]1CCCCO1 1857685901 ZJNQHOZFMPXJQH-HXUWFJFHSA-N 388.508 2.545 0 50 GFAA O=C(c1cn(-c2ccccc2)nn1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857696486 COGVCGNTOGNRRD-UHFFFAOYSA-N 384.443 2.898 0 50 GFAA Cc1cc(C)n(C2CN(C(=O)[C@@H]3CC(=O)N(c4nc5ccccc5s4)C3)C2)n1 1857719649 SALBQCGLNJZXOG-CQSZACIVSA-N 395.488 2.546 0 50 GFAA COc1cccc(CCNC(=O)c2nnn(Cc3ccc(F)cc3F)c2C)c1 242047855 VQRBUTNVKFWXPF-UHFFFAOYSA-N 386.402 2.894 0 50 GFAA C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 158181415 BHSDYVHYUFRWHR-CQSZACIVSA-N 396.878 2.982 0 50 GFAA N[C@@H]1CC[C@@H](C(=O)Nc2cc3c(cc2NC(=O)c2cccs2)OCCO3)C1 262610162 ARPLZXSENRSXJO-VXGBXAGGSA-N 387.461 2.838 0 50 GFAA NC(=O)COc1cccc(N[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)c1 264965517 PHENOLWWBXVTRL-INIZCTEOSA-N 393.365 2.787 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)COc3ccc(Cl)c(Cl)c3)C[C@@H]12 1704302443 LENYMNHLGLGMLD-SJLPKXTDSA-N 387.307 2.677 0 50 GFAA O=C(CCCc1ccccc1)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704329347 RVNQJMAVVDGXPQ-NFBKMPQASA-N 381.472 2.916 0 50 GFAA O=S(=O)(c1sccc1Br)N1CCC([C@H]2CCOC2)CC1 371711845 WNAFEBRCUJPOKB-NSHDSACASA-N 380.329 2.948 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1Br 4144277 TWCFGSSEBKLZLF-CYBMUJFWSA-N 385.283 2.983 0 50 GFAA Brc1cccc2c1ccn2CCNCc1cnc2n1CCOC2 2325777539 JKMTUIDMFUDVDW-UHFFFAOYSA-N 375.270 2.920 0 50 GFAA CC(C)c1nocc1C(=O)N1C[C@@H](NC(=O)COCC2CCCC2)[C@H](C)C1 2325793688 DIEPXXJTIDXFTQ-RHSMWYFYSA-N 377.485 2.582 0 50 GFAA O=C1CCCc2ccc(C(=O)N3CCOC[C@H]3Cc3ccc(O)cc3)cc2N1 2325797029 UPLKMGPOFNYMAQ-GOSISDBHSA-N 380.444 2.751 0 50 GFAA CN(C)Cc1ccsc1C(=O)N1CCc2[nH]c3ccc(F)cc3c(=O)c2C1 2325803434 GNLDGSVZNZWWGQ-UHFFFAOYSA-N 385.464 2.989 0 50 GFAA NC[C@H](CC(=O)N[C@@H]1CCCc2n[nH]cc21)c1ccc(Br)s1 2325808291 MXNOCUQDRIIIBR-GXSJLCMTSA-N 383.315 2.860 0 50 GFAA CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)N[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 248235216 DJZZFRQMSFYHDE-PCADIABFSA-N 395.503 2.926 0 50 GFAA CCCC1=C(C(=O)OCC)[C@H](c2cc(OC)c(OC)c(OC)c2)NC(=O)N1 844168 JFXOGNNXERVWME-INIZCTEOSA-N 378.425 2.684 0 50 GFAA O=C(Cc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 917467 SSXJTXTYNSFIEF-UHFFFAOYSA-N 394.880 2.542 0 50 GFAA O=C(COc1ccc(Cl)cc1)NCCNC(=O)COc1ccc(Cl)cc1 2133677 YYBBZOXEUZXLIK-UHFFFAOYSA-N 397.258 2.684 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3ncccc3F)CC1)OCC2 2356150096 LNPDDUKHIJMNEV-UHFFFAOYSA-N 386.423 2.942 0 50 GFAA CN(C)c1ncccc1C(=O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356162683 OXRNPLQWROWHOH-HSZRJFAPSA-N 392.503 2.945 0 50 GFAA CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)O 4536421 XINBRUNUJFZFGH-RTBURBONSA-N 398.459 2.750 0 50 GFAA CCc1nnc(SCC(=O)Nc2ccc(Cl)cn2)n1C[C@@H]1CCCO1 6700050 XCDFZXILBJCFDC-LBPRGKRZSA-N 381.889 2.799 0 50 GFAA O=C(CC(=O)Nc1ccc(F)c(Cl)c1)NCCCn1nnc2ccccc21 55357921 AGFWQEJZUQTORW-UHFFFAOYSA-N 389.818 2.759 0 50 GFAA Cn1cc(CN2CCC[C@@H]2c2ccc(C(=O)NCCc3c[nH]cn3)s2)cn1 20168609 WSMZAOMPCRAUFD-MRXNPFEDSA-N 384.509 2.514 0 50 GFAA CC(C)Cn1c(CN2CCC(n3cc(CCO)nn3)CC2)nc2ccccc21 55270828 VUSLGEQVIAERMQ-UHFFFAOYSA-N 382.512 2.656 0 50 GFAA COC(=O)c1sccc1NC(=O)CN1CCN(c2cccc(Cl)c2)CC1 52518703 ZZHYGTMPFZSNPF-UHFFFAOYSA-N 393.896 2.949 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CNCCc3cscn3)C2=O)cc1 67433015 MXIGDDVYSQHOHN-OAQYLSRUSA-N 387.549 2.952 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)Cn4ccnc4)C3)C2)c1 39532665 KDCHDWSONZXDML-OAQYLSRUSA-N 386.471 2.546 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2N[C@@H](C)Cn2cc(Br)cn2)cn1 328632288 LIFVECVNDNPFHW-PEYYIBSZSA-N 395.305 2.700 0 50 GFAA Cn1c(=O)n(C)c2cc(Cn3ccnc3-c3ccc(-n4ccnc4)cc3)ccc21 72146860 PPOSDUZZPQCGQZ-UHFFFAOYSA-N 384.443 2.975 0 50 GFAA O=C(N[C@H]1CC(=O)N(CCc2ccc(F)cc2)C1)c1cccc2cccnc12 72140057 ARTNSXDGCQMDAA-SFHVURJKSA-N 377.419 2.947 0 50 GFAA O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cnn(-c2ccccc2F)c1-n1cccc1 378199229 IPRLCRFZEPMBKC-CQSZACIVSA-N 390.422 2.813 0 50 GFAA O=C(CCc1cc2n(n1)CCNC2)Nc1ccc2c3c([nH]c2c1)C(=O)CCC3 72468232 BQZYLMFVCAVCCH-UHFFFAOYSA-N 377.448 2.558 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)Nc3cccc(S(C)(=O)=O)c3C)cn2)n1 133424436 SYMFUNYZOTUHRI-UHFFFAOYSA-N 384.461 2.848 0 50 GFAA O=C(NCC1CC1)[C@H]1CCCN([C@@H]2CCN(c3cccc(Cl)c3)C2=O)C1 177031321 ANVMYRSXBRZAMK-MAUKXSAKSA-N 375.900 2.684 0 50 GFAA Cc1cc2cc(C(=O)N3CCCn4nc([C@@H](O)CN(C)C)cc4C3)ccc2o1 221408953 URNBCLXLUJVYLE-IBGZPJMESA-N 382.464 2.579 0 50 GFAA CCOc1ccccc1CN(CC)C(=O)NC(C)(C)CN1CCN(C)CC1 426399010 KJFSVLYSMJCYPM-UHFFFAOYSA-N 376.545 2.643 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NCCc3ccccc3)cc12 20776308 LUNNUUOYTHQCEO-UHFFFAOYSA-N 396.447 2.599 0 50 GFAA Cn1ccc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)n1 91663607 CSKOVIYMDWRCNO-UHFFFAOYSA-N 380.492 2.508 0 50 GFAA Nc1nc2c(c(C(=O)N3CCC[C@H](c4cccc(C(=O)O)c4)C3)n1)CCCC2 95370332 NNGHVYNMQRADCH-HNNXBMFYSA-N 380.448 2.656 0 50 GFAA CC(C)O[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91871620 BGTDTORJFKIBMH-GOSISDBHSA-N 387.524 2.669 0 50 GFAA O=C(O)CN1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95511608 SIFDCPHQHSUKKO-UHFFFAOYSA-N 380.872 2.940 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccc4ncsc4c3)C2)CCC1=O 92107395 ZPYAGHCHIHUBNA-HXUWFJFHSA-N 387.505 2.788 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(CC(=O)N(Cc2ccco2)c2ccccc2)C1 298592706 ZOCADMKTJMCDJQ-QGZVFWFLSA-N 390.505 2.569 0 50 GFAA O=C(CCCc1cnn[nH]1)N1CCC(c2nccc(-c3ccccc3)n2)CC1 952891879 JVSYTABKQKBUNB-UHFFFAOYSA-N 376.464 2.991 0 50 GFAA Cc1ccc(C(=O)N2CCN(C3CN(C(=O)C4CCC5(CC4)CC5)C3)CC2)cc1 1875328565 YWJGVTKUIYLLEF-UHFFFAOYSA-N 395.547 2.934 0 50 GFAA COc1cccc(N2CCC(N3CCN(c4ncnc(C)c4C)CC3)CC2)c1 952970972 FAEUXDOSOIWULY-UHFFFAOYSA-N 381.524 2.893 0 50 GFAA O=C(N=c1cc[nH]cc1)c1ccc(CNC(=O)c2ncoc2[C@@H]2CCCO2)cc1 1339298059 SGRFGSJYVCGJMI-KRWDZBQOSA-N 392.415 2.525 0 50 GFAA Cc1oncc1S(=O)(=O)N1C[C@@H]2CC[C@H]1CN(CCCc1ccccc1)C2 1565513405 VOWWPADRRCNUEQ-MOPGFXCFSA-N 389.521 2.701 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](N(C)c3ncc(C(N)=O)cc3Cl)C2)c1 170651621 DEJWZWKVYJIEGQ-ZDUSSCGKSA-N 390.871 2.566 0 50 GFAA COc1nccnc1N1CCC(CNC(=O)Cc2ccc(F)cc2Cl)CC1 1506414017 MTILYANEGCMKRQ-UHFFFAOYSA-N 392.862 2.853 0 50 GFAA OC1CCN(c2ccnc(NCc3nc(-c4ccccc4Cl)no3)n2)CC1 1529126673 MBZYKWDFBGDHJJ-UHFFFAOYSA-N 386.843 2.753 0 50 GFAA O=C(COc1ccccc1)N1CCCN(Cc2cnc(-c3ccco3)nc2)CC1 1772809830 GAQBFFLAJNXVIY-UHFFFAOYSA-N 392.459 2.850 0 50 GFAA COC(=O)[C@@H](NC(=O)C1CCN(c2nc(C)c3cc(C)ccc3n2)CC1)C(C)C 11969342 JNKYRFPLLJBEQT-IBGZPJMESA-N 398.507 2.777 0 50 GFAA CCCN1C[C@@H](n2ccnc2-c2cnc(=NCc3ccccc3)[nH]c2)CC1=O 1857670056 NLPBJWPAUHBLCX-SFHVURJKSA-N 376.464 2.558 0 50 GFAA CNS(=O)(=O)c1ccc(CNC(=O)[C@@]2(C)CCCc3ccccc32)s1 159506696 NNHJJJBYLHQRDO-SFHVURJKSA-N 378.519 2.567 0 50 GFAA FC(F)(F)c1ccc(-n2nnnc2CN2CCc3nc[nH]c3C23CCC3)cc1 931679130 KMNYIHLHRWOVSP-UHFFFAOYSA-N 389.385 2.842 0 50 GFAA O=C(O)C[C@H](NS(=O)(=O)c1cccc2nsnc12)c1ccc(Cl)cc1 4126539 SGQLMLKFYNQNOY-LBPRGKRZSA-N 397.865 2.839 0 50 GFAA CC(C)Cc1nc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@@H](CO)C4)cc2n1CCCN 2100482215 ICJOFFFUGSKBGQ-LUPIEILUSA-N 398.551 2.959 0 50 GFAA Cc1ccc(C(=O)NCCC(=O)OCc2nnc(-c3ccccc3F)o2)c(O)c1 2325748033 IDYOGMHXKZFPNV-UHFFFAOYSA-N 399.378 2.753 0 50 GFAA CC(C)(C)OC(=O)NC[C@H]1C[C@@H]([S@](C)(=O)=NC(=O)CCc2ccncc2)C1 2325813132 ORMLRSBGVKKIQP-KSRHRBNTSA-N 395.525 2.942 0 50 GFAA CCC[C@@H](CNS(=O)(=O)c1c(OC)ccc(Br)c1F)OC 2325874471 NRHSIZBGODVCJN-VIFPVBQESA-N 384.267 2.690 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H]2COc3cc(F)c(Br)cc32)CC1 2325881968 BTQKVZRSKBLRRY-AWEZNQCLSA-N 397.244 2.563 0 50 GFAA CCOc1ccc(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 100618977 UCWFVPLGCOXIMK-FQEVSTJZSA-N 395.459 2.666 0 50 GFAA NC(=O)c1ccc(-n2nnnc2SCc2ccccc2Br)cc1 1144901 WMQOJGYLNHNREV-UHFFFAOYSA-N 390.266 2.816 0 50 GFAA CCOC(=O)CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 2696518 VOILOQIFQZXTJM-UHFFFAOYSA-N 382.482 2.533 0 50 GFAA Cn1ncc(Cl)c1C(=O)OCC(=O)Nc1nc(-c2ccccc2)cs1 2741774 WMUGGWLLZQRHSK-UHFFFAOYSA-N 376.825 2.993 0 50 GFAA CCOC(=O)c1cccc(NC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)c1 4728046 FMMVDBLVLVRXBL-UHFFFAOYSA-N 385.811 2.809 0 50 GFAA COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc(OC)c(OC)cc2Cl)C1=O 4951972 HNGMQXOAWCIWNP-VVESDKHQSA-N 385.825 2.955 0 50 GFAA C[C@@H]1CCCN(C(=S)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)C1 6368673 NECVLXJLTKVCDJ-CYBMUJFWSA-N 391.522 2.706 0 50 GFAA CCOCCCNC(=O)c1sc2ncnc(NC[C@H]3CCCO3)c2c1C 12217477 RAEYRAJBGZKHIP-CYBMUJFWSA-N 378.498 2.747 0 50 GFAA COc1ccccc1CCNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2OC)C1 12596692 PGGBWXLPUWUENQ-LJQANCHMSA-N 396.487 2.801 0 50 GFAA Cc1cc(C)nc(CCNC(=O)c2cc(COc3cncc(Cl)c3)on2)n1 15069856 LJIMGHLHWNSWIW-UHFFFAOYSA-N 387.827 2.681 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)c1 16606277 QKOVJBGTAGYYSL-UHFFFAOYSA-N 377.466 2.639 0 50 GFAA CN1c2cnc(NC(=O)c3cccs3)nc2-c2sccc2S1(=O)=O 19894259 USLRETHTOKJNSE-UHFFFAOYSA-N 378.460 2.657 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3F)cc2CNCc2n[nH]c(O)n2)cc1 20206617 JXQGCZMFNPHQRA-UHFFFAOYSA-N 394.410 2.801 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN([C@H]2CCCC[C@H]2OC)CC1 20228036 DDSPTLXNWPWAQQ-ZWKOTPCHSA-N 378.513 2.788 0 50 GFAA CC(C)(C)c1nnc(NC(=O)N2CCCN(C(=O)c3ccoc3)CC2)s1 20857378 DDBXVFKTDASVAR-UHFFFAOYSA-N 377.470 2.809 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@H]3CN(S(=O)(=O)C(C)C)CC[C@@H]32)cs1 43631946 QTJNPHZLLSCDQR-HOCLYGCPSA-N 398.550 2.615 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)N2CCc3ccccc3C2)n1 44891450 JQXVEPOHGSRJMS-UHFFFAOYSA-N 393.418 2.643 0 50 GFAA CC1(C)CC(CC(=O)N2CCC(n3cc(C(C)(C)N)nn3)CC2)CC(C)(C)N1 48327167 FQXSAMGEADXHQF-UHFFFAOYSA-N 390.576 2.582 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(Cc3cscn3)CC2)C1 71746464 PINRPRFYOVYWTH-QGZVFWFLSA-N 399.564 2.531 0 50 GFAA CCn1ccc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n1 71763745 TUGQVUZYEMKVTP-IBGZPJMESA-N 386.471 2.941 0 50 GFAA CN(Cc1nc(-c2ccccn2)no1)C(=O)CN1CC[C@@H](c2ccccc2)C1 82126403 DNBKSAYWSVCSNW-QGZVFWFLSA-N 377.448 2.580 0 50 GFAA O=C(NCCc1nc(-c2ccccn2)no1)c1c[nH]nc1-c1cccc(F)c1 91769264 QLRKJIFPKXZLLC-UHFFFAOYSA-N 378.367 2.633 0 50 GFAA O=C(NCCNc1cccnc1)[C@@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91943338 AEHVVCXYFJZITJ-MRXNPFEDSA-N 386.883 2.702 0 50 GFAA O=C(Cc1cc(=O)[nH]nc1O)N1CCCC(c2ccccc2)(c2ccccc2)C1 95527270 RGTRBRUALWUHPU-UHFFFAOYSA-N 389.455 2.627 0 50 GFAA Cc1c(CC(=O)N2CCCNCC2)c2c(n1Cc1ccccc1)CCCC2=O 95529919 GQFQPDBTBMMTIW-UHFFFAOYSA-N 379.504 2.728 0 50 GFAA COc1ccc(CNC(=O)C2CCN(C(=O)Nc3ccc(F)nc3)CC2)cc1 96142074 YUWYMVZFDQWKNA-UHFFFAOYSA-N 386.427 2.790 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N3CC[C@]4(CC(=O)c5ccccc5O4)C3)c2n1 97655411 LXABVENBFHWPFL-NRFANRHFSA-N 376.416 2.596 0 50 GFAA c1cc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c2cc[nH]c2c1 112505980 BYMWZUKNHQOEEV-SFHVURJKSA-N 392.507 2.553 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N[C@H]2CCN(c3ccccc3OC)C2)cc1 120429375 ZMHAWZLUXKSCBB-KRWDZBQOSA-N 382.464 2.845 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1 120933151 JPAAYWNQQPKMPV-KBPBESRZSA-N 386.351 2.589 0 50 GFAA C[C@@H]1CN(C(=O)Nc2cccc(N3CCOC3=O)c2)CCN1CC(F)(F)F 135540526 OFCSTZDZQWYNQO-GFCCVEGCSA-N 386.374 2.744 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCN([C@H](C)c3ccccn3)CC2)[nH]n1 152654110 KPZFGYCAMNCACT-MRXNPFEDSA-N 391.475 2.999 0 50 GFAA O=C(NS(=O)(=O)c1ccc(C(F)(F)F)cn1)C1(c2ccccc2F)CC1 158851153 FIMMFDVFJMMRMZ-UHFFFAOYSA-N 388.342 2.776 0 50 GFAA Cc1ccc(NC(=O)[C@H](C)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)c(C)c1 170599758 UGKOHVPSRFHPLJ-DLBZAZTESA-N 391.512 2.856 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)cc1 171988720 QJRABYGRKCJWPK-TZIWHRDSSA-N 393.487 2.614 0 50 GFAA CN(C[C@H]1CCOC1)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 176220688 GFMSVQOPWLSXEH-WBVHZDCISA-N 385.430 2.958 0 50 GFAA COc1cccc2[nH]cc(CCNC(=O)N[C@@H]3CCN(c4ncccc4F)C3)c12 181474300 QQIVYNKDSMUSRT-OAHLLOKOSA-N 397.454 2.831 0 50 GFAA NC(=O)c1c[nH]c(C(=O)N[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2)c1 191472140 FAKLEUVMIXCVIG-GFCCVEGCSA-N 381.263 2.819 0 50 GFAA CCCCc1nc(NC(=O)c2cnc3c(c2)c(C)nn3C)c(C(=O)OCC)[nH]1 191962457 YCOFPJVQNXCQQX-UHFFFAOYSA-N 384.440 2.771 0 50 GFAA CC(C)(C)c1nc2ccc(S(=O)(=O)Nc3nc4ncccn4n3)cc2s1 225427157 YWEPBJPMJTZVSO-UHFFFAOYSA-N 388.478 2.832 0 50 GFAA CCC(CC)(CNC(=O)[C@H](CCSC)NC(=O)c1cccc(C)c1)C(=O)O 241719802 QPSXVJAPMBQQQW-INIZCTEOSA-N 394.537 2.854 0 50 GFAA CC(C)C[C@]1(CO)CCCN1CC(=O)NCCc1nc2ccccc2s1 252482623 DLHWZOCCUNDBRL-FQEVSTJZSA-N 375.538 2.828 0 50 GFAA CC[C@H](C)[C@H](NC(=O)[C@H]1Cc2ccccc2CN1)C(=O)NCc1ccc(C)cc1 253487814 QXXLHODIWNSIJU-WTOYTKOKSA-N 393.531 2.857 0 50 GFAA O=C(NCc1cc(F)cc(F)c1)c1nnn2c1CO[C@H](c1ccc(F)cc1)C2 263615567 DBPNWMBIYCMOIJ-KRWDZBQOSA-N 388.349 2.897 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CCOC[C@H]3C(=O)O)ccc21 268986352 PZZKQFMZANKBLF-ZDUSSCGKSA-N 385.342 2.562 0 50 GFAA Cc1c(NCC(C)(C)C)cccc1C(=O)N1CCC[C@](O)(Cn2ccnn2)C1 284977525 YLFCMVCHLRTASZ-OAQYLSRUSA-N 385.512 2.712 0 50 GFAA O=S(=O)(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 285180545 BQPLCJBDKCLNDM-SQNIBIBYSA-N 378.881 2.928 0 50 GFAA O=C(CCc1nc(C2(c3ccc(F)cc3F)CCCC2)no1)N1CCOCC1 289239935 XKTOPYXMIDXGOM-UHFFFAOYSA-N 391.418 2.999 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)c1cc(-c2ccncc2)[nH]n1 409414273 OOGZCDNDXMFHDM-RXVVDRJESA-N 397.523 2.825 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)N(Cc1ccccn1)C[C@@H]1CCCO1 426368303 LTKYZAOMKGSGRL-KRWDZBQOSA-N 383.496 2.964 0 50 GFAA COc1cncc(-c2ccc(C(=O)N3CCC4(CCC(=O)NC4)CC3)cc2)c1 426428408 VEVVKINLKOAXPL-UHFFFAOYSA-N 379.460 2.890 0 50 GFAA Cc1ccc(-c2ccc(CCC(=O)N3CC[C@]4(CN(C)C(=O)CO4)C3)o2)cc1 426489845 BCTJFEMMYHHZQA-QFIPXVFZSA-N 382.460 2.647 0 50 GFAA NCCOc1ccc(F)cc1C(=O)NC[C@H]1CCN(c2ccccc2F)C1 426627854 UYKNOKFDHAIABJ-CQSZACIVSA-N 375.419 2.559 0 50 GFAA COc1ccc(N2CCN(C(=O)NCc3ccc4c(c3)CCO4)[C@@H](C)C2=O)cc1 426698513 XFIZZZIAHFWSEL-HNNXBMFYSA-N 395.459 2.577 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)c2onc3c2CCCC3)CC1)C1CC1 426705705 NXZOPKUMUOJCOR-UHFFFAOYSA-N 383.452 2.576 0 50 GFAA CCn1ccnc1CN(C(=O)c1ccc2c(c1)CCN2)[C@@H]1CC12CCNCC2 435575303 QKKKEJIFICSFGG-LJQANCHMSA-N 379.508 2.656 0 50 GFAA O=C(c1sccc1F)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 498534449 OIDWUDNTFLONFF-AWEZNQCLSA-N 394.493 2.884 0 50 GFAA Cc1nccn1CC1(CNC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)CC1 534651752 OFPUCVZPVGXOPR-IBGZPJMESA-N 383.496 2.758 0 50 GFAA CC[C@H](NC(=O)N(C)Cc1cnn(-c2cccc(OC)c2)c1)c1nc(C)no1 584889506 KAQIGNJRVZOPIK-KRWDZBQOSA-N 384.440 2.865 0 50 GFAA Cc1ccc(CN2CCC(CNC(=O)N3CCC4(CC3)COC(=O)O4)CC2)o1 584895547 GXVSJTBRBBGOBT-UHFFFAOYSA-N 391.468 2.511 0 50 GFAA O=C(CNC(=S)NCc1cccc(C(F)(F)F)c1)NCc1ccccc1 726460840 INORXCLQGKPDNE-UHFFFAOYSA-N 381.423 2.986 0 50 GFAA FC(F)(F)[C@]1(c2nc(-c3n[nH]c(C4CC4)n3)no2)CCN(c2ccccn2)C1 952893543 JDFNATRUADOLNB-MRXNPFEDSA-N 391.357 2.838 0 50 GFAA COc1cccc(SCC(=O)Nc2ccccc2N2C(=O)N[C@H](C)C2=O)c1 1506414186 MNMYFFDZMKKMLV-GFCCVEGCSA-N 385.445 2.871 0 50 GFAA O=S(=O)(CCOc1ccc(F)cc1)N1CCC(c2ccnc(O)c2)CC1 1772817891 ZVAKXUMDNIWAJZ-UHFFFAOYSA-N 380.441 2.515 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2cn([C@H]3CC[C@@H](N)CC3)nn2)C[C@H](C(C)C)O1 1857716983 UJASAJXUBRTRBG-SFNKJDCFSA-N 377.533 2.776 0 50 GFAA CC(C)(C)c1nc(N2CC(O)C2)c2c(n1)[C@]1(CCCN(C(=O)C3CCC3)C1)CC2 1875240104 IJKLHTBCIYVUGF-HSZRJFAPSA-N 398.551 2.562 0 50 GFAA CSc1nc(C)c(S(=O)(=O)NC(=O)c2cc3sccc3cn2)s1 1875357824 YDJFUSXZKVJLRS-UHFFFAOYSA-N 385.517 2.902 0 50 GFAA Cc1cccc2nc(COCC(=O)Nc3n[nH]c(-c4ccccc4F)n3)[nH]c12 2100554918 HVYUJVXHEFXYQQ-UHFFFAOYSA-N 380.383 2.951 0 50 GFAA Cc1[nH][nH]c(=NC(=O)[C@@H]2CCCN(C3CCOCC3)C2)c1-c1ccc(F)cc1 2100556846 JYEQNASQVIUGIQ-MRXNPFEDSA-N 386.471 2.776 0 50 GFAA Cc1[nH]nc2c1CC[C@@H](NC(=O)N[C@H]1CN(Cc3ccccc3)C(C)(C)C1)C2 2325828445 HPZQGXBTEGBSDI-QZTJIDSGSA-N 381.524 2.928 0 50 GFAA O=C(N[C@H](CNC(=O)[C@@H](O)C1CCCC1)c1ccccc1)[C@@H]1CCCCS1 2325860461 IXKKADMKSPHYAH-QYZOEREBSA-N 390.549 2.797 0 50 GFAA CC[C@]1(O)CCC[C@H]2CN(C(=O)CN3CCN(c4cccc(C)c4)CC3)C[C@H]21 2356149582 KIBLHJYYQYWXRQ-WPYKKVEZSA-N 385.552 2.517 0 50 GFAA COc1ccccc1CCNC(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356164682 CNGZFAXNNIRPDF-UHFFFAOYSA-N 386.517 2.881 0 50 GFAA CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1-c1ccncc1 779256 RMSBIMWEEIKOOX-UHFFFAOYSA-N 397.460 2.862 0 50 GFAA CCNC(=O)C[C@H]1C(=O)N(c2ccc(C)cc2)C(=O)N1Cc1ccc(F)cc1 1127930 OSRSYOPFXTXZBT-SFHVURJKSA-N 383.423 2.998 0 50 GFAA CN1CCN(NC(=O)c2ccc(COc3ccccc3Br)o2)CC1 4395669 BTIXOVJULJCUQC-UHFFFAOYSA-N 394.269 2.513 0 50 GFAA CCc1nc(C)cn1S(=O)(=O)c1cc(OC)c(Br)cc1OC 7425012 DPSDHWBUQYOTAQ-UHFFFAOYSA-N 389.271 2.771 0 50 GFAA CCOC(=O)[C@]1(Cc2cccc(OC)c2)CCCN(C(=O)C2CCOCC2)C1 12209370 IJHVXJJBMDVHJQ-QFIPXVFZSA-N 389.492 2.836 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1ccco1)C2 14742039 BSVPVGXQDIQNMI-OAHLLOKOSA-N 388.537 2.722 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3nc4ccccc4[nH]3)CC2)C1 15061570 PDPBXNFPOCWDAZ-MRXNPFEDSA-N 381.524 2.518 0 50 GFAA COc1ccccc1-n1cc(CN2CCN(CC=C(C)C)[C@@H](CCO)C2)cn1 20918125 VSWIATXBQYNFLY-FQEVSTJZSA-N 384.524 2.716 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@H](Cn4cc(C5CC5)nn4)C3)c(C)nc2c1 48121822 AAMRNNBESAPXGX-INIZCTEOSA-N 378.480 2.972 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4nc(C)cc4C)ncn3)CC2)c(C)c1 67602007 IQAWTZOYMWNNPV-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)N[C@@H](CO)C(C)C)co3)ccc2s1 67679204 IAVLBJJHURFWIN-AWEZNQCLSA-N 375.450 2.918 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc(C)ccc3C)CC2)C1 67757000 IPLQMZSJIHHAGJ-HXUWFJFHSA-N 387.568 2.742 0 50 GFAA Cc1ccc2nc([C@H]3CCCN3Cc3cc(=O)n4cccc(O)c4n3)[nH]c2c1 72134297 SNZHNHYJBBSRQA-QGZVFWFLSA-N 375.432 2.922 0 50 GFAA COc1ccc(C2(C(=O)N[C@H]3CC(=O)N(Cc4ccc(F)cc4)C3)CC2)cc1 72149084 XEFDTSPMJSUBEB-SFHVURJKSA-N 382.435 2.783 0 50 GFAA C[C@H](CN(C)C)NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1 72166003 GVHNRKZCOJDGNH-LJQANCHMSA-N 379.548 2.765 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(C/C=C/c1ccccc1)CCN2Cc1ccccc1 72425218 CXICIFBYZFDDPD-VFPWRSFOSA-N 382.529 2.683 0 50 GFAA CC(C)C(=O)N1CCc2ccc(S(=O)(=O)N(C)Cc3nccs3)cc2C1 77376746 YLLWEKMBLRAMMG-UHFFFAOYSA-N 393.534 2.505 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)[C@@H](F)c1ccccc1)CC2 91849210 ATUNNWHZOPHHHK-FQEVSTJZSA-N 389.515 2.880 0 50 GFAA O=C([C@H]1CCC(=O)N(C2CC2)C1)N(CCCO)Cc1cccc2ccccc12 91987030 HOIIFBUHKLLAIU-IBGZPJMESA-N 380.488 2.952 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC[C@H](c3cccc(C(=O)O)c3)C2)cn1 95357272 FYWHOYCSTYPAKA-INIZCTEOSA-N 377.466 2.560 0 50 GFAA CN1CCCCC[C@@H]1C(=O)N1CCN(CCCOc2ccc(F)cc2)CC1 95370832 STAOWWQBWYRCIQ-HXUWFJFHSA-N 377.504 2.613 0 50 GFAA CCc1nsc(N2CCN(C(=O)c3cnc(-c4ccccc4)nc3C)CC2)n1 123630748 KZNBCSFYVREZAG-UHFFFAOYSA-N 394.504 2.828 0 50 GFAA O=C(CN1CCN(c2cnccn2)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 144295439 MEWZEEMBCHPDET-UHFFFAOYSA-N 399.804 2.910 0 50 GFAA Cc1ccc(C)c(OC2CCN(C(=O)NCC3(CS(C)(=O)=O)CC3)CC2)c1 175496057 KKWFANLCSRFBKP-UHFFFAOYSA-N 394.537 2.681 0 50 GFAA CCN(C)C[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1 177870529 GTIPSVPKUAOJFQ-SFHVURJKSA-N 386.540 2.583 0 50 GFAA CCN(C(=O)Nc1cccc(C(=O)NC)c1)[C@@H]1CCN(c2ccccc2)C1=O 178005971 HBOLJUOMOGVLFF-GOSISDBHSA-N 380.448 2.706 0 50 GFAA CCn1cc(C2CCN(CC(=O)Nc3ccccc3C(=O)NC(C)C)CC2)cn1 195501438 VUQUMBLARYFTKG-UHFFFAOYSA-N 397.523 2.859 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)c3ccc(O)c(Cl)c3)CC[C@@H]21 216519492 FICMEHXICRODRP-ZBFHGGJFSA-N 380.872 2.535 0 50 GFAA COc1cccc(-n2cc([C@H](C)NC(=O)CN(C)Cc3cccnc3)cn2)c1 219117949 TWSHYHOXFOSZTK-INIZCTEOSA-N 379.464 2.585 0 50 GFAA C[C@@H](Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1)C(=O)O 262797351 NXECUWGFKPVBDI-RDJZCZTQSA-N 387.480 2.816 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(Cc3ccc(Br)s3)C2=O)nn1 328614318 VPLKTQDYHSZGCA-LLVKDONJSA-N 398.286 2.551 0 50 GFAA Cc1cc(NC(=O)C2CCN(C(=O)c3cc(C)oc3C(F)(F)F)CC2)no1 331817763 GSNIZUAXYMEOTF-UHFFFAOYSA-N 385.342 3.394 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@@H]4CO)csc3C2)nc1 426387980 QTNYCNDMAGFITP-QGZVFWFLSA-N 385.533 2.861 0 50 GFAA CN1CCCN(C(=O)c2ccc(-c3ccccc3O)cc2)CC12CCNCC2 426435330 GYXZCISKFXWBKB-UHFFFAOYSA-N 379.504 2.959 0 50 GFAA C[C@H](NC(=O)c1ccc(-c2cncc(C(=O)O)n2)cc1)c1nc(C2CC2)no1 426594839 LHYBBQUWNVIFST-JTQLQIEISA-N 379.376 2.593 0 50 GFAA O=C(NC[C@@H]1CCCN(CCO)C1)N1CCC(Oc2ccccc2Cl)CC1 534651028 WUZYWADYKNCEPV-INIZCTEOSA-N 395.931 2.597 0 50 GFAA O=C(Cc1ccc(Cl)cn1)Nc1ccc(-n2ncc3c(O)ncnc32)cc1 785840480 OTLANPUCDXRICW-UHFFFAOYSA-N 380.795 2.751 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@@H]1CCCN(C(=O)C(C)C)C1 824742923 YLIMKGXTQMSSMS-MRXNPFEDSA-N 382.526 2.744 0 50 GFAA COc1cccc2c1OCCCN(C(=O)CN1CCOc3ccccc3C1)C2 824804693 FWHGZIUHCSJQBD-UHFFFAOYSA-N 382.460 2.701 0 50 GFAA C[C@H](C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1)n1cncn1 837230728 FSYVIOKXSHLGTM-NVXWUHKLSA-N 385.468 2.660 0 50 GFAA N[C@@H]1CCCCCC[C@H]1C(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894176 MRYVULVLPAYMLK-RTBURBONSA-N 394.523 2.937 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)[C@H]4CCCCCC[C@H]4N)CC3)n2)cn1 952894602 OFFCIDNCZQQCND-RBUKOAKNSA-N 396.539 2.881 0 50 GFAA CC(C)Cn1nccc1NC(=O)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 1073347864 UKGGPZGDUJDQFO-CVEARBPZSA-N 386.452 2.650 0 50 GFAA CCc1cc(N2CCN([C@H](C(=O)O)c3cc(Cl)ccc3OC)CC2)ncn1 1506415174 MGKDQFFQTJAVSU-SFHVURJKSA-N 390.871 2.649 0 50 GFAA CCOc1ccc(C(=O)N2CCCN(C(=O)c3n[nH]c4ccccc34)CC2)cc1 1529186446 ZQACKTJGZPIXJS-UHFFFAOYSA-N 392.459 2.950 0 50 GFAA CNC(=O)c1ccc(CNC(=O)[C@H](Cc2ccc(O)cc2)c2ccccc2)o1 1772701919 PUIIDYSVJDJVBT-LJQANCHMSA-N 378.428 2.988 0 50 GFAA O=C(NCc1cccn2nccc12)c1cccc(OCC(=O)N2CCCCC2)c1 1772819306 ICQLSJMGUTUMTK-UHFFFAOYSA-N 392.459 2.656 0 50 GFAA COc1c(N2C[C@@H]3CCCN[C@@H]3C2)c(C)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 1857526847 AYDPRSBEZLFMKY-SUMWQHHRSA-N 397.475 2.540 0 50 GFAA NC[C@H]1Cc2cc(F)ccc2N(C(=O)COCc2nc(-c3ccccc3)no2)C1 1875314927 AKRJHMAQYULFOD-CQSZACIVSA-N 396.422 2.557 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nc2ccc(OCc3nc[nH]n3)cc2)cc1 1875373976 WWJBPPKSERRTKZ-UHFFFAOYSA-N 377.404 2.785 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1ncc(Cc2ccccc2)o1 1875401644 NNUMUWNDAFCJSV-IAGOWNOFSA-N 393.447 2.713 0 50 GFAA O=C1CCNc2ccc(OC(=O)c3sc(N4CCOCC4)nc3Cl)cc21 2325872005 DIXDLQQBKNUWIA-UHFFFAOYSA-N 393.852 2.851 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCO[C@@H](c2ccccn2)C1 2356145206 GEXUZMPLZLOGQK-QGZVFWFLSA-N 399.516 2.508 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCO[C@@H](c2cccnc2)C1 2356151241 YQEWUPSJAWDAQY-QGZVFWFLSA-N 399.516 2.508 0 50 GFAA O=C1C[C@H](c2ccccc2)NCCCCN(C(=O)c2ccccn2)CCCN1 2356162262 FETJWIFIFTYUCN-HXUWFJFHSA-N 380.492 2.545 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2cc(C)nc3ccccc23)C1=O 2356168324 YTULSXSWTNFAQE-JOCHJYFZSA-N 381.476 2.787 0 50 GFAA COC(=O)C1=CN(C)C=C(C(=O)OC)C1c1cc(Br)ccc1OC 1170467 HWMMBYZYPCCNDS-UHFFFAOYSA-N 396.237 2.601 0 50 GFAA CCCCN(C)CCCNC(=O)CN1N=C(c2ccc(Cl)cc2)CCC1=O 4687649 JBTFTXZXVBRTHF-UHFFFAOYSA-N 392.931 2.905 0 50 GFAA CCCNC(=O)c1ccccc1NC(=O)CCCN1C(=O)c2ccccc2C1=O 7644067 MUVVGDVPLVKZKM-UHFFFAOYSA-N 393.443 2.841 0 50 GFAA COC(=O)[C@H]1CCc2c(nn(CCCSC)c2I)C1 225824685 SODQYKBZFRFRSW-VIFPVBQESA-N 394.278 2.519 0 50 GFAA Cc1ccc(CC(=O)NCc2csc(NC(=O)Cc3ccc(C)nc3)n2)cn1 114127022 MTXUTPPTUDSVBN-UHFFFAOYSA-N 395.488 2.590 0 50 GFAA COC(=O)c1ccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)cc1 10454387 HTAYJLVTUQMDBF-INIZCTEOSA-N 382.416 2.634 0 50 GFAA O=C1N[C@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cccnc1 67883948 XLTRVZMPTREUHI-JOCHJYFZSA-N 378.476 2.505 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)Nc1nnc([C@H]2CCCO2)s1 36360183 LLCAFBKMYVKSKW-CQSZACIVSA-N 385.449 2.518 0 50 GFAA CCCOCCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1cc(F)cc(F)c1 4987300 GOBWECMOYZHYDG-INIZCTEOSA-N 378.379 2.815 0 50 GFAA O=C(c1ccccc1)[C@@H]1CCCN(C(=O)c2ccc3c(c2)ncn3CCO)C1 77439936 PNISLWFEPVZSQI-GOSISDBHSA-N 377.444 2.764 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)C12CCC2 152497314 VWOMVCPSBZHZLN-QZTJIDSGSA-N 385.439 2.758 0 50 GFAA O=C1COc2cc(NC(=O)NCc3ccc(-n4ccnc4)c(F)c3)ccc2N1 127306366 ABVGSGYZENIXJG-UHFFFAOYSA-N 381.367 2.664 0 50 GFAA O=C1CC2(CCN(C(=O)[C@@H]3CCOC3)CC2)CN1Cc1ccc(Cl)cc1 77357107 YQORTOGZLREPOA-MRXNPFEDSA-N 376.884 2.718 0 50 GFAA CN1C(=O)C[C@@H](C(=O)NCc2ccc(C(=O)O)cc2)[C@H]1c1cccc(Cl)c1 237063346 NKZJLTSTHRJWTI-SJLPKXTDSA-N 386.835 2.874 0 50 GFAA COC(=O)c1sc2cnc(S(C)(=O)=O)nc2c1-c1cc(F)ccc1OC 215979773 QPNGNXMMUXZFPC-UHFFFAOYSA-N 396.421 2.696 0 50 GFAA CCc1c(C(=O)N2CC[C@]3(CCCN(CCOC)C3=O)C2)[nH]c2ccccc12 72158068 KLCMTSGDFQBONL-JOCHJYFZSA-N 383.492 2.831 0 50 GFAA CCc1ccc(C(=O)N[C@@H]2CCOC[C@H]2Oc2ccc(C(=O)O)cc2)s1 218705016 QNFACHJKWIMWRU-HZPDHXFCSA-N 375.446 2.975 0 50 GFAA C[C@H](NC(=O)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc(C(F)(F)F)c1 241869067 SUEPTQLNXRRMPH-MAZHCROVSA-N 383.414 2.578 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)c3snnc3C3CC3)sc2c1 291149337 ZHESCDILHJDMTG-UHFFFAOYSA-N 380.476 2.681 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(Cc4ncccn4)C3)C2=O)c1OC 426550393 ITKPFKQMBLEKAZ-QFIPXVFZSA-N 396.491 2.509 0 50 GFAA CN1CC(=O)N(c2cccc(NC(=O)N3CCC[C@H]3c3ccccn3)c2)C1=O 97568786 KDSFKTRTPUNSJP-KRWDZBQOSA-N 379.420 2.849 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(Cc2cnn(C(C)C)c2)CC1 96165805 LDQNDQWQLHWIQH-UHFFFAOYSA-N 382.516 2.700 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N1Cc2cnc(C(C)(C)C)nc2C1 97635012 MGCFEZWDLDTBRY-AWEZNQCLSA-N 380.448 2.751 0 50 GFAA COc1cc2c(cc1CN1C[C@H]3CC[C@@H]1CN(Cc1cccnc1)C3)OCO2 95374992 KBBVNSMCJVBQIW-PKOBYXMFSA-N 381.476 2.915 0 50 GFAA COc1ccccc1COC1CCN(C(=O)c2n[nH]c3ccccc3c2=O)CC1 180284109 VUQFXFNZXIOOOM-UHFFFAOYSA-N 393.443 2.753 0 50 GFAA CC(C)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)C[C@H]1NS(=O)(=O)N(C)C 95369179 NDRJFPUVXDCPPI-JKSUJKDBSA-N 393.475 2.558 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccccc3Cl)CC2)C(=O)N1c1ccc(F)cc1 96793218 QSZNTMGNNWXSBG-GOSISDBHSA-N 387.842 2.933 0 50 GFAA Cc1cc(C)nc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95361857 WAJLBSDZAGRSHN-IOMROCGXSA-N 378.476 2.889 0 50 GFAA COc1ccc([C@@H](NC(=O)Cc2ccc(O)c(Cl)c2)[C@H]2C[C@@H](O)C2)cn1 244811549 SGRCVAIVBLGSPJ-BIENJYKASA-N 376.840 2.620 0 50 GFAA COCCN1C(=O)[C@@H]2[C@@H](C(=O)C(C)(C)C)N3c4ccccc4C(C)=C[C@@H]3[C@@H]2C1=O 245310703 KBFDNAPGBWEVPX-XWSJACJDSA-N 396.487 2.524 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N[C@H](c2ccccn2)[C@H]2C[C@@H](O)C2)c1 241081942 YSXLAZGLHSORQC-MDOVXXIYSA-N 378.432 2.722 0 50 GFAA C[C@@H](CCc1ccccc1)NC(=O)C[C@H]1N=C(O)N(Cc2ccccc2)C1=O 252552131 UPLVZOKPZTVHHS-QFBILLFUSA-N 379.460 2.839 0 50 GFAA COc1ccccc1-c1nc2sc(=CC3=Cc4ccccc4OC3)c(=O)n2n1 254344448 OMIVRCYRNLIVBF-UHFFFAOYSA-N 389.436 2.802 0 50 GFAA Cn1nc(-c2cccc(C(=O)N(CC3CCC3)C[C@H]3CCCO3)c2)ccc1=O 534648580 LAHGSDKPPKNRQL-LJQANCHMSA-N 381.476 2.869 0 50 GFAA COc1ccc(Cn2ccn3nc(-c4ccccc4)c(CO)c3c2=O)cc1F 263619520 ZBHHKVTUMRQYDI-UHFFFAOYSA-N 379.391 2.851 0 50 GFAA COC(=O)c1ccc(CN2C[C@H](Sc3ccccn3)C[C@H]2C(=O)N(C)C)cc1 64002257 ZDDHBXJWBWLARN-MSOLQXFVSA-N 399.516 2.692 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CC[C@H](N4CCN(C)CC4)C3)cc2)c1 299770992 UFHVSGHJKZVWJR-NRFANRHFSA-N 379.504 2.824 0 50 GFAA CC(C)N1CCO[C@@H](CC(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)C1 827812436 FEQGHHPGXUVGON-HNNXBMFYSA-N 378.904 2.764 0 50 GFAA Cc1nc(-c2cc(NS(=O)(=O)C[C@H]3CCCO3)cc(C(F)(F)F)c2)n[nH]1 864097415 RXWDPEKLYSCRFH-CYBMUJFWSA-N 390.387 2.720 0 50 GFAA CCN=c1[nH]cnc2cc(C(=O)N[C@@H]3CCO[C@@H](c4ccncc4)C3)ccc12 1875267899 HCSKIWBBLPSXFZ-VQIMIIECSA-N 377.448 2.529 0 50 GFAA CN(C1CCCCC1)S(=O)(=O)c1ccc(SCCCn2cncn2)nc1 1875253697 QQAQAHKKOCUAGA-UHFFFAOYSA-N 395.554 2.809 0 50 GFAA COc1cccc(N(C)c2ccnc(N[C@@H]3C[C@@H](Cn4ccnc4)C[C@H]3O)n2)c1 1875398975 KQRQDPBMDUKNAN-ATZDWAIDSA-N 394.479 2.701 0 50 GFAA CN1CCC(n2nnc3c2C[C@H](c2nc(Cc4cccc(F)c4)no2)CC3)CC1 952893425 HIGYONDFCHQDML-OAHLLOKOSA-N 396.470 2.930 0 50 GFAA O=S(=O)(NCC1CC1)c1ccc(NC2CCN(C3CCCC3)CC2)nc1 301575223 YJMCWRIBEHKOEN-UHFFFAOYSA-N 378.542 2.589 0 50 GFAA Cc1ccc(-n2nnc(C(=O)NC3CCN(CC(F)(F)F)CC3)c2C)cc1 195138967 FBFXIDVRUKGWII-UHFFFAOYSA-N 381.402 2.641 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cc(O)nc(O)n2)C1)c1ccc2ccccc2c1 1506420198 YBKUYRAYTCVREW-OAHLLOKOSA-N 392.459 2.683 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N(C)Cc2ccc3nsnc3c2)nn1 11944373 FVGIZCFAUOIPOL-UHFFFAOYSA-N 378.461 2.912 0 50 GFAA COc1cc(C(=O)N[C@@H](C)c2cn(C)nc2C)ccc1OC1CCN(C)CC1 12028283 AKBJVJOSKMYKHI-AWEZNQCLSA-N 386.496 2.701 0 50 GFAA CCc1c(C(=O)N2CCSCC2)c(=O)cc(C)n1Cc1ccccc1OC 12327921 GPHYPEVCZIRWKB-UHFFFAOYSA-N 386.517 2.965 0 50 GFAA O=C1CC[C@](CCC(=O)N(CCO)Cc2ccccc2)(Cc2ccc(F)cc2)N1 14883283 PMRXQFAHVSLDAU-QHCPKHFHSA-N 398.478 2.818 0 50 GFAA CCc1cc(=O)n(CC(=O)NCc2ccc(OC)cc2)c(-c2ccccc2)n1 169759481 DPNDUWXPXKNLAQ-UHFFFAOYSA-N 377.444 2.798 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCc2[nH]nc(C3CC3)c2CC1 1857670152 WVUZLPWWWVZIOK-HXUWFJFHSA-N 392.503 2.909 0 50 GFAA Cc1cc(C(=O)N2CCN3[C@@H](c4ccccc4)COC[C@H]3C2)c2c(C)noc2n1 1857718027 KNTGYNLNXVMPSM-IEBWSBKVSA-N 392.459 2.738 0 50 GFAA Cc1cc(C)cc(CN2C[C@@H]3[C@H](CNC(=O)c4ccon4)[C@H]4CC[C@]3(C2)O4)c1 1857723424 FQVCNVJJGBITIZ-XHYAQGIWSA-N 381.476 2.701 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c(F)c1 241470697 NXFBWZRFIIXXCS-ZDUSSCGKSA-N 382.432 2.778 0 50 GFAA CO[C@H](C)C(=O)Nc1cccc(NC(=O)CC2(N3CCOCC3)CCCC2)c1 265529053 OYUAUDBREIRIQX-MRXNPFEDSA-N 389.496 2.634 0 50 GFAA O=C(CCc1ccc(OC(F)(F)F)cc1)N1CC[C@@H](c2cc(O)nc(O)n2)C1 828400543 NMYNFZLYUGSMPN-GFCCVEGCSA-N 397.353 2.735 0 50 GFAA COc1ccc(-c2nnn(CC(=O)Nc3ccc(F)c(Cl)c3)n2)cc1OC 1181525 KSOANFATRZLUJA-UHFFFAOYSA-N 391.790 2.789 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(NCc1ccccc1Cl)n2Cc1ccccc1 6849456 CUOVWWKIPXNIHF-UHFFFAOYSA-N 395.850 2.737 0 50 GFAA Cc1ccc(NC(=O)C(=O)N2CCN(Cc3cccc4cc[nH]c34)CC2)cc1 2325856705 ZWYXGGFHEZKZNR-UHFFFAOYSA-N 376.460 2.759 0 50 GFAA CN(C)Cc1nc2ccc(NC(=O)c3cc(O)nn3-c3ccccc3F)cc2[nH]1 2325859972 RUBZQFSOAKOLGE-UHFFFAOYSA-N 394.410 2.907 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)c(OC)c1 821127 YZXWMNTYSKACRG-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)O 2556557 WTUOGGZPHJOAND-HOTGVXAUSA-N 378.469 2.738 0 50 GFAA COCCn1c(C)cc(C(=O)CSc2nnc(-c3ccncc3)n2C)c1C 3417646 SHIRWOLNHHHRBL-UHFFFAOYSA-N 385.493 2.917 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@H]2CC(c3ccc(F)cc3)=NO2)CC1 4904330 FBKXVEHGTDDWMM-HXUWFJFHSA-N 383.423 2.676 0 50 GFAA CC(C)Cn1c(CN(C)Cc2ccco2)cnc1S(=O)(=O)C[C@@H]1CCCO1 11662085 XHKLUHSRJXRVKB-SFHVURJKSA-N 395.525 2.717 0 50 GFAA O=C(Cn1cncn1)N1CCc2[nH]nc(C(c3ccccc3)c3ccccc3)c2C1 11664247 QIXIKWHZUVPKGP-UHFFFAOYSA-N 398.470 2.766 0 50 GFAA CC1CCN(C(=O)c2cc(N3C(=O)C(C)(C)CS3(=O)=O)ccc2Cl)CC1 12003556 VIFSGEGOHGQKJK-UHFFFAOYSA-N 398.912 2.915 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccccc2F)C1)C(=O)CN1CCCCC1=O 12076274 FNXFJSBVFLTFFM-SFHVURJKSA-N 389.515 2.551 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)cc1 13009046 JYLCLRLWQDJXAX-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA Cc1cccc(-n2c(C)c(C)c3c(NCCCN4CCOCC4)ncnc32)n1 13724658 QMEWNPQKCRDEFY-UHFFFAOYSA-N 380.496 2.875 0 50 GFAA CCNC(=O)c1nn(CC2CC2)c2c1CN(Cc1ccc(NC(C)=O)cc1)CC2 14745585 MBVDYWCTLFQSKU-UHFFFAOYSA-N 395.507 2.560 0 50 GFAA CCCN(CC1CC1)c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 15066394 CODYTGBEPHGEON-UHFFFAOYSA-N 394.523 2.851 0 50 GFAA CCOCCN1CCN(C(=O)c2ccc(NC(=O)c3ccoc3C)cc2)CC1 55404269 BYHXWTSJNFHXKE-UHFFFAOYSA-N 385.464 2.635 0 50 GFAA CC[C@H](C(=O)N1CCCn2nc(C(=O)Nc3ccccc3)cc2C1)n1cccn1 65467478 OFNGFMVLCYVRTQ-LJQANCHMSA-N 392.463 2.716 0 50 GFAA CSc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)N(C)Cc2nc(C)c[nH]2)cc1 67678938 NHRDVORTLOHXKB-KRWDZBQOSA-N 385.493 2.727 0 50 GFAA NC(=O)NCC(=O)N1CCC[C@H](C(=O)c2ccc(Oc3ccccc3)cc2)C1 72133666 TZLNQGRBEZJNRK-INIZCTEOSA-N 381.432 2.569 0 50 GFAA O=C1OCCN1c1cccc(-n2ccnc2-c2cnc(N3CCCC3)nc2)c1 77286981 VLWYXNQEVPWZLH-UHFFFAOYSA-N 376.420 2.886 0 50 GFAA CCN(CC)C(=O)Cn1c(Cc2ccccc2)nn(-c2ccc(OC)cc2)c1=O 77520924 XLJWFBWSDRCMKR-UHFFFAOYSA-N 394.475 2.502 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3c[nH]c(C)cc3=O)CC2)OC1=O 77553479 DAQKFYJATFYNRZ-UHFFFAOYSA-N 375.469 2.691 0 50 GFAA Cn1c(C(=O)N2CCN(c3ccc4[nH]ncc4c3)C(=O)C2)cc2cc(F)ccc21 82161163 SXVZVOJNRNTIBR-UHFFFAOYSA-N 391.406 2.683 0 50 GFAA COc1ccc(N2C[C@H](C(=O)NCCc3nccs3)CC2=O)cc1Cl 91782014 CZVCJTOGNCLEDS-LLVKDONJSA-N 379.869 2.517 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95351966 RYALBZUOZXEPFI-WMLDXEAASA-N 384.911 2.777 0 50 GFAA Cc1ccc2nc(CCCNC(=O)c3coc(CN4CCOCC4)c3)oc2c1 95366896 XXJRQKXYPJMGKF-UHFFFAOYSA-N 383.448 2.924 0 50 GFAA CCc1cc(C(=O)N2CC[C@]3(CCCN(C4CCOCC4)C3=O)C2)cs1 95383137 VPUOEIHKZAYMRH-HXUWFJFHSA-N 376.522 2.944 0 50 GFAA CCc1ccccc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95500931 WBTZAPVGGUWAJY-UHFFFAOYSA-N 392.503 2.898 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)on1 95505945 RVHKKEMEDOXSEV-SFHVURJKSA-N 391.512 2.801 0 50 GFAA COCCN1CCC(CN(Cc2ccncc2)C(=O)c2c(C)noc2C)CC1 95524714 UVWBLBXNZRYMHO-UHFFFAOYSA-N 386.496 2.687 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(Cc3nccn3C)CC2)cc1Cl 96136470 YOHIBPRRAJUVPO-UHFFFAOYSA-N 377.876 2.822 0 50 GFAA CC(C)[C@@H](NC(=O)Cn1ncc2ccccc2c1=O)c1nc2ccccc2n1C 223238703 XIBULGVECJCVFJ-HXUWFJFHSA-N 389.459 2.797 0 50 GFAA C[C@@H]1CCCN([C@H](C)CNC(=O)[C@H]2CC(=O)N(c3cccc(Cl)c3)C2)C1 229818672 IPDSMUURMRECIW-OAGGEKHMSA-N 377.916 2.930 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)Cc2csc(-c3ccc(Cl)s3)n2)CCO1 238053373 URBLMGYNROWAIR-JTQLQIEISA-N 386.882 2.770 0 50 GFAA O=S(=O)(N1C[C@H]2CC[C@H]1C2)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 246076541 FLKLZVVUYMDBDS-XIRDDKMYSA-N 388.493 2.993 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)c2nnnn2C)cc1NC(=O)Nc1ccccc1 252495641 OUXINWWHVHPVFJ-ZDUSSCGKSA-N 379.424 2.654 0 50 GFAA CN1CCN(CC2CCN(C(=O)/C=C/c3nc4ccccc4s3)CC2)CC1 264606789 GQRSRBQHDGHBSP-VOTSOKGWSA-N 384.549 2.796 0 50 GFAA Cc1ccc2c(CC(=O)N3CC[C@H](N(C)Cc4nccc(N)n4)C3)coc2c1C 275698235 NGTBBHUEJDEQSC-KRWDZBQOSA-N 393.491 2.697 0 50 GFAA O=C(NC[C@@H]1CCOC1)c1cccn(Cc2c(Cl)cccc2Cl)c1=O 299777350 BZBHSEDCYOYIPQ-LBPRGKRZSA-N 381.259 2.970 0 50 GFAA O=C(Cn1ncc2ccccc21)N1CCC(c2nc(-c3ccccn3)no2)CC1 363086628 CLDAIMKCZHFGHM-UHFFFAOYSA-N 388.431 2.888 0 50 GFAA COc1ccccc1CC1CCN(C(=O)c2cnc3sccn3c2=O)CC1 365585209 HJVHCNIAROOADD-UHFFFAOYSA-N 383.473 2.860 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2c(O)nc(C)c(Cl)c2C)CC1=O 426690686 ODBCYVLVCLWYJA-UHFFFAOYSA-N 389.839 2.555 0 50 GFAA COc1ccccc1CN1CCN(C(=O)[C@H](c2cccc(C)c2)N(C)C)CC1 824820286 QJUSZGZPNVSDGA-QFIPXVFZSA-N 381.520 2.951 0 50 GFAA Cc1nnnn1-c1ccc(CC(=O)Nc2ccccc2CN2CCCC2)cc1 828075060 DWIICTKKHUJHBC-UHFFFAOYSA-N 376.464 2.748 0 50 GFAA CN(C[C@@H]1OCCN(C)[C@H]1c1ccccc1)C(=O)CCc1ccccc1C(=O)O 887557420 MHPDFZABFNCFGE-UNMCSNQZSA-N 396.487 2.848 0 50 GFAA Cc1sc(CC(=O)N[C@@H]2CCCN3CCSC[C@H]23)nc1-c1ccco1 928082973 YFRPUZZLEHPRTK-ZIAGYGMSSA-N 377.535 2.950 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)CCOc2ccccc2F)n1 952987363 KLLKWOKKOUGLTJ-AWEZNQCLSA-N 383.445 2.878 0 50 GFAA O=C(c1csc(-c2ccccc2F)n1)N1CCNCCC12CCOCC2 1335302249 XDALLXDYFBKYDZ-UHFFFAOYSA-N 375.469 2.934 0 50 GFAA Cc1ccccc1CCC(=O)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704342905 GIOSHCAJURLZGW-NFBKMPQASA-N 381.472 2.835 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(Cc3ccc4c(c3)OCCO4)CCN12 1857673221 LMFPYVZWZQLIPB-QFIPXVFZSA-N 380.444 2.707 0 50 GFAA COc1ccc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cc1F 1857684309 ICSFYXJHDOLCDV-OAQYLSRUSA-N 384.407 2.724 0 50 GFAA CCCC(CCC)C(=O)N1CCC2(CC1)CN(Cc1cnc[nH]1)C[C@H]2C(=O)O 1857692350 AJOJRSVDSBGTGD-SFHVURJKSA-N 390.528 2.751 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)O1 1857709508 BQNFGSZWHOSAAU-SJLPKXTDSA-N 375.465 2.515 0 50 GFAA CN(CCc1ncon1)C(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857712775 SHPXACACSSRSLW-LBPRGKRZSA-N 389.843 2.782 0 50 GFAA CCc1cccc(N2C[C@@H](C(=O)N(C)[C@@H](CO)c3cccc(F)c3)CC2=O)c1 1875257336 FRDCMNBXZQKMTA-PXNSSMCTSA-N 384.451 2.933 0 50 GFAA O=C(NCC(=O)N1CCOC[C@@H]1Cc1c[nH]c2ccccc12)c1ccccc1F 1875264896 AIYWTLAUJHQGFY-INIZCTEOSA-N 395.434 2.507 0 50 GFAA CCN(CCCOCc1ccccc1)C(=O)C(=O)Nc1ccc2c(c1)CNCC2 1875286329 ORHGPUYZXHDTFC-UHFFFAOYSA-N 395.503 2.726 0 50 GFAA CC[C@@H](O)Cn1nc(-c2ccc(N(C)CC)cc2)nc1CCn1cc(C)cn1 1875324992 PWUYUWSHJHLZKW-LJQANCHMSA-N 382.512 2.920 0 50 GFAA CN=[S@]1(=O)CCC[C@]2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1 1875396179 YCKMASXQLVUKIT-BZQUYTCOSA-N 375.416 2.967 0 50 GFAA CNC(=O)c1ccc(CN2CCC(NC(=O)c3ccc(F)cc3F)CC2)cc1 2325792909 USRRARWXSRGHBT-UHFFFAOYSA-N 387.430 2.719 0 50 GFAA C[C@@H]1CN(Cc2cnon2)C[C@H]1CCNC(=O)c1ccc2c(c1)C(C)(C)CO2 2325794682 MYWCIJUFGJZETI-GDBMZVCRSA-N 384.480 2.628 0 50 GFAA CC1(C)C[C@H](S(N)(=O)=O)CN1C(=O)c1c(C(F)(F)F)oc2ccccc12 2325810981 VHAFOAJROKKZFM-VIFPVBQESA-N 390.383 2.733 0 50 GFAA O=C(N=c1ccn(-c2ccccc2Cl)[nH]1)NC[C@@H]1NCCc2ccccc21 2325857276 VVUMJANSZYHYFD-KRWDZBQOSA-N 381.867 2.956 0 50 GFAA O=C(c1ccc2nccnc2c1)N1CCc2nc(Cc3ccccc3)nn2CC1 2356138212 IGKQCWRTIMLNKD-UHFFFAOYSA-N 384.443 2.511 0 50 GFAA Cc1c(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)nc2ccccn12 2356145810 JGOZSBHPVDLVGI-JOCHJYFZSA-N 390.491 2.619 0 50 GFAA O=C1c2ccccc2C(=O)N1Cc1nc2ccccc2c(=O)n1-c1ccccn1 754055 JXTNSWCHZCQWRZ-UHFFFAOYSA-N 382.379 2.577 0 50 GFAA NC(=O)CC[C@@H](CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21 2386814 GMXKYUGMPJITQT-ZDUSSCGKSA-N 382.416 2.634 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(c2noc(-c3ccc(Cl)cc3)c2C(=O)O)C1 2356157068 CYGQEYJZDOXSEL-LLVKDONJSA-N 398.868 2.954 0 50 GFAA Oc1ccc(OC(F)(F)F)cc1-c1cnc2c(N3CCC(O)CC3)nccn12 2356159879 UDWPCVDQTWGRKE-UHFFFAOYSA-N 394.353 2.962 0 50 GFAA CCn1cc(CN2CCC3(CCc4c(O)nc(-c5cccnc5)nc43)CC2)cn1 2356166439 XULKYYVVBRYDJZ-UHFFFAOYSA-N 390.491 2.941 0 50 GFAA O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCN(c2ccccn2)CC1 4833928 RUDBXEDUVWLLJD-OAHLLOKOSA-N 382.291 2.950 0 50 GFAA CC(C)c1ccc(-n2nnnc2S[C@@H]2CCCN(c3cnn(C)c3)C2=O)cc1 133876655 KMPROLPFVORYGX-QGZVFWFLSA-N 397.508 2.807 0 50 GFAA C[C@H]1CCCCN1c1ccc(C(N)=O)cc1NC(=O)C(=O)Nc1cccc(F)c1 55155055 BMVVMHLQKWZLDT-ZDUSSCGKSA-N 398.438 2.881 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccco3)n1)CCN(C(=O)[C@@H]1CCCO1)C2 20601011 LQIKYYLNJYXBPC-INIZCTEOSA-N 380.404 2.764 0 50 GFAA O=C(Nc1ccc2oc(=O)ccc2c1)[C@@H]1CCCN1C(=O)Cc1ccccc1 142123340 VXPBAJAJMMWYKR-SFHVURJKSA-N 376.412 2.965 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4ccc(C)c(F)c4)CC3)ncn2)n1 72115933 BCUYBMMVYRFNFZ-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@@H]2CNCCC[C@H]21 366454524 STFLGQFSNQUTJQ-CXAGYDPISA-N 393.413 2.890 0 50 GFAA CC[C@]1(c2cnn(C)c2)NC(=O)N(Cc2nc(-c3ccccc3)oc2C)C1=O 126742533 XJXPSUORZNYLPZ-HXUWFJFHSA-N 379.420 2.741 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CCC[C@@](C)(O)C1 71757125 SRXTVALAGWMVAX-HSZRJFAPSA-N 392.503 2.953 0 50 GFAA CCc1ccc(C(=O)O)cc1S(=O)(=O)NC[C@H](c1ccco1)N1CCCC1 236973318 YURURMYNWGCFLH-MRXNPFEDSA-N 392.477 2.656 0 50 GFAA COc1cc(N2CC[C@@H](c3ccc(F)cc3)[C@H](NC(=O)C(F)(F)F)C2)ncn1 129221386 MEHPVTAOIRMZBY-UONOGXRCSA-N 398.360 2.665 0 50 GFAA O=C(c1cccc(F)c1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71575176 HFJBOYKCRFYXJM-SFHVURJKSA-N 387.499 2.765 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cccc(OC(F)F)c2)C2CC(O)C2)cn1 223427385 GYJLZHXBVDRENU-MQBCKMQZSA-N 378.375 2.934 0 50 GFAA Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@@H](C)c1nnnn1C 241231175 KSUGQPOEDMCYMV-ZDUSSCGKSA-N 379.424 2.654 0 50 GFAA CC(C)[C@@H](CNS(=O)(=O)c1cccc(S(C)(=O)=O)c1)Cc1ccccc1 241338586 MCBBCEPKTNNUNC-QGZVFWFLSA-N 395.546 2.883 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CC[C@H](n2cccn2)C1 291702266 IBRWCZTWHAMBTO-IBGZPJMESA-N 381.480 2.666 0 50 GFAA CC(C)n1cc(CN2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cn1 92037930 IDLHDGUKDYWKLW-OAQYLSRUSA-N 384.528 2.634 0 50 GFAA O=C1CCC2(CCN(c3nnc(-c4ccccc4)s3)CC2)CN1CCCO 91440798 SEVQDDMARLBGGN-UHFFFAOYSA-N 386.521 2.797 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)COc3ccc4c(c3)OCO4)C2)c1 95361315 ZRTYFEVPIWKNRF-MRXNPFEDSA-N 383.400 2.899 0 50 GFAA O=C(NCc1cnn2cccnc12)Nc1ccc(OC[C@H]2CCCCO2)cc1 96180491 ZXTIMHFIOQSGMN-GOSISDBHSA-N 381.436 2.999 0 50 GFAA CN1CCN(C(=O)c2ccnc(NC[C@H]3CCOc4ccccc4C3)c2)CC1 95391132 XMAXWNXCGCVFQX-KRWDZBQOSA-N 380.492 2.523 0 50 GFAA CC(C)N1CCCN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)CC1 91574255 SFDPTSHKSILMKR-UHFFFAOYSA-N 387.436 2.539 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3=O)c(O)c1 95354222 DVZHWUMJABLGNN-DLBZAZTESA-N 380.444 2.664 0 50 GFAA O=C1Nc2ccccc2S[C@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 299748711 HXQQINASEQHVOX-WBVHZDCISA-N 382.441 2.528 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C[C@H](O)[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 253498273 SHIBSTMRCDJXLN-USJVZEJJSA-N 390.520 2.575 0 50 GFAA biogenic,in-vitro COCCN1CCC[C@]2(CCN(Cc3cc(OC)c(OC)c(OC)c3)C2)C1 55061192 XRBOMLVWCZASAU-NRFANRHFSA-N 378.513 2.647 0 50 GFAA CC(C)c1nccc(CN2CCOC3(CCN([C@@H]4CCSC4)CC3)C2)n1 822280238 RFBNPXUZTOWGRB-GOSISDBHSA-N 376.570 2.772 0 50 GFAA C[C@H](CN1CCc2ccccc2C1)NC(=O)COCc1nc2ccc(F)cc2[nH]1 821789264 OQWKETYZLBECQU-OAHLLOKOSA-N 396.466 2.782 0 50 GFAA Cc1sc2nc(CCNC(=O)c3ccccc3-c3nc[nH]n3)nc(O)c2c1C 828184160 IYSMAFMWFYCNDH-UHFFFAOYSA-N 394.460 2.771 0 50 GFAA C[C@H]1Oc2ccccc2N(CCC(=O)N[C@@H](CCC(=O)O)c2ccccc2)C1=O 268889920 IXSNPVPWPQDZIH-WBVHZDCISA-N 396.443 2.913 0 50 GFAA CCNS(=O)(=O)c1ccc(CC(=O)N2Cc3ccccc3C3(CCC3)C2)cc1 952845372 DILURICYWWBZSA-UHFFFAOYSA-N 398.528 2.991 0 50 GFAA COc1ccccc1CC(=O)N1CC[C@H]2[C@@H](CCCN2C(=O)c2ccco2)C1 43641981 CZVQCIIDFLCLJO-ROUUACIJSA-N 382.460 2.984 0 50 GFAA CS[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C)cc(C)n2)cc1 888093309 XEYOIIRPKPVZRA-LBPRGKRZSA-N 380.495 2.584 0 50 GFAA O=C(N[C@H]1CCCc2c(O)cccc21)N1CCC2(CC1)CCS(=O)(=O)CC2 888102492 YVOQGJVWZCUMFR-KRWDZBQOSA-N 392.521 2.770 0 50 GFAA CCn1c([C@@H]2Cc3cc(F)ccc3NC2=O)nnc1N1C[C@@H](OC)CC[C@H]1C 1356270294 LNKKUAMUFIOSCX-KCXAZCMYSA-N 387.459 2.719 0 50 GFAA C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2C(=O)[C@@H]2CSCN2C(=O)C2CCCC2)C1 408260102 DCHCXDIXVODQDK-XXQMMXQMSA-N 394.581 2.866 0 50 GFAA CS(=O)(=O)Nc1ccc(OCCNc2cc(Cl)nc(C3CC3)n2)cc1 170591574 GXYUBZFRUVOFLF-UHFFFAOYSA-N 382.873 2.870 0 50 GFAA COC(=O)c1ccc(/C=C/C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1 194611777 JRRLCNSWWPTUBY-DLENHJPASA-N 378.428 2.576 0 50 GFAA O=C1C[C@H](C(=O)N2C[C@H](O)C[C@@H]2c2ccc(F)cc2)CN1c1ccc(F)cc1 770185806 FHZTYZYUJCROEE-GDIGMMSISA-N 386.398 2.652 0 50 GFAA COc1ccc(-n2cnnc2)cc1NC(=O)c1cc(-c2cccs2)nn1C 1506401995 HTNGSGFTLKFLSF-UHFFFAOYSA-N 380.433 2.990 0 50 GFAA O=C(CN1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1)NCC1CCCCC1 1704344527 SUZYREHQHXDOGD-DENIHFKCSA-N 381.520 2.767 0 50 GFAA CCC1=NO[C@H](C(=O)N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)C1 1704358372 ISGSLEACJMMFLP-IBGZPJMESA-N 388.464 2.649 0 50 GFAA CC(C)[C@@H](NC(=O)/C(=C\c1ccc(F)cc1)NC(=O)c1ccccc1)C(=O)O 5102880 QKGRIBSRJBJWAO-XCMFGDQWSA-N 384.407 2.822 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OCCOC(C)C)cc(Cl)c1O 5008694 OIAHKHLINHADBI-OAHLLOKOSA-N 398.843 2.650 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3cccc(Cl)c3)c2)C1=O 12003868 XOUXUCTVKNYWFH-LLVKDONJSA-N 378.837 2.905 0 50 GFAA Cc1c(C(=O)NCCN2CCCC2)cnn1-c1nccc(-c2ccccc2F)n1 12048141 ZSPJLYWJMPGUSJ-UHFFFAOYSA-N 394.454 2.602 0 50 GFAA O=C(CCC1CCN(C(=O)c2cn3ccsc3n2)CC1)NCc1cccnc1 12433496 MIPLRQPISUMYQA-UHFFFAOYSA-N 397.504 2.740 0 50 GFAA CC1(C)C(=O)NCCN1C(=O)C[C@H](c1ccccc1)c1ccc2c(c1)OCO2 12440407 CEAUWVOOKDBVRZ-QGZVFWFLSA-N 380.444 2.674 0 50 GFAA CCn1ccnc1CNC(=O)c1cccc(OC2CCN(C(=O)C3CC3)CC2)c1 12440523 LGXRKFAQNRQWNU-UHFFFAOYSA-N 396.491 2.613 0 50 GFAA O=C(CCc1nnc(Cc2ccc3c(c2)OCO3)o1)N1CCc2ccccc2C1 12582144 YBDICVBLJXOLMI-UHFFFAOYSA-N 391.427 2.907 0 50 GFAA O=C(NC1Cc2ccccc2C1)c1coc(COc2ccc3c(c2)OCO3)n1 12710270 RBTUMTAFWPFBQO-UHFFFAOYSA-N 378.384 2.880 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C3CCOCC3)C2)c(OC)c1 14953113 MTCDSUDLTIGRNP-KRWDZBQOSA-N 390.524 2.991 0 50 GFAA O=S(=O)(N[C@@H]1c2cccc3cccc(c23)[C@H]1N1CCNCC1)c1ccccc1 19810997 DFHHBGRWPZJXGB-FGZHOGPDSA-N 393.512 2.819 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ccc(C(F)(F)F)cn2)C[C@H]1C(=O)O 169725715 XAFOEBBRNPDHQM-NSHDSACASA-N 375.347 2.611 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1ccc(-n3cnnc3)cc1)CC2 1857682891 VDJYAMLUMZIILE-UHFFFAOYSA-N 398.470 2.909 0 50 GFAA Cc1cccc(CN2C[C@H](C(=O)O)C3(CCN(C(=O)C4CCCC4)CC3)C2)n1 1857687318 PXNHHFIHMDIHOA-LJQANCHMSA-N 385.508 2.705 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857695545 OAGBJJRKPHAKKI-NVXWUHKLSA-N 389.883 2.961 0 50 GFAA Cc1ccn(CCC(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)n1 1857723898 BKWYDIVRKCPNFY-GBESFXJTSA-N 388.899 2.566 0 50 GFAA Cc1cc(S(=O)(=O)N2CC[C@H](C)C[C@@H]2[C@@H](C)O)sc1Br 408425360 FTOXCVKUROQKHU-JMJZKYOTSA-N 382.345 2.989 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)Nc1cccc3c1C(=O)NC3)CC2 121983285 FPTASDIWSAHJKR-JTQLQIEISA-N 390.365 2.791 0 50 GFAA Cc1c(C(=O)N(C)Cc2ccc(Br)s2)nnn1C1CCNCC1 237263914 OSVOGKKQHVBJRQ-UHFFFAOYSA-N 398.330 2.607 0 50 GFAA CC(C)CC(=O)N1CCC(c2nnc3n2CCN(C(=O)OC(C)(C)C)C3)CC1 802400405 STSXWPUZZSFBOH-UHFFFAOYSA-N 391.516 2.781 0 50 GFAA Cn1cccc1-c1nnc2ccc(C(=O)N3CCN[C@@H](c4ccccc4)C3)cn12 2100556518 DLQYXTKWIXRPAW-GOSISDBHSA-N 386.459 2.522 0 50 GFAA CN(C(=O)c1ccn2ncc(-c3ccc(C(N)=O)cc3)c2c1)c1ccc(C#N)cn1 209387100 YTIYJNWWLQSAAU-UHFFFAOYSA-N 396.410 2.643 0 50 GFAA Cc1cc(S(N)(=O)=O)sc1C(=O)Nc1ccc2c(c1)[C@@H](O)CC2(C)C 2325745254 MHHPJRUKDYPUMY-ZDUSSCGKSA-N 380.491 2.671 0 50 GFAA C[C@@]1(Cc2ccc(C(F)F)cc2)CCCN1CCN1CCS(=O)(=O)CC1 2325756514 BWNCNAUFXQSTJA-IBGZPJMESA-N 386.508 2.752 0 50 GFAA Cc1cnn([C@H]2CCCNC2)c1C(=O)N1CCC[C@H](c2cc(O)cc(F)c2)C1 2325779090 GGICEFZCHCAEGD-YJBOKZPZSA-N 386.471 2.981 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@@H]3CCN(C)C[C@H]3c3cnn(C)c3)cc2)c1C 849596508 ORDZZMWGMQCYTP-RTWAWAEBSA-N 392.507 2.897 0 50 GFAA C[C@@H]1CC(C(=O)N2CCCC[C@H](NC(=O)c3cccc(C(N)=O)c3)C2)C[C@@H](C)C1 2325864553 SLFLNYWWRYVDKW-FTRWYGJKSA-N 399.535 2.969 0 50 GFAA COC(=O)c1c(N)n(-c2ccc(OC)c(OC)c2)c2nc3ccccc3nc12 636247 UULMNDBSIBOUCG-UHFFFAOYSA-N 378.388 2.960 0 50 GFAA O=C1C[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C(=O)N1c1ccc(F)cc1 712635 HGDVRYUQXFNFMW-GOSISDBHSA-N 387.842 2.933 0 50 GFAA COc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(C(C)(C)C)cc1 937494 DWGPVUXGNQQMKX-UHFFFAOYSA-N 376.478 2.910 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccccc2F)S(C)(=O)=O)cc1Cl 2981821 HRTMDDWLJSWMME-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA Cc1ccc(-n2nnc(C(=O)Nc3ccc(N4CCN(C)CC4)cc3)c2C)cc1 11692786 WGPQGOONDGSEBL-UHFFFAOYSA-N 390.491 2.888 0 50 GFAA Cc1ccc(OC2CCN(Cc3ccncc3)CC2)c(C(=O)N[C@@H]2CCOC2)c1 12304620 FJSWSGNGVSLGHV-LJQANCHMSA-N 395.503 2.952 0 50 GFAA COc1ccc(NC(=O)CCN2CCN(Cc3ccccc3)CC2)c(OC)c1 19361400 YCALHNIHGSUWEB-UHFFFAOYSA-N 383.492 2.850 0 50 GFAA Cc1cc(-c2cnn(CC(=O)Nc3ccnn3C3CCCCC3)c2)nc(N)n1 48284587 KGCCSWBXDIDTGZ-UHFFFAOYSA-N 380.456 2.571 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)OCc2ccccc2)C1)Nc1nncs1 55060479 FHWORDBLXRQSNO-CQSZACIVSA-N 375.454 2.708 0 50 GFAA Cc1cnc(C(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)cn1 55211405 PANXZAMGMKEXKC-IBGZPJMESA-N 379.508 2.520 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3ncc[nH]3)no2)c(Cl)c1 67754645 JNTKRFVAMPGNRA-UHFFFAOYSA-N 376.800 2.911 0 50 GFAA COc1ccc2[nH]c(=O)c(CN3CCc4[nH]cnc4[C@@H]3c3ccncc3)cc2c1 67834119 XGGYRAKAYAXCPY-NRFANRHFSA-N 387.443 2.803 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(F)c(C)c3)CC2)C1 67908572 PQKRUAUVLFHMQF-LJQANCHMSA-N 391.531 2.573 0 50 GFAA COc1cccc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c1F 71746917 SPARLBVLOUDFER-QGZVFWFLSA-N 389.515 2.789 0 50 GFAA CN(C)c1nc2c(c(=O)[nH]1)CCN(C(=O)[C@H](c1ccccc1)C1CCCC1)C2 72153374 VPFVDLLYSSGIDG-LJQANCHMSA-N 380.492 2.695 0 50 GFAA CCc1nccn1CC(=O)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95359915 KSORWENPHKTBFX-FXAWDEMLSA-N 378.520 2.536 0 50 GFAA CCCn1nccc1S(=O)(=O)N1CCC[C@H](c2ccc(C(=O)O)cc2)C1 95368002 JBTPEVWUEZMMOR-INIZCTEOSA-N 377.466 2.560 0 50 GFAA COc1ccc2c(c1)[C@H](Nc1nc(C)ncc1S(C)(=O)=O)CC(C)(C)O2 95388368 IMWKBRFJRBURDB-CQSZACIVSA-N 377.466 2.911 0 50 GFAA CC[C@@H](NC(=O)Nc1cc2c(cc1OC)n(C)c(=O)n2C)c1cc(C)ccn1 96164415 YCMBUYQZWQAAFV-CYBMUJFWSA-N 383.452 2.862 0 50 GFAA CC(C)N(Cc1cc(-c2ccccc2)[nH]n1)C(=O)[C@H]1CSC(C)(C)C(=O)N1 97301405 RIJVJZLKQBEXIC-QGZVFWFLSA-N 386.521 2.824 0 50 GFAA COc1cccc(OCCN2CCN(C(=O)Cc3noc4ccccc34)CC2)c1 156040415 CTVOXRRKAMUVKW-UHFFFAOYSA-N 395.459 2.602 0 50 GFAA CCOc1ccc(NC(=O)c2cc(C)nc(Cl)c2)cc1S(=O)(=O)N(C)C 170601000 MUZVMBWCASAIMB-UHFFFAOYSA-N 397.884 2.945 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N2CCC(C(=O)N3CCCCC3)CC2)c1 170917094 BVGUDECAOJWWHS-UHFFFAOYSA-N 385.508 2.643 0 50 GFAA O=C(Nc1ccc(OCCc2ccccc2)nc1)N1CC[C@@H](N2CCOCC2)C1 173904052 VWAKUCZWJKRKOB-HXUWFJFHSA-N 396.491 2.642 0 50 GFAA Cc1c(C(=O)N[C@@H]2CCOC3(CCCC3)C2)cnn1CCO[C@H]1CCCCO1 179327160 MPTTZTSYNGCCBM-MJGOQNOKSA-N 391.512 2.956 0 50 GFAA COc1ccc(CCN2C(=O)O[C@H]3CN(C(=O)NC4CCCCC4)C[C@H]32)cc1 209804429 SANIZIKASQIMDJ-MOPGFXCFSA-N 387.480 2.785 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N(C)Cc3ccc4nonc4c3)c2n1 215879508 DXFIBILAEXCNNF-UHFFFAOYSA-N 390.325 2.865 0 50 GFAA Cc1cn([C@@H](C)c2ccccc2)nc1NC(=O)NCC1CCS(=O)(=O)CC1 252503351 VBXUSCYJHRELHH-HNNXBMFYSA-N 390.509 2.747 0 50 GFAA CN(C)c1cc(CNC(=O)c2cnn(CC(F)(F)F)c2)c2ccccc2n1 252553241 VIMWTSHWYICCEW-UHFFFAOYSA-N 377.370 2.990 0 50 GFAA COC(=O)C[C@H](c1cc2c(cc1O)OCO2)c1cc2ccccc2n(C)c1=O 253409578 MBHBZAZYNVFGJV-CYBMUJFWSA-N 381.384 2.668 0 50 GFAA biogenic C[C@H]1C[C@@H](Nc2cnc(N3CCOCC3)c(Br)c2)[C@H](C)CN1C 253430834 MBEQOAGNOIHSSM-DVOMOZLQSA-N 383.334 2.821 0 50 GFAA CN1CC[C@H](CNC(=O)NC[C@@H]2CCC[C@@H]2O)[C@H]1c1ccc(Cl)c(F)c1 270724376 XDWVCJMKMKGYIB-IHETXDGRSA-N 383.895 2.932 0 50 GFAA CCn1c(=O)c2ccccc2n2c(CN3CCCC[C@H]3c3ccnn3C)nnc12 298686595 ZGFUNKPGEQQNID-SFHVURJKSA-N 391.479 2.525 0 50 GFAA C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)c1 299422253 USNWMHLMDRXRED-CDHQVMDDSA-N 391.471 2.812 0 50 GFAA COCCN1C[C@@H](CN2CCN(c3cccc(Cl)c3Cl)CC2)CC1=O 299787542 OWFBVARWGNUPMJ-CQSZACIVSA-N 386.323 2.610 0 50 GFAA Cc1nc([C@H]2CCCN2S(=O)(=O)c2c(C(F)F)c(C)nn2C)cs1 333095358 BPQUXVHNFIXWFE-LLVKDONJSA-N 376.454 2.957 0 50 GFAA Cn1nnc2c(C(=O)N3CCC[C@H](C(F)(F)F)[C@@H]3C(F)(F)F)ccnc21 333953001 CYONWTYNTOQEOD-WCBMZHEXSA-N 381.280 2.709 0 50 GFAA COc1cccc(CNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1OC 363435469 GUTBJADUJZBCPI-IBGZPJMESA-N 396.487 2.801 0 50 GFAA CC(=O)N(Cc1noc(C(C)C)n1)[C@@H]1CCN(Cc2ccc3c[nH]nc3c2)C1 371336342 OWFYSPNUYTUJQX-QGZVFWFLSA-N 382.468 2.692 0 50 GFAA CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)N2CCC[C@@H](OC)CC2)c1 376282893 SCQSENRCERKUBV-MAUKXSAKSA-N 397.541 2.937 0 50 GFAA CC(C)n1cc(CNC(=O)N2CCCN(C3Cc4ccccc4C3)CC2)cn1 426478008 NEFRAVDYJQQUII-UHFFFAOYSA-N 381.524 2.849 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2onc3c2CCCC3)C1 426503252 JFZBDELHYNJQHP-INIZCTEOSA-N 385.512 2.721 0 50 GFAA Cc1ccc(-c2ccnn2C)cc1NC(=O)N1CCCC[C@H]1CS(C)(=O)=O 455361160 DIQOQHGLRJHWTA-INIZCTEOSA-N 390.509 2.827 0 50 GFAA Cc1ccc(OCCN(C)C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)cc1 584901517 MWUWTRGETWPFAK-FQEVSTJZSA-N 375.513 2.659 0 50 GFAA Cc1ccoc1C(=O)N1CCC2(CC1)CN(C(=O)C(C)(C)n1cccc1)CCO2 827654286 GWWZTAUMXUWAJB-UHFFFAOYSA-N 399.491 2.658 0 50 GFAA Cc1ccc(-c2ccc(C(=O)NCCc3ccc(S(N)(=O)=O)cc3)cc2)o1 828161117 DLCOTIMKZPZKSU-UHFFFAOYSA-N 384.457 2.875 0 50 GFAA CCCOC(=O)N1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1 858884747 AMOQCNVUVCLFGK-UHFFFAOYSA-N 376.844 2.555 0 50 GFAA CC1(C)CN(C(=O)C(C)(C)N2CCNCC2)[C@@H]1c1nccn1-c1ccc(F)cc1 952892619 BCDORNMTGOCJBK-GOSISDBHSA-N 399.514 2.605 0 50 GFAA COc1cccc(CN2CCN(C3CCN(Cc4ccco4)CC3)CC2=O)c1 1506399138 KRCJXJPBDMESDD-UHFFFAOYSA-N 383.492 2.597 0 50 GFAA CCCC[C@@H]1CN(C(=O)CCc2c(C)nc3ncnn3c2C)C[C@H](C2CC2)O1 1529092680 WYOBOMVIKHVDQH-IEBWSBKVSA-N 385.512 2.870 0 50 GFAA CC(=O)N[C@H]1CN(Cc2nccn2Cc2ccccc2)C[C@@H]1c1ccc(C)o1 1565508525 DJUGKKDLRGDVEV-PMACEKPBSA-N 378.476 2.937 0 50 GFAA Nc1nc(C(=O)N2CCCN(C(=O)CCc3c[nH]c4ccccc34)CC2)cs1 1772710569 NDJCRGCYFDUOIH-UHFFFAOYSA-N 397.504 2.514 0 50 GFAA Cc1cnc(CN2CCC3(CC2)CN(Cc2ccccc2C)C[C@H]3C(=O)O)[nH]1 1857689513 RODMLHXYSWPLDT-IBGZPJMESA-N 382.508 2.825 0 50 GFAA CC(=O)N[C@H](Cc1ccc2c(c1)OCO2)C(=O)N1CC=C(c2cccs2)CC1 1875259126 HWCQLWWNVHZYJP-QGZVFWFLSA-N 398.484 2.840 0 50 GFAA CC1(C)CCCc2c1nc(Cl)[nH]c2=NC[C@H]1CC12CCS(=O)(=O)CC2 1875329657 BMSRENGSGGGYTI-GFCCVEGCSA-N 383.945 2.793 0 50 GFAA O=C(NCc1cncc(C(F)(F)F)c1)N1CCN(c2ccccc2)C(=O)C1 1875334894 JKPQWCMHJQJMSP-UHFFFAOYSA-N 378.354 2.659 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@]1(CN[C@@H]1CCS(=O)(=O)C1)c1ccccc1 1875340050 JIKMSFJYLJWGJQ-XLIONFOSSA-N 394.537 2.690 0 50 GFAA CN(C(=O)c1ccccc1OC[C@@H]1C[N@]1Cc1cnn(C)c1)c1ccccc1 1875385101 MRAGOCZAWOMNAB-SIBVEZHUSA-N 376.460 2.960 0 50 GFAA O=C1C[C@@H](C(=O)Nc2c(-c3ccccc3)cnc3ncnn23)C2(CCCC2)O1 2100540752 OPARGAIDGUFTOP-HNNXBMFYSA-N 377.404 2.606 0 50 GFAA CC(C)[C@@H](CNC(=O)C1(CN(C)C)CCCCC1)NC(=O)Cc1ccoc1 2325793969 MRSBVMAGLJFUCN-GOSISDBHSA-N 377.529 2.591 0 50 GFAA CN(C)C[C@H]1CN(C(=O)N2CCCc3ccc(-c4cnn(C)c4)nc32)CC12CC2 2325798362 VMRPNZSYHPSISP-SFHVURJKSA-N 394.523 2.628 0 50 GFAA Cc1ccc(-c2nc(O)n[nH]2)cc1NC(=O)c1sc([C@@H]2CCCNC2)nc1C 2325817816 BULQHYCPWRPORX-CYBMUJFWSA-N 398.492 2.970 0 50 GFAA Cn1nc(C(=O)NS(=O)(=O)Cc2ccc3ccccc3c2)cc1C(F)(F)F 2325853178 GPDVAIILSJOVAT-UHFFFAOYSA-N 397.378 2.852 0 50 GFAA COc1cc(-c2o[nH]c(=NCCc3nc(C)cc(C)n3)c2C(=O)O)ccc1F 2356155496 FXIVNQRNCYRGAX-UHFFFAOYSA-N 386.383 2.671 0 50 GFAA Nc1nc(CN2CCN(c3ccccc3F)CC2)nc(Nc2ccccc2)n1 2340072 VMBKXMUODGBTIE-UHFFFAOYSA-N 379.443 2.659 0 50 GFAA C[C@@H](NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O)c1ccccc1 2879117 XPCXGJWGYOPOKA-CQSZACIVSA-N 380.897 2.979 0 50 GFAA COC(=O)c1ccc(NC(=S)N[C@@H](NC(C)=O)C(Cl)(Cl)Cl)cc1 3124855 PPKSJFOHUNOFPW-LLVKDONJSA-N 398.699 2.592 0 50 GFAA CCOc1cc(-c2noc(CCC(=O)NC)n2)cc(Br)c1OC 4840177 NHBYNGRWEMZJSN-UHFFFAOYSA-N 384.230 2.585 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc(NC(=S)NC(=O)c2cccs2)cc1 12406004 CGIQNKGNNATPNT-AWEZNQCLSA-N 389.502 2.784 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)c3cccc(N4CCNC4=O)c3)C2)cc1 12432192 SYGIHNIMFNSOOL-SFHVURJKSA-N 394.475 2.942 0 50 GFAA O=C(CSc1ncccn1)N[C@H]1CCCN(c2nc3ccccc3s2)C1 12708163 CLMPOQIBUUWRIZ-ZDUSSCGKSA-N 385.518 2.964 0 50 GFAA Cc1csc(CN(C)[C@@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)n1 14533326 XPCPMAYVCCRNLG-OAHLLOKOSA-N 387.553 2.800 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1nccs1)CC2 14744820 HTPFOZZRHXQJRI-UHFFFAOYSA-N 384.505 2.614 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCOCC2)c2c1CC[C@H](N1CCC(C)CC1)C2 14753030 VLKBXGDHJKYMKU-SFHVURJKSA-N 388.556 2.601 0 50 GFAA COCCn1cnc2sc3c(c2c1=O)CC[C@@H](NC1Cc2ccccc2C1)C3 14952993 AAZINGXQMMYNGN-MRXNPFEDSA-N 395.528 2.719 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@H](C(=O)NCc4ccc(F)cc4)C3)nn12 32072010 GMMYBBGABWZJGX-INIZCTEOSA-N 396.470 2.920 0 50 GFAA COc1cccc(NC(=O)Cn2nc(-c3ccc(OC)cc3F)ccc2=O)c1 49550764 HFFYQRQVCIYTCZ-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA O=C(Nc1ccccc1)c1cc2n(n1)CCN(C(=O)c1cnoc1C1CC1)C2 65373858 LYLVMMPUVPIPTF-UHFFFAOYSA-N 377.404 2.657 0 50 GFAA COc1ccccc1Oc1ncccc1CNC(=O)c1ccc(C)n(C)c1=O 67490706 KEAUJTCDAPRQBF-UHFFFAOYSA-N 379.416 2.820 0 50 GFAA CN(Cc1nncn1C)C(=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 67654131 XAYQZMHDFBSWFU-UHFFFAOYSA-N 395.341 2.673 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC(CN)CC3)nc2)cc1 67879164 XPIACEDJPZTXDY-UHFFFAOYSA-N 382.508 2.628 0 50 GFAA Cc1nnc([C@H](C)NC(=O)c2coc(COc3cccc4cccnc34)n2)o1 67965085 ICDFUWHMTXOAJY-NSHDSACASA-N 379.376 2.984 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCc4n[nH]cc4C3)n[nH]2)c(Cl)c1 71315201 ZCIKNLMVZLXQRE-UHFFFAOYSA-N 387.827 2.572 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2 72410366 BKTMYTGAXKRYPH-UHFFFAOYSA-N 380.492 2.774 0 50 GFAA COc1cccc(CN2CC3(CCN(c4cc(OC)ncn4)CC3)CC2=O)c1 77378483 NQGQVBZSLZCVKF-UHFFFAOYSA-N 382.464 2.513 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N1CCC[C@@H]1c1nc(-c2ccccc2)no1 77471561 JACFQSZDCGKPGD-OAHLLOKOSA-N 377.404 2.675 0 50 GFAA CN(C)c1ccc(CN2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)cn1 91563081 ZADKZHDTKVEEPC-LJQANCHMSA-N 386.540 2.531 0 50 GFAA Cc1n[nH]c(SCCN2C[C@](C)(Cc3ccc4c(c3)OCO4)CCC2=O)n1 91646145 YIRZGOFNKAHNGN-IBGZPJMESA-N 388.493 2.805 0 50 GFAA Cc1occc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CCC1 91663547 MVLJBVNRFSBQBZ-UHFFFAOYSA-N 382.464 2.627 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NS(=O)(=O)C2CC2)cc1 91663862 KNRLNOXOPIVQGW-KRWDZBQOSA-N 375.494 2.976 0 50 GFAA CCCc1cnc(C)nc1N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1 91830252 UBMVPGYHUULLJW-UHFFFAOYSA-N 396.539 2.912 0 50 GFAA O=C([C@@H]1CCC(=O)N(C2CC2)C1)N(CCCO)Cc1cccc2ccccc12 91987028 HOIIFBUHKLLAIU-LJQANCHMSA-N 380.488 2.952 0 50 GFAA Cc1ccccc1-c1ccccc1C(=O)N1CCC2(CC1)NC(=O)C[C@H]2C(=O)O 95386974 UYBADMCYUHFHRT-IBGZPJMESA-N 392.455 2.858 0 50 GFAA CC(C)n1ccnc1[C@@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 95498253 UKTGBAWPAKIRFM-QGZVFWFLSA-N 386.496 2.909 0 50 GFAA COc1cc(CN2CCCC2(C)C)ccc1OC[C@@H](O)CN1CCSCC1 95521740 IOQVFPVGDFBPQM-SFHVURJKSA-N 394.581 2.858 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)c3cnc(C)nc3)C2)cc1 95527685 UYEGHRTUIYDYJD-IBGZPJMESA-N 382.508 2.820 0 50 GFAA O=C(C[C@H]1CN(Cc2ccccc2)CCO1)N1CCN(c2ccc(F)cc2)CC1 154485614 FACWGLXWXYOFKR-QFIPXVFZSA-N 397.494 2.765 0 50 GFAA CN1CCC(=O)Nc2cc(C(=O)Nc3cccc(C(=O)NC4CC4)c3)ccc21 155173855 UATRLXAVGDAFEK-UHFFFAOYSA-N 378.432 2.610 0 50 GFAA CCc1nc(NS(=O)(=O)c2ccc(OCc3ncnn3C)cc2)sc1C 162321400 KXEAJDRKULMQHU-UHFFFAOYSA-N 393.494 2.522 0 50 GFAA O=C1N[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)c2cccnc2)[C@](O)(C(F)(F)F)N1 170620737 BPVKQRQJQSDSDR-ZENOOKHLSA-N 399.756 2.839 0 50 GFAA CN1CCCc2ccc(S(=O)(=O)NCCc3nc4c(s3)CCCC4)cc21 177140400 MTAZZAFFZOEFJU-UHFFFAOYSA-N 391.562 2.925 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)c3ccc(Cl)cc3O)CC[C@@H]21 222075941 MZZOWOAZNIXLNX-CJNGLKHVSA-N 380.872 2.535 0 50 GFAA C[C@H]1CCCN(c2ccccc2OS(=O)(=O)c2cnn([C@H]3CCOC3)c2)C1 225445068 CFRCXETZPYERCI-HOTGVXAUSA-N 391.493 2.849 0 50 GFAA CN1C(=O)C[C@@H](C(=O)NCc2ccc(C(=O)O)cc2)[C@@H]1c1cccc(Cl)c1 237058750 NKZJLTSTHRJWTI-AEFFLSMTSA-N 386.835 2.874 0 50 GFAA O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)Nc1cc(Cl)ccc1Cl 239347110 MCUPLIBUCFXMBW-NYZVLYBASA-N 384.215 2.673 0 50 GFAA O=C([C@H](O)[C@@H](O)c1nc2ccccc2s1)N1CC[C@@H](Cc2ccccc2)C1 245642290 AYUNLJBSWADZGP-KFKAGJAMSA-N 382.485 2.782 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cc1OC 245800365 ZEUKYTQWCHRUKZ-UKRRQHHQSA-N 399.495 2.906 0 50 GFAA COc1ccc(/C=C/CN2C[C@H]3CN(Cc4ccncc4)C[C@@]3(C(=O)O)C2)cc1 247943779 YIONSYDPFWWXFT-AMZQEUFUSA-N 393.487 2.622 0 50 GFAA O=C(CCc1nccs1)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1 262439760 NCOPDLJOPXUEKW-OAHLLOKOSA-N 387.461 2.794 0 50 GFAA C[C@H](Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1)C(=O)O 262797349 NXECUWGFKPVBDI-NVXWUHKLSA-N 387.480 2.816 0 50 GFAA CC(C)[C@H](Nc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1)c1ccccc1 276068124 LUUJVAMMLNUWAX-IBGZPJMESA-N 387.505 2.761 0 50 GFAA O=C(O)CCN(C(=O)COc1ccc(C(F)(F)F)cc1)C1CCOCC1 299750398 NJLAOGSOIOOEJF-UHFFFAOYSA-N 375.343 2.567 0 50 GFAA C[C@]1(CNC(=O)N2CCC(c3nc(C(F)(F)F)cs3)CC2)CCC(=O)N1 333658300 LQIIDHIIRZVMTJ-OAHLLOKOSA-N 390.431 2.720 0 50 GFAA O=C(c1ccsc1)N1CCc2cc(S(=O)(=O)Nc3ncccn3)ccc21 364838299 DTRGVGBGCILCLL-UHFFFAOYSA-N 386.458 2.542 0 50 GFAA CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1nccn1CCc1ccccc1 375874691 LZXCPDYXEJAFGJ-NRFANRHFSA-N 388.471 2.720 0 50 GFAA Cc1c(C(=O)O)cccc1S(=O)(=O)N1CCN(Cc2ccccc2)[C@H](C)C1 396362719 JXBCLWDSHLWVKC-OAHLLOKOSA-N 388.489 2.588 0 50 GFAA COCC1(C(=O)N2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)CC1 426395130 GBZLXVBFHWHYAR-HXUWFJFHSA-N 392.446 2.733 0 50 GFAA CCn1nc(C)c([C@@H](C)NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1C 670470034 JFXVNCUWTWBKOM-CYBMUJFWSA-N 379.482 2.721 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)[C@]1(C)CC1(F)F 817731167 WRMMGFSKIHJZIV-XPTSAGLGSA-N 397.827 2.604 0 50 GFAA CC(=O)N1CCOC2(CCN(C(=O)c3c(-c4ccccc4)ccnc3C)CC2)C1 820570162 LRNSFDPJRRGPAI-UHFFFAOYSA-N 393.487 2.911 0 50 GFAA O=C(C[C@H]1CCCO1)N1CCC(N(C(=O)C(F)(F)F)c2cccnc2)CC1 864096399 CPOMOBRUQLMZNE-OAHLLOKOSA-N 385.386 2.537 0 50 GFAA CSc1cccc(CN(C(C)C)S(=O)(=O)N2CCC[C@H](C(=O)O)C2)c1 1506396471 HAWSVQLPYZOSLO-HNNXBMFYSA-N 386.539 2.660 0 50 GFAA Cc1c(CN2CCC3(CC2)C[C@@](O)(CO)CCO3)[nH]c2ccc(Cl)cc12 1704342473 DAWKUSPLAVUABG-LJQANCHMSA-N 378.900 2.998 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N(C)C3(COC)CC3)cc12 1857690681 LFLBHMDWZGSIDS-UHFFFAOYSA-N 378.538 2.883 0 50 GFAA Cc1cccnc1CN1CCOC2(CCN(C(=O)C3CCCC3)CC2)CC1=O 1857692966 BNROUDJMNUJHLJ-UHFFFAOYSA-N 385.508 2.690 0 50 GFAA O=C(C1CCNCC1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857713945 YKEZGJPNMRFMSL-UHFFFAOYSA-N 392.503 2.655 0 50 GFAA Cc1noc(C)c1C(=O)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1875245005 GFLFSKATBADSBB-DYESRHJHSA-N 386.448 2.592 0 50 GFAA Cn1nc(C(F)(F)F)cc1-c1noc([C@@H]2Cc3ccccc3S2(=O)=O)n1 1875281187 UJLNVNOIVLCGKN-NSHDSACASA-N 384.339 2.560 0 50 GFAA O=C1NCC[C@H](NC(=O)N2CCC[C@H](c3cccc(O)c3F)C2)c2cc[nH]c21 1875301163 BRPWBEUNVQMHIE-WFASDCNBSA-N 386.427 2.623 0 50 GFAA COc1ccc(C)cc1-n1nc(CSC)nc1-c1ccnc(OCCO)c1 1875336202 VUZQSAFUADORLK-UHFFFAOYSA-N 386.477 2.880 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cncc(-c2ccoc2)c1 1875402458 HKSCPVDSBFJAFM-JBBXEZCESA-N 386.839 2.761 0 50 GFAA O=C(CCCn1nnc(-c2ccc(F)cc2)n1)Nc1n[nH]cc1-c1ccccn1 2100473404 LEQMKUUNKOJOCI-UHFFFAOYSA-N 392.398 2.683 0 50 GFAA O=C(C[C@H](c1ccc(F)c(F)c1)C1CC1)N[C@H](C(=O)O)C1CC(C(=O)O)C1 2325877463 RMKHKPPULQDQSS-MFGDRVGDSA-N 381.375 2.529 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)N1CCC(O)(CN2CCCCCC2)CC1 6221820 YLBPHKYGCZCKCT-UHFFFAOYSA-N 386.945 2.732 0 50 GFAA CC(=O)c1cccc(N(CC(=O)N2c3ccccc3C[C@@H]2C)S(C)(=O)=O)c1 10449851 PXCBFEMKFLCWDZ-AWEZNQCLSA-N 386.473 2.633 0 50 GFAA COc1cc(CNS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1OC(C)C 10543743 FPCVVRHOEGEVLP-UHFFFAOYSA-N 393.461 2.732 0 50 GFAA CN(CC(=O)N(C)[C@H]1CCCN(CCc2ccccc2)C1)Cc1cccnc1 11664942 UPCHRLIPQPNYAB-QFIPXVFZSA-N 380.536 2.679 0 50 GFAA CC(=O)NCCC(=O)NC[C@@H]1Cc2cc(-c3ccccc3C(C)=O)ccc2O1 12002045 VRBOOIPUPKOLMC-SFHVURJKSA-N 380.444 2.502 0 50 GFAA CCc1ccc(C(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)cc1 13009120 OWHRGOPQJYQEPO-UHFFFAOYSA-N 390.491 2.804 0 50 GFAA Cc1ccccc1N1CCN([C@H]2CCCN(C(=O)C(=O)c3ccccc3)C2)CC1 15065825 XGHFIGMRUSMIAM-NRFANRHFSA-N 391.515 2.991 0 50 GFAA O=C(CN1CCN(Cc2ccc3c(c2)OCO3)CC1)Nc1ccc(Cl)cc1 19335451 WCOCAALLUIZPFD-UHFFFAOYSA-N 387.867 2.825 0 50 GFAA COC(=O)c1c(NC(=O)CN2CCOCC2)sc2c1CC[C@H](C(C)(C)C)C2 19902720 KPLLQTTXOQHOPX-ZDUSSCGKSA-N 394.537 2.956 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1ccncc1)C2 20385899 HGZCMANJWKGRKB-KRWDZBQOSA-N 399.564 2.524 0 50 GFAA Cc1cccc2cc(CN(CCN(C)C)C(=O)[C@H]3CCCO3)c(N(C)C)nc12 20451959 JMAPGCRITNQSNO-LJQANCHMSA-N 384.524 2.678 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3cscn3)n1)CCN(c1cnccn1)C2 20514758 TXRGZGZZLVKFLF-UHFFFAOYSA-N 377.433 2.916 0 50 GFAA CCc1nnc(NC(=O)N2CCC(c3nnc4n3CCCCC4)CC2)s1 23145931 ZJSPVNNSYLYPOQ-UHFFFAOYSA-N 375.502 2.830 0 50 GFAA Cc1ccccc1[C@H](NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 67603461 GVLNCDRTQIJYPW-UYAOXDASSA-N 386.517 2.872 0 50 GFAA CN(C)CCNC(=O)[C@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 67805056 VQTONSCHSMQMJY-SFHVURJKSA-N 393.535 2.527 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(C(=O)C3CCCC3)CC2)C1 71721458 QCUIBYSADYPGCU-FQEVSTJZSA-N 398.551 2.591 0 50 GFAA CCCc1nc(C(=O)N[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)cs1 72122466 VZSHWYUULDCWAL-OAHLLOKOSA-N 375.469 2.808 0 50 GFAA Cc1ccc([C@@]2(C(=O)NCc3cc(N4CCOCC4)ncn3)CC2(C)C)cc1 72474972 CPKNWWWAZGHAGD-JOCHJYFZSA-N 380.492 2.606 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)c2cccc(CCC(C)(C)O)c2)C1 72481118 FKKPWSNELIFPJK-GOSISDBHSA-N 383.492 2.859 0 50 GFAA COC(=O)c1coc(CN2CCC[C@]3(CCC(=O)N(C4CCCC4)C3)C2)n1 77440177 QPPFTLGRJMKQGF-FQEVSTJZSA-N 375.469 2.608 0 50 GFAA CCS[C@H](C)C(=O)N1CCC2(CC1)CN(CCN(C)CC(C)C)C(=O)O2 77524260 VLHXTMDYFIQSBY-MRXNPFEDSA-N 385.574 2.529 0 50 GFAA O=C(N[C@@H]1CCCCN(C(=O)Cc2ccccc2)C1)c1n[nH]c2ccccc12 82096972 WQRAFAUEPSTZEZ-QGZVFWFLSA-N 376.460 2.917 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2cnccc2C)CC3)cn1 91468846 SAXLLKPYDCDETH-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)CCc3cccc(OC)c3)C2)CCC1=O 91574227 NJGPUKJOZHBVNR-JOCHJYFZSA-N 388.508 2.505 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC3(CCC(=O)N(Cc4cccnc4)C3)CC2)o1 91745945 PMUGBNWJYSVJEC-UHFFFAOYSA-N 382.464 2.731 0 50 GFAA COC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 97756718 FJCVKTNOERGECM-GOSISDBHSA-N 385.416 2.978 0 50 GFAA CN[C@H]1CCCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2C)C1 133503112 QLGHVGHYVFVDEM-AWEZNQCLSA-N 377.286 2.767 0 50 GFAA O=C(CCn1ccn2nc3c(c2c1=O)CCCC3)NCCc1ccc(Cl)cc1 169779625 JZDBNZOILWYUPI-UHFFFAOYSA-N 398.894 2.777 0 50 GFAA Cc1ccc(Cn2c(C3CCN(C(=O)c4ccccc4)CC3)n[nH]c2=O)cc1 169780723 GOCZHDQEEAZLIU-UHFFFAOYSA-N 376.460 2.948 0 50 GFAA O=C(CCC(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1)NC1CCCC1 170591523 QTEYCIHWCUZNML-HNNXBMFYSA-N 399.413 2.919 0 50 GFAA O=C(c1ccccc1)N1CCN(C(=O)c2cnc3c(F)cc(F)cc3c2O)CC1 170600136 UBCOSSNVRCGZKC-UHFFFAOYSA-N 397.381 2.817 0 50 GFAA O=C(c1ccc(=O)n(-c2ccccc2)n1)N(Cc1ccccc1)[C@H](CO)C1CC1 181448351 VVRQJAUWDBIBEH-OAQYLSRUSA-N 389.455 2.646 0 50 GFAA C[C@](O)(CC(=O)N1CCc2c(cccc2N2CCOC2=O)C1)c1ccccc1 182521837 PJWXSAPWMNIDJK-QFIPXVFZSA-N 380.444 2.826 0 50 GFAA CCCc1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](C)S(=O)(=O)CC3)c12 192303976 VAYSDLVUYSBTPW-LBPRGKRZSA-N 391.493 2.702 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)cc1 195474291 JGICOWSVJHKSPV-IBGZPJMESA-N 389.459 2.622 0 50 GFAA O=C(CN1CCC[C@H]1C(=O)O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 262603557 AHKRMOLLHWCPFL-NQIIRXRSSA-N 391.471 2.965 0 50 GFAA COCCN1Cc2cc(C(=O)N[C@@H](C)CCc3ccccc3)ccc2OCC1=O 263617804 PSCJWKQFAWKERW-KRWDZBQOSA-N 396.487 2.805 0 50 GFAA C[C@@H]1CN(C(=O)CCC(=O)N2CC(=O)Nc3ccccc32)c2ccccc2O1 264731333 JAPGWVNBYBADRI-CQSZACIVSA-N 379.416 2.566 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CCCN2c3ccccc3C[C@@H]2C1 291808638 HQMYROAWIAOIMB-QUCCMNQESA-N 393.487 2.938 0 50 GFAA NC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc(-c3cccs3)nn2Cc2ccccc2)O1 297633767 LHBRBDBEAPFEAR-JKSUJKDBSA-N 396.472 2.631 0 50 GFAA C[C@H]1CCCCN1CC(=O)N1CCc2[nH]c(-c3cccc(C(=O)O)c3)nc2C1 299798173 WDTFKJSGQWSERC-AWEZNQCLSA-N 382.464 2.534 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNCc2cnc3ccsc3c2)CC(=O)N1C 328634545 UDLRCQDYDOMPSQ-MGPUTAFESA-N 383.521 2.956 0 50 GFAA O=C(Nc1ccccc1)c1cccc(CN2CCC[C@@H](N3CCNC3=O)C2)c1 363638073 PTGJYLNXYFBJRU-HXUWFJFHSA-N 378.476 2.929 0 50 GFAA CCc1nc(CN2CCOC[C@H]2c2c(C)nn(Cc3ccccc3)c2C)n[nH]1 368433743 LZLYUTNWTMQHIW-SFHVURJKSA-N 380.496 2.802 0 50 GFAA CSc1ccsc1C(=O)N1CCCC[C@@H]1COC(=O)N1CCOCC1 377415778 ZVZDWXQIHMJFGX-CYBMUJFWSA-N 384.523 2.934 0 50 GFAA Cc1cnc(-c2ccc(C(=O)N(C)C[C@@]3(C)CCN(C)C3)cc2)nc1N(C)C 426615175 PTPGCEUVNMKBJM-QFIPXVFZSA-N 381.524 2.932 0 50 GFAA O=C(CCN1CCCN(C(=O)CCc2ccccc2)CC1)Nc1cccnc1 478370097 MKYLTIWOWLSUFG-UHFFFAOYSA-N 380.492 2.577 0 50 GFAA O=C(C[C@@H]1CCNC[C@@H]1F)Nc1nccn1Cc1ccc(Br)cc1 888101820 PFDBIXJKERLJDM-ZFWWWQNUSA-N 395.276 2.970 0 50 GFAA COc1c(C)cc(S(=O)(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)c(C)c1C 1704300312 RSVXXKYCSFEOLF-QZTJIDSGSA-N 390.505 2.551 0 50 GFAA CN(C)C[C@@]12CN(C(=O)CCC3CCCC3)C[C@@H]1CN(C(=O)C1CC=CC1)C2 1772706565 SYEADELUVHEOJC-OFNKIYASSA-N 387.568 2.772 0 50 GFAA CCOc1c(Cl)cc(CNC(=O)c2ncoc2[C@H]2[C@H]3CN[C@H]2C3)cc1OC 1857530430 NLCYYYAJMMSEAS-ZLDLUXBVSA-N 391.855 2.741 0 50 GFAA O=C(CCc1cc(Cl)no1)N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857735661 FYBYEANZNWIGMX-YQQAZPJKSA-N 375.856 2.591 0 50 GFAA Cc1csc(CN2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)n1 1857738545 MZGQOXBPTLSBFX-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA COc1c(C(=O)O)cc(-c2ccc(C3(O)CCNCC3)cc2)c(OC)c1OC 1875248666 FIFFABNWMQYRCZ-UHFFFAOYSA-N 387.432 2.649 0 50 GFAA CC(C)n1ccn(CN(CCN2CCOCC2)Cc2ccncc2)c1=S 1875256424 GYJVYCZYJOFTDV-UHFFFAOYSA-N 375.542 2.787 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@]2(Cc3ccc(Cl)cc3)CCCOC2)CC1 1875267966 CQDXTKSZVUJHII-OAQYLSRUSA-N 390.911 2.973 0 50 GFAA O=C(NCc1ccnc(N2CCC[C@H](O)C2)c1)c1ccc(NC2=NCCC2)cc1 1875270744 JPTGEVKWJRIOMG-IBGZPJMESA-N 393.491 2.577 0 50 GFAA Cc1cn2c(n1)[C@H](C)C[C@H](C(=O)N1CCc3c(ccc(F)c3F)[C@H]1C(=O)O)C2 1875304251 FGYFZRVWEJWGQU-MOCULFSLSA-N 389.402 2.804 0 50 GFAA O=C(O)c1ccccc1CCC(=O)N1CC[C@@H](n2cc(-c3cncs3)nn2)C1 1875326347 HCTZAGPAKZEUAW-CQSZACIVSA-N 397.460 2.506 0 50 GFAA O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)N[C@@H]1CCC[C@@H](CO)C1 2356156888 VNUQDYDLBSAVSE-SJLPKXTDSA-N 391.471 2.731 0 50 GFAA CCOC(=O)c1cnn(-c2nc(SC)nc3sc4c(c23)CCC4)c1N 1068195 KJBYQUWXTYDNMT-UHFFFAOYSA-N 375.479 2.847 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)c1cn(CCc2ccccc2)nn1 12049719 RZCQRNLSZXNXJL-UHFFFAOYSA-N 390.487 2.999 0 50 GFAA Cc1nc(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)sc1C 12299078 XRGGRKHPUIPASL-OAHLLOKOSA-N 375.469 2.954 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@@H]1CCCCCN1C 12440925 IHAZSAXPHDEAGB-FQEVSTJZSA-N 381.524 2.646 0 50 GFAA O=C(c1cn(Cc2ccc(Cl)cc2)nn1)N1CCN(Cc2ccccc2)CC1 19837266 AUNPQGHFEBNIPE-UHFFFAOYSA-N 395.894 2.938 0 50 GFAA Cc1ccc(OCCn2c(=N)n(CCN3CCOCC3)c3ccccc32)cc1 20069495 QDHIWXKIMXFZKE-UHFFFAOYSA-N 380.492 2.642 0 50 GFAA O=C(c1ccc([C@@H]2CCCN2C(=O)c2cscn2)s1)N1CCOCC1 20233239 CTCVBUDRTFDFTH-ZDUSSCGKSA-N 377.491 2.654 0 50 GFAA O[C@H]1[C@H](N2CCC(Oc3cccnc3)CC2)c2ccccc2C12CCNCC2 23153475 IRSANVAQSLPRQB-YADHBBJMSA-N 379.504 2.662 0 50 GFAA CCN(Cc1noc(CC(C)C)n1)C(=O)c1cnc2sc(C)c(C)n2c1=O 55211374 NMIOTXNOBXBMKN-UHFFFAOYSA-N 389.481 2.617 0 50 GFAA CC(=O)c1cn(CC(=O)N2CCC[C@@]3(CC2)CN(C)C(=O)O3)c2ccccc12 72158853 DTNYWDHXFRSHII-OAQYLSRUSA-N 383.448 2.677 0 50 GFAA O=C(c1ccc(F)cc1F)N1CCN(c2ccnc(N3CCCCC3)n2)CC1 72437186 IKZAPKODVVJFJA-UHFFFAOYSA-N 387.434 2.708 0 50 GFAA CN(CCn1ccc2ccccc21)C(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 91872443 SUPGETJRYFNSNO-GOSISDBHSA-N 376.460 2.543 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95510936 PUVXZNDDVGWWNR-IBGZPJMESA-N 378.480 2.628 0 50 GFAA Cn1cnnc1CN1CCCC[C@@H]1C(=O)Nc1ccc(Oc2ccccc2)nc1 95527649 RAKYNKHIHXCWGP-GOSISDBHSA-N 392.463 2.996 0 50 GFAA CNC(=O)c1cccc(NC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)c1 115751389 VARZZWCJSXXELR-GOSISDBHSA-N 380.448 2.706 0 50 GFAA COc1ccc(-c2cncc(C(=O)N[C@H]3CC(=O)N(CC(F)(F)F)C3)c2)cc1 131532659 AOYWLYLGPAOKQZ-HNNXBMFYSA-N 393.365 2.650 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2cccc(F)c2)N3)cc1 169764114 ZYAIBYBDLRFRGA-UHFFFAOYSA-N 397.454 2.558 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)CCc4ccccc4)nnc23)n1 169776063 WCPUECRCPCYZKT-UHFFFAOYSA-N 390.447 2.981 0 50 GFAA COc1cc(C2(C(=O)N(C)Cc3nc4ccsc4c(=O)[nH]3)CC2)ccc1C 170606388 UXHLKEBPMRNJKS-UHFFFAOYSA-N 383.473 2.992 0 50 GFAA Cc1ccccc1C1(CN[C@H]2CCCN(c3cnn(C)c3)C2=O)CCOCC1 173996736 AKAOLQWMUYDZQI-FQEVSTJZSA-N 382.508 2.562 0 50 GFAA CNc1nnc(CC(=O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)s1 183979122 ZRXQTPHMMVJOAL-NSHDSACASA-N 377.539 2.864 0 50 GFAA CN1C(=O)CCc2cc(CN3CCC(CCCN4CCOCC4)CC3)ccc21 187371345 OQNVNNNOTNUNJA-UHFFFAOYSA-N 385.552 2.920 0 50 GFAA O=C(NC1CN(C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)C1)C1CCC1 188476890 MFMSOJPUMCOGQI-UHFFFAOYSA-N 399.882 2.539 0 50 GFAA O=C(N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)[C@H]1OCCc2ccccc21 238210381 SRZVEVGRLPUBAK-MOPGFXCFSA-N 382.391 2.733 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1ccc(Cl)c(Cl)c1 239433038 XDBLINCRGNVXGY-GKAQULHVSA-N 384.215 2.673 0 50 GFAA CN1CCN(c2cc(CNC(=O)N3CCc4cc(Cl)ccc4C3)ccn2)CC1 241316700 LUDXHKVCGGIZEU-UHFFFAOYSA-N 399.926 2.755 0 50 GFAA CCn1ccnc1[C@H]1CCCN(Cc2ccc(OCC(N)=O)c(Cl)c2)C1 243901517 BCCAXZCOXCBVHN-HNNXBMFYSA-N 376.888 2.800 0 50 GFAA COc1ccc(N2CCN(Cc3cc(-c4cccnc4)no3)[C@H](C)C2=O)cc1 243901732 BDJFXOCAIMCXKM-OAHLLOKOSA-N 378.432 2.983 0 50 GFAA COc1ccc(CCCN2C(=O)O[C@H]3CN(c4nc(C)cc(C)n4)C[C@H]32)cc1 247923888 PLONXFZAMITYQJ-MOPGFXCFSA-N 382.464 2.744 0 50 GFAA O=C(C[C@H]1N=C(O)N(Cc2ccccc2)C1=O)Nc1cc(F)c(F)c(F)c1 252536590 IXSFYBQSTPXLBU-CQSZACIVSA-N 377.322 2.758 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)CCO1 262705416 DBVARTZRJQUXEJ-CYBMUJFWSA-N 389.429 2.502 0 50 GFAA Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N1CCC[C@@]1(C)C(=O)O 263496373 XXYIMXGVFQDDHS-NRFANRHFSA-N 380.448 2.898 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)NCC1(C)COC1)CC2 275600154 HWKZIEYREYINHI-QGZVFWFLSA-N 391.537 2.697 0 50 GFAA CN1CCC[C@H]1[C@H]1CCCN1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 363403787 FLMJNPXFJIMWHL-LEWJYISDSA-N 394.519 2.665 0 50 GFAA CCCc1nc(CN(CC)C(=O)N[C@@H](C)c2nc(-c3ccncc3)no2)no1 426530745 DSTDSBMSIUISCJ-LBPRGKRZSA-N 385.428 2.760 0 50 GFAA O=C(CCNC(=O)c1ccccc1F)NCCOc1cccc2cccnc12 827819950 LMGORBHXJJMOSO-UHFFFAOYSA-N 381.407 2.689 0 50 GFAA COc1ccc(OC)c2[nH]c(C(=O)N3C[C@@H]4C[C@@H](C3)[C@H]3CCCC(=O)N3C4)cc12 888088445 ACMMPUOLMHQVET-GRDNDAEWSA-N 397.475 2.658 0 50 GFAA COCCN1CC[C@@H](CNCc2ccccc2OCCCCn2ccnc2)C1 952970493 PFQDFTGYQANOMH-FQEVSTJZSA-N 386.540 2.800 0 50 GFAA O=C(NC[C@@H]1CCCN(c2cc(C3CC3)ncn2)C1)c1ccc2c(c1)OCCO2 952991323 XBXBYRBKWGUUGO-HNNXBMFYSA-N 394.475 2.772 0 50 GFAA O=C(c1cn2cc(Cl)ccc2n1)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565528722 IKQFVVFAOOXPTB-PBHICJAKSA-N 388.899 2.703 0 50 GFAA O=C(c1ccc[nH]1)N1C[C@@H]2CN(Cc3cc[nH]n3)C[C@@]2(CCc2ccccc2)C1 1772804576 ATIHXWWXSYXZTD-CVDCTZTESA-N 389.503 2.945 0 50 GFAA Cc1cc(=O)c(O)c(C2(CC(=O)NCCc3ccccn3)CCSCC2)o1 1776111386 SEMVGROKWNEYIA-UHFFFAOYSA-N 388.489 2.563 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)N1CC[C@H]2C[C@H]2C1 1857527648 ZSAJVIGHSYXNOV-SLEUVZQESA-N 383.370 2.742 0 50 GFAA O=C(Nc1cnn(Cc2nnc3n2CCCC3)c1)c1c[nH]nc1C1CCCCC1 1875265331 SQCZEVGKFOJXQK-UHFFFAOYSA-N 394.483 2.882 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@H]([C@@H](C)c2ccccc2)C1 1875297492 STZVMAFOOGBMIV-LRDDRELGSA-N 376.478 2.810 0 50 GFAA CCc1onc(C)c1CN1CCC[C@H]1CNC(=O)c1ccc2nc(O)[nH]c2c1 1875362115 RQXUALQVPUICJX-AWEZNQCLSA-N 383.452 2.522 0 50 GFAA C=CC(=O)NCCN(Cc1cccc(Cl)c1)C(=O)C1CC2(CC(C)=NO2)C1 1875386328 NCBVDYOISHRXMN-UHFFFAOYSA-N 389.883 2.916 0 50 GFAA Cc1ccc(OCCc2nnc(NC(=O)[C@]3(C)CCC(=O)O3)s2)cc1C 2100554933 IIQIHPBCDIEELK-SFHVURJKSA-N 375.450 2.811 0 50 GFAA CC(C)c1ccc(C(C)C)c(S(=O)(=O)N2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)c1 2325793761 HCOGSZOFYIFDGB-MAUKXSAKSA-N 385.551 2.741 0 50 GFAA Cc1ccc2c(C[C@H](C)NC(=O)c3ccnc(N4CCN(C)CC4)c3)c[nH]c2c1 2325859643 FEPYKAUHMTXXDD-KRWDZBQOSA-N 391.519 2.984 0 50 GFAA O=C(c1cccc2c1COC2)N1CCc2nc(CCc3ccccc3)nn2CC1 2356150865 CUDIFXMSRXWAIM-UHFFFAOYSA-N 388.471 2.792 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356151808 ALLJLRDBIIFQMP-HXUWFJFHSA-N 384.867 2.927 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(SCCc1ccccc1)n2Cc1ccccc1 728240 BXQYJBBCTSUSPW-UHFFFAOYSA-N 392.484 2.806 0 50 GFAA O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccccc1 834839 GHGURPKZNHYEEM-UHFFFAOYSA-N 387.457 2.901 0 50 GFAA Cc1ccc(NC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1 1119491 GRTYLDPVPJCQEX-UHFFFAOYSA-N 383.267 2.675 0 50 GFAA COc1ccc(C)cc1N(CC(=O)Nc1ccc(F)cc1F)S(C)(=O)=O 1131880 HYYTTWJIFKUWBN-UHFFFAOYSA-N 384.404 2.687 0 50 GFAA COc1ccccc1NC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 1178041 WFAOMKATHYJMGW-AWEZNQCLSA-N 380.400 2.723 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2c(C)noc2C)C[C@H]1NC1CCSCC1 2356149644 NPNZHQZULFCGRH-BMGDILEWSA-N 381.542 2.577 0 50 GFAA Cc1cc(N2CCO[C@H](c3nnn(C)n3)C2)c2ccc(C(F)(F)F)cc2n1 2356150014 IILRQNDQXLIPPZ-HNNXBMFYSA-N 378.358 2.663 0 50 GFAA Cc1ccc(Cl)cc1N(CC(=O)Nc1ccc2c(c1)OCO2)S(C)(=O)=O 2978391 DOOZAYAXOSBPDC-UHFFFAOYSA-N 396.852 2.782 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)N1CCC[C@@]2(CCc3c[nH]nc32)C1 2356158278 GVBYZEWUAJAFAA-HXUWFJFHSA-N 381.436 2.882 0 50 GFAA CN1C(=O)CCN(C(=O)c2cnc(-c3ncccn3)s2)c2ccc(F)cc21 225405246 AMVQUJHXSSEREO-UHFFFAOYSA-N 383.408 2.753 0 50 GFAA O=C(Nc1ncccn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 10435166 AKJPNWHZTXLLOU-UHFFFAOYSA-N 380.857 2.557 0 50 GFAA CC1(C)SC[C@H](C(=O)NCc2cccnc2Oc2ccccc2F)NC1=O 67560980 JTWBRTUUZAXKAN-CQSZACIVSA-N 389.452 2.639 0 50 GFAA COC(=O)c1ccc(CN2CC[C@H](N(C)Cc3cc(C)no3)CCC2=O)cc1 20994019 GLYSKRDGFVWCJD-GOSISDBHSA-N 385.464 2.783 0 50 GFAA COc1cccc(-c2cn[nH]c2C2CCN(C(=O)C[C@H](C)NC(C)=O)CC2)c1 67881091 NEBRUGHSSQPGPL-AWEZNQCLSA-N 384.480 2.706 0 50 GFAA CC(=O)NCc1nnc2n1CCN(Cc1ccc(-c3ccccc3Cl)o1)CC2 23130272 AFCSQOIGXCMMBY-UHFFFAOYSA-N 399.882 2.886 0 50 GFAA c1cc(CN2CCC[C@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)ccn1 22851588 CBWPKQRMQGJTMP-NRFANRHFSA-N 394.519 2.593 0 50 GFAA CN(C1CCCCC1)S(=O)(=O)NCc1cccnc1OCC(F)(F)F 330776098 INSWOLKQYNTBAN-UHFFFAOYSA-N 381.420 2.622 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)ncn2)n1 67604672 JOZNJMKPSOFUEB-UHFFFAOYSA-N 396.882 2.895 0 50 GFAA CN1CCCC[C@@H]1CCC(=O)Nc1ccc(-n2ncc3c(O)ncnc32)cc1 480887531 YPBNGMBBYFZDCZ-OAHLLOKOSA-N 380.452 2.724 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@H](CC(=O)O)c2ccc(Cl)cc2)cc1 4689759 UVQIPZNXTNPIJW-MRXNPFEDSA-N 396.852 2.793 0 50 GFAA Cc1n[nH]c(C)c1[C@@H]1COCCN1CC(=O)N1CCC(Cc2ccccc2)CC1 363106874 BEJQKNLUXOOJHF-NRFANRHFSA-N 396.535 2.881 0 50 GFAA O=C(COCc1ccccc1)N1CCn2nc([C@H](O)c3ccccc3)cc2C1 218899921 KCCBDGLQNCWWRZ-JOCHJYFZSA-N 377.444 2.524 0 50 GFAA O=C([C@@H]1C[C@@H]1c1cccnc1)N1CC[C@@H](Oc2cccnc2N2CCCC2)C1 328636888 VSYZIVSKNKNLMW-GUDVDZBRSA-N 378.476 2.860 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N1CCC(Oc2cnccn2)CC1 369467146 ZILDOQMZUSZXJQ-UHFFFAOYSA-N 378.436 2.797 0 50 GFAA Cc1ccccc1C1(CNC(=O)c2cnc(C3OCCO3)s2)CCOCC1 241371313 MMKFMSGZEWFHBN-UHFFFAOYSA-N 388.489 2.975 0 50 GFAA CC(C)[C@](C)(CN)NC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 236685665 GYPVVMVRDRTVHR-IBGZPJMESA-N 393.484 2.730 0 50 GFAA CCN1CCOC[C@H]1C(=O)NCc1cccc(NC(=O)c2ccc(C)cc2)c1 378364417 QFXWIOTVZUMGKC-FQEVSTJZSA-N 381.476 2.584 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)ccc1F 175559292 XTHMCNVTCNEHBR-LJQANCHMSA-N 397.450 2.700 0 50 GFAA CCc1cc(-c2ccc(C(=O)NCc3nnc(CC)o3)cc2)nc(N(C)C)n1 426641385 OKZXOLZYZVVWPA-UHFFFAOYSA-N 380.452 2.647 0 50 GFAA CC(C)c1ncc(C(=O)N2CCC(n3cc(-c4ccccn4)nn3)CC2)cn1 48175464 PMZWPHDDRGHELB-UHFFFAOYSA-N 377.452 2.731 0 50 GFAA CCc1ncc(C(=O)N2CCC(c3nccn3Cc3ccncc3)CC2)cn1 91595761 QNKIHSXEUWZZBD-UHFFFAOYSA-N 376.464 2.699 0 50 GFAA CN1CC2(CCN(C(=O)N[C@@H](c3ccccc3)c3ccncc3)CC2)OC1=O 426510923 YZTNCKUKKYBEOP-SFHVURJKSA-N 380.448 2.797 0 50 GFAA Cc1nc2c(NC(=O)N3CCC[C@]4(C3)C(=O)Nc3ccccc34)cccn2n1 97785507 BDGYPRKMWUVRGQ-HXUWFJFHSA-N 376.420 2.556 0 50 GFAA CCCc1nc(N2CCC(c3nnc(Cn4ccnc4)n3C3CC3)CC2)no1 96131471 DCSYFHWSQFHZNJ-UHFFFAOYSA-N 382.472 2.577 0 50 GFAA O=C(N[C@H](c1ccccn1)[C@H]1C[C@H](O)C1)c1cnc(Nc2ccccc2)nc1 244795554 RIMMQLLQFBZJJM-FNHZYXHNSA-N 375.432 2.857 0 50 GFAA CC1=C[C@@H]2[C@@H]3C(=O)NC(=O)[C@H]3[C@H](C(=O)c3cccs3)N2c2ccc(C)cc21 253387464 NJXWMPDQQFJXCZ-BZZMCLGOSA-N 378.453 2.802 0 50 GFAA Cc1c(-c2cc(CN3CC[C@H](NC(=O)Nc4ccc(F)cc4)C3)on2)cnn1C 184647554 AHXRTMMYWIBGOH-INIZCTEOSA-N 398.442 2.919 0 50 GFAA Cc1cc(C)n(CC2(CNC(=O)c3ccc(-c4cncc(O)n4)cc3)CC2)n1 534591389 PXKQICOHGMMEHI-UHFFFAOYSA-N 377.448 2.873 0 50 GFAA CC[C@@H](NC(=O)NC1(C(=O)NC)CCCCC1)c1ccc(OC)c(OC)c1 584895168 PNOZOBSQCKZFII-OAHLLOKOSA-N 377.485 2.903 0 50 GFAA Cc1cc(C)nc(N2CCC(C(=O)N[C@@H]3CCO[C@@H](c4ccccn4)C3)CC2)n1 1875284118 MPLRUKUSBNSJKA-UYAOXDASSA-N 395.507 2.741 0 50 GFAA Cc1cc(C)cc(-n2nnnc2SCc2nc3ccccc3n(C)c2=O)c1 1875258546 PFPOMSISKLQGDH-UHFFFAOYSA-N 378.461 2.818 0 50 GFAA Cn1cc(CC(=O)N[C@H]2CCC[C@@H]2CNCc2ccc(Cl)cc2F)cn1 1875374697 XUROJXXEMXHWMF-QAPCUYQASA-N 378.879 2.830 0 50 GFAA Cc1nc2cc(Cl)cc(C(=O)N[C@H](Cc3ccccc3)C(=O)N(C)C)c2[nH]1 1875340882 XGYUZXIBKBZJIP-QGZVFWFLSA-N 384.867 2.954 0 50 GFAA CC(=O)Cc1ccc(OC[C@@H]2C[N@@]2Cc2cnn(C)c2)c(Br)c1 1875381692 DLHBVYGPIGPLAX-YCRPNKLZSA-N 378.270 2.577 0 50 GFAA Cc1nc(O)cc(CN2CCC(CNC(=O)C[C@H]3CCc4ccccc43)CC2)n1 952968773 DCHWYOWDSRNVLE-LJQANCHMSA-N 394.519 2.939 0 50 GFAA COc1cccc([C@@H]2CCN(S(=O)(=O)N(C)Cc3ccccc3)C2)c1OC 952972513 VWECHAVSAMRLKT-QGZVFWFLSA-N 390.505 2.870 0 50 GFAA COc1cc(S(=O)(=O)N(C)C[C@H]2CC(=O)N(C(C)(C)C)C2)c(C)cc1C 952986958 HCYAUXKEQNJIFZ-OAHLLOKOSA-N 382.526 2.580 0 50 GFAA CS[C@H](C)CC(=O)N1CC[C@@]2(NC(=O)Cc3ccn(C(C)C)n3)CCC[C@H]12 1775991341 KYGMBCHJDWITNY-SYNHAJSKSA-N 392.569 2.788 0 50 GFAA O=C1NC2(CCCC2)C(=O)N1CCc1nc(C2(c3ccccc3)CCC2)no1 274069317 TUYWKYNNDMAYCY-UHFFFAOYSA-N 380.448 2.947 0 50 GFAA CC1CCN(C(=O)c2ccc(NC(=O)N3CCC[C@@]4(CNC(=O)C4)C3)cc2)CC1 170643967 GXUYCAFLNXYTHX-JOCHJYFZSA-N 398.507 2.693 0 50 GFAA O=C(NC1(c2nnc[nH]2)CCC1)c1cn(-c2ccc(Br)cc2)cn1 190356907 VCLYOGVYTAWEOV-UHFFFAOYSA-N 387.241 2.562 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(C(=O)CCCn3cnc4ccccc4c3=O)C[C@@H]21 1704296993 BRXOVQLHDQFMKX-TVTNDZMWSA-N 383.492 2.576 0 50 GFAA COc1ccc(OC[C@H](O)CN(C)C)c(CNCCc2ccccc2Cl)c1 11813412 SRXZUCSSPCSJQR-GOSISDBHSA-N 392.927 2.982 0 50 GFAA C[C@@H](Cn1cncn1)NC(=O)c1ccc2nc(Cc3ccccc3F)oc2c1 11840589 FBUIWZOWNCQZGY-ZDUSSCGKSA-N 379.395 2.968 0 50 GFAA CCOC(=O)[C@H]1CCCN(C2CCN(Cc3nc(-c4ccccc4)no3)CC2)C1 11843285 XWKNQGDMIUKBJS-SFHVURJKSA-N 398.507 2.976 0 50 GFAA Cn1c(CCNC(=O)/C=C/c2cccc(F)c2)nnc1SC[C@@H]1CCCO1 12245904 OUMSIFIHABJTPJ-WAVCKPEOSA-N 390.484 2.597 0 50 GFAA CC(C)(C)CN1CCC[C@]2(CCN(C(=O)c3ccc(Cn4cnnn4)cc3)C2)C1 12712024 IYIDFHQLLVUUFL-QFIPXVFZSA-N 396.539 2.696 0 50 GFAA COC[C@@H](C)NC(=O)c1sc2ncnc(N(C)CCc3ccccn3)c2c1C 14989037 NAHWBIYRXZNQGC-CYBMUJFWSA-N 399.520 2.838 0 50 GFAA O=C(c1ccc(N2CCSCC2)nc1)N1CCCC[C@@H]1CCn1cccn1 19642144 CEUSOWQKGLMQSY-GOSISDBHSA-N 385.537 2.916 0 50 GFAA Cc1ccc2nc(-c3cnc(Cn4cncn4)nc3)c(C)c(C(=O)N(C)C)c2c1 19773952 HASXOIUGRJMDSM-UHFFFAOYSA-N 387.447 2.650 0 50 GFAA Cc1noc(C)c1C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857681309 INRWQOWQFCLPGQ-YESZJQIVSA-N 375.856 2.889 0 50 GFAA CSCC(=O)N1C[C@@H](C(=O)O)C2(CCN(CCCc3ccccc3)CC2)C1 1857684948 KZBGNTIMXDONSB-SFHVURJKSA-N 390.549 2.607 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(Cc3ccc(OC)c(OC)c3OC)CC2)O1 1857711162 KUHRQCFMWXTOKV-SJORKVTESA-N 379.497 2.997 0 50 GFAA Cc1nc(CN2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cn1C 1857715639 ATSVOSDXQVZLFT-QFIPXVFZSA-N 390.491 2.766 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccc(F)cc3Cl)C[C@]23CC[C@H]1O3)C1CC1 1857719201 GUFTVSXBCDNJAW-IXIUHKBRSA-N 378.875 2.985 0 50 GFAA O=C1NC(=O)[C@](Cc2ccccc2F)(C2CCN(Cc3ccc(F)cc3)CC2)N1 12203274 QVZXLIPXFJUHAW-QFIPXVFZSA-N 399.441 2.998 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@@H](CC(=O)O)c2ccc3ccccc3c2)CC1 263209507 ZLXUJYAZCWZYPJ-IBGZPJMESA-N 397.475 2.865 0 50 GFAA C[C@]1(C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)c2[nH]ccc2-c2ccccc2)CCOC1 2325793157 IYHSYBKXKRGZKH-HOIFWPIMSA-N 379.460 2.534 0 50 GFAA CCn1ncc(Cl)c1CN1C(=O)c2ccc(C(F)(F)F)cc2S1(=O)=O 2325800629 YMPSMQBPCCEFQA-UHFFFAOYSA-N 393.774 2.920 0 50 GFAA CC(C)(C)[C@H]1CC[C@@H](NC(=O)C2CCN(c3ccc(-c4nn[nH]n4)cn3)CC2)C1 2325807366 UTUJKQRFARUEON-DLBZAZTESA-N 397.527 2.809 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)c1 824217 OQGMICVKMOWPBH-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA COc1cccc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccc(OC)cc2OC)c1 909831 HTKCYWSABJWFHZ-IBGZPJMESA-N 397.431 2.979 0 50 GFAA COc1cc(OC)c(C2=NO[C@@H](C(=O)NCc3cccnc3)C2)cc1Cl 1059197 LYCMVYUUMBKSEA-QGZVFWFLSA-N 375.812 2.562 0 50 GFAA CCCCOC(=O)c1cccc(NC(=O)CN2C(=O)c3ccccc3C2=O)c1 1801388 MNLQASYXIAUETJ-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA CCC[C@H]1[C@H]2C[C@H](CN(C(=O)Cn3nc4ccccc4n3)C2)c2cccc(=O)n21 2356157134 BKZQSXLMQTWIAI-FCEWJHQRSA-N 391.475 2.580 0 50 GFAA COc1ccc(N2C(=O)N(c3ccc(Cl)cc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 4475672 CESBMHZTHWVGEY-IAGOWNOFSA-N 392.864 2.961 0 50 GFAA Cc1cc(C)c(NC(=O)CNC(=O)CNc2cnn(-c3ccccc3)c2)c(C)c1 225389157 OAJVFYMTVNRHDL-UHFFFAOYSA-N 391.475 2.964 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc(-c4ccccc4)no3)C[C@H]2CCO)o1 104628580 DWLSBENWYUWAKH-GOSISDBHSA-N 382.464 2.707 0 50 GFAA O[C@]12C[C@H](C(Cl)(Cl)Cl)O[C@@]1(O)C[C@@H](C(Cl)(Cl)Cl)O2 8580849 ILZPXCIRVHHHJM-FSIIMWSLSA-N 380.866 2.682 0 50 GFAA COc1ccc(NC(=O)N[C@H]2c3ccccc3O[C@H]2C)cc1S(C)(=O)=O 417350842 QRZFJDDGYAXNTO-APPDUMDISA-N 376.434 2.742 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)NCCc1c[nH]c2ccc(Cl)cc12 9418774 NSZYFVSUHSRZNF-UHFFFAOYSA-N 380.835 2.890 0 50 GFAA COc1ccccc1C(=O)Nc1cccc(NC(=O)C(=O)Nc2cc(C)on2)c1 65532804 DUKQQQLRPTYTAV-UHFFFAOYSA-N 394.387 2.821 0 50 GFAA NC(=O)[C@@H]1CCCN(C(=O)CN2CCCCC[C@@H]2/C=C/c2cccs2)C1 248389271 SDXPDFGJQKJKQL-VEUZHWNKSA-N 375.538 2.730 0 50 GFAA O=C1CCC2(CCN1)CCN(C(=O)c1c[nH]c3cc(Cl)ccc3c1=O)CC2 67723931 AJLNRAOZOZPHSL-UHFFFAOYSA-N 387.867 2.704 0 50 GFAA CN(Cc1cnn(C)c1)C(=O)c1coc(COc2ccc3ncccc3c2)n1 67713579 DAWJYSNDHLFZDC-UHFFFAOYSA-N 377.404 2.808 0 50 GFAA Cc1cccc(N2CCN(Cc3n[nH]c(=O)n3Cc3cccc(F)c3)CC2)c1C 65419833 DYKFAGRGUVRQHB-UHFFFAOYSA-N 395.482 2.698 0 50 GFAA CN(C)CCNC(=O)CCC1CCN(Cc2c[nH]nc2-c2ccccc2)CC1 67965905 WRTCOEVHRZRSAO-UHFFFAOYSA-N 383.540 2.747 0 50 GFAA Cc1cc(C)nc(N2CCC(C(=O)NC[C@H]3CCCN4CCCC[C@@H]34)CC2)n1 170613672 NFDKTFHFPOGECM-UXHICEINSA-N 385.556 2.691 0 50 GFAA CCC[C@H](NC(=O)[C@H](C)Sc1nnnn1C[C@H]1CCCO1)c1ccccc1 252444199 PMUMEMRGPZLPCF-UAGQMJEPSA-N 389.525 2.990 0 50 GFAA C[C@]1(C(=O)N2CCC(Cn3ccnn3)CC2)CC(c2ccccc2Cl)=NO1 253408148 XMMYPSKMHIMMHZ-LJQANCHMSA-N 387.871 2.753 0 50 GFAA CNC(=O)C[C@@H](Nc1nc(O)c2cnn(-c3ccccc3)c2n1)c1ccccc1 481099049 BKTFVRRBPQJFAG-QGZVFWFLSA-N 388.431 2.810 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3ccn(Cc4ccccc4)c3)CC(=O)N2C)cnn1C 328628732 OAGLDJXHDNGESD-NZQKXSOJSA-N 391.519 2.888 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2)CC1 328630570 JNOQRTILIJZEIL-SFTDATJTSA-N 386.471 2.552 0 50 GFAA O=C(Nc1ccn2ccnc2c1)N1CCOC[C@H]1c1ncnn1-c1ccccc1 368001285 YDJVZNQXFFJTOO-KRWDZBQOSA-N 389.419 2.520 0 50 GFAA C[C@H]1[C@@H](C)NCCN1C(=O)c1cccc(NC(=O)c2ccc3[nH]cnc3c2)c1 262773527 KJXUKAXYQYOHQV-KGLIPLIRSA-N 377.448 2.638 0 50 GFAA Cc1ccccc1[C@H](CC(=O)O)NC(=O)c1nc(N2CCCC2)ncc1Cl 237670723 YDWKPRCRIFPMBU-HNNXBMFYSA-N 388.855 2.984 0 50 GFAA O=C1CC[C@@H](CC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)N1 72428080 JNEUAQLUPXKCFH-FQEVSTJZSA-N 377.488 2.589 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CC(c3cccnc3)C2)nc2cccnc21 77375136 PPFGKMHHBPFEJU-INIZCTEOSA-N 393.491 2.982 0 50 GFAA Cc1c(NC(=O)N[C@@H]2c3ccccc3O[C@@H]2C)cccc1S(=O)(=O)N(C)C 455968901 QPWZSCMWUOSVQA-ACJLOTCBSA-N 389.477 2.889 0 50 GFAA O=C(c1cscn1)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2cccs2)C1 72481474 NMAVHLQRJDKTNN-XJKSGUPXSA-N 375.519 2.900 0 50 GFAA COC(=O)Cc1ccc(CCN2CCN(c3noc4ccccc34)CC2)cc1 44127009 FDAPXJNNUZZYEG-UHFFFAOYSA-N 379.460 2.908 0 50 GFAA CNC(=O)c1ccc(-c2ccc(C(=O)N[C@H](C)Cn3nc(C)cc3C)cc2)o1 426486103 VWISPEFSURISQU-CQSZACIVSA-N 380.448 2.938 0 50 GFAA CC[C@H](C)N1C(=O)[C@@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C(=O)NC1=S 229920643 FJMLSUBLPZDWFA-SGJUXQJHSA-N 391.924 2.893 0 50 GFAA Cc1nccn1[C@H](C)C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95527562 PRHPGMHOZFXZHH-MRXNPFEDSA-N 378.480 2.799 0 50 GFAA CO[C@@]12CC[C@H](OCCO)C[C@@H]1N(C(=O)CCc1ccc(C)c(C)c1)CC2 426530719 CPTOUZAEVDLZGK-JAXLGGSGSA-N 375.509 2.784 0 50 GFAA Cc1nnc(SCCCNC(=O)N2CCC(Cn3ccnc3)CC2)s1 426478657 FLLYGWWKKCQHFG-UHFFFAOYSA-N 380.543 2.647 0 50 GFAA CN(C)c1ccc(CN2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)cn1 91859421 RRFRWLICNCOTGW-UHFFFAOYSA-N 393.535 2.947 0 50 GFAA O=C(O)[C@H](c1cnn(Cc2ccccc2)c1)N1CCC(Oc2cccnc2)CC1 95388094 UVFKXSCJCAWJLI-NRFANRHFSA-N 392.459 2.996 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(c2ncc(Cl)cc2F)C1 91503939 FTEDHFNZJWGENX-LBPRGKRZSA-N 375.839 2.631 0 50 GFAA O=C(NCCCc1ncc[nH]1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 95512208 VPOBSNGMCQDDKO-UHFFFAOYSA-N 396.491 2.552 0 50 GFAA COc1ccc(-c2nn3ccn(Cc4ccc(F)cc4F)c(=O)c3c2CO)cc1 263616837 KUKSFYMPZZDRRM-UHFFFAOYSA-N 397.381 2.990 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CC[C@H]2[C@H](C1)OCc1cnnn12 299791725 FHUVJZJWCRSVSB-OALUTQOASA-N 375.432 2.635 0 50 GFAA CCCC[C@H]1C(=O)N(C)CCN1S(=O)(=O)c1cc(C)cc2cccnc12 822831069 MGPJSYBFLJHMMH-INIZCTEOSA-N 375.494 2.565 0 50 GFAA Cc1cc2n(n1)CCN(C(=O)NC[C@H](C)Cn1nc(C)cc1C(F)(F)F)C2 584896469 ZUHOTVTYIKSQIJ-NSHDSACASA-N 384.406 2.577 0 50 GFAA Cc1ccc(NC(=O)C(=O)N=c2[nH]n(C)c3ccccc23)cc1Br 1875289392 NZGNCWRPZFBJBS-UHFFFAOYSA-N 387.237 2.643 0 50 GFAA COCc1ccc(S(=O)(=O)Nc2cnc(OC)c(Br)c2)cc1 1875317341 VQDDVKNVEGSHDN-UHFFFAOYSA-N 387.255 2.800 0 50 GFAA CC(=O)N/C(=C/c1ccccc1)C(=O)N1CC[C@@H](CO)[C@@H](c2ccccc2)C1 1875312488 FBBIQKHFCBBSCJ-VCZWFDIMSA-N 378.472 2.788 0 50 GFAA CC(C)c1nn(C)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1 874342349 QNJTYBRLQKFFFC-JTQLQIEISA-N 383.374 2.773 0 50 GFAA O=C(Nc1ccccc1C(F)F)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@H]3C2)C1 886093358 CWSQMMMAWLRORA-ILXRZTDVSA-N 392.450 2.973 0 50 GFAA CC(C)[C@H](CC1CCCCC1)C(=O)N1CCn2c(nn(CC(F)F)c2=O)C1 888091092 DWKDHZUYMNCZJD-HNNXBMFYSA-N 384.471 2.895 0 50 GFAA Cc1ccncc1[C@H]1CCN(S(=O)(=O)c2ccc(N3CCCC3=O)cc2)C1 888077508 FVYBQUQLUZRCTC-INIZCTEOSA-N 385.489 2.695 0 50 GFAA CC(C)CCn1nc(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)c2ccccc21 888101781 GMBPGDXKKDLRAR-QGZVFWFLSA-N 380.439 2.994 0 50 GFAA CC(=O)c1cccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)c1 1565514184 YHGKADBCBINKBQ-UZLBHIALSA-N 377.444 2.661 0 50 GFAA O=C(c1ccc(Oc2ccccc2)cc1)N1CCC[C@H](N2CCNCC2=O)C1 186683019 UTBXFSOBMVNBNI-SFHVURJKSA-N 379.460 2.515 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)N2CCC(Nc3ccccc3Cl)CC2)o1 170623121 AZQSJIWBCIBEMI-UHFFFAOYSA-N 398.868 2.985 0 50 GFAA O=C1CCCc2cc(S(=O)(=O)N3CC[C@H](Nc4ccccc4)C3)ccc2N1 170690009 BVCPKBAZXVEIJA-KRWDZBQOSA-N 385.489 2.837 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)c3cc(Cl)cc(Cl)c3)CCO2)cn1 189223762 QFTGSUHOOFRPEQ-HNNXBMFYSA-N 390.292 2.972 0 50 GFAA Cc1ccc(OCC(=O)N2CCCN(C(=O)c3nc4ccccc4[nH]3)CC2)cc1 1529150972 CMYVQBSCUSTSBA-UHFFFAOYSA-N 392.459 2.625 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@@H](O)[C@H](Cc4ccccn4)C3)CCCC2)cc1 1529119996 PYDGBOWLILCFPZ-DYESRHJHSA-N 380.488 2.964 0 50 GFAA CN(C(=O)CN1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1)C1CCCCC1 1704343525 ISEGOSJXKVPHOZ-GCJKJVERSA-N 381.520 2.861 0 50 GFAA COc1cc2c(cc1CN1CCC3(CC1)C[C@](C)(O)CCO3)OCCCO2 1704311085 XKVBUUHZAMHWDB-HXUWFJFHSA-N 377.481 2.753 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@@H]1c1nc2ccc(F)cc2[nH]1 1772804062 FAAJSSZQDCNFNR-OAHLLOKOSA-N 385.399 2.504 0 50 GFAA CCc1cc(C(=O)N2CCCN(C(=O)c3cn(C)c4ccccc34)CC2)no1 1772708736 BRQXBCYRFBHJPR-UHFFFAOYSA-N 380.448 2.717 0 50 GFAA Nc1nc(CCNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)cs1 1772810023 HGWVKQLGLVMMMD-GFCCVEGCSA-N 385.518 2.708 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)Cc3ccccc3C)C2)nn1 12005484 SEMUFCIXTPJANO-SFHVURJKSA-N 397.523 2.550 0 50 GFAA O=C(CCc1ccccc1)Nc1ccnn1C1CCN(C(=O)[C@@H]2CCOC2)CC1 12597184 ZWZFXWRNUGROGJ-GOSISDBHSA-N 396.491 2.654 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(N[C@H](C)CC(C)C)cc12 14539088 DNYSINHFWWHKHK-GFCCVEGCSA-N 376.457 2.791 0 50 GFAA Cn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCc1nc3ccccc3s1)C2 14732331 RSXRYTYJFKTDSO-CQSZACIVSA-N 395.532 2.913 0 50 GFAA COc1cccc(CNC(=O)c2cn(CC(C)C)cc(C(=O)NC(C)C)c2=O)c1 14999168 SDHDCHDEWXTLGR-UHFFFAOYSA-N 399.491 2.581 0 50 GFAA C[C@H](NC(=O)N1CCC(N2CCCC2=O)CC1)c1ccccc1-n1cccn1 154565272 NJPGHKGADZAGRC-INIZCTEOSA-N 381.480 2.730 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)Cc4ccccc4)[C@H]4CC[C@]3(C2)O4)ccn1 1857722223 RTFKCQHWUZMDBG-ZZLPTCMGSA-N 377.488 2.733 0 50 GFAA Cc1ccc(CC(=O)NC[C@H]2[C@H]3CN(C4CCOCC4)C[C@]34CC[C@H]2O4)cc1C 1857734215 OELCHGDWONNDMB-JVNMPXIPSA-N 398.547 2.621 0 50 GFAA C[C@H]1C[C@H](O)CN1C(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 408295634 VSFQCOJZEOQZDC-FZMZJTMJSA-N 390.281 2.719 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)c2ccc3c(c2)NC(=O)CO3)C1 117190081 OLQNSYXISZTPOU-MRXNPFEDSA-N 383.423 2.864 0 50 GFAA Cc1nnc2ccc(N3CCO[C@H](c4cccc(OC(F)(F)F)c4)C3)nn12 377162176 QETPCJCVAOIXHW-AWEZNQCLSA-N 379.342 2.909 0 50 GFAA Cc1c(CN[C@@H]2C[C@H](Cn3cc(C(=O)O)cn3)C[C@H]2O)ccc2ccccc12 2325785646 HILKUZRQQFDMKK-IWMITWMQSA-N 379.460 2.972 0 50 GFAA Cc1nc(C(C)(C)C)sc1C(=O)NC[C@@H](C)NC(=O)[C@@H](O)c1ccccc1 2325873481 ISYQHJDOOAKPJF-DOMZBBRYSA-N 389.521 2.717 0 50 GFAA CCC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccccc3)CC2)c(F)c1 902310 XLJUUZHOKWQRSN-UHFFFAOYSA-N 376.453 2.929 0 50 GFAA CC(C)c1nccn1S(=O)(=O)c1ccc(I)cc1 1139825 LZRCYUSRHQXEJR-UHFFFAOYSA-N 376.219 2.848 0 50 GFAA O=C(NC1=NCCS1)c1cnn2c(C(F)(F)F)cc(-c3ccco3)nc12 2771144 PEAXIJKMGYWKSR-UHFFFAOYSA-N 381.339 2.841 0 50 GFAA Cc1ccn([C@@H](C)C(=O)Nn2c(C)nc3sc4c(c3c2=O)CC[C@H](C)C4)n1 2778073 NNVRSXKIALPPSB-JQWIXIFHSA-N 385.493 2.727 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)NC2CCCCCC2)cc1Cl 2885189 JJLFIGYZJRDLBT-UHFFFAOYSA-N 388.917 2.808 0 50 GFAA O=C(O)CCc1nn2c3ccccc3n(Cc3ccccc3Cl)c2nc1=O 4858708 IIVRFSITUWGRKA-UHFFFAOYSA-N 382.807 2.763 0 50 GFAA Cc1nc(SCC(=O)Nc2cccc(Cl)c2Cl)[nH]c(=O)c1CCO 11905722 QHSSFKBAIJEENE-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA CCOC(=O)c1ccc(CNC(=O)[C@H]2CCC(=O)N(CCc3ccccc3)C2)o1 11998014 DIVWHLURIOLEGP-KRWDZBQOSA-N 398.459 2.554 0 50 GFAA CCOc1ccccc1CN1CCC[C@@H](n2cc(C(=O)N(CC)CC)nn2)C1 12122935 KADHQBFSMASLBK-GOSISDBHSA-N 385.512 2.996 0 50 GFAA CC(=O)c1ccc(OCC(=O)N2CCC(CCC(=O)N3CCCC3)CC2)cc1 12192040 ZSEPGDSXNFKOQN-UHFFFAOYSA-N 386.492 2.909 0 50 GFAA COc1ccc(OC)c(Cc2nnc(CCC(=O)NCCCOC(C)C)o2)c1 12315840 NOFGFXIDIVWYHR-UHFFFAOYSA-N 391.468 2.542 0 50 GFAA CCn1nc(C(=O)N2CCN(c3ccccc3)CC2)c2c1CCN(CC1CC1)C2 14531664 CQKRRMNPLYOKCL-UHFFFAOYSA-N 393.535 2.634 0 50 GFAA COc1ccccc1NS(=O)(=O)c1ccc(NC(=O)[C@H]2CCCO2)cc1 16606068 MLHDYKIMCOUZBA-QGZVFWFLSA-N 376.434 2.614 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc4c(c3)OCCO4)C[C@@H]2CCO)cc1 22913547 OOUJGJJERQPVJB-NRFANRHFSA-N 382.504 2.835 0 50 GFAA CCCS(=O)(=O)c1ncc(CN(C)Cc2ccccc2)n1C[C@@H]1CCCO1 55153882 GWSLOFPKXRQFCG-IBGZPJMESA-N 391.537 2.878 0 50 GFAA Cc1cc(C)cc(-n2nc(CC(C)C)nc2CN(C)[C@H]2CCS(=O)(=O)C2)c1 65407674 XIMFRBTUPVLEAZ-KRWDZBQOSA-N 390.553 2.702 0 50 GFAA O=C(Cn1nc(Cl)ccc1=O)N1CCC[C@@]2(C=Cc3ccccc3O2)CC1 65530186 RSMNDSVQASNIQD-HXUWFJFHSA-N 385.851 2.754 0 50 GFAA CNC(=O)CCN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67871807 VQRPHNPDWFTYLC-UHFFFAOYSA-N 383.473 2.999 0 50 GFAA CN1C(=O)[C@](CC(=O)NC(C)(C)C(=O)O)(Cc2ccccc2)c2ccccc21 71760818 HAAMLNGHEURTRY-QFIPXVFZSA-N 380.444 2.513 0 50 GFAA O=C(N[C@H]1COC[C@@H]1N1CCCC1)c1ccc2nc(-c3ccccc3)cn2c1 82121744 AHJYAUWUEGZHIA-PMACEKPBSA-N 376.460 2.594 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2csc(C)n2)CC3)cn1 95363862 YHFJOVUFQFWTPD-UHFFFAOYSA-N 385.537 2.955 0 50 GFAA Cc1c(Cl)c(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2cscn2)C3)nn1C 95365623 ZFJUXRISOKTUDT-GXTWGEPZSA-N 379.917 2.575 0 50 GFAA COc1cccc(C(=O)N2CCN([C@H](C(=O)O)c3cc(C)cc(C)c3)CC2)c1 95383327 SACDSYJXALKLRY-FQEVSTJZSA-N 382.460 2.896 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC(Cc3noc(C)n3)CC2)c(C)c1 95521982 DAOVRGLTBPCTKQ-UHFFFAOYSA-N 385.468 2.923 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)CN3CCCC3=O)CC2)C1 96162366 NXPZHCDUCUYUKJ-FQEVSTJZSA-N 383.536 2.727 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)NCCC(=O)Nc2nccs2)cc1 97436951 ZNTPDYGQCGWJJY-LBPRGKRZSA-N 387.465 2.809 0 50 GFAA CC[C@@H]1CN(C)c2ccccc2CN1C(=O)NC1CCN(c2ncccn2)CC1 153954212 HDUXIHDXPVNWOG-LJQANCHMSA-N 394.523 2.886 0 50 GFAA CS(=O)(=O)c1cccc(OCCN2CCO[C@]3(CCc4ccccc43)C2)c1 158980655 LSWGDOYTOVRMNV-OAQYLSRUSA-N 387.501 2.643 0 50 GFAA CC(C)n1ncc2c1C[C@H](NC(=O)C[C@@H]1CN(Cc3ccccc3)CCO1)CC2 170681765 RPFOQQWSAGILFI-NHCUHLMSSA-N 396.535 2.729 0 50 GFAA NC(=O)[C@H]1CCC[C@H](NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 172442301 YTZWMQNIYYKSGR-GJZGRUSLSA-N 395.438 2.576 0 50 GFAA O=C1[C@H](N2CCN(c3cccnn3)CC2)CCN1c1ccc(Cl)cc1Cl 190499666 HWRBUXQAXPWBIG-MRXNPFEDSA-N 392.290 2.711 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N[C@H]3CCN(Cc4ccc(C)cc4)C3=O)c2c1 191630591 LZAYVQOIRPEJMM-NRFANRHFSA-N 391.471 2.945 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)NCc2ccnc(-n3ccnc3)c2)n1 194650931 NPKWZMWUCOXGFF-UHFFFAOYSA-N 388.431 2.700 0 50 GFAA O=C(c1ccccc1Cl)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@H]2C=Cc3cc(F)ccc3N12 245256119 NVPOKVXVPBYCIS-XDNAFOTISA-N 396.805 2.835 0 50 GFAA O=C(c1ccccc1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)COCc1ccccc1 247955066 UZOUICNXVPWQEH-CTNGQTDRSA-N 378.472 2.966 0 50 GFAA CC(=O)N(CCC(=O)N[C@H](C(=O)O)c1ccc(C)c(C)c1)Cc1ccccc1 262896855 HVHHYDBNDHPVMV-NRFANRHFSA-N 382.460 2.984 0 50 GFAA O=C(c1ccc2cc[nH]c2c1)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263619079 WUDPADYITOAVGC-UHFFFAOYSA-N 384.439 2.971 0 50 GFAA O=C(NCc1cccc(-n2cncn2)c1)[C@@H]1CCCN(Cc2ccccc2)C1 265513737 AYUJBFHGHLUZFS-HXUWFJFHSA-N 375.476 2.796 0 50 GFAA Cc1ccc(C(C)C)c(OCC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)c1 276654121 YILOWDZIIAHLPK-KRWDZBQOSA-N 397.523 2.602 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccc3)nc3ccccc23)CN1 299771199 UFWWWJOYWZAMEW-YWZLYKJASA-N 375.428 2.535 0 50 GFAA C[C@@H](C(=O)N1C[C@@H]2CCCN(C(=O)[C@H](C)c3cccnc3)[C@@H]2C1)c1cccnc1 330066379 SUUVORBJYSYJRP-SGLNWRHMSA-N 392.503 2.833 0 50 GFAA Cc1cnccc1OC1CCN(C(=O)N[C@@H]2CCOC3(CCOCC3)C2)CC1 333492491 ZQHUBTBJNOFDIR-QGZVFWFLSA-N 389.496 2.671 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N1CCC(OC[C@H]2CCOC2)CC1 363744330 BKGHSUVOFCVWSD-SFHVURJKSA-N 384.480 2.981 0 50 GFAA CC1(C)OB(c2cc(C#N)c(B3OC(C)(C)C(C)(C)O3)cc2Cl)OC1(C)C 382066630 RDZQPXNNBYHBHR-UHFFFAOYSA-N 389.497 2.810 0 50 GFAA O=C(NCc1csc(-c2cnccn2)n1)c1cc(-c2ccccc2O)[nH]n1 670461905 UGVOOUONHFEBQT-UHFFFAOYSA-N 378.417 2.626 0 50 GFAA Cn1cc(Cl)c(C(=O)NCC2CCN(C(=O)/C=C/c3ccccc3)CC2)n1 827910674 UERSDSMVDNDAOG-BQYQJAHWSA-N 386.883 2.755 0 50 GFAA CC1(C)CN(C(=O)NCc2ccc(O)nn2)[C@H]1c1nccn1Cc1ccccc1 952892666 PIHOJGGCQHTEOC-SFHVURJKSA-N 392.463 2.720 0 50 GFAA CCc1cc(S(=O)(=O)N(C)C[C@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC 952986548 IAKUHXMISHXKIH-CQSZACIVSA-N 382.526 2.525 0 50 GFAA CC1=C(CCN2CCC(=O)N(CCN3CCOCC3)CC2)C(C)(C)CCC1 1506415902 BOLVBVLFWGOTKK-UHFFFAOYSA-N 377.573 2.770 0 50 GFAA Cc1cc(C)n(C2CN(S(=O)(=O)c3cc(-c4cc(C)[nH]n4)sc3C)C2)n1 1506426715 JXAAHZLOYKQJAG-UHFFFAOYSA-N 391.522 2.814 0 50 GFAA Cc1[nH]nc(-c2ccc(S(=O)(=O)N3CCC[C@]4(CCC[C@H]4O)C3)o2)c1C 1704359647 XKRYHGVHEZIUFG-CRAIPNDOSA-N 379.482 2.602 0 50 GFAA CCOC(=O)N1CCC(N2CCCN(C(=O)CCc3ccccc3)CC2)CC1 1772804302 LNTQVYALYWJETB-UHFFFAOYSA-N 387.524 2.774 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)C[C@]2(CCC(=O)O)C1 1772819349 KBPSDTRIUGXMRZ-ZHRRBRCNSA-N 398.507 2.531 0 50 GFAA Cc1c(CN2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cnn1C 1857683329 VQXSIARJPFCRGL-QFIPXVFZSA-N 390.491 2.766 0 50 GFAA CN1CC2(C1)CN(C(=O)C[C@H]1CCCN(c3nc4ccc(Cl)cc4o3)C1)C2 1857722140 PFKJTGOUXRTKPL-CQSZACIVSA-N 388.899 2.862 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3sc(N4CCOCC4)nc3C)CC2)c1 1857730988 GYJLJIFCCYCRCI-UHFFFAOYSA-N 386.521 2.559 0 50 GFAA CCCN1CCC[C@@]2(CCc3c(N4CCc5c(O)ncnc5C4)nc(C)nc32)C1 1875249177 JUXDZXMWUWFAHC-JOCHJYFZSA-N 394.523 2.533 0 50 GFAA O=S(=O)(NCc1ccccc1)C1CCN(Cc2cccc3c2OCC3)CC1 1875287984 ISHSWGXSOCKJKA-UHFFFAOYSA-N 386.517 2.706 0 50 GFAA CCCc1sc(NC(=O)CCNS(C)(=O)=O)nc1-c1ccc(OC)cc1 1940194985 GTOYOPWEDPNZHI-UHFFFAOYSA-N 397.522 2.649 0 50 GFAA CCC(=O)N1C[C@@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CN1CCC2(CCCO2)CC1 2100480686 POOYGESRZKBMDX-QVHJCDIPSA-N 398.547 2.645 0 50 GFAA Cc1ccc(CNC(=O)[C@@]23CCCC(=O)N2CCC3)c(OC[C@H]2CCOC2)c1 2325808413 XXENOPPDKNPYBN-JTSKRJEESA-N 386.492 2.572 0 50 GFAA Cc1cnc(C(C)(C)NC(=O)C[C@@H]2Cn3nc(-c4ccccc4)cc3NC2=O)[nH]1 2325859813 LLJASZBWBWEYTR-OAHLLOKOSA-N 392.463 2.592 0 50 GFAA O=C(O)[C@H](Cc1csc(Br)c1)NC(=O)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 2325875918 FTEPQQCFVSEAMR-LYUGOTMTSA-N 384.295 2.915 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC2(CC1)C[C@@](C)(O)CCO2 2356156849 TYERYTPGZKXOAU-QFIPXVFZSA-N 397.519 2.954 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(C(=O)Cc2cccc(C(F)(F)F)c2)C1 2356157404 JBDXGWSEIPGLPP-IBGZPJMESA-N 390.409 2.957 0 50 GFAA COc1ccc2nc(O)c(CN3CCC[C@@]4(CCc5c[nH]c(=N)nc54)C3)cc2c1 2356158428 KAUIULVGJBOHOA-JOCHJYFZSA-N 391.475 2.632 0 50 GFAA CS(=O)(=O)N(Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1)c1ccccc1 839567 JAIGEPWMHQYETA-IBGZPJMESA-N 388.489 2.562 0 50 GFAA CCc1ccc(OCC(=O)NC(=S)Nc2cc(C(=O)O)ccc2OC)cc1 1159656 ZRUJXUCWVMCLOC-UHFFFAOYSA-N 388.445 2.848 0 50 GFAA CCOC(=O)N1CCN(c2nc(C)c3c(n2)C[C@H](c2ccco2)CC3=O)CC1 2237331 CPIOTALASNSZDX-AWEZNQCLSA-N 384.436 2.569 0 50 GFAA CCOc1cc(C(=O)N2CCC3(CC2)OCCO3)cc(OCC)c1OCC 2872833 PEUPSCBFXJGQGS-UHFFFAOYSA-N 379.453 2.862 0 50 GFAA COc1ccc(N(CC(=O)N2CCCCC2)S(=O)(=O)c2ccccc2)cc1 4996186 HSZKJXMJBDWGTQ-UHFFFAOYSA-N 388.489 2.903 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccc(Cl)cc3)n2)cc1 5388999 VZHIMXGRDZEUOC-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA COc1ccc(S(=O)(=O)NCc2cccnc2)cc1C(=O)Nc1ccccc1 6715945 DLGYQNDMVCQJFR-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA Cc1cc(C)n(CCNC(=O)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)n1 11933103 BTJCXTSUETVKQA-KRWDZBQOSA-N 388.899 2.708 0 50 GFAA COc1ccc(F)cc1C(=O)[C@@H]1CCCN(C(=O)CCN2CCCCO2)C1 12594297 VCJLGHJRDRKMHO-OAHLLOKOSA-N 378.444 2.673 0 50 GFAA COc1ccc(F)c(C[C@]2(CCC(=O)NCc3cccnc3)CCC(=O)N2)c1 14880401 PYNJHOIMSXEOKO-NRFANRHFSA-N 385.439 2.517 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3c[nH]c4ccccc34)C[C@@H]2CCO)CC1 23375295 PDQMUDHQFJKERN-NRFANRHFSA-N 384.568 2.909 0 50 GFAA Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1CCC(=O)N(Cc2ccccn2)C1 39420682 LHEBULKRBLTWAH-QGZVFWFLSA-N 390.487 2.969 0 50 GFAA Cc1cccc(-c2noc(Cn3cnc4sc5c(c4c3=O)CCNC5)n2)c1 65376575 XLJUXMIWCHGHBC-UHFFFAOYSA-N 379.445 2.510 0 50 GFAA O=c1cc(CN2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)nc(C2CC2)[nH]1 67605727 SDQKIXVEXYMUOA-UHFFFAOYSA-N 392.415 2.589 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)CCc2nc3ccccc3[nH]c2=O)C[C@H]1O 67947589 PEOVZLXWACQWJX-RDTXWAMCSA-N 397.500 2.603 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c1 72140636 PNFZALYECWSIPX-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=c1cc(CN2CCN(CCOc3ccccc3)CC2)[nH]c2ccc(F)cc12 91713594 QMJXOUUPPSKEST-UHFFFAOYSA-N 381.451 2.864 0 50 GFAA Cc1cnn(CCCN2CCC[C@@]3(CCC(=O)N(Cc4ccccn4)C3)C2)c1 92062386 QZTSADCIRADIPA-JOCHJYFZSA-N 381.524 2.881 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@@H](c4nccn4CCCN(C)C)C3)cn2c1 95372069 IZLUJJCAGHGGTD-GOSISDBHSA-N 394.523 2.811 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)Cn3ccc4ccccc4c3=O)CC2)n1 95498922 MQJAUIMOCIUDEE-UHFFFAOYSA-N 380.448 2.914 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)CCc2nc(-c3ccccc3C)no2)on1 96137441 BZNUXFNKPQCLKA-QAPCUYQASA-N 396.447 2.648 0 50 GFAA Cc1c(C(=O)Nc2cccn(C)c2=O)cnn1-c1cccc(Br)c1 114348386 TXODCZDGMZADID-UHFFFAOYSA-N 387.237 2.894 0 50 GFAA O[C@H](COc1ccc(-c2ccccc2)cc1)CN1CCOC2(CCOCC2)C1 135636433 DWNIXLIRYYCVPM-NRFANRHFSA-N 383.488 2.975 0 50 GFAA CC(C)[C@@H](NC(=O)c1cc(-c2ccccc2)on1)c1nc(-c2nnc[nH]2)no1 154444533 LRAWDJVUMRHSBR-CQSZACIVSA-N 379.380 2.637 0 50 GFAA CCc1nccn1[C@@H]1CCCN(CCOc2cccc(S(C)(=O)=O)c2)C1 154947636 PSBLGSODGPMMHB-MRXNPFEDSA-N 377.510 2.565 0 50 GFAA O=C1c2c(-c3nc(-c4ccsc4)no3)nnn2CCN1Cc1ccc(F)cc1 169765757 MIWPAKRUOQLVTE-UHFFFAOYSA-N 396.407 2.852 0 50 GFAA CC(=O)c1cc(C(=O)OCCn2cc(Br)ccc2=O)c(C)nc1C 170600973 JRKVRYLWNHYNON-UHFFFAOYSA-N 393.237 2.682 0 50 GFAA COc1ccccc1[C@H](c1nccn1C)N1C(=O)CN(Cc2ccccc2)C1=O 170613721 OHCQFZNMUAKYQQ-HXUWFJFHSA-N 390.443 2.983 0 50 GFAA CN1CC[C@H]2[C@H](CCCN2C(=O)NC2CCN(CCc3ccccc3)CC2)C1 182301091 XQEXVPXHJKDNJV-IRLDBZIGSA-N 384.568 2.819 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(N4CCCC4)ccn3)C2)n1 194461519 XWUSPQSFPKOOET-KRWDZBQOSA-N 393.491 2.876 0 50 GFAA O=C(NC1CCOCC1)c1cccc(S(=O)(=O)N2CCCCCCC2)c1 214958920 OYLOMYISFNDOHH-UHFFFAOYSA-N 380.510 2.550 0 50 GFAA COc1cc2c(cc1CN(C)Cc1nc(-c3ccccn3)no1)OCCCO2 215617656 UUQHFYOQXQIRDA-UHFFFAOYSA-N 382.420 2.934 0 50 GFAA CCOC(=O)c1c[nH]c(=O)c([C@@H](CC(=O)O)c2c(F)cccc2Cl)c1O 218203539 LXZNQIBYJUDPSA-QMMMGPOBSA-N 383.759 2.656 0 50 GFAA CCn1cc(C(=O)N[C@H](C)c2nc(C)no2)c(=O)c2cc(F)c(F)c(F)c21 244811642 SIGRVBOYMHTMCP-SSDOTTSWSA-N 380.326 2.621 0 50 GFAA C[C@@H](C(=O)N1CCC2(CC1)COC(=O)O2)N1C(=O)c2cccc3cccc1c23 252495870 PDIRKLFLIZTDFR-ZDUSSCGKSA-N 380.400 2.717 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@H](NCc2ccc(F)cc2F)CNC3=O)cc1 263617982 QTNFCVVTSVCNND-IBGZPJMESA-N 384.386 2.869 0 50 GFAA Cn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)c2ccc(C(C)(C)C)s2)cn1 275380927 YQZNTFVOYKCPKP-XJKSGUPXSA-N 383.539 2.978 0 50 GFAA CN1C(=O)C[C@H](C(=O)NC2CCC(C(=O)O)CC2)[C@H]1c1cccc(Cl)c1 299746119 VJVVBLXLRGWOMZ-YEPBWIEESA-N 378.856 2.619 0 50 GFAA O=C(NCCCn1ccnc1)c1cccc(-c2cc(N3CCCC3)cnn2)c1 299792875 GMNYVZSSEKYNEV-UHFFFAOYSA-N 376.464 2.760 0 50 GFAA OC1=NC2(CCC(NC[C@H]3CCc4nc(C(F)(F)F)cn4C3)CC2)C(O)=N1 328633256 LXVXTRADUHGCCN-VHTNMKBUSA-N 385.390 2.619 0 50 GFAA CS(=O)(=O)c1ccc(-c2nc(-c3ccc(OCC(F)F)cn3)no2)cc1 350613139 VUIPWKRQKXODPI-UHFFFAOYSA-N 381.360 2.846 0 50 GFAA O=C(Nc1sccc1C(=O)N1CC(n2cncn2)C1)c1ccc2c(c1)CCC2 370986144 QSPLGNJMWBSONW-UHFFFAOYSA-N 393.472 2.778 0 50 GFAA CCOC(=O)c1nc(NC(=O)CC2(Cn3cnnn3)CCCCC2)sc1C 409413220 FUZSPSKJOBBCCR-UHFFFAOYSA-N 392.485 2.594 0 50 GFAA Cc1cc(C)c(C[C@H](C(=O)N2CCn3c(O)nnc3C2)C(F)(F)F)c(C)c1 438430473 NLEUGIDNMFNBDU-CQSZACIVSA-N 382.386 2.672 0 50 GFAA COCC(COC)NC(=O)[C@@H]1CCCc2sc(Nc3ccccc3)nc21 456234202 ZSEOPHGGJRRBHJ-OAHLLOKOSA-N 375.494 3.084 0 50 GFAA CN1CC2(CCN(C(=O)C[C@@H](c3ccccc3)c3ccco3)CC2)OCC1=O 670454116 FOQWHJFJHJOWHB-SFHVURJKSA-N 382.460 2.651 0 50 GFAA CC[C@@H](NS(=O)(=O)c1ccc(OC)c(C(=O)NC)c1)c1nc(C)c(C)s1 822668892 OJQBZBSDNIOCJL-CQSZACIVSA-N 397.522 2.558 0 50 GFAA CCn1ncnc1CN1CCC[C@@H](CNC(=O)c2ccc(OC)c(Cl)c2)C1 824716483 MVZLMVWYVPHHON-AWEZNQCLSA-N 391.903 2.602 0 50 GFAA Cc1cnc(CN2CC[C@H](c3ccc(F)cc3)[C@H](NC(=O)C(F)(F)F)C2)[nH]1 862413840 DESKTXQSRCQHDZ-HUUCEWRRSA-N 384.377 2.894 0 50 GFAA C[C@H]1Cc2cc(-c3ccc(CNC(=O)c4c(CN)cnn4C)cc3)ccc2O1 876891797 GJZAJSXKLQRKJA-AWEZNQCLSA-N 376.460 2.799 0 50 GFAA Cc1ncsc1CN(C)C[C@@H]1CCN(C(=O)[C@H]2CCC[C@@H](C(=O)O)C2)C1 888095920 FIBXZAOTTICNBT-HRCADAONSA-N 379.526 2.623 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@H](C)[C@@](C)(CO)C1 888101833 XGRBCOCPQUOXJA-MEDUHNTESA-N 376.375 2.754 0 50 GFAA COc1cc(Cl)c(CN[C@@H]2CCC(=O)N(C)[C@H]2c2ccnn2C)cc1OC 922405710 JJIXQQMFTVLLJS-AUUYWEPGSA-N 392.887 2.542 0 50 GFAA CC[C@@H]1c2ccccc2CN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 932246911 HJKUPJPDGWSDKH-MRXNPFEDSA-N 385.445 2.911 0 50 GFAA COc1ccc(CCN(Cc2ccncc2)C(=O)Cc2nonc2C)cc1OC 1506398922 HQKGUFVKKFHELY-UHFFFAOYSA-N 396.447 2.604 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@H]2CCCN(C(=O)c3cccs3)C2)s1 1506403528 PYDZTRBRZXUYPB-LBPRGKRZSA-N 378.523 2.979 0 50 GFAA Cc1noc(C)c1CO[C@H]1COCC[C@@H]1NC(=O)c1cc2ccccc2cn1 1565527772 XRQXMEVEEWYQAP-ICSRJNTNSA-N 381.432 2.944 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(CCC(=O)NC3CCCCC3)C1)CC2 1704300917 ZKVSPKYHBXUYCP-JOCHJYFZSA-N 385.556 2.661 0 50 GFAA Cc1ccc(-c2ccccc2CN2C[C@H]3CN(Cc4cnc[nH]4)C[C@@]3(CO)C2)o1 1772805693 PMHKNQXNMHZHBF-WMZHIEFXSA-N 392.503 2.904 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cncnc4C)[C@H]4CC[C@]3(C2)O4)s1 1857725370 SUMLWFSYIVTBQX-QEUVDIPISA-N 398.532 2.564 0 50 GFAA COc1cc(Cl)cc(C(=O)N2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c1 1857729606 QZZKMLTUYMNODH-FCEWJHQRSA-N 378.856 2.547 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)/C=C/c2ccccc2)cn1 1857735632 IGAUOWJIOYBJSK-FACVGWQGSA-N 394.519 2.888 0 50 GFAA COc1cccc(NC(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c1 1875246522 QFFJPYJXYGKBIS-WIYYLYMNSA-N 384.432 2.607 0 50 GFAA O=C(O)C[C@@H]1CCN(C(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)C1 1875277209 DMFVLNZFNOWHIM-QFBILLFUSA-N 380.444 2.871 0 50 GFAA O=C(c1ccc(=NCC2CC2)[nH]c1)N1CCN(c2nsc3ccccc23)CC1 1875316283 FYASGMAZEGTVIC-UHFFFAOYSA-N 393.516 2.898 0 50 GFAA Cc1cc2ncnc(N[C@@H]3CN(C(=O)[C@H]4C[C@H](N(C)C)C4)CC(C)(C)C3)c2[nH]1 1875327896 OTIGLYWPIXFONQ-JYJNAYRXSA-N 384.528 2.646 0 50 GFAA O=C(N=[S@@]1(=O)CCC[C@]2(CCCN2)C1)c1cccc(Oc2cnccn2)c1 1875392986 CDSHFDCRTBOKIJ-XHCCPWGMSA-N 386.477 2.793 0 50 GFAA Cc1nc(NC(=O)Cc2cc3c(cc2Cl)OCCO3)sc1C(=O)N(C)C 1940196446 MIRYFPKWKNDPDK-UHFFFAOYSA-N 395.868 2.759 0 50 GFAA Cc1ccc(-c2cccnc2)cc1NC(=O)N1CC[C@H](n2cc(CN)nn2)C1 2325859996 TVSLYUMAQFRQPE-SFHVURJKSA-N 377.452 2.586 0 50 GFAA Cc1nn(Cc2nnc3n2[C@H](C)C(=O)N(CCc2ccccc2)C3)c(C)c1C 2356138652 OHLXSBDDNNTUMB-QGZVFWFLSA-N 378.480 2.594 0 50 GFAA Cc1cccn2cc(C(=O)N3CCC[C@]4(CCc5cnc(N(C)C)nc54)C3)nc12 2356147144 JWSQRBRMRDZWKL-QFIPXVFZSA-N 390.491 2.619 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCN(C)C(=O)[C@H]3C)cc2)c2sccc2n1 2356148854 WPZPNQMPRAKSMD-GFCCVEGCSA-N 380.473 2.969 0 50 GFAA O=C(c1nc2ccccc2[nH]c1=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccccc2)C1 2356166288 RDVVOEYPHZYDKJ-XSSDXNQZSA-N 389.455 2.683 0 50 GFAA Cc1ccc(OCc2nnc(SCC(=O)Nc3nccs3)n2C)cc1 1128263 MLGUDYHRXORZJH-UHFFFAOYSA-N 375.479 2.890 0 50 GFAA O=C(c1ccc(-n2ccnc2)cc1)N1CCc2nc(-c3ccccc3)nn2CC1 2356149943 YOTHLGBBBKNYOO-UHFFFAOYSA-N 384.443 2.829 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)no1 2356152035 NPKMUFYMBWEJOX-QYWGDWMGSA-N 389.496 2.699 0 50 GFAA COCCNC(=O)C1CCC(Cn2c(=S)[nH]c3ccccc3c2=O)CC1 4014254 KFXLQROCBSAZFL-UHFFFAOYSA-N 375.494 2.628 0 50 GFAA O=S(=O)(N[C@H]1CCO[C@@H]1c1cccnc1)c1ccc(OCC(F)F)cc1 225545837 FOMRNOBGHJVZTH-DOTOQJQBSA-N 384.404 2.534 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1Cc1ccc(I)cc1 100411356 OEDCLHKPZZFZSE-NZBPQXDJSA-N 393.224 2.988 0 50 GFAA Cc1cc(C)n(CCc2nnc(NC(=O)N[C@@H](C)Cc3ccccn3)s2)n1 23399453 IWSNKCVBOGOHKN-LBPRGKRZSA-N 385.497 2.742 0 50 GFAA CC1(C)[C@H](c2ccccc2)CCN1S(=O)(=O)c1ccc2nc(O)nc(O)c2c1 420743901 BBCGQBYDFJTLBL-INIZCTEOSA-N 399.472 2.998 0 50 GFAA O=C1C[C@H](N2CCN(c3ccccc3F)CC2)C(=O)N1c1cccc(Cl)c1 100519320 VJMOJFBSKWCRJW-SFHVURJKSA-N 387.842 2.933 0 50 GFAA O=C(O)c1nn(CCCc2ccccc2)c2c1CN(C(=O)c1ccccn1)CC2 67675382 GIIYTALWQMNSFG-UHFFFAOYSA-N 390.443 2.808 0 50 GFAA O=C(CN1CCOCC1)Nc1ccc(Oc2cccc(Br)c2)nc1 136776797 YWSHWPAZSFCJFH-UHFFFAOYSA-N 392.253 2.907 0 50 GFAA Cc1ccccc1[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1ccccc1 65361819 KWQFNUYJICIHRC-HXUWFJFHSA-N 386.517 2.872 0 50 GFAA Cc1nc(C)c(C(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)nc1C 252510381 ZJAORKYPYHLKEF-UHFFFAOYSA-N 388.493 2.875 0 50 GFAA Cc1cc2c(N3CCC[C@H](c4n[nH]cc4CN4CCOCC4)C3)ncnc2s1 328616837 CDBNDWATVZIBOO-HNNXBMFYSA-N 398.536 2.939 0 50 GFAA C[C@@H](C(=O)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1)n1cnnn1 67756021 YNXGHPAEUXOKRV-LBPRGKRZSA-N 399.838 2.681 0 50 GFAA COc1cccc(C2=NO[C@@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)C2)c1 4904238 LTIPTPJAOJDIGE-HXUWFJFHSA-N 383.423 2.676 0 50 GFAA Cc1ccc(NC(=O)c2cccc(NC(=O)c3cccnc3)c2)cc1-n1cnnn1 363092337 SFDARRMGCNAYLJ-UHFFFAOYSA-N 399.414 2.870 0 50 GFAA O=S(=O)(C[C@H]1CCCC1(F)F)N1CCCC[C@@H]1c1nnc2n1CCCC2 333479983 XSOZVXUXWDWIRG-ZIAGYGMSSA-N 388.484 2.907 0 50 GFAA CN(C[C@H]1CC12CCN(C(=O)Cn1cc(-c3ccccc3)nn1)CC2)C1CC1 367354624 YHBUNAHXAVLNMD-GOSISDBHSA-N 379.508 2.668 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(CCCF)CC2)C1 71770806 ZXQLVJLNBAXKBV-FQEVSTJZSA-N 375.532 2.881 0 50 GFAA Cc1c(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cnn1-c1ccncc1 129720647 XTSJCYDKMMHKAY-UHFFFAOYSA-N 381.411 2.804 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1 158141414 LXPMVMPUMCUDEW-VQIMIIECSA-N 395.511 2.841 0 50 GFAA CC(C)NC(=O)C(=O)N1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 71755294 VIRWOZLQNPAGHX-FQEVSTJZSA-N 380.488 2.961 0 50 GFAA O=C(CCC(=O)N1CCCO[C@@H](CN2CCCCC2)C1)c1ccc(F)cc1 216434727 YKVZSDRTFOMMTA-IBGZPJMESA-N 376.472 2.892 0 50 GFAA C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCC2CCN(S(C)(=O)=O)CC2)C1 287636866 UGOFMLIWBJOXIS-APWZRJJASA-N 393.553 2.841 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1CC(=O)N(C(C)C)C1=O 177574976 PVLHOQFAVNRDNH-GFCCVEGCSA-N 393.802 2.708 0 50 GFAA CC(=O)N[C@H]1CCN(c2nccc(-c3cnn(-c4ccccc4Cl)c3)n2)C1 19229221 XQAXMYDSNSICJV-HNNXBMFYSA-N 382.855 2.698 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)CC[C@@]1(CCC(=O)O)CCC(=O)N1 220036053 CWVFJMDBKWZXKB-HXUWFJFHSA-N 389.427 2.559 0 50 GFAA Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N3CCN4CCC[C@@H]4C3)c12 20606155 DTEXTVRNUSPOTI-CQSZACIVSA-N 381.505 2.925 0 50 GFAA OC[C@H](O)c1cc2n(n1)CCCN(CC(c1ccccc1)c1ccccc1)C2 221373721 KCKICXQLMRHMDZ-QHCPKHFHSA-N 377.488 2.947 0 50 GFAA CN(C)CCCC1CCN(S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)CC1 179622872 ARXWRJFVVHPLQF-UHFFFAOYSA-N 393.553 2.704 0 50 GFAA COc1cccc(C(=O)N2CCN([C@@H](C(=O)O)c3ccc(C)cc3C)CC2)c1 95363622 PVUAIEXHPIKNGI-HXUWFJFHSA-N 382.460 2.896 0 50 GFAA O=C(C[C@@H]1C[C@@H]2C=C[C@H]1C2)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95498702 BDPGGYHVANKRIM-NJAFHUGGSA-N 394.519 2.624 0 50 GFAA CCc1cc(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C)C3)[nH]n1 91269913 XUPMJIGQGQFDDT-GOSISDBHSA-N 380.492 2.840 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC(c2nccn2Cc2ccccn2)CC1 95503520 XRNFZEKVBJWEDI-UHFFFAOYSA-N 376.464 2.558 0 50 GFAA O=C1CCC2(CCN(C(=O)NCc3ccccc3)CC2)CN1C[C@@H]1CCCO1 92080357 ACSDOOHNVQRQFD-IBGZPJMESA-N 385.508 2.780 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)N[C@@H]1CCC[C@H]1OCc1ccccc1 91621436 XURGGXCVGQLHFQ-WOJBJXKFSA-N 377.444 2.651 0 50 GFAA CN(CC1CCN(CCc2cccc(F)c2)CC1)C(=O)c1ccc(=O)n(C)c1 95518315 CBRFIOXHUYZYAY-UHFFFAOYSA-N 385.483 2.551 0 50 GFAA C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1ccc2cncn2c1 297448030 JIKINACZGFVFAP-CQSZACIVSA-N 379.468 2.870 0 50 GFAA O=C(NCCCn1ccc2ccccc21)c1ccc(C(=O)N2CCOCC2)cc1 527686139 GEHXQGNXBIPDRJ-UHFFFAOYSA-N 391.471 2.934 0 50 GFAA COc1ccc(CNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)O 299753451 YGEGAJGHJTXGDK-HXUWFJFHSA-N 396.443 2.763 0 50 GFAA Cc1cccc(F)c1S(=O)(=O)NC[C@](O)(c1ccccc1)C(F)(F)F 184873455 SZNDCMTXVZEIAJ-HNNXBMFYSA-N 377.359 2.863 0 50 GFAA O=C(NCc1nc([C@@H]2CC(=O)N(Cc3ccccc3)C2)no1)NC1CCCCC1 274091802 UKCDYLGCDGLESV-MRXNPFEDSA-N 397.479 2.718 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl)NCC1CCCCC1 55169097 ASFGJFUCZMKLPT-GOSISDBHSA-N 395.906 2.866 0 50 GFAA c1ccc2c(-c3ncc(CN4CCN(Cc5nc[nH]n5)CC4)cn3)cccc2c1 829078385 UXXCBJFUXXMBMK-UHFFFAOYSA-N 385.475 2.733 0 50 GFAA O=C(O)c1ccccc1S(=O)(=O)NCCCc1nc2ccc(Cl)cc2[nH]1 825573678 DKIHYYVYDHRDCU-UHFFFAOYSA-N 393.852 2.826 0 50 GFAA O=c1cc(CN2CCC[C@H](c3nc4ccccc4o3)C2)nc2c(O)cccn12 1506406799 JIBCNGJQSRTWGE-AWEZNQCLSA-N 376.416 2.921 0 50 GFAA Cc1cnn(C[C@H]2CN(C(=O)Nc3nc(C)c(C(F)(F)F)s3)CCO2)c1 952845203 JCLYFJJVGSUJIM-LLVKDONJSA-N 389.403 2.908 0 50 GFAA C[C@H](C(=O)NS(=O)(=O)[C@@H]1CCc2ccccc21)n1ccc(C(F)(F)F)n1 1875285473 ODZRFVIPOPSQQJ-ZWNOBZJWSA-N 387.383 2.596 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N3CC[C@]4(C)[C@H](C3)C4(F)F)CC2=O)cc1OC 1875255902 FRCQVPQYNDVTSX-RNRVQEDPSA-N 394.418 2.560 0 50 GFAA O=C(Nc1cccc(Cn2cnnc2)c1)c1cccc(CN2CCCC2=O)c1 1875260917 NTCWZNDZCANIOC-UHFFFAOYSA-N 375.432 2.701 0 50 GFAA O=C(O)C[C@H](CO)C(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 1875313627 RKKUSHNQQCFOTP-SNVBAGLBSA-N 388.367 2.774 0 50 GFAA O=C1N[C@H](Cc2cc3ccccc3o2)C(=O)N[C@H]1Cc1c[nH]c2cccc(F)c12 1875320246 MLAUQOJSGGLQLU-ZWKOTPCHSA-N 391.402 2.822 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](c3ccccn3)C3CC3)C2)c1C 1875397674 JUVJKJKEQCEEIE-IEBWSBKVSA-N 394.523 2.510 0 50 GFAA Oc1cc(N2CC[C@H](Nc3nc(-c4ccccn4)nc4sccc34)C2)ncn1 1875362646 NVLBUTHAPRMPAV-LBPRGKRZSA-N 391.460 2.940 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2ccc(F)cc2)nc1 1875403366 UUNVQVNPEMUJNM-GDIGMMSISA-N 396.422 2.779 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)Nc3ccccc3OC[C@H]3CCCO3)nn2)CC1 952979189 NATCIGXGKTVESE-OWCLPIDISA-N 385.468 2.531 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC[C@@H](O)c2cccc3ccccc23)s1 1309671036 NJPIRKIRUVBCFP-OAHLLOKOSA-N 391.470 2.700 0 50 GFAA O=C(c1ccn2ccccc12)N1CCN(C(=O)C2CC2)C2(CCOCC2)CC1 1775962931 YDJGEUQTXBKRFN-UHFFFAOYSA-N 381.476 2.573 0 50 GFAA C[C@@H](NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1)c1cccc(O)c1 170856658 ILOSQWWRPDMMGY-GFCCVEGCSA-N 382.869 2.544 0 50 GFAA COCCn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)c2ccccc21 194371480 FJDATDAPMIHBSH-UHFFFAOYSA-N 393.491 2.687 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NCCCc2cnn(C)c2)s1 1506424302 IVUDRQKFHBYJGA-UHFFFAOYSA-N 380.495 2.665 0 50 GFAA CCc1nc(CN2CCC(O)(Cc3cc(-c4cccc(OC)c4)no3)CC2)no1 1506400138 ULGSOHMUSVDUMU-UHFFFAOYSA-N 398.463 2.865 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)C3CCOCC3)CC1)OCC2 1704297499 BDEURSCQJWRZGD-UHFFFAOYSA-N 375.465 2.521 0 50 GFAA CN(CCc1cnn(C)c1)C(=O)[C@H]1CCc2sc(-c3ccncc3)nc2C1 1772813017 SVSJNCVEQGMFIZ-INIZCTEOSA-N 381.505 2.745 0 50 GFAA Cc1nnc(CCNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)s1 1772819203 GWQNZVRLAFDTOV-ZDUSSCGKSA-N 385.518 2.829 0 50 GFAA CCCCn1c(CN(C)Cc2nonc2C)cnc1S(=O)(=O)CC1CCC1 11820451 OEPVCXODKXHSOK-UHFFFAOYSA-N 395.529 2.580 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@]2(CCCN(CCCc3ccccc3)C2)C1 12301690 FQQYZOFMQWFVOV-QHCPKHFHSA-N 379.504 2.881 0 50 GFAA O=C1CCC(C(=O)N2CCC[C@@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)=NN1 12594382 SEZSUIXDVXXBDP-MRXNPFEDSA-N 389.455 2.626 0 50 GFAA CCOCCCN[C@@H]1CCc2c(c(C(=O)N3CCCC3)nn2CC(C)C)C1 14750614 YYHXRNXEFQBNCR-QGZVFWFLSA-N 376.545 2.649 0 50 GFAA CC(=O)Cc1nsc(NC(=O)c2nnn(-c3cccc(C)c3)c2C(C)C)n1 16625412 QFQRKOPEACPCBS-UHFFFAOYSA-N 384.465 2.934 0 50 GFAA CNC(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)c1cncc(-c3ccccc3)c1)C2 1857528125 JQGSASBUCRHLJK-RCCFBDPRSA-N 388.427 2.724 0 50 GFAA COC(=O)[C@H]1CN(C(=O)C[C@H]2CCCO2)C[C@@H]1c1ccc(Br)cc1 1857531819 QACKIDBGMOBALS-OAGGEKHMSA-N 396.281 2.733 0 50 GFAA O=C1CC2(CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)OCCN1 1857684851 HMUIXKYXRBOZNS-UHFFFAOYSA-N 380.444 2.990 0 50 GFAA C/C=C/CCCC(=O)N1CCC2(CC1)CN(Cc1ccncc1)C[C@H]2C(=O)O 1857684972 LXPSCQXNEQDSEX-PHXNAMCJSA-N 385.508 2.953 0 50 GFAA Cc1cnc(CN2CCC3(CC2)CN(Cc2cccc(F)c2)C(=O)CCO3)cn1 1857715802 JAMYTFMVIPCFRX-UHFFFAOYSA-N 398.482 2.708 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(Cc3cccc(O)c3Cl)C[C@]23CC[C@H]1O3 1857721286 IENWHDHRVRXJDG-DKYLXPRQSA-N 378.900 2.941 0 50 GFAA O=C([C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1)N1CCC(CO)CC1 1857732085 BJRCCLSUFXGVMH-CQSZACIVSA-N 377.872 2.929 0 50 GFAA Cc1cc(Br)ccc1NCC(=O)NCCc1cccc(C(N)=O)c1 225505043 BJYUBPFOWLZBRO-UHFFFAOYSA-N 390.281 2.627 0 50 GFAA CNC(=O)COc1ccc(NC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2)cc1 265302271 POFHNBYWRJBGAM-IBGZPJMESA-N 396.491 2.944 0 50 GFAA Cc1c(Br)c(=O)[nH]c(=O)n1Cc1c(F)cccc1C(F)(F)F 35973432 RDQPTRWUBKZZFJ-UHFFFAOYSA-N 381.123 2.814 0 50 GFAA in-vitro CC(=O)N[C@H](CC(=O)N1C[C@@]2(C)CN(C)C[C@]2(C)C1)c1ccc(Cl)cc1 823754869 IBCTXPKRIKCZNH-MISYRCLQSA-N 377.916 2.708 0 50 GFAA C[C@H]1CC(=O)Nc2cc(C(=O)NCCC3CC3)ccc2N1C(=O)N1C[C@@H]2C[C@H]2C1 1775964564 CKFRXCBNKKOFGO-JQFCIGGWSA-N 396.491 2.825 0 50 GFAA Cc1ccc(CN2CC[C@@H](CN(C)C(=O)c3nc4ccccc4[nH]c3=O)C2)s1 2325780324 YMTVWIOHIRKIPI-HNNXBMFYSA-N 396.516 2.887 0 50 GFAA O=C(C[C@H](c1ccccc1)C1CC1)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 2325798210 WKJSNNAZZAMQHL-MRXNPFEDSA-N 384.457 2.935 0 50 GFAA CCOC(=O)c1ccn(-c2ccc(NC(=O)N(C)[C@H]3CC[C@H]3OC)cc2F)n1 932034019 HOQQIOSMPMZHLK-DLBZAZTESA-N 390.415 2.829 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1Cl 810408 LMTSULAECSVQJO-UHFFFAOYSA-N 383.809 2.699 0 50 GFAA COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)ncn1 945489 KDUZVMMLMWUVLT-UHFFFAOYSA-N 398.444 2.847 0 50 GFAA CCOc1cc([C@@H]2CC(=O)NC(C)=C2C(=O)OC)cc(Br)c1OC 1107198 VZAABJAGVCPPNU-NSHDSACASA-N 398.253 2.907 0 50 GFAA COc1ccc(CCNC(=O)[C@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)cc1 2875208 PUVSIOOZKMFXLL-INIZCTEOSA-N 390.505 2.517 0 50 GFAA CCN(CC(=O)NCc1ccccc1Cl)S(=O)(=O)c1ccc(C)cc1 2890882 NFMPSHXFGHPDKR-UHFFFAOYSA-N 380.897 2.975 0 50 GFAA COc1cnc(C)cc1C(=O)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356158916 DVNJWJIOBXPDCL-QFIPXVFZSA-N 394.475 2.591 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)O 4700927 AYQHQTALHLLYTN-RBUKOAKNSA-N 382.460 2.643 0 50 GFAA Cn1c(SCC(=O)Nc2ccccc2O)nnc1-c1ccc2c(c1)OCO2 4736178 BVKOVPJDNOSUHY-UHFFFAOYSA-N 384.417 2.647 0 50 GFAA CCCCCNS(=O)(=O)c1ccc(OC)c(I)c1 4832596 CFVUAJYZRPREAH-UHFFFAOYSA-N 383.251 2.768 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1CCN(S(=O)(=O)c2ccccc2)CC1 6731054 ICEKTUMAJLLDSZ-UHFFFAOYSA-N 382.844 2.626 0 50 GFAA CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 34760411 DSCBSBPYDCIRPP-OAHLLOKOSA-N 389.452 2.583 0 50 GFAA in-vitro Cc1nccc(-c2cccc(N3CCC(N[C@H]4CCCCNC4=O)CC3)c2)n1 23337734 KGHIZEWZYYWKOD-NRFANRHFSA-N 379.508 2.679 0 50 GFAA CC(C)(O)c1cn(CC2CCN([C@@H]3CCN(c4ccc(F)cc4)C3)CC2)nn1 20601440 VCHNMDYYZNRVGL-LJQANCHMSA-N 387.503 2.636 0 50 GFAA CN1CCN(CC(C)(C)c2nc3c(cnn3Cc3ccccc3Cl)[nH]2)CC1 20999335 AAHWJVMMVLYROJ-UHFFFAOYSA-N 386.931 2.986 0 50 GFAA C[C@@H]1CCCC[C@@H]1NC(=O)CS(=O)(=O)Cc1nnc(-c2ccccc2)s1 122442474 KRIJZJJOJQFIGB-HIFRSBDPSA-N 393.534 2.815 0 50 GFAA CCN(Cc1ccncc1)C(=O)C[C@@H]1COCCN1C(=O)NC1CCCCC1 72429831 ZOIKEAYHWPEHSR-LJQANCHMSA-N 388.512 2.563 0 50 GFAA CCc1ccc(-c2ccc(C(=O)NC[C@@H]3CN(c4nncs4)CCO3)o2)cc1 328594562 UVMLPYIOYOWSMZ-MRXNPFEDSA-N 398.488 2.996 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)C1 363210294 GUFKVQCFDDJPBW-FUHWJXTLSA-N 399.495 2.719 0 50 GFAA O=C(Cc1csc(Cc2ccc(F)cc2)n1)N1CCC(c2nc[nH]n2)CC1 363319590 LPWWKEIWHUVAHT-UHFFFAOYSA-N 385.468 2.940 0 50 GFAA O=C(c1cc2ccccn2c1)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328636020 VHMVUEKGYSDLOY-LJQANCHMSA-N 377.448 2.543 0 50 GFAA CN1CCC[C@H]1[C@H]1CCCN1C(=O)NCC1CCN(CC(F)(F)F)CC1 364009122 ZPTRZXSZYKCPRS-JKSUJKDBSA-N 376.467 2.529 0 50 GFAA CCN(CC)[C@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccco2)C1 174160140 BAHNZMOCXBRWTR-PMACEKPBSA-N 395.503 2.789 0 50 GFAA COc1ccc([C@@H]2CC(O)=Nc3c2cnn3C2CCCC2)cc1OCC(N)=O 72115791 NWODOKSQEVTTTK-AWEZNQCLSA-N 384.436 2.995 0 50 GFAA C[C@@H]1CCc2sc(C(=O)N3CCn4c(nnc4-c4cnn(C)c4)C3)cc2C1 370954974 HRZRUVPMCQUASZ-GFCCVEGCSA-N 382.493 2.521 0 50 GFAA CN(CC(=O)N1CCC[C@@H](C(=O)O)C1)C(=O)c1ccc(Oc2ccccc2)cc1 262209145 POIJUVTVWFNUEK-QGZVFWFLSA-N 396.443 2.874 0 50 GFAA Cc1sc(=O)n(CC(=O)N2CCOC[C@H]2c2nc3ccccc3s2)c1C 374319673 AODCUWITIJMKPK-AWEZNQCLSA-N 389.502 2.736 0 50 GFAA Cc1nn(C)c2nc(-c3ccncc3)nc(N3CCN[C@@H](c4ccccc4)C3)c12 72475052 VBZCSZQBJYERIG-GOSISDBHSA-N 385.475 2.885 0 50 GFAA O=C(Cn1nc(-c2ccc(F)cc2)ccc1=O)N1CCO[C@@H](c2ccccc2)C1 44900951 CUGICDOGASKLNJ-HXUWFJFHSA-N 393.418 2.650 0 50 GFAA Cn1cc([C@H]2[C@H](CNC(=O)c3cc[nH]c3C3CC3)CC(=O)N2C(C)(C)C)cn1 285774181 BQXTYXFYBWKXLS-IFXJQAMLSA-N 383.496 2.744 0 50 GFAA Cn1c(-c2ccc3c(c2)OCO3)nc2cc(S(=O)(=O)N3CCCC3)ccc21 82120825 ULZBQXLGGNLNBU-UHFFFAOYSA-N 385.445 2.754 0 50 GFAA C[C@@H]1CN(c2ccc(CNC(=O)N(Cc3ccccn3)C3CC3)cn2)CCO1 193316794 SWSFIERSNLUIAO-MRXNPFEDSA-N 381.480 2.576 0 50 GFAA Cc1cc(NC(=O)Cn2cc(-c3ccc(CO)cc3)cn2)n(-c2ccccn2)n1 48135059 DUDZNNCHRDOXDB-UHFFFAOYSA-N 388.431 2.570 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)cc1 291117049 FUWMXAJTYNYAQQ-OAQYLSRUSA-N 387.501 2.548 0 50 GFAA O=C(Cc1ccc(Cl)cc1)c1c[nH]c(C(=O)NCCCN2CCOCC2)c1 20366768 FJKZXIDUAJRLHH-UHFFFAOYSA-N 389.883 2.546 0 50 GFAA Cc1ncsc1CN(Cc1ccccc1)C(=O)NCCCN1CCOCC1 426740312 BMUMXBSBROTIAP-UHFFFAOYSA-N 388.537 2.886 0 50 GFAA Cc1ccc(-c2cc(CN3CCN(C)[C@@]4(CCC(=O)N(C)CC4)C3)on2)cc1 230177619 UDZGMWVIMMHHMG-JOCHJYFZSA-N 382.508 2.779 0 50 GFAA CCN1CCN(C[C@@H](O)CN2CCn3c4c(c5cc(C)ccc53)CCC[C@H]42)CC1 239309067 HFDBNPIDCZKBSN-AUSIDOKSSA-N 396.579 2.641 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)Cn3ncc4ccccc4c3=O)C2)c1 95361941 ULBUKCIJFZKNGM-GOSISDBHSA-N 391.427 2.501 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@]2(C[C@H]1C(=O)O)CC2(Br)Br 97436606 HYIIWDPUZNALMC-WRWORJQWSA-N 399.079 2.957 0 50 GFAA CN(C)c1cc2c(cc1NC(=O)N1CC[C@H]1c1cccs1)n(C)c(=O)n2C 96152669 GQXFKIDJDHILQB-ZDUSSCGKSA-N 385.493 2.983 0 50 GFAA Cc1ccc(C)c(CCNC(=O)[C@@H]2CCC(=O)N(CCc3ccccn3)C2)c1 91327142 SMACKIBMXFEKPR-HXUWFJFHSA-N 379.504 2.838 0 50 GFAA Cc1cccc([C@@H](CNC(=O)CCn2c(CO)nc3ccccc32)N(C)C)c1 97776147 PVHPWDGLXLDIDN-HXUWFJFHSA-N 380.492 2.646 0 50 GFAA CCc1ocnc1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95383087 IFVYJNFCYUXKQG-IWMITWMQSA-N 395.459 2.668 0 50 GFAA O=C(O)COCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1 260164304 YTHFMKYARZJMRW-UHFFFAOYSA-N 397.500 2.948 0 50 GFAA COC[C@@H](NC(=O)N(C)CCc1nc2ccc(Cl)cc2[nH]1)c1ccnn1C 534634364 ZPWNAMRYROBWIC-OAHLLOKOSA-N 390.875 2.521 0 50 GFAA COC(=O)c1cn([C@@H](CC(C)C)c2nc3ccccc3n2C)cc2c(=O)[nH]nc1-2 263587453 GZKSNJIDYKRJDV-KRWDZBQOSA-N 393.447 2.985 0 50 GFAA O=C(NCc1ccc2sccc2c1)N1CCCN(C(=O)[C@H]2CCCO2)CC1 366107442 TYHZTGWEAXGQEE-QGZVFWFLSA-N 387.505 2.824 0 50 GFAA CCc1nccn1CCNC(=O)Nc1cc(N2CCOCC2)ccc1Cl 299793318 INEYMYZLFXBBOE-UHFFFAOYSA-N 377.876 2.757 0 50 GFAA Oc1nnc2n1CCN(C[C@@H]1CCCO[C@H]1c1ccc(C(F)(F)F)cc1)C2 953107662 BDTPFZDEOPVTIH-BBRMVZONSA-N 382.386 2.986 0 50 GFAA CNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1csc(Cc2ccccc2)n1 1875263652 JPNJOQMRPFTPBM-QGZVFWFLSA-N 379.485 2.821 0 50 GFAA Cc1sc(C)c(CNC(=O)COc2cccc(C(N)=O)c2)c1Br 1875296696 JXDYFRZJKNSDTM-UHFFFAOYSA-N 397.294 2.922 0 50 GFAA O=C(NC[C@H]1CCCO1)C1CCN(C(=O)c2cccn2Cc2ccccc2)CC1 1875254815 AZWPNENSEBPOOS-HXUWFJFHSA-N 395.503 2.684 0 50 GFAA CC(C)C[C@H](CNC(=O)[C@@H](C)n1cncn1)NC(=O)CC1(C)CCCCC1 1875329418 VEWIQNYYRDIUBF-IAGOWNOFSA-N 377.533 2.847 0 50 GFAA COC[C@@H](Cc1ccc(F)cc1F)NC(=O)[C@@H]1CCCN1Cc1ccccn1 1875320013 CJTCZIYIMLQSPG-QUCCMNQESA-N 389.446 2.698 0 50 GFAA COc1cccc(-c2noc(COC(=O)c3nnc(O)c4ccccc34)n2)c1 952962069 ZEUHUQCTYVKRPM-UHFFFAOYSA-N 378.344 2.751 0 50 GFAA CCc1nc(CNC(=O)N2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)no1 1565506754 ABTQIVAQKHOAID-MSOLQXFVSA-N 380.448 2.845 0 50 GFAA O=C(Nc1ccccc1Oc1cccc(F)c1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 167576497 XYHPCPNWGKSAAK-OAHLLOKOSA-N 394.406 2.953 0 50 GFAA O=C(Nc1cnn(Cc2nnc3n2CCCC3)c1)N[C@@H]1CCCc2occc21 277701557 HSELJTFIXGKVEY-OAHLLOKOSA-N 381.440 2.651 0 50 GFAA Cn1cc(C(=O)NCCc2nc(-c3ccccn3)cs2)c(C(F)(F)F)n1 110795622 PIALIGGVONEPMW-UHFFFAOYSA-N 381.383 2.930 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCCC[C@@H]3CO)ncn2)CC1 192294262 PMNAVDAIHLEBRK-GOSISDBHSA-N 397.523 2.917 0 50 GFAA Nc1nc2c(c(C(=O)N3C[C@@H]4CC[C@H]3CN(Cc3ccccc3)C4)n1)CCCC2 1506415105 KRXWCABDJSSMRJ-MSOLQXFVSA-N 391.519 2.674 0 50 GFAA COC(=O)CN(C)C(=O)Cc1c2c(n(Cc3ccccc3)c1C)CCCC2=O 11880019 JZYJIOFDPOMBAL-UHFFFAOYSA-N 382.460 2.538 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)CCSC)C2)cc1OC 12204414 UKOYDAVGKJIOAX-KRWDZBQOSA-N 380.554 2.922 0 50 GFAA O=C1CCC(=O)N1Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2)cc1 12322895 BOZWXTMLKRMRPE-UHFFFAOYSA-N 378.837 2.790 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3cccc4c3OCO4)CC2)CC1 12588952 LZXLFBSMCGYCJT-UHFFFAOYSA-N 387.524 2.572 0 50 GFAA COc1ccc(-n2cc(CNC(CO)CO)c(-c3ccccc3Cl)n2)cc1 12744396 XYXAJPZOPDROBQ-UHFFFAOYSA-N 387.867 2.644 0 50 GFAA COc1ccc(C)c(N2C(=O)C[C@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c1 18136480 DYQSPHNWWAEDBM-FQEVSTJZSA-N 397.450 2.597 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3ccccc3F)CC2)cc(OC)c1OC 19608261 LEXHCYJNRFBFAB-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C(=O)c2cccs2)CC1 19831945 PRYJDQYJKGTGKG-UHFFFAOYSA-N 376.478 2.732 0 50 GFAA COC(=O)C[C@@H](C1=Cc2ccccc2OC1)c1c(O)n2ccccc2nc1=O 205949625 XMJGAEGJMFLCML-HNNXBMFYSA-N 378.384 2.523 0 50 GFAA COCCn1nc2c(c1C(=O)NCCOc1ccccc1C)C[C@@H](C)O[C@H]2C 1857528254 HISMRAYPSDVDEI-CVEARBPZSA-N 387.480 2.669 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)n(C)n1 1857673763 XELXWGUOOIDMSK-JOCHJYFZSA-N 396.491 2.508 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCCn4ccnc4)C3)nc2c1 1857698461 SKBRRAXJKNKTCC-MRXNPFEDSA-N 397.479 2.846 0 50 GFAA COc1cccc(-c2ncc(CNC(=O)[C@H]3CC[C@H]4OCCN[C@@H]4C3)s2)c1 1857741010 XUSRBYZFNFGYSZ-MORSLUCNSA-N 387.505 2.592 0 50 GFAA O=C(c1ccnc(OCc2ccccc2)c1)N1CCC[C@H](N2CCCC2=O)C1 111056490 HNCVYLYMEQTYIS-IBGZPJMESA-N 379.460 2.888 0 50 GFAA Cn1cc(-c2nc(C(=O)N3CCC[C@H](CNC(=O)C(C)(C)C)C3)cs2)cn1 112676314 ZPGBBYMKNYNZAD-CYBMUJFWSA-N 389.525 2.558 0 50 GFAA Cc1nc(C(=O)N2CCC[C@H](CCC(=O)O)C2)nn1-c1ccc(Cl)cc1 237827325 SFCPHATWJUJLAW-CYBMUJFWSA-N 376.844 2.946 0 50 GFAA Cc1nc(CN2CCC(C(=O)NCc3ccnc(-n4ccnc4)c3)CC2)cs1 263908477 LMVPTAFMTOLLSX-UHFFFAOYSA-N 396.520 2.561 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1occc1-c1ccc(F)c(F)c1 2325800237 ZEJMQWIOCJBQMS-JBBXEZCESA-N 387.386 2.991 0 50 GFAA CC(C)[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc2c(-c3nn[nH]n3)c[nH]c12 2325807976 PUPZJIRYAKTGPM-KBXCAEBGSA-N 393.495 2.683 0 50 GFAA CCOc1ccc(CN2CCC[C@@]23CCCN(CCOC)C3=O)cc1OC 2356150242 SNYDUVYPNJVXGD-OAQYLSRUSA-N 376.497 2.697 0 50 GFAA COCCN1C[C@H](CNc2noc(-c3ccc(Cl)cc3)c2C(=O)O)CC1=O 2356155902 NIMWIRXVAKMEFH-NSHDSACASA-N 393.827 2.600 0 50 GFAA COc1ccc(OC)c([C@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)c1 4042661 XOTRRQJMTJIJPY-SFHVURJKSA-N 392.419 2.618 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@@]12CC[C@@](C)(C(=O)C1)C2(C)C 4185872 YIBMUIHHMYIIKU-VQTJNVASSA-N 392.521 2.969 0 50 GFAA COc1ccc(C(=O)Nc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1OC 4994019 ACWALNLWLJLHOK-UHFFFAOYSA-N 383.448 2.625 0 50 GFAA COc1ccc(S(=O)(=O)NCc2cccc(C)c2)cc1C(=O)N1CCCC1 10448243 XOXZHDPHJBRBBE-UHFFFAOYSA-N 388.489 2.718 0 50 GFAA Cc1cnn(C[C@@H]2CN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CCO2)c1 112136672 FQYVXFLQJOKDPO-IBGZPJMESA-N 386.471 2.863 0 50 GFAA Clc1cc2c(cc1CN1CCc3nnc([C@H]4CCCO4)n3CC1)OCO2 20119120 WMBZNDPDDQYDPX-CQSZACIVSA-N 376.844 2.570 0 50 GFAA CCNC(=O)N1CCc2c(cnc(C)c2-c2noc(Cc3c(C)noc3C)n2)C1 23251266 YEKQJHNNZCAWNM-UHFFFAOYSA-N 396.451 2.723 0 50 GFAA COCCN1C[C@H](c2nc(C(C)C)nn2-c2cccc3cccnc23)CC1=O 65386102 YDBKUKUVUNRPRL-MRXNPFEDSA-N 379.464 2.901 0 50 GFAA CN(C)CCN1C[C@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)CC1=O 173751807 LXKKDMIBLSSOPD-MRXNPFEDSA-N 391.475 2.579 0 50 GFAA C[C@@H]1CC[C@@H]2[C@@H](CCCN2S(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)C1 229663687 GPDREEOSADIGDI-RVKKMQEKSA-N 379.526 2.840 0 50 GFAA CCN1CCN(CC(=O)N2CCC[C@@H](CCc3ccc(F)c(F)c3)C2)CC1 20537499 PZQKQILJHPAIOD-SFHVURJKSA-N 379.495 2.774 0 50 GFAA COc1ccc(CN2CCC(NCc3cn(C(C)(C)C)nn3)CC2)cc1F 252495022 OKYWIADBUCOGNI-UHFFFAOYSA-N 375.492 2.935 0 50 GFAA Cc1nnc2ccc(-n3cc(-c4cc(C(=O)N(C)C)c5ccccc5n4)cn3)nn12 63855919 PXEQTZKVTKHOLV-UHFFFAOYSA-N 398.430 2.535 0 50 GFAA NC(=O)c1ccc(NC(=O)CCN2CCc3nc[nH]c3C23CCCCC3)cc1 65428483 QBCBYDQBCZUMPN-UHFFFAOYSA-N 381.480 2.555 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3nc4c(s3)CCCC4)n2)c1 61718870 CLAYGJUKRBFASY-UHFFFAOYSA-N 396.472 2.893 0 50 GFAA CNC(=O)[C@H](C)N(C)C(=O)c1coc(COc2ccc3ccc(OC)cc3c2)n1 67743714 VMARSFRJEXIBIW-ZDUSSCGKSA-N 397.431 2.622 0 50 GFAA O=C(CSCc1ccccc1Cl)N[C@H]1[C@H]2CCO[C@H]2[C@@H]1N1CCCC1 219267670 MJEWKSQUFXDROY-ZWQIFLOQSA-N 380.941 2.941 0 50 GFAA Cc1cc(=O)c(O)c([C@H](CC(N)=O)c2ccc(-c3ccccc3C(=O)O)o2)o1 217704179 JXYNTACEWSZZET-CYBMUJFWSA-N 383.356 2.619 0 50 GFAA biogenic CCn1ccc(C(=O)N[C@H]2CC[C@H](Nc3nccc(-c4ccncc4)n3)C2)n1 72129211 NNJZJSWVMOPVEY-HOTGVXAUSA-N 377.452 2.518 0 50 GFAA CCN(Cc1cccs1)C(=O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C 366348641 NIVOEDRZBLDIAH-LPHOPBHVSA-N 386.521 2.972 0 50 GFAA C[C@@H](c1nc(Cc2ccccc2)no1)N(C)CCN1C(=O)c2ccccc2C1=O 159023792 FCLCODBVJZPIPE-HNNXBMFYSA-N 390.443 2.949 0 50 GFAA C[C@@H](C(=O)O)[C@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1 237764594 OIKRWSKRYDJDAW-DOMZBBRYSA-N 388.855 2.922 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCc3c(nc(-c4ccccc4)[nH]c3=O)C2)on1 72157306 UTFPVTJBMXCFEP-UHFFFAOYSA-N 378.432 2.822 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(N2CCCC2=O)c1 130020563 AKOCGTDBJMMPCK-HXUWFJFHSA-N 391.471 2.734 0 50 GFAA O=C(NCc1nnc2ccccn12)N1CCC(OCCc2ccccc2)CC1 194452500 OQZBUUKOOCGWSO-UHFFFAOYSA-N 379.464 2.663 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(C(=O)NCCSc2nc[nH]n2)C1 426489939 APRDDTZLQPJXNQ-OAHLLOKOSA-N 375.498 2.706 0 50 GFAA O=C(C1CCCCC1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 82086759 MMFAFUITJVJNAN-LJQANCHMSA-N 375.557 2.892 0 50 GFAA CNC(=O)C1(NC(=O)NCC[C@@H]2CCN(Cc3ccccc3)C2)CCCCC1 426677934 GKZKSFVTISUGDL-LJQANCHMSA-N 386.540 2.647 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)c3cccc([C@@H]4CCCNC4)c3)CC2)n1 95354718 FSWYDCBJYGVJCX-HXUWFJFHSA-N 379.508 2.523 0 50 GFAA Cc1cccc2cc(C(=O)N(Cc3ccccn3)C[C@@H]3CCC(=O)N3)n(C)c12 95372340 JDHNDOACYMSOCP-SFHVURJKSA-N 376.460 2.803 0 50 GFAA CCOc1ccc(CN2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)cc1Cl 230202300 WJKUVWKKOIDQCA-HXUWFJFHSA-N 379.932 2.867 0 50 GFAA COc1ccc(C2(C(=O)NCCCn3nc(C)nc3C)CCCC2)cc1OC 426361187 NMIQTIJYMBAGMH-UHFFFAOYSA-N 386.496 2.930 0 50 GFAA CCS(=O)(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2 91915492 BYRXPAPYIDERAK-SFHVURJKSA-N 376.522 2.597 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@@H]2CCCN(CCc3ccc(F)cc3)C2)cn1 95501817 HFVWKPNQKNCEJD-KRWDZBQOSA-N 385.487 2.684 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)CCc2ccc3c(c2)OCO3)CC1 95505996 MJNYPHVAZUGTHR-UHFFFAOYSA-N 385.464 2.597 0 50 GFAA CCc1ccccc1OCCN1CC[C@@]2(O)CCN(C(=O)C3CCC3)C[C@H]2C1 95358465 ZXZYDQNNOGAMRF-NFBKMPQASA-N 386.536 2.713 0 50 GFAA CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cccnc1-n1cc(Br)cn1 294946493 IPOUNWFHYVELMB-SWLSCSKDSA-N 393.285 2.653 0 50 GFAA Cc1cc2cc(C(=O)N[C@H]3C[C@@H](c4cc(N5CC[C@H](O)C5)ncn4)C3)ccc2o1 252553118 VFVDSCZCKZTBPH-JQHSSLGASA-N 392.459 2.778 0 50 GFAA COc1cccc(C(=O)NCC(=O)N2CCn3cccc3[C@H]2c2ccccc2)c1 183213829 PBRQHSFUZLMVKB-JOCHJYFZSA-N 389.455 2.858 0 50 GFAA COC(=O)c1cc(CN)cc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)c1 299792943 GIUSFQQZUOQVMB-UHFFFAOYSA-N 388.367 2.752 0 50 GFAA COc1ccc([C@@]23CC[C@@H](C2)[C@@H]3C(=O)N2CCC23CCS(=O)(=O)CC3)cc1 1875396335 CDDHAMHYIZFQEC-RRMPHLOHSA-N 389.517 2.543 0 50 GFAA O=CN[C@H](Cc1ccsc1)C(=O)N1CCC2(CC1)OCCc1ccsc12 1875321666 QJLUZGSXUJGTQL-MRXNPFEDSA-N 390.530 2.557 0 50 GFAA O=C(Cc1ccc(Br)cc1)NS(=O)(=O)c1cccc2[nH]ccc12 1875350381 KKFZIXSLQNJNCT-UHFFFAOYSA-N 393.262 2.978 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCc2cc(-c3ccc(F)cc3F)on2)CC1 1875366846 LUPMZEATKDHHCK-UHFFFAOYSA-N 375.375 2.661 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1ncncc1Cl 1875402791 LPPJCLHAGLOMAD-KBRIMQKVSA-N 397.866 2.563 0 50 GFAA COc1cc(-c2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)cc(C)n1 952895674 VOSPXAZFCDACGT-CYBMUJFWSA-N 396.451 2.664 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)CN1CCC2(CC1)C[C@H](N)c1ccccc1O2 1875284269 UKFXSZNZWNWELV-UNMCSNQZSA-N 395.547 2.796 0 50 GFAA COc1ccc(S(=O)(=O)N(Cc2ccccn2)C[C@H]2CCCO2)cc1F 952967369 ZAQSMZNYYYIKEM-OAHLLOKOSA-N 380.441 2.599 0 50 GFAA Cc1ccn2cc(-c3ccc(NC(=O)CN(C)C4CCNCC4)cc3)nc2c1 952974422 JLIRZRRRMRBMQC-UHFFFAOYSA-N 377.492 2.932 0 50 GFAA CCc1c(C)cc(C(=O)N[C@H]2[C@H](Cc3ccccc3)[C@@H]3OCC[C@H]23)c(=O)n1C 1565506921 XSRYKXVUONKZQV-HRQSHJORSA-N 380.488 2.632 0 50 GFAA O=C(N[C@H]1CCNC[C@@H]1O)c1cccc(-c2cc(F)ccc2C(F)(F)F)c1 1565505667 LOXGPNWHQAFWHJ-IRXDYDNUSA-N 382.357 2.964 0 50 GFAA O=C1OCCN1c1ccc(S(=O)(=O)N2CC[C@H](Nc3ccccc3)C2)cc1 170637273 QMXFVFZFUDFVHE-INIZCTEOSA-N 387.461 2.518 0 50 GFAA C[C@@H](C(=O)NC1CCCC1)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171806165 NKLDZNAIJBKXEH-KRWDZBQOSA-N 394.519 2.887 0 50 GFAA CC(=O)NCc1ccc(C(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)s1 188426900 CBTFEPJTNCHUJF-INIZCTEOSA-N 380.416 2.876 0 50 GFAA O=C(Nc1cc(N2CCNC2=O)ccc1F)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2 410782004 FOPDINMJXBJYCJ-AAVRWANBSA-N 387.333 2.650 0 50 GFAA OC[C@H]1CCCN(c2cc(NCc3cccnc3OCC(F)(F)F)ncn2)C1 110129165 IBSTVSLIJQXCBZ-ZDUSSCGKSA-N 397.401 2.634 0 50 GFAA C[C@@H](CN1CCCC1=O)NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F 193414656 WXXFFQAGGQPNNO-LBPRGKRZSA-N 380.370 2.632 0 50 GFAA CCN(Cc1nc(C)no1)S(=O)(=O)c1cc(Cl)c(OC)cc1Cl 1506408143 VMTVVKSGXDRIJL-UHFFFAOYSA-N 380.253 2.904 0 50 GFAA CC(=O)NCCC(=O)N(Cc1cccnc1)CC1CCN(C2CCCC2)CC1 12305103 WTACEXKFCPGBPB-UHFFFAOYSA-N 386.540 2.591 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2ccc(Cl)c(F)c2)C1)N1CCOCC1 12476394 ZMKSEWFAFNPKEP-CQSZACIVSA-N 382.863 2.970 0 50 GFAA O=C(Nc1ccccc1)[C@H]1CCCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 12866556 WIAOHLAXMASLRO-LBPRGKRZSA-N 390.369 2.998 0 50 GFAA Cc1nn(C)cc1CN1CC(=O)N(CC(C)C)C[C@H](OCc2ccccc2)C1 14750448 UIXOTGPQQJZCAF-OAQYLSRUSA-N 384.524 2.614 0 50 GFAA CC(C)c1cc(C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)nc(=N)[nH]1 1857708109 VPJDNHGCGKONRE-UHFFFAOYSA-N 390.491 2.654 0 50 GFAA CCCN1C(=O)c2ccc(Cl)cc2NC12CCN(CCC(=O)OC)CC2 414180911 LZNDCJCCYUTKGD-UHFFFAOYSA-N 379.888 2.973 0 50 GFAA C[C@@H](C(=O)NC1CCCCC1)S(=O)(=O)Cc1nnc(-c2ccccc2)s1 122433281 PMPYFZBEVGJQEQ-ZDUSSCGKSA-N 393.534 2.957 0 50 GFAA CSc1nnnn1-c1cccc(NS(=O)(=O)c2cccc(Cl)c2O)c1 436479684 XCIQQJWTDNOFBF-UHFFFAOYSA-N 397.869 2.544 0 50 GFAA Cc1ccc(N(C)S(=O)(=O)c2ccc3c(c2)NC(=O)CC(=O)N3)cc1Cl 499295342 OHGFUYJHDURONF-UHFFFAOYSA-N 393.852 2.754 0 50 GFAA C[C@@H](CO)NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1Br 821376681 HUSMAPOPKDILGE-GXFFZTMASA-N 387.274 2.512 0 50 GFAA COc1ccc(-c2nnn(Cc3cc4c(cc3Br)OCO4)n2)cc1 4727726 NXMPPYSULWOGLX-UHFFFAOYSA-N 389.209 2.888 0 50 GFAA Cc1cc(C)n([C@H]2CCN(C(=O)c3ccc4nnc(-c5cccn5C)n4c3)C2)n1 2100482395 WFQMZZISBXLTMY-KRWDZBQOSA-N 389.463 2.635 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N=c1[nH]n(CC2CC2)c2ccccc12 2100545456 VWPMCJMRFPFTKN-UHFFFAOYSA-N 397.504 2.722 0 50 GFAA Cc1cccc2c(CCNC(=O)N3CCN(c4ccncc4)CC3)cn(C)c12 2325857629 JMCVTXKQCPQTCC-UHFFFAOYSA-N 377.492 2.956 0 50 GFAA CCOC(=O)c1nc2sc3c(c2c(=O)n1[C@@H](C)C(=O)OCC)CCCC3 957819 RIZVEGIITHUUPF-JTQLQIEISA-N 378.450 2.638 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC2CCCC2)cc(OC)c1OC 1189021 FJLZPVQCELLXMH-KRWDZBQOSA-N 390.436 2.826 0 50 GFAA CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C(=O)O 4899423 VFBACQGDAHTASH-XIRDDKMYSA-N 378.469 2.943 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N2CCC(Cc3ccccc3)CC2)CC1 4992950 MKNJOLKZNHQDGD-UHFFFAOYSA-N 378.538 2.529 0 50 GFAA Cc1ccccc1CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 7965972 DXOJBEDVDGQRSN-MRXNPFEDSA-N 378.519 2.774 0 50 GFAA O=C(CCNC(=O)Nc1cc(N2CCNC2=O)ccc1F)Nc1ccccc1 225680090 SXDVXBZHDYJOHW-UHFFFAOYSA-N 385.399 2.506 0 50 GFAA Nc1nc(Cl)c(I)cc1I 113844954 DSMVLZSENUEPBF-UHFFFAOYSA-N 380.354 2.526 0 50 GFAA CCNc1ncc([C@@H]2CC(=O)Nc3c2c(C)nn3-c2ccc(OC)cc2)cn1 65373547 NFALUFOWOBNUBS-INIZCTEOSA-N 378.436 2.885 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(CCn4nccc4C4CC4)[nH]c3C2)c1 65372954 ANFFBACBLAWVKX-INIZCTEOSA-N 391.475 2.805 0 50 GFAA COC(=O)CCSc1cc(C)ccc1NS(=O)(=O)CCOC(C)C 252489848 KCHHZZZMQYTMOM-UHFFFAOYSA-N 375.512 2.817 0 50 GFAA CCC(=O)Nc1ccc(-c2nnc(SCC(=O)N3CCCCC3)n2C)cc1 2198257 CHEMVCOHHSCFJR-UHFFFAOYSA-N 387.509 2.935 0 50 GFAA COc1ccc([C@@H](CC(=O)O)NC(=O)c2cc3ccccc3oc2=O)cc1OC 4581002 MRZOHXVESLCTCR-OAHLLOKOSA-N 397.383 2.756 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc(F)cc3nc[nH]c23)C[C@@H]1c1ccc(F)cc1F 366373794 XFGXQABZMFNSBU-KGLIPLIRSA-N 389.333 2.921 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](C(=O)O)N(C(=O)C2CC2)C3)c(C)c1 72419121 WVXXYTHWGGFWJO-SFHVURJKSA-N 384.476 2.621 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cccc4c3OCO4)C[C@H]2CCO)cc1 36385802 MPIDYJKJGGAKGP-HXUWFJFHSA-N 398.503 2.883 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@@H](O)c3ccc(Cl)s3)c2c1 240278293 DQCNAPUOWFICCR-GFCCVEGCSA-N 383.882 2.894 0 50 GFAA Cc1cccc(O)c1NC(=O)C[C@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71750349 DNTFFRMFZGTURG-HNNXBMFYSA-N 383.448 2.628 0 50 GFAA Cc1nc(N2CC[C@](O)(c3cn(C(C)C)nn3)C2)c2c3c(sc2n1)CCC3 375262539 UXFPBBFWRNVIHO-LJQANCHMSA-N 384.509 2.759 0 50 GFAA Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 175649993 JIBKLMHUPURSBD-UZLBHIALSA-N 383.540 2.932 0 50 GFAA Cc1ccnn1CCCNC(=O)[C@@]1(C)CC1(Br)Br 17077517 VOGJBXDDGOUASL-LLVKDONJSA-N 379.096 2.594 0 50 GFAA CN(CC(=O)Nc1ccc(N2CCCCC2)nc1)C[C@@H]1COc2ccccc2O1 175484494 PQLKFZYJDMVXHM-GOSISDBHSA-N 396.491 2.782 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCC[C@@H](Cn2ccnc2)C1 426677703 PUNVLEZDGQPJDS-INIZCTEOSA-N 380.452 2.590 0 50 GFAA CCN(C(=O)Nc1cccc(C(=O)NC)c1)[C@H]1CCN(c2ccccc2)C1=O 178005987 HBOLJUOMOGVLFF-SFHVURJKSA-N 380.448 2.706 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1ccccn1)c1ccccc1-n1cccc1 223440840 AJOBAVWKUHYNNJ-TZIWHRDSSA-N 377.444 2.976 0 50 GFAA O=C(c1ccccc1-n1cnnc1)N1Cc2cnn(Cc3ccc(F)cc3)c2C1 426388533 RNSZNPZFVFIYCO-UHFFFAOYSA-N 388.406 2.807 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C(=O)NC(C)C)CC2)c(Cl)c1 95524974 MRDMUMDIAFPIDU-UHFFFAOYSA-N 397.903 2.677 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)c1ccc(C)c(Cl)c1)CCN2C 95380744 XTYYSBRBKHHFCD-HXUWFJFHSA-N 377.916 2.807 0 50 GFAA O=C(CN1CCCCCC1)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2 95524299 ZVXSMLMIJORKIH-UHFFFAOYSA-N 383.536 2.904 0 50 GFAA Cc1oc(CN(C)C(=O)Cc2cc(Cl)c3c(c2)OCCO3)cc1C(=O)O 299747474 DCSYDTGLVQPPSH-UHFFFAOYSA-N 379.796 2.912 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)c3cscn3)C[C@@H]1N(Cc1ccc(C)o1)CC2 534649207 GUKXBEYEBXEBDA-DKSSEZFCSA-N 375.494 2.987 0 50 GFAA NC1CCN(c2cc(C(=O)N3CCC[C@@H]3COc3ccc(F)cc3)ccn2)CC1 1875301834 SBOXNVDAAHXVCN-LJQANCHMSA-N 398.482 2.832 0 50 GFAA C=CC(=O)NCCC(=O)N(Cc1ccccc1)Cc1nc(O)c2ccccc2n1 1875365803 MSRXYGIOKZLHEU-UHFFFAOYSA-N 390.443 2.557 0 50 GFAA COCC1CCN(S(=O)(=O)N(C)Cc2cccc(C(F)(F)F)c2)CC1 952970949 QFSKANKVZGPMEW-UHFFFAOYSA-N 380.432 2.740 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNCc2cnn(-c3ccccc3C)c2)cc1 952990208 LLAPMXXPWLAEQR-UHFFFAOYSA-N 398.532 2.947 0 50 GFAA O=C(NCC1CCN(c2cc(C3CC3)ncn2)CC1)c1cnc2ccccc2n1 952973538 AJQHFWWEJPDYDA-UHFFFAOYSA-N 388.475 2.944 0 50 GFAA NC(=O)c1cccnc1N1CCN(C2CCN(c3ccccc3Cl)CC2)CC1 952978613 RXEJLEPVICORHN-UHFFFAOYSA-N 399.926 2.625 0 50 GFAA CN(C(=O)CN1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1)C1CCCCC1 271250753 DZKUCMSHLUZPDJ-HSZRJFAPSA-N 398.595 2.670 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(CCn3cc(Cl)cn3)CC2)O1)c1ccco1 1506403074 VIRNFCYLDKJHIO-INIZCTEOSA-N 392.887 2.573 0 50 GFAA CCc1nc(CN2CCc3cc(OC)c(OC)cc3[C@@H]2c2cccnc2)n[nH]1 1506428423 PVGOQFWICHOZOB-NRFANRHFSA-N 379.464 2.927 0 50 GFAA COc1ccc(-c2onc(N3CCC4(CCC(=O)N(C)C4)CC3)c2C(=O)O)cc1 1772700844 ICUDYORJCCFBLF-UHFFFAOYSA-N 399.447 2.887 0 50 GFAA O=C(Cn1ccc2ccccc21)Nc1ccc2c(c1)C(=O)N1CCC[C@@H]1C(=O)N2 206256303 QTXZOMRGFXNBEZ-LJQANCHMSA-N 388.427 2.837 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)NCCCc1ccccn1 1857667309 KKTYSDRQKSWEHZ-MRXNPFEDSA-N 379.464 2.973 0 50 GFAA C/C=C/CCCC(=O)N1CCC2(CC1)CN(Cc1ccccn1)C[C@H]2C(=O)O 1857681502 LNLKGOZPAAKCDW-PHXNAMCJSA-N 385.508 2.953 0 50 GFAA CCn1cc(CN(C)C(=O)[C@@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)cn1 1857727264 OGQXNKGKBOTSQL-OAHLLOKOSA-N 397.504 2.833 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccccc1I)C(=O)O 2385541 CAPUJMUOMAUNOD-LLVKDONJSA-N 391.205 2.812 0 50 GFAA in-vitro CN1CCN(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c2ccccc2C1 119493421 NQVXWDGMIJNMRJ-UHFFFAOYSA-N 385.489 2.557 0 50 GFAA O=C(O)c1csc(CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)n1 124367145 LNZKBIWAIKLKND-UHFFFAOYSA-N 380.853 2.859 0 50 GFAA Cc1nc(N2CCN([C@H]3CCN(c4c(F)cccc4F)C3=O)CC2)sc1C 157477006 VKEGLPPBTVWAGT-INIZCTEOSA-N 392.475 2.966 0 50 GFAA CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)c1cncs1)[C@@H]1COC[C@@H]12 839895329 JIIYRGLYCUSPGE-UONOGXRCSA-N 393.509 2.631 0 50 GFAA Cc1cc(NC(=O)/C=C/c2cnn(-c3ccccc3)n2)n(C2CCN(C)CC2)n1 2325745897 WXIUGONKQAYRQD-CMDGGOBGSA-N 391.479 2.691 0 50 GFAA CCc1noc(-c2ccc(CCNC(=O)c3ccc4c(c3)C[C@H](N)C4)cc2)n1 2325760842 YHIYJTXSPWPYFW-LJQANCHMSA-N 376.460 2.697 0 50 GFAA CC(C)(C)OC(=O)N1CCCN(c2ccc3nnc(C(F)F)n3n2)CCC1 2325807283 NVKWOGHSHRGAGL-UHFFFAOYSA-N 382.415 2.899 0 50 GFAA CCN(CC)C(=O)c1sc(NC(=O)c2ccncc2)c(C(=O)OC)c1C 1116274 HBKKBOTZDKIYDO-UHFFFAOYSA-N 375.450 2.972 0 50 GFAA COc1ccc(N2C(=O)N(c3ccccc3Cl)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 1135429 GBNNYSMKJRWEBL-DLBZAZTESA-N 392.864 2.961 0 50 GFAA O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1cc(Cl)ccc1Cl 4019234 KCSACQAXDQBIRP-UHFFFAOYSA-N 385.228 2.777 0 50 GFAA O=C(N[C@@H](CCCCNC(=S)NCc1ccccc1)C(=O)O)c1ccccc1 4724926 VHWLHWFSDVVBGZ-SFHVURJKSA-N 399.516 2.704 0 50 GFAA CCOc1cc(C=O)ccc1OCC(=O)Nc1ccc(N2CCOCC2)cc1 4865950 LTJSEGDRYUQBAY-UHFFFAOYSA-N 384.432 2.752 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc4c(s3)CCCC4)C[C@H]2CCO)o1 106967360 USUOBKNVSFJLFV-MRXNPFEDSA-N 375.538 2.992 0 50 GFAA COc1ccc(Cn2ccc3c(cnc4nc(C(F)(F)F)nn43)c2=O)cc1 8991910 UEWDIJSMOPCXRA-UHFFFAOYSA-N 375.310 2.515 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)N1CCO[C@@H]([C@@H]2CCCO2)C1 247279932 KGMBCNYVGZRICZ-BPQIPLTHSA-N 379.888 2.508 0 50 GFAA Cc1ccccc1Oc1ncccc1CNC(=O)[C@@H]1CSC(C)(C)C(=O)N1 67850867 XBXRFKWSNKHDJT-HNNXBMFYSA-N 385.489 2.809 0 50 GFAA Cc1nc(CN2CCN(C(=O)c3cc(COc4ccccc4)[nH]n3)CC2)cs1 20232688 AZWJCZJBOHPIJI-UHFFFAOYSA-N 397.504 2.712 0 50 GFAA O=c1cc(CN2CCN(Cc3ccc(F)cc3Cl)CC2)nc2sccn12 20435985 PXVPBWBUDRZWDM-UHFFFAOYSA-N 392.887 2.866 0 50 GFAA CCOc1ccccc1NC(=O)CC(=O)NC[C@H](c1cccs1)N(C)C 65453182 CSJRYXXXJCUMGU-OAHLLOKOSA-N 375.494 2.895 0 50 GFAA CC[C@@H]1CN(C(=O)C2CCN(c3nccc(OC)n3)CC2)c2ccccc2O1 172686702 XXFABWPSQFFAEP-MRXNPFEDSA-N 382.464 2.906 0 50 GFAA CC1=NN(C(=O)c2ccn(COc3cccc(Cl)c3)n2)[C@](O)(C(F)F)C1 6394749 DITVXOMFGKTSNJ-MRXNPFEDSA-N 384.770 2.749 0 50 GFAA COc1ccc(OC)c(-c2nc(CN3CCC4(CC3)CNC(=O)C4)c(C)o2)c1 71760843 OSLMNXOUHWNUAT-UHFFFAOYSA-N 385.464 2.769 0 50 GFAA O=C(CCc1cncc(F)c1)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 121617671 RGSDVNKZJJYAOU-KRWDZBQOSA-N 394.443 2.508 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3sc4nc[nH]c(=O)c4c3C)[C@H](C)C2)cc1 77428108 YLDCHSBOJWRIRU-CYBMUJFWSA-N 382.489 2.952 0 50 GFAA COc1ccc(C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)c(OC)c1 152773041 DPEQLZPPGHNRQX-UHFFFAOYSA-N 382.460 2.986 0 50 GFAA O=C(Nc1cc(CC2CC2)nn1-c1ccccc1)[C@@H]1CC12CCS(=O)(=O)CC2 328881009 LZOPBQKTQLLIJQ-SFHVURJKSA-N 399.516 2.978 0 50 GFAA Cc1cc(CC(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)on1 71750536 SCVCHNCQUWOCCE-LJQANCHMSA-N 387.455 2.950 0 50 GFAA CC(C)N1CC[C@@H](CNC(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1 240902751 IVCQJPHMEWRPQF-JKSUJKDBSA-N 380.483 2.821 0 50 GFAA COc1ccc(-c2cncc(C(=O)N[C@@H]3CCN(CC(F)(F)F)C3=O)c2)cc1 130094064 WCSPIONMASORFT-MRXNPFEDSA-N 393.365 2.650 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC(OC[C@@H]2CCCO2)CC1 175373965 DBLZAZYZEUAYQP-NRFANRHFSA-N 398.507 2.801 0 50 GFAA O=C(NC1CCN(C2CCCC2)CC1)c1ccc(S(=O)(=O)C(F)F)cc1 177426100 WAIBMCXZPPOQPU-UHFFFAOYSA-N 386.464 2.820 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N1CCc2[nH]c3ccccc3c2C1 19657569 WYLGRHZCUZNINJ-UHFFFAOYSA-N 382.489 2.968 0 50 GFAA CC(C)(CN1C[C@](C)(Cc2ccc3c(c2)OCO3)CCC1=O)N1CCOCC1 91818575 IANLOHSNLBJIRH-QFIPXVFZSA-N 388.508 2.697 0 50 GFAA CCOc1cccc(CN(CC)C(=O)NCC2(N(C)C)CCN(C)CC2)c1 426358138 AVUIUPHHVHCAEN-UHFFFAOYSA-N 376.545 2.643 0 50 GFAA Cc1ccnn1CCc1nc(CC2CCN(C)CC2)nn1Cc1ccccc1 95502310 YLUGAIMCZSJRNS-UHFFFAOYSA-N 378.524 2.958 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3cccc(Cn4cccn4)c3)CC2)c1 91988542 RLERKWQOGRICQE-UHFFFAOYSA-N 390.487 2.898 0 50 GFAA Cc1ccc(N2CCN(C(=O)Nc3ccc(-c4nnn(C)n4)cc3)CC2)cc1 96154029 ATQARNRJPQLVKC-UHFFFAOYSA-N 377.452 2.540 0 50 GFAA O=C1NCCN(C(=O)c2ccn3ccnc3c2)[C@H]1c1ccccc1C(F)(F)F 180306207 GASISHHMGJPAAU-INIZCTEOSA-N 388.349 2.666 0 50 GFAA COCc1ccsc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 181153530 FLVGQIDHHZAVLL-UHFFFAOYSA-N 375.450 2.616 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(S(=O)(=O)N3CCCC3)CC2)C1 92038696 WXKUKAXTNFBUCV-IBGZPJMESA-N 377.554 2.529 0 50 GFAA COC[C@@H](NC(=O)Nc1cc(C)nn1Cc1cccc(C)c1)c1ccnn1C 96132254 KNJCVMATVOEKFJ-QGZVFWFLSA-N 382.468 2.791 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N[C@@H](c1ccc(OC)nc1)[C@H]1C[C@@H](O)C1)n2C 244900091 ZVVUNEPWYPQPGY-MRUHUIDDSA-N 395.459 2.833 0 50 GFAA Cn1cc(S(=O)(=O)Nc2ccc(C(C)(C)C(=O)O)cc2)c(C(F)(F)F)n1 295695981 DUHAOMYXVHWEDS-UHFFFAOYSA-N 391.371 2.602 0 50 GFAA CCn1cc(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)cn1 55042424 XTEFJVJVVMGMLN-HXUWFJFHSA-N 381.524 2.638 0 50 GFAA O=C1C[C@@H](C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)c2cc(F)ccc2N1 827693753 KXDLGZPJRYWBJG-QGZVFWFLSA-N 381.407 2.711 0 50 GFAA O=C(C1CCC1)N1CCC2(CC1)CN([C@@H]1CCN(c3ccccc3)C1)CCO2 827921071 HCZGVCYFKXLGDK-OAQYLSRUSA-N 383.536 2.759 0 50 GFAA C[C@@]1(c2ccc(NC(=O)N3CCc4c(O)nc(O)nc4C3)cc2)CC1(F)F 1875306529 JKMJJJUVIYYDEV-KRWDZBQOSA-N 376.363 2.775 0 50 GFAA COc1ccc2cccnc2c1CNC(=O)c1c2c(nn1C)[C@H](C)O[C@H](C)C2 1875314687 MKNHEFTVXUILQG-OLZOCXBDSA-N 380.448 2.929 0 50 GFAA CC(C)(C)OC(=O)c1cc2c(NCC(C)(C)[C@@]3(O)CCCOC3)ncnc2[nH]1 1875327603 BIZIEHSBSLJFJB-HXUWFJFHSA-N 390.484 2.893 0 50 GFAA CSCC[C@@H](O)C(=O)NCC1(NC(=O)c2ccc(C)s2)CCCCC1 1875361444 SHWILHGSDFOESJ-CQSZACIVSA-N 384.567 2.719 0 50 GFAA O=C(NCC1(O)CN(C(=O)C(C2CCC2)C2CCC2)C1)c1ccsc1Cl 1875330898 HWOSJHWTSZYKQW-UHFFFAOYSA-N 396.940 2.921 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N=[S@]3(=O)CCC[C@@]4(CCCN4)C3)cnc21 1875393591 PXRAERWZYZUHAQ-PPHZAIPVSA-N 389.525 2.612 0 50 GFAA CNC(=O)COc1ccccc1CN1CCN(c2nccc3sccc23)CC1 952963420 KLMXINARHNHHIC-UHFFFAOYSA-N 396.516 2.743 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@H](C)CNC(=O)CCc2c(C)nn(C)c2C)n1 952962462 BSPMPXFJXRNWJP-LLVKDONJSA-N 385.434 2.946 0 50 GFAA O=C(NC[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)N1CCO[C@@H](C(F)F)CC1 892149489 DWFCSYIHGFAZMB-USXIJHARSA-N 385.430 2.584 0 50 GFAA CC(C)COc1ccc(C(C)(C)CNC(=O)[C@H]2CCCN2S(C)(=O)=O)cc1 171522697 ZIQPSXWNJOUCJG-GOSISDBHSA-N 396.553 2.539 0 50 GFAA COCc1noc(CN2CCN(c3cc(C(C)(C)C)nc(C(C)C)n3)CC2)n1 192359490 USCYFCJOPPABIP-UHFFFAOYSA-N 388.516 2.749 0 50 GFAA COc1ccc2c(c1)[C@@H](NC(=O)c1cnc3ccccn3c1=O)CC(C)(C)O2 1506406418 KKIJWMOHJXJQCW-INIZCTEOSA-N 379.416 2.735 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@@H](O)[C@H](Cc4ccccn4)C3)cc2c1 1529178403 KLHLJZVMNZSMIO-IIBYNOLFSA-N 379.460 2.770 0 50 GFAA Cc1ccc(-c2nnc(NC(=O)[C@@H]3CC(=O)N(Cc4cccnc4)C3)s2)cc1 1529139280 OGXXMKUUTSZGQQ-MRXNPFEDSA-N 393.472 2.896 0 50 GFAA O=C([C@H]1CCc2sc(-c3ccncc3)nc2C1)N1CCC(c2nc[nH]n2)CC1 1772806805 FNGCBNBRUAFPHV-HNNXBMFYSA-N 394.504 2.834 0 50 GFAA COCCc1nc2ccc(C(=O)NCCc3nc4ccc(OC)cc4[nH]3)cc2o1 12316521 OGBLWXJVKFHQHB-UHFFFAOYSA-N 394.431 2.874 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)s1 12590554 DOCCGLSCQCTWIO-KRWDZBQOSA-N 389.565 2.786 0 50 GFAA CC(=O)Nc1ccc(CN2CCc3c(c(C(=O)NC4CCCC4)nn3C)C2)cc1 14747494 UXEVPTAFZOEEFT-UHFFFAOYSA-N 395.507 2.609 0 50 GFAA O=C(/C=C/c1cccc(F)c1)N1C[C@@H]2C[C@H]1C(=O)N2c1ccc2c(c1)OCO2 14959810 NMOYJLGOVFLMDZ-SFXFJHKKSA-N 380.375 2.584 0 50 GFAA Cc1cc(C(=O)N2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)CC2)n[nH]1 19885303 BOIVHUVDNRDTPT-UHFFFAOYSA-N 380.370 2.612 0 50 GFAA Cc1nnc(C2CCN(C(=O)[C@H](C)NC(=O)c3ccc(Cl)cc3)CC2)o1 1857529952 RDPNTZZPGIGTIC-NSHDSACASA-N 376.844 2.556 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccncc4)[C@H]4CC[C@]3(C2)O4)c1 1857738915 DNSBYPPKNATWGZ-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA CN(C)c1ccc(CN2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cn1 130931629 XHSGYNGGEAGGHK-UHFFFAOYSA-N 376.863 2.898 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)N2CCc3ccccc3C2)c1=O 15066905 GRPJTHDEFPLUGE-UHFFFAOYSA-N 393.487 2.912 0 50 GFAA CNC(=O)[C@@H](NC(=O)CNc1cc(F)c2nc(C)sc2c1)c1ccccc1 2325851320 WIZGPFPDTBRJJQ-KRWDZBQOSA-N 386.452 2.759 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2cc(Br)c3c(c2)OCO3)C1 2325888321 HSFFXMPMIGUSDO-SNVBAGLBSA-N 381.226 2.541 0 50 GFAA CC(=O)c1cccc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1 1062294 YOMNXMSOTCCXCA-KRWDZBQOSA-N 386.473 2.929 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)c1 1167846 YFFLZWJFMKNCQB-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CCOC(=O)C[C@@H]1C(=O)N[C@H]2CCCC[C@H]2N1C(=O)Nc1ccc(Cl)cc1 1432186 KPQPVPCXNWMUJO-ARFHVFGLSA-N 393.871 2.937 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3C)CC2)c(OC)c1 6715193 FCCAFVRSJWKMIS-UHFFFAOYSA-N 376.478 2.523 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4nc(C)cc4C)nn3)CC2)cc1 65364402 MXAOQZSRFXFAQS-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=C([C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCC(CO)CC1 71754305 BVAUFKHNVCBCHX-QFIPXVFZSA-N 399.579 2.594 0 50 GFAA COc1ccc(C(=O)N2CCN(Cc3ccnn3-c3ccccc3)CC2)cc1 72158200 LYPKQBLULSACOK-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)c3nc4ccccc4[nH]c3=O)C2)c1 95368274 JOCVHGSPKOMGMN-HNNXBMFYSA-N 377.400 2.641 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCN1CCCOC1=O 95499967 DURLJYJVNNUEMY-GOSISDBHSA-N 396.443 2.896 0 50 GFAA COc1cccc2c1OC[C@]1(C(=O)O)CN(CCC(F)(F)C(F)F)C[C@H]21 95499997 AANICPCFEASWED-BDJLRTHQSA-N 377.334 2.848 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccccc2F)C1)S(=O)(=O)N1CCCCC1 95518668 CAUUQLAFWLHNRR-GOSISDBHSA-N 397.560 2.743 0 50 GFAA Nc1ncc(C(=O)N2C[C@@H]3CC[C@H](C2)N(CC2CC2)C3)c(-c2ccccc2)n1 95520513 NHHVWKSVKDAAAS-SJLPKXTDSA-N 377.492 2.672 0 50 GFAA Cc1cc(CC(=O)N2CCCC[C@H]2C(=O)Nc2ccc(-n3cccn3)cc2)on1 95528761 XMYZJZJGIXZCDQ-IBGZPJMESA-N 393.447 2.731 0 50 GFAA CC(=O)N1C[C@H]2CN(Cc3ccc(-c4cccc(Cl)c4)o3)C[C@@]2(C(=O)O)C1 96180711 UCFIDPHSEUFEFC-FOIQADDNSA-N 388.851 2.965 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)Nc2cccn3nc(C)nc23)s1 97569043 DUIAFBPZCVQUHJ-ZDUSSCGKSA-N 384.465 2.828 0 50 GFAA O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1 109281981 WFAGKERWFPNXGR-ZDUSSCGKSA-N 388.361 2.556 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@H](Cn2cccn2)C1)c1cccs1 111081843 MKVHPKOWOPZJSY-HNNXBMFYSA-N 396.472 2.738 0 50 GFAA COc1cccc([C@@H]2CCCN2C(=O)CN(C)S(=O)(=O)c2cccs2)c1 170626387 LGNVIDZQAROLND-INIZCTEOSA-N 394.518 2.741 0 50 GFAA COCC(=O)N1CCc2cc(NC(=O)C[C@H]3OCCc4ccccc43)ccc21 186323237 FNQXUZVYDHVRMD-HXUWFJFHSA-N 380.444 2.865 0 50 GFAA CCc1noc(CC)c1CNC(=O)c1ccc(-n2ncc(C(=O)O)c2C)cc1 191663778 MCVYQUGISYGUSX-UHFFFAOYSA-N 382.420 2.922 0 50 GFAA O[C@H]1CN(CCCC(F)(F)F)CC[C@@H]1N1CCN(c2ccccc2F)CC1 207993462 JRMHKEZQDNTQQI-ROUUACIJSA-N 389.437 2.725 0 50 GFAA O=C(COc1ccc(F)cc1)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 213041681 AHOWBELCFKOYQD-PBHICJAKSA-N 375.469 2.784 0 50 GFAA CN1C[C@@]2(CCN(C(=O)c3ccccc3OC(F)(F)C(F)F)C2)OC1=O 219483853 HSAHBWUUEKUECG-OAHLLOKOSA-N 376.306 2.590 0 50 GFAA COc1ccccc1C[C@@H](CNC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)O 237223390 PSEKEIVKYCGRRH-VQTJNVASSA-N 396.487 2.719 0 50 GFAA Cc1nc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)nn1-c1ccc(Cl)cc1 237681173 NCGRRYYPTKVBEQ-QGZVFWFLSA-N 396.834 2.881 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CCN(C)CCC(=O)O)c2ccccc2)cc1 262630014 GTVNEWPCRMIWRU-LJQANCHMSA-N 390.505 2.811 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CC[C@](O)(c3nc(C4CC4)no3)C2)s1 275390528 ZMOKHRWVSOTTJQ-QGZVFWFLSA-N 397.522 2.588 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(c1nccn3cnnc13)CC2 275841096 VZYGBFBXLQMSOD-MRXNPFEDSA-N 382.493 2.593 0 50 GFAA C[C@@H]1CN(C(=O)c2cc(Cl)cc(Br)c2F)CCS1(=O)=O 278575904 KYORKEVVZVXGQV-SSDOTTSWSA-N 384.654 2.501 0 50 GFAA NC(=O)c1ccc(NC(=O)N2CCC(CCn3cccn3)CC2)cc1Cl 299788382 UYFRPHBEXZCPMN-UHFFFAOYSA-N 375.860 2.970 0 50 GFAA CCn1cc(NC(=O)N2Cc3cnc(Cc4ccc(OC)cc4)nc3C2)cn1 299793473 HDEHQMXIWFNFJC-UHFFFAOYSA-N 378.436 2.840 0 50 GFAA Cc1cc2cc(NC(=O)N3CCC[C@@H](N4CCCS4(=O)=O)C3)ccc2[nH]1 378206142 ZABQXNJDUGLNEA-MRXNPFEDSA-N 376.482 2.508 0 50 GFAA CC[C@H]1CN(CCNC(=O)c2onc3c2CCCC3)Cc2cc(OC)ccc2O1 426547505 BEBOFTJGIJXHNX-INIZCTEOSA-N 399.491 2.965 0 50 GFAA COC(=O)c1cccc(CN2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N3)n1 426620317 YUBNOCWLHAOXHG-SFHVURJKSA-N 379.460 2.507 0 50 GFAA CCOc1nc2ccc(C(=O)N[C@H]3CCN(c4ccccc4F)C3=O)cc2[nH]1 469654986 XWSZUYZVJKEWFU-HNNXBMFYSA-N 382.395 2.636 0 50 GFAA Cc1cccc(-c2nc(C)c(C(=O)N3CCC(CO)(NCC(C)C)CC3)[nH]2)c1 912586449 BFLLVENRHQBSLZ-UHFFFAOYSA-N 384.524 2.906 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)NCc3cn4cccc(C)c4n3)o2)c1C 1506421115 FOMYTXZLGKUQKT-UHFFFAOYSA-N 386.433 2.986 0 50 GFAA CC(C)C(=O)N1CCC(N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)CC1 1529133297 HTVZKKXTJYJNQZ-XMSQKQJNSA-N 381.520 2.717 0 50 GFAA Cc1cc(=O)c2oc(-c3ccccc3)c(CC(=O)NCCn3ccnc3)c2o1 1772491305 YORFKDUIJCFCLV-UHFFFAOYSA-N 377.400 2.917 0 50 GFAA O=C(COc1ccc(F)cc1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857731548 JVDGIGWSSOTILG-KNKQGSTJSA-N 396.418 2.506 0 50 GFAA COc1ccccc1CCC(=O)N1CCC[C@@]2(CCc3c(O)nc(C)nc32)C1 1857731604 LZWQVNYWPYUKNW-JOCHJYFZSA-N 381.476 2.938 0 50 GFAA CCC(=O)N1CCC[C@@]2(CCc3c2nc(C(C)(C)C)[nH]c3=NCc2cc[nH]n2)C1 1857731964 VYUYXLZETWLXMR-JOCHJYFZSA-N 396.539 2.748 0 50 GFAA CCc1noc([C@@]23CCN(C)C[C@@H]2CN(c2nc(C(C)C)nc4[nH]ccc24)C3)n1 1875392304 MRHQBPVLDSXJAH-SPLOXXLWSA-N 395.511 2.736 0 50 GFAA COC(=O)c1ccc(C(=O)NCc2ccsc2C(=O)O)cc1Br 2325866743 YMNNBZHWYQBGPP-UHFFFAOYSA-N 398.234 2.925 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356134132 ZTZSZQHQUIRGCJ-QHCPKHFHSA-N 392.503 2.933 0 50 GFAA O=C(c1ccn2ncnc2c1)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356137728 XDBYGSXUZMCAAX-UHFFFAOYSA-N 387.443 2.915 0 50 GFAA CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2OC)C1 810992 PWRVWZIZWQJOMT-JTQLQIEISA-N 396.292 2.966 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@H](NCc3ccc(C(=O)O)cc3)C2=O)cc1 2878684 NQMHRKNEZDFSKH-SFHVURJKSA-N 382.416 2.595 0 50 GFAA CCCCN1C[C@@H](C(=O)Nc2ccc(C(=O)Nc3nccs3)cc2)CC1=O 10461852 MNYRBVSXYVIBDC-AWEZNQCLSA-N 386.477 2.983 0 50 GFAA CCNC(=O)c1cn(Cc2ccccc2)cc(C(=O)NCc2ccsc2)c1=O 12451398 CKTGWLCRZXZAEL-UHFFFAOYSA-N 395.484 2.638 0 50 GFAA Cc1nc[nH]c1CN1CC(=O)N(CC(C)C)C[C@H](OCc2cccc(F)c2)C1 14531756 NZTKWXHZUPJANM-LJQANCHMSA-N 388.487 2.743 0 50 GFAA Cn1c(CNC(=O)/C=C/c2cccc(F)c2)nnc1SCc1ccccn1 15069069 AWARSBSDLYEQGP-CMDGGOBGSA-N 383.452 2.971 0 50 GFAA Cc1cc(=O)[nH]c(-c2cccc(CN3C[C@@H]4C[C@H](C3)Cn3c4cccc3=O)c2)n1 20451555 UDTMNNMDWWUSMZ-MJGOQNOKSA-N 388.471 2.526 0 50 GFAA CCOc1cccc(N2C(=O)C[C@@H](N3CCN(Cc4ccccc4)CC3)C2=O)c1 23355672 BNEFYPCYXTYKFX-OAQYLSRUSA-N 393.487 2.535 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@@H](c1ccccc1F)CC(=O)N2 33271389 LCIGSYBDGWIIME-CYBMUJFWSA-N 377.383 2.540 0 50 GFAA O=S1(=O)C=C[C@H](Cc2nc(-c3ccccc3)nn2-c2ccc3c(c2)OCO3)C1 63870898 JVTWSZZGRYNXLO-CQSZACIVSA-N 395.440 2.764 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC[C@@](CO)(Cc3ccccc3F)C2)nn1 67604192 HSZQESMZGTUDGE-OAQYLSRUSA-N 381.455 2.838 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4cccc(F)c4)CC3)nc(C)n2)n1 67629596 PCUUBEWJNBUOEK-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA COc1ccc(-c2noc(COc3cccc4ccc(C(N)=O)nc34)n2)cc1 72166035 XDXDAVIFKBYIKT-UHFFFAOYSA-N 376.372 2.971 0 50 GFAA CCOCCNC(=O)c1ccc([C@H]2CCCN2Cc2ccc(CO)o2)s1 82039615 PUWDYWCMUZQURQ-MRXNPFEDSA-N 378.494 2.937 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(C(=O)c1conc1-c1ccccc1)CC2 91987631 UQSJLJNPQDSYPK-UHFFFAOYSA-N 377.448 2.684 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4cccs4)C3)CCC2=O)cn1 92065156 BFEVBWGTCLMRCB-HXUWFJFHSA-N 384.505 2.892 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccn1)C2 95354952 RECHYVDAUDFRCS-HUUCEWRRSA-N 387.915 2.768 0 50 GFAA COCC(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@H]1CCCO1 95511175 XHOYGCURVJJWHA-LJQANCHMSA-N 378.488 2.692 0 50 GFAA CCC(=O)Nc1cc(NC(=O)N2CCC[C@@H](CN3CCOCC3)C2)ccc1C 97713707 VTARIMREACVTBO-KRWDZBQOSA-N 388.512 2.920 0 50 GFAA CC(C)N1CC[C@H](NC(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)C1=O 114835664 HOKUKWAUNXHNKR-JKSUJKDBSA-N 383.851 2.571 0 50 GFAA CN(C(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 120045854 OPPOWJLRJMQNNP-IBGZPJMESA-N 376.460 2.770 0 50 GFAA CCO[C@H](C(=O)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1)c1ccccc1 142494982 LJRYRZRUMGWLSQ-FQEVSTJZSA-N 392.459 2.625 0 50 GFAA C[C@H](C(=O)Nc1ccc(CC(=O)N(C)C)cc1)[C@@H](C)NC(=O)OC(C)(C)C 170612377 FQRRTYMNAIHMFX-UONOGXRCSA-N 377.485 2.805 0 50 GFAA Cn1c(-c2cnccn2)nnc1S(=O)(=O)Cc1ccc(Cl)cc1Cl 170617105 LGEQVDLWJNXBPG-UHFFFAOYSA-N 384.248 2.553 0 50 GFAA NC(=O)NC1CCN(C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)CC1 170647079 VUESPZWWTIMJGA-UHFFFAOYSA-N 381.480 2.549 0 50 GFAA Cc1cc(N2CCC(NC(=O)N[C@@H]3CC(C)(C)OC3(C)C)CC2)nc(C)n1 181860281 ZWKAEUBPCLXOMN-MRXNPFEDSA-N 375.517 2.708 0 50 GFAA Cc1nn(-c2ccccc2)cc1CNS(=O)(=O)CCc1ccc2c(c1)CCO2 189810779 YEICMQHTEOKIBF-UHFFFAOYSA-N 397.500 2.778 0 50 GFAA O=C(CC1C[C@@H]2CC[C@H](C1)N2)NCC(=O)N1CCC(Cc2ccccc2)CC1 237881809 AZSCUHYPLMLQCL-SEJPIABJSA-N 383.536 2.505 0 50 GFAA C[C@H](O)c1ncc(C(=O)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)s1 241862556 SRARNODOLXSHSZ-STQMWFEESA-N 392.500 2.578 0 50 GFAA O=C(N[C@H](c1cccs1)[C@H]1C[C@@H](O)C1)C1(N2CCOCC2)CCCCC1 244748816 OOVYNHOQWKGEAN-JZXOWHBKSA-N 378.538 2.711 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)N[C@@H](Cc3ccccn3)[C@H]3C[C@@H](O)C3)c2c1 253535491 WOMNAYBAGIAGHL-NBQZKYEYSA-N 377.444 2.756 0 50 GFAA COc1ccc(-c2cc3c(=O)n(C[C@@H](O)c4ccc(OC)cc4)ccn3n2)cc1 263615805 FHBUSIRIPMVQDT-OAQYLSRUSA-N 391.427 2.914 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)N4CCc5ccccc54)c3CO2)cc1 263616538 JIAAYMLWVWEAOR-LJQANCHMSA-N 376.416 2.761 0 50 GFAA COCCN1Cc2cc(C(=O)N[C@H](C)c3ccc(OC)cc3)ccc2OCC1=O 263618497 UBSUVYZEQJNNOA-OAHLLOKOSA-N 398.459 2.554 0 50 GFAA COc1ccc2c(c1)OC(C)(C)CN(C(=O)NCc1c(C)nn(C)c1OC)C2 420830949 IIWMGYMUFKAGLE-UHFFFAOYSA-N 388.468 2.629 0 50 GFAA CC(C)N(C)C(=O)CN1CC[C@]2(CCCN(CCCc3ccccc3)C2=O)C1 426649766 VLNPJXPNCKCENC-HSZRJFAPSA-N 385.552 2.801 0 50 GFAA CCCCc1ncc(CN2CCOC3(CCN(C(=O)NC(C)C)CC3)C2)[nH]1 822884288 GGZOATBOFOYDKF-UHFFFAOYSA-N 377.533 2.537 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2cnc(-c3ccccn3)nc2)cc1C 952966245 GLIUPBIMOXRBNZ-UHFFFAOYSA-N 377.404 2.684 0 50 GFAA Cn1c(=O)cc(C(=O)N2C[C@H]3CC[C@@H](C2)N(CC2CCC2)C3)c2ccccc21 1073280161 NTKNRNANHZSHPZ-ROUUACIJSA-N 379.504 2.875 0 50 GFAA C[C@H](NC(=O)Nc1ccn(CCN2CCNC2=O)n1)c1cc2ccccc2o1 1311227482 DDWUBXWEEJLVAR-ZDUSSCGKSA-N 382.424 2.537 0 50 GFAA COc1ccc([C@H]2CN(C(=O)CCc3cc(Cl)no3)C[C@@H]2N(C)C)cc1 1565526871 QGZAZBBQCHNGBM-SJORKVTESA-N 377.872 2.825 0 50 GFAA CCCCCc1nc(CCn2cnc3ccccc3c2=O)n(-c2ccnn2C)n1 1772817226 MVHGGPKSRHEQOW-UHFFFAOYSA-N 391.479 2.686 0 50 GFAA CN1CCC[C@@H](CNC(=O)NCCc2nccn2C)[C@@H]1c1cccc(Cl)c1 1775996415 RSWZEBYISJFEJH-LPHOPBHVSA-N 389.931 2.998 0 50 GFAA COCCn1nc(Cc2ccc(OC)c(OC)c2)nc1-c1cc(C2CC2)n(C)n1 1857677260 TWFZMKQDZSTPOU-UHFFFAOYSA-N 397.479 2.810 0 50 GFAA Fc1cccc(OCc2nc([C@H]3CCc4ncnn4C3)n(-c3ccccn3)n2)c1 1857679539 YKAGHSOXXAIBMQ-AWEZNQCLSA-N 391.410 2.702 0 50 GFAA COc1cc(-c2nccn2C2CCN(c3ncccn3)CC2)cc2c1OCO2 1857701635 SBKCBBVUCNALDY-UHFFFAOYSA-N 379.420 2.919 0 50 GFAA O=C(NCCC1CCC1)[C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857718524 ITLUXIAVWQUEMW-INIZCTEOSA-N 384.505 2.788 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccc(Cl)cn3)C[C@]23CC[C@H]1O3)c1cccnc1 1857719379 JSNSNMOEJTWUMH-TVKQPGBESA-N 384.867 2.544 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccc(F)c4)[C@H]4CC[C@]3(C2)O4)n1 1857728318 WSPODBQWDNKNLL-ZZLPTCMGSA-N 395.478 2.939 0 50 GFAA O=C([C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1)N1CCC(CO)CC1 1857732084 BJRCCLSUFXGVMH-AWEZNQCLSA-N 377.872 2.929 0 50 GFAA NC(=O)[C@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccccc1F 1875262023 SGUIHBOWHZBTEY-QGZVFWFLSA-N 387.411 2.969 0 50 GFAA O=C(NCc1cccnc1-n1cncn1)c1cccc(CN2CCCCC2)c1 1875265932 GYOUZVRZWBWTQH-UHFFFAOYSA-N 376.464 2.578 0 50 GFAA CN[C@@H](Cc1ccccc1)C(=O)N1CCC2(CC1)C[C@H](N)c1ccccc1O2 1875276705 ROOBXCKYCKLHOK-PMACEKPBSA-N 379.504 2.661 0 50 GFAA O=C(NC[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)[C@H]1NCCC12CC2 1875287801 ZYVWAGKGHHMXCR-WOJBJXKFSA-N 375.472 2.642 0 50 GFAA CN1CCN(Cc2nc3ccc(NC(=O)c4cc5cnccc5o4)cc3[nH]2)CC1 1875330313 NCNGFYGCAHFPNW-UHFFFAOYSA-N 390.447 2.704 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2100556184 HLQGFWMEWDEFSI-HSZRJFAPSA-N 378.472 2.976 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2csc(C)n2)CC[C@@H]1Nc1ncccn1 2356168649 MBGSYJJVZAZBQH-XIRDDKMYSA-N 389.525 2.934 0 50 GFAA Cc1c(NC(=O)c2cc3ccccc3oc2=O)c(=O)n(-c2ccccc2)n1C 636695 BLVFBXQGQFQKFH-UHFFFAOYSA-N 375.384 2.843 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1[C@@H](C(=O)O)Cc3c([nH]c4ccccc34)[C@@H]21 754222 NNRWDPOHSYYGEI-RDTXWAMCSA-N 378.384 2.740 0 50 GFAA biogenic,in-vitro CN(Cc1n[nH]c2c1CCCCC2)C(=O)c1cccc(-c2cncc(N)n2)c1 2356152480 LNNTZDQRMXHUHM-UHFFFAOYSA-N 376.464 2.990 0 50 GFAA Cc1c(CN2CC[C@H](c3ccccc3)[C@H](O)C2)c(=O)n(-c2ccccc2)n1C 2356167483 QCJBAYHWELZODO-IFMALSPDSA-N 377.488 2.835 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1C(F)(F)F 100627025 DDYHBIRITVNHTG-KUDNYVPYSA-N 378.350 2.841 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CCc4n[nH]cc4C3)nc2)C1 67649762 HGXMEPIBKRLXPK-KRWDZBQOSA-N 395.507 2.835 0 50 GFAA Cc1ccccc1-c1c[nH]nc1C1CCN(C(=O)CN2CCC[C@@H](O)C2)CC1 67818317 MVLWDNJNNVVXLX-GOSISDBHSA-N 382.508 2.548 0 50 GFAA O=C(N[C@H]1CCCc2c1cnn2-c1ccccn1)c1scc2c1OCCO2 11937749 WMJMFLAUWQRSKB-ZDUSSCGKSA-N 382.445 2.907 0 50 GFAA Cc1ncccc1O[C@H]1CCN(S(=O)(=O)Cc2cccc3cccnc23)C1 328644921 ZNGRVDXCEBYDBN-SFHVURJKSA-N 383.473 2.921 0 50 GFAA CC[C@@H](NC(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C)c1ccncc1 219014468 WBSGEDJFCGTSHE-QGZVFWFLSA-N 379.464 2.686 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cnc(C)s1)C(=O)N(C1CCCC1)C2 71661610 UTJSGXCCAUXSFB-UHFFFAOYSA-N 386.477 2.684 0 50 GFAA Cc1onc(-c2ccccc2)c1C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1 173280463 NPBUBKAZVJXUNS-LJQANCHMSA-N 382.508 2.892 0 50 GFAA COc1ccc(OC[C@H]2CCCN(C(=O)CN(C)Cc3ccncc3)C2)cc1 77407301 GVCYTBAVBULWQR-IBGZPJMESA-N 383.492 2.840 0 50 GFAA COc1ccc(-n2nc(Cc3ccccc3)n(CC(=O)N(C)C(C)C)c2=O)cc1 77298743 HENHHRRWSSSTKK-UHFFFAOYSA-N 394.475 2.500 0 50 GFAA CN(C)c1ncn(-c2cccc(NC(=O)N3CCCC[C@@H]3c3ccnn3C)c2)n1 333419219 FSBBOYHNDDHUKE-GOSISDBHSA-N 394.483 2.826 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3CC[C@H](Cc4ccc(C(=O)O)cc4)C3)cc2n1 72432261 MVOGJHRBDVITOO-MRXNPFEDSA-N 378.432 2.749 0 50 GFAA COc1ccc(-n2ccnc2CN2CCCN(Cc3cccnc3)CC2)cc1 215200848 BFOGXOMYUZAATD-UHFFFAOYSA-N 377.492 2.984 0 50 GFAA Cc1nn(C)c(C)c1[C@@H](NC(=O)N1CCOc2cc(O)ccc2C1)C(F)(F)F 376629219 MWDSMTSYSKHBOV-MRXNPFEDSA-N 398.385 2.950 0 50 GFAA COc1ccc(N2CCN(Cc3n[nH]c4cc(OC)ccc34)[C@H](C)C2=O)cc1 72156201 IRSWABJQONMPSZ-CQSZACIVSA-N 380.448 2.817 0 50 GFAA CS[C@H](CO)[C@@H](C)NC(=O)C(C)(C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 241774185 RNTPJTMFVAQAFE-QLFBSQMISA-N 388.574 2.888 0 50 GFAA Cc1cc(S(=O)(=O)NC(=O)c2ccc(-c3ncon3)cc2)cc(C)c1F 241515665 OGWZIGODYNHXOS-UHFFFAOYSA-N 375.381 2.611 0 50 GFAA CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H]1CCS(=O)(=O)C1 242302127 YPTDMWGPTWQLPT-FPMFFAJLSA-N 375.412 2.845 0 50 GFAA O=C(NC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cn(-c2ccccc2)nn1 72120958 ANTXWGVDBYQCKK-INIZCTEOSA-N 376.338 2.750 0 50 GFAA Cc1ccccc1CNC(=O)CN1CCC2(CC1)Nc1ccccc1NC2=O 82107153 MNDXUOJMKOABGT-UHFFFAOYSA-N 378.476 2.510 0 50 GFAA Cc1nn(C)cc1CNC(=O)c1csc2c1CCN(Cc1c(C)noc1C)C2 426707454 QNHKBTCKFFUEIK-UHFFFAOYSA-N 399.520 2.883 0 50 GFAA COc1ccccc1-c1noc(CCC(=O)N2CCC[C@@H](c3ccn[nH]3)C2)n1 221216620 PYAAXTPGEIALOK-CQSZACIVSA-N 381.436 2.807 0 50 GFAA Cc1cc(N2CCC(NS(=O)(=O)c3cccc4ncccc34)CC2)nc(C)n1 178604094 XTDKFCRBALVIRP-UHFFFAOYSA-N 397.504 2.589 0 50 GFAA CNC(=O)c1ccc(-c2cccc(C(=O)N3CC(n4nc(C)cc4C)C3)c2)o1 426546179 MPQJCQUZCATOND-UHFFFAOYSA-N 378.432 2.817 0 50 GFAA Cn1cc(CNC(=O)N2CCCN3c4ccccc4C[C@H]3C2)c(C(F)(F)F)n1 292527506 PKKGOLNDRXUWMP-HNNXBMFYSA-N 393.413 2.786 0 50 GFAA O=S(=O)(N1CCOCC1)N1CCCC(c2ccccc2)(c2ccccc2)C1 91769177 ARENJJYZWWFDFU-UHFFFAOYSA-N 386.517 2.646 0 50 GFAA COCCC(=O)N1CCC(Oc2ccc(C(=O)N3CCC[C@@H](C)C3)cc2)CC1 95516936 ANKDOMOKJXOSAE-QGZVFWFLSA-N 388.508 2.965 0 50 GFAA CC[C@H](C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2CC(C)C)n1cccn1 95504832 RLDALYMQBFLTIM-GOSISDBHSA-N 384.528 2.589 0 50 GFAA O=C(COc1ccc(Cl)cc1Cl)N1CCC(O)(Cn2ccnc2)CC1 91932702 JKYWVDGEXOLOLF-UHFFFAOYSA-N 384.263 2.622 0 50 GFAA CCc1ocnc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 92002223 CVXKLNUVVVRMCP-UHFFFAOYSA-N 396.491 2.720 0 50 GFAA O=C1[C@H]2[C@H]3[C@@H]4[C@H]5[C@H](C(=O)[C@H]4[C@@H]2OCOCc2ccccc2)[C@@H]2C=C[C@@H]4[C@@H]1[C@H]3[C@@H]5[C@H]42 254380676 IMOUDSNFOYCYFR-WANOATSGSA-N 388.463 2.730 0 50 GFAA COc1ccc([C@H](CC(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)NC(C)=O)cc1 299749877 LXWYRSMJLGIQBN-WNHJNPCNSA-N 388.464 2.507 0 50 GFAA COc1cccc(CN2CCN(C[C@@H]3CC(c4ccccc4)=NO3)CC2=O)c1 252500818 TVUCKQFOHWCFGZ-FQEVSTJZSA-N 379.460 2.533 0 50 GFAA COC(=O)C1=C(C(=O)OC)[C@H]2C(=Cc3ccccc3)[C@H]1[C@@]13O[C@]21[C@H]1CC[C@H]3C1 257358448 UNLAFMWRBFJTDV-LXKFEYAZSA-N 378.424 2.910 0 50 GFAA CCCn1nccc1C(=O)N1CCc2[nH]c(-c3cccc(C(=O)O)c3)nc2C1 299799278 QTKOXCXEMRKEAK-UHFFFAOYSA-N 379.420 2.580 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@@H](OCc2cccnc2)C1 827927097 XLVVYEHDLLOPDQ-MRXNPFEDSA-N 382.420 2.865 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 268947880 HNGTUADNKKRLNZ-INIZCTEOSA-N 378.226 2.572 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)N[C@@H]1[C@H]2CCO[C@H]2C12CCC2 269921021 JBIBAKWYLJHICK-MISYRCLQSA-N 399.491 2.767 0 50 GFAA Cc1cccc(OCCC(=O)N[C@@H]2C[C@H](Cn3cc(Cl)cn3)C[C@H]2O)c1C 1875403603 WMGPTJRYQLFWJY-CGTJXYLNSA-N 391.899 2.878 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccncc2)CN(C(=O)N[C@@H]2CCCCNC2)C1 952895724 WWAHAGGDXNYRAM-QGZVFWFLSA-N 382.512 2.503 0 50 GFAA Cc1nn(C(C)C)c(C)c1S(=O)(=O)N(C)Cc1ccc2nsnc2c1 952984481 UOMQOICKKJEWMD-UHFFFAOYSA-N 379.511 2.906 0 50 GFAA CCCOc1ccc(-c2nc(C(=O)NC3(CO)CCOCC3)cs2)cc1 273628321 BCURUHPVSZWHHJ-UHFFFAOYSA-N 376.478 2.870 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)N2CCN(c3cnccn3)CC2)c1C 1506430685 YAIRTDCXJYCQNP-UHFFFAOYSA-N 388.537 2.902 0 50 GFAA CC(C)CN1C[C@H]2CN(CCS(C)(=O)=O)C[C@]2(CCc2ccccc2)C1 1772806225 ABHJRBQEFJVQJU-NHCUHLMSSA-N 378.582 2.554 0 50 GFAA COCCC(=O)N1C[C@H]2CN(C(=O)c3cc[nH]c3)C[C@@]2(CCc2ccccc2)C1 1772707083 YIXFYWRFUGWSSW-NZQKXSOJSA-N 395.503 2.585 0 50 GFAA O=C(c1cc[nH]n1)N1C[C@@H]2CN(C(=O)C3CCC3)C[C@]2(CCc2ccccc2)C1 1772707069 QVTYWQQWZLVGFH-WMZHIEFXSA-N 392.503 2.743 0 50 GFAA O=C(c1cn(CCCc2ccccc2)nn1)N1CCC[C@H](CN2CCCC2)C1 11878553 IRVZWHQKBVHWMO-HXUWFJFHSA-N 381.524 2.859 0 50 GFAA CCN(CC)C[C@@H](O)COc1cc(CN(C)Cc2cccnc2)ccc1OC 12307631 IEYHGOOZOVBFHN-HXUWFJFHSA-N 387.524 2.804 0 50 GFAA O=C(Nc1ccc(-n2cnnn2)cc1)[C@@H]1CCCCN1Cc1ccc(F)cc1 12750962 NPRJAKKWZCGWKB-IBGZPJMESA-N 380.427 2.795 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4cc(C)cc(C)c4)CC3)nn2)n1 169780328 COFLBONKZAWLPH-UHFFFAOYSA-N 380.452 2.985 0 50 GFAA Cc1nc(C(=O)N(C)Cc2ccc(F)cc2)nc(N2CC[C@@H](N(C)C)C2)c1C 1857528658 HBJIUTWCKKRAPG-GOSISDBHSA-N 385.487 2.645 0 50 GFAA CN(CC(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1)Cc1ccncc1 1857676996 OVHODMXZKJZIGL-UHFFFAOYSA-N 389.503 2.541 0 50 GFAA Cc1nc(N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c2cccnc2n1 1857729536 DIKKWAFECIEWDD-NRFANRHFSA-N 375.432 2.587 0 50 GFAA O=C([C@@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1)N1C[C@H]2CCC[C@H]2C1 1857732885 LLEVGCCGHRAZNN-IXDOHACOSA-N 396.516 2.740 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)C2(c3ccc(Br)cc3)CCOCC2)C1 109621837 QGNCXYLSNKFWOJ-ZDUSSCGKSA-N 396.281 2.821 0 50 GFAA COc1ccc(CNCCC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1F 237375527 VUKFNGVDQCNZDH-UHFFFAOYSA-N 389.446 2.802 0 50 GFAA COc1cccc2c1OC[C@@]1(C(=O)O)CN(C(=O)CCc3cccs3)C[C@@H]21 248246480 MFUNMXPDLSXHGQ-YWZLYKJASA-N 387.457 2.779 0 50 GFAA CCOc1cccc(CNC(=O)N[C@@H]2CCc3[nH]ncc3C2)c1OC(F)F 152289528 GVEJSVNGQZLODY-CYBMUJFWSA-N 380.395 2.767 0 50 GFAA Cc1noc(C2CCN(C(=O)N[C@H]3CCN(c4ncccc4Cl)C3)CC2)n1 159149719 JVJJWFLSBGBSHX-AWEZNQCLSA-N 390.875 2.594 0 50 GFAA CN(C)CC1CCN(c2ccc(NC(=O)c3cnc4[nH]cncc3-4)cc2)CC1 2325771193 BLZJTAZUCHMMBR-UHFFFAOYSA-N 378.480 2.940 0 50 GFAA CC(C)Oc1cc(Br)cc(C(=O)N2CCc3onc(CO)c3C2)c1 2325791426 YDESYJHNWFCRBH-UHFFFAOYSA-N 395.253 2.915 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2ccccc2Br)NC(=O)N1 1168298 HWXFJYJURNLLQO-ABAIWWIYSA-N 395.253 2.799 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1OC 1203923 GZZIHLXVUZDHAH-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1ccc(Cl)cc1)S(C)(=O)=O 2880138 HXKKQXMGTFFIOF-LLVKDONJSA-N 396.852 2.862 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N3Cc4cnc(C(C)(C)C)nc4C3)cn12 2356150039 JBDRYYIIKSWPIQ-QGZVFWFLSA-N 394.479 2.662 0 50 GFAA CCn1cc(CN(C)C(=O)[C@H]2CC[C@@H](OC)[C@H](NC3CCSCC3)C2)cn1 2356152359 GIGBKZJFSBPISB-QXAKKESOSA-N 394.585 2.530 0 50 GFAA COc1ccccc1C1=NN(S(C)(=O)=O)[C@H](c2cnc3ccccc3n2)C1 225507792 HWEWXJOOACMSPM-SFHVURJKSA-N 382.445 2.749 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccc(-n4cccn4)c3)C[C@H]2CCO)o1 104371311 IBQWXWWXNJYKQW-OAQYLSRUSA-N 380.492 2.843 0 50 GFAA O=C(NCCN1CCOCC1)c1cc(-c2cccs2)nn1-c1ccccc1 21866017 IDEQWHYLKURVFF-UHFFFAOYSA-N 382.489 2.663 0 50 GFAA O=C(CCn1cnc2ccccc21)N1CCCN(C(=O)c2cccs2)CC1 112306922 MMWHPTSVJHRPPG-UHFFFAOYSA-N 382.489 2.863 0 50 GFAA COc1ccc2c(c1)OC(C)(C)CN(C(=O)Cn1ncc3ccccc3c1=O)C2 422052568 RGCZXUXYPPBYSS-UHFFFAOYSA-N 393.443 2.605 0 50 GFAA O=S(=O)(NCCCN1CCOCC1)c1ccc(Cl)c(Cl)c1Cl 20191824 YGWANWAGCZXLRU-UHFFFAOYSA-N 387.716 2.647 0 50 GFAA CCC(=O)Nc1ccc(S(=O)(=O)N(CCO)[C@H]2CCc3ccccc32)cc1 119562775 WPGOMSNFNKXXAF-IBGZPJMESA-N 388.489 2.706 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)N[C@@H]1CCN2CCCC[C@@H]12 229688397 IWNPOKCRHAQPAA-KYNGSXCRSA-N 378.467 2.717 0 50 GFAA C[C@@H]1C[C@H](c2ccc(F)cc2)CN1CC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 172328777 QXUSQGHFOWWGRV-HIFRSBDPSA-N 395.434 2.868 0 50 GFAA Cc1cc2c(cc1NC(=O)CN(C)C)NC(=O)C[C@@H]2c1ccc2nonc2c1 65387405 HHYMDOMLKHRMSW-CYBMUJFWSA-N 379.420 2.505 0 50 GFAA CC(C)(O)CCc1ccc(C(=O)N2CCN(Cc3ccccc3)C(=O)C2)cc1 72481653 IWIMLBOVZSPCRF-UHFFFAOYSA-N 380.488 2.875 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c1 72437074 OZSYGIKJTFINJF-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccccc2S[C@H](C)C(=O)O)C1 262393093 AQTUIKCYOIQPBK-HUUCEWRRSA-N 392.521 2.876 0 50 GFAA CCN1CCOC[C@@H]1C(=O)NCc1cccc(NC(=O)c2ccc(C)cc2)c1 378364418 QFXWIOTVZUMGKC-HXUWFJFHSA-N 381.476 2.584 0 50 GFAA O=C(N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1)N1CC[C@]2(CCOC2)C1 459087433 BNYNPKUVIHVNCX-SCTDSRPQSA-N 397.441 2.839 0 50 GFAA NC(=O)c1ccc(C(=O)N2CCC3(CCN(Cc4ccccc4)C3)CC2)cc1 378301941 RJQRGQVGQQIYTP-UHFFFAOYSA-N 377.488 2.914 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-c2ccccc2CN(C)C)c1 71750236 OJEHSUOKZJJYJG-UHFFFAOYSA-N 376.478 2.800 0 50 GFAA Cc1cccc(N2C[C@@H](C)N(C(=O)c3ccc(SCCO)cc3)CC2=O)c1 82092418 VNAVGQPJYGMQJP-MRXNPFEDSA-N 384.501 2.957 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cccc(-c3ncc[nH]3)c2)C2CC(O)C2)cn1 223134117 SYQFSNBROXYYTJ-FAFZWHIHSA-N 378.432 2.722 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2c(C)nc3ncccn23)CC1(C)C 82087276 PTWGUXLQBDWHJZ-UHFFFAOYSA-N 379.464 2.787 0 50 GFAA O=C(CC1CCCC1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 82098011 BCVWLMOAQXUUAG-IBGZPJMESA-N 375.557 2.892 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Oc3ccc(Cl)cc3)[C@@H]3OC(C)(C)O[C@H]3[C@@H]2O1 239235672 WLUSHOBOGRNGTN-NJURLYQPSA-N 384.812 2.642 0 50 GFAA Cc1nc(CN2CC[C@@H](NC(=O)c3ccc(C)c(Cl)c3)[C@H](O)C2)cs1 426584064 RKKOSYNRWZYPGD-IAGOWNOFSA-N 379.913 2.779 0 50 GFAA Cc1nccn1CCC(=O)NCc1cc2n(n1)CCCN(C1CCCCC1)C2 91745186 BXTGAGDJQGCCAJ-UHFFFAOYSA-N 384.528 2.633 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)NCCc3nccs3)CC2=O)cc1Cl 91782016 CZVCJTOGNCLEDS-NSHDSACASA-N 379.869 2.517 0 50 GFAA CCc1nnc(-c2ccc(OC)c(NC(=O)N[C@H](C)c3ncnn3CC)c2)o1 97730000 DQFQGLWPQRFBTR-LLVKDONJSA-N 385.428 2.802 0 50 GFAA COc1ccc(F)cc1[C@@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95385392 VROFXJAHQAUSLB-KRWDZBQOSA-N 379.457 2.543 0 50 GFAA CN1CCCCC[C@@H]1C(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 91326800 PWALWENDJASCBW-HXUWFJFHSA-N 398.551 2.687 0 50 GFAA Cc1noc([C@@H]2CCCCN2C(=O)c2cnc(-c3csc(C)n3)nc2O)n1 92021627 HCTGHLCWFYPZQU-ZDUSSCGKSA-N 386.437 2.673 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCO[C@H](C(=O)O)C3)c(F)c2)c(F)c1 299745922 UCHONCISJSVKOP-KRWDZBQOSA-N 377.343 2.566 0 50 GFAA O=c1c2ccccc2ncn1C[C@H]1CC[C@H](C(=O)NCC2CCOCC2)CC1 252474854 NMOHSOJRQICMTI-IYARVYRRSA-N 383.492 2.746 0 50 GFAA CNC(=O)c1ccc(NC(=O)COc2cccc3c2ccn3CCOC)cc1 263588390 SVLKDQQZWGQGAO-UHFFFAOYSA-N 381.432 2.665 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 268944442 MBEYIXSPAJKZCP-SQNIBIBYSA-N 379.412 2.599 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)NC[C@H]3CC(C(F)(F)F)=NO3)ccc21 1875372020 UEAMADYCIGTOGK-CYBMUJFWSA-N 381.354 2.589 0 50 GFAA CC(=O)N1C[C@H]2[C@@H](NC(=O)c3cc(C(F)(F)F)nn3C3CC3)CCC[C@H]2C1 1875311229 QVBACEYKSSYMSE-YUTCNCBUSA-N 384.402 2.614 0 50 GFAA Cc1ccc2c(c1)C[C@H](C(=O)Nc1cccc([C@H]3CCCC(=O)N3)c1)S2(=O)=O 1875392624 KWFSIZJFBGNZMF-IEBWSBKVSA-N 398.484 2.673 0 50 GFAA COCCn1nc2c(c1C(=O)NCCOc1ccccc1C)C[C@H](C)O[C@@H]2C 1875315780 HISMRAYPSDVDEI-JKSUJKDBSA-N 387.480 2.669 0 50 GFAA Cc1noc2nc(-c3ccccc3)cc(C(=O)NC34CC(CO)(C3)O[C@H]4C)c12 1875299232 DVRDGORASHRVDL-GQKRIFGNSA-N 379.416 2.610 0 50 GFAA C[C@H](C(=O)NS(=O)(=O)[C@H]1CCc2ccccc21)n1ccc(C(F)(F)F)n1 1875285472 ODZRFVIPOPSQQJ-MFKMUULPSA-N 387.383 2.596 0 50 GFAA CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 170596160 RUCQOCCYDZRMGC-FXAWDEMLSA-N 399.516 2.560 0 50 GFAA NC(=O)c1coc(CNC(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)c1 189332023 JKCHEZNIRNPXIF-UHFFFAOYSA-N 393.325 2.905 0 50 GFAA CN1CCCc2ccc(S(=O)(=O)Nc3cn(Cc4ccccc4)nn3)cc21 190345344 XBVSOUDWILGXKV-UHFFFAOYSA-N 383.477 2.510 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N[C@H]1CCCN(C(=O)c2cccs2)C1 1506400279 BOKOGKFKGBETTC-AWEZNQCLSA-N 386.521 2.704 0 50 GFAA CCN1C(=O)C[C@@H](Sc2ccccc2C(=O)Nc2cnn(C(C)C)c2)C1=O 1529151251 IXHBMIJLEHPABX-MRXNPFEDSA-N 386.477 2.956 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)c3ccc(=O)n(C)c3)C[C@@]2(CCc2ccccc2)C1 1772809904 GVBCYIMGUWNXSQ-ZJSXRUAMSA-N 393.531 2.802 0 50 GFAA O=C(NC1(Cc2ccccc2)CC1)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772818975 DDKMQTPHJZXPQZ-QGZVFWFLSA-N 397.544 2.976 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(c3ccnc(C)n3)C[C@@]2(CCc2ccccc2)C1 1772815407 LGKXTDNTDSZHPO-OFNKIYASSA-N 394.519 2.719 0 50 GFAA CO[C@H](C(=O)NC[C@H]1Cc2cc(-c3cnccn3)ccc2O1)c1ccccc1 12052663 JMMXOPQJNVNWPQ-NQIIRXRSSA-N 375.428 2.951 0 50 GFAA CC(C)(C)NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 12381479 VAXQFZQBVYUERE-UHFFFAOYSA-N 390.461 2.787 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)CCc4ccccc4)CC3)nn2)n1 13009112 HDVIXXKLNCYEEW-UHFFFAOYSA-N 390.491 2.561 0 50 GFAA Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCCCn2ccnc2)cc1 13689608 YSKKSKRQASXJKO-UHFFFAOYSA-N 398.488 2.812 0 50 GFAA Cc1ccc(CN(C)C(=O)c2nc(C)c(C)c(N3CC[C@@H](N(C)C)C3)n2)cc1 1857529747 SGLBLCPVSJLTFJ-LJQANCHMSA-N 381.524 2.814 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cccc3c2OCCO3)[C@H]1c1ccccc1 1857687081 KEWCIUUKLCFBET-PMACEKPBSA-N 382.460 2.602 0 50 GFAA O=C(O)C1CCN(C(=O)C2(c3ccc(Br)cc3)CCOCC2)CC1 238020461 ZARAKUHGUYXDJI-UHFFFAOYSA-N 396.281 2.821 0 50 GFAA CSc1ccc2cc(CN3C(=O)N[C@]4(CCCNC4)C3=O)c(Cl)nc2c1 830545444 HDEOFZORSRSVLC-SFHVURJKSA-N 390.896 2.784 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)c(O)n1 2100547398 IVQBEWOFLWJFLS-QHCPKHFHSA-N 393.487 2.936 0 50 GFAA COc1ccc(-c2noc(CNC(=O)c3cccc4c3COC4)n2)cc1OC 2100556410 MPGFMFVYHWGHOY-UHFFFAOYSA-N 381.388 2.714 0 50 GFAA O=C(NCCc1ccccc1)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2100556804 IDBIUIMFOQQFEA-HSZRJFAPSA-N 392.503 2.991 0 50 GFAA COC(=O)c1cc(=NC(=O)N2CCC[C@H](Cc3ccc(Cl)cc3)C2)[nH]n1C 2325818937 HGJKWZZXUYFLSD-CQSZACIVSA-N 390.871 2.769 0 50 GFAA Cc1c(O)c(=O)ccn1CC(=O)N[C@@H](COc1ccccc1)c1ccc(F)cc1 2325876476 WPTZBIDRLYGUST-IBGZPJMESA-N 396.418 2.938 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2cc(Br)c3c(c2)OCO3)C1 2325888320 HSFFXMPMIGUSDO-JTQLQIEISA-N 381.226 2.541 0 50 GFAA CC(C)C(=O)N1CC2(C[C@@H](NC(=O)Cc3ccccc3Cl)c3nccn32)C1 2332237716 ISOAXWNUKQSBKG-MRXNPFEDSA-N 386.883 2.534 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)C1CCN(C(=O)Cc2ccccc2)CC1 783920 GTJQRZHBAZZBLX-UHFFFAOYSA-N 380.444 2.878 0 50 GFAA COc1cc(NC(=O)CCN2CCN(c3ccccc3OC)CC2)cc(OC)c1 895245 HBEIZXVFPCJMJO-UHFFFAOYSA-N 399.491 2.863 0 50 GFAA Cc1cc(F)ccc1NC(=O)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2795403 KNEQXAGDINYGFT-UHFFFAOYSA-N 377.383 2.742 0 50 GFAA CCOC(=O)c1ccc(C(=O)OCC)c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c1 2801100 LMIYGGSMPMMYTQ-UONOGXRCSA-N 389.404 2.646 0 50 GFAA O=C1CC2(CCCC2)CC(=O)N1CCCCNC[C@@H]1COc2ccccc2O1 3995603 HCVRCHQFYYZPHT-QGZVFWFLSA-N 386.492 2.906 0 50 GFAA in-vitro COCCCn1c(S)nnc1-c1ccccc1I 6640812 NLGKFVZSOKGWTC-UHFFFAOYSA-N 375.235 2.875 0 50 GFAA O=C(NCc1ccccn1)c1ccc(OC2CCN(C[C@@H]3CCOC3)CC2)cc1 12435930 YZQOGPYEPVJGER-SFHVURJKSA-N 395.503 2.891 0 50 GFAA CN(C(=O)CCc1nnc(Cc2ccc3c(c2)OCO3)o1)C(C1CC1)C1CC1 12718605 PLRINEZGAQAARH-UHFFFAOYSA-N 383.448 2.969 0 50 GFAA CC(C)OCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14531594 VSTDNIXWEADEOI-SFHVURJKSA-N 384.524 2.564 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCCc2cccs2)c1=O 15003631 DLOAHRACPDJFOX-UHFFFAOYSA-N 387.505 2.747 0 50 GFAA CCOC(=O)[C@@H](Cc1ccccc1)C(=O)N1CCN(Cc2ccccc2)CC1 19787325 MBNBZHWJLOFIPQ-NRFANRHFSA-N 380.488 2.753 0 50 GFAA O[C@@H]1CN(Cc2cccc(OCc3ccccc3)c2)CC[C@H]1N1CCOCC1 20601093 QDDXMHSJPNJRGA-DHIUTWEWSA-N 382.504 2.533 0 50 GFAA Cc1cccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)c1 30850286 CAXNKZDJSUGUIF-INIZCTEOSA-N 378.519 2.774 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)c(Cl)c1 35598124 MWEDCTBEWHUONW-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1cc(Cl)ccc1Cl 54225092 UMMWTIQVLRNKKQ-UHFFFAOYSA-N 382.247 2.983 0 50 GFAA O=C(Cn1c(=O)[nH]c2ccccc21)N1CCC[C@H](c2nc3ccccc3o2)C1 67785074 INVIEZVSTJMBHN-AWEZNQCLSA-N 376.416 2.877 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCN2CCCC2)(Cc2ccccc2)c2ccccc21 71751407 SBSATKFFYYNWPI-DEOSSOPVSA-N 391.515 2.746 0 50 GFAA NC(=O)c1cncc(N2CCC[C@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)n1 71765325 HCERGIVBMHMJGZ-INIZCTEOSA-N 386.455 2.927 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)C3CCN(C(=O)[C@@H]4CCCO4)CC3)cc2c1C 72152370 UYWDNESCXUVFRS-FQEVSTJZSA-N 383.492 2.819 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCn2nc(CCC(=O)O)cc2C1 72407501 XLFWFIWAZSEQEV-UHFFFAOYSA-N 390.443 2.927 0 50 GFAA CCc1ncc(CN2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)cn1 72438847 KTJQCIJPSSLXFI-JOCHJYFZSA-N 379.508 2.839 0 50 GFAA CC(C)c1ccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3CCSCC3)[C@@H]4C2=O)cc1 77301458 VNMCLCOYUKYELV-VWNVYAMZSA-N 398.528 2.672 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(C(=O)CCc1ccco1)C2 82133913 YPLKHBHZRIGMLZ-KNKQGSTJSA-N 390.524 2.578 0 50 GFAA CCCCn1ccnc1[C@@H]1CCCN(C(=O)c2cccc(OCC(N)=O)c2)C1 95502639 KRYBJQZNQAJUDI-QGZVFWFLSA-N 384.480 2.567 0 50 GFAA O=C(/C=C/c1ccccc1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95507210 LKOMVPUEPMVHJQ-RMKNXTFCSA-N 390.487 2.736 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC(c2nccn2Cc2cccnc2)CC1 95508464 FDZQHKJWBFFCEP-UHFFFAOYSA-N 376.460 2.981 0 50 GFAA CN1CCN(C[C@@H](O)COc2ccc(CN3CCCCCCCC3)cc2)CC1 95522267 XNPXHHCQFBKMQG-JOCHJYFZSA-N 389.584 2.830 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)Nc2ccc(C(=O)OC)cc2C)C1 95527524 AEVOPUKKXZJYEP-INIZCTEOSA-N 375.469 2.894 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)N2CCN(c3ccncc3)CC2)cc1 97619033 QSTBPVXMELDDCQ-INIZCTEOSA-N 379.464 2.951 0 50 GFAA Cc1ccccc1[C@@H]1CCN(CCNC(=O)c2ccccc2-c2nc[nH]n2)C1 97743167 FPPOZEAAISMSNI-QGZVFWFLSA-N 375.476 2.999 0 50 GFAA COc1cc(OC)cc(-c2nnc(SCC(=O)N[C@@H]3C[C@H]4CC[C@H]3C4)[nH]2)c1 101760505 KWLVCGQKCCZOIO-MQIPJXDCSA-N 388.493 2.886 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(COC)o3)C[C@H]2CCO)cc1 104462128 OIWPKDZXTTZZSF-LJQANCHMSA-N 388.508 2.894 0 50 GFAA CCCOc1ccc(C(=O)N2CCO[C@@H](Cn3cc(C)cn3)C2)cc1OCC 112062598 LSVVXOJWPHZDER-GOSISDBHSA-N 387.480 2.920 0 50 GFAA C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)c2n[nH]c3c2CCC3)CC1 112678516 ZHIARVGEQPYDKV-GFCCVEGCSA-N 398.492 2.529 0 50 GFAA Cc1nc2n(n1)C[C@@H](Nc1cc(C(F)(F)F)nc(-c3cccnc3)n1)CC2 116870873 MSZHUYSKJHQJMK-LBPRGKRZSA-N 375.358 2.884 0 50 GFAA O=C(NCc1nnc(-c2ccccc2)s1)Nc1ccc(N2CCOCC2)nc1 161997109 WZAOFUPEJSSHGU-UHFFFAOYSA-N 396.476 2.758 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)Cc4ccc(F)cc4)CC3)nn2)n1 169777394 AXXAJYFPWUWLQU-UHFFFAOYSA-N 398.442 2.826 0 50 GFAA CC(=O)Nc1ccc(OC[C@@H](O)Cn2nc(C(F)(F)F)c3cnccc32)cc1 193007210 CKNYAKWVMFWSTM-ZDUSSCGKSA-N 394.353 2.848 0 50 GFAA CC(C)[C@H](C(=O)NCCc1nc2ccccc2n1C)N1Cc2ccccc2C1=O 223230661 QWTKTEORHJZWHB-OAQYLSRUSA-N 390.487 2.913 0 50 GFAA Cc1cccc(C[C@H](CNC(=O)c2cc(N3CCCC3=O)ccc2F)C(=O)O)c1 237699348 NDFQNURRKGWQDX-MRXNPFEDSA-N 398.434 2.934 0 50 GFAA O=C(O)CCC/C=C/C[C@H]1[C@H](/C=C/[C@@H](O)COc2ccsc2)[C@@H](O)C[C@H]1O 245204674 FYBFDIIAPRHIQS-XNJWTFPASA-N 396.505 2.603 0 50 GFAA C[C@H](CNC(=O)[C@H](C)N1CCn2c(Br)cnc2C1)c1ccccc1 252536249 HZFAVYYJFAYRIW-KGLIPLIRSA-N 391.313 2.770 0 50 GFAA CC(C)C[C@H](NC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1)C(=O)O 262674769 QSYZGOBOPSCKPM-OCCSQVGLSA-N 376.482 2.523 0 50 GFAA O=C(Nc1nnc(Cc2cccc(F)c2)s1)c1ccc(N2CCCC2)nn1 264406723 UOUNOIKVAHPUKF-UHFFFAOYSA-N 384.440 2.911 0 50 GFAA C[C@@H]1CCCN(c2cc(C(=O)NCCc3cccc(C(=O)N(C)C)c3)ccn2)C1 291838360 BMRNBKZTTIBBEY-QGZVFWFLSA-N 394.519 2.992 0 50 GFAA O[C@@H](COc1ccc(F)cc1)CN1CCC[C@H](c2nnc3n2CCCCC3)C1 298206211 IZJAJWGPJZEVHC-FUHWJXTLSA-N 388.487 2.763 0 50 GFAA O=C(Nc1nncs1)c1ccc(N2CC[C@H](Oc3cccc(F)c3)C2)nc1 302140798 JIOGLYDADRPSPY-HNNXBMFYSA-N 385.424 2.982 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C[C@H](O)c2ccccc2F)CC1 328650603 VOMKZWFEKCKWBA-RXVVDRJESA-N 386.471 2.552 0 50 GFAA CC(C)(C)C1CCN(c2nnc([C@@H]3COCCO3)n2C[C@H]2CCOC2)CC1 328805046 CVEDFVMOOADCKD-WBVHZDCISA-N 378.517 2.665 0 50 GFAA CC(C)n1cc([C@@]2(O)CCN(C(=O)Nc3cccc(COCC4CC4)c3)C2)nn1 375418980 BGOHDAJRSJRPKR-OAQYLSRUSA-N 399.495 2.911 0 50 GFAA Cc1nn(C)c(C)c1[C@H](NC(=O)N1CCOc2cc(O)ccc2C1)C(F)(F)F 376629218 MWDSMTSYSKHBOV-INIZCTEOSA-N 398.385 2.950 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CCC[C@@H]2c2cn(C)nc2C)c1 378095456 DCQONXSIGVCOIW-QGZVFWFLSA-N 380.456 2.771 0 50 GFAA CCO[C@H]1COC[C@@H]1NC(=O)Nc1ccc2sc(C(=O)N(C)C)cc2c1 426615554 PLEVKFIPAQTGCC-KBPBESRZSA-N 377.466 2.529 0 50 GFAA CN(Cc1nc(O)c2ccccc2n1)C(=O)NCc1noc(C2CCCC2)n1 534590931 BLMMNTXDGUDFFX-UHFFFAOYSA-N 382.424 2.718 0 50 GFAA CC[C@H]1C(=O)NCCN1C(=O)c1cccc(-c2nn(C)c3ccc(F)cc23)c1 534638284 JDHFOJHSTRZURG-KRWDZBQOSA-N 380.423 2.730 0 50 GFAA O=C(N[C@H]1CCCN(Cc2cccs2)C1)c1cc(=O)n(-c2ccccc2)[nH]1 670444058 XBJYIWTVAVDRHL-HNNXBMFYSA-N 382.489 2.622 0 50 GFAA COc1cccc([C@H]2CNCCN2C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c1 883552969 GIPABBNROGQRNY-LJQANCHMSA-N 392.463 2.669 0 50 GFAA CC[C@@H]1c2cc(F)c(F)cc2CCN1C(=O)c1nnn([C@H]2CCNC2)c1C 888101955 RIURSXWLIADHBL-SUMWQHHRSA-N 375.423 2.549 0 50 GFAA COc1ccc2c(c1)C=C(CNC[C@@H](c1ccccn1)N1CCOCC1)CO2 952968075 JLJPALHNDWEOIQ-NRFANRHFSA-N 381.476 2.529 0 50 GFAA CC1(C)[C@H]2CC=C(CN3CCCN(C(=O)c4cn5cccnc5n4)CC3)[C@@H]1C2 1529133582 QBRVEJFAEULTQW-ROUUACIJSA-N 379.508 2.870 0 50 GFAA Cc1ccc2[nH]c(C(=O)N[C@H]3CCN(Cc4cccnc4)C[C@@H]3O)c(C)c2c1 1565512127 OVMCSGZHBOFNGY-PMACEKPBSA-N 378.476 2.545 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3C[C@@H](O)[C@H](Cc4cc(C)no4)C3)n[nH]2)cc1 1704349691 CYSHSNXEABDDCC-OXQOHEQNSA-N 380.448 2.611 0 50 GFAA Cc1ccc(OCC(=O)N2CCCN(C(=O)CSc3ccccn3)CC2)cc1 1772704991 JGWWESDNGLOKQE-UHFFFAOYSA-N 399.516 2.622 0 50 GFAA CN1CCOC2(CCN(C(=O)c3ccccc3OC(F)(F)C(F)F)CC2)C1 1772805996 SRMDPILUDNKMMD-UHFFFAOYSA-N 390.377 2.860 0 50 GFAA O=C1CC2(CCN(Cc3cccc(OCc4ccccn4)c3)CC2)OCCN1 1857694743 JBNNELKDMAVRFB-UHFFFAOYSA-N 381.476 2.532 0 50 GFAA CCn1ccc(CN2C[C@@H]3[C@H](CNC(=O)C4(C)CCCC4)[C@H]4CC[C@]3(C2)O4)n1 1857720876 PEPPAIMUSCKJQO-JZJXAQOMSA-N 386.540 2.579 0 50 GFAA O=C(O)C[C@H]1CCN(C(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)C1 1875277210 DMFVLNZFNOWHIM-VQIMIIECSA-N 380.444 2.871 0 50 GFAA Nc1cc(C(=O)Nc2cccc(N3CCCNC3=O)c2)nn1-c1ccc(F)cc1 1875336907 OZSDLVSIZPYLBW-UHFFFAOYSA-N 394.410 2.766 0 50 GFAA O=C(O)[C@]1(CCCc2ccccc2)CN(c2ccnc3[nH]ncc23)CC[C@H]1O 2100556223 IZTCHOKBGRQMII-WIYYLYMNSA-N 380.448 2.623 0 50 GFAA Cn1nc(CN(Cc2ccccc2Br)S(C)(=O)=O)cc1Cl 2325788050 JIWVICRKUPRHSZ-UHFFFAOYSA-N 392.706 2.798 0 50 GFAA CCn1cc(Cl)cc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)Cc1cnc(C)o1 2325794516 FGPRHDOBBCZYPQ-BMFZPTHFSA-N 390.871 2.562 0 50 GFAA CC1(C)CO[C@H](CCC(=O)N[C@H]2COCC[C@H]2NC(=O)[C@H]2CC[C@H](C)CC2)C1 2325794986 ZAAGNMUSTIVAKR-NNIGNNQHSA-N 394.556 2.798 0 50 GFAA Cc1nc(C)c(C(=O)N2CC[C@@H](CN(C)C(=O)C3=C(Cl)CC3)C2)c(C)n1 2325824972 XRQQBJLQZQQDOQ-AWEZNQCLSA-N 376.888 2.609 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CCCCCC3)CC2)cc1 783871 DHDQFBUYSMEDFJ-UHFFFAOYSA-N 394.537 2.935 0 50 GFAA O=C(NC[C@@H]1CCCO1)C1CCN(C(=O)c2ccc(Br)cc2)CC1 1144578 ODBKANJFTRQVLV-INIZCTEOSA-N 395.297 2.597 0 50 GFAA CC(C)[C@H](NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2556587 ORVHFHUXDLSLMX-FQEVSTJZSA-N 396.443 2.751 0 50 GFAA COC(=O)CSc1nnc(COc2ccc3c(c2)OCO3)n1-c1ccccc1 2641664 HFLVDBUOCOGFSM-UHFFFAOYSA-N 399.428 2.840 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3cccc4[nH]c(=N)sc34)C1)CC2 2356154278 PMFLJJLWAJNSMR-HXUWFJFHSA-N 379.489 2.927 0 50 GFAA CCOC(=O)C1CCN(C(=O)C2CCN(Cc3cccc(OC)c3)CC2)CC1 4725553 BRTHZSVMAISZOZ-UHFFFAOYSA-N 388.508 2.709 0 50 GFAA COC(=O)c1cc(NC(=O)c2ccc(NS(C)(=O)=O)cc2)ccc1Cl 4742554 RYWMUOOKRIQRSI-UHFFFAOYSA-N 382.825 2.750 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(F)cc1Cl 6266767 DJTYYWVCGSWCFW-UHFFFAOYSA-N 398.843 2.752 0 50 GFAA COc1ccc(Cl)cc1N([C@@H](C)C(=O)Nc1cccnc1)S(C)(=O)=O 6710021 UMPJMQYPCRAPPW-NSHDSACASA-N 383.857 2.537 0 50 GFAA CC(=O)N1CCN(c2ccc(NC(=O)c3sc4ncccc4c3N)cc2)CC1 10010940 NNVKANZPCZVIMR-UHFFFAOYSA-N 395.488 2.799 0 50 GFAA COc1cc(OC)cc([C@@H]2CC(c3ccc(F)cc3)=NN2S(C)(=O)=O)c1 225495017 VGBPXUFKRNTESJ-SFHVURJKSA-N 378.425 2.954 0 50 GFAA O=C(OCc1conc1C(F)(F)F)[C@H](c1ccccc1F)N1CCOCC1 225858470 NZQCREOATFBVGK-AWEZNQCLSA-N 388.317 2.949 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1ccccc1C(F)(F)F 55069451 JZEOAHHMZPKSQI-UHFFFAOYSA-N 381.354 2.695 0 50 GFAA Cc1ccc(CN2CCN(C3CCN(Cc4ccccn4)CC3)C[C@H]2CCO)o1 104628185 WQFONRGAXXMATJ-JOCHJYFZSA-N 398.551 2.516 0 50 GFAA Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)N1CCN(CCCC(=O)O)CC1 116342632 STRVRFDPHJLJJJ-UHFFFAOYSA-N 396.553 2.772 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)Nc1ccc(Br)cc1 101321378 WEAKHMUNEQPWFR-KUDNYVPYSA-N 391.265 2.809 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCCN(C(=O)c2ccoc2)CC1 56235532 OJGDQWHOWNOABM-UHFFFAOYSA-N 394.431 2.637 0 50 GFAA CCN1CCCN(C[C@@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)CC1 106733769 JWEWMFXRAPHCLR-QHCPKHFHSA-N 387.568 2.691 0 50 GFAA c1ccc([C@@H]2N=C3NCN(Cc4ccco4)CN3c3nc4ccccc4n32)nc1 20101468 CNUDAERKWLQWHO-LJQANCHMSA-N 385.431 2.768 0 50 GFAA CCN(CC)C(=O)c1cn(C2CCN(C(=O)C(C)(C)c3ccccc3)CC2)nn1 67713062 MRBMJWQOBLLOOA-UHFFFAOYSA-N 397.523 2.901 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)CCn2cnnc2)CCO3)s1 67774296 WALPBLHUGZVDBG-UHFFFAOYSA-N 384.461 2.832 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@]1(O)CNCc1ccc2c(c1)OCO2 67975082 NESJWWZCYBCZOG-QFIPXVFZSA-N 388.508 2.829 0 50 GFAA Cc1cc(C)n2nc(CC(=O)NCCc3cccc(C(F)(F)F)c3)nc2n1 65468433 YETFNUDUYAXTKS-UHFFFAOYSA-N 377.370 2.661 0 50 GFAA COc1ccc(C(=O)NC2CC2)c(OC2CCN(Cc3nc(C)c[nH]3)CC2)c1 12305506 UCHNOURFZGYSSP-UHFFFAOYSA-N 384.480 2.662 0 50 GFAA C[C@H](OC(=O)CCn1cnc2ccccc2c1=O)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 229707723 SCKSQEPVVFHCLJ-MUQADHOPSA-N 399.491 2.659 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3nc4c(s3)CCCC4)n2)cc1 61718714 BXVCTUUBHVKATR-UHFFFAOYSA-N 396.472 2.893 0 50 GFAA O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccn(Cc2ccccc2Cl)n1 2788375 WQXXRIVZGMHKBE-UHFFFAOYSA-N 393.838 2.877 0 50 GFAA CC(C)S(=O)(=O)c1ccccc1NC(=O)N1CCN(C2CCCC2)CC1 151284797 JEECISSFJNIGKX-UHFFFAOYSA-N 379.526 2.961 0 50 GFAA CC1([C@H]2CCCN(C(=O)[C@H]3CCCCN3C(=O)c3ccccc3)C2)OCCO1 363722532 KZLTWIVRIXVLCE-RBUKOAKNSA-N 386.492 2.683 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCN2CCCC2)(Cc2ccccc2)c2ccccc21 71751406 SBSATKFFYYNWPI-XMMPIXPASA-N 391.515 2.746 0 50 GFAA O=S(=O)(NCc1ccccc1)N1CCC[C@@H](Cc2nc3ccccc3[nH]2)C1 72169550 SRSGAJMWBJWTQR-KRWDZBQOSA-N 384.505 2.852 0 50 GFAA CC(C)CCN1CC2(CCN(C(=O)[C@@H](O)c3ccc(F)cc3)CC2)OC1=O 77358418 AIUWEVGQPSLKDC-KRWDZBQOSA-N 378.444 2.719 0 50 GFAA O=C(Nc1ccccc1N1CCCC1=O)N[C@H]1CCN(c2ncccc2F)C1 130374545 BSGAAIOMNXWSFQ-AWEZNQCLSA-N 383.427 2.748 0 50 GFAA CC[C@@H](O)c1cc2n(n1)CCN(C(=O)Cc1nc(-c3ccccc3)oc1C)C2 221289389 YUJUJPBPLKQMQR-LJQANCHMSA-N 380.448 2.875 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)NCc3snnc3C(C)C)c2n1 426545060 MGPAHEYWKNAXTG-UHFFFAOYSA-N 384.387 2.961 0 50 GFAA O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccccc2F)CC1 225249345 ADPSEXHWASRMNB-URLQWDBASA-N 394.512 2.672 0 50 GFAA CS(=O)(=O)N1CCC(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 178266763 VGEAGWMBCLNMEU-INIZCTEOSA-N 392.443 2.834 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@@H]4CCNC[C@@H]4C)csc3C2)nc1 426407572 NTDXRFFSSCSXCA-MGPUTAFESA-N 398.576 2.992 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)N1CCCN(Cc2cccs2)CC1 426394468 CMKCTEQKEQOTCC-UHFFFAOYSA-N 375.542 2.938 0 50 GFAA Cc1cc(C)n(-c2ccc(=O)n(CC(=O)Nc3ccc(C(C)(C)C)cc3)n2)n1 40266187 BHXNTWZYZYYNMJ-UHFFFAOYSA-N 379.464 2.982 0 50 GFAA CC(=O)N[C@@H]1CN(Cc2cccc(Cn3cccn3)c2)C[C@H]1c1ccc(C)o1 95500673 PXZGDJXRBULLBL-NHCUHLMSSA-N 378.476 2.937 0 50 GFAA O=C(c1ccc(Cl)cc1)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@@H]2C=Cc3cc(F)ccc3N21 247800737 FODXHQMLJQBXRZ-FJIDUMEYSA-N 396.805 2.835 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cn(Cc3ccccc3)nc2-c2ccccc2)CCO1 299752597 URNDQTJFOGWBDZ-IBGZPJMESA-N 391.427 2.524 0 50 GFAA COc1ccc(C(F)(F)F)cc1-c1cccc(C(=O)N[C@@H]2CCNC2=O)c1 584885719 NMCNZTHTBGCLAK-OAHLLOKOSA-N 378.350 2.999 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1cnc(Cc3ccccc3F)s1)CC2 185422438 XPFRKUMBTICHRT-ZDUSSCGKSA-N 385.468 2.772 0 50 GFAA CN(Cc1ccns1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2 872510952 GVBIZVFMFRLUAL-UHFFFAOYSA-N 385.898 2.892 0 50 GFAA CC[C@H]1CC[C@H](C(=O)NC[C@H]2CC[C@H](NC(=O)CN3CCCC3=O)CC2)CC1 1875341987 SBHLYBKCNCFUOX-VVPTUSLJSA-N 391.556 2.616 0 50 GFAA CCn1nc2c(c1C(=O)N1CC(=O)N(C)c3ccccc3C1)C[C@H](C)O[C@@H]2C 1875314321 RMGTWGDWCUQTGI-UONOGXRCSA-N 382.464 2.544 0 50 GFAA Cc1c(S(=O)(=O)N2CC3CC2(c2ccnn2C)C3)oc2ccc(F)cc12 1875396587 NVHFJBQRZNEGAM-UHFFFAOYSA-N 375.425 2.924 0 50 GFAA CN1C(=O)N[C@@](C)(c2ccc(NS(=O)(=O)c3ccsc3Cl)cc2)C1=O 1875316902 HTJBMZJCFICEHO-HNNXBMFYSA-N 399.881 2.599 0 50 GFAA Cc1ncsc1CN1CCOC2(CCN(C(=O)Cc3ccccc3)CC2)C1 952969446 NMLBEPIOGPPSOW-UHFFFAOYSA-N 385.533 2.888 0 50 GFAA COc1cccc2c1ccn2CC(=O)N1C[C@@H]2C[C@@H](C1)[C@H]1CCCC(=O)N1C2 888088277 DZPHADAIXNUVQX-XYJFISCASA-N 381.476 2.509 0 50 GFAA O=C(c1cc2c(nc1O)CCOC2)N1CC=C(c2c[nH]c3ncccc23)CC1 900060491 GVMIOUOYBZDZFQ-UHFFFAOYSA-N 376.416 2.666 0 50 GFAA CC(C)N(C(=O)[C@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)C(C)C 170616587 ZTWAKOHPIMUCMT-WMZOPIPTSA-N 389.496 2.511 0 50 GFAA COC(=O)c1ccc(NC(=O)N2CCC[C@H](c3nc(C)no3)C2)c(N(C)C)c1 170612032 CGTVGEGQFDPEMJ-AWEZNQCLSA-N 387.440 2.642 0 50 GFAA O=C(O)C1CCN(S(=O)(=O)N2CCCC[C@@H]2CCc2cccs2)CC1 1506400814 YEUHAZBGCKIYCJ-OAHLLOKOSA-N 386.539 2.577 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=S)Nc2cccc(C(F)(F)F)c2)cc1 5616281 LUZUWORKPFSYNW-UHFFFAOYSA-N 389.424 2.839 0 50 GFAA COc1ccc(C(=O)N[C@@H](c2nnc3n2CCN(CC(C)C)CC3)C(C)C)cc1 11996438 APIXKHXOPAXALK-HXUWFJFHSA-N 399.539 2.928 0 50 GFAA C[C@@H](CCn1cccn1)N1CCC(n2nccc2NC(=O)c2cccnc2)CC1 12299060 ULJDDTOMFMCHGW-KRWDZBQOSA-N 393.495 2.843 0 50 GFAA COCCNC(=O)c1cccc(OC2CCN(C3CCSCC3)CC2)c1 12303820 XJNIPBYYKZUNPD-UHFFFAOYSA-N 378.538 2.802 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@H](NCc1cccs1)C2 14531943 JFMHANWIZNLSJO-AWEZNQCLSA-N 390.578 2.801 0 50 GFAA CN1C(=O)N(Cc2ccccc2)C2(CCN(Cc3ccc(O)cc3)CC2)C1=O 14742251 CTZHMCJJMQSMQR-UHFFFAOYSA-N 379.460 2.821 0 50 GFAA Cc1ccc(CN2CCOC3(CCN(Cc4ncc[nH]4)CC3)CC2=O)cc1F 1857699779 YCSVNNALIUDBBT-UHFFFAOYSA-N 386.471 2.641 0 50 GFAA O=C(c1ccn2nccc2c1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857714537 CRBRPHMNUDSKTR-QFIPXVFZSA-N 389.459 2.828 0 50 GFAA O=C([C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1)N1C[C@H]2CCC[C@H]2C1 1857732884 LLEVGCCGHRAZNN-BBWFWOEESA-N 396.516 2.740 0 50 GFAA Cc1ccccc1OCC(=O)NCc1cnc2c(c1)CN(C(=O)C1(C)CC1)CC2 1875251295 WIUYTWFRPKWNMP-UHFFFAOYSA-N 393.487 2.770 0 50 GFAA Cc1cc(S(N)(=O)=O)ccc1CNC(=O)Cc1c(Cl)cccc1Cl 225567261 HEFGANIGZFRZBK-UHFFFAOYSA-N 387.288 2.808 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1Br 4451110 XGEGNHGCIINXJS-ZDUSSCGKSA-N 382.254 2.906 0 50 GFAA CCCCn1c(-c2ccc(C)cc2)c(C)n2c3c(=O)n(C)c(=O)n(C)c3nc12 4626156 DRCTWFMNXLJDPN-UHFFFAOYSA-N 379.464 2.770 0 50 GFAA Cc1ccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC(C)CC3)n2)cc1 1857797735 HWCGIIKSIDBKRL-QGZVFWFLSA-N 393.491 2.905 0 50 GFAA COc1cccc(N2CCN([C@H]3CC(=O)N(c4ccc(Cl)cc4)C3=O)CC2)c1 19798417 BYKBNSVCPGZRGU-IBGZPJMESA-N 399.878 2.803 0 50 GFAA C=CC(=O)NCCC(=O)N1CCc2ccc(OCc3ccccc3)cc2CC1 2325887865 GOTQRVHJSJWULY-UHFFFAOYSA-N 378.472 2.885 0 50 GFAA COc1cccc(NC(=O)CSc2nc(N)c(-c3ccccc3)c(=O)[nH]2)c1 640426 WEIYMMVJXINANZ-UHFFFAOYSA-N 382.445 2.759 0 50 GFAA COc1ccc(C(=O)NCCn2c(=O)[nH]c3ccccc32)cc1-c1ccccn1 133846836 VEJNZHROXSIVGB-UHFFFAOYSA-N 388.427 2.830 0 50 GFAA O=C(NC[C@H]1CCCO1)c1ccc2c(=O)n(-c3ccccc3)c(S)nc2c1 3630360 CPMUAWDJQQAPHB-OAHLLOKOSA-N 381.457 2.583 0 50 GFAA COc1ccc(C2(C(=O)N3CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C3)CC2)cc1 2356155670 IVITUAKAQWNDOY-XMSQKQJNSA-N 389.492 2.827 0 50 GFAA CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(Br)cc2F)C1 10302293 HESFQDCQAXGBRD-SNVBAGLBSA-N 393.278 2.588 0 50 GFAA O=C(N[C@@H](CO)CC1CCCC1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 225542522 IXFPDSIHTLUUAO-QGZVFWFLSA-N 394.462 2.874 0 50 GFAA CC(C)c1nc2c(n1C)CCN(C(=O)CCNC(=O)c1ccc(F)cc1F)C2 112664417 FECYWUYFNOSRGZ-UHFFFAOYSA-N 390.434 2.527 0 50 GFAA CCc1nc(C)c(CN2CCN(Cc3ccc(OC)c(C)c3)[C@@H](CCO)C2)[nH]1 105903410 BQJGSMKTNGAARS-IBGZPJMESA-N 386.540 2.666 0 50 GFAA CCOc1ccc(C(F)(F)F)cc1NC(=O)NCCCN1CCOCC1 67584217 XZTDVQKVIGTWIE-UHFFFAOYSA-N 375.391 2.948 0 50 GFAA O=C(c1nc(O)nc2ccccc12)N1CCCN(Cc2cccc(F)c2)CC1 1506406905 RZERSLCZPSSEMI-UHFFFAOYSA-N 380.423 2.823 0 50 GFAA CCc1cnc(N2CCN(Cc3cc(OC)ccc3-n3cccn3)CC2)nc1 65386050 UHACOOAOTVLYHQ-UHFFFAOYSA-N 378.480 2.556 0 50 GFAA O=C1N[C@H](C(=O)N2CCOc3c(O)cc(-c4cccc(Cl)c4)cc3C2)CO1 67541181 JKRWOEOLFWBTAV-HNNXBMFYSA-N 388.807 2.542 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@@H](O)c3ccc(OC)cc3)c2C)cc1 252480233 BYTLXUVAPKPQOA-HXUWFJFHSA-N 394.475 2.669 0 50 GFAA C[C@@H]1CN(Cc2ccc(CNC(=O)[C@H]3CCCc4cn[nH]c43)cc2)C[C@@H](C)O1 229975424 GOFWVXNPHPCHLP-QINHECLXSA-N 382.508 2.755 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)c2ccc(OC)c(F)c2C)cn1 328643259 YRRSQCGSEYOSNT-KBXCAEBGSA-N 397.472 2.558 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@@H](O)c2ccc(F)cc2F)n1C 328625544 DFYRTJJSCBLKCD-PKOBYXMFSA-N 377.435 2.924 0 50 GFAA Cn1cc([C@@H]2CN(C(=O)NCc3cccc(-c4cccnc4)c3)CCO2)cn1 363811331 CWJHKKOCNQTVQE-FQEVSTJZSA-N 377.448 2.765 0 50 GFAA Cc1nc[nH]c1CN1CCc2c(c(C(=O)NC3CCCC3)nn2CC(C)C)C1 14747213 SOCAQMOWLVTYHZ-UHFFFAOYSA-N 384.528 2.801 0 50 GFAA CN(Cc1noc(-c2ccccc2)n1)C(=O)c1cn(Cc2ccc(F)cc2)nn1 72147284 SCQVGDOAXLUFKD-UHFFFAOYSA-N 392.394 2.788 0 50 GFAA CC(C)n1cc(S(=O)(=O)N2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)cn1 333181534 PWBQESSHFVMQIV-AWEZNQCLSA-N 395.447 2.834 0 50 GFAA O=C(NC1CCCCC1)[C@@H]1CCCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 32094143 OIRDIEYVSPTORY-GFCCVEGCSA-N 396.417 2.808 0 50 GFAA Fc1ccccc1N1CCN([C@@H]2CCCN(CCn3cc(Cl)cn3)C2)CC1 72172406 UXLGQYKBDHZDRF-GOSISDBHSA-N 391.922 2.962 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@H](CC(=O)NCCCC(C)(C)C)CO2 71776851 ZUEZCYKAWGCWOS-MRXNPFEDSA-N 375.513 2.918 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCc3cnn(C)c3)csc2C1 426574794 SFFBJVYNWDGBNA-UHFFFAOYSA-N 385.493 2.575 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)N[C@H]2COc3ccccc3C2)CC1 193305269 NULWRFDELRSTRZ-GOSISDBHSA-N 381.476 2.921 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)NCc2n[nH]c3c2CCCCC3)CC1 426491593 WIKFVKVIEOIVAH-UHFFFAOYSA-N 382.512 2.804 0 50 GFAA O=C1NCCCN(Cc2nc(-c3ccc(F)cc3)no2)[C@H]1Cc1ccccc1 292954224 KUZGIMPMNDQTPS-SFHVURJKSA-N 380.423 2.809 0 50 GFAA CCNC(=O)N1CCC(NC(=O)c2ccc(-c3ccc(C)nc3N)cc2)CC1 426534139 XVDFKKYOCWDUSP-UHFFFAOYSA-N 381.480 2.563 0 50 GFAA CC1(C)CN(Cc2ccccc2OCCCN2CCOCC2)CC[C@]1(C)O 91645144 TWXOIVBEQCGMLH-QFIPXVFZSA-N 376.541 2.771 0 50 GFAA CC(C)(CNC(=O)c1coc(COc2ccc3c(c2)OCO3)n1)N1CCCC1 91365124 UTPYTCPTCIVBAZ-UHFFFAOYSA-N 387.436 2.587 0 50 GFAA CN(Cc1cccc(OC[C@@H](O)CN2CCOCC2)c1)Cc1ccccc1F 95519960 IQFXOOQTOAVLOL-FQEVSTJZSA-N 388.483 2.530 0 50 GFAA CN(C)Cc1cccc(C(=O)N[C@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)c1 244773717 PFCVRKITMXVSOP-RZUBCFFCSA-N 380.488 2.925 0 50 GFAA COc1cncc([C@@H](NC(=O)c2ccccc2-n2cccn2)[C@H]2C[C@H](O)C2)c1 244874678 XFMRNCPMBLADPW-UVFQYZLESA-N 378.432 2.518 0 50 GFAA Cc1nc(O)c2c(n1)CCN(Cc1ccc3c4c(cccc14)C(=O)OC3)CC2 253536483 SJAPEVBRKNEFTH-UHFFFAOYSA-N 375.428 2.915 0 50 GFAA CC(=O)N1CCN(Cc2ccc3c(c2)CN(C(=O)CCC(C)C)CCO3)CC1 299788533 USBQFFZRRSCGET-UHFFFAOYSA-N 387.524 2.508 0 50 GFAA CNC[C@H]1CCCN(C(=O)COc2ccc(Br)cc2Cl)C1 269117715 VYKBBXAGGPXWGV-LLVKDONJSA-N 375.694 2.939 0 50 GFAA COC(=O)c1c(CNC(=O)c2cc(Cl)nc(Cl)c2)nn2c1CCCC2 1875370204 FVGNWDDKDWNWQE-UHFFFAOYSA-N 383.235 2.638 0 50 GFAA COC(=O)[C@@H]1CCCC[C@]1(C)NCC(=O)NC(=O)Nc1cc(C)ccc1C 1875308936 JBQGNHSWHXGREP-YWZLYKJASA-N 375.469 2.663 0 50 GFAA CCn1nc2c(c1C(=O)N(C)Cc1nnc3n1CCCCC3)C[C@H](C)O[C@@H]2C 1875314132 IXCSEUIYSOMUIR-UONOGXRCSA-N 386.500 2.515 0 50 GFAA O=C(NCCN(C(=O)c1cccc2nccn12)C1CC1)[C@@H]1CCCC(F)(F)C1 1875331667 RYWAJXHONORBNB-CQSZACIVSA-N 390.434 2.881 0 50 GFAA CC(C)n1cc2c(n1)[C@H](O)CC1(CCN(C(=O)Cc3ccsc3)CC1)O2 1875394360 GWBBGLFESNNWPD-OAHLLOKOSA-N 375.494 2.945 0 50 GFAA Cc1cc(F)ccc1-n1nc(CC2CCC2)nc1-c1cnn2c1OC[C@@H](O)C2 1875331029 MAQLTMWIELSMLD-HNNXBMFYSA-N 383.427 2.674 0 50 GFAA O=C(NC[C@H](O)CCc1ccccc1)N[C@@H]1Cc2n[nH]cc2[C@H](C(F)(F)F)C1 1875276635 KHWTVYWLGGZDAI-SQWLQELKSA-N 396.413 2.663 0 50 GFAA O=C(N=c1ccn(C[C@H]2CCOC2)[nH]1)Nc1cc(F)c(OC(F)F)cc1F 1875260020 UINGRZOOFLRDPU-SECBINFHSA-N 388.321 2.865 0 50 GFAA Cc1ncc2n1CC[C@@H](C(=O)NCc1noc(-c3ccc(Cl)cc3F)n1)C2 885703030 MBEMAWHTIQZIKG-LLVKDONJSA-N 389.818 2.913 0 50 GFAA Cn1cc(N2CCC[C@@H](NC(=O)NC3(Cc4cccc(F)c4)CCC3)C2)cn1 185527289 LQCOPICSALYTIJ-GOSISDBHSA-N 385.487 2.993 0 50 GFAA Cc1nc([C@H]2CCCN2C(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cs1 187133076 QWVGYMPEPOFZRF-MRXNPFEDSA-N 399.520 2.940 0 50 GFAA O[C@@H](CN1CCN(Cc2nc(-c3cccs3)no2)CC1)c1ccccc1F 193781019 LNESNDKHSXQLDC-INIZCTEOSA-N 388.468 2.788 0 50 GFAA CC(=O)N[C@H](Nc1sc2c(c1C(N)=O)CCCC2)C(Cl)(Cl)Cl 677380 PSEFISGMWKEZPY-GFCCVEGCSA-N 384.716 2.970 0 50 GFAA CCc1oc(C(=O)N2C[C@H](O)[C@H](Cc3ccncc3)C2)cc1CN1CCCC1 1529180570 KKKUCSQIZWCGFA-MJGOQNOKSA-N 383.492 2.508 0 50 GFAA COc1cc(C)ccc1OCCN1CC[C@H](O)[C@](CO)(Cc2ccccc2)C1 1529167689 PZFPYODTEQAAQJ-XZOQPEGZSA-N 385.504 2.670 0 50 GFAA COC(=O)c1cc(NC(=O)[C@@]23CC[C@@](C)(C(=O)C2)C3(C)C)cc(C(=O)OC)c1 702853 VFSJTKVAJKMBHW-LEWJYISDSA-N 387.432 2.984 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)CN(C)Cc3ccncc3)CC1)OCC2 1704339223 PDILLDWIRZDMIJ-UHFFFAOYSA-N 395.503 2.613 0 50 GFAA Cc1ccc2c(c1)c1c(n2C[C@@H](O)Cn2c(C)cc(C)nc2=O)C(=O)CCC1 795443 XYQKRXJUPAPPOL-INIZCTEOSA-N 379.460 2.703 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(C(=O)c3ccc(-c4noc(C5CC5)n4)cc3)CCN21 1616074162 XCFJWZFXYJLCFN-MOPGFXCFSA-N 396.491 2.939 0 50 GFAA COc1ccc(NC(=O)N2CCCN(C(=O)Cc3cccnc3)CC2)c(C)c1 1775984353 QABPNZBIWXJUMQ-UHFFFAOYSA-N 382.464 2.708 0 50 GFAA Cc1cc(OCC(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)ccc1Cl 5163274 ORCVDDOPLQDAAY-AWEZNQCLSA-N 397.880 2.836 0 50 GFAA COc1ccc(-c2nnnn2C)cc1S(=O)(=O)Nc1ccc(C)c(Cl)c1 5942648 ACXIZGDAIQUEHB-UHFFFAOYSA-N 393.856 2.648 0 50 GFAA Cc1c(C(=O)N(C)[C@@H]2CCOC2)sc2ncnc(NCc3ccccn3)c12 11913377 FLDIHRRNVNSXGC-CQSZACIVSA-N 383.477 2.868 0 50 GFAA CC[C@H](O)C1CCN(Cc2nc(-c3ccc(OC)c(OC)c3OC)no2)CC1 11934827 BVAPORCNPDHGCY-HNNXBMFYSA-N 391.468 2.745 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(N(C)CCn3ccnc3C)nc2)CCN1C(C)C 12305666 UITFAGKWTVGJLV-HXUWFJFHSA-N 398.555 2.668 0 50 GFAA O=C(NCC1(N2CCCCC2)CCCC1)c1cn(Cc2ccc(F)cc2)nn1 12577684 VVEBMYOSAHUFAY-UHFFFAOYSA-N 385.487 2.994 0 50 GFAA COc1cccc(CN[C@@H]2CCc3c(c(C(=O)N(C)C)nn3CC(C)C)C2)c1 14533715 LEKSIODLHVIVRJ-QGZVFWFLSA-N 384.524 2.897 0 50 GFAA O[C@@H](COc1cccc(CN2CCc3[nH]ncc3C2)c1)CN1CCCCCC1 15065624 KGDUMMXTFFBKGJ-HXUWFJFHSA-N 384.524 2.584 0 50 GFAA COc1ccc(CCN[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC 18144059 JZYXCOZMMBSEMN-MRXNPFEDSA-N 388.851 2.821 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)Nc2ccc(F)cc2F)cc1 4978136 FQKSIAVCQGHVKJ-UHFFFAOYSA-N 384.404 2.669 0 50 GFAA COC(C)(C)C(=O)N1CCC2(CC1)CN(Cc1ccc(C)s1)C[C@H]2C(=O)O 1857699636 XHZFHNFISFMUSO-INIZCTEOSA-N 394.537 2.607 0 50 GFAA Cc1nc(N2CCC[C@@H](O)C2)c2c(n1)C1(CC2)CCN(Cc2cccnc2)CC1 1857702858 RBBJTCTTWVJKDS-LJQANCHMSA-N 393.535 2.621 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857709292 PJBKGFURLUHAOC-HSZRJFAPSA-N 393.487 2.601 0 50 GFAA CN(CC(=O)Nc1ccc(Br)cc1)C[C@@H]1CCn2ccnc2C1 225671966 SXFMMNLCEIYSLS-CYBMUJFWSA-N 377.286 2.779 0 50 GFAA CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc(Br)nc2)CC1 746587891 FNFURISCGJWOMX-UHFFFAOYSA-N 384.274 2.973 0 50 GFAA O=C1NC(=O)[C@](Cc2ccccc2)(C2CCN(C(=O)CC3=CCCCC3)CC2)N1 12124023 HLYUSAKIWGBLMW-QHCPKHFHSA-N 395.503 2.936 0 50 GFAA Cn1nccc1[C@H](CO)NC(=O)c1ccc(Br)c(C(F)(F)F)c1 458149787 HAJYUZXAXUVADS-NSHDSACASA-N 392.175 2.665 0 50 GFAA O=C(Nc1cc(-c2ccc(Cl)cc2)nn1CCO)[C@@H]1CCCc2[nH]ncc21 135303579 XYTBFLAPNVBWPD-CQSZACIVSA-N 385.855 2.978 0 50 GFAA CC(C)(C(N)=O)c1ccc(NC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)cc1 155350851 HYEJAMHAUGXAIK-KRWDZBQOSA-N 387.386 2.859 0 50 GFAA COc1ccc(-c2c(C)[nH][nH]c2=NC(=O)[C@H](Cc2ccccc2)N(C)C)cc1 2100534726 WCIJKSKAHIYCFF-IBGZPJMESA-N 378.476 2.927 0 50 GFAA CCCN1C[C@H](c2nc(-c3ccc(N(C)C)cc3)nn2[C@@H]2CCOC2)CC1=O 2325839647 AASIBVVJPGEZER-SJLPKXTDSA-N 383.496 2.698 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)Cc2ccccc2F)cc1 780785 ANANDBWWIHJSJP-UHFFFAOYSA-N 390.480 2.947 0 50 GFAA COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2-c2ccccc2OC)cc1 1140039 FTIHLWIRRZONSR-UHFFFAOYSA-N 391.427 2.712 0 50 GFAA CC(=O)c1ccc(NC(=S)NC(=O)c2c(Br)c(C)nn2C)cc1 2792955 DQWLYYIURCBZHC-UHFFFAOYSA-N 395.282 2.820 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)[C@H]1CCCC[C@H]1C(=O)O 4559279 WKLJTSBXAWSUKP-DLBZAZTESA-N 394.493 2.691 0 50 GFAA C[S@](=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 4899537 CEHRSUBRZOGRSW-XRHLQHRESA-N 387.457 2.747 0 50 GFAA biogenic,in-vitro Cc1nn(Cc2ccc(C(=O)N3N=CC[C@@]3(O)C(F)(F)F)o2)c(C)c1Cl 6526487 VGGRDOAJOHYTEM-CQSZACIVSA-N 390.749 2.877 0 50 GFAA COc1cc(N2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)ncn1 11842075 MTZYZSKUYPOTHQ-HXUWFJFHSA-N 388.418 2.783 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)C3=C(C)OCCO3)CC2)c1 11878878 OJBXJTMBHOFIQS-UHFFFAOYSA-N 388.464 2.931 0 50 GFAA Cn1cc(/C=C/C(=O)N2CC[C@]3(CCCN(CCc4ccccc4)C3)C2)cn1 12432009 CKSACKLLTUWYKZ-YVSHKSEASA-N 378.520 2.991 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H](NC(=O)CCC(F)(F)F)C1 15077467 GWJSZQOPXSCDLV-ZDUSSCGKSA-N 386.418 2.785 0 50 GFAA O=C1C(=O)N(CN2CCN(Cc3c(F)cccc3Cl)CC2)c2ccccc21 20045213 BYTSIDZYNVTWPJ-UHFFFAOYSA-N 387.842 2.784 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3ccc(F)cc3F)CC2)C1 67855035 DYWQNLSUPCDUCG-MRXNPFEDSA-N 377.479 2.920 0 50 GFAA COc1ccccc1-c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 67885182 YYXOUOBHJJGDRG-UHFFFAOYSA-N 389.459 2.900 0 50 GFAA Cc1cc(C(=O)N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)cs1 71763623 JHQZNRMNXKPLPI-HNNXBMFYSA-N 375.538 2.652 0 50 GFAA COc1cccc(CN2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)c1 71764800 HENSLMWPCSPDCQ-HXUWFJFHSA-N 385.552 2.994 0 50 GFAA COc1cccc2ccc(-c3nccn3-c3ccc(S(N)(=O)=O)cc3)nc12 71774492 CQGQEGDKXUIDGG-UHFFFAOYSA-N 380.429 2.744 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)[C@@H]1CC(=O)N(C)c2ccccc21 72454812 JCYLNVSRXQPIOT-MRXNPFEDSA-N 376.416 2.845 0 50 GFAA FC(F)(F)c1cccc(-c2noc(-c3ccc(NCc4nnn[nH]4)nc3)n2)c1 72481550 OQHWTBZLPZZFJU-UHFFFAOYSA-N 388.313 2.943 0 50 GFAA CCC[C@@]1(C(=O)O)CCCN(C(=O)c2ccc(NS(=O)(=O)CC)cc2)C1 91451999 GOXWLYMKDXWOTB-GOSISDBHSA-N 382.482 2.555 0 50 GFAA CC(=O)c1cccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)c1 91645229 YHGKADBCBINKBQ-OXJNMPFZSA-N 377.444 2.661 0 50 GFAA O=C(NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1ccc2[nH]cnc2c1 91680215 GKVYHPALWFGDLD-UHFFFAOYSA-N 378.480 2.838 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91831180 FLUIBHARBUMDAB-UHFFFAOYSA-N 395.507 2.559 0 50 GFAA COc1ccc(-c2cc(C(=O)NCc3nc(C)c4c(n3)CCCC4)[nH]n2)cc1 91907212 RIPVHTQDNFZERZ-UHFFFAOYSA-N 377.448 2.993 0 50 GFAA CCN1CCN(C[C@H](O)COc2cccc(CN3CCCCC34CC4)c2)CC1 95506895 AMQCANIKDRLHRQ-NRFANRHFSA-N 387.568 2.582 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCC2)cc1)N[C@]1(CO)CCc2ccccc21 128713907 KWMDBVAGAQRXHR-QFIPXVFZSA-N 379.460 2.878 0 50 GFAA O[C@@H](COc1c(Cl)cccc1Cl)CN1CCOC2(CCOCC2)C1 135585180 CKKFZGLJUQLMBH-CYBMUJFWSA-N 376.280 2.615 0 50 GFAA Cc1c(NC(=O)[C@H](C)N2CCc3ccccc32)cccc1C(=O)N1CCOCC1 141023396 IPNNJFQOYBXNKT-KRWDZBQOSA-N 393.487 2.857 0 50 GFAA CCN(C(=O)[C@@H](C)N(C)C1CCN(CCn2cccn2)CC1)C1CCCCC1 155114708 XYGKTYKRFKUPHO-LJQANCHMSA-N 389.588 2.849 0 50 GFAA C[C@H](O)CN(C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCS(=O)(=O)CC1 170091137 KAVVFQCOLNZZAT-JTQLQIEISA-N 395.308 2.785 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@@H](c1ccccc1)[C@@H]1CCCO1 170680072 FIKKBHRRTJQLKI-OALUTQOASA-N 377.448 2.987 0 50 GFAA C[C@@H](NS(=O)(=O)c1cccc2cnccc12)C1(N2CCOCC2)CCCC1 178132495 ITYZBLUKSNEZOF-MRXNPFEDSA-N 389.521 2.547 0 50 GFAA O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)N1CCCCCCC1 185914087 ANHCJETUKMQUQB-UHFFFAOYSA-N 383.489 2.841 0 50 GFAA CCN1CCC(N(c2ccccc2)S(=O)(=O)c2cnn(CC(F)F)c2)CC1 191975294 YZRZKWKGDLPLIQ-UHFFFAOYSA-N 398.479 2.828 0 50 GFAA CN1CCN(CC[C@H]2CCCCN2C(=O)CCc2ccc(F)cc2F)CC1 223144094 LEQLHCVLJHHNHH-LJQANCHMSA-N 379.495 2.916 0 50 GFAA Cc1ccc(CN2C[C@@H](C(=O)N[C@@H](CC(=O)O)c3cccs3)CC2=O)cc1 237727103 URSCFUGANVEQRC-HOTGVXAUSA-N 386.473 2.737 0 50 GFAA CC[C@@H](C)[C@@H](CO)NC(=O)c1cn(Cc2ccncc2)c(=O)c2ccccc12 253408539 KVCQKFRMEGATEL-FOIQADDNSA-N 379.460 2.582 0 50 GFAA biogenic O=C(CC[C@@H]1NC(=O)N(c2cccc3ccccc23)C1=O)NCc1ccccn1 253411050 OCPFYKAAGCTCSY-SFHVURJKSA-N 388.427 2.756 0 50 GFAA Cc1ccc2[nH]cc([C@H](C(=O)O)N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 263585996 ORKNERHMCZSBPF-VTJXTGGHSA-N 377.444 2.883 0 50 GFAA biogenic CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N[C@@H]1c2ccccc2C[C@H]1O 274836974 NNKVBJMSUCZBSX-IEBWSBKVSA-N 383.448 2.567 0 50 GFAA Cc1ccc(OCc2nc(CN3CCOC[C@@H]3c3ncnn3C)cs2)cc1 284835335 QQKQULANQWJVDS-QGZVFWFLSA-N 385.493 2.733 0 50 GFAA O=S(=O)(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 285180523 BQPLCJBDKCLNDM-FGTMMUONSA-N 378.881 2.928 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CC[C@H](n2cc(Cl)cn2)C1 291000437 QZLLQULRBFNNEF-ZWKOTPCHSA-N 386.883 2.544 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)c1cccc(-c2cc(O)ncn2)c1 299800467 WUWAZDPGISPNON-UHFFFAOYSA-N 378.436 2.876 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N1CC[C@@H](c2ccccc2)[C@@H](CO)C1 376577163 ANAIEWWHSLNURL-QUCCMNQESA-N 378.476 2.684 0 50 GFAA O=C([C@H](F)C(F)(F)F)N1CCC(O)(c2scnc2Br)CC1 378139515 XREPOISJVAVFQV-LURJTMIESA-N 391.184 2.616 0 50 GFAA CCN(CC)C(=O)c1sc2ncn(CCc3nccs3)c(=O)c2c1C 584884357 UYVPILKOVYCKNT-UHFFFAOYSA-N 376.507 2.948 0 50 GFAA COc1ccc(NC(=O)c2cccc(Cn3cccn3)c2)cc1C(=O)N(C)C 824704455 QXBMNYFETSNUBC-UHFFFAOYSA-N 378.432 2.894 0 50 GFAA Cc1ccn(CC(=O)NC[C@H]2CCCN(Cc3cc(-c4ccccc4)no3)C2)n1 827860863 MXEHVKGXTMLJOJ-GOSISDBHSA-N 393.491 2.875 0 50 GFAA CN(Cc1cc(=O)n2nc(C3CC3)sc2n1)C[C@@H]1CCN(c2ccccc2)C1 1506395075 BCQRPDAYBXDGEF-HNNXBMFYSA-N 395.532 2.987 0 50 GFAA COc1ccc2[nH]cc(C(=O)N3CCC[C@@H](C(=O)c4ccccn4)C3)c(=O)c2c1 1506425916 SMZIZHVZDAJHRW-CQSZACIVSA-N 391.427 2.667 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)c2ccc(CSc3nc[nH]n3)o2)C1 1506431395 IVWOANHEXCDGIM-ZDUSSCGKSA-N 397.460 2.820 0 50 GFAA CCCN1CC[C@@H](NC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704309010 VBTPKZDQANJFPV-CQSZACIVSA-N 390.459 2.769 0 50 GFAA COc1cc(-c2onc(N[C@@H](C(=O)N(C)C)C(C)C)c2C(=O)O)ccc1F 1704314454 QWYMKYVOTPZUHH-CQSZACIVSA-N 379.388 2.712 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCOc2ccccc2C1 1857698918 AYDMYIPTWDOUHI-UHFFFAOYSA-N 384.501 2.934 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCC2(c3ccccc3)CCN(C)CC2)C[C@H]1N 1857716148 YSBDRLGXWHZDGS-CEWLAPEOSA-N 387.568 2.689 0 50 GFAA O=C(O)c1cnc([C@H]2CCCN2C[C@@H](O)COCc2ccc(Cl)cc2)nc1 1875282897 XLJUGIGBLISNQW-IAGOWNOFSA-N 391.855 2.543 0 50 GFAA O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CC[C@](O)(c2cccc(C(F)(F)F)c2)C1 1875288812 FEEUPQAIISAMFR-CRAIPNDOSA-N 394.397 2.589 0 50 GFAA COC(=O)C1(C2CCN(C(=O)/C(=C\c3ccccc3)NC(C)=O)CC2)CCC1 1875298087 NXTOTKYGJYOTBQ-XDJHFCHBSA-N 384.476 2.746 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@H]([C@@H]3CCCCN3c3ncc(F)cn3)C2)n1 1875312498 MZQWPSSIJDGHNP-YJBOKZPZSA-N 386.475 2.743 0 50 GFAA O[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1NCc1cccc2c1OCCCO2 1875399404 BGTIYLSFBXULHR-IAOVAPTHSA-N 377.872 2.627 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3F)CC2)cc1 2325889635 BICLGELMTYEOCA-UHFFFAOYSA-N 395.434 2.573 0 50 GFAA CN(C(=O)c1ccc(N2CCCC2)c(Cl)c1)[C@@H]1C[C@@H]2CNC(=O)C[C@@H]2C1 2356157759 PMOBMOKSYHGYCN-XHSDSOJGSA-N 375.900 2.927 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccoc1)NCC1(c2ccccc2)CCCC1 55225960 UQNYMPRDHZPNCH-FQEVSTJZSA-N 395.503 2.598 0 50 GFAA CC[C@@H](CO)N(Cc1ccsc1)C(=O)c1ccc(Cn2nnnc2C)cc1 55368839 GWFNYWFKHCFWIX-SFHVURJKSA-N 385.493 2.505 0 50 GFAA C[C@H]1CCCN(c2ccc(C(N)=O)cc2NC(=O)c2c[nH]c(=O)c(Cl)c2)C1 55099847 KJXLMCAJMONHKM-NSHDSACASA-N 388.855 2.616 0 50 GFAA NC(=O)CCN(Cc1ccccc1)C[C@@H](O)CO[C@H]1CCCc2ccccc21 247710670 JAYVWTVWLVAGBS-IRLDBZIGSA-N 382.504 2.819 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@H]2CCCN(C(=O)c3c[nH]c(=O)cc3O)C2)cc1 67834354 YROXXADKBZTJCE-HNNXBMFYSA-N 378.432 2.799 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)C1CCN(C(=O)c2ccccn2)CC1 172860860 OXNUCWLOEJHHOZ-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA COc1ccccc1CN1CC=C(c2cnn([C@@H]3CCS(=O)(=O)C3)c2)CC1 67872706 SJEOESGFSZSCOF-LJQANCHMSA-N 387.505 2.541 0 50 GFAA Cn1nc(C(F)(F)F)c(CO)c1S(=O)(=O)c1ccc(Br)cc1 1391465 RCISSSPINXEHIP-UHFFFAOYSA-N 399.188 2.527 0 50 GFAA Cc1ccc2nc(CN(C)C(=O)[C@H]3CCCN(C4CCN(C)CC4)C3)[nH]c2c1 71767861 KZQKMISQMDLYPU-KRWDZBQOSA-N 383.540 2.636 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@@H](CC(=O)O)c1cccs1 236584240 NGFUGRNZFWRUQL-IRXDYDNUSA-N 386.473 2.916 0 50 GFAA Cc1cc(C)c2c(OCC(=O)NC[C@H](N)c3ccc(C(C)C)cc3)nn(C)c2n1 236769123 HNIUPPHLJUQYJP-SFHVURJKSA-N 395.507 2.904 0 50 GFAA CC1CCN(C[C@H]2CCCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)CC1 363474514 NDODYCUAEJMOFZ-HXUWFJFHSA-N 396.539 2.921 0 50 GFAA NC(=O)[C@H](NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1 363830077 WZEWTTJUHHVKKS-FXAWDEMLSA-N 398.482 2.564 0 50 GFAA O=C(Nc1ccc(C(=O)N[C@@H]2CCc3[nH]ncc3C2)cc1)OCC(F)(F)F 173446645 JILYSJWLBZUUSG-CYBMUJFWSA-N 382.342 2.808 0 50 GFAA CCc1noc(C)c1C(=O)N1CCCn2nc([C@@H](O)c3ccccc3)cc2C1 219045742 GTEUOLJXKBDZKE-FQEVSTJZSA-N 380.448 2.870 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)NCc2cc(Cl)ccc2Cl)CCC(=O)N1 219243410 XJAXVHLGQRAIGD-QGZVFWFLSA-N 387.263 2.903 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CCn3cccc3C2)nc2cccnc21 77319021 PAXSSQNPAHWNLP-INIZCTEOSA-N 381.480 2.805 0 50 GFAA Cc1cccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c1C 71738897 WRLLAVOJISBSBR-GOSISDBHSA-N 383.536 2.899 0 50 GFAA CN1C(=O)[C@](CC(=O)NCC2CCNCC2)(Cc2ccccc2)c2ccccc21 71404027 KHLCSWFBBZTFIZ-DEOSSOPVSA-N 391.515 2.649 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)N(C)C[C@H]2CCCC[C@@H]2O)C1 245973605 OIDNBQZLAYUGRP-LMMKCTJWSA-N 375.513 2.714 0 50 GFAA COc1cccc(N2C[C@H](Cc3ccccc3)N(C(=O)c3cc[nH]n3)CC2=O)c1 82127287 AQDZQQQNSBHRLH-SFHVURJKSA-N 390.443 2.519 0 50 GFAA CCN1CCC[C@@H](NC(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)C1 177100717 NUOZTNRIDOYINY-CQSZACIVSA-N 378.519 2.795 0 50 GFAA Cn1c(=O)c(C(=O)N2CCC([C@@H](O)Cc3ccccc3)CC2)cc2ccccc21 82099693 WSCULNXGVHKMQU-QFIPXVFZSA-N 390.483 2.994 0 50 GFAA CC(C)N1CCC[C@@H](CNC(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)C1 291112947 XDPXYCQWIJHKGI-UGKGYDQZSA-N 391.531 2.883 0 50 GFAA CNC(=O)CCN(C)C(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCCCC1 426544258 BVPPCTGJYWXSLW-KRWDZBQOSA-N 380.920 2.645 0 50 GFAA Cc1cccc(-c2noc(CCCC(=O)N3CCC(n4cnnc4)CC3)n2)c1 426479109 QJGZDNGMLXRTIP-UHFFFAOYSA-N 380.452 2.823 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccc(Cl)cc3O)C2)CCC1=O 91325515 JPEBCQXDQHCBSL-LJQANCHMSA-N 380.872 2.537 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1n[nH]c(N)c1-c1ccccc1)C2 95530728 YYLKXGYVYWOPGZ-CYBMUJFWSA-N 378.432 2.649 0 50 GFAA CSCCC(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91650580 CAPIEFOYYDSPDO-UHFFFAOYSA-N 375.538 2.608 0 50 GFAA CN(C)CCN1CC2(CCC1=O)CCN(C(=O)c1ccc3cc[nH]c3c1)CC2 95389146 PXFLWILKJCVATR-UHFFFAOYSA-N 382.508 2.574 0 50 GFAA CSCC(=O)N1CCC2(CCN(Cc3cccc(F)c3)CC2)[C@H](CO)C1 97660671 JJRXJLSVJDOGIR-KRWDZBQOSA-N 380.529 2.612 0 50 GFAA COc1cc(CN2CC(c3cccnc3)C2)ccc1OC[C@@H](O)CN1CCCC1 95516899 WUZSZEWWWNBSGW-NRFANRHFSA-N 397.519 2.525 0 50 GFAA Nc1nnc(CNC(=O)C[C@H](c2ccccc2)c2ccc3c(c2)OCO3)s1 95529075 OIYFNCPSGBVIQO-CQSZACIVSA-N 382.445 2.687 0 50 GFAA O=C1CC[C@@]2(CCCN(S(=O)(=O)Cc3ccc(F)cc3)C2)CN1C1CC1 91964952 JYKGTGGVNUDRPE-LJQANCHMSA-N 380.485 2.523 0 50 GFAA O=C(NCCn1ccc2c(Cl)cccc21)[C@@H](c1ccccc1)n1cnnn1 252492880 MWQGBHLNDVZVNR-GOSISDBHSA-N 380.839 2.687 0 50 GFAA COc1ccc(NC(=O)CN2CCOc3ccc(CO)cc3C2)cc1Cl 252500504 SWZBXXPJAGHWBY-UHFFFAOYSA-N 376.840 2.674 0 50 GFAA COC(=O)c1cn(CCNc2ccnc3cc(Cl)ccc23)cc2c(=O)[nH]nc1-2 263586955 AEKOKIDHPXSINS-UHFFFAOYSA-N 397.822 2.777 0 50 GFAA Cc1cc(-c2ccc(C(=O)N[C@H]3COC[C@@H]3N3CCCC3)cc2)c(O)nc1C 534671685 RUZRBUKJMFIUCP-PMACEKPBSA-N 381.476 2.664 0 50 GFAA CN1CCN(c2cccc(NC(=O)N3CCC[C@H](c4ccncn4)C3)c2)C1=O 299786362 JWYKXZDGWFCZTL-HNNXBMFYSA-N 380.452 2.760 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1ccc(O)cc1)N(C(=O)c1ccnn1C)CC2 824619859 YQTJOWQYQLFWMV-NRFANRHFSA-N 393.443 2.931 0 50 GFAA O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(OCC(=O)N2CCOCC2)cc1 827807386 ITQIBBAKTKRLDS-SFHVURJKSA-N 394.471 2.983 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)Nc1cccc(-c3nncn3C)c1C)CC(=O)N2 824751153 WIGXHCZSFNKKIN-INIZCTEOSA-N 391.431 2.864 0 50 GFAA C[C@@H](CN1CCc2ccccc2C1)NC(=O)COCc1nc2ccc(F)cc2[nH]1 821789263 OQWKETYZLBECQU-HNNXBMFYSA-N 396.466 2.782 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)Cn2cnc3ccccc3c2=O)cc1 827861525 QXHPJAWVHMEQEY-AWEZNQCLSA-N 376.416 2.551 0 50 GFAA CCc1nc(C)cc(N2CC[C@H]([C@@H](C)NC(=O)c3cccc4[nH]ncc34)C2)n1 1875358287 QGJFZSVOIJSPNZ-CABCVRRESA-N 378.480 2.869 0 50 GFAA C[C@H](NC(=O)N1CC[C@H](C)S(=O)(=O)CC1)c1ncc(-c2ccc(F)cc2)o1 1875301320 FCTUORUQABAOHP-STQMWFEESA-N 395.456 2.760 0 50 GFAA COC[C@]1(C)COCCN1C(=O)c1ccn(-c2ccccc2C(F)(F)F)n1 1875311913 DKWWXMXBWJEUDL-QGZVFWFLSA-N 383.370 2.769 0 50 GFAA C[C@H]1Cc2ccccc2CN1C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 1875260389 LSQPEEAFZFSDQN-YOEHRIQHSA-N 378.428 2.742 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)c3ccc(C(N)=O)c(Cl)c3)cn2)C[C@@H](C)O1 1875280439 JMBYYZHXAZHMKC-VXGBXAGGSA-N 388.855 2.700 0 50 GFAA CCN(Cc1nc(-c2cccc(C)c2)no1)C(=O)c1cccc(-n2cnnc2)n1 952977630 VOFYODUZDJMDHY-UHFFFAOYSA-N 389.419 2.683 0 50 GFAA COc1cccc(SCC(=O)N2CCCO[C@@H](CN3CCCCC3)C2)c1 952971593 HMPVHVVAHQFRIU-SFHVURJKSA-N 378.538 2.891 0 50 GFAA Cc1cc(C)n(CC(=O)NC[C@H]2CCCN(c3ncc(Cl)cc3F)C2)n1 952982016 UYEHAXPHHRPQSU-CQSZACIVSA-N 379.867 2.720 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(CC(C)C)[C@@H](CCO)C2)c(Cl)cc1F 952984054 NGOBQFBNYVCKPA-AWEZNQCLSA-N 392.924 2.501 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565505528 RYALBZUOZXEPFI-PBHICJAKSA-N 384.911 2.777 0 50 GFAA O=C1O[C@H]2CN(Cc3ccccc3OC(F)F)C[C@H]2N1Cc1ccccn1 1565508303 FQMCBTJWBAIFCR-WBVHZDCISA-N 375.375 2.888 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N[C@H]3CCCO[C@@H]3c3nccn3C)c2)no1 275542473 OFPDADGNYCMIKS-HOTGVXAUSA-N 382.424 2.820 0 50 GFAA c1ccc(-c2noc(CCc3nnc(-c4ccc5c(c4)OCCO5)o3)n2)nc1 1324031656 BDYGTGZCQLLBPD-UHFFFAOYSA-N 377.360 2.738 0 50 GFAA O=C1COc2cc(N[C@@H]3CCCN(Cc4ccc(F)cc4F)C3=O)ccc2N1 189785258 AXUWJPDBBIBPJJ-QGZVFWFLSA-N 387.386 2.899 0 50 GFAA O=C(c1cccs1)[C@@H]1CCCN(c2ccc(C(=O)N3CCOCC3)cn2)C1 1529142254 IQKGRRTVFGUVJK-MRXNPFEDSA-N 385.489 2.715 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)c2)n1 1704330884 HXJSEELQJCQTNX-UHFFFAOYSA-N 380.496 2.725 0 50 GFAA COc1ccc(OC)c(N(CC(=O)Nc2ccccc2Cl)S(C)(=O)=O)c1 1170533 QBQROHIJSBXRCD-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CC(C)CN1C[C@@H]2CN(CCS(C)(=O)=O)C[C@]2(CCc2ccccc2)C1 1772806223 ABHJRBQEFJVQJU-LEWJYISDSA-N 378.582 2.554 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cnc[nH]4)C[C@@H]2CN(c2nncs2)C3)cc1 1772808837 CFLLWDFVRSXYCB-YLJYHZDGSA-N 380.521 2.832 0 50 GFAA COc1cc(CNCCC(C)C)ccc1OC[C@H](O)CN1CCSCC1 11879555 UJGFXHDMQCCYMU-GOSISDBHSA-N 382.570 2.619 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N1CCC(c2[nH]ncc2-c2ccccc2)CC1 12338217 RLKJHMCANGGFNU-UHFFFAOYSA-N 399.520 2.995 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@]1(O)CN1CCC(N2CCCC2)CC1 12440539 YISFJXJZZOWFPJ-QHCPKHFHSA-N 391.600 2.871 0 50 GFAA Cc1[nH]cnc1CN1CC(=O)N(CC(C)C)C[C@@H](OCc2ccccc2F)C1 14742800 ZRJNUKCETAMSHN-SFHVURJKSA-N 388.487 2.743 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)N1CCN(c2ccccc2)CC1 6702007 IMVUPSUNSIJJFP-UHFFFAOYSA-N 376.460 2.920 0 50 GFAA COc1cc(-c2nccn2[C@@H]2CCN(C)C2=O)ccc1OCCN1CCCCC1 1857667317 QBEQGRGIKBPCHA-GOSISDBHSA-N 398.507 2.827 0 50 GFAA O=C(c1cccn1C1CC1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857729036 RYWPWRLPIZCRAC-KNKQGSTJSA-N 377.444 2.738 0 50 GFAA CCCOc1c(Br)cc(CNCC2(O)CCOCC2)cc1OC 236989163 BXPMFVRQZTWGIB-UHFFFAOYSA-N 388.302 2.878 0 50 GFAA O=C(NC[C@H]1CN(C2CC2)CCO1)c1cc2ccc(OC(F)(F)F)cc2[nH]1 127253190 JYAGZCQZDWLZBZ-AWEZNQCLSA-N 383.370 2.660 0 50 GFAA CCN(CCNC(=O)N1CCC(Nc2cccnn2)CC1)c1cccc(C)c1 152963973 FOYRELPNQCVUFE-UHFFFAOYSA-N 382.512 2.897 0 50 GFAA Cc1ccc2occ(CC(=O)N3C[C@@H](C(=O)O)C[C@@H](c4cnn(C)c4)C3)c2c1 902496859 YJPFKVVCGDJLNC-CABCVRRESA-N 381.432 2.734 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCCN(Cc3ccccc3)CC2)cc1C(=O)O 237833895 BBZDPSBRHWEKAR-UHFFFAOYSA-N 388.489 2.590 0 50 GFAA COc1cccc([C@@H](CN)NC(=O)c2ccn3c(Br)cnc3c2)c1 2325859267 SYODTBHRHDWPKV-CQSZACIVSA-N 389.253 2.535 0 50 GFAA N=c1cc[nH]cc1-c1cn([C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)nn1 2325860082 WXMWVIPZRXOLRB-INIZCTEOSA-N 388.353 2.749 0 50 GFAA Cc1c(NC(=O)c2ccco2)cccc1C(=O)NN1C(=O)c2ccccc2C1=O 1143646 YSSZBDOQQOCAAA-UHFFFAOYSA-N 389.367 2.781 0 50 GFAA Cc1cc(C)c(NS(=O)(=O)c2ccc(NC(=O)/C=C/C(=O)O)cc2)c(C)c1 2986646 WGVQQWMVKFQCFA-CMDGGOBGSA-N 388.445 2.992 0 50 GFAA COCCN(CCOC)C(=O)/C(=C\c1ccccc1)NC(=O)c1ccccc1 4802015 DNPLMLRPSFIEOT-LVZFUZTISA-N 382.460 2.579 0 50 GFAA COc1cccc(NC(=O)Cn2nc(-c3ccc(OC)c(OC)c3)ccc2=O)c1 5388644 YCVXHPYZYHVBJR-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA COc1cc(=O)n2c(c1C(=O)N[C@@H](C)c1ccco1)CCN(CC=C(C)C)CC2 11995972 PKZDVPRXSNFPHB-INIZCTEOSA-N 399.491 2.765 0 50 GFAA COc1ccc(CN2CCC(N3CCC(C(=O)N4CCCC4)CC3)CC2)cc1 12712286 BZNWARRVQPZZGW-UHFFFAOYSA-N 385.552 2.994 0 50 GFAA COC(=O)c1c(NC(=S)N2CCC[C@@H](C)C2)sc(C(=O)N(C)C)c1C 17078365 MLUMJAKCEYREEZ-SNVBAGLBSA-N 383.539 2.974 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccnc(N)c4)C3)C2)c1 19223709 DWKKADNBKUCZDR-QFIPXVFZSA-N 380.492 2.801 0 50 GFAA COc1ccc(OC)c([C@@H]2CCN(c3ncc(C)c(-c4ncnn4C)n3)C2)c1 20206265 LIKVSLVRYRPWGU-CQSZACIVSA-N 380.452 2.592 0 50 GFAA CCOc1ccc(S(=O)(=O)N(C)Cc2nn(C)c(Cl)c2Cl)cc1 20602690 USSLKPHIIKDGPJ-UHFFFAOYSA-N 378.281 2.946 0 50 GFAA COc1ccc2cc(C(=O)N3CCN(CCc4ccccc4)CC3)c(=O)oc2c1 55058881 PTOYWFPOTVALKZ-UHFFFAOYSA-N 392.455 2.802 0 50 GFAA O=C1C[C@H](c2cnc(NCc3ccccc3)nc2)c2c(nc3ccccn23)CN1 65507700 IWRJKJXHZOYQFB-QGZVFWFLSA-N 384.443 2.888 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccc(F)cc4)CC3)nc(C)n2)n1 67602075 PGWRERZMOOQJAQ-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA COc1ccc(C)cc1-n1c(SCC(=O)O)nnc1[C@@H]1CCCN(C)C1 67769885 VRQWJMPYPOJSRW-CYBMUJFWSA-N 376.482 2.570 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](N(C)Cc1cc(-c3ccncc3)no1)C2 67885988 XMJYYBXODIOTAK-CQSZACIVSA-N 381.436 2.641 0 50 GFAA CC[C@@H](O)CN1CCC(n2nccc2NC(=O)Nc2ccccc2OC)CC1 67983225 QBXXDNPJNWFHKI-MRXNPFEDSA-N 387.484 2.944 0 50 GFAA COc1ccc2cc([C@@H]3CN(c4cncc(C(=O)N(C)C)n4)CCO3)ccc2c1 71497759 IVYOHLFWCUESPC-FQEVSTJZSA-N 392.459 2.918 0 50 GFAA CC(C)(N)C(=O)N1CCC[C@@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 72150887 GIVBMTMKDJFECV-QGZVFWFLSA-N 398.473 2.556 0 50 GFAA COc1cc(N2CCC[C@H](N(C)CCc3ccc(OC)c(OC)c3)C2)ncn1 72170464 GBYBMSSBHBXIOS-KRWDZBQOSA-N 386.496 2.646 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)CCc1nc(-c2ccco2)no1 72477900 KYUUOTAMULEKSB-UHFFFAOYSA-N 379.376 2.971 0 50 GFAA CCOCCn1c(=O)[nH]c2cc(C(=O)NCc3cc4ccccc4[nH]3)ccc21 77421505 XNNYVEWYIISLSK-UHFFFAOYSA-N 378.432 2.777 0 50 GFAA C[C@@H]1CCc2n[nH]c(C(=O)N3CCC4(CC3)Nc3ccccc3NC4=O)c2C1 82109252 DHEHAELNOXWMSA-CYBMUJFWSA-N 379.464 2.574 0 50 GFAA O=C(O)c1ccnc(N2CCC[C@@]3(CCC(=O)N(Cc4ccccn4)C3)C2)c1 91468523 MCXVSVYLWNGKKV-OAQYLSRUSA-N 380.448 2.584 0 50 GFAA Cc1c([C@@H](C)NC(=O)CCc2n[nH]c3c2CCCC3)cnn1-c1ccccn1 91587095 VXHSGPNPCTWIEJ-CQSZACIVSA-N 378.480 2.988 0 50 GFAA CS(=O)(=O)N1CCC[C@H](CNC(=O)Nc2ccc(-c3ccco3)cc2)C1 96140576 GXOIDOOZBWJVQV-CQSZACIVSA-N 377.466 2.740 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2cc(C)oc2C)CC1 96152799 KFXHCEMHLLAPOI-UHFFFAOYSA-N 382.468 2.772 0 50 GFAA O=C(NCCc1nccs1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 116951992 SKAMVQOESXYRLH-GFCCVEGCSA-N 382.436 2.865 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)N1CCOC2(CCC2)C1 127525856 ZLEJYKUKFWDVHH-MRXNPFEDSA-N 392.883 2.735 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)n[nH]1 155859401 LKURDPHMCWAZIQ-LSMKGQCFSA-N 398.551 2.973 0 50 GFAA O=C(NCCc1ccccc1)c1cc2n(n1)C[C@@H](c1ccc3c(c1)OCO3)OC2 169759882 SUEWVHLSDSJKSY-NRFANRHFSA-N 391.427 2.856 0 50 GFAA Cc1nc(-c2c3n(c(=O)n(Cc4ccc(Cl)cc4)c2=O)CCCCC3)no1 169763981 DAIDTWZRBYYPHZ-UHFFFAOYSA-N 386.839 2.797 0 50 GFAA CN(CC(F)(F)F)C(=O)CN1[C@H](C(=O)OC(C)(C)C)C[C@H]2CCCC[C@@H]21 170599737 RQQUCQUINQLJHJ-RDBSUJKOSA-N 378.435 2.982 0 50 GFAA Cc1nc(C)c(S(=O)(=O)NC(=O)/C=C/c2ccc(OC(F)F)cc2)s1 170650532 RKNNFPLZZWBUTJ-VMPITWQZSA-N 388.417 2.880 0 50 GFAA CC(C)n1ncc2c1C[C@@H](NC(=O)C[C@H]1CN(Cc3ccccc3)CCO1)CC2 170681767 RPFOQQWSAGILFI-SFTDATJTSA-N 396.535 2.729 0 50 GFAA CCc1ccc(CC(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cc1 181359548 GRQFWFGHRRWDOR-LJQANCHMSA-N 378.538 2.645 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)CC1 182534050 DNZJZDTTXLMGHV-IEBWSBKVSA-N 386.540 2.790 0 50 GFAA C[C@H](NC(=O)C[C@H]1NC(=O)c2ccccc2NC1=O)C12CC3CC(CC(C3)C1)C2 206241455 HKCZEKGWCBMHBD-XSMRRUQQSA-N 395.503 2.848 0 50 GFAA CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccc(N2CCC[C@@H](C(N)=O)C2)nc1 221831109 DGHZJOSQPQDFLE-SJLPKXTDSA-N 396.491 2.888 0 50 GFAA COC(=O)N1CCCC[C@H]1C(=O)NCc1c[nH]nc1-c1ccc(Cl)cc1 222669773 CGTPDLVKHMTDMM-HNNXBMFYSA-N 376.844 2.967 0 50 GFAA COc1ccc([C@H](NC(=O)c2cccc(-c3ncc[nH]3)c2)C2CC(O)C2)cn1 223134182 SYQFSNBROXYYTJ-TVPLGVNVSA-N 378.432 2.722 0 50 GFAA O=C1NC(=O)[C@]2(Cc3ccccc3N3CCCC[C@H]32)C(=O)N1c1ccccc1 247965001 YXXRVSYQDSBZML-PGRDOPGGSA-N 375.428 2.871 0 50 GFAA O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N1CCOCC(F)(F)C1 288604944 PXKFHJBVMJSOOG-UHFFFAOYSA-N 382.388 2.689 0 50 GFAA Cc1cc(C)n([C@H](C)CNC(=O)Nc2ccc3c(c2)C(=O)N(C2CC2)C3=O)n1 299775409 CDRFXNCRDDPBJD-CYBMUJFWSA-N 381.436 2.641 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@@H](C)CNC(=O)Nc2ccc3[nH]nnc3c2)n1 299793798 HKBRDHLDMWQWQF-VIFPVBQESA-N 381.362 2.939 0 50 GFAA O=C(c1cc(-c2ccccc2)nn1-c1ccccc1)N1Cc2cnn(CCO)c2C1 426428984 UGJTXJCTXPMGGV-UHFFFAOYSA-N 399.454 2.884 0 50 GFAA COc1ccccc1CNC(=O)N1CCN(Cc2ccc(C)cc2)C(=O)[C@@H]1C 426512292 PQLOPOGPHDZTBK-KRWDZBQOSA-N 381.476 2.946 0 50 GFAA C[C@H]1CCc2ccccc2N1S(=O)(=O)NC(=O)[C@H]1CCC(=O)c2ccccc21 793141511 OEABNPSLQULDES-KSSFIOAISA-N 398.484 2.949 0 50 GFAA COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](c1cccs1)C1(CO)CCC1)C2 855116479 HCOJKIUQIJKVAP-JKQORVJESA-N 392.521 2.935 0 50 GFAA Cn1ncc2c1C[C@@H](C(=O)Nc1ccc(-c3nncn3-c3ccccc3)cn1)CC2 886027712 JDHRVCMRBOWDJM-HNNXBMFYSA-N 399.458 2.806 0 50 GFAA O=C(Nc1ccccc1C(F)F)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@@H]3C2)C1 886093361 CWSQMMMAWLRORA-RBSFLKMASA-N 392.450 2.973 0 50 GFAA O=S(=O)(CCOc1ccccc1F)N1CCCN(c2ccc(F)cc2)CC1 952868227 GJOVCYKJJMPHJR-UHFFFAOYSA-N 396.459 2.886 0 50 GFAA c1ccc([C@H]2COC[C@H]3CN(Cc4cnc(-c5ccco5)nc4)CCN23)cc1 1529179609 ZBAJFSDULYDQLE-WOJBJXKFSA-N 376.460 2.994 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@@H](C)n3cc(C)cn3)CC1)OCC2 1704300486 XQNFRKMMZUVKSV-MRXNPFEDSA-N 399.491 2.860 0 50 GFAA Cc1cncc(C(=O)N2CCCN(C(=O)c3ccc(C(F)(F)F)nc3)CC2)c1 1704339430 GAJLSWZBELEEQH-UHFFFAOYSA-N 392.381 2.792 0 50 GFAA OCCN1C[C@@H]2CN(Cc3nc4ccccc4[nH]3)C[C@]2(CCc2ccccc2)C1 1772804950 FGNIRRQXFMYWGJ-YKSBVNFPSA-N 390.531 2.922 0 50 GFAA O=C1c2ccccc2CN1C[C@H]1CC[C@H](C(=O)N2CCc3nc[nH]c3C2)CC1 1775968559 QSXJIBPBUFNIHZ-WKILWMFISA-N 378.476 2.757 0 50 GFAA O=C(N1CCC2(CCCO2)CC1)[C@@]12CCCCN1C[C@@H](NC1CCCC1)C2 1857695871 BWCYDCLFWICQDA-UGKGYDQZSA-N 375.557 2.687 0 50 GFAA N[C@@H]1C[C@@H](c2nc(-c3ccccn3)nn2-c2ccc3ccccc3n2)CC[C@H]1O 1857722602 JKKOZTUJEIVCSL-FRQCXROJSA-N 386.459 2.833 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3)c1cc(F)ccc1F 1875243229 XKGPIZYJDXLRMO-LTVCHDBBSA-N 385.414 2.774 0 50 GFAA Cc1cnc(-c2noc([C@H]3CCCN(CC(=O)Nc4ccccc4)C3)n2)nc1 1875260326 AAWQJQGHGUUGJB-HNNXBMFYSA-N 378.436 2.653 0 50 GFAA CC(C)[C@@H]1C[C@@H](C(=O)NS(=O)(=O)c2ccccc2Br)CCO1 1875283731 CSBSTWUPGSJQAC-AAEUAGOBSA-N 390.299 2.705 0 50 GFAA Cc1nc(O)nc(O)c1CC(=O)N1CC=C(c2cccc(Cl)c2F)CC1 2325797042 YPJMVNXSSXTMHA-UHFFFAOYSA-N 377.803 2.847 0 50 GFAA O=C(c1cc2cnccc2[nH]1)N1CC[C@@H](CN=c2[nH]c3c(F)cccc3o2)C1 2325812106 MKFDIKAYAIOIAG-LBPRGKRZSA-N 379.395 2.839 0 50 GFAA CN(C)C[C@@H](NC(=O)N=c1[nH]nc2ccc(C(F)(F)F)cn12)c1ccccc1 2325858314 IGEDSENYRLTDES-CQSZACIVSA-N 392.385 2.594 0 50 GFAA CC(C)NC(=O)N1CCO[C@@H]2CC[C@H](C(=O)NCc3cccc4[nH]ccc34)C[C@H]21 2356166602 FKJAGSNDCQJSRZ-CWFSZBLJSA-N 398.507 2.772 0 50 GFAA Cc1ccc(NC(=O)CCN2C(=O)c3ccccc3S2(=O)=O)cc1Cl 1144922 PSXVNTQTOUHXGU-UHFFFAOYSA-N 378.837 2.822 0 50 GFAA O=C(c1ccc(-c2cnc3cc(F)ccc3c2)cc1)N1CCS(=O)(=O)CC1 2356166976 QGWNTHBSQNRMSJ-UHFFFAOYSA-N 384.432 2.912 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N2CCCC2)C[C@H]1Nc1cc(COC)ncn1 2356168084 ORECWPDYLVWSCT-CGTJXYLNSA-N 376.501 2.621 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)ccc1NCc1cccnc1 100582038 ZNFUSHNZKCNOBJ-LSOMNZGLSA-N 389.411 2.703 0 50 GFAA CCOc1ccc(S(=O)(=O)N[C@@H]2CCN(C(C)C)C2=O)c2ccccc12 114743686 JPVSGUIUVXEJCQ-MRXNPFEDSA-N 376.478 2.526 0 50 GFAA Cc1ccc(CN2CCc3nnc([C@@H](C)NC(=O)c4ccco4)n3CC2)cc1 23339723 GQJRYRAWIGDSFH-MRXNPFEDSA-N 379.464 2.729 0 50 GFAA Cc1cnc(C)c(-c2cnn(CC(=O)Nc3ccn(Cc4ccccc4)n3)c2)n1 63883253 NMBBBPFUSLFKSN-UHFFFAOYSA-N 387.447 2.840 0 50 GFAA NC(=O)c1ccc([C@@H]2CCCN2C(=O)c2cn3c4c(cccc4c2=O)CC3)s1 23251362 AMFNTOZOLQLAEA-HNNXBMFYSA-N 393.468 2.695 0 50 GFAA Cc1nc([C@H](C)N(C)C(=O)c2cc(CN3CCC(O)CC3)on2)c(C)s1 67742149 UQQWAAIZKYFGKK-NSHDSACASA-N 378.498 2.538 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCCN(c3ncccn3)CC2)c(F)c1 67561803 NEPUEZROTUMXNI-UHFFFAOYSA-N 382.443 2.727 0 50 GFAA CCc1noc2ncc(C(=O)N[C@H](C)CN3CCN(c4ccccc4)CC3)cc12 119589581 UURHISBHOVQAFL-MRXNPFEDSA-N 393.491 2.726 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](N(C)CCc2ccccc2)C1 12592060 IENOAUZEVHPODT-GOSISDBHSA-N 377.510 2.619 0 50 GFAA Cc1noc(-c2ccccc2OCC(=O)N2CCN(c3ccccc3)CC2)n1 35528351 BKLJWAROSPELEO-UHFFFAOYSA-N 378.432 2.773 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1C[C@@H](N(C)C)[C@H](c2ccc(C)cc2)C1 77419640 JISANVKUYRPVAK-PZJWPPBQSA-N 384.524 2.706 0 50 GFAA Cc1cc(C(=O)NC[C@H](N)c2ccc(C(C)C)cc2)cc(S(N)(=O)=O)c1C 262552626 TYRKDVBHCBWDIL-SFHVURJKSA-N 389.521 2.504 0 50 GFAA O=S(=O)(c1cncc(Cl)c1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 285180539 BQPLCJBDKCLNDM-KZNAEPCWSA-N 378.881 2.928 0 50 GFAA Cc1ccc(CN2C[C@H](C(=O)N[C@@H](CC(=O)O)c3cccs3)CC2=O)cc1 237730279 URSCFUGANVEQRC-CVEARBPZSA-N 386.473 2.737 0 50 GFAA Cn1cc(C(N)=O)cc1C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1 130898747 YEDFXXMQLUOAGO-UHFFFAOYSA-N 383.452 2.784 0 50 GFAA Cc1ccn2c(C(=O)N3CCC(Cn4cc(C5CC5)nn4)CC3)c(C)nc2c1 48428330 MEBSNWGIXCVSIF-UHFFFAOYSA-N 378.480 2.972 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3cccc4ccccc34)CC2)n1 82230457 IPFIEVMCIKSZAC-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA COc1ccccc1CCNC(=O)N1CCC(C(=O)NCc2ccco2)CC1 426503559 NVEZQFOCWPJSMM-UHFFFAOYSA-N 385.464 2.569 0 50 GFAA Cn1cnc(-c2cccc(NC(=O)NCc3cccnc3OCC(F)F)c2)n1 162280830 FILZDIQPKGLGRB-UHFFFAOYSA-N 388.378 2.843 0 50 GFAA O=C(Nc1ccccc1F)c1cccc(S(=O)(=O)NCc2ccno2)c1 95366005 PJQZSHRQLOCWEG-UHFFFAOYSA-N 375.381 2.545 0 50 GFAA COc1ccc2c(c1)[C@@H](Nc1nc(C)ncc1S(C)(=O)=O)CC(C)(C)O2 95388369 IMWKBRFJRBURDB-AWEZNQCLSA-N 377.466 2.911 0 50 GFAA NCCc1cccc(CN2CCC3(CCC(=O)N(Cc4cccnc4)C3)CC2)c1 91665410 RHGGEZNODFEJDI-UHFFFAOYSA-N 392.547 2.988 0 50 GFAA COc1ccc(CN2CCN(C(=O)C[C@@H]3CCc4ccccc43)CC2=O)cc1 91635420 KJPXQJQFALKEPX-IBGZPJMESA-N 378.472 2.986 0 50 GFAA O=C(CN1CCN(C/C=C/c2ccccc2)CC1)Nc1cccc2nsnc12 23092483 FZBXFMZVTJZIIZ-VMPITWQZSA-N 393.516 2.961 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)CCc3cc(Cl)no3)C[C@H]2N(C)C)cc1 95523373 QGZAZBBQCHNGBM-DLBZAZTESA-N 377.872 2.825 0 50 GFAA COc1ccc(CN2C(=O)[C@@H](CC(=O)NC3CCCCCCC3)N=C2O)cc1 252527583 CXVIOTKEAYUMDH-GOSISDBHSA-N 387.480 2.939 0 50 GFAA CCc1nnc(CNC(=O)N2CC[C@H](c3cc(OC)ccc3OC)C2)s1 584894896 WQQRCQSMWTUWCR-LBPRGKRZSA-N 376.482 2.817 0 50 GFAA CC(C)(C)N1CC[C@@H](NC(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)C1 670437981 ZAILENZDWLBALL-GOSISDBHSA-N 380.483 2.665 0 50 GFAA CCn1nc2c(c1C(=O)N(C)Cc1nc3c(n1C)CCCC3)C[C@H](C)O[C@@H]2C 1875314362 UKZUMDCAPFOEGR-UONOGXRCSA-N 385.512 2.810 0 50 GFAA Cc1ccccc1OCC(=O)N1CCn2c(C)nc(C3CCN(C)CC3)c2C1 1875394659 QYMIJVJVMUWMTR-UHFFFAOYSA-N 382.508 2.730 0 50 GFAA Cn1nc2c(c1CNC[C@@H](CCO)c1ccc(C(F)(F)F)cc1)COCC2 1875299385 JFFXCIJXFCSYQE-CQSZACIVSA-N 383.414 2.767 0 50 GFAA COC[C@H](C)N(Cc1cccc(OC)c1)C(=O)c1cccc(S(C)(=O)=O)c1 952964383 CUPXFFMRSJFPCW-HNNXBMFYSA-N 391.489 2.776 0 50 GFAA O=C(Nc1ncn(CC(=O)N2CCCCCC2)n1)c1ccc2ncsc2c1 171171598 BKDWIGBUFKKQAQ-UHFFFAOYSA-N 384.465 2.543 0 50 GFAA C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1 171271893 OACHAGNCWCNODD-GFCCVEGCSA-N 384.398 2.990 0 50 GFAA CCOC1CCN(C(=O)[C@@H]2CC[C@H](NC(=O)c3cc(F)cc(C#N)c3)C2)CC1 216939303 SMDSZMWOVFNXQW-QAPCUYQASA-N 387.455 2.623 0 50 GFAA O=C(c1ccccc1OCc1ccccc1)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772703914 FELQCQXYQWPONQ-VGSWGCGISA-N 381.428 2.829 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)CCc2nnc(-c3ccccc3)o2)C1 12301999 YDSPFAAIEFETKK-INIZCTEOSA-N 393.447 2.524 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCc2onc(-c3cccc(F)c3)c2C1 12706384 BCKQPQWXJIQUEG-UHFFFAOYSA-N 377.397 2.833 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC(Cn3cc(C4CCCCC4)nn3)CC2)c[nH]1 19799299 QWSHYPSNOPZDTQ-UHFFFAOYSA-N 383.496 2.875 0 50 GFAA O=C(N1CC[C@@H](n2cc(-c3nc(C4CC4)no3)nn2)C1)C1(c2ccccc2)CC1 169778660 FCTRPWHPRRZYJI-MRXNPFEDSA-N 390.447 2.711 0 50 GFAA COc1ccc(NC(=O)CSc2nnc(-c3ccncc3)n2C)c(OC)c1 897248 XDLXGDKLAFGBBJ-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA COc1ccc(NC(=S)NCCn2cc(Br)cn2)cc1OC 2857998 UGNWLSXQLHUONR-UHFFFAOYSA-N 385.287 2.649 0 50 GFAA O=C(Cc1cccnc1)N1CCCN(Cc2ccc(Cn3cccn3)cc2)CC1 1857690478 FMRAADPPPMJTRW-UHFFFAOYSA-N 389.503 2.603 0 50 GFAA CN(C)Cc1ccc([C@@H]2CCCN2C(=O)c2cc(N3CCOCC3)no2)cc1 1857706884 ADSMJKJZLFYZDV-SFHVURJKSA-N 384.480 2.550 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(C1CCN(Cc3ccccc3)CC1)C[C@H]2O 1857724907 RNPAQQQBFYWPFZ-ZGFBMJKBSA-N 392.543 2.720 0 50 GFAA C[C@H](NC(=O)N[C@@H]1C[C@H]2CC[C@@]1(C)C2(C)C)c1cccc(S(N)(=O)=O)c1 241897382 TYFXVEQOJQUCHG-WRUATKAJSA-N 379.526 2.909 0 50 GFAA CO[C@H]1C[C@@H](CN(C)Cc2nc(-c3ccc(C(F)(F)F)cc3)no2)N(C)C1 497513141 WUNSKWDLEGKSOY-GJZGRUSLSA-N 384.402 2.906 0 50 GFAA CC1([C@@H]2CCCN(C(=O)N[C@@H](C[C@H]3CCCO3)C(F)(F)F)C2)OCCO1 847244359 CCHZZQJMBSHQKD-MCIONIFRSA-N 380.407 2.671 0 50 GFAA CCn1cc(CN(C)S(=O)(=O)c2ccc(Br)s2)c(C)n1 14226388 CMGBHDRYJNLWAW-UHFFFAOYSA-N 378.317 2.856 0 50 GFAA O=C1CC[C@@H](Nc2cc(N3CCCC3)nc(-c3ccc(Cl)cc3)n2)C(=O)N1 1857797825 YEZOXYAFERPYNK-CQSZACIVSA-N 385.855 2.614 0 50 GFAA COc1cc(C(=O)N(Cc2ccccn2)C2CCNCC2)cc2c1O[C@@H](C)C2 2325774742 PGIYNDDMJIQKIJ-HNNXBMFYSA-N 381.476 2.808 0 50 GFAA Cc1nnc(COc2ccc(NC(=O)c3ccc4c(c3)C[C@H](C)NC4)cc2)n1C 2325814030 HGOUMHLAMVPCLD-AWEZNQCLSA-N 391.475 2.989 0 50 GFAA NC(=O)[C@H](CC(=O)N[C@@H](CO)c1cccc(O)c1)c1ccc(Cl)cc1Cl 2325851146 QEAGIDJZUQKMHI-ZBFHGGJFSA-N 397.258 2.508 0 50 GFAA COc1ccc(C)cc1-n1cnc(C(=O)NC[C@@H]2NCCc3ccccc32)c1 2325859974 RUDTWXWUQDWLND-SFHVURJKSA-N 376.460 2.806 0 50 GFAA COC(=O)c1cccc(NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1 715336 NLBYKYJKKDVASV-QGZVFWFLSA-N 380.400 2.733 0 50 GFAA COC(=O)COc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2OC)cc1 1119745 JFCDJMRPCKTGDU-UHFFFAOYSA-N 385.825 2.701 0 50 GFAA CCOc1ccccc1NC(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C 1141615 SIRCKNKKXGXQJO-UHFFFAOYSA-N 376.478 2.928 0 50 GFAA Cc1ncc(C[n+]2csc(CCOC(=O)C34CCC(CC3)C4)c2C)c(N)n1 1216218 SNQYTSHJQRKIIW-UHFFFAOYSA-N 387.529 2.739 0 50 GFAA COCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(Br)cc1 2755582 SMOCIIIXVSVKPS-AWEZNQCLSA-N 383.242 2.609 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H](C(=O)NCc3ccco3)C2)c(C)c1 4837803 OLHKMCLSZSNKIH-QGZVFWFLSA-N 390.505 2.922 0 50 GFAA COc1ccccc1C(=O)N(Cc1sccc1C)[C@H]1CCS(=O)(=O)C1 6810205 XQXMKLKRHCAJOK-AWEZNQCLSA-N 379.503 2.895 0 50 GFAA CC(C)N1CCC(N2CCC[C@@H](C(=O)NCc3cnc4ccccn34)C2)CC1 12206928 QLIGSTKVJZSKMJ-GOSISDBHSA-N 383.540 2.535 0 50 GFAA CC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1cccnc1)C2 14747883 FYJFMZXWLFSEOW-UHFFFAOYSA-N 395.507 2.805 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCCN(C2CCCCC2)CC1 14961476 OOWPEAYHAVNBJJ-UHFFFAOYSA-N 385.487 2.946 0 50 GFAA Cc1cc(CNC(=O)c2cccc(OC3CCN(C(=O)C4CC4)CC3)c2)on1 15065281 ZTDQLSGPQODZGX-UHFFFAOYSA-N 383.448 2.693 0 50 GFAA CCOc1cccc(N2C(=O)C[C@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c1 18107067 IGWSTOBADNAJJM-FQEVSTJZSA-N 397.450 2.679 0 50 GFAA CCN1CCN(CC(=O)N2CCC[C@H](CCc3ccc(F)c(F)c3)C2)CC1 20537501 PZQKQILJHPAIOD-GOSISDBHSA-N 379.495 2.774 0 50 GFAA O=C(Cn1nc(-c2ccc(Cl)cc2)ccc1=O)N=c1[nH]c2ccccc2[nH]1 44891029 JNDGDQICOAHTQT-UHFFFAOYSA-N 379.807 2.501 0 50 GFAA Cc1nn(C)cc1-c1ccnc(N2CCC[C@@H]2c2nc(-c3cccnc3)no2)n1 48221840 ZNQVGMRCTXBVDE-QGZVFWFLSA-N 388.435 2.972 0 50 GFAA Cc1cccc2[nH]c(CNC[C@@]3(O)CCCN(Cc4ccc(F)cc4)C3=O)nc12 67678731 BXFIZVGWVQOVRG-QFIPXVFZSA-N 396.466 2.654 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(Cl)s3)CC2)C1 67740609 ZWXNLLXSRQFKFP-HNNXBMFYSA-N 399.988 2.841 0 50 GFAA O=C(NCc1ccccn1)[C@@H]1CCCN(C2CCN(Cc3nccs3)CC2)C1 71661229 GHHQOTHTQXVGBC-QGZVFWFLSA-N 399.564 2.531 0 50 GFAA O=C(c1ccc(F)cc1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71776320 QHJUCRNUHNPOIY-GOSISDBHSA-N 387.499 2.765 0 50 GFAA CC(C)Cc1ccc(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)cc1 91550611 AJHLNQNUDKGKPQ-YADHBBJMSA-N 388.552 2.821 0 50 GFAA CCC1(CC)CN(C(=O)[C@H]2CCC(=O)N(Cc3ccccc3F)C2)CCO1 91586844 KUBBPUUHTOJPGA-KRWDZBQOSA-N 376.472 2.982 0 50 GFAA Cc1ncsc1CN1C(=O)N(CCc2ccccc2)C2(CCNCC2)C1=O 95362365 VRPRAIXHWMVBEB-UHFFFAOYSA-N 384.505 2.581 0 50 GFAA Cc1nccn1-c1ccccc1CNC(=O)c1coc(CN2CCOCC2)c1 95363627 YPWUNGSCMYWTAI-UHFFFAOYSA-N 380.448 2.536 0 50 GFAA COCc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccn2)C3)s1 95381352 UXKBUVCSQVFWDR-LSDHHAIUSA-N 385.489 2.666 0 50 GFAA Cc1ccc(C(=O)NCCC(=O)N2C[C@@H]3CC[C@H](C2)N(CC2CCC2)C3)cc1 95390531 ZTVJKXRTHNSWJU-TZIWHRDSSA-N 383.536 2.838 0 50 GFAA Cc1cc(=O)[nH]c(NCCNC(=O)Nc2cccc3c4c(oc23)CCCC4)n1 96148123 PLGUIZSBTAROKD-UHFFFAOYSA-N 381.436 2.937 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(C(=O)CN(C)CCOC)CC2)C1 96166261 QIPFDWVGBQXHJO-OAQYLSRUSA-N 387.568 2.683 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)Nc1nnc(C(C)C)s1 132020410 AMBRAPZRFZRSRL-UHFFFAOYSA-N 380.495 2.762 0 50 GFAA COc1cc(CCNC(=O)NC2CCN(Cc3ccccn3)CC2)ccc1C 154507940 KBNGXYHMTVJKMC-UHFFFAOYSA-N 382.508 2.905 0 50 GFAA CCCn1nc(C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)ccc1=O 190801745 AAWOLNMRAZKXDJ-UHFFFAOYSA-N 397.523 2.744 0 50 GFAA COc1cccc(CC(=O)N2CCn3nc([C@@H](O)Cc4ccccc4)cc3C2)c1 221408092 VVGCKJIEAAQXDP-QFIPXVFZSA-N 391.471 2.753 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@@H](c2ccccc2)C(C)(C)CO)ccc1C 225657910 DJLQDGJSEFZEJG-IBGZPJMESA-N 390.505 2.992 0 50 GFAA CN1CCC([C@H]2CCN(C(=O)CNC(=O)c3ccc(C(F)(F)F)cc3)C2)CC1 270267396 SRTXDJGNTSXXOJ-INIZCTEOSA-N 397.441 2.626 0 50 GFAA CN(C(=O)c1cnc2nc(O)nc(O)c2c1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C 288040311 DNTHMIKWNQZMQJ-HOTGVXAUSA-N 394.431 2.754 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[S@](=O)C[C@@H](C)C3)cc2F)n1 297640769 IJPGVXMQPYKFGG-QDXKXIGTSA-N 378.473 2.861 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)cc1 299748658 HVDMAHDPLVHWPV-PVAVHDDUSA-N 379.478 2.728 0 50 GFAA Cc1ccc(C(=O)N2C[C@H]3CCC[C@@]3(c3nc(-c4cnccn4)no3)C2)c(O)c1 328605636 OHZCDXVAOHWCSM-SPLOXXLWSA-N 391.431 2.735 0 50 GFAA COCc1ncc(C(=O)N2CCN(c3ccnc(-c4ccccc4)n3)CC2)s1 367153260 XTEJCQUFBJDWDC-UHFFFAOYSA-N 395.488 2.709 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)NCc1ccccc1-n1cncn1 426537438 GWOGNEIBQOTMNC-UHFFFAOYSA-N 379.468 2.601 0 50 GFAA CC(C)Cn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)c(C(F)F)n1 448635118 OGRYQMKFHYLVDE-UHFFFAOYSA-N 392.454 2.876 0 50 GFAA COc1ccc([C@H]2CNCCN2C(=O)Nc2cccc(-c3cn(C)nn3)c2)cc1 883575319 CUJWEUMUKOBMBR-HXUWFJFHSA-N 392.463 2.669 0 50 GFAA Cc1nc(CN2C[C@H](C(=O)N3CCOCC3(C)C)[C@@H](C(F)(F)F)C2)oc1C 888103114 HKVIZXLTNYWHEB-KBPBESRZSA-N 389.418 2.539 0 50 GFAA Cc1nc(-c2cccnc2)ncc1C(=O)Nc1ccc2c(c1)N(C)C(=O)[C@H](C)O2 1506398487 DOJDBNMDNFAKNT-ZDUSSCGKSA-N 389.415 2.843 0 50 GFAA Nc1nc2c(c(C(=O)NCC3(c4cccc(F)c4)CCOCC3)n1)CCCC2 1506417478 JVJHNVWMTAWOLL-UHFFFAOYSA-N 384.455 2.555 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N1CCC(N)CC1 1704330482 DSGHPINBKDRGBZ-UHFFFAOYSA-N 378.860 2.617 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857688719 YCWVRIMLSCSBKX-ABSDTBQOSA-N 381.432 2.751 0 50 GFAA CC(C)SCC(=O)N1CCC2(CC1)CN(Cc1ccccc1)C[C@@H]2C(=O)O 1857691298 DUTDWJPSFGNHCY-GOSISDBHSA-N 390.549 2.953 0 50 GFAA Cc1ccc(OCC(=O)NC[C@H]2[C@H]3CN(C4CCCC4)C[C@]34CC[C@H]2O4)cc1 1857715276 JUMGTLATORKBIT-ZZLPTCMGSA-N 384.520 2.912 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cnc4c(-c5ccccc5)cnn4c3)C[C@@H]2O)on1 1857734547 VIAGFKJDQZONKO-NQIIRXRSSA-N 389.459 2.728 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC2CCC2)CC[C@H]1NC(=O)c1scnc1C 1875244277 PTGYRAFHKJLQJR-NUEKZKHPSA-N 379.526 2.814 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1cccc(C)c1OC)C[C@H](C)O[C@@H]2C 1875316086 UGBBMDYGWTUNPI-LSDHHAIUSA-N 387.480 2.799 0 50 GFAA Cc1ccn2c(C3CCN(C(=O)c4n[nH]c5c4C[C@@H](C)O[C@H]5C)CC3)nnc2c1 1875393232 BGMTWOFYLHKSHL-KGLIPLIRSA-N 394.479 2.803 0 50 GFAA COCc1nnc([C@]23CC[C@H]2CCN3C(=O)c2cc3ccccc3c(OC)n2)o1 1875404600 OHWBYBPUGLDSDJ-QKKBWIMNSA-N 394.431 2.924 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3ccccc3-n3cccn3)cn12 2100484023 ZQBTYCQHLMPQDZ-IBGZPJMESA-N 390.447 2.534 0 50 GFAA COc1ccc(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)cc1C 2100556205 ILBHYJBFLLRHMM-DENIHFKCSA-N 383.444 2.524 0 50 GFAA CSc1ccc2ncnc(N3CCC4(CC3)C[C@@H](O)c3nn(C)cc3O4)c2c1 2325775988 ZKTNEWPGLBNYRX-MRXNPFEDSA-N 397.504 2.940 0 50 GFAA O=C(N=c1ccn(Cc2ccc(Cl)cc2)[nH]1)c1cccc(-c2nc(=O)o[nH]2)c1 2325821912 LVZKUQUDJPASDY-UHFFFAOYSA-N 395.806 2.602 0 50 GFAA O=C(C[C@H](c1ccc(F)c(F)c1)C1CC1)N[C@@H](C(=O)O)C1CC(C(=O)O)C1 2325877462 RMKHKPPULQDQSS-JJOHEJHASA-N 381.375 2.529 0 50 GFAA COCCC1CCN(C(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)CC1 2356160242 JSPRJGLIZHEPMC-FHJLPGHOSA-N 397.519 2.593 0 50 GFAA O=C1C[C@@H](c2ccccc2)NCCCCN(C(=O)c2cccnc2)CCCN1 2356161538 ZFYUROYIPSSYAU-FQEVSTJZSA-N 380.492 2.545 0 50 GFAA CCOc1cc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)ccc1Br 1051498 POMZXPCROGGSES-QWRGUYRKSA-N 378.288 2.646 0 50 GFAA O=C(c1cn2cccnc2n1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356148820 URYIMXFXBRBTMH-QFIPXVFZSA-N 389.459 2.527 0 50 GFAA O[C@@]1(c2ccccc2)CCC[C@H]2CN(CCCc3cnc4ncnn4c3)C[C@H]21 2356166932 PDFZXCLCDGECFQ-CZTZKLFOSA-N 377.492 2.677 0 50 GFAA O=C(NCC1(OCCO)CCOCC1)c1sccc1-c1ccc(F)cc1 225743696 WDBYMYBRCDVLKF-UHFFFAOYSA-N 379.453 2.842 0 50 GFAA Cc1cccc(CN2CCN(Cc3ccc(-n4cccn4)cc3)C[C@@H]2CCO)n1 20539611 ZXIUAOQLCBGGPM-QHCPKHFHSA-N 391.519 2.645 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccccc1)CC2 20762212 TWAXKVFHZBGLEJ-PGRDOPGGSA-N 394.471 2.808 0 50 GFAA biogenic CCn1c(CN2CC[C@]3(CCCN(C(=O)CCOC)C3)C2)nc2ccccc21 67947328 PUNHZFLBEFHIQB-JOCHJYFZSA-N 384.524 2.907 0 50 GFAA COc1ccc(Cn2nc(C(=O)O)c3c2CCN(C(=O)c2ccccc2)C3)cc1 67868829 VEUBXWWYJOLTBK-UHFFFAOYSA-N 391.427 2.837 0 50 GFAA COc1cccc(C(=O)N2CCN(Cc3nc(Cc4ccccc4)no3)CC2)c1 23129377 DRHCTTQNQFFPDC-UHFFFAOYSA-N 392.459 2.627 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3ccc(C(=N)O)cn3)CC2)cn1 328642179 QXUVALKSZIQMRX-OAHLLOKOSA-N 382.468 2.533 0 50 GFAA NC(=O)COc1cccc(NC(=O)N2CCC(Oc3ccc(F)cc3)CC2)c1 363222736 NWDFBUJPVPRFAM-UHFFFAOYSA-N 387.411 2.765 0 50 GFAA Cc1ncoc1C(=O)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 67982451 ORXKXDROUGEVQL-LSDHHAIUSA-N 375.812 2.524 0 50 GFAA CN(C)c1ccc(-c2nnc(SCC(=O)NCc3ccccc3)n2C)cc1 10163423 HWMWFSKXYSHGET-UHFFFAOYSA-N 381.505 2.957 0 50 GFAA COc1ccc(/C=C/C(=O)NN2C(=O)N[C@](C)(CCc3ccccc3)C2=O)cc1 253630012 VHKLHMYUHKVCDR-KCQSEKJDSA-N 393.443 2.683 0 50 GFAA COc1cccc(C(=O)NCC(=O)N[C@@H](c2ccccc2)C2CCOCC2)c1 363708846 DZHHLLAONISVNF-NRFANRHFSA-N 382.460 2.709 0 50 GFAA CC(=O)NCCCC(=O)N1CCCN(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 72129281 HSJCLOFLPUNDNE-HXUWFJFHSA-N 377.504 2.801 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3cccnc3O)C2)cc1OC 72147071 PVVMTZQWKBEZRW-QGZVFWFLSA-N 399.491 2.584 0 50 GFAA CC(C)c1cc(N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)ncn1 71755387 BBXZBDCRIJZVRY-SFHVURJKSA-N 385.556 2.903 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 176611645 QURZODHMVUKROZ-LJQANCHMSA-N 393.528 2.814 0 50 GFAA O=C(NCCCN1CCC[C@H](O)C1)N1CCC(Cc2ccccc2F)CC1 426427920 IXWGRKWHVVBPLI-IBGZPJMESA-N 377.504 2.637 0 50 GFAA CCc1ccc(S(=O)(=O)N2CCC3(CCC(=O)N(C4CC4)C3)CC2)cc1 91656137 MFMWHVHKKJAXKS-UHFFFAOYSA-N 376.522 2.805 0 50 GFAA CN(C)c1ncc(CN2CCC3(CCN(CC4CC4)CC3)[C@H](CO)C2)s1 97272414 PQGPUYHNNSLFFO-KRWDZBQOSA-N 378.586 2.516 0 50 GFAA Cc1nc(C2CCN(C(=O)N[C@@H](C)c3cnn(-c4ccccc4)c3)CC2)n[nH]1 426684535 RFIPIURRWBLABN-AWEZNQCLSA-N 379.468 2.949 0 50 GFAA O=C(c1ccc(-c2cccc(O)n2)cc1)N1CCCO[C@H](CN2CCCC2)C1 426728088 AAGBFOHSAGXZMJ-LJQANCHMSA-N 381.476 2.781 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@H](NS(=O)(=O)N2CCCC2)C1 91616320 XNLSSWGCJRDOED-QGZVFWFLSA-N 392.500 2.955 0 50 GFAA O=C(C1CCCC1)N1CCC(C(=O)N(CCO)Cc2ccc(F)cc2)CC1 91915437 OIMONPHKNLDMAG-UHFFFAOYSA-N 376.472 2.575 0 50 GFAA COc1cccc2c1OC[C@@H](CNC(=O)c1n[nH]c(N)c1-c1ccccc1)C2 95386209 WOIZIRKHQQZMOV-CYBMUJFWSA-N 378.432 2.649 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cccc4cccnc34)C[C@@H]2CCO)CC1 91469102 CFKRQYPJZJUFKM-QHCPKHFHSA-N 396.579 2.976 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)nc(C)n1 91876888 XEKDZZGJXRTNQJ-UHFFFAOYSA-N 393.491 2.533 0 50 GFAA O=C(O)CCC/C=C/C[C@H]1[C@H](/C=C/[C@H](O)COc2ccsc2)[C@@H](O)C[C@H]1O 245204673 FYBFDIIAPRHIQS-VQJBHRCLSA-N 396.505 2.603 0 50 GFAA CC1(Cn2cc(C(=O)Nc3nc(-c4cc(F)ccc4F)cs3)nn2)COC1 183726563 WDLYJFLBCDFTNR-UHFFFAOYSA-N 391.403 2.969 0 50 GFAA N=c1nc(O)c2c([nH]1)C1(CC2)CCN(C(=O)c2ccc3ccccc3c2O)CC1 1940196034 FLTVCRRHTMCORD-UHFFFAOYSA-N 390.443 2.574 0 50 GFAA Cc1ccccc1-n1cc(CNC2CCN(C(=O)c3ccncc3)CC2)cn1 647173768 ZYHIQSWLWFVLHX-UHFFFAOYSA-N 375.476 2.970 0 50 GFAA CCOC(=O)C1CCN(c2nc3c(C)cccc3cc2CN[C@H](C)CO)CC1 299760823 KGDFIPXMACRXEZ-MRXNPFEDSA-N 385.508 2.793 0 50 GFAA COc1ccccc1[C@H]1CCCN1CC(=O)Nc1nc(C)c(C(=O)O)s1 299784820 MYOHYDNQHLLTHB-CYBMUJFWSA-N 375.450 2.934 0 50 GFAA Cc1ccccc1N1CC[C@@H](CNC(=O)CCS(=O)(=O)c2ccccc2)C1 827819931 HEWAKVPOTHQRPQ-SFHVURJKSA-N 386.517 2.802 0 50 GFAA Cc1nc2ccc(C(=O)NC[C@H](c3ccccn3)N3CCOCC3)cc2s1 670455793 BDHHDDLHUNDYPY-GOSISDBHSA-N 382.489 2.803 0 50 GFAA NCc1ccoc1C(=O)N(CCc1ccc(Cl)cc1)C[C@H](O)C(F)(F)F 1875315372 REOPQMBNJJFOPJ-AWEZNQCLSA-N 390.789 3.000 0 50 GFAA COc1ccc(CC(=O)N2CCc3nc[nH]c3[C@@H]2c2cccnc2)cc1OC 888088912 XEGIGKCXXAUGBJ-NRFANRHFSA-N 378.432 2.539 0 50 GFAA O=C(c1ccc(Cl)c(F)c1)N1C[C@@H]2CN(CC3CCC3)C[C@]2(C(=O)O)C1 1565505958 HBASSXMIHNWMLY-LIRRHRJNSA-N 380.847 2.738 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 170638297 SNQODTZDJFBIFN-STQMWFEESA-N 386.351 2.589 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2CCC(c3ccnn3C)CC2)cc1C(N)=O 280395986 AXKOYWYFOCDAEH-UHFFFAOYSA-N 385.468 2.718 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCC[C@H](CO)C3)ncn2)CC1 171884622 UDHUVSJCTRSIRA-KRWDZBQOSA-N 397.523 2.775 0 50 GFAA CCCc1c(C(=O)NC[C@H]2CCN(CC)C2)nnn1-c1cccc(Cl)c1 109259254 RAVGURXRIHQSKF-CQSZACIVSA-N 375.904 2.945 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(S(=O)(=O)c2cc(C)c(C)cc2OC)C1 1260764884 SJIGKFGCOWGIDA-INIZCTEOSA-N 382.526 2.581 0 50 GFAA Cc1onc(-c2c(Cl)cccc2Cl)c1CN1C[C@H]2CNC[C@@]2(CO)C1 1772704350 QRBYRLDRKHHQRD-XIKOKIGWSA-N 382.291 2.971 0 50 GFAA CC(=O)N1CCC(CC(=O)N2CCC[C@H](C)C2)(N2Cc3ccccc3C2=O)CC1 1772501659 YJWVXPGGUXNTEX-KRWDZBQOSA-N 397.519 2.672 0 50 GFAA CCOc1ccc2nc(N3CCC(N4CCC[C@H]4C(=O)OC)CC3)nc(C)c2c1 11965498 OFKPJKOKEMASBE-FQEVSTJZSA-N 398.507 2.943 0 50 GFAA O=C(NCCCn1ccc2ccccc21)[C@@H]1CCC(=O)N(Cc2ccccn2)C1 12434870 KLOATCQBOWVXAC-LJQANCHMSA-N 390.487 2.981 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(Cc2ccco2)CC1 12718240 WYZXFMQPOLOHHO-UHFFFAOYSA-N 388.464 2.708 0 50 GFAA O=C(NC[C@@H]1CCCN(C(=O)CCN2CCCCO2)C1)c1ccccc1Cl 15067829 FLMVDVSACHMMRU-INIZCTEOSA-N 393.915 2.726 0 50 GFAA Cc1cccc(OCC(=O)N2CC[C@@H](n3cc(-c4nc(C(C)C)no4)nn3)C2)c1 169781409 HWBHVTGZXOITCA-OAHLLOKOSA-N 396.451 2.612 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857669369 BDOYUEYIPMFPME-FDDCHVKYSA-N 395.455 2.871 0 50 GFAA CC1CCN(C(=O)COc2ccccc2CN2C[C@H]3CCCN3C(=O)[C@@H]2C)CC1 1857702273 GSVCYFKREWTXDM-AZUAARDMSA-N 399.535 2.519 0 50 GFAA Cc1nc(N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c2cnn(C)c2n1 1857718667 NNYAEGZAPCMNAH-SOLBZPMBSA-N 398.898 2.951 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@H]2[C@H]3CN(C4CCCC4)C[C@]34CC[C@H]2O4)s1 1857727414 RMYHZHQBYDEIHT-TVKQPGBESA-N 375.538 2.912 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCNC(=O)C3(C)C)cc12 110707950 MOCKKRUSITYTIT-UHFFFAOYSA-N 382.489 2.805 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCO[C@@H](CC(=O)O)C1 237681131 QOKADHJYWLERPZ-JTQLQIEISA-N 382.775 2.758 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)C(=O)N3CC1CCC1)OCCO2 247949396 LFWZOKBRVCMMRC-AEFFLSMTSA-N 386.492 2.689 0 50 GFAA Cc1nc(S(=O)(=O)N[C@H]2CCCC23CCOCC3)sc1Br 374450578 GSDSKORJMHDGAS-JTQLQIEISA-N 395.344 2.842 0 50 GFAA Cc1cc(NC(=O)N2CCO[C@@]3(CCCOC3)C2)nn1-c1cccc(Cl)c1 376584977 AMVGJICERHYFAT-IBGZPJMESA-N 390.871 3.247 0 50 GFAA COc1ccc(C(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)c(OC)c1 264718710 ONHOOOLZGTXKDS-UHFFFAOYSA-N 387.480 2.951 0 50 GFAA CCn1cnnc1C1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1 265573910 MCZBKYMFIAANPC-UHFFFAOYSA-N 377.452 2.724 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc4c(c3)ncn4C)C1)CC2 1704339445 HBOVQBWTXKXIRA-JOCHJYFZSA-N 390.491 2.550 0 50 GFAA Cc1ccc([C@]23C[C@H]2CN(CC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)C3)cc1 2325778751 NEXMCZRZNMBVLQ-XUZZJYLKSA-N 397.563 2.674 0 50 GFAA CC[C@H](SC)C(=O)NC[C@@]1(C)CCN(C(=O)c2ocnc2C(F)(F)F)C1 2325794345 ZAAZDOJDQGXSQK-ZUZCIYMTSA-N 393.431 2.803 0 50 GFAA C[C@@H]1CN(c2cccc(F)c2)CCN1C(=O)c1ccc(-c2nc(=O)o[nH]2)s1 2325821947 OPABPBRIBXSSGJ-LLVKDONJSA-N 388.424 2.581 0 50 GFAA Cc1cc(CC(=O)Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)n(C)n1 2325875631 YDWPJAIVCDNOTB-UHFFFAOYSA-N 393.472 2.788 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NCc1ccccn1 885079 CLUZRCZBDBRKMR-UHFFFAOYSA-N 395.484 2.589 0 50 GFAA O=C(CN1C(=O)COc2ccccc21)Nc1ccc(Br)cc1F 8390926 FPFSFBWBIRLFDC-UHFFFAOYSA-N 379.185 2.952 0 50 GFAA CCSc1nnc(NC(=O)CSc2nnnn2-c2ccccc2C)s1 10382194 NQTAYANGTUPEGX-UHFFFAOYSA-N 393.523 2.665 0 50 GFAA O=C(NCCN1CCCc2ccccc21)c1cn(Cc2c(F)cccc2F)nn1 11937566 XDSSSIJPZJBPKO-UHFFFAOYSA-N 397.429 2.787 0 50 GFAA Cc1c(CNC(=O)c2coc(COc3ccc4ncccc4c3)n2)cnn1C 12308887 UQZGSQSBKWFNHP-UHFFFAOYSA-N 377.404 2.774 0 50 GFAA CC(C)Cn1c(CN2CCC(CN3CCCCC3)CC2)cnc1S(C)(=O)=O 12316808 SYCIEOQZSYMDTN-UHFFFAOYSA-N 396.601 2.641 0 50 GFAA COc1cccc2c1OCC(CN1CCC(n3nccc3NC(C)=O)CC1)=C2 12596662 GNCIHNDQHIRTDQ-UHFFFAOYSA-N 382.464 2.963 0 50 GFAA COc1ccc(CN2CCC(OC)CC2)cc1OC[C@@H](O)CN1CCCCC1 12706761 MHLOVTWMRJIZBV-IBGZPJMESA-N 392.540 2.532 0 50 GFAA CCCn1cc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c(C)n1 14980643 JGCRGMIRQXGZII-GOSISDBHSA-N 387.572 2.557 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N2CCN3CCC[C@@H]3C2)nc1 15068756 JERLKUUAYPJEBK-LJQANCHMSA-N 396.539 2.506 0 50 GFAA O=C(CCc1ccncc1)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 15070212 JLVXVJLWWDBDHD-INIZCTEOSA-N 391.393 2.950 0 50 GFAA O=C(NCC1CC1)c1coc(CN2CCN(C/C=C/c3ccccc3)CC2)n1 20599313 CHLGIWOSWVZEFG-QPJJXVBHSA-N 380.492 2.645 0 50 GFAA O[C@H](COc1ccc2c(c1)OCO2)CN1CCN(c2cccc(Cl)c2)CC1 22298799 NCCCZHSXDKVARM-KRWDZBQOSA-N 390.867 2.631 0 50 GFAA CCn1cc(CN2CCN(Cc3ccc(OC)c(C)c3C)[C@H](CCO)C2)cn1 39420460 HQOKAUCQZBOJAF-OAQYLSRUSA-N 386.540 2.597 0 50 GFAA COC(=O)c1ccc(N2CCN(Cc3nc(Cc4ccccc4)no3)CC2)cc1 55569051 BGHCENCXGVGBSC-UHFFFAOYSA-N 392.459 2.769 0 50 GFAA O=C([C@H]1CCCN(C2CCN(c3ncnc4ccsc34)CC2)C1)N1CCCC1 71763962 QRQCCRNEQKDBBZ-INIZCTEOSA-N 399.564 2.995 0 50 GFAA CC(C)c1noc(CCNC(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)n1 91656646 KVAQAIULWXKFBN-MRXNPFEDSA-N 376.501 2.671 0 50 GFAA Cc1ccccc1-c1noc(CN2CCN(c3ccc4cn[nH]c4c3)C(=O)C2)n1 91830117 VQZVNTPREMUBDC-UHFFFAOYSA-N 388.431 2.770 0 50 GFAA O=C1NC2(CCN(Cc3nnc(-c4ccco4)o3)CC2)C[C@H]1c1ccccc1 95366265 XBSXZACXMPRSAX-INIZCTEOSA-N 378.432 2.968 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2O)C1 95392496 PGFBCIPAUNHWRC-CQSZACIVSA-N 376.888 2.824 0 50 GFAA Cn1cnnc1CN1CCC[C@H](C(=O)Nc2ccccc2Oc2cccnc2)C1 95496906 IBFRIGDTDYUOLK-INIZCTEOSA-N 392.463 2.853 0 50 GFAA Cc1ccn2c(C(=O)N3CCC[C@](C)(Cc4ccc5c(c4)OCO5)C3)nnc2n1 95500013 BHOUOPJBMXJXBB-OAQYLSRUSA-N 393.447 2.646 0 50 GFAA CN(C)[C@@H](CNC(=O)c1cnn(-c2ccc(F)cc2)n1)c1c(F)cccc1F 118946089 RLCSOGGUYKLHQS-KRWDZBQOSA-N 389.381 2.717 0 50 GFAA CN(CCO)C(=O)c1nn(-c2ccc(Br)cc2)c2c1CCCC2 120658533 YFIKUDZKSUSPGP-UHFFFAOYSA-N 378.270 2.578 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)c3cnn(C4CCOCC4)c3C)cn2)n1 159060359 KILXAYKJWCJTFT-UHFFFAOYSA-N 380.452 2.993 0 50 GFAA Cc1c(C(=O)N2CCCN(C3CC3)CC2)nnn1-c1ccc(Cl)cc1F 173336853 WYWGMZBLPXNBCJ-UHFFFAOYSA-N 377.851 2.679 0 50 GFAA C[C@H](OC(=O)C(=O)N1CCC[C@@H](C)C1)C(=O)Nc1ccc(Br)cc1 225840776 XOASAVYKWWHDFQ-NEPJUHHUSA-N 397.269 2.578 0 50 GFAA CC(C)CN1CC[C@H](CNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)C1 229875080 LZIVSHNPXFMHFQ-FGTMMUONSA-N 389.544 2.795 0 50 GFAA Cc1cccc(CC2(O)CCN(C(=O)N[C@H](C)c3nnc4ccccn34)CC2)c1 279548540 DGSXHWBEYOOCNB-QGZVFWFLSA-N 393.491 2.878 0 50 GFAA CCc1nnc(CNC(=O)N[C@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)s1 291088432 SETJLBSBNUGAHH-MFKMUULPSA-N 389.481 2.770 0 50 GFAA Cc1c(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)cnn1-c1ccc(=O)[nH]n1 292326434 JLFKBSWDGLJTDU-GFCCVEGCSA-N 389.868 2.786 0 50 GFAA Cc1noc(-c2ccc(NC(=O)NCCc3nc(C)c4c(n3)CCC4)cc2)n1 299760871 RUQNMAOEOUOLPG-UHFFFAOYSA-N 378.436 2.996 0 50 GFAA Cc1ccnc(-c2noc([C@H]3CCCN(C(=O)Cc4ccc(F)cc4)C3)n2)n1 378044123 XFOMKSFOXTXWMS-HNNXBMFYSA-N 381.411 2.923 0 50 GFAA COCC(C)(C)N1CCN(C(=O)c2ccc3c(c2)nc(C(F)F)n3C)CC1 424990233 KGEFKSFVYDPZGY-UHFFFAOYSA-N 380.439 2.694 0 50 GFAA CCN(C(=O)c1cccc(-c2cnn3ccccc23)c1)[C@@H]1CCS(=O)(=O)C1 534646462 ZBZXWVJBIGDQSX-QGZVFWFLSA-N 383.473 2.651 0 50 GFAA CC(C)(C)c1cc(CS(=O)(=O)N2CCCN(c3ncccc3F)CC2)no1 790290815 QHUDKHNEKTWXOY-UHFFFAOYSA-N 396.488 2.548 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCCN(Cc3ccccc3F)CC2)c1C 827939202 RBXVIHHDKQZWNF-UHFFFAOYSA-N 386.471 2.576 0 50 GFAA C[C@@H](CONC(=O)c1ccc(-c2csnn2)cc1)NC(=O)OC(C)(C)C 863901957 IVSMCTXNZSEUFW-NSHDSACASA-N 378.454 2.780 0 50 GFAA O=C1C[C@@H](C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)C2(CCCC2)O1 952991337 XNJBUJUXEXDGBF-LBPRGKRZSA-N 384.436 2.683 0 50 GFAA Cc1nn(C)cc1CN(C)S(=O)(=O)c1ccc(-c2c(C)noc2C)s1 1506425918 SOOSWELVLDPITJ-UHFFFAOYSA-N 380.495 2.883 0 50 GFAA CCn1ncnc1[C@H](C)NS(=O)(=O)c1cc(Cl)c(OC)cc1Cl 1506431794 ZLZYINWQJIUJNM-QMMMGPOBSA-N 379.269 2.653 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1529112236 HCFLEEBQRBPYOE-XMSQKQJNSA-N 392.503 2.580 0 50 GFAA CCNC(=O)[C@@H]1CC[C@](C)(C(=O)Nc2ccc(NC(=O)COC)cc2)C1(C)C 1616158525 JATCWTVGMKTEKQ-HRAATJIYSA-N 389.496 2.789 0 50 GFAA O=S(=O)(N[C@H]1COC[C@H]1Cc1ccncc1)c1cc(Cl)c(Cl)s1 1704338033 JDEBBOKBBMZMDX-PWSUYJOCSA-N 393.317 2.986 0 50 GFAA COC(=O)N1CCCC[C@@H]1C(=O)N1CCC2(CC1)OCCc1sccc12 1704339853 YJYGPTSCHWLAIB-OAHLLOKOSA-N 378.494 2.759 0 50 GFAA O=C(O)CC[C@]12CN(Cc3cccnc3)C[C@@H]1CN(C1Cc3ccccc3C1)C2 1772711924 LPDJGMJCHVBEKG-ZJSXRUAMSA-N 391.515 2.848 0 50 GFAA CCCCOCC(=O)NC[C@H]1CN(C(=O)c2occc2C)C[C@@H]1C(F)(F)F 1775989238 HVOCDMKOHIQHQS-KBPBESRZSA-N 390.402 2.771 0 50 GFAA O=C(Nc1ccc2c(c1)COB2O)c1cccc(Oc2ccc(Cl)cn2)c1 1776003080 ULUXZTRLZNLDHL-UHFFFAOYSA-N 380.596 2.997 0 50 GFAA Cc1ncc(-c2ccc(C)c(S(=O)(=O)N3CC[C@@H]4NCCC[C@@H]4C3)c2)o1 1857670413 MNTCJYIRTPCXCR-SJORKVTESA-N 375.494 2.721 0 50 GFAA O=C([C@H]1CCn2nccc2C1)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 1857708909 TXBJIZUCDJABBJ-AWEZNQCLSA-N 393.409 2.975 0 50 GFAA CNC(=O)C(C)(C)NC(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857723953 DVWATXUECSNAAM-LBPRGKRZSA-N 392.887 2.729 0 50 GFAA OCCOc1ccccc1CN1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857733782 YFZYQJSSNGJFFF-HSZRJFAPSA-N 395.503 2.911 0 50 GFAA O=C(CC1CCN(Cc2ccccc2)CC1)Nc1cccc(-n2nnnc2O)c1 1875298604 HGACHRBOFVHIRL-UHFFFAOYSA-N 392.463 2.609 0 50 GFAA Cc1cc(C(F)(F)F)ccc1CN1CCN(c2ncc(C(=O)O)cn2)CC1 1875315910 MLAOBCMGNOGXNO-UHFFFAOYSA-N 380.370 2.824 0 50 GFAA COCCn1nc(CCC(C)C)nc1-c1ccc2c(c1)CCCS2(=O)=O 1875348690 ZCKIQCRZSVUWQQ-UHFFFAOYSA-N 377.510 2.900 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](N[C@H]3CCCC(F)(F)CC3)C2)n1 1875397516 CONROPOWRHMJOI-LSDHHAIUSA-N 381.471 2.589 0 50 GFAA Cn1cc(C2CCN(C(=O)C(=O)N3CC[C@H]3c3ccc(Cl)cc3)CC2)cn1 2325751668 NTGVGNXQGIYXOB-SFHVURJKSA-N 386.883 2.753 0 50 GFAA COC(=O)c1cc(O)cc(C(=O)N2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)c1 2356151040 NRZVPDYXHTTXCN-UYGSHGSRSA-N 395.455 2.939 0 50 GFAA O=C(O)c1c(NCCCN2CCC[C@H](O)C2)noc1-c1ccc(Cl)cc1 2356157504 NVEYAKDKNRLFGT-AWEZNQCLSA-N 379.844 2.952 0 50 GFAA CCOc1cc(C(=O)N2CCC(C(=O)OC)CC2)cc(OCC)c1OCC 1181626 FFYZOTMDKQCKHN-UHFFFAOYSA-N 379.453 2.908 0 50 GFAA O=C1N(CCO)CCC[C@]12CCCN2Cc1cc(O)c2cccc(Cl)c2n1 2356166217 XOIIBCIYOXEZLK-FQEVSTJZSA-N 389.883 2.543 0 50 GFAA CCn1c(SCC(=O)N2CCCCC2)nnc1-c1ccc2c(c1)OCCO2 9096199 GGAIUFCGUWKNGQ-UHFFFAOYSA-N 388.493 2.841 0 50 GFAA O=C(COc1cccnc1)N(Cc1cccnc1)Cc1ccc2c(c1)OCO2 55243615 XRNCUBDTAVDAOU-UHFFFAOYSA-N 377.400 2.813 0 50 GFAA Cc1nnc(SCCCNC(=O)[C@H]2CCCN(Cc3ccco3)C2)s1 55393436 UDFQWVJOJRHZBS-AWEZNQCLSA-N 380.539 2.950 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccnnc3)n1)CCN(C(=O)CC1CC1)C2 20456019 VKVGUTBBYBDSER-UHFFFAOYSA-N 376.420 2.582 0 50 GFAA Cc1nc(C)c(C(=O)N2CCN(c3ccc(Nc4ccccn4)nn3)CC2)s1 67601999 OVYCMJWFBBOZAG-UHFFFAOYSA-N 395.492 2.651 0 50 GFAA C[C@@H]1CC[C@H]2[C@@H](CCCN2S(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)C1 229663702 GPDREEOSADIGDI-VKJFTORMSA-N 379.526 2.840 0 50 GFAA Cc1ccc(F)c2[nH]c(C(=O)N3C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C3)cc12 862167410 SAQWLAUVTOKEDY-GWCFXTLKSA-N 392.374 2.663 0 50 GFAA COc1cccc(-c2cc(F)ccc2[C@H]2Cc3nc(N)nc(C)c3C(=O)N2)n1 60329723 WSMQUUGTQYPVPD-OAHLLOKOSA-N 379.395 2.604 0 50 GFAA in-vitro CNC(=O)c1ccc([C@@H]2CCCCN2Cc2nnc(C3CC3)n2C2CC2)n1C 328648410 UMGVTCAVEIPGRX-KRWDZBQOSA-N 382.512 2.916 0 50 GFAA COc1ccc(C(=O)N2C[C@H](O)[C@@H](N(C)Cc3ccc4ncccc4c3)C2)cc1 12307936 CZYITDJJTRLIIB-VXKWHMMOSA-N 391.471 2.561 0 50 GFAA COc1ccc(-c2nc(CSc3nc4c(=O)[nH]cnc4n3C)c(C)o2)cc1 12372647 IKXCICPDRKELQL-UHFFFAOYSA-N 383.433 2.921 0 50 GFAA biogenic,in-vitro CCNC(=O)c1ccc(N2CCC[C@@H](Nc3ccc4c(c3)OCCO4)C2)nc1 72163994 ZVIMWAFEFWOFAT-QGZVFWFLSA-N 382.464 2.683 0 50 GFAA O=C1CCCc2nc(O)c(C(=O)N3CCNC[C@H]3c3ccccc3Cl)cc21 261702887 DDLUDLWEYKRQEL-KRWDZBQOSA-N 385.851 2.746 0 50 GFAA C[C@H]1Cc2cc(C(=O)NCc3nc(C4CC4)cs3)ccc2N1S(C)(=O)=O 127010151 DVJCWCKKNICCRY-NSHDSACASA-N 391.518 2.661 0 50 GFAA Cc1nc(CN2CCCN([C@@H](C)C(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)oc1C 370807981 GHSCVWMZEYEERW-JZXOWHBKSA-N 376.545 2.692 0 50 GFAA CN1C[C@@]2(CCCN(c3cc(Sc4cccs4)nc(N)n3)C2)OC1=O 72447733 HJAWTLOIJSEAON-MRXNPFEDSA-N 377.495 2.693 0 50 GFAA COc1ccc(Cc2ncc3c(n2)CN(C(=O)c2ccc(OC)c(O)c2)C3)cc1 71315495 SYNNGVWMRYJMTG-UHFFFAOYSA-N 391.427 2.946 0 50 GFAA O=C(NC1CCN(C(=O)c2ccncc2)CC1)c1cc(F)cc2cccnc12 179393052 WTAKWJYSGZLTJZ-UHFFFAOYSA-N 378.407 2.804 0 50 GFAA Cc1sc(-c2ccco2)nc1C(=O)N(C)CC1CCN(C[C@@H](C)O)CC1 176889444 BBCBMFMLAYJFKJ-CYBMUJFWSA-N 377.510 2.876 0 50 GFAA CN(C)C(=O)NCc1cc2n(n1)CCCN(Cc1cccc3ncccc13)C2 82086581 MROJVTWIXXVNQS-UHFFFAOYSA-N 378.480 2.608 0 50 GFAA CC[C@@H](C(=O)NC[C@@H](C)Cn1cccn1)n1nc(C(F)(F)F)c2c1CCC2 20607690 HCIHGYDTZFOJCB-OCCSQVGLSA-N 383.418 2.991 0 50 GFAA O=C(Cn1nc(-c2ccco2)ccc1=O)N1CCN(c2cccc(Cl)c2)CC1 49548273 PRKONWZRYHONPX-UHFFFAOYSA-N 398.850 2.506 0 50 GFAA CC[C@H](NC(=O)Cn1c(C)cc(=O)c2ccccc21)c1cn2cccnc2n1 221287309 HZEKZUFAEYNZMS-INIZCTEOSA-N 375.432 2.620 0 50 GFAA O=C(c1ccc(-c2ncccn2)cc1)N1CCCC[C@H]1CCN1CCOCC1 426571644 QSZJTZYYYHHTNB-FQEVSTJZSA-N 380.492 2.861 0 50 GFAA Cn1c(CN2CCCCC2)nnc1[C@@H]1CCCN(C(=O)c2cccc(F)c2)C1 426444700 VOVIQVRREVUVRK-QGZVFWFLSA-N 385.487 2.960 0 50 GFAA CCOc1ccc(-c2cn(CC(=O)c3ccc4c(c3)OCO4)c(=N)n2C)cc1 334157660 ZGTVMOLSPYNTSF-UHFFFAOYSA-N 379.416 2.983 0 50 GFAA CCc1c(C)nc(C)nc1N1CCC2(CCC(=O)N(CCCN(C)C)C2)CC1 91829257 XZDPTROSMISBQM-UHFFFAOYSA-N 387.572 2.817 0 50 GFAA CNC(=O)c1ccc(OC)c(-c2cccc(C(=O)N3CCCC[C@@H]3CN)c2)c1 426726716 GMYRLFNODHDMDE-GOSISDBHSA-N 381.476 2.675 0 50 GFAA COCC(=O)N1CCC(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1 95497479 TXSTUVOBLQBPSZ-UHFFFAOYSA-N 382.460 2.980 0 50 GFAA O=C(OCc1ccccc1)[C@@H]1[C@H]2C=C[C@@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 239426018 VPPDEEZJOFBAPZ-UGTOYMOASA-N 375.424 2.712 0 50 GFAA COc1ccnc(N2CCN(Cc3cccc(-n4nc(C)cc4C)c3)CC2)n1 244659885 HKMXTXKQYFSAET-UHFFFAOYSA-N 378.480 2.610 0 50 GFAA O=C(O)[C@H]1COCCN1C(=O)c1cc2ccccc2n1Cc1ccccc1F 299750005 MJBYBJMVUBVVMT-LJQANCHMSA-N 382.391 2.754 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CCC[C@@]2(CCCN(C)C2=O)[C@@H]1C 1940196378 HBKAQXFRMUWMPT-SBUREZEXSA-N 395.503 2.559 0 50 GFAA O=C(Nc1ccnc(O)c1)[C@H]1CC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1 1940196875 ARODQAUJXADNSR-ZDUSSCGKSA-N 398.850 2.952 0 50 GFAA CN1CCN(c2cccc(NC(=O)N3CCC[C@@H](c4ccncn4)C3)c2)C1=O 299786366 JWYKXZDGWFCZTL-OAHLLOKOSA-N 380.452 2.760 0 50 GFAA CC(C)n1cc(CN(C)C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 584890198 UUGPLERYCWYCCW-CQSZACIVSA-N 378.498 2.770 0 50 GFAA COC1CCN(S(=O)(=O)NCC[C@@H](c2ccccc2)c2ccco2)CC1 670444593 ZUWXFFUVGICWOC-SFHVURJKSA-N 378.494 2.747 0 50 GFAA O=C(Nc1cccc2nn[nH]c12)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1875289442 SJMPAWMFHAKUSF-YCRPNKLZSA-N 391.431 2.945 0 50 GFAA Brc1ccc2c(=NC3CCN(Cc4ccccc4)CC3)nc[nH]n12 1875264632 AXRSTCQCDZEJOZ-UHFFFAOYSA-N 386.297 2.990 0 50 GFAA CCOc1cccnc1S(=O)(=O)N1CC[C@H](Oc2ccc(Cl)cc2)C1 1875313724 YHWOSINTYNNOEP-HNNXBMFYSA-N 382.869 2.976 0 50 GFAA Fc1ccc2oc(N3CCC[C@H](c4[nH]ncc4CN4CCOCC4)C3)nc2c1 275745084 VUFRROSIZYNTHZ-AWEZNQCLSA-N 385.443 2.906 0 50 GFAA COc1cccc([C@@H](NC(=O)c2cc3c(cn2)OCCC3)c2nccn2C)c1 170593859 CPVUOWDKGNMLCB-LJQANCHMSA-N 378.432 2.668 0 50 GFAA O=C(NC1CN(Cc2nnc(-c3ccccc3Br)o2)C1)C1CCC1 170601545 RLPQSEKBYIUJSY-UHFFFAOYSA-N 391.269 2.600 0 50 GFAA COC(=O)N1CCCC[C@H]1C(=O)N1CCC2(CC1)OCCc1sccc12 1704339850 YJYGPTSCHWLAIB-HNNXBMFYSA-N 378.494 2.759 0 50 GFAA O=C(c1n[nH]c2c1COCC2)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704337320 UXOMDSVRVKWOJF-UHFFFAOYSA-N 392.459 2.668 0 50 GFAA Cc1ccc(N([C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)S(C)(=O)=O)cc1 1057400 IZCZRDPCZHPCJK-AWEZNQCLSA-N 390.461 2.559 0 50 GFAA COc1c(S(=O)(=O)N2CCC[C@@H](C3(O)CC3)C2)ccc(Cl)c1Cl 1772819405 KTRLMNLPHAROSK-SNVBAGLBSA-N 380.293 2.928 0 50 GFAA COCc1c(C(=O)N2CCC[C@@H](C)C2)cnn1-c1nccc(-c2ccco2)n1 12048698 KVQHAHMLCAFQGG-CQSZACIVSA-N 381.436 2.941 0 50 GFAA CCNC(=O)c1cn(CCc2ccccc2)cc(C(=O)N2CCCC[C@@H]2C)c1=O 12135739 FTOCMZYSELTHFJ-KRWDZBQOSA-N 395.503 2.855 0 50 GFAA COCCN(Cc1ccc(OC)c(OC[C@@H](O)CN2CCCCC2)c1)C(C)C 12588959 XEYGDVLJNNNRMY-FQEVSTJZSA-N 394.556 2.778 0 50 GFAA CCn1nc(C)c(CN2CCC(=O)N(Cc3ccc(C(=O)OC)cc3)CC2)c1C 15071966 RPBVELQEBGEUJQ-UHFFFAOYSA-N 398.507 2.541 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@H](C(=O)N4C[C@H](C)O[C@H](C)C4)C3)nc2c1 18067211 YJYSLCQFSBNYFM-UXLLHSPISA-N 398.507 2.799 0 50 GFAA COc1ccccc1N1CCN([C@H]2CC(=O)N(c3ccccc3Cl)C2=O)CC1 19808597 ODZYUIZRXKWSLL-SFHVURJKSA-N 399.878 2.803 0 50 GFAA S=C(NCCc1ccccc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 19841022 SCKJUHIRLZBBHO-UHFFFAOYSA-N 383.517 2.650 0 50 GFAA CCOC(=O)c1cccc(NC(=O)CSc2nnnn2-c2cccc(C)c2)c1 4840017 SCNXHTFQIQORPE-UHFFFAOYSA-N 397.460 2.878 0 50 GFAA CC(C)CCN1CCOC2(CCN(C(=O)c3cc(C4CC4)[nH]n3)CC2)CC1=O 1857690592 GEKGIIRQRHCKJE-UHFFFAOYSA-N 388.512 2.557 0 50 GFAA CCCN1CCC2(CC1)OCCc1cc(C(=O)NC[C@@H]3CCOC3)sc12 1857684708 ZNKHLTNIMOQXJU-HNNXBMFYSA-N 378.538 2.788 0 50 GFAA O=C(O)[C@@H]1CN(Cc2cccnc2)CC12CCN(C(=O)CCC1CCC1)CC2 1857685203 QPFZEMOIXWATIX-IBGZPJMESA-N 385.508 2.787 0 50 GFAA COc1cc(CN2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)ccn1 1875240841 HQWHKHFNTWTNDX-DENIHFKCSA-N 384.476 2.751 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4cccc(C)n4)C[C@]34CC[C@H]2O4)n1 1875246658 JINBNNFNTOCGEZ-ODULNIPZSA-N 378.476 2.507 0 50 GFAA Cn1c(C(=O)N2CC[C@H](c3ccc4c(c3)OCO4)[C@@H](O)C2)cc2ccccc21 209790683 IPVMYFVYEQERPI-APWZRJJASA-N 378.428 2.898 0 50 GFAA C[C@@H](NC(=O)N1CCC(N2CCCS2(=O)=O)CC1)c1ccc(Cl)cc1 334023803 FTHLIBNWFPBSGA-CYBMUJFWSA-N 385.917 2.611 0 50 GFAA CCN(CCNC(=O)N1CCC(Nc2cccnn2)CC1)c1ccccc1C 153592590 VHOIMQWEAJJOQJ-UHFFFAOYSA-N 382.512 2.897 0 50 GFAA Cn1c(=O)oc2ccc(S(=O)(=O)Nc3ccc(Cc4ccccn4)cc3)cc21 6659100 KHQOBLWZJQYWJC-UHFFFAOYSA-N 395.440 2.918 0 50 GFAA CC[C@@H](C)N(C)CCNC(=O)C(=O)N1CC[C@H](c2cc(C)c(Cl)cc2O)C1 2325757203 VENSYVCLVVSEBS-CABCVRRESA-N 395.931 2.516 0 50 GFAA C[C@@H](CNC(=O)C(C)(C)C1CCCCC1)N(C)C(=O)C[C@@H]1CCC(=O)N1C 2325794325 YRRCTKIFNUKQLI-RDJZCZTQSA-N 379.545 2.567 0 50 GFAA CCc1c(C(=O)N(C)CC(C)(C)CNC(=O)[C@@H]2CCC[C@H]3C[C@@H]32)nnn1CC 2325794794 RNSIEKNPYGUZNW-XHSDSOJGSA-N 389.544 2.511 0 50 GFAA O=C1O[C@H](CN2CC[C@](O)(c3cccc(Br)c3)C2)CC12CCC2 2325799467 ALINYJUAMDRPGF-MAUKXSAKSA-N 380.282 2.828 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)Nc1cccc(-n2ccc(C(=O)O)n2)c1 225483448 ICPYJBIIGDGDAE-UHFFFAOYSA-N 388.383 2.524 0 50 GFAA CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)CSc1ncccn1 892524 ADIMBGRJDYHDSW-UHFFFAOYSA-N 383.433 2.570 0 50 GFAA Cc1ccc(NS(=O)(=O)c2cc(C(=O)N3CCOCC3)ccc2C)c(C)c1 1078270 ZFQQBCHKGVLBAB-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2ccc3nc(C)sc3c2)C1=O 2356142498 VBWYGCVIMDIHOH-FQEVSTJZSA-N 387.505 2.848 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(OC)c(Cl)c2)C1 9974702 GSZWBUWNKVBXTI-ZDUSSCGKSA-N 388.917 2.618 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(CCCOc3cccc(Cl)c3)C2=O)nn1 328610827 JFQRPVQPMKYUPS-INIZCTEOSA-N 391.859 2.649 0 50 GFAA Cc1ccccc1[C@H]1C(O)=NCCN1C(=O)c1cc2c(nc1O)CCCC2=O 329569571 LXLLBZQPOVBRES-SFHVURJKSA-N 379.416 2.768 0 50 GFAA CC(=O)c1cc(C(=O)N2CCO[C@@H](Cc3ccccc3Cl)C2)c(=O)[nH]c1C 71751037 WRWDQALKIQYTTK-HNNXBMFYSA-N 388.851 2.623 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(c3ccc4ccccc4n3)CC2)C1 71639099 VLWQYTCBIAMAPU-LJQANCHMSA-N 396.535 2.678 0 50 GFAA C[C@@H]1CN(C(=O)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)[C@H]1c1ccccc1 124488489 PVGSIXUEXWGOON-CWTRNNRKSA-N 381.407 2.869 0 50 GFAA COc1cc(CCC(=O)N[C@H]2CC(=O)N(Cc3ccc(F)cc3)C2)ccc1C 72154487 HHFPXXIDWGJOPG-IBGZPJMESA-N 384.451 2.993 0 50 GFAA COc1cc(OC)cc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCC3)c2)c1 71775993 YRQLSHLMBMKOOA-UHFFFAOYSA-N 391.445 2.854 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 156410417 FFVBXCDQDGMHFB-WBMJQRKESA-N 379.482 2.510 0 50 GFAA C[C@H](NC(=O)c1occ2c1CCOC2)c1cc(F)ccc1N1CCN(C)CC1 375715716 DNXZETBYVMQTOQ-AWEZNQCLSA-N 387.455 2.734 0 50 GFAA CC(C)C[C@@H](NC(=O)c1cncc(-c2cnn(C)c2)c1)C(=O)Nc1nccs1 378365078 HNOBLZMMPZBOGR-MRXNPFEDSA-N 398.492 2.722 0 50 GFAA Cn1nc(NC(=O)CCc2cc(Cl)no2)c2c(N3CCOCC3)cccc21 72421748 JHYPYDYDUCOORD-UHFFFAOYSA-N 389.843 2.623 0 50 GFAA COc1cccc(OC)c1C(=O)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1OC 72436420 FHPJGXMVVVMWCU-RTWAWAEBSA-N 396.487 2.825 0 50 GFAA CC(C)c1nnc2n1C[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccc(F)cc1)CC2 176174028 HBGUZINXFYCLAR-ROUUACIJSA-N 385.487 2.636 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CC[C@@H](n2cc(Cl)cn2)C1 291049769 VKLPJGOUPDHRPF-HUUCEWRRSA-N 376.844 2.598 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](O2)[C@@H]1C(=O)NCCC(c1ccccc1)c1ccccc1 225649628 GNMWHBAJTKJJEB-MXEMCNAFSA-N 377.440 2.979 0 50 GFAA CSCCc1nc(Cn2nc(C)c(C(C)=O)c2C)n(CC(F)(F)F)n1 96133191 RSTXBKWDCZWVOS-UHFFFAOYSA-N 375.420 2.810 0 50 GFAA C[C@H](NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1cc(F)cc(F)c1 95372211 BRRHTOBRFYCOOK-NSHDSACASA-N 380.416 2.897 0 50 GFAA CCOCc1nc([C@@H]2CC(=O)OC23CCCCC3)n(C2CCN(C)CC2)n1 95509733 GVPDCPNRSFGADA-INIZCTEOSA-N 376.501 2.815 0 50 GFAA O=C(c1cc(-c2ccccc2)on1)N1C[C@@H]2c3ccccc3OC[C@]2(CO)C1 95512604 HXYOQFQOLFQAON-VGOFRKELSA-N 376.412 2.952 0 50 GFAA Cc1c(CC(=O)N[C@H]2CCNC2)c2c(n1Cc1ccccc1F)CCCC2=O 95518602 FIOCOHGDGITQBE-INIZCTEOSA-N 383.467 2.524 0 50 GFAA CC(=O)N1CCC(Oc2ccc(Cl)cc2C(=O)N[C@H]2CCSC2)CC1 95512236 ZUNCSNBOKPNROH-AWEZNQCLSA-N 382.913 2.965 0 50 GFAA CN(C)C[C@H]1COCCN(C(=O)NCC2(c3ccccc3F)CCCC2)C1 534583355 LSTIFRLVXAMIHG-QGZVFWFLSA-N 377.504 2.857 0 50 GFAA O=C(NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1)NC[C@H]1CC(F)(F)CO1 1875301751 SHKFOZXLALOQSR-TZMCWYRMSA-N 396.356 2.580 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(C)cc1OC)C[C@H](C)O[C@@H]2C 1875316145 XHBCPKJRXIEYCU-LSDHHAIUSA-N 387.480 2.799 0 50 GFAA O=C(Nc1cn(CC(F)(F)F)nc1C1CC1)N1CCC(N2CCCC2=O)CC1 1875318007 ABSRQHVMZISTGC-UHFFFAOYSA-N 399.417 2.942 0 50 GFAA O=C(c1csc(=NC[C@H]2C[C@H]2CO)[nH]1)N1CCC[C@@H]1c1cccc(F)c1F 1875360530 CUZOAPXUXKAXAE-BFQNTYOBSA-N 393.459 2.861 0 50 GFAA COC(=O)c1c(Cn2nnc3sc(C)cc3c2=O)nc2ccccc2c1C 1875357609 NSCUIPJBRPWFJP-UHFFFAOYSA-N 380.429 2.853 0 50 GFAA Cc1ccc(-c2noc(CCNC(=O)CCc3nc(-c4ccco4)no3)n2)cc1 952986623 MLWNWWXPHQTVKM-UHFFFAOYSA-N 393.403 2.980 0 50 GFAA CCNc1nc(C)c(C(=O)N2CCC(C(=O)NCc3ccco3)CC2)s1 952977767 UWONEJLEFYVMMC-UHFFFAOYSA-N 376.482 2.645 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)NCc2nc(C(F)(F)F)no2)n1 889896941 QDPKBWVOQFZDOI-UHFFFAOYSA-N 381.314 2.521 0 50 GFAA O=C(CCN1C[C@H]2c3ccccc3OC[C@@]2(C(=O)O)C1)NC1CCCCCC1 1565529912 GTIRDIZXWYMVLC-AVRDEDQJSA-N 386.492 2.778 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(Cc3cccc(N4CCOCC4)c3)C2)N1CC1CCC1 1565507045 BDCBARMOEQNKHB-IRLDBZIGSA-N 383.536 2.746 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)c2ccccc2N2CCOCC2)C1 1506398587 SJBTVKOGGCJWON-KRWDZBQOSA-N 379.460 2.653 0 50 GFAA O=C(Nc1ccc(CC(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1)C1CC1 1529111506 ZMTYMFBCBYHRQT-IFMALSPDSA-N 394.471 2.539 0 50 GFAA CCOC(=O)c1c(NC(=O)/C=C/c2ccc(OC)cc2)sc(C(N)=O)c1C 688862 DQMSHLDHRKPIBJ-JXMROGBWSA-N 388.445 2.993 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCCCn2cccn2)ccc1F 1704331692 SRKDDSGIHALPLM-UHFFFAOYSA-N 387.415 2.572 0 50 GFAA O=C(Cc1ccc(Br)cc1)NS(=O)(=O)c1ncccc1Cl 1875350621 UXPUYGZFBSURGQ-UHFFFAOYSA-N 389.658 2.545 0 50 GFAA COc1ccc(-c2nccn2-c2ccc3ncn(C)c3c2)cc1OCC(=O)O 1775984076 YQYFZFKZQKPKEG-UHFFFAOYSA-N 378.388 2.898 0 50 GFAA CCOC(=O)C1(CCCc2ccccc2)CCN(C(=O)CCn2cncn2)CC1 11813054 WUEZJBYCAQJJHB-UHFFFAOYSA-N 398.507 2.863 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)CCc2cnccn2)CC1 12073488 QYCSGFGBBLLBMK-UHFFFAOYSA-N 396.535 2.831 0 50 GFAA COc1ccc(CNC(=O)c2cn(C(C)C)cc(C(=O)NC(C)(C)C)c2=O)cc1 14962910 IYFJMEGCJLTMTI-UHFFFAOYSA-N 399.491 2.896 0 50 GFAA O=C([C@H]1CC(Cc2cccc(F)c2)=NO1)N1CCC(Oc2cccnc2)CC1 15068136 YKOBPBOPXWAQFR-HXUWFJFHSA-N 383.423 2.978 0 50 GFAA Cc1sc(NC(=O)c2ccccc2)c(C(=O)NCCN2CCOCC2)c1C 19792855 JKOYLXTUNCEXFD-UHFFFAOYSA-N 387.505 2.679 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)Nc1ccc2c(c1)OCO2)CCCCC3 169777283 OMUYDFJFPUXTJQ-UHFFFAOYSA-N 394.431 2.600 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2c3ccccc3NC(=O)[C@@H]2C)cc1OC 225437400 XXDHJXIKKKAVCW-LBPRGKRZSA-N 376.434 2.548 0 50 GFAA Cc1ccc(NC(=O)c2ccc(N3CCN(Cc4nccn4C)CC3)nc2)cc1 112557770 QZSKEMXRRVVBIU-UHFFFAOYSA-N 390.491 2.698 0 50 GFAA COc1ccccc1N1CC[C@H](Nc2ccccc2CN2CCOCC2)C1=O 133110846 BBNHUNPMOQGGBN-IBGZPJMESA-N 381.476 2.745 0 50 GFAA Cc1cccc(-c2nnc([C@@H](C)N(C)Cc3ccccc3S(N)(=O)=O)o2)c1 814656041 OQQCUGFIURHGEE-CQSZACIVSA-N 386.477 2.885 0 50 GFAA O=C(Cc1c[nH]c2cnccc12)N[C@H]1CCCN(c2ccc(F)c(F)c2)C1=O 2325781865 WQUQMTHKRRTCDC-KRWDZBQOSA-N 384.386 2.695 0 50 GFAA COc1ccc(N2CCC[C@H](NC(=O)[C@H](C)n3ccc(C4CC4)n3)C2=O)cc1 2325791089 RBSBVHUAYDMACT-LIRRHRJNSA-N 382.464 2.642 0 50 GFAA CSCC[C@@H](C(=O)Nc1cccc(F)c1O)N1C(=O)c2ccccc2C1=O 1471166561 LQFKAMXTCSNIFA-HNNXBMFYSA-N 388.420 2.888 0 50 GFAA CCOC(=O)N1CCN(C(=S)Nc2cc(OC)c(Cl)cc2OC)CC1 986438 LYHQNAIHDGLQAX-UHFFFAOYSA-N 387.889 2.828 0 50 GFAA C=CCN1C(=O)/C(=C\c2cc(Br)ccc2OCC)C(=O)NC1=S 1012450 YCRYWOSJEFCNKM-XFXZXTDPSA-N 395.278 2.661 0 50 GFAA Cc1cc(=O)[nH]c(SCC(=O)Nc2ccc(OC(F)(F)Cl)cc2)n1 1429984 KIWPTZCUXOSHKW-UHFFFAOYSA-N 375.784 2.977 0 50 GFAA COC(=O)[C@H]1CCCCN1C(=O)c1cc(COc2ccc(C)cc2OC)on1 11813323 NROHDHTZYYUTRX-MRXNPFEDSA-N 388.420 2.738 0 50 GFAA Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)Cn2nc3ccccc3n2)C1 12030008 WAMBKMMKKOQHTQ-QFIPXVFZSA-N 378.476 2.584 0 50 GFAA Cc1nnc(SCC(=O)N[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)o1 12094064 APOAFTZWPCSUBG-HNNXBMFYSA-N 380.901 2.904 0 50 GFAA CC(=O)N1CCCN(C(=O)C[C@@H](c2cccc(O)c2)c2ccccc2O)CC1 12716525 CSBIBMMAVUUMRA-FQEVSTJZSA-N 382.460 2.701 0 50 GFAA C[C@@H](NC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1)c1ccncn1 15065391 UXCGQAXHPAOCSR-LLVKDONJSA-N 376.342 2.626 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2F)CCCN(C(=O)C2=C(C)OCCO2)C1 15080557 MGBLMVKDSBOCBY-NRFANRHFSA-N 391.439 2.818 0 50 GFAA Cc1cc(CNc2ccc(C(=O)NCC[C@H]3COc4ccccc4O3)cn2)no1 19840213 GZPWKKDZGXIFPF-KRWDZBQOSA-N 394.431 2.950 0 50 GFAA O=c1c2cnc3nc(-c4ccccc4Cl)nn3c2ccn1CCc1c[nH]cn1 20103283 ANOYTDCUAGQJAF-UHFFFAOYSA-N 391.822 2.725 0 50 GFAA CN(C(=O)N1CCC2(CC1)NC(COc1ccccc1)=NC2=O)c1ccccc1 63881713 FECRUYBPGOKMGK-UHFFFAOYSA-N 392.459 2.685 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1 65365102 RDAAMGXSMZPHGA-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)NCCCc2ccc(C(C)C)cc2)CC1 67603746 UPMDWBWUSDNSDL-UHFFFAOYSA-N 380.554 2.921 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2ccc(-n3cccn3)nn2)CC1 67614074 LFGLSMQJCJTWDB-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CC[C@@H](OC)C(=O)NCc1cccnc1N1CCN(c2ccccc2C)CC1 67908879 AIZGWRBTWLCZEE-HXUWFJFHSA-N 382.508 2.758 0 50 GFAA O=C(NCC(F)F)[C@@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 71747589 KFCKSYRXFKXRMJ-GOSISDBHSA-N 379.495 2.787 0 50 GFAA COc1ccccc1CN1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71763837 ZENCUWWUELSXMY-FQEVSTJZSA-N 385.552 2.994 0 50 GFAA NCCCC(=O)N1CCC[C@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)C1 72161700 ZBXOVIBEVGOTQQ-SFHVURJKSA-N 398.473 2.557 0 50 GFAA Cc1cc(C)c2c(C(=O)N3CC4(CCNCC4)C[C@@H]3C(=O)O)cc(C)nc2c1 72161800 KYUOSCPNOBGVMC-GOSISDBHSA-N 381.476 2.829 0 50 GFAA O=C(c1ccc2ccccc2c1)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 82230291 BVCJICFZVLIRQW-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA CCn1cc(S(=O)(=O)N[C@@H]2CCCc3nc(-c4ccccc4)ncc32)cn1 91382224 YBPVQYOYJBFOLA-GOSISDBHSA-N 383.477 2.716 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)NCCc3ccc(C)o3)CC2=O)cc1Cl 91593747 IFLXIBNNRCWTRH-ZDUSSCGKSA-N 376.840 2.962 0 50 GFAA CCCc1nnsc1C(=O)N1CC[C@]2(CCCN(CC3CCC3)C2=O)C1 91694559 GQAKBAHDZQHYLD-LJQANCHMSA-N 376.526 2.745 0 50 GFAA O=C(O)c1cccc([C@H]2CCCN(C(=O)Cn3cnc4ccsc4c3=O)C2)c1 95367454 NGSIYCYTNNKHER-HNNXBMFYSA-N 397.456 2.562 0 50 GFAA O=C(CCc1ccsc1)N1CCC2(CC1)CC(=O)N(C[C@H]1CCCO1)C2 95370996 CCPYCRLQRBDZST-QGZVFWFLSA-N 376.522 2.701 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(Cc2cccc(O)c2)CC3)cn1 95508502 OJWCOLGUHGILQR-UHFFFAOYSA-N 380.492 2.895 0 50 GFAA O=C(Nc1cnc(-c2ccccc2)nc1)N1CCC[C@H](CN2CCOCC2)C1 112204254 PPMPDVPTYPMPNZ-QGZVFWFLSA-N 381.480 2.720 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@H](Sc2nnnn2C2CCOCC2)C1=O 117111930 DNAAZHYTMNBAAB-INIZCTEOSA-N 391.472 2.760 0 50 GFAA O=C(NC[C@H](O)c1ccccc1Cl)c1nc(N2CCCC2)ncc1Cl 130228379 QBKRBXGAXZYMQB-AWEZNQCLSA-N 381.263 2.847 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 136305378 RTARCSWGSRIDLF-UOVPBQLFSA-N 376.884 2.731 0 50 GFAA CN1CCN(c2ccc(CNC(=O)N3CCc4c(Cl)cccc43)cn2)CC1 163050592 BUYSUHBPZIAQKR-UHFFFAOYSA-N 385.899 2.759 0 50 GFAA O=C(Cc1cccc(F)c1)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779738 BPNOUVVFRNJEIF-UHFFFAOYSA-N 380.423 2.648 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)c2nnn(-c3ccc(OC)cc3)c2C)o1 172499531 MESPYKUDMQBQFT-GOSISDBHSA-N 396.447 2.953 0 50 GFAA CC(C)[C@H](NCc1ncc(-c2ccccc2Cl)o1)C(=O)N1CCOCC1 180057702 NAUJDNRKCJRJCC-SFHVURJKSA-N 377.872 2.968 0 50 GFAA Cc1noc(-c2ccc(C(=O)NC3CCC(Oc4cnccn4)CC3)cc2)n1 188254466 BSEWLPBVIDNJQO-UHFFFAOYSA-N 379.420 2.955 0 50 GFAA Cc1cccc2c1OCC[C@@H]2NC(=O)CNC(=O)c1ccccc1OC(F)F 190613936 RWVZZDTUDSGQCY-HNNXBMFYSA-N 390.386 2.966 0 50 GFAA Cc1ccsc1[C@H]1CCN(C(=O)COCc2nc3ccccc3[nH]2)C[C@@H]1O 212879477 JTYYWFGBCBHEKD-YOEHRIQHSA-N 385.489 2.826 0 50 GFAA Cc1ccc(O)c(NS(=O)(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)c1 253425303 SDGNONDSXSPGQP-UHFFFAOYSA-N 375.855 2.558 0 50 GFAA COc1cc(NC(=O)N2CCC(c3nc(C)no3)CC2)ccc1N1CCCC1=O 264290342 RGSXVAUAGFRZSX-UHFFFAOYSA-N 399.451 2.925 0 50 GFAA Cc1cccc2c(CCC(=O)N3CC[C@H](N(C)Cc4nccc(N)n4)C3)c[nH]c12 276345892 HMBRUSKYPVXPBB-KRWDZBQOSA-N 392.507 2.514 0 50 GFAA O=C1COc2cc(C(=O)N[C@@]3(Cc4ccc(Cl)cc4)CCOC3)ccc2N1 282271219 XJWQSPXSYSJADS-HXUWFJFHSA-N 386.835 2.803 0 50 GFAA CNC(=O)C1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)CC1 287168304 JHDYFGUNLWOJBB-PBDJWPIDSA-N 385.508 2.505 0 50 GFAA C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N(CC(=O)O)C1CCOCC1 299747313 CONPHDRJSLLPSL-JTQLQIEISA-N 376.236 2.853 0 50 GFAA O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 332793295 BRZQQLPVXLDEGU-OPNNQBFTSA-N 375.513 2.567 0 50 GFAA Cc1ccc(-c2cc(C(=O)N[C@@H](c3nc(-c4nc[nH]n4)no3)C(C)C)no2)cc1 334161941 HMYFTPOWKSZIPQ-OAHLLOKOSA-N 393.407 2.945 0 50 GFAA CN1CCC(NC(=O)N(Cc2ccncc2)Cc2ccc3c(c2)OCO3)CC1 426491532 MNDSRQPGHDDWPZ-UHFFFAOYSA-N 382.464 2.616 0 50 GFAA C[C@H]1CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C[C@@H](C)N1CCO 456227263 PBSDJKKXEOMITL-BETUJISGSA-N 379.913 2.991 0 50 GFAA CC1=C[C@]23C(=O)[C@H](C=C4COC(C)(C)O[C@H]4[C@]2(O)[C@H]1O)[C@H]1[C@@H](C[C@H]3C)C1(C)C 498035591 ONMDPPVVEFWDOD-FWYWUCQLSA-N 388.504 2.614 0 50 GFAA CCc1nc(CCNC(=O)N2CCC[C@H](Cc3nc4ccccc4[nH]3)C2)no1 584892460 CUPCWGDUOGBLDJ-CQSZACIVSA-N 382.468 2.715 0 50 GFAA Cc1sc(NC(=O)Cc2nnn(C(C)(C)C)n2)c(C(N)=O)c1-c1ccccc1 857574511 UDMGNRWYJYAUEN-UHFFFAOYSA-N 398.492 2.745 0 50 GFAA Cc1cc(N2CCN(c3noc(C4CC4)n3)CC2)nc(-c2ccccc2O)n1 1506398907 HKKKHVYGJGGXPA-UHFFFAOYSA-N 378.436 2.745 0 50 GFAA COC[C@H](C)N(Cc1cccc(F)c1)C(=O)c1ccc(-c2nnn(C)n2)cc1 1506417417 IHMTXTBFEVJGGA-AWEZNQCLSA-N 383.427 2.694 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(N3C[C@H](C)O[C@H](C)C3)CC2)cc1F 1529195877 PCBIKSBKDVVKTD-BIENJYKASA-N 380.460 2.534 0 50 GFAA Cc1cc(N2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)c2cc3c(cc2n1)OCO3 1704330015 SVNMKQZZRLRQIU-CTNGQTDRSA-N 383.448 2.647 0 50 GFAA Cc1nnc(CCNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)s1 1772819199 GWQNZVRLAFDTOV-CYBMUJFWSA-N 385.518 2.829 0 50 GFAA CCOc1ccc(CCCC(=O)N2CCC3(CC2)CC(=O)NCCO3)cc1C 1857689242 KMTFKLNUARYHPC-UHFFFAOYSA-N 388.508 2.614 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)CCCOc1ccccc1 1857695985 HKCCVJFMWDTCBQ-OEWRPIJISA-N 382.508 2.606 0 50 GFAA Cc1nn(C)c(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)c1C 1857729893 VNYRHSSYLMHGGC-RTBURBONSA-N 383.492 2.924 0 50 GFAA Cc1ccc(-n2nc(COc3cccc(F)c3)nc2[C@H]2C[C@@H](N)[C@H](O)C2)cc1 1857735185 LVMMIGUHDIYORQ-GDIGMMSISA-N 382.439 2.859 0 50 GFAA CCC(=O)N[C@H](C(=O)N1CCC(C2(C(=O)OC)CCC2)CC1)c1ccccc1 1875298353 XVYYPWLYCXDYCJ-IBGZPJMESA-N 386.492 2.836 0 50 GFAA Cc1cn(COC(=O)[C@@H]2C[C@@H](OC(F)F)CN2C(=O)OC(C)(C)C)c(C)n1 1875339908 CLUJYQAPSPTVIN-OLZOCXBDSA-N 389.399 2.618 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOc3cc(Br)c(F)cc32)CC1 1875382830 SYQZFWNMYIBSFJ-UHFFFAOYSA-N 397.244 2.738 0 50 GFAA C[C@@](O)(Cc1cn(C[C@@H](O)CCOCc2ccccc2)nn1)c1cccs1 2325772818 OXVLHDVAWNXBQU-AZUAARDMSA-N 387.505 2.758 0 50 GFAA Cc1cccc(-c2noc(CCC(=O)N3CCC[C@@]34CCCN(C)C4=O)n2)c1 2356135433 DVNXGBTXEJIEQS-OAQYLSRUSA-N 382.464 2.591 0 50 GFAA Cc1cccc(CCCNC(=O)[C@H]2OCC(=O)N(C3CC3)[C@@H]2c2cccnc2)c1 2356152871 FFABGRYPLAMFOA-YADHBBJMSA-N 393.487 2.570 0 50 GFAA Cc1cc(CN(C)C(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)ccn1 2356157556 LHKJQCKQLFZBFU-FHJLPGHOSA-N 390.487 2.680 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1 2356167188 USBHYDIDSRJWJB-TXTKFYIRSA-N 399.535 2.653 0 50 GFAA Cc1nc(/C=C/C(=O)NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@@H](C)O3)cs1 115921274 KVPMXAQQNLIKNL-CDAZIORVSA-N 398.893 2.947 0 50 GFAA C[C@H](CNC(=O)N(CCc1ccccc1)Cc1cccnc1)N1CCOCC1 52524581 DFGIFZVRHVLYED-LJQANCHMSA-N 382.508 2.557 0 50 GFAA CC(=O)NCC1CCN(Cc2ccccc2-c2nc(CC(C)C)cc(=O)[nH]2)CC1 67850943 MNNOFPQGSZKOHZ-UHFFFAOYSA-N 396.535 2.984 0 50 GFAA COc1ccc(CNC(=O)c2c(O)c3cccc4c3n(c2=O)[C@@H](C)C4)cc1OC 170624701 IOSXMFVPHNQBRQ-LBPRGKRZSA-N 394.427 2.771 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)NC[C@@H]4CCN(C)C4)co3)ccc2s1 67966110 ROBZGZXYQZLFEI-ZDUSSCGKSA-N 386.477 2.853 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@@H](O)c3ccc(C)cc3)c2C)cc1 252496009 PEGHXXXLROMOSZ-HXUWFJFHSA-N 378.476 2.969 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCC[C@@H]2OCC[C@H]21)n1c(S)nnc1-c1cccs1 230227090 LPGQDESJQXVDIX-XQHKEYJVSA-N 378.523 2.930 0 50 GFAA Cc1cc(=O)c(O)c([C@@H](CC(N)=O)c2ccc(-c3cccc(C(=O)O)c3)o2)o1 217609459 ZSCVQSSIQMVMLU-ZDUSSCGKSA-N 383.356 2.619 0 50 GFAA biogenic Cc1cnn([C@@H]2CCCN(C(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)C2)c1 151707061 MLIRURIHOSNFGV-OAHLLOKOSA-N 397.447 2.594 0 50 GFAA O=C(NC1CCCCC1)[C@H]1CCCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 32094145 OIRDIEYVSPTORY-LBPRGKRZSA-N 396.417 2.808 0 50 GFAA c1ccc(-c2nc3c(c(NC[C@H]4OCCc5ccccc54)n2)CCNCC3)nc1 72419240 XGSLOWKHMXUBGQ-OAQYLSRUSA-N 387.487 2.953 0 50 GFAA C[C@H](C(=O)Nc1ccc(N2CCCC2)c(F)c1)N1C(=O)NC2(CCCC2)C1=O 363375941 FMYSDUMOQALOPA-CYBMUJFWSA-N 388.443 2.618 0 50 GFAA COc1ccccc1[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1 363415823 KDVJXPCSGJZOIL-QGZVFWFLSA-N 377.448 2.975 0 50 GFAA Cc1nn(C)cc1[C@H]1CCCN1C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 363923885 SZUQFCNVUCOKCR-GOSISDBHSA-N 385.468 2.565 0 50 GFAA O=C(Nc1cn(Cc2ccccc2)nn1)N1CCCN2c3ccccc3C[C@H]2C1 377821108 KWPKLQYAMXZFGB-IBGZPJMESA-N 388.475 2.995 0 50 GFAA C[C@H](NC(=O)N1C[C@@H](C)OC2(CCOCC2)C1)[C@H]1CCCN(C2CCC2)C1 333223734 SICVDFFILSYWCG-SQNIBIBYSA-N 379.545 2.619 0 50 GFAA Cc1nc2ccccc2n1CCNC(=O)N1CCC(OC[C@H]2CCCO2)CC1 378039556 FIRLIHGRYRMIKR-GOSISDBHSA-N 386.496 2.714 0 50 GFAA O=C(NC1CCN(C(=O)CCc2ccccc2C(=O)O)CC1)c1ccccc1 262106463 DYHUYKUSNMPUNL-UHFFFAOYSA-N 380.444 2.738 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc3ccccc3n2Cc2ccccc2F)CCO1 238143387 VUAQYFZQKCMZPZ-LJQANCHMSA-N 382.391 2.754 0 50 GFAA CN(C)c1noc([C@H]2CCCN(Cc3noc(-c4ccc(F)cc4F)n3)C2)n1 374534950 FVWILYDLESZVDU-NSHDSACASA-N 390.394 2.843 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC2(CC1)c1ccccc1C[C@H]2O 72141815 WPGGUNDDOSGKQF-HXUWFJFHSA-N 377.444 2.615 0 50 GFAA O=C(NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)N1CC2(CCCOC2)C1 376731314 YLVYOSLJQAOTLR-SFHVURJKSA-N 393.915 2.535 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2CCO[C@H](CC(=O)O)C2)cc1OCC 262706000 DFAKFKBYEMRBDV-CYBMUJFWSA-N 385.844 2.843 0 50 GFAA CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1cc(C(F)(F)F)ccc1O 241775915 RQDCCUYPVGYYTA-UHFFFAOYSA-N 375.324 2.934 0 50 GFAA CN(C)CCNC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 133378713 JSIGBAJZFOWILX-UHFFFAOYSA-N 377.492 2.959 0 50 GFAA NC(=O)C[C@H]1CCCN(C(=O)c2cccc(OCc3cn4ccccc4n3)c2)C1 174782366 BVWYVSRVJZJARQ-MRXNPFEDSA-N 392.459 2.641 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)[C@H]2CC(=O)Nc3ccccc32)C[C@@H]1c1ccccc1 456970742 YONUTSBAQZQLNP-RCCFBDPRSA-N 378.428 2.528 0 50 GFAA O=C(NC[C@H]1CCCN(CCc2ccccc2)C1)N1CCC(n2cnnc2)CC1 426399074 RVXKKOUJOFHOKT-HXUWFJFHSA-N 396.539 2.579 0 50 GFAA C[C@H](CNC(=O)N1CCC(NC(=O)C2CC2)CC1)c1nc(-c2ccccc2)no1 179335115 PTDHMCCBFWWUCW-CQSZACIVSA-N 397.479 2.540 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC[C@H](c3ccc(C(=O)O)cc3)C2)c1C 95363297 AXMYPMBZYIKQMV-SFHVURJKSA-N 383.448 2.807 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2ccc3c(c2)N(C)CC3)N2CCOCC2)o1 180244006 GRIAZPGTCYRLLF-LJQANCHMSA-N 384.480 2.775 0 50 GFAA CCc1cc(N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N3)nc(N(C)C)n1 95363190 UCQAAAMLZUYIJS-SFHVURJKSA-N 379.508 2.748 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ncc(C(C)C)s3)CC2)cc1 182947056 JGOPRTUUJHLCMM-UHFFFAOYSA-N 395.550 2.782 0 50 GFAA O=C(CCOc1ccccc1)N[C@H]1C[C@@H](c2cc(O)nc(N3CCCC3)n2)C1 253535359 VJYMAUIPYBMPHA-IYBDPMFKSA-N 382.464 2.614 0 50 GFAA COc1cccc(CNC(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1OC 299052406 QTOWLAZAFGZBRD-UHFFFAOYSA-N 397.475 2.808 0 50 GFAA CN(CCC(=O)O)C(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 299742305 BANQYBBXMDUQSD-UHFFFAOYSA-N 382.342 2.710 0 50 GFAA O=C(NCc1cccc(COC2CCOCC2)c1)Nc1nc2ccccn2n1 184342938 NTALPQYFXSTKSM-UHFFFAOYSA-N 381.436 2.747 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccco2)C1=O)Nc1nc2c(s1)CCCC2 252540396 PIXUAYZPNPFGDD-CYBMUJFWSA-N 388.449 2.659 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@@H](NCc2ccccc2OC)CNC3=O)cc1 263618977 WJBINPUMUBJFCL-HXUWFJFHSA-N 378.432 2.599 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc(CC(=O)NC3CC3)cc1)CC(=O)N2 824750814 ATHTXEPERZRLFV-SFHVURJKSA-N 393.443 2.581 0 50 GFAA CC[C@@H](C)C(=O)Nc1ccccc1C(=O)N1CCCN(c2ncccn2)CC1 822560168 YCDHPGRHTZKDAN-MRXNPFEDSA-N 381.480 2.814 0 50 GFAA O=C(NCCOc1ccc(Cl)cc1)N1CCCN(C(=O)c2ccco2)CC1 584903157 HLUBIOSHXZAXHS-UHFFFAOYSA-N 391.855 2.870 0 50 GFAA CC1(C)C[C@H](O)CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1 584895088 OFRIPDCCIBGBPO-LJQANCHMSA-N 377.504 2.983 0 50 GFAA C[C@H](NC(=O)Cc1ccc(NC(=O)C2CC2)cc1)c1nc(-c2ccccn2)no1 670470555 PASKERSDIICSJI-ZDUSSCGKSA-N 391.431 2.900 0 50 GFAA COc1ccc(CCCNC(=O)c2nn(C)c3c2C[C@H](C)O[C@@H]3C)cc1OC 1875401997 YBIZQIZSHGUPIP-UONOGXRCSA-N 387.480 2.822 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccncc2)CN(C(=O)CC[C@@]2(C)CCC(=O)N2)C1 952894317 ZFYRKZPOAVSFOL-JOCHJYFZSA-N 395.507 2.627 0 50 GFAA CC[C@H](Cc1ccccc1Br)C(=O)N1CCO[C@@H](CC(=O)O)C1 271920580 UTPWMNXUGZXPQE-OCCSQVGLSA-N 384.270 2.720 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)[C@@H]1Cc3ccccc3O1)CC2 277783937 XUTZYLHUQNBLED-UZLBHIALSA-N 397.427 2.608 0 50 GFAA Cc1cccc(C2(C(=O)N(C3CCC(O)CC3)S(C)(=O)=O)CCCC2)c1 170015828 ZVECCHGSMVVTHE-UHFFFAOYSA-N 379.522 2.899 0 50 GFAA O=C1C[C@]2(CCN(C(=O)NCc3ccc4cc[nH]c4n3)C2)Oc2ccccc21 413590652 UIPHJKZJRZBKPX-NRFANRHFSA-N 376.416 2.882 0 50 GFAA Cc1ccc(CC(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)c(Cl)c1 790786784 ZVNHWBOMJRDRBC-UHFFFAOYSA-N 391.836 2.746 0 50 GFAA Cn1c(NCC[C@@H](c2ccccc2)c2ccco2)nc2c1c(O)nc(=O)n2C 1529188778 COPUTAAGCUTOEN-AWEZNQCLSA-N 379.420 2.600 0 50 GFAA Cc1cc(=O)c(C2=NCCS[C@@H](c3ccc(O)c([N+](=O)[O-])c3)C2)c(O)o1 137749800 NJUUVHXLARNCTB-OAHLLOKOSA-N 376.390 2.935 0 50 GFAA O=C(c1cc(COc2ccc(F)c(F)c2)on1)N1CCN(CC2CC2)CC1 11844317 MYKSWRTVEWZDQG-UHFFFAOYSA-N 377.391 2.700 0 50 GFAA O=C(C[C@]1(c2ccccc2)CC(=O)N(Cc2cccs2)C1=O)N1CCCC1 12050440 FNWAKESSDYOIDN-OAQYLSRUSA-N 382.485 2.958 0 50 GFAA COC(=O)c1ccccc1NC(=O)CCSc1nnnn1-c1ccccc1 12274097 AKTZYKWCQWEWKH-UHFFFAOYSA-N 383.433 2.570 0 50 GFAA COc1ccc(C(=O)N(C)[C@H]2CCOC2)cc1OC1CCN(C(C)C)CC1 12314343 BQHNVCSYDSDMSD-KRWDZBQOSA-N 376.497 2.808 0 50 GFAA CCn1ccnc1CN1CCC(Oc2cc(OC)ccc2C(=O)NC2CC2)CC1 12433270 LVEIFNQMTUXLDC-UHFFFAOYSA-N 398.507 2.847 0 50 GFAA Cc1c([C@@H](C)NC(=O)CCn2cnnn2)cnn1-c1cccc2ccccc12 12585194 PIYKMFSVJWVODS-CQSZACIVSA-N 375.436 2.588 0 50 GFAA Cc1nc(CN(C)C[C@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)cs1 12747852 KKLCCYUDCLECQX-LJQANCHMSA-N 395.475 2.715 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NC(=O)CN3CCCCC3=O)C2)cc1 15064218 ZSJRSHLHFRBFBQ-NRFANRHFSA-N 385.552 2.978 0 50 GFAA CCCCOc1ccc(/C=c2/sc3nc(-c4ccncc4)nn3c2=O)cc1 1832384 VTULALYAUGQKEA-GHRIWEEISA-N 378.457 2.940 0 50 GFAA CC[C@H]1SC2=NC(C)=C(C(=O)OC)[C@H](c3ccc(OC(C)=O)cc3)N2C1=O 2533756 OJZBJKXWRMCKQR-ZBFHGGJFSA-N 388.445 2.824 0 50 GFAA NS(=O)(=O)c1ccc2nc(NC(=O)c3ccc4ccccc4n3)sc2c1 2554304 BWPWZSOAMZHENM-UHFFFAOYSA-N 384.442 2.744 0 50 GFAA CC[C@@]1(C(=O)NCc2cccs2)C[C@@H]2CC[C@H]1N2C(=O)CCc1cnccn1 1857677206 ZFPCFXOFTVNLDM-YRISNDGFSA-N 398.532 2.947 0 50 GFAA CCCN1CCC2(CC1)OCCc1cc(C(=O)NC[C@H]3CCOC3)sc12 1857684709 ZNKHLTNIMOQXJU-OAHLLOKOSA-N 378.538 2.788 0 50 GFAA Cn1nc(C(F)F)cc1C(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857709689 MANWZVUMYNSNKR-UHFFFAOYSA-N 385.418 2.999 0 50 GFAA COC(=O)c1cc(N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)ncn1 1857724988 IDQAISUGIXUYOG-HLLBOEOZSA-N 388.855 2.543 0 50 GFAA Cc1ncnc(N2C[C@@H]3[C@H](CNC(=O)C4(C)CCCC4)[C@H]4CC[C@]3(C2)O4)c1C 1857737576 TUIPOAGWHMJCHA-KCXPTXFHSA-N 384.524 2.774 0 50 GFAA CC(=O)NCc1cnc2c(c1)CN(C(=O)c1ccc(-c3cnco3)cc1)CC2 1875244746 SFHRGWTVJIGUJT-UHFFFAOYSA-N 376.416 2.571 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(Cc3ccc4nsnc4c3)C2)N1Cc1ccccn1 222067180 CIPHXVNTWNUDFZ-WBVHZDCISA-N 379.489 2.709 0 50 GFAA CCCOc1ccc(C(=O)N2CCN([C@H]3CCCN(C)C3)CC2)cc1OCC 363424042 ONDNYVCDXHMHKD-IBGZPJMESA-N 389.540 2.726 0 50 GFAA C[C@@]1(O)CCOC2(CCN(Cc3ccc(C(F)(F)F)cc3F)CC2)[C@H]1O 1704330664 ZXYQGZYHMHUMCY-JKSUJKDBSA-N 377.378 2.711 0 50 GFAA O=C(Nc1ccn(CCc2ccncc2)n1)[C@@H]1CCO[C@@H](c2ccccc2)O1 847413878 CNUVLJWKRXVFIN-GHTZIAJQSA-N 378.432 2.964 0 50 GFAA Cc1n[nH]c(C)c1C(=O)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100473213 GSSNZCFQXKNJGN-JOCHJYFZSA-N 380.492 2.866 0 50 GFAA Cc1nc(CCCNC(=O)c2ccc3nnc([C@@H](O)C(C)C)n3c2)sc1C 2100534326 CXDDUCYRDWNHPV-KRWDZBQOSA-N 387.509 2.855 0 50 GFAA O=C(O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(Br)cc1 4980119 WLCPIYKBYDOXRE-UHFFFAOYSA-N 398.278 2.767 0 50 GFAA O=C(c1ccc(F)cc1)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 11697642 YHWQLBZMEZFWDC-UHFFFAOYSA-N 378.411 2.717 0 50 GFAA O=C(c1ccc(Cl)c(N2CCCC2)n1)N1CC(O)(c2ccccc2F)C1 2325792789 LYJSKMUMCOCUBJ-UHFFFAOYSA-N 375.831 2.818 0 50 GFAA O=C(O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@@H]2CCCc3nn[nH]c32)CC1 910030927 ABCBGGYIGHLCBH-SJORKVTESA-N 382.464 2.722 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1OC 811955 BHTAZNWJTJOPMG-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA Cc1nn(CCCNC(=O)c2noc3c2C[C@H](C)CC3)cc1Br 2804403 GLLJQDGSPIZNFT-SNVBAGLBSA-N 381.274 2.887 0 50 GFAA COc1ccc(S(=O)(=O)NCCOC23CC4CC(CC(C4)C2)C3)cc1OC 4362687 GZWBHBIPYKEYFR-UHFFFAOYSA-N 395.521 2.968 0 50 GFAA COc1cccc(-c2nnc(SCC(=O)Nc3nc(C)cs3)n2C)c1 4736495 QJZYBXDBIMNREB-UHFFFAOYSA-N 375.479 2.986 0 50 GFAA C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)OCc1ccccc1 4760492 UVFGJKZMNXFIME-HOTGVXAUSA-N 384.432 2.549 0 50 GFAA Cc1nn(C)cc1CN(C)Cc1ccc(OC[C@H](O)CN2CCCCC2)cc1 11717367 XALRFSKCLBLDEK-OAQYLSRUSA-N 386.540 2.586 0 50 GFAA COc1cc(CN2C[C@H](Sc3ccccn3)C[C@H]2C(=O)N(C)C)ccc1O 11996113 GXEAZHFPFKBIRE-CVEARBPZSA-N 387.505 2.619 0 50 GFAA CCCNC(=O)N1CC[C@]2(CCCN(Cc3cccc(OC)c3OC)C2=O)C1 12030865 ZOLIQCCWHTWMGY-OAQYLSRUSA-N 389.496 2.638 0 50 GFAA O=C(NC[C@H]1OCCc2ccccc21)c1cn(Cc2c(F)cccc2F)nn1 12315149 DFNQVNFYPQRTGB-LJQANCHMSA-N 384.386 2.648 0 50 GFAA Cn1cc(/C=C/C(=O)N2CC[C@@]3(CCCN(CCc4ccccc4)C3)C2)cn1 12432008 CKSACKLLTUWYKZ-UPWIVDSGSA-N 378.520 2.991 0 50 GFAA Cc1cnccc1CN(C)C(=O)c1cc(COc2ccc3c(c2)OCO3)[nH]n1 12433384 UTMFXSMHAQDVRU-UHFFFAOYSA-N 380.404 2.693 0 50 GFAA Cc1nc[nH]c1CN1CC(=O)N(C2CCCCC2)C[C@@H](OCc2ccccn2)C1 14534955 LTWUWBHOKXWVHC-FQEVSTJZSA-N 397.523 2.675 0 50 GFAA COCCNC(=O)c1cccc(OC2CCN(Cc3cnc(C)s3)CC2)c1 19338808 BCSJPAUYHRXFGF-UHFFFAOYSA-N 389.521 2.871 0 50 GFAA Cc1ccc(CN2CCc3nnc(CCNC(=O)c4ccco4)n3CC2)c(C)c1 19745096 KQDCLDTYMBCZOH-UHFFFAOYSA-N 393.491 2.519 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38530400 ONJLATAZEUXNFJ-UHFFFAOYSA-N 389.862 2.832 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3cccc(F)c3)n2)c(F)c1 44901804 KGFONEPNSLQCIT-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA COc1ccc(-c2nn(CC(=O)Nc3cnn(C)n3)c3ccccc23)cc1F 48135020 HRAQHHVKSPRMSJ-UHFFFAOYSA-N 380.383 2.618 0 50 GFAA CC(C)C(=O)N1CCC(N2CCC[C@@]3(CCN(C(=O)c4ccco4)C3)C2)CC1 67696630 TYXBRERPPPUPIP-JOCHJYFZSA-N 387.524 2.855 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCC3(C(C)C)CC3)C2=O)c1 67740384 HNLWWNZHSVFRJE-NRFANRHFSA-N 378.488 2.714 0 50 GFAA O=C(Nc1ccccc1Cl)C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12 72153882 RLOFOKRNBKWDBH-UHFFFAOYSA-N 383.835 2.791 0 50 GFAA CCN1CCC[C@@H]1CN1Cc2ccc(C(=O)NCc3ccc(C)o3)cc2C1=O 72423255 WZUOEGSTAXWYMW-GOSISDBHSA-N 381.476 2.958 0 50 GFAA CC(C)CN1CCn2nc(CNC(=O)c3cc(-c4ccccc4)n[nH]3)cc2C1 91255832 FFHPLHCTBYIPRQ-UHFFFAOYSA-N 378.480 2.675 0 50 GFAA Cc1nn(C)c(C)c1CN1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91620284 FMYLENXQVYMNSE-UHFFFAOYSA-N 381.524 2.837 0 50 GFAA COCCn1cncc1CN1C[C@@](C)(Cc2ccc3c(c2)OCO3)CCC1=O 91942964 GHFKJZGKOPEHJT-OAQYLSRUSA-N 385.464 2.630 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NC(=O)c2cc(O)n[nH]2)cc1 92020113 IGRYUYIBHKYDFP-MRXNPFEDSA-N 381.436 2.753 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1C[C@H]2CC[C@@H]1CN(Cc1ccc(F)cc1)C2 95383446 NHPYADRZRLIQAL-MAUKXSAKSA-N 379.439 2.834 0 50 GFAA COc1cc(C(=O)N2CCC[C@H](c3nccn3Cc3cccnc3)C2)ccn1 95387690 POSALGGOJWJJBG-SFHVURJKSA-N 377.448 2.750 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)on1 95505946 RVHKKEMEDOXSEV-GOSISDBHSA-N 391.512 2.801 0 50 GFAA O=C(c1ccc2oc(Cc3ccc(Cl)cc3)nc2c1)N1CCOC[C@@H](O)C1 95530450 FLDPCZQOPPBXNZ-INIZCTEOSA-N 386.835 2.905 0 50 GFAA COCC(=O)Nc1ccc(Cl)c(NC(=O)NCCCn2cc(C)cn2)c1 96131763 ISRSEGWLKNNSIR-UHFFFAOYSA-N 379.848 2.642 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCC[C@@H](Cn3nc(C)nc3C)C2)[nH]n1 116778289 WFDGTBKOVWWBBB-MRXNPFEDSA-N 394.479 2.846 0 50 GFAA CCOC(=O)CN(C(=O)c1csc(-c2ncccn2)n1)c1ccccc1F 125199446 NQDGNIAQQWYCNP-UHFFFAOYSA-N 386.408 2.949 0 50 GFAA NC(=O)COc1ccccc1C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1 126510757 JHYGOSCNXRLAAU-AWEZNQCLSA-N 387.867 2.603 0 50 GFAA Cc1nc(CN2CCN(C(=O)Nc3cnn(Cc4ccccc4)c3)CC2)oc1C 129672324 OFXSYSNGMFIQQH-UHFFFAOYSA-N 394.479 2.886 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(F)c(F)c4)C3)nn2)n1 169778174 BXDYFBNDNMRPGQ-GFCCVEGCSA-N 388.378 2.817 0 50 GFAA COc1cccc2c1CCN(C(=O)NC1CCN(c3cc(C)nc(C)n3)CC1)C2 183966554 XTVQKECWEINEAX-UHFFFAOYSA-N 395.507 2.839 0 50 GFAA Cc1ccc(Cl)c(OC[C@@H](O)CSc2nnc(-c3cnccn3)n2C)c1 184720974 KJHDDMVVGCGDHG-GFCCVEGCSA-N 391.884 2.766 0 50 GFAA O=S(=O)(c1ccc(OC2CCOCC2)c(F)c1)N1CCc2cnccc21 187345361 SGADJFZUIQISDB-UHFFFAOYSA-N 378.425 2.530 0 50 GFAA O=C1C[C@@H](Cc2ccc(NC(=O)N3CCC(c4ccncc4)CC3)cc2)C(=O)N1 191908175 QUQRLDDSJZFZNU-GOSISDBHSA-N 392.459 2.698 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 232756913 MVYPYIUVWYRYHQ-HNNXBMFYSA-N 380.491 2.562 0 50 GFAA NC[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)C1CC1 238085402 AWUOLYCQEQMCCF-WOJBJXKFSA-N 397.906 2.761 0 50 GFAA CC(C)[C@@]12O[C@H]3[C@H]4C[C@H]([C@H]3O)[C@@H](C(=O)N1c1ccc(Br)cc1)[C@@H]42 238900250 IFAYFRXLRHFRHC-DDHKBXJMSA-N 378.266 2.790 0 50 GFAA C[C@H](OC(=O)CNC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H]1CCCC[C@H]1C 239667479 BQJXBYONTMNTDU-DVOMOZLQSA-N 380.872 2.696 0 50 GFAA COc1ccc(OCCN(C)CN2C(=O)N[C@]3(C2=O)[C@@H](C)CCC[C@H]3C)cc1 249233258 KYJFKRCKPVDENJ-JIPZTSHUSA-N 389.496 2.710 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)C1 262618095 IDEJKXWVEHUESO-VQIMIIECSA-N 386.517 2.860 0 50 GFAA CCOC(=O)[C@@H](NC(=O)c1cncs1)c1ccc(OC)c(Br)c1 272631047 ZWJLMRFOBQSPCF-ZDUSSCGKSA-N 399.266 2.948 0 50 GFAA O=C(CN1[C@H](C(=O)O)C[C@H]2CCCC[C@H]21)Nc1ccc(Br)cn1 274715137 AWPZCEMQTYBTFZ-RTXFEEFZSA-N 382.258 2.500 0 50 GFAA CNS(=O)(=O)c1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)nc1 296555873 CDVPWMXTMHCJJR-QGZVFWFLSA-N 386.477 2.749 0 50 GFAA Cc1ncsc1CCCNC(=O)[C@H]1CC(Cc2ccc3c(c2)OCO3)=NO1 299763828 FBUNEWNHSKUIJC-QGZVFWFLSA-N 387.461 2.617 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(OC[C@H]2CCCCO2)CC1 363357859 WUUXNXAQJFMIJL-LJQANCHMSA-N 399.495 2.527 0 50 GFAA Nc1nccc(-c2ccc(C(=O)NCc3nc(C4CCCCC4)no3)cc2)n1 426689898 QPCCLVJMYWEQEX-UHFFFAOYSA-N 378.436 3.087 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cn1 584900661 JHINRPVQTOPWAK-CQSZACIVSA-N 375.860 2.503 0 50 GFAA O=S(=O)(NCCOc1cccc2cccnc12)c1cccc2nsnc12 670457970 SIONHVXVPSOJRJ-UHFFFAOYSA-N 386.458 2.597 0 50 GFAA Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cccs3)C2)cc1N1CCNC1=O 670472377 ACYCOYMBZFDSON-KRWDZBQOSA-N 398.532 2.981 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cnccc1C 788412535 FCVQZDNDPKOXMM-GFCCVEGCSA-N 398.868 2.576 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)NCCOc1cccc2cccnc12 827819922 GGWHPLOQCGXZOI-UHFFFAOYSA-N 375.428 2.776 0 50 GFAA Cc1nccn1CCC(=O)N1CCC2(CC1)CN(Cc1ccsc1)CCO2 827921125 MBGPUARQXZSNBJ-UHFFFAOYSA-N 388.537 2.537 0 50 GFAA Cc1ccnc(N[C@@H]2CN(C(=O)c3cnccn3)CC[C@H]2c2ccc(F)cc2)n1 888103618 QDXQSKVXOMBPFJ-PKOBYXMFSA-N 392.438 2.825 0 50 GFAA COc1cc2nc(N3CCC(Nc4ccccn4)CC3)nc(N)c2cc1OC 895350192 DIOROBRJQYLQMG-UHFFFAOYSA-N 380.452 2.705 0 50 GFAA CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)Cc1cc(=O)n(CC(C)C)[nH]1 934441933 KITWHAOCWZSMJF-IBGZPJMESA-N 391.487 2.732 0 50 GFAA Oc1nc2ccc(CNCc3cc4ccccc4nc3N3CCOCC3)cc2[nH]1 952979053 MPUZYADLSREJRB-UHFFFAOYSA-N 389.459 2.943 0 50 GFAA Cc1ncnc(N2CCN(C(=O)c3cnc(Nc4ccccc4)nc3)CC2)c1C 1506428284 OPDJWWLCDNTWQT-UHFFFAOYSA-N 389.463 2.589 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(Cc3cnn(-c4ccccc4)c3)C2)N1Cc1cscn1 1565509218 VGEDBKTUSMUQKU-XLIONFOSSA-N 393.516 2.952 0 50 GFAA Cc1nn(CC(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccc2)C3)c(C)c1C 1565510787 DAOMNLDHTXXQPR-QUCCMNQESA-N 380.492 2.572 0 50 GFAA CCOc1cc(Cl)c(CN2CC[C@H](O)[C@@]3(CCCNC3=O)C2)cc1OCC 1857695150 WLJJPAHXHXFXCB-AZUAARDMSA-N 396.915 2.600 0 50 GFAA O=C(O)[C@H]1CN(CCc2ccccc2)CC12CCN(C(=O)C1CC=CC1)CC2 1857703780 RKCZNBBNKVTFTQ-HXUWFJFHSA-N 382.504 2.821 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cncc(F)c2)N1Cc1cc2ccccc2o1 1857704123 DZRMQZFWQVSVOW-ROUUACIJSA-N 379.391 2.983 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)cn1 1857708170 ISIIZCKVDISTKW-RTBURBONSA-N 382.460 2.978 0 50 GFAA CCOCCNC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)C1CCC1 1857711472 BNNSECBPOYEIHW-MIZPHKNDSA-N 384.520 2.932 0 50 GFAA O=C1CCOC2(CCN(C(=O)CCc3ccc(-c4cccs4)o3)CC2)CN1 1857730920 CNPCRBQDKNAMME-UHFFFAOYSA-N 388.489 2.838 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](C(C)C)CN4C3)c2)n1 1875246162 JGTMCVXWCQKSHJ-HLAWJBBLSA-N 382.508 2.717 0 50 GFAA Cc1nnc([C@@H]2CCCN2C(=O)NCC2(N3CCSCC3)CCCC2)o1 1875256185 SKVXQMFLNZRBJY-HNNXBMFYSA-N 379.530 2.586 0 50 GFAA CCc1nsc(N2CCN(C(=O)c3ccc4c(c3)ncn4C(C)C)CC2)n1 1875264435 XUHQTEQDMITTSS-UHFFFAOYSA-N 384.509 2.994 0 50 GFAA O=C(CCC(=O)c1ccc2c(c1)CCC2)N[C@H](CCc1ccncc1)C(=O)O 1875277412 KVSUSNSBAOWCJH-LJQANCHMSA-N 380.444 2.735 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCCC[C@H]3[C@@H](C)NC(=O)c3cocn3)n[nH]2)o1 1875342114 YFQSJCTVNJNEFA-DYVFJYSZSA-N 397.435 2.779 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CC[C@H](c2ccon2)C1 2325774508 QOCGOXZLUYGJAK-ZBEGNZNMSA-N 392.818 2.772 0 50 GFAA CCN(CC)C(=O)c1ccc(-c2cnc3cncc(N4CCC(O)CC4)n23)cc1 2356155253 DKJNUHOLVNXPNY-UHFFFAOYSA-N 393.491 2.839 0 50 GFAA COc1ccc(CC(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1 892664 HFNSPSIPJZVXRG-UHFFFAOYSA-N 376.459 2.890 0 50 GFAA Cc1csc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2N)n1 2872311 XBNKCELKRPSRHP-UHFFFAOYSA-N 380.886 2.808 0 50 GFAA COC1(CN(C)C)CCN(Cc2ccc(O[C@H](C)C(=O)O)c(Cl)c2)CC1 2356158521 NJQCDTUTUHQHLI-CQSZACIVSA-N 384.904 2.735 0 50 GFAA Cc1cc(Br)ccc1NC(=O)C(=O)NCc1ccc2c(c1)OCO2 4856715 OROATWJVZMCOEN-UHFFFAOYSA-N 391.221 2.741 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)ccc1NCc1cccnc1 4954492 PMIVVJRCJYEVKM-HZPDHXFCSA-N 377.400 2.848 0 50 GFAA O=C([C@@H]1CCCO1)N1CCN(C(=S)Nc2ccccc2C(F)(F)F)CC1 8682702 ZQWDGNPUZKZRDO-AWEZNQCLSA-N 387.427 2.725 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NCc1ccnc(-n2cccn2)c1 134252766 DFDZMOZGUDNSCR-UHFFFAOYSA-N 392.385 2.502 0 50 GFAA COc1ccc(NC(=O)N2C[C@H](OC)Cc3ccccc32)cc1S(C)(=O)=O 417348043 IGQFIKXAERUQMT-OAHLLOKOSA-N 390.461 2.708 0 50 GFAA O=C(NCCc1nc(-c2cccc(Cl)c2)no1)c1ccnc(-n2ccnc2)c1 114695374 CNBIWFRZJYUIPV-UHFFFAOYSA-N 394.822 2.943 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)[C@H]2CC(=O)N(C)C2)CCO3)s1 67805014 QFNNLJMRPMJDDM-HNNXBMFYSA-N 386.473 2.628 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc4c(c3)C(=O)N(C)CC4)cn2)n1 151088393 CLKBDUMNNJAVGB-UHFFFAOYSA-N 375.432 2.765 0 50 GFAA O=C([C@@H]1C[C@H]1c1cccnc1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328636885 VSYZIVSKNKNLMW-GBESFXJTSA-N 378.476 2.860 0 50 GFAA c1ccc(Cc2nnc(N3CC[C@@H](C4CCOCC4)C3)n2C[C@@H]2CCCO2)nc1 328855920 UCVARPXBYSHWLQ-QUCCMNQESA-N 397.523 2.696 0 50 GFAA CCn1c(-c2cnn(C)c2)nnc1N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 333944640 SDVAKXHOBMPPOF-CQSZACIVSA-N 398.433 2.884 0 50 GFAA CN(C)CCCN(C)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71715357 GKWCYEQYQKXALS-XMMPIXPASA-N 393.531 2.944 0 50 GFAA C[C@H](C(=O)O)[C@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1 237634921 OIKRWSKRYDJDAW-WFASDCNBSA-N 388.855 2.922 0 50 GFAA O=C1NCCN(C(=O)c2cc(C3CC3)on2)[C@H]1c1ccc(C(F)(F)F)cc1 369760607 PYFBMXVYFQJZMT-HNNXBMFYSA-N 379.338 2.884 0 50 GFAA Cc1noc(C)c1CCC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1 262700549 CDRZKMLBOASCSK-SFHVURJKSA-N 399.447 2.942 0 50 GFAA O=C(N[C@@H]1c2ccccc2C[C@@H]1O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 131056084 HMWNQOWDRXIDLH-LSTHTHJFSA-N 379.460 2.705 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)N3CCCCC[C@H]3CCO)CC2)oc1C 496221872 KIZJPXIYXUIKSW-IBGZPJMESA-N 392.544 2.840 0 50 GFAA COc1ccc(Br)cc1CN(C)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 241124132 JFWCGZZFOFAZJS-HUUCEWRRSA-N 393.281 2.798 0 50 GFAA COc1ccc(N2CCN(C(=O)[C@@H](C)Cc3cnc4ccccc4n3)CC2)nc1 457024177 OERFLXYDKBIUCA-INIZCTEOSA-N 391.475 2.561 0 50 GFAA O=C(COc1ccccc1CN1CCO[C@H](C(F)(F)F)C1)N1CCCCC1 71774399 SVGVHOHMVNMUOQ-KRWDZBQOSA-N 386.414 2.841 0 50 GFAA Cc1ccc(C(=O)N[C@H]2CC(=O)N(C3CC3)C2)cc1NC(=O)c1ccccc1 176804326 CZWSAPIXTCHMHB-KRWDZBQOSA-N 377.444 2.740 0 50 GFAA Cc1nn(CC(=O)N[C@H](C)c2nc3c(s2)CCCC3)c(=O)c2ccccc12 223525605 DFOZTWTZXMWNMI-CYBMUJFWSA-N 382.489 2.918 0 50 GFAA COc1ccc2cc([C@@H]3CN(C(=O)NCc4nnc(C)o4)CCO3)ccc2c1 426380755 VVMKKZKRUOVNAO-SFHVURJKSA-N 382.420 2.823 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(C(=O)CCCc3nc(-c4cccnc4)no3)C2)n1 426386856 FAYJPDDHMPUUDK-QGZVFWFLSA-N 380.452 2.741 0 50 GFAA Cc1cccc2cc(C(=O)NC[C@H](c3cccnc3)N3CCOCC3)n(C)c12 95379660 IWBSAQRECBCMKK-HXUWFJFHSA-N 378.476 2.685 0 50 GFAA CC1(C)[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C[C@H]2[S@@]1=O 21992703 AZIUCAWYSMPKQK-QMALHXIISA-N 383.469 2.787 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4ccccn4)C3)C2)o1 95525205 YCMXSLGJEWCMQA-QFIPXVFZSA-N 397.475 2.771 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCC[C@H](CNC(=O)c4cccnc4)C3)[nH]n2)o1 95497857 WIRTYYPNPPEAOH-OAHLLOKOSA-N 393.447 2.655 0 50 GFAA COCCCCN1CCN(C(=O)Nc2ccc(Cl)c(C(=O)OC)c2)CC1 96131600 DTKTTWCQHZIYCW-UHFFFAOYSA-N 383.876 2.703 0 50 GFAA CN1CC2(CCC1=O)CCN(CCC(=O)NCc1ccc(Cl)cc1)CC2 91933155 QRFOUAOVRGKDAD-UHFFFAOYSA-N 377.916 2.681 0 50 GFAA CCOC(=O)N1CCC(NCc2cc3n(n2)CCN(C2CCCCC2)C3)CC1 95375996 NVQUJGNHQZFMNY-UHFFFAOYSA-N 389.544 2.742 0 50 GFAA Cc1ccccc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 91595972 NAEAKBMGVXIOII-UHFFFAOYSA-N 378.476 2.644 0 50 GFAA CN(C)[C@@H](C(=O)NC1CCN(c2ccc(Cl)nn2)CC1)c1ccccc1F 91289504 JWXMMPHSENWMFV-GOSISDBHSA-N 391.878 2.657 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N2CCN(Cc3ccccc3)CC2)c1 97742783 IHHNAYYDFLVDGD-UHFFFAOYSA-N 380.492 2.715 0 50 GFAA Cc1cc2c(N3CCC(NCc4cnn5cccnc45)CC3)ncnc2s1 96151082 FVBZRETURPDFHI-UHFFFAOYSA-N 379.493 2.801 0 50 GFAA Cc1ncnc(N[C@@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)c1C 91518792 FCVQDIRXBSPRSL-QGZVFWFLSA-N 382.512 2.970 0 50 GFAA O=C(c1ccsc1)N1CCC2(CCN(Cc3ccncc3)CC2)[C@H](CO)C1 97213263 ZBXNJADDMZQZJB-IBGZPJMESA-N 385.533 2.880 0 50 GFAA CCc1nnc(NC(=O)CCN2CC[C@@]3(CC(=O)c4ccccc4O3)C2)s1 244763911 OXSPKUKKIAZPPZ-LJQANCHMSA-N 386.477 2.539 0 50 GFAA COc1ccc(F)cc1[C@@H](NC(=O)c1ccc2c(c1)ncn2C)[C@H]1C[C@@H](O)C1 252540162 OUKMRNOMEVSVIK-AGKSTNPPSA-N 383.423 2.963 0 50 GFAA CNC[C@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)C1 299740378 ZCHLWNAFOZCNOT-CYBMUJFWSA-N 377.286 2.625 0 50 GFAA Cc1cc2c(N3CCn4nc(CNC(=O)C5CCC5)cc4C3)ncnc2s1 534587491 AAOMKYKSXQUCJP-UHFFFAOYSA-N 382.493 2.633 0 50 GFAA CC(C)c1nc(C(=O)N2CCC[C@H](CCC(=O)N3CCN(C)CC3)C2)cs1 42992851 ROAJZYQLUBMIKL-MRXNPFEDSA-N 392.569 2.673 0 50 GFAA CC(C)CCOc1ccccc1CCNC(=O)N1CCC[C@](O)(CO)CC1 584895154 ISMBOHYNRACSTB-OAQYLSRUSA-N 378.513 2.573 0 50 GFAA O=C(N=c1cc(C2CCOCC2)o[nH]1)NC[C@@H](CO)c1ccc(Cl)cc1 1875257831 WXGFPAUQGIWRJP-AWEZNQCLSA-N 379.844 2.542 0 50 GFAA CCN(c1ccccc1C)S(=O)(=O)NC(=O)C[C@@H]1COCc2ccccc21 1875293903 HCDSFQRSFVTUAZ-QGZVFWFLSA-N 388.489 2.886 0 50 GFAA CC(C)(C)n1nccc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1 1875275895 KPNDBLKLEZBJBI-SFHVURJKSA-N 382.508 2.992 0 50 GFAA Fc1ccc(Cn2nc(-c3nc[nH]n3)nc2-c2cnn3ccccc23)cc1F 1875341229 LRBCMCHSNZBOCZ-UHFFFAOYSA-N 378.346 2.704 0 50 GFAA CC1(C)[C@@H](CN)CC[S@]1(=O)=NC(=O)c1csc(Nc2ccccn2)n1 1875358854 LRUBWIHNUYHBJF-SSINHNECSA-N 379.511 2.647 0 50 GFAA CO[C@H]1C[C@@H](CN)N(c2cc(N(C)Cc3cccc(C(F)(F)F)c3)ncn2)C1 1875394431 IQTGABHXYHFTFR-HOTGVXAUSA-N 395.429 2.684 0 50 GFAA C[C@H]1CCC(=O)N1c1cccc(NC(=O)Cn2ncc3ccccc3c2=O)c1 952969731 APUADAJMBRVQSP-AWEZNQCLSA-N 376.416 2.551 0 50 GFAA CCCc1nc(C(=O)N2C[C@H](c3ccc(OC)cc3)[C@@H](NC(C)=O)C2)cs1 1565525321 CNJXNOPORWIAEZ-SJORKVTESA-N 387.505 2.849 0 50 GFAA CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1SCCc2ccccc21)C(C)(C)O 1326067434 YHBMMSZUONWHSR-JKSUJKDBSA-N 394.537 2.797 0 50 GFAA COc1cc(OC)cc(N(C)C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)c1 191079644 HSGZQQSWBWXFQO-UHFFFAOYSA-N 387.827 2.674 0 50 GFAA O=C1CCCC[C@@H](C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)N1 193904056 LQNGWWGGGZEGQN-INIZCTEOSA-N 398.425 2.929 0 50 GFAA COc1ccc([C@@H](C)NC(=O)N(Cc2ccncc2)C[C@@H]2CCC(=O)N2)cc1 1506417951 UIOFDDZDNATQNF-QAPCUYQASA-N 382.464 2.642 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCCO2)cccc1C(=O)Nc1c2c(nn1C)CSC2 1529161790 QAJWJYJSANOKJS-INIZCTEOSA-N 386.477 2.845 0 50 GFAA O=C1CCCCN1c1ccc(S(=O)(=O)N2CCC[C@]3(CCC[C@H]3O)C2)cc1 1704297829 DEAPKEUKOMWWHA-UYAOXDASSA-N 392.521 2.519 0 50 GFAA Cc1cccc(C(=O)N2CCCN(C(=O)c3cccc4c3OCCO4)CC2)c1F 1704307071 SQAUKBUOCSVTAU-UHFFFAOYSA-N 398.434 2.894 0 50 GFAA O=C(NCCc1noc(C2CC2)n1)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 1772818428 DZAPHNSJARIFRP-CQSZACIVSA-N 395.488 2.929 0 50 GFAA Cn1cc(CC(=O)N2CCCN(c3noc(C4CC4)n3)CC2)c2ccccc21 1772813544 GRUZDBOKWFYDHZ-UHFFFAOYSA-N 379.464 2.720 0 50 GFAA Cc1occc1C(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCC(O)CC3)ncc21 11933985 BIKWVPDARXAPBD-KRWDZBQOSA-N 384.480 2.783 0 50 GFAA O=C1CCC(C(=O)N2CCO[C@H](CC(c3ccccc3)c3ccccc3)C2)=NN1 12477069 IBLJJXFQHIDJQO-LJQANCHMSA-N 391.471 2.702 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)[C@H]1CCCN(C2CCN(C(C)C)CC2)C1 12718212 NAPXSLPESJVIDQ-IBGZPJMESA-N 389.588 2.612 0 50 GFAA O=C(O)C1CCN([C@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2=O)CC1 13856348 MCATYWYBZHIWMS-IBGZPJMESA-N 394.427 2.907 0 50 GFAA Cn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NC1CCCCCC1)C2 14745679 LKQWHSSSAQCANJ-MRXNPFEDSA-N 376.570 2.779 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cn(CCCc2ccccc2)nn1 14972692 LVVJNSNJQXPHPS-NRFANRHFSA-N 389.503 2.915 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)c1cn(CCCc2ccccc2)nn1 15065217 UHOZHPGVKWPRHB-UHFFFAOYSA-N 378.480 2.785 0 50 GFAA O=C(O)c1ccc(N2C(=O)C[C@@H](N3CCC(Cc4ccccc4)CC3)C2=O)cc1 18105586 QNXAGDJPTCGKDF-HXUWFJFHSA-N 392.455 2.971 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cc(O)n1 1857720763 JFUOCOCYNBALRM-FPOVZHCZSA-N 381.476 2.774 0 50 GFAA Cc1ccccc1OCC(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857738371 FEAVNSOEVUJWGA-NOXFTYBFSA-N 392.455 2.675 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1857738660 RSZXKLYYKARNOT-UHFFFAOYSA-N 385.489 2.728 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)c2ccccc2OC(F)(F)C(F)F)C[C@@H]1O 1875247977 XKCXXNIRWBVMLO-WMLDXEAASA-N 393.377 2.909 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)N4CC(c5ccncc5)C4)CC3=O)sc2c1 1875250215 GNVGIPWUJBPYQF-OAHLLOKOSA-N 392.484 2.979 0 50 GFAA CCc1nc(NC(=O)N2CCc3c(cccc3S(=O)(=O)NC)C2)sc1C 367490411 SWXRWNMVTSMIHS-UHFFFAOYSA-N 394.522 2.512 0 50 GFAA CN1C[C@@H](C(=O)N2CCCN(c3ccc(F)c(F)c3)CC2)c2ccccc2C1=O 375204485 HMYSOFFJBAZPCH-GOSISDBHSA-N 399.441 2.873 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CCN(c2ccccn2)C1 162755909 CUPZKCMECNLJKO-FQEVSTJZSA-N 379.508 2.624 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)CCc3ccc4c(c3)OCO4)C1)CC2 1704301130 LMUOEJDAAODUBP-QFIPXVFZSA-N 379.460 2.953 0 50 GFAA CCOC(=O)c1nc(CCN)sc1NC(=O)c1ccccc1Br 2325801861 YSHGCYRBVSPLTJ-UHFFFAOYSA-N 398.282 2.836 0 50 GFAA Cn1ccc2ccc(C(=O)N3C[C@H](O)[C@H](Cc4ccnc5ccccc45)C3)nc21 2100543088 LLVBAXFSCMLRDB-UTKZUKDTSA-N 386.455 2.797 0 50 GFAA Cc1csc([C@@H](C)CNC(=O)C[C@H]2CN(C(=O)C3CC3)C3(CCC3)CO2)n1 2325785418 XMAFDTWPVOYGNU-BBRMVZONSA-N 391.537 2.621 0 50 GFAA C[C@H]1Cc2c(Br)cccc2CN1C(=O)[C@@H]1CCn2cnnc2C1 2325811645 LUESUTOHVNXSOY-NWDGAFQWSA-N 375.270 2.576 0 50 GFAA O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@@H]1CCCN1C1CCOCC1 134415187 BJQDXBQYWUPSBC-LIRRHRJNSA-N 395.906 2.817 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCC1)c1ccc(OCc2ccccc2)cc1 1110709 DQAQENDWSZIMQA-UHFFFAOYSA-N 388.489 2.654 0 50 GFAA CCOc1ccc(N(CC(=O)Nc2ccc(F)cc2F)S(C)(=O)=O)cc1 1122227 AVYVNSIWXGPACH-UHFFFAOYSA-N 384.404 2.768 0 50 GFAA O=C(N[C@]1(C(F)(F)F)N=C(O)N(Cc2ccccc2)C1=O)c1ccccc1 2376890 MEKDUFZIZUOACA-KRWDZBQOSA-N 377.322 2.631 0 50 GFAA COc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1Cl 4808054 OQNHWHBOTASBJA-UHFFFAOYSA-N 397.884 2.600 0 50 GFAA COc1cc(C(=O)N2N=C(C(F)F)C[C@@]2(O)C(F)F)ccc1OC(F)F 6490560 KWSMXDAEDNRVIZ-CQSZACIVSA-N 386.248 2.717 0 50 GFAA O=C(C1CCOCC1)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 11952712 UHSNQQNLKDVAQB-OAQYLSRUSA-N 392.446 2.733 0 50 GFAA O=C(c1cccc(OC2CCN(Cc3ccncc3)CC2)c1)N1CCC[C@H](O)C1 12308415 FCPCXVVLDWALBE-FQEVSTJZSA-N 395.503 2.722 0 50 GFAA C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCN(c2ncccn2)CC1 12380505 IBXNVGXHCGJTBW-LBPRGKRZSA-N 381.263 2.900 0 50 GFAA O[C@@H]1CN(CCCC(F)(F)F)CC[C@H]1N1CCN(c2ccccc2F)CC1 12443539 JRMHKEZQDNTQQI-QZTJIDSGSA-N 389.437 2.725 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(Cc4cnc(C)nc4)C3)C2=O)c1 12836575 RNQDXFLZXCEVRT-QFIPXVFZSA-N 380.492 2.808 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)NCc2cc(C(C)C)no2)CCC1=O 14956245 KMEGYEQPSQDGMU-MRXNPFEDSA-N 385.464 2.862 0 50 GFAA Cc1nc(CN2CCN(Cc3nc(-c4ccc5c(c4)OCO5)no3)CC2)cs1 20992348 QFRHMYWQEYVFDA-UHFFFAOYSA-N 399.476 2.548 0 50 GFAA O=c1[nH]c(-c2cccc(CN3CCC[C@H]3c3ccccn3)c2)nc2c1CNCC2 23505272 ZHDNNQDGVWCDCJ-NRFANRHFSA-N 387.487 2.815 0 50 GFAA Cc1cc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)c2c(C)noc2n1 41843763 IGGLWRYYGRDMSX-MRXNPFEDSA-N 384.436 2.544 0 50 GFAA CCn1cnc(NC(=O)c2cccc(CN3CCC[C@H]3c3nonc3C)c2)n1 65509262 IKSQLDSEBHAGEB-INIZCTEOSA-N 381.440 2.579 0 50 GFAA CCn1ccc(C(=O)N2CCCn3nc(-c4nc5ccccc5[nH]4)cc3C2)n1 67741090 IRIARDNZOWMWJB-UHFFFAOYSA-N 375.436 2.689 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)NCCc4cn[nH]c4)no3)ccc2s1 67804747 UJYLHUMBYVZCQV-UHFFFAOYSA-N 383.433 2.867 0 50 GFAA CC(C)c1ncc(C(=O)N2CCO[C@@H](Cc3ccccc3Cl)C2)c(=O)[nH]1 71745236 LBRNHACEEFDBKM-AWEZNQCLSA-N 375.856 2.630 0 50 GFAA O=C(O)c1ccc(CN2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1 71763799 YJTZDSKALHYHNO-HXUWFJFHSA-N 399.535 2.684 0 50 GFAA COc1ccc(C(=O)N2CCc3c(nc(-c4ccncc4)nc3N(C)C)C2)cc1 72131837 OGTWQMONNSUCNO-UHFFFAOYSA-N 389.459 2.812 0 50 GFAA C[C@H]1CN(C2CCN(c3nc(C(C)(C)C)nc4c3cnn4C)CC2)C[C@@H](C)O1 72145239 JNZBQLZAVVHLKS-GASCZTMLSA-N 386.544 2.739 0 50 GFAA O=C(O)c1cc(-n2cc3c(n2)CCC3)cc(S(=O)(=O)N2CCCCCC2)c1 72154896 XGINHEQHARJSTG-UHFFFAOYSA-N 389.477 2.624 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Nc3ccccc3OC)C2)CCC1=O 91650942 IYVNVMREKLHLED-FQEVSTJZSA-N 375.469 2.578 0 50 GFAA CC(C)C[C@H]1CN(C(=O)c2coc(COc3ccc4c(c3)OCO4)n2)CCO1 92096772 IDMKVXMTABABQN-HNNXBMFYSA-N 388.420 2.869 0 50 GFAA CCCOCC(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95368911 MECLBQOYUFQPSK-UHFFFAOYSA-N 380.435 2.733 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)COc3cccnc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95375611 OTPAPFVIAAOAGZ-MDNUFGMLSA-N 377.488 2.858 0 50 GFAA COc1cccc2c1OC[C@H](CNC(=O)C1CCN(Cc3ccco3)CC1)C2 95507131 XZEWLLMWJREENF-INIZCTEOSA-N 384.476 2.868 0 50 GFAA CN1CCC(N2CCC(CN(Cc3ccncc3)C(=O)c3cnco3)CC2)CC1 95516908 SZMDNGFTUISVAR-UHFFFAOYSA-N 397.523 2.518 0 50 GFAA CCCN1CCc2nc[nH]c2C12CCN(C(=O)[C@H](OC)c1ccccc1)CC2 95521541 OCYRHARKHATIOM-LJQANCHMSA-N 382.508 2.883 0 50 GFAA O=C(Cn1cc(C(F)(F)F)ccc1=O)NC[C@@H]1CCOc2ccccc2C1 97674466 GTUXZJNYLODLKQ-CYBMUJFWSA-N 380.366 2.625 0 50 GFAA Cn1ccnc1C[C@@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)C1 119985384 GKYKQIIARFBIRK-AWEZNQCLSA-N 389.883 2.869 0 50 GFAA CN[C@@H]1CCCN(C(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)C1 133272725 ZWLUGJYWWWUJDX-OAHLLOKOSA-N 395.429 2.656 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(C(C)C)C(=O)[C@@H]3ON2c2ccccc2)c(OC)c1 136231053 VVSVAJQQYLURHZ-XUVXKRRUSA-N 396.443 2.959 0 50 GFAA CCc1nc2cc(NC(=O)C(=O)N3CCO[C@H](c4ccc(C)o4)C3)ccc2o1 162886980 FKPFQULUWSYMOO-KRWDZBQOSA-N 383.404 2.830 0 50 GFAA CC[C@H]1CN(C)c2ccccc2CN1C(=O)Nc1ccc(=O)n(CCOC)c1 162950616 RCTSCRIDYKBCIF-SFHVURJKSA-N 384.480 2.757 0 50 GFAA O=C(c1ccc(Br)cc1O)N1CCN(c2cccc(F)c2)C(=O)C1 170596255 UCWLDNGRKDWVBY-UHFFFAOYSA-N 393.212 2.783 0 50 GFAA COc1ccc([C@@H](NC(=O)COc2ccccc2Cl)[C@H]2C[C@@H](O)C2)cn1 252536079 HOLLYXZAMANHKD-BIENJYKASA-N 376.840 2.751 0 50 GFAA Cc1noc(C)c1CN1CCN(Cc2ccccc2N2CCO[C@H](C)C2)CC1 253425016 NWBZPKBOTYEMEW-QGZVFWFLSA-N 384.524 2.834 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)[C@H]1CCCN1c1ncnc2sccc12 264020080 RHIIWBQCGQSMBQ-CQSZACIVSA-N 382.445 2.705 0 50 GFAA CC[C@H](C)[C@H](C(=O)N1CC[C@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276621546 WQLKTVJEPOBBHA-MDKPJZGXSA-N 381.524 2.921 0 50 GFAA CN(Cc1nccs1)[C@H]1CC12CCN(S(=O)(=O)c1cccc(F)c1)CC2 283166198 KQDLWYCAPKHDPQ-INIZCTEOSA-N 395.525 2.957 0 50 GFAA O=C(NCc1ccncc1OC[C@H]1CCOC1)c1cc(-c2ccccc2)[nH]n1 288453106 STMZKNVJBYZACL-HNNXBMFYSA-N 378.432 2.817 0 50 GFAA O=C1CC[C@]2(C(=O)N3CC[C@H](Oc4ccccn4)C3)Sc3ccccc3N12 330013762 AGKVPVWQJXUMKC-VBKZILBWSA-N 381.457 2.690 0 50 GFAA COc1cccc([C@@H]2C[C@H](C)CN2C(=O)NCCNC(=O)c2cccnc2)c1 363736344 GQHAQPLODRDBSK-KXBFYZLASA-N 382.464 2.613 0 50 GFAA Cc1ccc(-c2noc(CCCC(=O)NC(C)(C)c3nnc(N)s3)n2)cc1 426389540 YISMBSASPKBEFZ-UHFFFAOYSA-N 386.481 2.853 0 50 GFAA COc1cc(OC2CC2)ccc1C(=O)N1CCC([C@@H](O)c2nccn2C)CC1 790799944 JRJQXZCMRGUNDW-LJQANCHMSA-N 385.464 2.556 0 50 GFAA COc1cc(-c2nn3c([C@H]4CCCN(C)C4)nnc3s2)cc(OC)c1OC 824585960 WXFWIZUTLNZXFN-NSHDSACASA-N 389.481 2.688 0 50 GFAA Cc1ccc2oc(=O)n(CCC(=O)NCc3nncn3C3CCCCC3)c2c1 827823077 VLTKBQSSHCMJOI-UHFFFAOYSA-N 383.452 2.706 0 50 GFAA Cc1cnc(CN2CCC(c3ncc(C(=O)N4C[C@H](C)O[C@H](C)C4)o3)CC2)o1 888103036 AWYHBAFCHCYADT-GASCZTMLSA-N 388.468 2.600 0 50 GFAA CCC1(CC)CNC(=O)[C@@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 897344377 BJZDPOORGZNDTB-KRWDZBQOSA-N 377.916 2.839 0 50 GFAA CCN1CCC[C@@H](CN(C)S(=O)(=O)c2ccc3nc(O)cc(C)c3c2)C1 952975388 YYOPONXQPWOMLY-HNNXBMFYSA-N 377.510 2.601 0 50 GFAA O=C(NC1CCN(C[C@H]2CCCO2)CC1)C1(N2CCCCC2)CCCCC1 952983610 PZIRMVPLKIUHJR-HXUWFJFHSA-N 377.573 2.935 0 50 GFAA O=C(C[C@@H]1NC(=O)c2ccccc21)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 952984486 WNCZRQGRMOIYDZ-AWEZNQCLSA-N 391.431 2.682 0 50 GFAA Cc1ccc(-c2ccc(O)nn2)cc1NC(=O)CN1CCOc2ccccc2C1 952987571 FIDGGUBPZLJGIP-UHFFFAOYSA-N 390.443 2.991 0 50 GFAA Cc1sc(-c2cc(C(F)(F)F)n[nH]2)cc1S(=O)(=O)N[C@@H]1CCOC1 1506419779 XAXBFHMYSQMAKH-MRVPVSSYSA-N 381.401 2.533 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2C[C@@H]3CN(CC4CCC4)C[C@]3(C(=O)O)C2)c1 1565508605 KPOGNQRFMKKPKE-YWZLYKJASA-N 376.884 2.907 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1ccc(-n2cccn2)cc1 1565509098 KAMBDIZRUCDGOU-UZLBHIALSA-N 378.476 2.735 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccc2)C3)c(OC)n1 1565528125 JUMBOTGEEBWHPK-MSOLQXFVSA-N 381.476 2.835 0 50 GFAA CCc1cc(N[C@H](c2ccccc2)c2nccn2C)nc(N2CCOCC2)n1 1704299287 HVPQLTFMIIOVHP-LJQANCHMSA-N 378.480 2.811 0 50 GFAA Fc1cccc(OCc2nc([C@@H]3CCc4ncnn4C3)n(-c3ccccn3)n2)c1 1857679540 YKAGHSOXXAIBMQ-CQSZACIVSA-N 391.410 2.702 0 50 GFAA COc1cccc(C(=O)N2CCC[C@]3(C2)CN(c2ncccc2F)CC[C@H]3O)c1 1857684154 AVPHSQVOBJPDIU-DENIHFKCSA-N 399.466 2.723 0 50 GFAA COc1ccc2[nH]c(=O)c(-c3nccn3CCCN3CCCC[C@@H]3CO)cc2c1 1857691263 CMRMLBLMDSYPFS-QGZVFWFLSA-N 396.491 2.637 0 50 GFAA COc1ccc2cc1OCCCNCC(=O)NCCc1c([nH]c3ccccc13)C2 1857707432 RYUYUYGFGSAOOJ-UHFFFAOYSA-N 393.487 2.798 0 50 GFAA O=C(c1ccccc1F)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857712964 PCZSZOPGURISRX-VXKWHMMOSA-N 398.478 2.865 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)c3ccc(C)cc3)CC(=O)N2[C@H]1c1ccccc1 1857736293 NVCJNWJVVAVSAA-ZJOUEHCJSA-N 392.455 2.582 0 50 GFAA CC(=O)N1CCC[C@]2(CCc3c(N(C)Cc4c[nH]nc4C)nc(C4CC4)nc32)C1 1875242068 LZNOWBQTQJFXEB-QFIPXVFZSA-N 394.523 2.848 0 50 GFAA Cc1nn(-c2ccccc2)c2ncc(C(=O)N3C[C@@H]4CC[C@H]3[C@H]4C(=O)O)cc12 1875305844 JXQFNBTWCIPBNL-KKXDTOCCSA-N 376.416 2.664 0 50 GFAA CCn1nc2c(c1C(=O)NC1CCC(O)(c3cccnc3)CC1)C[C@H](C)O[C@@H]2C 1875313967 AMXTWLPKDGUQFP-LFYYULSSSA-N 398.507 2.880 0 50 GFAA CCN1CCN(C(=O)c2cc(Cl)ccc2OC[C@H]2C[N@]2CC2CC2)CC1 1875383831 BJUHJPFUZVQMCY-OSPHWJPCSA-N 377.916 2.591 0 50 GFAA OC[C@]1(Cc2ccc(F)cc2)CN(Cc2nc3c(s2)CCCC3)CC[C@@H]1O 2356165365 FFRJXOFWKGBHLD-FPOVZHCZSA-N 390.524 2.949 0 50 GFAA CCOc1ccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1 827720 DUAPKTOZXOULCZ-UHFFFAOYSA-N 376.478 2.510 0 50 GFAA CN(CC(=O)Nc1ccccc1)S(=O)(=O)c1ccc(Br)cc1 1163828 ROJYTNLBAOMNQJ-UHFFFAOYSA-N 383.267 2.708 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc(Cn3nc(C)cc3C)cc2)CC[C@H]1O 2356136409 SYDWIHNQLZZWSN-DENIHFKCSA-N 399.491 2.626 0 50 GFAA Cc1ccccc1-n1c(Cn2cnc3c(N)ncnc32)nc2cccc(C)c2c1=O 3841590 GNWHRHGTIBRNSM-UHFFFAOYSA-N 397.442 2.773 0 50 GFAA in-vitro CC[C@H](C)NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 6267359 CPDQGPLRAMPDEC-ZDUSSCGKSA-N 390.461 2.787 0 50 GFAA CCOC(=O)[C@@]1(COC)CCCN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1 225624194 OUHZSZZWVIMFCD-IBGZPJMESA-N 397.855 2.543 0 50 GFAA Cc1ccccc1NC(=O)c1cc2c(=O)[nH]c(=O)n(Cc3ccco3)c2nc1C 67631213 SCVMCWMLIJAFMB-UHFFFAOYSA-N 390.399 2.595 0 50 GFAA O=C(c1ccccc1-c1ncc[nH]1)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65380694 VQHFFPSQPOSTPZ-MAUKXSAKSA-N 391.427 2.796 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(N2CCO[C@@H](c3nccs3)C2)n1 328635674 NOQDKIZJQYWXJJ-UXLLHSPISA-N 389.525 3.127 0 50 GFAA Cn1cc(I)c(C(=O)NC2C3CC4CC(C3)CC2C4)n1 657161 VEFCZNADDMZZMG-UHFFFAOYSA-N 385.249 2.579 0 50 GFAA O=C(c1cnn2c1CCCC2)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 72147515 SQERNBVVEIWHLB-CEMLEFRQSA-N 376.504 2.922 0 50 GFAA CCc1nc(C)c(C(=O)N2CCn3nc([C@@H](O)Cc4ccccc4)cc3C2)o1 219369867 ICJKCUIVVUAOIC-SFHVURJKSA-N 380.448 2.674 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCn2ccnc2)(Cc2ccccc2)c2ccccc21 71752710 LMNMNVKWJIHRPN-HSZRJFAPSA-N 388.471 2.547 0 50 GFAA CN1CCC[C@@H](N2CCN(C(=O)Cc3csc(-c4cccs4)n3)CC2)C1 363218116 FSXBNNAANLOWGV-MRXNPFEDSA-N 390.578 2.653 0 50 GFAA O=C(Nc1nccs1)c1ccc(NC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)cc1 363553177 MTTCYLNOGPKGEA-AGUYFDCRSA-N 385.445 2.576 0 50 GFAA Cn1cc([C@H]2OCC[C@@H]2C(=O)Nc2cc(-c3cc4ccccc4o3)[nH]n2)cn1 366678074 GMIFUJKDBMQELJ-IFXJQAMLSA-N 377.404 3.273 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N1CCC[C@@H]1c1nc2ccccc2[nH]1 72474421 IIVXPMFFOFGPET-LJQANCHMSA-N 378.480 2.549 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)[C@H]3[C@@H](N)[C@H]4CC[C@@H]3C4)CC2)OC1=O 77342895 OLKUFWCWTWIRLQ-XDNAFOTISA-N 377.529 2.609 0 50 GFAA CN1C(=O)[C@@](CC(=O)N2CCC(O)CC2)(Cc2ccccc2)c2ccccc21 71757254 VZOOLSSGISUFNA-HSZRJFAPSA-N 378.472 2.517 0 50 GFAA Cc1c(C(=O)N2CCC[C@H]2CN2CCOCC2)cnn1-c1ccccc1Cl 174491148 FARBPAQNJMCAFG-INIZCTEOSA-N 388.899 2.771 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC[C@H](O)c1ccccc1 47681028 FTTFGHLPOVQHFR-FQEVSTJZSA-N 381.476 2.846 0 50 GFAA Cc1nnc(CNC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)o1 426527137 YUWRSDYHRCVZTI-UHFFFAOYSA-N 387.465 2.533 0 50 GFAA CCCCC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)c1cn2cc(Cl)ccc2n1 82092266 NDAZIIKDVNBASI-KBPBESRZSA-N 380.851 2.847 0 50 GFAA Cn1ccnc1C(=O)[C@H]1CCCN(C(=O)NCCn2ccc3ccccc32)C1 426370531 QZVQTZAYYGZEAO-KRWDZBQOSA-N 379.464 2.679 0 50 GFAA CCn1ncc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)c1C 95503363 YTUOOWPZKVNPDC-GOSISDBHSA-N 378.480 2.871 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(c3cccc(O)c3)CC2)CN1Cc1ccccn1 97551272 HZUBOFKKYCAECR-SFHVURJKSA-N 379.460 2.542 0 50 GFAA COc1cccc2[nH]cc(CCNC(=O)N[C@H]3CCN(c4ncccc4F)C3)c12 181474317 QQIVYNKDSMUSRT-HNNXBMFYSA-N 397.454 2.831 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)Cc2cc(C)ccc2C)CC1 96133637 CNWUVRQIUGNKIH-UHFFFAOYSA-N 383.540 2.925 0 50 GFAA O=C(NCc1ccco1)c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc1 239174189 PMCXEGKYIKKDNM-IPJCAIGPSA-N 388.423 2.767 0 50 GFAA CCc1ccccc1NC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]2OC(C)(C)O[C@H]21 245265000 FMWYZWRRCNHKLR-ORDFZIBCSA-N 377.437 2.584 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCOC[C@@H]1c1ncn(Cc2ccccc2)n1 297201514 UVTYJBMVGQJVSF-QGZVFWFLSA-N 383.839 2.589 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)c1ccc(NC(N)=O)cc1 299026087 PZEPWSNVLUMGTR-BBRMVZONSA-N 384.436 2.642 0 50 GFAA CCc1ccc(C(=O)N2CCc3[nH]c(-c4ccc(C(N)=O)cc4)nc3C2)s1 252499319 RYSXDIGOKAWMFE-UHFFFAOYSA-N 380.473 2.998 0 50 GFAA CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)CCCCN2CCOCC2)C(C)(C)C1 253392232 NMFXHMHCBGCVRY-QGZVFWFLSA-N 397.560 2.641 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccco2)C1=O)Nc1cccc2ncccc12 252550548 SRYFPKPZFXXRFK-QGZVFWFLSA-N 378.388 2.872 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)Nc4cccc(OC)c4)c3CO2)cc1 263619313 YBSZQGVXXQKHLS-GOSISDBHSA-N 380.404 2.819 0 50 GFAA COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)NCC(C)(C)O)C(=O)OC2 276415654 JHBTTZMYBWSMDK-WUXMJOGZSA-N 391.464 2.536 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@@H](C(=O)N1CCCCCC1)C2)c1cccnc1 299758034 KHYYPNSDTLVFKG-AWEZNQCLSA-N 398.488 2.938 0 50 GFAA COc1ccc(Oc2ccc(NC(=O)[C@H]3CCc4nn(C)c(=O)n4C3)cc2)cc1 824684110 PXOXDJHPWAZOEX-AWEZNQCLSA-N 394.431 2.584 0 50 GFAA O=C1C[C@@H](C(=O)N2CCCN(C3Cc4ccccc4C3)CC2)C2(CCCC2)O1 828244552 MZEMESPBRYNRTI-FQEVSTJZSA-N 382.504 2.564 0 50 GFAA COc1ccc(F)cc1CC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 185566127 QYPRXXIHVSUREG-UHFFFAOYSA-N 388.414 2.891 0 50 GFAA O=C1COc2cccc(C(=O)N[C@H]3CCN(C(=O)CCCC4CCCC4)C3)c2N1 1875330731 ARBXXTKXFVXWTL-INIZCTEOSA-N 399.491 2.709 0 50 GFAA NCc1ncc(C(=O)N2CCC[C@@H](c3cc(O)cc(F)c3)C2)c(C(F)F)n1 1875311395 XTIPLOYZWCAOEB-SNVBAGLBSA-N 380.370 2.737 0 50 GFAA O=C(N[C@@H]1CC[C@H](CCNc2ncnn3cccc23)C1)[C@@]12CC=CCN1CCC2 1875326664 RWLKZIMQLBCDNC-HMFYCAOWSA-N 394.523 2.611 0 50 GFAA COc1ccc(CN2CCC[C@@H](C(=O)c3ccccn3)C2)cc1Cn1cncn1 952983078 UNUIFJNXNTZYBW-GOSISDBHSA-N 391.475 2.825 0 50 GFAA C[C@@H](NC(=O)Cc1noc(Cc2cnn(-c3ccccc3)n2)n1)c1ccccc1 770960140 NTOXEUHDDVQRJT-OAHLLOKOSA-N 388.431 2.661 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC[C@H](c2nnc3ccccn23)C1 1506409339 GPQVXMCPSLCBHO-HNNXBMFYSA-N 378.480 2.670 0 50 GFAA Nc1nc2c(c(C(=O)N3CCN(c4nsc5ccccc45)CC3)n1)CCCC2 1506416102 UFRYVSDGYSUSSZ-UHFFFAOYSA-N 394.504 2.510 0 50 GFAA COc1cc(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)ccc1F 1529169319 VFXDMWBVXWFGLD-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA COc1cc2c(cc1CN1CCC3(CC1)C[C@@](C)(O)CCO3)OCCCO2 1704311084 XKVBUUHZAMHWDB-FQEVSTJZSA-N 377.481 2.753 0 50 GFAA CN(CCC1CCOCC1)C(=O)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12052096 NBBVCMFHLIOEIU-IBGZPJMESA-N 390.499 2.882 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@@H]2CCOC2)c1 12430454 WJJFRVMOIDYLHZ-MRXNPFEDSA-N 388.508 3.000 0 50 GFAA Cc1ccc(CN(C)C[C@@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)o1 14974064 JINNIIXOCOPERV-FQEVSTJZSA-N 378.419 2.852 0 50 GFAA CCOC(=O)N1CCN(Cc2nc(-c3ccc(OC)c(OC)c3)oc2C)CC1 19842408 QHTGGNDUSWLBDA-UHFFFAOYSA-N 389.452 2.941 0 50 GFAA O=C([C@H]1[C@@H]2CC[C@H]1CN2C(=O)c1ccccc1-n1cncn1)N1CCCCCC1 1857667354 SCMODUUGLRXKLK-FFZOFVMBSA-N 393.491 2.521 0 50 GFAA Cc1ccc2cc(-c3nccn3[C@H]3CC(=O)N(C)C3)c(N3CCOCC3)nc2c1 1857672857 IOYJJXSPMWBDEP-KRWDZBQOSA-N 391.475 2.647 0 50 GFAA CC[C@]12COC(=O)N1CCN(C(=O)c1oc3c(OC)c(OC)ccc3c1C)C2 1857680011 DWPRRHNWUABHBS-FQEVSTJZSA-N 388.420 2.815 0 50 GFAA NC[C@@H]1CCCN(C(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)C1 425261904 ZUWGXQYDRAZRPP-LBPRGKRZSA-N 376.863 2.964 0 50 GFAA Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)N1CCC[C@@H](N)C1 158151404 JTBPDLMCRHTDDB-MRXNPFEDSA-N 391.313 2.874 0 50 GFAA CC(C)c1nccn1CCNC(=O)c1ccc2ncc(Br)n2c1 2325796389 MVIICWWBLUWYRT-UHFFFAOYSA-N 376.258 2.847 0 50 GFAA O=C(N[C@H](CO)[C@H](O)c1cccnc1)c1cccc2[nH]c(-c3cccs3)nc12 1471065736 DHMVCGPMQTUXIV-CRAIPNDOSA-N 394.456 2.511 0 50 GFAA O=C(c1nn(-c2ccccc2)c2c1CCC2)N(C[C@H]1CCCO1)c1ccnnc1 953100280 FPPDALLQEAROPY-GOSISDBHSA-N 389.459 2.977 0 50 GFAA CCn1cc(Cl)c(C(=O)Nn2c(C)nc3sc4c(c3c2=O)CCCC4)n1 2780564 PBECIHVCZYDXHO-UHFFFAOYSA-N 391.884 2.899 0 50 GFAA CCOc1ccccc1N(CC(=O)Nc1ccc(F)c(F)c1)S(C)(=O)=O 2858096 PAXVIGAMHXTRGC-UHFFFAOYSA-N 384.404 2.768 0 50 GFAA COc1ccccc1NC(=S)N[C@@H](NC(=O)CF)C(Cl)(Cl)Cl 2905388 LOMQGCFEXKQJFX-SNVBAGLBSA-N 388.679 2.764 0 50 GFAA CCC(=O)N1CCN(c2ccc(NC(=O)c3ccc4c(c3)OCCO4)cc2)CC1 4412707 RXSUVFJWJPEAQV-UHFFFAOYSA-N 395.459 2.769 0 50 GFAA CN(C[C@@H](O)COc1cccc(CNCCn2cccn2)c1)C1CCCCC1 11759409 IRKOJTUCCFIYSL-OAQYLSRUSA-N 386.540 2.677 0 50 GFAA CCOC(=O)[C@@]1(Cc2cccc(OC)c2)CCCN(C(=O)c2cc(C)[nH]n2)C1 12447291 WDRCNXDUFBMVMB-OAQYLSRUSA-N 385.464 2.755 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4ccc(C)c(C)c4)CC3)nn2)n1 13009051 WCZYQWCRRBHTOT-UHFFFAOYSA-N 390.491 2.858 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NCc3cccc(C)c3)cc12 14531091 ZXLVSLZRKQWVLZ-UHFFFAOYSA-N 396.447 2.865 0 50 GFAA O=C(c1cn([C@@H]2CCCN(Cc3ccc(F)c(F)c3)C2)nn1)N1CCCC1 14991958 YFASBIPVOXWJLE-OAHLLOKOSA-N 375.423 2.629 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(Cc4nccn4C)C3)C2=O)c1 15065061 GAGUULWFRLSIRL-OAQYLSRUSA-N 386.471 2.583 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@H](C(=O)N2CCN(c3ccccc3F)CC2)C1 59741046 WVIIOKCACZNEAM-INIZCTEOSA-N 375.488 2.759 0 50 GFAA CCn1nccc1C(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71748628 SKSBIXHSRWSBMM-LJQANCHMSA-N 386.471 2.941 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cccnc1C)C(=O)N(C1CCCC1)C2 71754436 KAUKVXBPCGBHDJ-UHFFFAOYSA-N 380.448 2.622 0 50 GFAA COCCN(Cc1ccncc1)C(=O)[C@H]1CCC(=O)N(CC2CCCCC2)C1 91624949 KIQJYFRSJJDCDF-FQEVSTJZSA-N 387.524 2.876 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccccc3-c3ncc[nH]3)C2)CCC1=O 95529365 FYXODKIMFNTLEL-JOCHJYFZSA-N 396.491 2.568 0 50 GFAA O=C(C1CCCC1)N1C[C@@H]2CN(Cc3ccc(F)cc3F)C[C@]2(C(=O)O)C1 96136356 IRTWSAAFOVJLPL-YWZLYKJASA-N 378.419 2.500 0 50 GFAA CN1CCN(C2(CNC(=O)Nc3cccc(OC(F)F)c3)CCCC2)CC1 97679903 BZQTZLHQYONYNP-UHFFFAOYSA-N 382.455 2.970 0 50 GFAA COc1ccc(N2C(=O)[C@H]3[C@@H](c4ccc(Cl)cc4)N4CCCN4[C@H]3C2=O)cc1 101269579 FQAIRYRCTPLSPA-IPMKNSEASA-N 397.862 2.884 0 50 GFAA C[C@H](Oc1ccc(F)c(F)c1)C(=O)N(C)C[C@@H]1CCCN1c1cccnn1 118742942 HIXFTTBDRPNGFS-KBPBESRZSA-N 376.407 2.650 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)[C@H]2C[C@H]2c2cccnc2)c1 133960312 MRRBWDZMAUFKGK-KBPBESRZSA-N 378.837 2.546 0 50 GFAA O=C(COc1ccc(F)cc1)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772344 ZFZAXIXDXZRXRS-UHFFFAOYSA-N 398.360 2.799 0 50 GFAA COC[C@H](Cc1ccccc1)N(C)C(=O)c1sc2ncn(C)c(=O)c2c1C 170608887 BHEMBUUXGZQHMP-HNNXBMFYSA-N 385.489 2.633 0 50 GFAA COc1ccccc1[C@H]1CCCN1C(=O)NC[C@@H](C(C)C)N1CCN(C)CC1 170838730 VPAFFAOJOMWKDO-UXHICEINSA-N 388.556 2.814 0 50 GFAA CCCS(=O)(=O)Nc1ccc(NC(=O)NC2CCN(CC3CC3)CC2)cc1 172574740 AMBCKIRQVRTCON-UHFFFAOYSA-N 394.541 2.834 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CCO1 178279944 RZJPYJQNPCVHPT-IBGZPJMESA-N 380.375 2.967 0 50 GFAA O=C(N[C@@H]1CCc2[nH]ncc2C1)[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 193262650 GWPIETZUDQXEMI-BRWVUGGUSA-N 392.425 2.694 0 50 GFAA CCN(Cc1ccc2[nH]ccc2c1)C(=O)CNC(=O)c1ccc2c(c1)OCO2 239667227 BPORYDATIQAYSG-UHFFFAOYSA-N 379.416 2.675 0 50 GFAA CSc1nn2c(=O)cc(CN(Cc3ccccn3)CC(C)C)nc2s1 244742042 OBANEWBOHKDSEB-UHFFFAOYSA-N 375.523 2.926 0 50 GFAA O=C1N[C@H](CCc2ccccc2)C(=O)N1CC(=O)N1CCC[C@@H]2CCCC[C@H]21 250289044 OKXRFDQHOMIIRC-IPMKNSEASA-N 383.492 2.721 0 50 GFAA Cc1ccc(-c2cc3n(n2)[C@@H](NCc2ccc4c(c2)OCO4)CNC3=O)c(C)c1 263618099 RFKABVRBUSDZIJ-OAQYLSRUSA-N 390.443 2.927 0 50 GFAA O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NCc1cc(O)nc2ccccc12 267083012 JUTVRNKGQQCGPJ-LJQANCHMSA-N 391.471 2.848 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CNS(=O)(=O)/C=C/c3ccccc3Cl)O2)n1 275282015 KPOXQLVCKGWIJV-HOMMJUPQSA-N 383.857 2.842 0 50 GFAA Cc1cc(S(=O)(=O)NCc2ccncc2OC[C@@H]2CCOC2)c(F)cc1F 288708386 XKVIJTRVAJPZED-CYBMUJFWSA-N 398.431 2.562 0 50 GFAA CSCCCN1CCC(N2C[C@H](COc3ccc(F)cc3)OCC2=O)CC1 299794777 KREISSWTZYTTAS-LJQANCHMSA-N 396.528 2.649 0 50 GFAA Cc1cccnc1NCCNC(=O)N1CCCN(C2Cc3ccccc3C2)CC1 534640873 BSKDZPHFZRCBJA-UHFFFAOYSA-N 393.535 2.687 0 50 GFAA Cc1n[nH]c(C)c1CCNC(=O)[C@@H]1CC(=O)N(c2ccc(OC(C)C)cc2)C1 670453422 REYXVGAJMPPXAB-MRXNPFEDSA-N 384.480 2.526 0 50 GFAA COc1cc(OC)cc([C@@H](O)CNC2CCN(C(=O)OCC(C)C)CC2)c1 796770530 CSWVNFZMOZKPQO-IBGZPJMESA-N 380.485 2.584 0 50 GFAA CC(C)NC(=O)c1ccc(NC(=O)CN2C[C@H](c3ccccc3)CC2=O)cc1 821809871 ARBRXHVCXOJKEI-GOSISDBHSA-N 379.460 2.779 0 50 GFAA CCC(=O)Nc1ccc(C)c(NC(=O)[C@H](c2cccnc2)N2CCOCC2)c1 822535052 XBALPWQSSZKCJK-FQEVSTJZSA-N 382.464 2.751 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cccc4[nH]ccc34)C2)c(=O)n1C 828161373 YTYDSQWZKKRKBL-QGZVFWFLSA-N 392.503 2.817 0 50 GFAA COc1ccc([C@@H]2CNCCN2C(=O)Nc2cccc(-c3cn(C)nn3)c2)cc1 883575318 CUJWEUMUKOBMBR-FQEVSTJZSA-N 392.463 2.669 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@H]1NC(=O)N[C@@H]1CCc2c(nnn2C)C1 888093950 NWUGYKFPFYUYPZ-JXXFODFXSA-N 383.496 2.670 0 50 GFAA O=C1CC[C@H](NCC2(N3CCOCC3)CCCCCC2)CCN1CC1CC1 952976108 YRRCJORQFHXOAS-FQEVSTJZSA-N 377.573 2.792 0 50 GFAA CCCc1cc(=O)n(-c2ccc(C(=O)N(C)C[C@@H]3CCCN(CC)C3)cc2)[nH]1 1506397001 NUVCFTFYRDPVOF-KRWDZBQOSA-N 384.524 2.922 0 50 GFAA CCn1nc(C)cc1C(=O)NC[C@H]1CCCN(CCn2cnc3ccccc32)C1 1506399807 QMHOILXMOVDYDX-GOSISDBHSA-N 394.523 2.703 0 50 GFAA O=C(Cn1ccc(=O)cc1)N1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 1506428604 RHDUJMLNGAZRCQ-HSZRJFAPSA-N 379.504 2.753 0 50 GFAA Cc1nc(N)sc1C(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565513642 DLMMMNPTDAHRSE-PBHICJAKSA-N 382.533 2.738 0 50 GFAA Cc1nc(CN2CC[C@H](NC(=O)c3ccc(C)c(Cl)c3)[C@@H](O)C2)cs1 1565525977 RKKOSYNRWZYPGD-IRXDYDNUSA-N 379.913 2.779 0 50 GFAA CO[C@@H](CNC(=O)N1C[C@H](C)O[C@H](c2nc(C)no2)C1)c1ccc(Cl)cc1 1857530078 AQHZAKHMPKMFMK-UVBJJODRSA-N 394.859 2.891 0 50 GFAA O=C(C1CCN(c2nc3ccc(Cl)cc3o2)CC1)N1C[C@H]2C[C@@H](O)C[C@H]2C1 1857728026 KAUZDJJPCXUKDZ-MIFYACCESA-N 389.883 2.927 0 50 GFAA COc1ccc(CCC(=O)N=[S@@](C)(=O)c2ccccn2)c(OC)c1OC 1875276182 AIDNYCPZVPFNDC-SANMLTNESA-N 378.450 2.724 0 50 GFAA NCCn1cc(C(=O)N2CC3(CCC3)c3cc(Br)ccc32)cn1 1875292777 SFIGWYFFGOSXSD-UHFFFAOYSA-N 375.270 2.686 0 50 GFAA CCc1n[nH]cc1NC(=O)Nc1cnc(N2CCOCC2)c(Br)c1 1875296379 TXLZTHNTAKEEJE-UHFFFAOYSA-N 395.261 2.610 0 50 GFAA O=C(c1[nH]nc(C(F)(F)F)c1Br)N1CC[C@@H]1C1CCOCC1 1875396326 BWDWHZCRFVENRI-MRVPVSSYSA-N 382.180 2.832 0 50 GFAA Cc1cc(-c2ccccc2)nc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)n1 2100483733 KNZPHVOLUBIFKQ-QGZVFWFLSA-N 387.443 2.834 0 50 GFAA COc1ccc([C@H]2C[C@H](C)N(C(=O)Cn3cnc4ccc(F)cc4c3=O)C2)cc1 2325734430 RFKHBTNHOVORHF-HOCLYGCPSA-N 395.434 2.949 0 50 GFAA COc1ccc(NC(=O)CNC(=O)c2ccc(OC)c(OC)c2)cc1Cl 1051633 VQGSCGFHMZPOSG-UHFFFAOYSA-N 378.812 2.734 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)N[C@@H](C)c1ccccc1)S(C)(=O)=O 2064942 GALLQRSMDKZAJX-ZDUSSCGKSA-N 396.896 2.992 0 50 GFAA O=C1C[C@H](c2ccccc2)NCCCN(C(=O)c2cccnc2)CCCCN1 2356134363 KGJKXIAJOBWZIO-HXUWFJFHSA-N 380.492 2.545 0 50 GFAA COc1ccc(OC)c(NC(=O)CN2CCN(Cc3cccc(F)c3)CC2)c1 20228945 LLZBERAHDKTNDV-UHFFFAOYSA-N 387.455 2.599 0 50 GFAA Cc1ccoc1C(=O)N1CCc2c(c(C(=O)O)nn2CCCc2cccnc2)C1 67688530 ALTPTWPXASWEOC-UHFFFAOYSA-N 394.431 2.709 0 50 GFAA Fc1ccc(-c2n[nH]cc2CNC[C@H](c2ccncc2)N2CCOCC2)c(F)c1 20601429 YPCXKEMNCIBNIR-HXUWFJFHSA-N 399.445 2.913 0 50 GFAA CCn1nc(NC(=O)Cn2cc(-c3nc(C)cc(NC)n3)cn2)c2ccccc21 63885246 OJFPVBAWSDCHLQ-UHFFFAOYSA-N 390.451 2.699 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(c2cncc(C(N)=O)n2)CCO3)s1 67908317 LCFLGSGNIMMIEZ-UHFFFAOYSA-N 382.445 2.717 0 50 GFAA O=C(NC[C@H](CO)Cc1cccnc1)c1cccc(-c2noc(C3CC3)n2)c1 253432258 JOGJYMGWONAZNT-OAHLLOKOSA-N 378.432 2.590 0 50 GFAA COc1ccc([C@H](CO)N(C)C[C@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)cc1 253426027 XMBYMXNNXLCEBH-MMOPVJDHSA-N 376.497 2.917 0 50 GFAA Cc1ccn2cc(Cn3nc([C@H]4CCCNC4)n(-c4ccccc4)c3=O)nc2c1 71756857 BDUBWXMOGOMUSW-KRWDZBQOSA-N 388.475 2.505 0 50 GFAA COc1cc(/C=C/C(=O)N(CCC(=O)O)C2CCOCC2)cc(Cl)c1OC 328595417 UQZNJKIURWQSDC-ONEGZZNKSA-N 397.855 2.853 0 50 GFAA CC(C)NC(=O)C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72129471 SWDMZCFPIGXXRL-FQEVSTJZSA-N 381.476 2.694 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccccc3)CC2)cc(-n2cnc(C)c2C)n1 72437828 YGRPNAPCONMGDS-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CC[C@H]3[C@@H](CCCN3C3CC3)C2)c1 158141841 LXPMVMPUMCUDEW-LPHOPBHVSA-N 395.511 2.841 0 50 GFAA Cc1nc2c(c(N(C)C)n1)CCN(C(=O)c1c[nH]nc1-c1cccc(F)c1)C2 71777234 KRAMUWFAWQZDBR-UHFFFAOYSA-N 380.427 2.579 0 50 GFAA CC(C)c1nc2ccccc2n1CC(=O)N[C@@H]1CCCN(c2ncccn2)C1 72143051 UEKAFKVJAZEFJA-MRXNPFEDSA-N 378.480 2.735 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(c3ccc(C(=O)O)cn3)C2)cc1OC 72430553 ZDQIOFPMYBXOQZ-GOSISDBHSA-N 399.491 2.940 0 50 GFAA CCOc1ccccc1CN1CCN(C(=O)c2ccnc3c2ncn3C)[C@@H](C)C1 288257452 TXLQRKNOWVYXNP-INIZCTEOSA-N 393.491 2.714 0 50 GFAA O=C(NCCc1nc2cc(F)ccc2[nH]1)[C@H]1CCCN1C(=O)Cc1ccccc1 176713388 BJJJOLUTMRGXEZ-LJQANCHMSA-N 394.450 2.594 0 50 GFAA Cc1nc2nc3ccn(Cc4cccnc4)c(=O)c3c(-c3ccc(F)cc3)n2n1 40398572 QILWJROBPRPKTB-UHFFFAOYSA-N 386.390 2.997 0 50 GFAA CCC(=O)NCc1cc2n(n1)CCN(Cc1c(C)nc3ccc(Cl)cn13)C2 426444749 XCSPLJCSNISPGT-UHFFFAOYSA-N 386.887 2.535 0 50 GFAA O=C1NCCN2CCN(C(=O)Nc3cccc(-c4cccc(Cl)c4)c3)C[C@@H]12 97099404 UDGLGAQNTTVYLT-SFHVURJKSA-N 384.867 2.655 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)Nc1ccccc1OC)CC2 91781945 FGJDPWIIGCNAEC-UHFFFAOYSA-N 375.469 2.578 0 50 GFAA COc1ccc(C(=O)NC[C@@H]2COc3ccccc3C2)cc1N1CCOCC1 95512977 QIDCSPKKNJEBMN-MRXNPFEDSA-N 382.460 2.513 0 50 GFAA COc1ccc(C)cc1NC(=O)N1CCC2(CC[C@H](CNC(C)=O)O2)CC1 96162841 KQTLGULCXPRIHI-MRXNPFEDSA-N 375.469 2.685 0 50 GFAA Brc1ncn(-c2csc(N3CCOCC3)n2)c1Br 230453712 KEFGZKYLWGZFFS-UHFFFAOYSA-N 394.092 2.690 0 50 GFAA CCOCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(-n2nc(C)cc2C)cc1 95519727 VBXVDRBFZBWTJB-LJQANCHMSA-N 384.480 2.845 0 50 GFAA O=C(CN1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1)Nc1ccccc1 91951284 SQSXBOUONJHMQQ-IBGZPJMESA-N 385.508 2.509 0 50 GFAA Cn1c(N2CCOCC2)nc2cc(C(=O)NCCCc3ccc(F)cc3)ccc21 95359912 VXPGCMMXHQZHOE-UHFFFAOYSA-N 396.466 2.912 0 50 GFAA Cn1cnnc1CN1CCCC[C@H]1C(=O)Nc1ccc(Oc2cccnc2)cc1 95521702 WIBWMIRVKRZDRH-IBGZPJMESA-N 392.463 2.996 0 50 GFAA CC(C)CCn1cc([C@H](C(=O)O)N2CCN(C3CCCCC3)C(=O)C2)cn1 95379737 HPMNKNSGTKNGRQ-LJQANCHMSA-N 376.501 2.532 0 50 GFAA O=C(O)C[C@@H](NC(=O)C[C@@H]1Sc2ccccc2NC1=O)c1cccs1 299742027 ARZAVMYCRNZMNR-RISCZKNCSA-N 376.459 2.883 0 50 GFAA O=C(N[C@H](c1cccs1)[C@H]1C[C@@H](O)C1)C1CCN(C2CCOCC2)CC1 252572250 ZAXWSTXOOSFYJG-WDYCEAGBSA-N 378.538 2.567 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCc4cccc(C)c4)c3CO2)cc1 263615319 BTITYEVYTCWKGF-LJQANCHMSA-N 378.432 2.797 0 50 GFAA COc1c(Cl)cc(C(=O)N2CC[C@H]3OCc4cnnn4[C@H]3C2)cc1Cl 299784286 GZMIEDVTLOYEDX-UONOGXRCSA-N 383.235 2.580 0 50 GFAA O=C([C@H]1CCCO1)N1CCC(NCCCc2nc3ccc(Cl)cc3[nH]2)CC1 825573672 CKSPZLJBNCZVIZ-GOSISDBHSA-N 390.915 2.909 0 50 GFAA C[C@H](O)C[C@@H](NC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)C(=O)O 1875313906 XJTOVGNOFFREGG-GXFFZTMASA-N 380.441 2.567 0 50 GFAA CCOCc1nc(-c2ccc3nc(C)n(C)c(=O)c3c2)n(C[C@H]2CCCCO2)n1 1875348210 JGPSJQRHISSZDS-MRXNPFEDSA-N 397.479 2.606 0 50 GFAA Cn1cc(-c2cccc(C(=O)N3CC[C@H](C4CC4)[C@@H]3c3nc(O)n[nH]3)c2)cn1 1875401095 FIOZORPRHMFFDT-IAGOWNOFSA-N 378.436 2.524 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1ncc(Cc2ccccc2)o1 1875401643 NNUMUWNDAFCJSV-DLBZAZTESA-N 393.447 2.713 0 50 GFAA O=C(c1csc(-c2ncccn2)n1)N(Cc1ccccn1)C[C@H]1CCCO1 952990686 WCHFLZBQRREOSG-OAHLLOKOSA-N 381.461 2.817 0 50 GFAA CCSc1ccccc1NC(=O)C1CCN([C@H]2CCS(=O)(=O)C2)CC1 952867978 VVECSZDOJFHMDS-HNNXBMFYSA-N 382.551 2.636 0 50 GFAA Cn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCS(=O)(=O)c2ccccc21 886046152 MIGWFIKGBINANB-INIZCTEOSA-N 381.457 2.987 0 50 GFAA Cc1cc(C)c(S(=O)(=O)Nc2c(F)cccc2CO)c(C)c1CC(=O)O 272757776 OHOMFSDEFNYPLV-UHFFFAOYSA-N 381.425 2.671 0 50 GFAA Cc1nc(C(F)(F)F)ccc1C(=O)NCc1cccc(N2CCOCC2)n1 274808854 VDSVFSIPTCVTDL-UHFFFAOYSA-N 380.370 2.570 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H]2CC[C@H](C1)CN2Cc1cnc(-c2ccco2)nc1 1073414420 WYTKKAFGDFQXKI-AEFFLSMTSA-N 378.480 2.865 0 50 GFAA CS(=O)(=O)Nc1cc(C(=O)NC[C@@H]2CCC3(CCCCC3)O2)ccc1F 276769579 SNRGKTHRJRWHQD-AWEZNQCLSA-N 384.473 2.809 0 50 GFAA CCc1nc(C2CCN(C(=O)CN3CCOc4ccc(Cl)cc43)CC2)n[nH]1 191505745 UFXICXMGINMJSL-UHFFFAOYSA-N 389.887 2.626 0 50 GFAA CCN(CCNC(=O)N1C[C@@H](OC)C[C@@H]1c1nc(C)no1)c1cccc(C)c1 192365502 JFGXHLXSXHJZPY-ZWKOTPCHSA-N 387.484 2.684 0 50 GFAA O=C(NC1CCN(CC(F)(F)F)CC1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 195146625 HERJFNOKWHUEFT-INIZCTEOSA-N 399.413 2.561 0 50 GFAA Cc1noc([C@H]2CCCN2S(=O)(=O)c2ccc(-c3onc(C)c3C)o2)n1 1506419799 JWIUGQCAWVSUPE-GFCCVEGCSA-N 378.410 2.769 0 50 GFAA CC[C@H](NC(=O)c1cc(CC(C)C)nc(O)n1)c1ccc(S(C)(=O)=O)cc1 1506397544 WATIRSYLVVAHHY-INIZCTEOSA-N 391.493 2.665 0 50 GFAA CCn1ncc(S(=O)(=O)N2CCC3(CC2)OCCc2ccsc23)c1C 1704302630 BHHDSNGOUXQMIY-UHFFFAOYSA-N 381.523 2.526 0 50 GFAA CC(=O)NCc1nnc2n1CCN(Cc1ccc(-c3ccccc3)cc1)CC2 11814011 WGNJVQTYZZSSGS-UHFFFAOYSA-N 375.476 2.640 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)c3cccc(C)c3)C2)nn1 12245031 OCDJLJLYGWGQSW-QGZVFWFLSA-N 383.496 2.621 0 50 GFAA CCN(Cc1ccccc1)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccccc1C 12581527 BRMNTWHJTNNVGF-OAQYLSRUSA-N 379.504 2.734 0 50 GFAA COc1cccc(CCC(=O)N2C[C@@H]3C[C@H]2C(=O)N3c2ccc(F)c(F)c2)c1 14989746 XWKPMYVUZNFNBK-KXBFYZLASA-N 386.398 2.922 0 50 GFAA c1cncc(CN2CCC[C@@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)c1 19536454 QBCDDSOECNCPCU-OAQYLSRUSA-N 394.519 2.593 0 50 GFAA CCOC(=O)N1CCN(C[C@@H](O)COCCC23CC4CC(CC(C4)C2)C3)CC1 19956903 AVSSJCYKBFPSJZ-KTKXKACQSA-N 394.556 2.745 0 50 GFAA CCc1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(F)cc4Cl)C3)nn2)n1 169778092 PSUZDBWYYKBFAO-LLVKDONJSA-N 390.806 2.770 0 50 GFAA O=C([C@@H]1CCOC1)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1C(=O)c1cc2ccccc2s1 1857677252 SWSNFXKTUROVNF-SFFUCWETSA-N 396.512 2.999 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NC3(c4cc(F)cc(F)c4)CC3)CC2=O)s1 1857712154 RVDLEYCTXZPQMJ-SNVBAGLBSA-N 392.431 2.537 0 50 GFAA NC(=O)C1(NC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CCCC1 1857713862 UYMAZFMVJUCILR-GFCCVEGCSA-N 390.871 2.612 0 50 GFAA CC[C@@]1(C(=O)N(C)CCN(C)C)C[C@@H]2CC[C@H]1N2C(=O)CCC(F)(F)F 1857728349 XYDRWLQTWCSLID-JJRVBVJISA-N 377.451 2.509 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)c3cccc(F)c3)CC2)n1 17012473 SVXMSONEOOIAAN-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA O=S(=O)(NCc1nc(-c2ccc3c(c2)CCO3)no1)c1ccc(Cl)s1 154775429 CKTXDMUHEOJKDB-UHFFFAOYSA-N 397.865 2.865 0 50 GFAA Cc1ccccc1-c1nc(C(=O)Nc2cnn(CCN3CCOCC3)c2)cs1 264357264 XZEGBRDUWHSCSR-UHFFFAOYSA-N 397.504 2.900 0 50 GFAA Cc1cc2c(cc1C)N[C@@H](CC(=O)Nc1ccc(N3CCOCC3)cc1)C(=O)N2 941071 NUPBIIGSDCCPHO-FQEVSTJZSA-N 394.475 2.901 0 50 GFAA CCOC(=O)Cc1ccccc1CCOC(=O)C[C@H]1Oc2ccccc2NC1=O 2325737708 JZKWLFSGOQXMCF-LJQANCHMSA-N 397.427 2.668 0 50 GFAA COc1ccc(CCNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 626451 OYDLZTSMGBJYJX-LJQANCHMSA-N 380.444 2.675 0 50 GFAA biogenic Cc1cc(C)c(S(=O)(=O)N2CCN(C(=O)c3cccs3)CC2)c(C)c1 937557 NJTAGSUKUUIVFT-UHFFFAOYSA-N 378.519 2.820 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1CCC[C@@]12CCCN(CCO)C2=O 2356138645 PUEKUEJTPRBJOF-HSZRJFAPSA-N 397.519 2.612 0 50 GFAA Cc1noc(CSCC(=O)N2CCC3(CC2)OCCc2ccsc23)n1 2356146460 HOQPGPMRJTZCFP-UHFFFAOYSA-N 379.507 2.763 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)Cc3cc4c(cc3Cl)OCCO4)CC2)C1 2356158120 XIHWWOYGMAEJDF-LJQANCHMSA-N 395.883 2.576 0 50 GFAA COc1ccc(CNS(=O)(=O)c2ccc(OC)c(Br)c2)cc1 2970168 DEUPEZAUAGBTQZ-UHFFFAOYSA-N 386.267 2.945 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)C4CC4)C3)[C@@H]3CCCC(=O)N23)c1 2356162202 BSHHSZNZNRSSHY-ZFMNYDKASA-N 382.504 2.876 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2CC[C@@]2(C)[C@H](C3=CC(=O)OC3)[C@H](O)C[C@]12O 3954643 PVAMXWLZJKTXFW-CTEUFYIQSA-N 390.520 2.575 0 50 GFAA CCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2cc(Cl)ccc2OC)n1 4868009 MFLOSHLLPQYSMC-UHFFFAOYSA-N 390.248 2.838 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3nccs3)C[C@H]2CCO)o1 104346041 XRTCZVHYUFNHOJ-QGZVFWFLSA-N 386.521 2.904 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@@H]2CCO)c(F)c1 23361142 YHLRAWAGUFXWGY-INIZCTEOSA-N 379.501 2.668 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)[C@]2(c3ccccc3)CC2(C)C)CC1 67785510 FGUZHRRKMGNIGR-HSZRJFAPSA-N 378.520 2.818 0 50 GFAA COc1ccc2c(C(=O)N(C)CC(C)C)cc(-c3cnn(CCO)c3)nc2c1 23619073 TUCABADEFMCNRI-UHFFFAOYSA-N 382.464 2.827 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNCc3ccc(C)cc3)C2=O)c1OC 67909513 KVUCKOPRCDJUDU-HSZRJFAPSA-N 398.503 2.656 0 50 GFAA O=C(NC1CCN(CC(F)F)CC1)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 148458952 XSSCRPVEEREXHA-LBPRGKRZSA-N 385.842 2.539 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N[C@H](C)Cc2cccnc2)o1 12320032 LJYVBFLXHLJTRO-MRXNPFEDSA-N 394.475 2.938 0 50 GFAA O=S(=O)(CC1CC1)c1ncc(CN2CCC(O)CC2)n1CC1CCCCC1 12307259 WSYKEDISUVCSDS-UHFFFAOYSA-N 395.569 2.604 0 50 GFAA CCOC(=O)c1ccc(C(=O)OCC)c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c1 2801103 LMIYGGSMPMMYTQ-KGLIPLIRSA-N 389.404 2.646 0 50 GFAA O=C(CCOC[C@H]1CCCO1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1 230232003 ONXRLYRXNBGDQJ-VQTJNVASSA-N 398.507 2.854 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4cc(Cl)ccc4Cl)ccc3n2n1 72115962 OZZJLKQMJLZKQG-UHFFFAOYSA-N 379.232 2.852 0 50 GFAA C[C@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@H](O)c1ccc(F)cc1 173610610 CRRVETGCYCYTDU-LIRRHRJNSA-N 383.427 2.904 0 50 GFAA Cc1cncc(CCC(=O)N2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)c1 368640034 ZTFNXQBMFBPLBL-UHFFFAOYSA-N 399.516 2.696 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 11821779 VQOMAVMXIZAISM-JOCHJYFZSA-N 381.451 2.805 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCN(c2cccs2)CC1 156767072 DIPGYYQPYLAGIQ-IBGZPJMESA-N 396.516 2.625 0 50 GFAA O=C(c1ccncc1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72156817 DJKFOQBGZQMJBA-IOMROCGXSA-N 377.444 2.513 0 50 GFAA O=C(CN1CCN(Cc2ccc(-c3ccccn3)cc2)CC1)N1CCCCC1 72157186 QQNXIHGYWGSTLC-UHFFFAOYSA-N 378.520 2.879 0 50 GFAA CN(CC(F)(F)F)C(=O)CN1[C@H](C(=O)OC(C)(C)C)C[C@@H]2CCCC[C@H]21 241775960 RQQUCQUINQLJHJ-MJBXVCDLSA-N 378.435 2.982 0 50 GFAA O=C(N[C@@H]1CCc2nnnn2CC1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 333675206 DGQFALCKYJYWCP-CRAIPNDOSA-N 379.468 2.796 0 50 GFAA CCOc1ccc(NC(=O)NC2CC(N(CC)CC(=O)O)C2)c2ncccc12 263129790 YAOZQVAXLNUHIM-UHFFFAOYSA-N 386.452 2.693 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)NCc2cc(Cl)cc(Cl)c2)CCC(=O)N1 222461218 XMIPSHLHALPVSL-QGZVFWFLSA-N 387.263 2.903 0 50 GFAA CN1CCN([C@@H]2CCN(C(=O)NC(c3ccccc3)c3ccccc3)C2)CC1 426690195 AJMDCBLRTKKARH-OAQYLSRUSA-N 378.520 2.807 0 50 GFAA Cc1ccnn1CCC(=O)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95503197 GXAWXPMQEYUSCD-INIZCTEOSA-N 384.509 2.689 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(C(=O)c1cccc(OC(F)F)c1)CC2 91664893 MHPUOUOMYXDPCP-UHFFFAOYSA-N 376.407 2.631 0 50 GFAA COc1ccc(C(=O)NC[C@H]2CCOC2)cc1OC1CCN(C(C)C)CC1 95509443 WXSIDBKTBWNGBI-MRXNPFEDSA-N 376.497 2.713 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@@H]2CCCN(CCc3ccccc3OC)C2)cn1 95512919 OSDQKVLHOBQIJB-KRWDZBQOSA-N 397.523 2.554 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)[C@H]2C[C@@H](O)C2)cn1 244778606 PTPMINJCBNGBIS-GQIGUUNPSA-N 378.432 2.722 0 50 GFAA COCc1nnc(NC(=O)CN2CCC(c3ccccc3OC)CC2)s1 244742290 OFBGIAWIKBCFND-UHFFFAOYSA-N 376.482 2.511 0 50 GFAA COc1ccc(CNC(=O)CCN2CCC(O)(c3ccc(F)cc3)CC2)cc1 244874699 XFVAKPVNJOZWMO-UHFFFAOYSA-N 386.467 2.824 0 50 GFAA O=C(NCCN1CCCCC1=O)Nc1ccc(OC[C@H]2CCCCO2)cc1 299779247 QLBKTCXLLJHIDV-GOSISDBHSA-N 375.469 2.769 0 50 GFAA Cc1occc1C(=O)N1CCOC2(CCN(C(=O)Cc3cccs3)CC2)C1 827921311 NNYRZPMMOPTYPG-UHFFFAOYSA-N 388.489 2.726 0 50 GFAA Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 1875269770 LZCYNBAEBIFYMU-HNNXBMFYSA-N 381.448 2.701 0 50 GFAA C[C@H]1CCCCN1c1cc(C(=O)N2CC[C@H](NC(=O)CC(F)(F)F)C2)ccn1 1875259081 DBJCEXWVEKKJCT-ZFWWWQNUSA-N 398.429 2.744 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)c3ccc(F)cc32)cc1 1875371023 MEPNKWSFNPSZHF-MRXNPFEDSA-N 388.420 2.599 0 50 GFAA CN(C)[C@@H](C(=O)N1CCC(c2nnc3ccccn23)CC1)c1ccc(F)cc1 952984409 UVVCLDRMNMTWRN-LJQANCHMSA-N 381.455 2.877 0 50 GFAA C[C@H]1CO[C@H](C(=O)NC2(C3CCN(c4ccc(C(F)(F)F)nn4)CC3)CC2)C1 1775991177 JDGPVDLFSARXSO-OCCSQVGLSA-N 398.429 2.786 0 50 GFAA C[C@@H]1CCc2sc(C(=O)N3CC[C@@H](N(C)Cc4nccc(N)n4)C3)cc2C1 276518182 QKNSJZQHIRQANP-UKRRQHHQSA-N 385.537 2.592 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(C(=O)N3C[C@@H](C)O[C@H](CC)C3)o2)C[C@H](C)O1 225427307 IYDWRCRGYLXHTF-GEEKYZPCSA-N 378.469 2.559 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N(Cc1ccncc1)C[C@@H]1CCC(=O)N1 1506398854 GSPOIKZGWHMOPM-KRWDZBQOSA-N 387.867 2.730 0 50 GFAA COc1ccc(CN2C[C@@H](O)[C@H](Cc3cnccn3)C2)c2c(OC)cccc12 1529141507 KVIOYVAJKVPCQU-VQIMIIECSA-N 379.460 2.682 0 50 GFAA CCn1ccnc1CN(C)C(=O)c1c(N2CCOCC2)noc1-c1ccccc1 1704333167 XENIFAZDUOQZOQ-UHFFFAOYSA-N 395.463 2.667 0 50 GFAA CC(C)c1nnc(CN2CCCN(C(=O)c3cc(=O)c4ccccc4o3)CC2)o1 1772707597 VMHAUCGTYLPSPB-UHFFFAOYSA-N 396.447 2.648 0 50 GFAA O=C1CN(c2nc3c(c(C(F)(F)F)n2)CCCC3)C[C@H](Cc2ccccc2)N1 1772707445 ZXWCDDLBBZIHSM-AWEZNQCLSA-N 390.409 2.922 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCCC[C@@H]2CCNC(C)=O)c(OC)c1 11664812 WUAYRCCYALLVTC-QGZVFWFLSA-N 386.496 2.975 0 50 GFAA O=C1CC[C@H](C(=O)N2CCC(c3ccncc3)CC2)CN1Cc1ccccn1 11822173 KXQBJOGLLUEIHP-IBGZPJMESA-N 378.476 2.621 0 50 GFAA COc1ccc(-n2ncc([C@@H](C)NS(=O)(=O)c3c(C)n[nH]c3C)c2C)cc1 11879315 UTMLASIKTWIQSX-LLVKDONJSA-N 389.481 2.569 0 50 GFAA Cc1cccc(NC(=O)c2ccc(Cl)c(N3C(=O)CCS3(=O)=O)c2)c1 12003470 ABGXRFFZNQCCEA-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA CSc1nnc(CNC(=O)CCn2nc(C)cc2C)n1Cc1ccccc1 12039881 ZIXCENVTWMIRLM-UHFFFAOYSA-N 384.509 2.568 0 50 GFAA Cc1ccn(CC(=O)N2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3)C2)n1 12192630 QKOGLYZJZJUXNS-NRFANRHFSA-N 388.462 2.984 0 50 GFAA Cc1cc(C(=O)NCc2cccnc2N(C)Cc2ccccc2)c(=O)[nH]c1C 14981316 GOXWVQRVDQMCER-UHFFFAOYSA-N 376.460 2.953 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ncccc1Cl)C[C@@H](C)O[C@H]2C 1857531166 BAAXKCOTLHAGEJ-NEPJUHHUSA-N 378.860 2.530 0 50 GFAA Cc1cccc(CC(=O)N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)c1 1857667651 RLEOGIJWTVGDSQ-SFTDATJTSA-N 378.472 2.566 0 50 GFAA O=C(c1c(O)cccc1O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857701987 UXTQPLNWJADWOZ-OAQYLSRUSA-N 381.432 2.591 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c(F)c1 1857724059 KEJVQSOKBQQXAM-JQVVWYNYSA-N 396.418 2.749 0 50 GFAA CC(C)c1cc(CN2C[C@@H]3[C@H](CNC(=O)C4CC=CC4)[C@H]4CC[C@]3(C2)O4)on1 1857741361 PBBZHARMJNDPIU-XHYAQGIWSA-N 385.508 2.860 0 50 GFAA O=S(=O)(Nc1nc2ncccn2n1)c1ccc(SC(F)(F)F)cc1 225550473 AMCXVYCKZORIBN-UHFFFAOYSA-N 375.357 2.537 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)C1 814335994 PYWVYBVWQZGGHS-FZMZJTMJSA-N 381.391 2.999 0 50 GFAA Cn1cnc(C(=O)N2CCN([C@@H](COc3ccccc3)c3ccccc3)CC2)c1 2100544857 MEDYAIIVEPMRAH-QFIPXVFZSA-N 390.487 2.998 0 50 GFAA Cc1nc2ccc(C(=O)N[C@@H]3C[C@H](Cn4cc(Cl)cn4)C[C@H]3O)cc2nc1C 2325785926 UUFDGYSNGLOGFZ-MJXNMMHHSA-N 399.882 2.666 0 50 GFAA CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)O)c1 754795 QHHBTRNZFJQIHP-UHFFFAOYSA-N 376.434 2.668 0 50 GFAA O=c1c(-c2ccc(Cl)cc2)[n+]([O-])c2ccccc2n1OCc1ccccn1 1109893 GBEWFRLKZGGVII-UHFFFAOYSA-N 379.803 2.979 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)no1 2356137330 KKLQGWMIMNQDEB-NRFANRHFSA-N 383.496 2.849 0 50 GFAA CCCc1cc(CNC(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)on1 2356156713 NPPYHOSQZZURTO-LDJQZATESA-N 394.475 2.575 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N3CCC4(CC3)OCC[C@H](O)[C@@H]4O)cc2)c1 2356160408 QQSFWMXJUGJPHY-SFTDATJTSA-N 397.471 2.904 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCc1ccccc1)c1cccc2ccccc12 2964233 ZKENUNVMSHKDEE-UHFFFAOYSA-N 382.485 2.965 0 50 GFAA CC(=O)Nc1ccc(CN2CC[C@H](O)[C@@](CO)(Cc3ccc(F)cc3)C2)cc1 2356168092 OXVXJASBADFMFL-VXKWHMMOSA-N 386.467 2.572 0 50 GFAA Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)CCC(=O)O)cc2)c1 4548577 KOJDPUICKGBEMM-UHFFFAOYSA-N 376.434 2.908 0 50 GFAA COc1ccccc1C(=O)C[C@]1(O)C(=O)N(C)c2ccc(Br)cc21 4554994 XQWDOZXIPBRSQK-GOSISDBHSA-N 390.233 2.895 0 50 GFAA Cc1nn(C)cc1CN(C)C[C@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67872808 IKPPFPGELDFUCT-HSZRJFAPSA-N 398.551 2.837 0 50 GFAA COc1ccc(CN(Cc2ccc3cn[nH]c3c2)[C@H]2CCS(=O)(=O)C2)cc1 119150820 VAHLZBQLZLDOSS-SFHVURJKSA-N 385.489 2.761 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 11817591 IXFHKAXULYKXJQ-INIZCTEOSA-N 392.459 2.980 0 50 GFAA Cc1ncccc1C(=O)N1CCC[C@@H](CCC(=O)N(C)C2CCN(C)CC2)C1 20999812 HCRPPKDAOXUFSG-SFHVURJKSA-N 386.540 2.575 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)CCNC(=O)c2ccccc2F)C[C@H]1O 67561290 NJLWIRRVOSRZGR-NVXWUHKLSA-N 390.480 2.693 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc4nc(C)cc(C)n34)CC2)cc1F 119918643 QHXLGLYRNQLBHM-UHFFFAOYSA-N 383.471 2.812 0 50 GFAA Cc1cc(NC(=O)c2cccc(CN(C)Cc3c(C)nn(C)c3C)c2)n(C)n1 67561544 SWDVYKGMOXVKNL-UHFFFAOYSA-N 380.496 2.963 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1cc2ncc(Br)cn2n1 2790003 LYVDGQSUZUMZLT-UHFFFAOYSA-N 375.182 2.515 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@@H](O)c2c(F)cccc2F)n1C 328640326 QANJVHUMNOBBDM-SJLPKXTDSA-N 377.435 2.924 0 50 GFAA CCN1CCN(C(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71715110 LKFPYCDCBCZORL-DEOSSOPVSA-N 391.515 2.698 0 50 GFAA Cc1c(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cnn1-c1ccccn1 153238565 FHCKVDZJNKJPSH-QGZVFWFLSA-N 393.422 2.640 0 50 GFAA CC(C)(C)NC(=O)c1cccc(NC(=O)N2CCO[C@@H]([C@H]3CCCO3)C2)c1 363962104 PWXPXJZCIMHGRV-IAGOWNOFSA-N 375.469 2.627 0 50 GFAA CCN(CC)C(=O)CN1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71753373 VCQGBLQMRRJHCF-IBGZPJMESA-N 377.504 2.753 0 50 GFAA Cn1c(CCC(=O)N2CC[C@@H](Cc3ccc(C(=O)O)cc3)C2)nc2cccnc21 72410966 BXECFUJQJQXYSF-INIZCTEOSA-N 392.459 2.690 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)on1 71388540 LOAQTZBRMKOBNL-HXUWFJFHSA-N 396.535 2.976 0 50 GFAA CC(=O)N[C@H](C(=O)Nc1cccc(-n2ncc(C(=O)O)c2C)c1)C1CCCC1 262309570 NLWMWPDSEURRDV-SFHVURJKSA-N 384.436 2.512 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC(C(=O)O)(n3ccc(C(C)(C)C)n3)CC2)s1 72410182 HDYLRCYUPFSVIJ-UHFFFAOYSA-N 390.509 2.970 0 50 GFAA COc1ccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cc1 71762461 CXOVHHUAHCDGSL-IBGZPJMESA-N 399.535 2.634 0 50 GFAA NC(=O)C[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)C1 175567290 IUMXZWNRUYDOMJ-HUUCEWRRSA-N 378.904 2.606 0 50 GFAA O=C(O)CC[C@]1(CCC(=O)NCc2cccc(Cl)c2Cl)CCC(=O)N1 223823380 PGSLWFIQBHYTQS-KRWDZBQOSA-N 387.263 2.903 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCOC[C@H]2C2CCOCC2)cc2sc(N)nc12 223049195 HXYNNKFTSAJGTK-GJZGRUSLSA-N 375.494 2.748 0 50 GFAA COCCn1cnnc1CN(C)C(=O)Nc1ccc(C(F)(F)F)c(F)c1 426405191 VCAMXHLUEJXQPU-UHFFFAOYSA-N 375.326 2.746 0 50 GFAA C[C@H]1CN(C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)CCS1(=O)=O 291642382 HJXYSMCAKBONIJ-JTQLQIEISA-N 388.367 2.620 0 50 GFAA Cn1c(=O)c(C(=O)N2CCN(c3ccccc3Cl)C(=O)C2)cc2ccccc21 82121858 DQZDAEKNLSNKIC-UHFFFAOYSA-N 395.846 2.681 0 50 GFAA CC(C)N1CCC(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)CC1 82109180 ZABJFWCLPDAMSP-UHFFFAOYSA-N 387.572 2.626 0 50 GFAA O=C(c1cncc(F)c1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95392508 BKIDEMBDKDQMOW-IOMROCGXSA-N 395.434 2.652 0 50 GFAA Cn1cnnc1SCC(=O)N1CCC[C@@](C)(Cc2ccc3c(c2)OCO3)C1 91747057 RYCFOJQZICVVLS-IBGZPJMESA-N 388.493 2.507 0 50 GFAA CCCS(=O)(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91526444 RNEVREZSJNNEJU-UHFFFAOYSA-N 378.538 2.674 0 50 GFAA Cc1ccccc1[C@]1(O)CCN(C(=O)c2cnc(-c3cccs3)nc2O)C1 91643583 YNDDCTYWMJPXAQ-FQEVSTJZSA-N 381.457 2.953 0 50 GFAA CC[C@H](C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1)n1cccn1 95526620 DSLAXVZHWRFUEU-LJQANCHMSA-N 378.480 2.880 0 50 GFAA Cc1c(C(=O)NCCCCCC(=O)O)sc2nc3n(c(=O)c12)CCCCC3 237781365 QZHIRPVTYCVLKR-UHFFFAOYSA-N 391.493 2.868 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)CCn3ccnc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95364418 HRARUNNIQDROHU-MDNUFGMLSA-N 394.519 2.679 0 50 GFAA CCc1nnc(NC(=O)[C@@H](C)N2CCC(OCc3ccccn3)CC2)s1 243885895 ADJNHKFQUHKJRJ-CYBMUJFWSA-N 375.498 2.504 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)NC2(CN3CCOCC3)CCCCC2)no1 534634287 OVEKZRPYCDXWOO-SFHVURJKSA-N 376.501 2.865 0 50 GFAA O=C(NC1CCN(C2CCSCC2)CC1)N[C@H](CO)c1ccc(F)cc1 584892912 VUOKKYXYSUVEQN-GOSISDBHSA-N 381.517 2.518 0 50 GFAA O=C(NC[C@@H]1CS(=O)(=O)c2ccccc21)N1CC[C@]2(CCc3ccccc32)C1 873027108 MLJFXIYNXPCKMV-VGOFRKELSA-N 396.512 2.857 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccnc(Oc2ccccc2)c1 1875402723 LMFNOZOHRQYHDP-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA FC(F)(F)[C@@]1(c2nc(C3CC3)no2)CCN(Cc2nc3c(s2)CNCC3)C1 952891120 AGVWJNQSATVHEC-INIZCTEOSA-N 399.442 2.755 0 50 GFAA COc1ccc2c(c1)C[C@H](NCCCNS(=O)(=O)c1ccc(C)cc1)CC2 952976527 RWMWUMQRSVDSNI-LJQANCHMSA-N 388.533 2.819 0 50 GFAA O=C(c1ccco1)N1CCC[C@H](NCc2ccccc2OCCn2ccnc2)C1 952966229 URSWRXLXNFJHMD-IBGZPJMESA-N 394.475 2.950 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(CNC(=O)c3ccoc3)CC2)c2cc(F)ccc2N1 952867593 QUDQPAAEABFEEQ-KRWDZBQOSA-N 399.422 2.513 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@]3(NC(=O)CC4(C)CCCC4)CCC[C@@H]23)n1 1775990049 CCFXZCJMIRKOQU-VGOFRKELSA-N 399.539 2.766 0 50 GFAA COc1cc(C(=O)NC2CCN(c3cccnn3)CC2)ccc1OCC(C)C 277141898 JZVBHNOTQCSDFG-UHFFFAOYSA-N 384.480 2.919 0 50 GFAA C[C@H](OC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)NC(=O)Nc1ccccc1 222025438 CTZAOWQTDUCFMH-AHQQAOBSSA-N 386.448 2.598 0 50 GFAA O=S1(=O)CC[C@@H](N(c2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)C1 5034306 WDONHTBMVAJOQW-OAHLLOKOSA-N 385.894 2.722 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)c2cc(C)nn2C)CC1 11715639 XNOXBERJLAQQOT-UHFFFAOYSA-N 399.491 2.765 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1)NC1CCC1 11934661 UBORSXXJHYPCJJ-QFIPXVFZSA-N 391.515 2.678 0 50 GFAA Cc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3snnc3C)C2)o1 12204085 IEVVWUQKADAQLG-CQSZACIVSA-N 376.482 2.697 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccccc1OC 13125219 PCUARVUBRMJYMD-SFHVURJKSA-N 392.419 2.618 0 50 GFAA O=C(c1ccccc1)N1CCN(C2=CC(=O)N(c3cccc(Cl)c3)C2=O)CC1 16134036 IAHHWBRMUOIMLE-UHFFFAOYSA-N 395.846 2.555 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC3(CC2)NC(c2ccccc2)=NO3)c1 169755036 PUHADNCKTPHSLL-UHFFFAOYSA-N 381.432 2.618 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccccn4)ccn3n2)c(C)c1 169775733 PVIQBOPSGGOJKE-UHFFFAOYSA-N 387.443 2.605 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCc3n[nH]c4c3CCCC4)C1)CC2 1857701013 KLJILBTYMIMXFI-QFIPXVFZSA-N 395.507 2.532 0 50 GFAA CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)NC[C@H](CO)CC1CCCC1 225622559 XBUZBVZKFHENKQ-APWZRJJASA-N 378.488 2.885 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)N3CCC(Cc4cccnc4)CC3)C2)n(C)n1 333764944 WMIPRMNFWWGRGP-HXUWFJFHSA-N 396.539 2.757 0 50 GFAA CNC(=O)c1cccc(CCNC(=O)Cn2cc(-c3ccccc3)c(C)n2)c1 469447247 ACEVXMDCYBFIPO-UHFFFAOYSA-N 376.460 2.577 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)NCc3cccc(F)c3)C1)CC2 1704335760 FCIRZGZBXRXLJU-OAQYLSRUSA-N 383.471 2.871 0 50 GFAA Cc1nc(-c2ccccc2)c(NC(=O)C2CCN(C(=O)[C@H]3CCCO3)CC2)n1C 2100545169 IMANYPICSOGLEC-GOSISDBHSA-N 396.491 2.752 0 50 GFAA O=C(Nc1nc(-c2cc3c(cc2Cl)OCCO3)cs1)c1cncnc1O 2100555065 LICWHERNSPKVHJ-UHFFFAOYSA-N 390.808 2.983 0 50 GFAA O=C(CCCN=c1nccc[nH]1)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 2325704986 KOYBWNQCUZABGO-UHFFFAOYSA-N 392.341 2.798 0 50 GFAA COc1ccc([C@@H]2C[C@H](C)N(C(=O)Cn3cnc4ccc(F)cc4c3=O)C2)cc1 2325734429 RFKHBTNHOVORHF-GOEBONIOSA-N 395.434 2.949 0 50 GFAA C[C@H](CNC(=O)C(C)(C)c1cccnc1)N(C)C(=O)C[C@H]1CCC(C)(C)CO1 2325794020 ODZSWIKBKWKTKV-SJLPKXTDSA-N 389.540 2.918 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CCCCC3)CC2)cc1 783983 QGQAEOXKQTVMEZ-UHFFFAOYSA-N 380.510 2.545 0 50 GFAA COC(=O)c1ccccc1NC(=S)N[C@@H](NC(C)=O)C(Cl)(Cl)Cl 1232356 FBMQXFUTLGCCFL-LLVKDONJSA-N 398.699 2.592 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)CCCc2ccc(F)cc2)C1=O 2356134973 KWMPMLADNVUMIA-NRFANRHFSA-N 376.472 2.778 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2cc(OC)c(OC)cc2OC)C1=O 2356138027 FNPVZSJZMCQWLV-OAQYLSRUSA-N 390.480 2.720 0 50 GFAA O=C(COc1ccc(CN2CCc3ccccc3CC2)cc1)NC[C@@H]1CCCO1 2356142237 JTTUYZRQEMBWPA-QHCPKHFHSA-N 394.515 2.961 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(Cc2cc(-c3cccnc3)no2)CC[C@H]1O 2356142925 NMKXHCPJOPIEPA-IFMALSPDSA-N 393.443 2.617 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2cnn(-c3cccc(Cl)c3)c2)C[C@@H]1O 2356144199 MRVVJELOFQHRLR-HKUYNNGSSA-N 377.872 2.963 0 50 GFAA CN(C)C[C@H]1[C@@H]2CC[C@@]3(CN(C(=O)c4ccc(N5CCCCC5)cc4)C[C@@H]13)O2 2356151177 VXFRPSOMOUHVBX-FBPBVXOASA-N 383.536 2.858 0 50 GFAA COCCSc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)s1 2865383 QEXUWEMXNRRQHU-GFCCVEGCSA-N 392.506 2.577 0 50 GFAA Cc1ccc(CC(=O)NCCOc2ccc(I)cc2)cn1 225756345 BUDIPKLZXIEZOJ-UHFFFAOYSA-N 396.228 2.732 0 50 GFAA COCCOc1ccc(C(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)cc1 8723061 LBIIRRCAFWTNNZ-GOSISDBHSA-N 398.459 2.873 0 50 GFAA Cc1nn(C)c2ncc(CONC(=O)c3cccc(Br)c3)cc12 135496015 DDCJXZBCUJAOKK-UHFFFAOYSA-N 375.226 2.901 0 50 GFAA NC1(C(=O)N2CCOc3c(O)cc(-c4nc5ccccc5s4)cc3C2)CC1 67982443 PHSFORHKFWRDHL-UHFFFAOYSA-N 381.457 2.881 0 50 GFAA O=C([C@@H]1COCCO1)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67714011 UIVQSPBNUCAPDU-SFHVURJKSA-N 389.835 2.849 0 50 GFAA CC1(C)Cc2cccc(CNCc3cccnc3N3CCC(C(N)=O)CC3)c2O1 119060909 JQLNOWVKUVEYRX-UHFFFAOYSA-N 394.519 2.787 0 50 GFAA CCN1CCN(C2(C(=O)NCCc3ccccc3F)Cc3ccccc3C2)CC1 22913366 HFAMTEUKJJKEJT-UHFFFAOYSA-N 395.522 2.660 0 50 GFAA CCOC(=O)c1cn(-c2ccccc2C(N)=O)cc(Oc2ccccc2)c1=O 65425830 OPGKQYRAEOUFRO-UHFFFAOYSA-N 378.384 2.905 0 50 GFAA O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1cccc(OCC(F)(F)F)n1 172361921 FFEJLXDTJKTWCJ-LBPRGKRZSA-N 379.338 2.879 0 50 GFAA O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCN(C/C=C/c2ccccc2)CC1 69348618 BLLBKPMERQHLBQ-ZGBFETHSSA-N 381.520 2.635 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCc2ccccc2C1)Cc1ccc(Cl)cc1 3105324 YJWLDNGEFUHRFA-UHFFFAOYSA-N 392.908 2.687 0 50 GFAA NC(=O)[C@H]1C[C@@H](C(=O)O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21 253185540 PZLZBGBHBUGRNT-ORAYPTAESA-N 394.427 2.586 0 50 GFAA Cc1nc2c(s1)CCC[C@H]2NS(=O)(=O)c1cccc(C(=O)N(C)C)c1 215345876 GMYMKZCEKRGGEN-CQSZACIVSA-N 379.507 2.509 0 50 GFAA C[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)CCN1 262956564 WCAJXJNGDWZMTD-PVXIVEMSSA-N 384.307 2.855 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)on1 77405977 XBQGMCQRUGNWFK-KRWDZBQOSA-N 375.444 2.646 0 50 GFAA CN(C)C(=O)CN(C(=O)c1ccnc(OCC(F)(F)F)c1)c1ccccc1 174081203 BTYONDRKZMTBMK-UHFFFAOYSA-N 381.354 2.758 0 50 GFAA COc1cc(S(=O)(=O)Nc2ncc(-c3cncc(F)c3)cn2)ccc1F 375759956 CTLMXCNOIWFWAO-UHFFFAOYSA-N 378.360 2.626 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(c3cc(C)nc(N)n3)C2)cc1OC 72145108 XZHRTXPNCSJEDG-QGZVFWFLSA-N 385.512 2.528 0 50 GFAA Cc1ccc(-c2cncc(C(=O)N3CCCC[C@@H]3CNC(=O)CCN)c2)cc1 262777846 KZTKFRHQRJBHNF-HXUWFJFHSA-N 380.492 2.517 0 50 GFAA CCCCN1CCN([C@@H](C(=O)N2CCCCCCC2)c2ccccc2)C(=O)C1=O 77437921 KJIRMRSPKHYKKA-HXUWFJFHSA-N 399.535 2.991 0 50 GFAA C[C@@H]1CN(Cn2nc(-c3cccs3)n(C[C@H]3CCCO3)c2=S)CCO1 242140861 WPXAPKQUKKRRNY-ZIAGYGMSSA-N 380.539 3.000 0 50 GFAA OCC[C@H]1CN(Cc2cccn2-c2ccccn2)CCN1Cc1ccccc1 20388303 FTUFDPAZTCYKCP-NRFANRHFSA-N 376.504 2.941 0 50 GFAA O=S(=O)(NCc1ccncc1OC[C@@H]1CCOC1)c1cccc2cnccc12 288679998 UICCWVOURSDZHO-OAHLLOKOSA-N 399.472 2.524 0 50 GFAA OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=N[C@H]2O 44699480 GBCYZJYLQAYLGN-KRWDZBQOSA-N 375.215 2.908 0 50 GFAA in-vitro CO[C@@]12CC[C@H](Oc3ccccn3)C[C@@H]1N(C(=O)Cn1nc(C)cc1C)CC2 426401871 MVYUTFRFHOBUCU-BBTUJRGHSA-N 384.480 2.513 0 50 GFAA O=C1c2ccccc2C(=O)N1CN1CCN(Cc2ccc(F)cc2Cl)CC1 20613935 FAVHSJONIRCWNS-UHFFFAOYSA-N 387.842 2.850 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccn(C(C)(C)C)c3)C2)CCC1=O 91551744 CMNWBTLDMUDOMD-NRFANRHFSA-N 375.513 2.734 0 50 GFAA CCc1cc(N2CCC(NCc3cnc4ccccn34)CC2)nc(N(C)C)n1 95501841 VHQSEQLEBHSVFU-UHFFFAOYSA-N 379.512 2.511 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C[C@H]1COc3ccccc3O1)CC2 91468508 SEXXJJVGHGWHLG-SFHVURJKSA-N 388.508 2.568 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2csc(S(C)(=O)=O)c2)CC1 179756099 ZWGPAQJTPFHFRF-UHFFFAOYSA-N 394.518 2.559 0 50 GFAA O=C([C@H](O)c1ccc(Cl)cc1)N1CCC2(CCC(=O)N(C3CC3)C2)CC1 91625114 JFFMNIDAQGGZPF-GOSISDBHSA-N 376.884 2.767 0 50 GFAA CCc1nc(C)ccc1OCC(=O)N1CC[C@H](Cc2cccc(C(N)=O)c2)C1 91426114 VBFSXFNBGQAYIT-QGZVFWFLSA-N 381.476 2.521 0 50 GFAA CCCc1cncnc1N1CCC(N2CCN(Cc3ccccn3)CC2)CC1 95521597 YPUPVOGJFXJVST-UHFFFAOYSA-N 380.540 2.611 0 50 GFAA CC(C)(C)c1cc(CNC(=O)Nc2ccc3c(c2)C(=O)N(C2CC2)C3=O)[nH]n1 96160496 WCMQODVTSVPFPZ-UHFFFAOYSA-N 381.436 2.787 0 50 GFAA CNc1ccc(-c2cccc(C(=O)NC[C@H](CO)Cc3ccsc3)c2)nn1 534673091 JCDJMVNXIDVKJD-OAHLLOKOSA-N 382.489 2.828 0 50 GFAA CN1C(=O)COc2ccc(C(=O)N[C@H]3CCCN(Cc4ccccc4F)C3)cc21 828288808 NWHKWXGXFHYJSN-KRWDZBQOSA-N 397.450 2.575 0 50 GFAA Cc1c(NC(=O)CCN2Cc3ccccc3C2=O)cccc1-c1nncn1C 828070149 XHEWWJYIBICMLR-UHFFFAOYSA-N 375.432 2.775 0 50 GFAA CC(=O)Cc1ccc(OC[C@@H]2C[N@]2Cc2cnn(C)c2)c(Br)c1 1875381689 DLHBVYGPIGPLAX-BTYIYWSLSA-N 378.270 2.577 0 50 GFAA CC(C)(C)OC(=O)N[C@@]12CC[C@@H](CN(C(=O)N=c3[nH]oc4c3CCCC4)C1)C2 1875323358 FYVJPWOTPWMIBS-ZUOKHONESA-N 390.484 2.886 0 50 GFAA O=C(N[C@@H]1C[C@@H]1[C@H]1CCCNC1)c1nccnc1-c1nc2ccccc2s1 1875293022 ZXSDOVPCDPPVFT-GZBFAFLISA-N 379.489 2.871 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 952982357 LCQGLOIKJFOALL-ZWKOTPCHSA-N 385.508 2.733 0 50 GFAA O=C(NOCc1ccc(F)cc1)N1CCCS(=O)(=O)C[C@H]1c1ccccc1 1343097020 DZFZKDUMJLNXDG-SFHVURJKSA-N 392.452 2.829 0 50 GFAA Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1ccc2nc(C(C)(C)CO)[nH]c2c1 1346410231 XFEBJOUOMBXFFW-SFHVURJKSA-N 381.480 2.852 0 50 GFAA Cc1cccn2c(=O)cc(CN3CCC[C@H]3c3nc4c(n3C)CCCC4)nc12 275898032 IFHQRQMDMNBBDF-IBGZPJMESA-N 377.492 2.952 0 50 GFAA CC[C@](C)(OC)C(=O)NCc1cccnc1Oc1cccc(S(C)(=O)=O)c1 280037900 AOHQISIFLKGISM-IBGZPJMESA-N 392.477 2.709 0 50 GFAA COc1ccc(CN2CC[C@@H](NC(=O)c3ccnc4ccccc34)C2=O)cc1 172266456 QSGKXLIFJAOMSN-HXUWFJFHSA-N 375.428 2.774 0 50 GFAA COc1ccc(-n2nnc(C(=O)N3CCOC[C@@H]3c3ccc(C)o3)c2C)cc1 172265321 MDNFKJHDCFVHDP-QGZVFWFLSA-N 382.420 2.699 0 50 GFAA C[C@@H]1C[C@H](CNc2ncnc3ccc(I)cc23)[C@@H](C)O1 413526813 CRIJGJRTLLMLJF-GMTAPVOTSA-N 383.233 3.460 0 50 GFAA CN1CCCN(C[C@@H](O)COCc2ccc3c(c2)OCO3)c2cc(F)ccc21 225442845 QTHIBWKFLCFBNZ-QGZVFWFLSA-N 388.439 2.778 0 50 GFAA NCCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC(F)F)c(F)c1 225427291 HHDNLCYNGVOEDX-UHFFFAOYSA-N 388.411 2.967 0 50 GFAA O=C(C[C@H](c1ccccc1)N1CCOC1=O)N=c1cc[nH]cc1Br 765182646 NQDJMOLPFCKXGE-OAHLLOKOSA-N 390.237 2.788 0 50 GFAA O=C(c1ccc(NCCc2nccc(-c3ccccc3)n2)nc1)N1CCOCC1 1529124993 DAOBJWDPNHIQCS-UHFFFAOYSA-N 389.459 2.666 0 50 GFAA Cc1cc(C)nc(CCNCc2ccccc2OC[C@H](O)CN2CCCCC2)n1 11933126 MGPISHDIVLMNNS-OAQYLSRUSA-N 398.551 2.651 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4ccc5[nH]ccc5c4)CC3)nn2)n1 169780516 WCRHPKFJVKVMFS-UHFFFAOYSA-N 391.435 2.849 0 50 GFAA Cc1[nH]c(-c2ccc(F)cc2)nc1C(=O)N1CC(=O)N[C@@H](Cc2ccccc2)C1 1857666583 FNHALWPGFSAQCE-SFHVURJKSA-N 392.434 2.708 0 50 GFAA O=C1C[C@@H](C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)C2(CCCC2)O1 1857674917 CVZAWFJESCUWFA-KRWDZBQOSA-N 379.460 2.880 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NCc3nccn3CC)cc12 1857684311 IEPVZNZRKHASCX-UHFFFAOYSA-N 388.537 2.778 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@H](C(=O)O)C4(CCOCC4)C3)cc2c1 1857694453 OTBQVFAGQIEQNX-QGZVFWFLSA-N 386.448 2.652 0 50 GFAA Cc1cc(C)nc(N2CC[C@@H](O)[C@]3(CCCN(C(=O)CC4=CCCC4)C3)C2)n1 1857694890 ZBZOPNXHHPRRAF-KNQAVFIVSA-N 384.524 2.774 0 50 GFAA COC(=O)c1coc(CN2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)n1 1857695428 JKVMQFDLSUVSMY-FUHWJXTLSA-N 386.448 2.708 0 50 GFAA O=C([C@H]1CC(=O)N(c2cccc(Cl)c2)C1)N1CCc2[nH]nc(C3CC3)c2CC1 1857701652 XNUYTANVVMXUIJ-AWEZNQCLSA-N 398.894 2.921 0 50 GFAA CCC(=O)NCC(=O)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1857739622 XVHZQSPAOIUYED-VQTJNVASSA-N 396.443 2.583 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3CCOc4c(Cl)cccc43)ccc21 123105612 YSRKHFWCXKHTFY-UHFFFAOYSA-N 392.864 2.837 0 50 GFAA O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc(-c2cnc3cccc(F)c3c2)cc1 2100480359 FNMSREWVVFGKAC-MRXNPFEDSA-N 384.432 2.958 0 50 GFAA COc1ccc(C(=O)Oc2cc(C(=S)N3CCOCC3)ccc2OC)cc1 866312 IMSKORWWBYXWKG-UHFFFAOYSA-N 387.457 2.931 0 50 GFAA CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C)cc1 1908378 YCNXJLYOYVQVPB-IBGZPJMESA-N 386.473 2.929 0 50 GFAA biogenic,in-vitro Cc1nn(C)cc1S(=O)(=O)Nc1nn(Cc2ccccc2F)cc1Cl 2804893 SRWVLHCVYQJNRR-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA CCOC(=O)CCS(=O)(=O)c1nc(-c2ccccc2)cc(C(F)(F)F)n1 2866172 KAGZAFKDOSGALN-UHFFFAOYSA-N 388.367 2.889 0 50 GFAA COc1ccc(-c2noc(CN(C)S(=O)(=O)c3ccccc3)n2)cc1OC 2866918 PGQHAPYYMYBCKA-UHFFFAOYSA-N 389.433 2.575 0 50 GFAA COC(=O)c1c(NC2=NS(=O)(=O)c3ccccc32)sc2c1CCCC2 3272752 XOXLUHCWHSHQIC-UHFFFAOYSA-N 376.459 2.975 0 50 GFAA O=C1CN(C(=O)C23CC4CC(CC(C4)C2)C3)CC(=O)N1CCc1ccccc1 4451860 BVQOPGXBWPIYQB-UHFFFAOYSA-N 380.488 2.643 0 50 GFAA CC1(C)CC(NC(=O)c2ccc(I)o2)CC(C)(C)N1 4981848 SBYHBILJLKPJEG-UHFFFAOYSA-N 376.238 2.923 0 50 GFAA O=C(c1ccc(F)cc1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 6335577 XGDVSQXPVMWLEF-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA COC(=O)c1ccccc1-c1cc(C)cc2c1O[C@H](CNC(=O)[C@@H]1CCOC1)C2 12027310 DEWFFSOFJYPKAO-WBVHZDCISA-N 395.455 2.905 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C2CCN(Cc3ccoc3)CC2)CC1 12303701 HNVWNDQKJZCNJM-UHFFFAOYSA-N 382.508 2.667 0 50 GFAA C[C@H](Cn1cncn1)NC(=O)c1cc(COc2cccc(C(F)(F)F)c2)on1 12466320 KFIQPPPUQCZNBO-LLVKDONJSA-N 395.341 2.682 0 50 GFAA COCCNC(=O)CCC1CCN(C(=O)Nc2cc(C)ccc2OC)CC1 12591129 XTCDMXCMFTWFQP-UHFFFAOYSA-N 377.485 2.790 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(COc3ccc(F)cc3)n2)C1 12714177 CBJOWSUPGHTZTQ-CYBMUJFWSA-N 376.384 2.808 0 50 GFAA Cn1cc(CCC(=O)NCc2cccnc2N2CCc3ccccc3C2)cn1 15065224 JMGLINLTURCJDH-UHFFFAOYSA-N 375.476 2.627 0 50 GFAA CN(Cc1n[nH]c(=O)[nH]1)C(=O)c1ccc([C@@H]2CCCN2C2CCCC2)s1 20449652 OSQTXUINAOSTGP-ZDUSSCGKSA-N 375.498 2.511 0 50 GFAA O=C(Cn1cc(-c2ccc(CO)cc2)cn1)Nc1ccn(Cc2ccccc2)n1 48234083 ZPAQTDRAPMSZJA-UHFFFAOYSA-N 387.443 2.926 0 50 GFAA COc1cccc(CN2CCN(Cc3nc4ccccc4[nH]3)C[C@H]2CCO)c1 52575123 RQHGXDGSRUBMOO-GOSISDBHSA-N 380.492 2.640 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1Cl)NC1CCCCC1 55368644 XMORVUMWTQKZEZ-KRWDZBQOSA-N 381.879 2.619 0 50 GFAA Cn1ccnc1NC(=O)c1ccc(CN2CCC(Oc3ncccn3)CC2)cc1 65528549 FATNHWXYKVLIPI-UHFFFAOYSA-N 392.463 2.506 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)NCC2(c3ccc(Cl)cc3)CC2)cc1 66937294 FWBKDEAZYQIFAX-UHFFFAOYSA-N 378.881 2.710 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@H](C)c2ccncn2)n1Cc1ccccc1 67588104 AUYKEIDRPYDLLW-MRXNPFEDSA-N 399.520 2.708 0 50 GFAA CC[C@@]1(C2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)CC2)NC(=O)NC1=O 67856376 IBSILFYEJPHPSO-NRFANRHFSA-N 380.448 2.522 0 50 GFAA Cc1ccc(F)c(NC(=O)C[C@@H]2COCCN2C(=O)CCc2cccnc2)c1 72428520 XUHYYQOEECJNCZ-QGZVFWFLSA-N 385.439 2.718 0 50 GFAA COc1ccc(-n2ncc([C@@H](C)NC(=O)CSc3nnc(C)o3)c2C)cc1 91460944 OHONHADLMQGFJH-LLVKDONJSA-N 387.465 2.850 0 50 GFAA Cc1nc(-c2ccncc2)ncc1[C@@H](C)NC(=O)Cc1cn2ccsc2n1 91468439 KQQQOBPJBXDSCU-GFCCVEGCSA-N 378.461 2.976 0 50 GFAA Cc1ccc(CN2CC[C@H](N3CCC(N4CCOCC4)CC3)CCC2=O)cc1 91506394 HQIKDKLIMRXCSX-OAQYLSRUSA-N 385.552 2.673 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3ccccc3SC)C2)CCC1=O 91859811 RYFSWEBGPKCIMF-FQEVSTJZSA-N 376.522 2.900 0 50 GFAA O=C(c1nc(N2CCCC2)nc2c1CCCC2)N1CCC[C@@H](c2ncc[nH]2)C1 95498477 JNRNOVPPKGIBMX-OAHLLOKOSA-N 380.496 2.699 0 50 GFAA Cc1ccc(F)cc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95508753 UGKRWHHFALGWOE-UHFFFAOYSA-N 396.466 2.783 0 50 GFAA CCCN(C/C=C/c1ccccc1)C(=O)Cn1ncc(N2CCCC2)cc1=O 95509408 RXKHZBQGNNVIEQ-DHZHZOJOSA-N 380.492 2.796 0 50 GFAA Cc1ccc(S(=O)(=O)n2cc(I)c3nccnc32)cc1 95707569 SRVCFXSYVHUCOB-UHFFFAOYSA-N 399.213 2.581 0 50 GFAA COc1cccc2c1OCCCN(C(=O)Nc1ccc3c(c1)oc(=O)n3C)C2 96150012 AGWFDVVJFVGQQR-UHFFFAOYSA-N 383.404 2.957 0 50 GFAA CNC(=O)Cc1ccc(NC(=O)NCc2cccc(CN3CCCC3)c2)cc1 97492406 MBGPRPGRALTMHW-UHFFFAOYSA-N 380.492 2.893 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@@H](NCc3ccc(C(=O)O)cc3)C2=O)cc1 100632420 NQMHRKNEZDFSKH-GOSISDBHSA-N 382.416 2.595 0 50 GFAA O=C1CCCCN1CC1CCN(C(=O)c2ccc(OCC(F)(F)F)nc2)CC1 118676408 PCBJPZKYOIRTKS-UHFFFAOYSA-N 399.413 2.887 0 50 GFAA NC(=O)c1cccnc1N1CCN(Cc2cccc(OC3CCCC3)c2)CC1 133137174 ZFIWIFHYHOGMDQ-UHFFFAOYSA-N 380.492 2.824 0 50 GFAA CCc1nn(C)c2[nH]nc(NC(=O)[C@H]3COc4ccc(Br)cc43)c12 134949386 ZZWHRHHDICNHEO-JTQLQIEISA-N 390.241 2.736 0 50 GFAA CN1c2cc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2C(=O)N2CCCCC[C@H]21 169766077 HDVOOBQIFZJEEI-IBGZPJMESA-N 392.459 2.830 0 50 GFAA COc1ccc(C(=O)N2CCN(c3cc(C(F)(F)F)ncn3)CC2)cc1F 169772255 ILTSLLDJRRRFED-UHFFFAOYSA-N 384.333 2.606 0 50 GFAA Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)N[C@@H](C)c1ncc[nH]1 170617835 GAXVVTFEDCZZAT-HNNXBMFYSA-N 398.488 2.688 0 50 GFAA CCOc1ncccc1CNC(=O)N1CCN(c2nc3ccccc3o2)CC1 172347554 HYXOQMPHPCMBMQ-UHFFFAOYSA-N 381.436 2.653 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)CC1 190729936 FFHMHRBHLSSZIZ-RUXDESIVSA-N 398.491 2.922 0 50 GFAA COC(=O)C[C@H](C1=Cc2ccccc2OC1)c1c(O)n2ccccc2nc1=O 205949611 XMJGAEGJMFLCML-OAHLLOKOSA-N 378.384 2.523 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)Cc3ccc(F)c(Cl)c3)CC[C@@H]21 213225793 DTNFPNWNBAXSHN-QAPCUYQASA-N 396.890 2.898 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2c(F)cccc2F)C[C@@H]1c1ccc2c(c1)OCO2 216656306 PTSZQBLZJVSCPK-NEPJUHHUSA-N 375.327 2.634 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@@H]4C[C@H](C3)Cn3c4cccc3=O)[nH]n2)cc1 225418338 XDHILGUKIZFGFU-ZBFHGGJFSA-N 390.443 2.507 0 50 GFAA biogenic CC[C@H]1CN(C(=O)C2(C)CCN(Cc3ccccc3)CC2)CCN1C[C@H](C)O 251673197 MGUHGJAJHICLCJ-FPOVZHCZSA-N 387.568 2.592 0 50 GFAA CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2ccc(C(=O)O)cc2)C1 262313260 QDASAAHYLRTRFO-AWEZNQCLSA-N 386.370 2.648 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)N(C)Cc4ccccc4)c3CO2)cc1 263616519 JDYPXJBJVSQZIU-IBGZPJMESA-N 378.432 2.830 0 50 GFAA O=C(N[C@@H]1CCCc2sccc21)N1CCC(S(=O)(=O)N2CCCC2)CC1 283885701 UBNMYNRHZKSKKQ-MRXNPFEDSA-N 397.566 2.725 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C(=O)NCc1ccccc1 299125159 HLUOMMWUMNOPGJ-WBVHZDCISA-N 399.516 2.564 0 50 GFAA COc1ccc(C(=O)N2CCCC2)cc1NC(=O)Cn1cnc2ccccc21 299324578 ZHDONHQYRICSDB-UHFFFAOYSA-N 378.432 2.920 0 50 GFAA Cc1ccc(-n2cnnc2)cc1NC(=O)NCc1nc(C)c2c(n1)CCCC2 299790084 AQOJFJRPYNLTJR-UHFFFAOYSA-N 377.452 2.875 0 50 GFAA O=C([C@H]1CC12CCCC2)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 329393409 USOOAKSFEYCKRH-QZTJIDSGSA-N 388.533 2.950 0 50 GFAA Cc1cnc(OC(C)C)c(NC(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c1 333703998 RXEDCVFQSGYDAB-GOSISDBHSA-N 381.498 2.610 0 50 GFAA COc1ccc([C@@H]2CCN(C(=O)NCc3ccc(-n4ccnc4)nc3)C2)cc1 363370992 VVZBJMRCCYIDTR-GOSISDBHSA-N 377.448 2.975 0 50 GFAA O=C(O)Cn1nccc1[C@H]1CCCN(C(=O)C2=Cc3ccccc3OC=C2)C1 426575038 ONXSQICMVHOYOF-KRWDZBQOSA-N 379.416 2.663 0 50 GFAA CSc1ncc(CNC(=O)N2CCC([C@H](O)c3cccs3)CC2)n1C 584888344 CAFOJSIJRXIFPW-HNNXBMFYSA-N 380.539 2.859 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)NC23CC4CC(CC(C4)C2)C3)N1 1506406052 MHUOLVACUPMEOP-ONUXSRJRSA-N 382.508 2.841 0 50 GFAA CCCC[C@H]1CN(C(=O)c2ccc(NC(=O)CN(C)C)cc2)C[C@@H](C2CC2)O1 1616082713 AYFINVJCBPZEML-PMACEKPBSA-N 387.524 2.997 0 50 GFAA CN(C)C[C@]12CN(C(=O)C3C(C)(C)C3(C)C)C[C@H]1CN(c1ccncc1F)C2 1772812108 APTYSKZDULRFPI-QRQCRPRQSA-N 388.531 2.729 0 50 GFAA C[C@H]1CC[C@@H](C(=O)NCC2(O)CCN(C(=O)CCCC(F)(F)F)CC2)C1 1775992518 QSYCINMFDUAPDH-UONOGXRCSA-N 378.435 2.625 0 50 GFAA Cn1c(=O)c(-c2nccn2-c2ccc(F)c(-n3cnnn3)c2)cc2ccccc21 1857673636 QEKXOSDOXQXZHW-UHFFFAOYSA-N 387.378 2.506 0 50 GFAA O=C(c1ccc(-c2nc[nH]n2)cc1)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1857716770 SETWGRWLQNAAPB-NQIIRXRSSA-N 399.454 2.696 0 50 GFAA COc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c(C)c1 1857726795 CQRGYLREEPJIOS-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA COc1nc2ccccc2cc1-c1ccccc1OC[C@@H](O)CN1CCOCC1 1875242259 PVKYAGHUJKZNDS-SFHVURJKSA-N 394.471 2.982 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)Cc4ccsc4)[C@H]4CC[C@]3(C2)O4)nc1 1875242819 CZEURHKNKAFYDW-XKGFGPFHSA-N 383.517 2.794 0 50 GFAA O[C@H]1CCCN(c2cc(CNc3nccn4nc(C(F)(F)F)cc34)ccn2)C1 1875272009 GPAIGWQCHNVNLS-ZDUSSCGKSA-N 392.385 2.716 0 50 GFAA Cn1cc(CN(C(=O)[C@H]2CCn3c(C(=O)c4ccccc4)ccc32)C2CC2)nn1 1875274722 UOGPCIJDRGCKCA-SFHVURJKSA-N 389.459 2.526 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)NCCN3CC[C@H](CO)C3)cs2)cc1 1875307101 KOPJCHBDJUHMIA-INIZCTEOSA-N 387.549 2.906 0 50 GFAA Cc1cccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1C 1875397105 LMXRUIRPWHTSTL-LJQANCHMSA-N 381.524 2.781 0 50 GFAA O=C(NCC12CC(C(=O)O)(C1)[C@@H](c1ccccc1)O2)[C@@H]1CC2(CCCC2)CO1 1875404685 QRPILPWZDMMPJG-JTFAEATFSA-N 385.460 2.827 0 50 GFAA CO[C@H]1C[C@@H](C(=O)NCC2=CCCCC2)CC[C@@H]1NC(=O)c1cccc(O)c1 2100547386 IJTFGTVKMXMNCO-IHPCNDPISA-N 386.492 2.922 0 50 GFAA Cc1cc(Br)c(F)cc1[C@H](C)NC(=O)CC1CC(=O)NC(=O)C1 2325781235 ZOAPGABTWWDNDK-VIFPVBQESA-N 385.233 2.517 0 50 GFAA CC1(C)O[C@]2(CCCN(C(=O)[C@@]3(c4ccccc4)C[C@@H]3C(F)(F)F)C2)NC1=O 2325784337 VHTVHDWVLWDNEA-ZOCIIQOWSA-N 396.409 2.750 0 50 GFAA COc1cc(F)ccc1C(=O)N1CCC[C@]2(CCc3cnc(N(C)C)nc32)C1 2356158063 BUZQAGJCQKCUGQ-NRFANRHFSA-N 384.455 2.811 0 50 GFAA COCCN1CCC[C@]2(CCCN2Cc2ccc3c(c2)OC(F)(F)O3)C1=O 2356162708 IXMAAMUOUHCTCM-SFHVURJKSA-N 382.407 2.612 0 50 GFAA CCOc1ccc(N(CC(=O)Nc2ccc(C(C)=O)cc2)S(C)(=O)=O)cc1 835389 ORCSOHHVVYJQBU-UHFFFAOYSA-N 390.461 2.693 0 50 GFAA COc1cccc([C@H]2NC(=O)NC(C)=C2C(=O)OCc2ccc3c(c2)OCO3)c1 844448 MLDSRMDEOAKFFQ-LJQANCHMSA-N 396.399 2.795 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(F)cc1Cl 2356137059 PZJNIHPUFVEJDA-GJZGRUSLSA-N 377.803 2.905 0 50 GFAA CC(C)(C)c1ccc(OCC(=O)N2CCC(C(N)=O)CC2)c(Br)c1 2849286 RBLAIEOLYSGFEG-UHFFFAOYSA-N 397.313 2.849 0 50 GFAA CC[C@H](Cc1ccccc1Br)C(=O)NCc1nnc(S)n1C 134312627 QCHPNDDCYCITLB-SNVBAGLBSA-N 383.315 2.751 0 50 GFAA CCN1CCN(CC(=O)NCc2cccnc2Oc2c(C)cccc2C)CC1 20109497 ZEOQUVPNEYGTCJ-UHFFFAOYSA-N 382.508 2.744 0 50 GFAA C[C@H]1CCCN(c2ccc(C(=O)N3CCC(CN4CCCC4=O)CC3)cn2)C1 20908752 RYEXPSVDUAEUOR-KRWDZBQOSA-N 384.524 2.793 0 50 GFAA O=C(c1ccc(-n2cc(Br)cn2)nn1)N(CC1CC1)c1cccnc1 135552000 SMPMUTTWTDPVQS-UHFFFAOYSA-N 399.252 2.877 0 50 GFAA O=C(c1ccnc(Br)c1)N1CCN(Cc2ccc(Cl)nc2)CC1 135614139 VBADELCDUWTJSU-UHFFFAOYSA-N 395.688 2.851 0 50 GFAA CCC1CCN(C[C@]2(O)CCCN(Cc3cc(OC)ccc3F)C2=O)CC1 67563178 QXSIRQXJKXHYEN-OAQYLSRUSA-N 378.488 2.810 0 50 GFAA CCS(=O)(=O)c1ccc(O)c(NC(=O)Cn2ccc3ccc(F)cc32)c1 20723848 MILRYYJHDRWTQO-UHFFFAOYSA-N 376.409 2.918 0 50 GFAA Cc1cccc(CN2CCN(C(=O)[C@@H](Cc3cnc[nH]3)n3cccc3)CC2)c1 63848752 FAXYUJUDOWNXPN-OAQYLSRUSA-N 377.492 2.648 0 50 GFAA O=C(C1CCN(C2CCN(CC3CCCCC3)CC2)CC1)N1CCOCC1 12702278 WVFLULFOSSPUNF-UHFFFAOYSA-N 377.573 2.602 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1cnc(C(F)(F)F)nc1 126311554 DYPFGAOWQPOKJG-HNNXBMFYSA-N 378.398 2.790 0 50 GFAA CN(C)CCN1C(=O)CC[C@@H]1CCNC(=O)c1cc2c(Cl)cccc2n1C 215777847 HDMNBZFZPMBBDQ-CQSZACIVSA-N 390.915 2.504 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 236582271 SGPVXEUUHMPDTF-SFTDATJTSA-N 392.455 2.561 0 50 GFAA Cc1c(NC(=O)[C@]2(O)CCc3ccccc3C2)nnn1Cc1ccccc1F 367635694 OQDRUBGUJNYHEL-NRFANRHFSA-N 380.423 2.632 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)c2ccncc2)cc1 181522723 QMXMVHNJMHBHDY-IBGZPJMESA-N 381.457 2.509 0 50 GFAA CCn1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)c1C 39489772 AZFXPKIPPTXXFP-GOSISDBHSA-N 378.467 2.558 0 50 GFAA CC(=O)c1cc(C(=O)N2CCO[C@H](Cc3ccccc3Cl)C2)c(=O)[nH]c1C 71751036 WRWDQALKIQYTTK-OAHLLOKOSA-N 388.851 2.623 0 50 GFAA COc1cc(N2CCN(C(=O)Nc3cccc(Cl)c3OC)CC2)ncn1 461991957 ZWLDCIJPMLWBCB-UHFFFAOYSA-N 377.832 2.501 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N2CCN(C3CCSCC3)CC2)c1 97813756 JHGQKNIWOSYEDK-UHFFFAOYSA-N 380.489 2.829 0 50 GFAA O=C1CN(C(=O)[C@H]2CCOc3ccccc3C2)CCN1Cc1ccccc1F 97360248 MKHKWSJVOXIDJI-KRWDZBQOSA-N 382.435 2.638 0 50 GFAA Cc1cnn(CCCNC(=O)c2cnc(CSc3ccccc3)nc2O)c1 91535565 GTQNBBWJHHAUHD-UHFFFAOYSA-N 383.477 2.800 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)c2cnc(COc3ccccc3)[nH]c2=O)no1 91468946 IEVUKEYVRPBHCQ-QGZVFWFLSA-N 380.404 2.623 0 50 GFAA O=C(NCc1ccco1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95363776 YLVMLFSMFJWHTI-IOMROCGXSA-N 395.459 2.780 0 50 GFAA CCNc1nc(C)c(C(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)O)C2)s1 95531583 MXIOLJPLXKWQPR-BFUOFWGJSA-N 387.461 2.586 0 50 GFAA CN(C)c1cccc(NC(=O)CCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)n1 183939486 YTQMJMQFLFAUST-UHFFFAOYSA-N 397.504 2.896 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)cc1 299388321 ZHGFCSFVZRVFJJ-XIRDDKMYSA-N 379.478 2.727 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCCN3CCCc4ccccc43)cn12 1940193549 SVEOLTURMIYDJU-HXUWFJFHSA-N 393.491 2.601 0 50 GFAA COCCCNC(=O)C[C@@H](c1ccc(OC)cc1)c1cc2c(cc1O)OCO2 824390212 SGDNEWKPTRFBHV-INIZCTEOSA-N 387.432 2.804 0 50 GFAA CCc1cncc(C(=O)N2CCC[C@H](CCN=c3ccc4ncc[nH]c-4n3)C2)c1 1875327253 RQEUQODVOGOLFB-QGZVFWFLSA-N 390.491 2.710 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2cnco2)cc1 1875401569 LLOFDTYFOQRVFV-DOTOQJQBSA-N 379.420 2.789 0 50 GFAA COc1ccc(C(=O)N[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875402571 HMOCKNNIQBTVJA-USXIJHARSA-N 381.432 2.721 0 50 GFAA O=C(c1cnc(NCc2nccc(C(F)F)n2)c(Cl)c1)N1CCOCC1 952845883 GDSYYOQTMLSYPZ-UHFFFAOYSA-N 383.786 2.547 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCC(Nc3cccnn3)CC2)ncn1 275574503 GLZBUGTXJPATLD-LAUBAEHRSA-N 397.527 2.963 0 50 GFAA CCOc1ccccc1C(=O)N1CCN([C@@H]2CCc3ccccc3NC2=O)CC1 191948387 QDTBDACLIFNIBZ-HXUWFJFHSA-N 393.487 2.797 0 50 GFAA O=C([C@@H]1Cc2cc(Br)ccc2O1)N1CCC(n2ccnc2)CC1 194209288 BOLCBWJZJOIWSB-INIZCTEOSA-N 376.254 2.813 0 50 GFAA O=C(CCCN1CCCCC1=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1529197365 PCUWSCHFUARZJQ-NQIIRXRSSA-N 395.503 2.701 0 50 GFAA COc1ccnc(C(=O)N2CCCN(Cc3ccc(-n4ccnc4)cc3)CC2)c1 1529105192 XVMYPADYFQMRRN-UHFFFAOYSA-N 391.475 2.624 0 50 GFAA CCc1nccc(CN2CC[C@@]3(CO)CCCN(Cc4cccc(O)c4)[C@@H]3C2)n1 1704311689 QDSGEJFOWZVBPO-FYYLOGMGSA-N 396.535 2.594 0 50 GFAA COc1cccc(SCC(=O)N2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)c1 1704352914 MMIJFDMRYAPCDH-KDOFPFPSSA-N 376.478 2.800 0 50 GFAA C[C@@H](c1ccccc1)n1c(CN2C[C@H]3[C@@H](C2)C3(CO)CO)nc2ccccc21 1772811092 ORDJYIDFZOEIFO-YTQUADARSA-N 377.488 2.678 0 50 GFAA O=C(Cc1cccc(F)c1F)N1CCCN(C2CSCCSC2)CC1 1775980666 GQDRYLQFWGZNJX-UHFFFAOYSA-N 386.533 2.890 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N(C)C[C@H]2COc3ccccc3O2)n[nH]1 11663076 YQMWGWRXRBDKBL-INIZCTEOSA-N 395.463 2.690 0 50 GFAA O=C(NC1CC1)c1cn(CC[C@H]2CCCCN2C(=O)CCc2ccccc2)nn1 11997805 NLGMWWMRUMYWPF-LJQANCHMSA-N 395.507 2.574 0 50 GFAA CCN(CCn1cccn1)C(=O)CCc1nnc(Cc2c[nH]c3ccccc23)o1 12481550 OALKSILVHMOGKR-UHFFFAOYSA-N 392.463 2.820 0 50 GFAA Cc1nnc(SCC(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)o1 12712178 VQUYEIXWPDBQOE-CQSZACIVSA-N 387.440 2.989 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCc1cccc(F)c1F)C2 14746018 FEUQUQNMXLASEE-OAHLLOKOSA-N 388.462 2.972 0 50 GFAA CC[C@H](C)CN1CCc2nnc(CCNC(=O)c3ccc(C)cc3C)n2CC1 14878839 IFKOVUNNMDCMDF-INIZCTEOSA-N 383.540 2.772 0 50 GFAA Cc1nc(C)c(CN2CCC3(CC2)c2ccccc2[C@@H](N(C)C)[C@@H]3O)nc1C 19771142 JRWDAOQXNUXGGP-YADHBBJMSA-N 380.536 2.913 0 50 GFAA O=C(Nc1nc2c(s1)CCC2)[C@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 169772936 XHXLCWDSDGYCNI-VIFPVBQESA-N 385.424 2.639 0 50 GFAA CCOC(=O)N1CC[C@H](NCc2nc(-c3ccc(OC)c(O)c3)oc2C)C1 1857685748 RRYULLIZTRCRGW-AWEZNQCLSA-N 375.425 2.685 0 50 GFAA C[C@H]1CN(C[C@@H](O)C2CCN(c3nc4ccccc4s3)CC2)C[C@@H](C)O1 1857708713 JBLGHSHZNLJKDI-RVKKMQEKSA-N 375.538 2.983 0 50 GFAA O=C1NCC(=O)N2C[C@H](n3ccnc3-c3cccc4c3oc3ccccc34)C[C@@H]12 1857709152 IFGHFRBFEJADOB-DYVFJYSZSA-N 386.411 2.721 0 50 GFAA Cc1nnc(CN2[C@H]3CC[C@@H]2C[C@]2(C3)CN(c3nccs3)CCO2)s1 1857710611 HBQPOSZAUZBIKM-HALDLXJZSA-N 377.539 2.705 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@@H]1C[C@@H](C(=O)NC(C)C)CC[C@H]1OC 1875245831 SYRLVQAGEVEVSE-XGWLTEMNSA-N 382.888 2.787 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3)C1(c2ccccc2)CC1 1875247780 OFUBTWHLSULVNE-UECWXEIQSA-N 389.499 2.913 0 50 GFAA CC(C)[C@@H](CNC(=O)c1cnc(-c2ccccc2F)s1)N1CCN(C)CC1 112914627 AXNMOFHBIACULO-QGZVFWFLSA-N 390.528 2.951 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N3CCC(CN4CCCCC4=O)CC3)c2c1 135318270 RMHOBFNOJFXOSY-UHFFFAOYSA-N 383.492 2.970 0 50 GFAA COc1ccc(OC)c(NC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 32601819 HYLSDEIJHARDPZ-UHFFFAOYSA-N 399.447 2.782 0 50 GFAA O=C(N[C@H]1CCCc2sccc21)c1nc(N2CCOCC2)ncc1Cl 2325738052 LDRAATORVUWSFF-ZDUSSCGKSA-N 378.885 2.836 0 50 GFAA O=C(CCc1cc2ccccc2nc1O)NS(=O)(=O)CCc1cccs1 2325740878 BAQDZIFMYWIEPJ-UHFFFAOYSA-N 390.486 2.623 0 50 GFAA O=C1NC2(CCC2)C2(CCN(C(=O)Nc3c(F)ccc4c3OCO4)CC2)O1 2325781773 KDZFKMVIXYRGQN-UHFFFAOYSA-N 377.372 2.583 0 50 GFAA CCCc1nnc(NC(=O)CSc2nnc(-c3ccncc3)n2CC)s1 4736163 BXVOXAAXKXYSBO-UHFFFAOYSA-N 389.510 2.895 0 50 GFAA CCCCNC(=O)N1CCC[C@@H](CNC(=O)c2cc(OC)cc(OC)c2)C1 11944267 UWMRFTOZPZNAJA-HNNXBMFYSA-N 377.485 2.655 0 50 GFAA O=C1NCCN(C(=O)c2cc(COc3ccccc3)on2)[C@H]1c1ccc(F)cc1 12057982 HFZHQVBFVAJWHR-IBGZPJMESA-N 395.390 2.706 0 50 GFAA Cc1nccn1CCCNC(=O)c1cc(COc2ccc(F)cc2F)on1 15066997 DEMNITDEMQMTAQ-UHFFFAOYSA-N 376.363 2.857 0 50 GFAA CSc1ccccc1NC(=O)NCc1cccnc1N1CCN(C(C)=O)CC1 19113325 OLNZBCOKKVFALG-UHFFFAOYSA-N 399.520 2.794 0 50 GFAA CC(C)CNC(=O)C1CCN(S(=O)(=O)Cc2c(F)cccc2Cl)CC1 24613218 WFNVVQLXQKPGGM-UHFFFAOYSA-N 390.908 2.793 0 50 GFAA Cc1nn(CC(=O)N2CCCN(Cc3cccs3)CC2)c(=O)c2ccccc12 41363452 OALWXGLPCWGONK-UHFFFAOYSA-N 396.516 2.501 0 50 GFAA O=C1NCCN(Cc2c(F)cccc2Cl)[C@H]1CC(=O)N1CCCCCCC1 55271215 MOOBTAKYEJPCNE-SFHVURJKSA-N 395.906 2.962 0 50 GFAA CNC(=O)c1cccnc1N1CCC(n2cc(-c3ccc(C)cc3)nn2)CC1 63834973 HNICJOVKGOLCPM-UHFFFAOYSA-N 376.464 2.850 0 50 GFAA COc1cccc2c1OC[C@@H](NC(=O)c1coc(COc3ccccc3)n1)C2 67921732 RVLRMYSACSBTPE-HNNXBMFYSA-N 380.400 2.996 0 50 GFAA CC[C@@H]1CN(c2ccc(C(=O)NCCCc3ccc(OC)cc3)cn2)CCN1 67934211 LMTADYUARGIWPQ-LJQANCHMSA-N 382.508 2.641 0 50 GFAA O=C(NCC(F)F)[C@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 71747588 KFCKSYRXFKXRMJ-SFHVURJKSA-N 379.495 2.787 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCCc3ccccc3)C2=O)c1 71753470 QXJBMQPNVVKKPV-JOCHJYFZSA-N 386.467 2.520 0 50 GFAA Cc1[nH]c(=O)c(C(=O)N[C@@H]2CC(=O)N(C3CCCCCC3)C2)c(C)c1Cl 72143305 BYEFBSJDPLGXCM-CYBMUJFWSA-N 379.888 2.699 0 50 GFAA CC(C)c1cc(C(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2ccccc2)C3)nc(N)n1 95387878 ZEHFCGXXLARORL-QZTJIDSGSA-N 379.508 2.919 0 50 GFAA CC(C)CCN1C[C@]2(CCCN(C(=O)Cc3ccc(CO)cc3)C2)CCC1=O 95502396 WGEUUWRVQIGODH-HSZRJFAPSA-N 386.536 2.999 0 50 GFAA CC[C@@H](NC(=O)Nc1cc(OC)cc(-n2nnnc2C)c1)c1ncccc1C 95522420 HXZXVIJSRWBKEP-QGZVFWFLSA-N 381.440 2.956 0 50 GFAA CCCOCc1nc(C2(c3ccccc3)CC2)nn1[C@H]1CCS(=O)(=O)C1 96149620 RXYMAGUKQWLMMQ-INIZCTEOSA-N 375.494 2.644 0 50 GFAA COc1ccc([C@@H]2[C@H]3C(=O)N(C(C)C)C(=O)[C@@H]3ON2c2ccccc2)c(OC)c1 101268078 VVSVAJQQYLURHZ-VAMGGRTRSA-N 396.443 2.959 0 50 GFAA CN1CCC(N2CCN(c3ccc4cc(Cl)ccc4n3)C[C@H]2CCO)CC1 106954485 DGADDJFGFBAAIX-LJQANCHMSA-N 388.943 2.855 0 50 GFAA O=S(=O)(c1ccccc1F)N1CCC[C@H](c2nnc3n2CCCCC3)C1 119886727 LVROCFYAIURFHO-AWEZNQCLSA-N 378.473 2.712 0 50 GFAA COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)N3C[C@@H](C)c4ccccc43)cc2)[nH]1 130751427 XCKZGKJSSDQJHY-CQSZACIVSA-N 391.427 2.645 0 50 GFAA O=C(c1cc(F)cc2nc(S)[nH]c12)N1CCC([C@H](O)C(F)(F)F)CC1 131648201 UFAFSLBSNKSWKB-LBPRGKRZSA-N 377.363 2.766 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4ccc(C)cc4)nnc3c2)n1 169776211 PHVUUQFXNXMOOO-UHFFFAOYSA-N 376.420 2.970 0 50 GFAA COc1ccc([C@H](CNCc2cnn3ccccc23)N2CCOCC2)cc1OC 171761998 JPMUWJJVSZJGQZ-FQEVSTJZSA-N 396.491 2.515 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@H](c2ncc(C)s2)C2CC2)ccc1F 173485989 BAYPWIXYOPDVLE-HNNXBMFYSA-N 383.470 2.979 0 50 GFAA CN(C[C@@H]1CCOC1)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 176220639 GFMSVQOPWLSXEH-DOTOQJQBSA-N 385.430 2.958 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)NCc1ccccc1CN1CCC[C@H]1CO 180471284 CESITSKFUAQQPP-QFIPXVFZSA-N 394.515 2.827 0 50 GFAA COc1c(F)ccc(C(=O)N2CC[C@H](c3ccc4c(c3)OCO4)[C@@H](O)C2)c1F 210076250 ZSEQFZNZQYJPRP-DOMZBBRYSA-N 391.370 2.693 0 50 GFAA COc1ccc(CCNC(=O)[C@@H](C)N2CC(c3nc4ccccc4[nH]3)C2)cc1 225482960 RTZSKLJJXGQHRA-OAHLLOKOSA-N 378.476 2.718 0 50 GFAA O=S(=O)(CCc1ccc(C(F)(F)F)cc1)N1CCC[C@@H](C2OCCO2)C1 225834783 WATDZPCWQCQCMM-CQSZACIVSA-N 393.427 2.663 0 50 GFAA O=C(O)CN(C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)C1CCOCC1 238104140 YNSBYDVUYWOBQL-LSDHHAIUSA-N 382.254 2.645 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)CC[S@]1=O 242178812 XBBHPADSAISGIQ-SGANQWHYSA-N 381.567 2.610 0 50 GFAA CC[S@](=O)[C@@H]1CCCC[C@H]1NC(=O)Cc1cc(Cl)c2c(c1)OCCO2 242338996 ZEBUMEBPGKBSLE-ZCBSFCEKSA-N 385.913 2.850 0 50 GFAA COc1ccc(C2=NO[C@@H]3[C@H]4C[C@H]([C@@H]5C(=O)N(c6ccccc6)C(=O)[C@H]54)[C@H]23)cc1 245255290 HCESIQRAMXQCCX-OQEAXXHESA-N 388.423 2.870 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3CC(C)(C)N2CCOCC2)cc1 247910491 UPRAILBTOXZKLU-RTWAWAEBSA-N 387.568 2.702 0 50 GFAA C[C@H](NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1ccc(-n2ccnc2)cc1 248378985 LGPFMQYWFDQBDY-KFKAGJAMSA-N 394.475 2.615 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCC(n4ncc(C(=O)O)c4C)CC3)cc2)CC1 263212284 PBFZUWYREPEIIS-UHFFFAOYSA-N 395.463 2.953 0 50 GFAA CCc1[nH]c(C(=O)Nc2cccc(N3CCCNC3=O)c2)c(C)c1C(=O)OC 266275276 NSFYYXXNJFNIGH-UHFFFAOYSA-N 384.436 2.844 0 50 GFAA NC(=O)c1cnc(NC(=O)C2(Cc3ccccc3Br)CC2)s1 298177599 UUVSIPGICJZOCN-UHFFFAOYSA-N 380.267 2.966 0 50 GFAA O=C(CNC(=O)c1ccc2c(c1)OCO2)NCc1ccc(-c2ccncc2)cc1 365488737 XVAQOKQLFIQZJY-UHFFFAOYSA-N 389.411 2.524 0 50 GFAA CO[C@@]12CC[C@H](Oc3ccccn3)C[C@@H]1N(C(=O)Cc1c(C)noc1C)CC2 426506653 LUMBCSYCPWPYBS-DJPFJPOOSA-N 385.464 2.847 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCN(C(=O)Nc2ccc(C(N)=O)c(F)c2)C1 454730877 YXCKHZKZKWCTCH-HNNXBMFYSA-N 384.455 2.910 0 50 GFAA CN(C)Cc1csc(CNC(=O)N2CC(O)(c3cccc4ccccc34)C2)n1 924783234 FNYZVBCTQBGDKZ-UHFFFAOYSA-N 396.516 2.771 0 50 GFAA C[C@H]1C[C@@H](NC(=O)N2Cc3cnn(-c4ccccn4)c3CC(C)(C)C2)CCN1C 952890937 NYJFMCZBCSULTB-WMZOPIPTSA-N 396.539 2.844 0 50 GFAA Cc1cccc(N2CCN(CC(=O)N(C)Cc3ccc4nsnc4c3)CC2)c1 1506399928 RKKBNCPKLGOVIM-UHFFFAOYSA-N 395.532 2.780 0 50 GFAA O=C(c1ccncc1)N1CCC(N[C@@H](Cn2ccnc2)c2ccccc2)CC1 1506423833 XDTJUNPDGYMZAO-NRFANRHFSA-N 375.476 2.914 0 50 GFAA O=C(c1cnc(C2CC2)nc1O)N1C[C@H]2CCC[C@](O)(c3ccccc3)[C@H]2C1 1704330276 HULCQEZCNMAGNH-QRFQSNJMSA-N 379.460 2.820 0 50 GFAA Cc1nn(C)c(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1Cl 1704354210 WUCIIAVECRWWAF-RHSMWYFYSA-N 384.867 2.606 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCC[C@@]2(CCc3c[nH]nc32)C1 1775982640 MRLGQEIMYJQSHL-OAQYLSRUSA-N 377.448 2.899 0 50 GFAA CC[C@H](O)CNC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=O 1857533250 IUEAFVOFARKHOJ-AWEZNQCLSA-N 391.464 2.536 0 50 GFAA O=C(CCC1CCCCC1)N1CCC[C@@]2(CN(Cc3cc[nH]n3)CC[C@H]2O)C1 1857684301 HVQVQQCKMMGUCT-IFMALSPDSA-N 388.556 2.946 0 50 GFAA c1ccc(-c2nc(CN3CC[C@]4(CN(Cc5cccnc5)CCO4)C3)no2)cc1 1857684474 PAAOJOJTXDTXOE-JOCHJYFZSA-N 391.475 2.609 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CC3CCCC3)CC(=O)N2[C@H]1c1ccccc1 1857719337 KHDZKWNTDLBDPA-WFXMLNOXSA-N 384.476 2.540 0 50 GFAA O=C(CCc1ccc(-c2cccs2)o1)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1857720750 IJVNUJSNGALEKH-RHSMWYFYSA-N 383.473 2.793 0 50 GFAA COc1cc(C[C@H](CO)CN=c2ccnc(-c3cccc(O)c3)[nH]2)cc(OC)c1 1875265988 IKNPGMMBXMXTNL-INIZCTEOSA-N 395.459 2.551 0 50 GFAA CCc1ccc(/C=C/COC(=O)c2ccc3c(c2)S(=O)(=O)N(C)C3=O)cc1 2325747345 KAONPPHLBALFHG-SNAWJCMRSA-N 385.441 2.894 0 50 GFAA COC(=O)CCCC(=O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356163478 FLMZOAVGQNWYPQ-QFIPXVFZSA-N 386.492 2.556 0 50 GFAA CN1C(=O)c2ccc(-c3nc4ccc(Br)cc4c(=O)o3)cc2C1=O 692551 SWOINTZTAGVBAW-UHFFFAOYSA-N 385.173 2.843 0 50 GFAA Cc1cc2oc(C(=O)NCCc3ccc(S(N)(=O)=O)cc3)c(C)c2cc1C 703713 JVRTZMWOXKMABX-UHFFFAOYSA-N 386.473 2.978 0 50 GFAA CCOC(=O)c1c(C)n(C)c2ccc(OC[C@H](O)Cn3nc(C)cc3C)cc12 811143 JQVVYVAFXFRXTE-MRXNPFEDSA-N 385.464 2.917 0 50 GFAA CC[C@@H]1SC2=NC(C)=C(C(=O)OC)[C@@H](c3ccc(OC(C)=O)cc3)N2C1=O 2695627 OJZBJKXWRMCKQR-GOEBONIOSA-N 388.445 2.824 0 50 GFAA Cc1cc(C)cc(OCC(=O)NCCNC(=O)COc2cc(C)cc(C)c2)c1 2853028 XBKPKZJCQGIXKD-UHFFFAOYSA-N 384.476 2.610 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCC[C@@H](CS(C)(=O)=O)C2)cc1 2356158666 ULZLKZSJHRDRSL-OAHLLOKOSA-N 388.489 2.654 0 50 GFAA CC[C@]1(O)CCC[C@H]2CN(C(=O)c3ccc4nnc(-c5cccn5C)n4c3)C[C@H]21 2356170127 WGDFCHGUUXBDCP-JIGPKXGUSA-N 393.491 2.748 0 50 GFAA CN(C(=O)[C@H]1CCCN(C(=O)C2CC2)C1)C1CCN(Cc2ccccc2)CC1 113093598 CLTVOMCCDPAJKK-FQEVSTJZSA-N 383.536 2.758 0 50 GFAA CN(Cc1cnn(C)c1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1 56453863 JYIPQSXEFBMIDP-UHFFFAOYSA-N 377.439 2.504 0 50 GFAA O=C(NC1CCCC1)C(=O)N1CCC(c2[nH]ncc2-c2cccc(F)c2)CC1 67772265 JKCPQOUYQSYURR-UHFFFAOYSA-N 384.455 2.981 0 50 GFAA CC[C@@H](C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1)N1CCCC1 67805754 KCFNDRRRIPDVNZ-INIZCTEOSA-N 383.448 2.829 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252549300 RCWQOSVNORVFMX-OAHLLOKOSA-N 376.416 2.814 0 50 GFAA CC(C)[C@H](CNC(=O)Nc1ccccc1CS(C)(=O)=O)c1ccnn1C 252502252 UOPCQYTWBXWMFM-HNNXBMFYSA-N 378.498 2.526 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@H](C(=O)c2cc(F)ccc2OC)C1 12316141 ZSCVFRVAHSJSHM-ZDUSSCGKSA-N 389.427 2.829 0 50 GFAA O=C(NCc1cccc(F)c1)C1CCN(S(=O)(=O)c2cccs2)CC1 72446747 OYMIYJBTXIQMSL-UHFFFAOYSA-N 382.482 2.604 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C(=O)CCc2ccc(C)o2)CC1 328632272 LHIFOSFSUMOSRW-LJQANCHMSA-N 384.480 2.740 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCCN(C3CCN(Cc4cccnc4)CC3)C2)o1 71754794 FPMVORUADNNPCV-FQEVSTJZSA-N 396.535 2.976 0 50 GFAA COc1ccccc1C/C(C)=C/C(=O)N1CCC([C@H](O)c2nccn2C)CC1 125043991 GVCJRGDWBQQVLO-ANUWBXLYSA-N 383.492 2.890 0 50 GFAA COc1ccccc1C(=O)N[C@H](C(=O)N1CCC(c2ccn[nH]2)CC1)C(C)C 125052029 XEXQIPHMRCFORD-IBGZPJMESA-N 384.480 2.579 0 50 GFAA CCOc1cccc2c1OCC(C(=O)N1c3ccccc3C[C@@H]1C(=O)NC)=C2 485132656 IWBFOQFNQNXXFO-GOSISDBHSA-N 378.428 2.565 0 50 GFAA CC(C)=C[C@H]1[C@@H](C(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)C1(C)C 159041979 TYZXZUYETJRMTI-GJZGRUSLSA-N 375.450 2.780 0 50 GFAA C[C@H](CS(C)(=O)=O)N[C@@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 368142543 PPXYERHEALFZPF-CFLQYTFWSA-N 393.480 2.600 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1noc([C@H]2CCCO2)n1 72420224 XSFTZWLJXLUZKU-QGZVFWFLSA-N 381.436 2.583 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(C(=O)C3CCCC3)CC2)C1 71736483 JRFRNRKGBWNRCY-IBGZPJMESA-N 398.551 2.591 0 50 GFAA O=C1NCCN(Cc2cccs2)[C@H]1CC(=O)N1CCC(c2ccccc2)CC1 15072179 SKXDTONSXBQLOB-FQEVSTJZSA-N 397.544 2.845 0 50 GFAA CCc1cc(N2CCC(NC(=O)CCc3ccc4c(c3)OCCO4)CC2)ncn1 177189411 GKTFYWSQISTGRP-UHFFFAOYSA-N 396.491 2.528 0 50 GFAA CNc1ncc(C(=O)N2CCC(c3nccn3Cc3ccccc3)CC2)cn1 82134130 CSJIZBMOLGDTEU-UHFFFAOYSA-N 376.464 2.783 0 50 GFAA CN(C[C@@H]1OCCN(C)[C@H]1c1ccccc1)C(=O)Nc1ccn2ccnc2c1 290739123 PXQMRZITBOADHX-ICSRJNTNSA-N 379.464 2.870 0 50 GFAA Nc1n[nH]c(C2CCN(C(=O)C[C@H](Cc3ccccc3)c3ccco3)CC2)n1 426739802 QSLAFXNWBJSFKY-KRWDZBQOSA-N 379.464 3.103 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(c3cccc(O)c3)CC2)CN1Cc1ccncc1 95352389 UVWFUIKCLSKKKT-LJQANCHMSA-N 379.460 2.542 0 50 GFAA COc1nc(C)cc(C)c1CNC(=O)[C@@]1(C)CC[C@@H](C(=O)N(C)C)C1(C)C 91896406 IQWNPMQWOWZGKF-HRAATJIYSA-N 375.513 2.854 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CCn3nc(C)cc3C)[nH]c2C1 95368552 XOIBIVQFTKMBRD-HNNXBMFYSA-N 379.464 2.544 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCC(c3nc([C@H]4CCOC4)no3)CC2)c1 96151173 VHYTUYNDOHLVOX-AWEZNQCLSA-N 387.436 2.611 0 50 GFAA Cn1nc2cccc(NC(=O)NCCN3CCC[C@@H](c4ccccc4)C3)c2n1 97522584 UWAAQWMEVFPGQB-QGZVFWFLSA-N 378.480 2.969 0 50 GFAA Cc1cc(CC(=O)N2CCC[C@H]2C(=O)Nc2ccc(-n3ccnc3C)cc2)on1 95527908 RHWBIUDYPRRWBD-IBGZPJMESA-N 393.447 2.649 0 50 GFAA CN(C)CC(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@@H]1CCCO1 95530411 OEZOCFBMROSXTG-FQEVSTJZSA-N 391.531 2.607 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(C1Cc3ccccc3C1)CC2 91656563 SSTJVGXGEBFVAN-UHFFFAOYSA-N 376.504 2.663 0 50 GFAA Cc1nn(C)cc1NC(=O)CN1CCC[C@@H](c2nc(-c3ccccc3)no2)C1 244817186 SVSIEJNQNGAYPB-MRXNPFEDSA-N 380.452 2.597 0 50 GFAA CCOC(=O)c1nnc(-c2ncc(C(F)(F)F)cc2Cl)nc1N(C)C 263639944 PLOUGZYVMWHIOX-UHFFFAOYSA-N 375.738 2.849 0 50 GFAA O=C(N[C@H]1CC(=O)N(c2ccccc2Cl)C1)NC1(CO)CCCCCC1 584899486 KSBFTSNTIUZROK-AWEZNQCLSA-N 379.888 2.830 0 50 GFAA O=C(NCCc1nc2ccccc2s1)N1CCC[C@@H](c2cc(O)ncn2)C1 670469728 FDVLBHQBDBTSPM-CYBMUJFWSA-N 383.477 2.924 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3[C@H](C(=O)O)C[C@@H]4CCCC[C@H]43)n2)cc1 268950934 TVNGXMRPJPMBQR-UAGQMJEPSA-N 399.447 2.922 0 50 GFAA C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Cn2cc(-c3cncc(C(=O)O)c3)nn2)C1 1875355200 CVSNJJKGJMYVEI-AUUYWEPGSA-N 391.431 2.648 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2)CN(C(=O)[C@H]2CCc3nncn3C2)C1 952891519 FKPMBNWAPDAYQI-INIZCTEOSA-N 390.491 2.637 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)N3CC(N4CCCC[C@H]4C)C3)CC2)cc1 952965070 FKWXHQYKAYEBLE-GOSISDBHSA-N 383.536 2.932 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(CNC(=O)c3ccsc3)CC2)C2(CCCC2)O1 952967234 ZJTDXOXMWSDEQN-MRXNPFEDSA-N 390.505 2.592 0 50 GFAA CC(C)Cn1cc(NC(=O)N[C@@H]2CCO[C@H]2c2nccn2C)c(C(F)F)n1 888100952 GOZZHCORKOYDTG-BXUZGUMPSA-N 382.415 2.862 0 50 GFAA CCn1cnc2c(N3CC[C@@]4(NC(=O)[C@@H]5C[C@H]5C5CC5)CCC[C@@H]34)ncnc21 1775990169 DLJUUFOODXRCGZ-IWLLQYOYSA-N 380.496 2.510 0 50 GFAA Cc1nn2cc(S(=O)(=O)NCc3cccc(Cl)c3F)cnc2c1Cl 1319756816 PYSINHFKVKJCJL-UHFFFAOYSA-N 389.239 2.962 0 50 GFAA Cc1nnc(S)n1CCNC(=O)[C@H]1C[C@@H]1c1ccccc1Br 170644557 SKPPOGJKLLWESJ-NEPJUHHUSA-N 381.299 2.558 0 50 GFAA CC1(c2cc(N3CCN(C(=O)c4occc4Br)CC3)[nH]n2)CC1 170614243 KWMWODFQFHVRAK-UHFFFAOYSA-N 379.258 2.779 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2CCc2cccc(O)c2)cc1 1506422455 RAJTXKPLAXAYPL-KRWDZBQOSA-N 388.489 2.667 0 50 GFAA CCOC(=O)N1CCC(NC(=O)[C@@H]2CC23CCN(Cc2ccoc2)CC3)CC1 12053210 GHBBVLDCGJQNMQ-SFHVURJKSA-N 389.496 2.619 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C3CCOCC3)CC2)c(Cl)c1 12300966 GVJMRMOJWCWNTC-UHFFFAOYSA-N 396.915 2.738 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)c2n[nH]c3c2CCC3)C1)NCc1ccccc1F 12446166 IOPAFDUVZADBMV-HNNXBMFYSA-N 398.482 2.986 0 50 GFAA COC(=O)CCNC(=O)c1sc2ncnc(NCc3cccc(C)n3)c2c1C 14988000 DVTYYAJTCRHKQC-UHFFFAOYSA-N 399.476 2.608 0 50 GFAA COc1cc(OC)c(CN2CCN(CC(C)(C)C)[C@@H](CCO)C2)c(OC)c1 19220067 CNDYKVYPBJKCPL-INIZCTEOSA-N 380.529 2.627 0 50 GFAA CC[C@H](C)CC(=O)N1CCOc2ccc(CN3CCN(C(C)=O)CC3)cc2C1 19744301 KUGOGATYSWNLIJ-KRWDZBQOSA-N 387.524 2.508 0 50 GFAA COc1ccccc1CN1C(=O)N[C@H](CC(=O)Nc2ccc3[nH]ccc3c2)C1=O 206241940 NKBSNMQBAHLHAB-QGZVFWFLSA-N 392.415 2.626 0 50 GFAA CCCCOc1ccccc1/C=c1/sc2nc(-c3cccnc3)nn2c1=O 2509387 OGDJLPHPXNBAIY-SFQUDFHCSA-N 378.457 2.940 0 50 GFAA CC[C@@]1(C(=O)NCc2ncc[nH]2)C[C@@H]2CC[C@H]1N2C(=O)CCc1ccccc1 1857678753 AGTJOXTWTCTFFR-NJNPRVFISA-N 380.492 2.818 0 50 GFAA CCOC(=O)c1cccnc1N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 1857694894 ZEKJQTVFFOURAL-OAQYLSRUSA-N 381.432 2.512 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N2CCO[C@@H](CO)[C@@H]2c2ccccc2)c1 1857713358 WMGLUTDXYKMOLD-FPOVZHCZSA-N 393.443 2.660 0 50 GFAA O=C(NCc1cccnc1OCC(F)(F)F)c1ccc(N2CCOCC2)cc1 109413969 XVHIYBRJWPTTBZ-UHFFFAOYSA-N 395.381 2.789 0 50 GFAA Cc1cc(N[C@@H](c2ccc(Br)cc2)[C@H](C)CO)n2ncnc2n1 225607139 XUAJAYXQAGTHLR-MEBBXXQBSA-N 376.258 2.977 0 50 GFAA O=C(NCc1c(F)cccc1OC(F)F)N1CCC[C@@H](Cn2ccnn2)C1 129436931 PQTQHSUSIJULLT-GFCCVEGCSA-N 383.374 2.640 0 50 GFAA C[C@](CO)(NC(=O)c1cnc(C2CC2)nc1O)c1cccc(C(F)(F)F)c1 912106401 IVIKTNCILYIKOD-QGZVFWFLSA-N 381.354 2.716 0 50 GFAA COc1ccccc1[C@@H](N)CNC(=O)COc1ccc(Br)cc1 2325745474 GPDCCDNNGCWFEV-HNNXBMFYSA-N 379.254 2.653 0 50 GFAA Cn1nccc1-c1ccccc1CN[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 2325786067 ZUIAARAYLMWWIN-BOUXLOLZSA-N 385.899 2.866 0 50 GFAA O=C(O)c1cnn(C[C@H]2C[C@@H](O)[C@H](NCc3cccc(-c4ccccn4)c3)C2)c1 2325786204 RFSGJTATSOJUOZ-MAODMQOUSA-N 392.459 2.573 0 50 GFAA CCc1cccc2c(C(=O)COC(=O)c3cn(CC(F)(F)F)nn3)c[nH]c12 2325789090 MKINEOBAPNZARK-UHFFFAOYSA-N 380.326 2.924 0 50 GFAA O=C(NC[C@H]1CCc2cc(F)ccc21)c1ccc(S(=O)(=O)N2CCCC2)o1 2325791238 FBECUWHPROWJSM-CQSZACIVSA-N 392.452 2.663 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(O)nc3c2CCCN3)cc1 2325827031 SMJMYWNDIBMWHY-MRXNPFEDSA-N 398.488 2.608 0 50 GFAA COc1cc(CNCCc2cccnc2)ccc1OC[C@H](O)CN(C)C(C)C 12303600 JNGYUUWIUTYUGR-HXUWFJFHSA-N 387.524 2.502 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCCc3ccccc3)C2)cc1 791666 NVCDSFGOCFZFFO-LJQANCHMSA-N 386.517 2.755 0 50 GFAA O=C1N(CCc2ccccc2)CCC[C@]12CCCN2C(=O)[C@H]1CC[C@@H](O)CC1 2356142998 PZXQICNRCAELGZ-MZKRTTBSSA-N 384.520 2.764 0 50 GFAA COC(=O)c1ccc(C(=O)OC)c(NC(=O)Nc2cc(OC)ccc2OC)c1 2853882 QCARANHLMQONKR-UHFFFAOYSA-N 388.376 2.921 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc(SC)c2)cc1 2871903 XPZQLXBEAPORMC-GFCCVEGCSA-N 380.491 2.723 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@H](c3cccc(F)c3)C2)c(OC)c1 225782263 UFBUXDNHDBHMRV-KRWDZBQOSA-N 378.425 2.954 0 50 GFAA CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(Br)cc2F)C1 10302291 HESFQDCQAXGBRD-JTQLQIEISA-N 393.278 2.588 0 50 GFAA COc1ccccc1Cc1cc(=O)[nH]c(-c2ccc(CN3CCOCC3)cc2)n1 20858471 CHAXKQZFRKVWEZ-UHFFFAOYSA-N 391.471 2.869 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CC(n4cccn4)C3)nc2)C1 67643025 SJLKSMZJMACTSQ-GOSISDBHSA-N 395.507 2.807 0 50 GFAA COc1ccc2nc(Cn3ccnc3-c3cnc(N4CCCC4)nc3)[nH]c2c1 71760394 MNJQPGHDHZTVFX-UHFFFAOYSA-N 375.436 2.874 0 50 GFAA O=C(C[C@@H]1CNCCO1)N1CCC(c2cc(-c3ccccc3Cl)[nH]n2)CC1 67757191 WLMLPWVFXKZNQO-OAHLLOKOSA-N 388.899 2.815 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](N(C)CCc2ccccc2)C1 12592067 IENOAUZEVHPODT-SFHVURJKSA-N 377.510 2.619 0 50 GFAA CCc1cc(C)c(C(=O)N2CCC[C@H](N(Cc3cncnc3)C(C)=O)CC2)o1 328629749 IPWRKRVPXQSKCO-SFHVURJKSA-N 384.480 2.984 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O)OCc1ccccc1 4760118 SLQMUASKUOLVIO-OALUTQOASA-N 396.443 2.600 0 50 GFAA in-vitro Cn1nc2c(cc1=O)CN(Cc1csc(COc3ccc(F)cc3)n1)CC2 172791777 BNXBKNSFGXQGPU-UHFFFAOYSA-N 386.452 2.513 0 50 GFAA CN(C[C@H]1CCc2nccn2C1)S(=O)(=O)c1sccc1Br 328638486 WLNVZLUENUCRMH-SNVBAGLBSA-N 390.328 2.590 0 50 GFAA O=C(N[C@@H]1COCC[C@@H]1OCc1ccccc1)c1ccccc1-c1nc[nH]n1 219180895 AMNXQPWGBUEKCQ-MOPGFXCFSA-N 378.432 2.576 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCc3ccccc3CC2)cc(F)c1Cl 156510309 ZCMITFJBIHJKIP-UHFFFAOYSA-N 383.828 2.967 0 50 GFAA COCCn1cnnc1[C@@H](C)NC(=O)c1ccc(-c2cccc(CO)c2)cc1 426379717 LJELTCMQCYEEIR-OAHLLOKOSA-N 380.448 2.575 0 50 GFAA Cc1n[nH]c(C)c1-c1ccc(C(=O)N2CCC[C@H](CN3CCOCC3)C2)cc1 426634074 AGFFPJPIXWJABL-GOSISDBHSA-N 382.508 2.878 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(-c3ccc(C)cc3)nc21 20615695 GVSPSSIAWANDMS-UHFFFAOYSA-N 385.445 2.863 0 50 GFAA Cc1cc(C(=O)NCc2nc(-c3cnccn3)n[nH]2)c2cccc(Cl)c2n1 426606749 NCSZOIKRGPGXEE-UHFFFAOYSA-N 379.811 2.702 0 50 GFAA CC(=O)Nc1cccc(NC(=O)Cn2nc(-c3ccccc3F)ccc2=O)c1 44901425 GNCYLBOOEXHACR-UHFFFAOYSA-N 380.379 2.647 0 50 GFAA COc1cccc(-c2cc(NC(=O)[C@@H]3COCCO3)n(-c3ccccc3)n2)c1 192506659 MLPHIOMCVFDSLL-IBGZPJMESA-N 379.416 2.902 0 50 GFAA O=C(c1cccc2nccnc12)N1CC[C@]2(CCCN(CC3CCC3)C2=O)C1 91964791 SZVPQUIQJDYJOX-JOCHJYFZSA-N 378.476 2.885 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCC(C)C)C2)C1 95387945 JXIFLEIDTQQIMT-IBGZPJMESA-N 378.542 2.925 0 50 GFAA Cc1nc2ccc(C(=O)N3CCCO[C@H](CN4CCCCC4)C3)cc2nc1C 95504580 WKRRQDZXXJVYEN-LJQANCHMSA-N 382.508 2.964 0 50 GFAA COc1ccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1F 95521754 UMKJPLIDOWKKOB-UHFFFAOYSA-N 398.482 2.843 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)n1 95376970 GMCLNBUTRXCUMZ-UHFFFAOYSA-N 380.492 2.806 0 50 GFAA Nc1nc2c(c(C(=O)N3CCC[C@@H](c4cccc(C(=O)O)c4)C3)n1)CCCC2 95370331 NNGHVYNMQRADCH-OAHLLOKOSA-N 380.448 2.656 0 50 GFAA Cc1ccc(N2CC[C@@H](CNC(=O)CCc3nc4ccccc4[nH]c3=O)C2)cc1 91691274 PDLBKHKKMNQTGC-KRWDZBQOSA-N 390.487 2.807 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1CCC[C@@H](N2CCCC2)CC1 182028560 KFGXKXCILYAQDN-CYBMUJFWSA-N 377.432 2.739 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)[C@H]3CC[C@@H](O)CC3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 244574748 CQSSJNHCDKZASR-ZQONDGBOSA-N 384.520 2.635 0 50 GFAA CCn1cnnc1CCNC(=O)N1CCC[C@@H](c2nc3ccc(C)cc3[nH]2)C1 534645449 SRZIXOAVHYCDNS-OAHLLOKOSA-N 381.484 2.614 0 50 GFAA CSCc1ccc(C(=O)N2C[C@H]3CN(C4CCCCC4)C[C@@]3(C(=O)O)C2)o1 534577140 AXNCKKTUOSUOSI-JLTOFOAXSA-N 392.521 2.934 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)Cc2nc3ccccc3o2)CC1 1940194762 NAMRMMHKRPEODV-UHFFFAOYSA-N 378.432 2.681 0 50 GFAA CN1C[C@@]2(CCCN(C(=O)Nc3cnn(Cc4ccccc4F)c3)C2)OC1=O 299761973 CNAYGDHOYUQHCT-LJQANCHMSA-N 387.415 2.519 0 50 GFAA CNC(=O)c1ccc(CN(C)c2nn3c(C(F)(F)F)nnc3c(C)c2C)cc1 268656602 WFUKAEIDDPBHMS-UHFFFAOYSA-N 392.385 2.756 0 50 GFAA COc1ccc(-c2csc3ncn([C@H]4CCN(C)C4=O)c(=O)c23)c(OC)c1 584901808 AWVPMZFPPIYTDN-AWEZNQCLSA-N 385.445 2.545 0 50 GFAA O=C1C[C@H](CNS(=O)(=O)Cc2cc(F)ccc2Cl)CN1C1CCCC1 670458014 DFNHDRPBEONMLO-GFCCVEGCSA-N 388.892 2.690 0 50 GFAA CS(=O)(=O)[C@H]1CCCCCN(C(=O)c2cc(Cl)nc(N3CCCC3)c2)C1 1875298380 YXHKNQBLSOSHBO-HNNXBMFYSA-N 399.944 2.765 0 50 GFAA CN(C)Cc1nc2ccc(NC(=O)c3ccc([C@@H]4CCC(=O)N4)cc3)cc2[nH]1 1875297154 FAKOEHKAPPMIDI-INIZCTEOSA-N 377.448 2.828 0 50 GFAA O=C(c1csc(C2CCNCC2)n1)N1CCOC[C@@H]1c1cccc(F)c1 876970760 YEIJYLMYPYCGSV-QGZVFWFLSA-N 375.469 2.963 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)Cc3ccc(Cn4ccnc4)cc3)n[nH]c21 1875396529 KVZVGFJNOWDWHQ-CABCVRRESA-N 379.464 2.949 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)C2(C)Cc3ccccc3C2)CC[C@H]1C(F)(F)F 1875386252 LVYGPKPWQXJXED-CVEARBPZSA-N 380.410 2.873 0 50 GFAA O=C(CCc1cccc(Br)c1)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875403450 UFSQNHKQGIOEGS-USXIJHARSA-N 392.297 2.534 0 50 GFAA COc1cc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)ncn1 952894963 PWRNDCBTIMOEEH-MRXNPFEDSA-N 392.341 2.641 0 50 GFAA Cc1cncc(CC(=O)N[C@@H]2C[C@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)c1 1875402758 KENHPSMZKGPIBL-CEWLAPEOSA-N 390.487 2.752 0 50 GFAA CC(C)[C@H]1N(c2ncnc3c2ncn3C2CC(CO)(CO)C2)CC12CCCCC2 888097310 HFYPDAFRWMBYLE-GOSISDBHSA-N 399.539 2.927 0 50 GFAA O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)N1CCNCCC12CCOCC2 1338407044 PSAMWIJCOOGCKR-UHFFFAOYSA-N 397.306 2.555 0 50 GFAA COc1cc(Br)cc(NC(=O)N2CCOC3(CCOCC3)C2)c1 271224510 OHDJOVSTHOCZBF-UHFFFAOYSA-N 385.258 2.871 0 50 GFAA O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 167439431 KAWOHHXXYJJOTI-MRXNPFEDSA-N 394.406 2.953 0 50 GFAA COc1ccccc1/C=C/CNc1cccc(S(=O)(=O)N2CCOCC2)c1 170615994 KYVGXUULOXLPCD-FNORWQNLSA-N 388.489 2.841 0 50 GFAA CN([C@@H]1CCN(c2ccccc2F)C1=O)S(=O)(=O)c1cccc2cnccc12 171836746 SCOJROFMPUCYJM-GOSISDBHSA-N 399.447 2.800 0 50 GFAA CCC[C@]1(COC)CCCN1C(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O 193758408 CFNKHYOYTJXDME-OAQYLSRUSA-N 388.512 2.619 0 50 GFAA CC1(C)C(=O)NCCN1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 194563664 ZDEOHQGLIGZMQR-UHFFFAOYSA-N 377.897 2.667 0 50 GFAA O=C(c1cccnc1)N1CCC(N[C@@H](Cn2ccnc2)c2ccccc2)CC1 1506407112 IOGBHOUJNNXUTH-NRFANRHFSA-N 375.476 2.914 0 50 GFAA CCCn1nc(C)cc1NC(=O)C[C@@H]1COc2ccc(C(=O)N(C)C)cc2N1C 1529110047 JRBQLMIEQUNEMB-MRXNPFEDSA-N 399.495 2.529 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)n(C)n1 1704339762 NWYUFDFDODKHEP-OAQYLSRUSA-N 382.512 2.520 0 50 GFAA O[C@@H]1CN(Cc2nc(C(F)(F)F)no2)C[C@H]1Cc1ccc2ccccc2n1 1704337447 ZFOXVMFTBYCAPO-IUODEOHRSA-N 378.354 2.672 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCCO3)C1 11666639 NZMLCHDWJKXBTB-LJQANCHMSA-N 381.476 2.632 0 50 GFAA CCc1cn[nH]c1C1CCN(C(=O)c2ccc(N3CCN(C)CC3)cc2)CC1 11784524 QOZTVYZRCIDPQU-UHFFFAOYSA-N 381.524 2.744 0 50 GFAA COC(=O)CCC(=O)N1CC[C@@]2(CCCN(CCC3CCCCC3)C2=O)C1 12049130 UMAYGXAFZASJQN-NRFANRHFSA-N 378.513 2.751 0 50 GFAA COC(=O)c1ccc(-c2noc(CN3CCCC[C@H]3c3nccn3C)n2)cc1 12300095 CFEKUHAOWLZVOY-INIZCTEOSA-N 381.436 2.984 0 50 GFAA O=C(Cn1cnc2ccccc21)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 12316723 CLHQIEWOPVASSF-QGZVFWFLSA-N 392.459 2.911 0 50 GFAA Cc1c([C@@H](C)NC(=O)CN2CCOc3ccccc3C2)cnn1-c1ccccn1 12320891 SFIGPZKVWFMOPK-MRXNPFEDSA-N 391.475 2.648 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@H](CNS(=O)(=O)c3cccs3)C2)o1 12593778 OKDOFVRNMXOBEX-CQSZACIVSA-N 382.507 2.789 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@H]1CC13CCC3)C2 1857685255 FWTDACPNSYGDFK-QJLMEOIESA-N 392.503 2.649 0 50 GFAA Cc1nc(C(=O)N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)cs1 1875247042 PPZRTJHPURQTGC-YLJYHZDGSA-N 388.489 2.752 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@H](C(=O)O)C3)cc2)c(C)c1Br 237660971 QFKUYOPWEJCWBD-ZDUSSCGKSA-N 392.253 2.798 0 50 GFAA CC(C)(C)NC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1 646125 BORKIIQZECPNOD-OAHLLOKOSA-N 378.519 2.778 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OCC(F)(F)F)cc(Cl)c1O 706336 LZURMMBFDNROIH-NSHDSACASA-N 394.733 2.788 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H]1Oc2ccccc2O[C@@H]1C 4867086 CLJQWQMNTFSHPW-ZMZPIMSZSA-N 387.388 2.657 0 50 GFAA CS(=O)(=O)CCN1CCN(C2=Nc3ccccc3Oc3ccccc32)CC1 2325760085 HLNPNPMSXIGNQU-UHFFFAOYSA-N 385.489 2.533 0 50 GFAA C[C@@H](c1ccc(Cl)cc1)N1C[C@H](C(=O)Nc2nnc3n2CCCC3)CC1=O 2325780637 DKYBGFFOLFQCJM-GXTWGEPZSA-N 387.871 2.816 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)C3CCC4(CC3)NC(=O)N(C)C4=O)cc2)c1C 2325784690 CSWAKFDJJKTRRE-UHFFFAOYSA-N 395.463 2.538 0 50 GFAA Cc1cccc([C@H](C)C(=O)NC[C@@H]2C[C@H](C(=O)NCCC(F)(F)F)CO2)c1 2332237677 HMTIUHADFPWSDL-BPUTZDHNSA-N 386.414 2.688 0 50 GFAA CCOC(=O)COc1ccc(S(=O)(=O)Nc2cccc(C(C)=O)c2)cc1 1126958 SFFRNFUFERAAOI-UHFFFAOYSA-N 377.418 2.632 0 50 GFAA CCN(CC)C(=O)/C=C/c1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1 2288120 PDRSAVFXFLRUCS-ZRDIBKRKSA-N 380.510 2.751 0 50 GFAA Cc1ccc(-c2c(C)n3c4c(=O)n(C)c(=O)n(C)c4nc3n2-c2ccccc2)cc1 4626155 RXORVMYCONHYHO-UHFFFAOYSA-N 399.454 2.959 0 50 GFAA O=S(=O)(c1ccccn1)C(Br)(Br)Br 6088327 FRCQMXHPNJVPJC-UHFFFAOYSA-N 393.882 2.651 0 50 GFAA in-vitro CCOCCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(CC)cc3)C2)s1 9426630 FPCILPBZKBMTFW-CQSZACIVSA-N 388.493 2.671 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 11934050 XUDQCSJFUODSEK-HXUWFJFHSA-N 389.402 2.916 0 50 GFAA Cn1nc(C(=O)N2CC[C@@]3(CCCN(CCC4CCCCC4)C3)C2)ccc1=O 12704709 VUTPYZDUDIEUDD-JOCHJYFZSA-N 386.540 2.679 0 50 GFAA CCCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](N(C)Cc1cscn1)C2 14537520 HGJXRFYMPLAIKO-MRXNPFEDSA-N 387.553 2.975 0 50 GFAA CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C/OC)C(=O)OC 14686820 DAXYUDFNWXHGBE-YCBKVTMHSA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro CCc1nnc(-n2ccc3c(cnc4c(-c5ccccc5)c(CC)nn43)c2=O)[nH]1 19818863 CYSLZHSUCQYBPE-UHFFFAOYSA-N 385.431 2.943 0 50 GFAA O[C@@H](c1ccccc1)c1nn(CN2CCOCC2)c(=S)n1-c1ccccc1 19973428 TVAOMLLMSGUXRG-SFHVURJKSA-N 382.489 2.775 0 50 GFAA Cc1ccccc1C(=O)N[C@@H](N[C@H]1CCCS1(=O)=O)C(Cl)(Cl)Cl 22205061 CBBHITHUVKGANW-DGCLKSJQSA-N 399.727 2.545 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccccc1 27640260 LYXKJZCRLQWIIN-OMIHVFMZSA-N 388.460 2.750 0 50 GFAA in-vitro O=C(NCCc1ccc2c(c1)OCO2)Nc1ccccc1CN1CCOCC1 48147525 VCPNHJFEVIKKNM-UHFFFAOYSA-N 383.448 2.612 0 50 GFAA O=C(c1ccccc1-c1ncn[nH]1)N1CCc2[nH]nc(Cc3ccccc3)c2C1 48179164 NUPAQCYNJGGLAF-UHFFFAOYSA-N 384.443 2.984 0 50 GFAA O=C(CN1CCN(c2ccccc2F)CC1)Nc1ccc(Br)cn1 55059026 PAJLISMMVOHXGX-UHFFFAOYSA-N 393.260 2.744 0 50 GFAA Cc1cccc(NC(=O)CC(=O)NC[C@@H](c2cccnc2)N2CCCC2)c1C 55309412 YGHNCURFAMYXDO-FQEVSTJZSA-N 380.492 2.980 0 50 GFAA CCN(Cc1ccc(C(=O)Nc2c(C)noc2C)cc1)[C@H]1CCS(=O)(=O)C1 65527809 QNGLTWAOCOLSLA-KRWDZBQOSA-N 391.493 2.553 0 50 GFAA CN1CC[C@@H](N(C)Cc2ccc(-c3nc(-c4ccncc4)cc(=O)[nH]3)cc2)C1 67696028 GQQZGAKHWVBVRT-LJQANCHMSA-N 375.476 2.635 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](N)CN1C(=O)c1cc(C)nc2ccc(Cl)cc12 67834379 KMMIILAWHMDKQW-KDOFPFPSSA-N 388.899 2.607 0 50 GFAA O=C([C@@H]1COc2ccccc2O1)N1Cc2cnn(Cc3ccc(F)cc3)c2C1 67841424 ZLBQHHRZXIPXBX-FQEVSTJZSA-N 379.391 2.753 0 50 GFAA O=C(Cc1ccccn1)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95355123 NLSHWTHTEUPOHU-KSEOMHKRSA-N 383.442 2.991 0 50 GFAA COCCC(=O)Nc1ccc2c(c1)CN(C(=O)c1ccc3c(c1)CCO3)CC2 95506070 VMALUZYSAZQLIX-UHFFFAOYSA-N 380.444 2.795 0 50 GFAA Cc1nccn1[C@@H](C)C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2CC(C)C 95519147 GBZCSQRPPFCURN-INIZCTEOSA-N 384.528 2.508 0 50 GFAA Cc1csc(SCC(=O)N2C[C@@H]3c4ccccc4OC[C@]3(CO)C2)n1 96164906 RCZYNUVNLWGLTM-RDTXWAMCSA-N 376.503 2.541 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)NC1CCN(c3cccc(C)n3)CC1)CO2 116670539 LDZYMQCIYIDJEM-QGZVFWFLSA-N 381.476 2.735 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 124003260 HYJNONUZZHPWDR-CQSZACIVSA-N 378.473 2.712 0 50 GFAA CS(=O)(=O)NCc1ccc(C(=O)NC2(c3ccc(F)cc3F)CCCC2)o1 130144754 BJHNSYLJSSUVHH-UHFFFAOYSA-N 398.431 2.806 0 50 GFAA O=C(Nc1ccc(CNC(=O)N2CCOC[C@H]2C2CC2)cc1)c1cccnc1 153529539 BBNOKOMHRRLTTD-IBGZPJMESA-N 380.448 2.654 0 50 GFAA CC[C@H](C(=O)N1CCC(NC(=O)Nc2cccn(C)c2=O)CC1)c1ccccc1 173525962 WKCVBJLVAQHLFJ-SFHVURJKSA-N 396.491 2.692 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)N[C@@H]1CCN(c2ncccc2Cl)C1 177440455 UUFYLISCJQNKAJ-MRXNPFEDSA-N 381.867 2.858 0 50 GFAA COCc1nc(NCCc2noc(-c3ccccc3)n2)cc(C2CC(N)C2)n1 219571661 WQFLFONQPYYGJX-UHFFFAOYSA-N 380.452 2.532 0 50 GFAA COC[C@@H](C)C(=O)NCc1cc(Cl)c(I)cc1OC 225468103 LGVAFJDHIDJRGT-MRVPVSSYSA-N 397.640 2.852 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N[C@H](c1ccc(OC)nc1)[C@H]1C[C@@H](O)C1)n2C 244900092 ZVVUNEPWYPQPGY-VWKPWSFCSA-N 395.459 2.833 0 50 GFAA CCN(C)C[C@@H]1CCN(C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)C1 246900211 KEOPJKMORRQBPG-YJLNNSPDSA-N 377.916 2.660 0 50 GFAA COc1ccc([C@@H](NC(=O)Cn2cnc3ccccc32)[C@H]2C[C@@H](O)C2)cc1F 252535871 HBKHCYVMKNAWCE-LRAJWGHMSA-N 383.423 2.812 0 50 GFAA CSCC[C@@H](NC(=O)c1cc(-c2ccncc2)[nH]n1)c1nnc2ccccn12 252537163 KMPMWGBZXXUHHC-CQSZACIVSA-N 393.476 2.739 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@@H](C(=O)N1CCCC1)C2)c1ccsc1 299793503 IVTWJEISQPXNIR-NSHDSACASA-N 375.475 2.824 0 50 GFAA CCn1ccnc1CN(C(=O)c1cc(Cl)cn1C)[C@H]1CC12CCNCC2 328635338 NHHZQGJUDDDCJP-INIZCTEOSA-N 375.904 2.679 0 50 GFAA COc1ccc(C2(C(=O)NCc3cnc4cnccn34)CCCC2)cc1OC 426374430 TXNQWBSBUBYUBJ-UHFFFAOYSA-N 380.448 2.875 0 50 GFAA Cc1ccc(C)c([C@H](C)NC(=O)CSc2nnc(C3CCNCC3)n2C)c1 426535910 PYDNNLXYRPIQKJ-HNNXBMFYSA-N 387.553 2.868 0 50 GFAA Cc1c(C(=O)NCc2cccnc2N2CCN(C)CC2)cnc2ccccc12 482045867 SRTLQICIZCYPAU-UHFFFAOYSA-N 375.476 2.620 0 50 GFAA C[C@H](O)c1cccc(-c2ccc(C(=O)N3CCC4(CC3)CNC(=O)O4)cc2)n1 534672389 DRBXRHAKKYIIMD-AWEZNQCLSA-N 381.432 2.517 0 50 GFAA O=C(N[C@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCC2(CCCO2)CC1 584900589 PHTMXWRBLWPXLM-AWEZNQCLSA-N 377.872 2.800 0 50 GFAA Cn1c(C(=O)NC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)cc2cc(F)ccc21 670436531 RHCIWGNIVZXBHR-ZXPDZVFASA-N 394.454 2.782 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)NCc1nc2ccc(Cl)cc2[nH]1 670459250 BJUJSMZUPBMNCB-CQSZACIVSA-N 382.851 2.849 0 50 GFAA O=C(NCCOc1cccc2cccnc12)c1cccc(N2CCNC2=O)c1 670470858 IILISJIWVVUEMG-UHFFFAOYSA-N 376.416 2.573 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1 779856493 JPVVHQITLDWRQZ-BPLDGKMQSA-N 377.828 2.571 0 50 GFAA CC(C)(NC(=O)c1cccc(Cl)c1)c1noc([C@@H]2CCCc3nn[nH]c32)n1 952894633 OVJQYKRXCFKIIZ-GFCCVEGCSA-N 386.843 2.974 0 50 GFAA COc1ccc(NC(C)(C)C(=O)N2CCN(Cc3ccc(F)cc3)C(=O)C2)cc1 952962735 HCGSASAJQZIVEB-UHFFFAOYSA-N 399.466 2.896 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CCC[C@H]2CN)CC1 1342087111 KHAJGGRXABCUES-RXVVDRJESA-N 396.535 2.583 0 50 GFAA O=C([C@H](c1cccnc1)N1CCOCC1)N1CCOc2ccc(Cl)cc2C1 1506403176 SCTRSVRJUCIPED-IBGZPJMESA-N 387.867 2.530 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N(C[C@@H]1CCC(=O)N1)C(C)C 1506423020 RZXJPONXQYHEGR-ZDUSSCGKSA-N 388.917 2.725 0 50 GFAA Cc1cc(C[C@H](C)NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n[nH]1 1506424262 ZPFAKZYSAUYPPI-NSHDSACASA-N 379.511 2.696 0 50 GFAA CCn1c(C)ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccccc2)C3)c1=O 1565515854 GIKXEKQTVJFRSL-UXHICEINSA-N 379.504 2.913 0 50 GFAA CC[C@H]1CN(C(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)CCN1C 1704326062 VJMHGGRSBQQHTG-AWEZNQCLSA-N 390.459 2.722 0 50 GFAA CN1CCCN(C(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CC1 1857667390 HTSKESALOLRIEX-CQSZACIVSA-N 376.888 2.862 0 50 GFAA O=C(CC1CCCC1)N1CCC[C@@]2(CN(Cc3cnsc3)CC[C@H]2O)C1 1857695857 BIWXUWTXBQHQNY-UYAOXDASSA-N 377.554 2.899 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857699897 COSCTMCVDGDKRJ-INIZCTEOSA-N 396.495 2.918 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCc4cnc(C)cn4)C3)nc2c1 1857730539 VZPOXDCZOLXLJJ-OAHLLOKOSA-N 395.463 2.858 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(C)nc4)[C@H]4CC[C@]3(C2)O4)nc1 1875249851 FVJQOMAHZPLXRT-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA CC(C)(NC(=O)NCCn1c(O)nc2ccccc21)c1ccc2c(c1)OCCO2 1875263741 AMQISPAUXCXBMN-UHFFFAOYSA-N 396.447 2.748 0 50 GFAA CN(C(=O)Nc1cnc2ccnn2c1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1875334880 JBGGJFDVHJAEGV-QGZVFWFLSA-N 394.435 2.604 0 50 GFAA O=C(Cc1ccc(Br)cc1)NS(=O)(=O)c1c[nH]c2ccccc12 1875350313 IGRKFFMJURUCQH-UHFFFAOYSA-N 393.262 2.978 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCN(C(=O)C(C)(C)C)CC2(C)C)cc1 1875373532 DUBSKKBWTIYYDR-UHFFFAOYSA-N 385.508 2.945 0 50 GFAA Cn1cc(-c2ccc(C(=O)N3CC[C@@H](C4CC4)[C@@H]3c3nc(O)n[nH]3)cc2)cn1 1875401990 XYIZUHAQJHZZBU-DLBZAZTESA-N 378.436 2.524 0 50 GFAA Cn1ncc2nc(C(F)F)c(C(=O)N[C@@H]3CCCC[C@@]34CCCNC4)cc21 2325779204 OENATDZUFKEHNR-BEFAXECRSA-N 377.439 2.948 0 50 GFAA CC(C)(C)N1C[C@H](CN2C(=O)CCN(CC[C@]3(C)CC3(F)F)C2=O)CC1=O 2325779607 RJBUYSQNDOCTHM-SCLBCKFNSA-N 385.455 2.723 0 50 GFAA NCc1cccc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(-c3ccccc3F)c2)c1 2325787560 HNVVKLJGMUXRPN-GHTZIAJQSA-N 394.450 2.864 0 50 GFAA CCc1nnc(N2C[C@H](CNC(=O)C3(C)CC(F)(F)C3)[C@@H](C)C2)nc1CC 2325793921 LOMGWFGPRSCNAF-STQMWFEESA-N 381.471 2.620 0 50 GFAA Cc1ccn(C)c1C(=O)N1C[C@@H]2CN(C(=O)C[C@@H]3CC[C@H](C4CC4)O3)C[C@]2(C)C1 2325794694 NPTMGSUIPFQUNO-PABYOWBDSA-N 399.535 2.602 0 50 GFAA O=C(CCc1cnccn1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356134194 CPEXCOFRRQUUOQ-QHCPKHFHSA-N 392.503 2.636 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)Cc3cn(C)nc3C)C2=O)cc1 2356143770 WHXOBNDGLLLYEL-QFIPXVFZSA-N 380.492 2.768 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)N1CCc2nc(C3CC3)nn2CC1 2356144508 AZHJBLDCDSQHOF-UHFFFAOYSA-N 379.489 2.906 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356151897 FRUDRWBHNMYYHV-HXUWFJFHSA-N 386.883 2.871 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)cn1 2356167467 PMMKQRRFTFPQTM-QFIPXVFZSA-N 378.476 2.625 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3cc(-c4cnn(C)c4C)on3)C1)CC2 2356155027 URVISMYUJLMGGJ-OAQYLSRUSA-N 392.463 2.602 0 50 GFAA Cn1c(C(=O)N[C@H](c2ccccc2)c2n[nH]c(=N)s2)cnc1-c1ccccc1 2356166000 SFEGETQHPXLZGP-MRXNPFEDSA-N 390.472 2.871 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2cccc(N3CCCC3=O)c2)C1=O 2356169052 JVRLVWAPMCTQDG-QFIPXVFZSA-N 383.492 2.821 0 50 GFAA C[C@@H](CN1CCOCC1)NC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 112439320 MGKFVHHPUKRHLZ-WMZOPIPTSA-N 399.495 2.694 0 50 GFAA CCOC(=O)Cc1cc(=O)n2ncc(-c3cccc(Br)c3)c2[nH]1 101277853 HKUDKTMJKFYTKO-UHFFFAOYSA-N 376.210 2.558 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1cc(Cl)cc(Cl)c1 54254068 NENBMFOBOLXSAO-UHFFFAOYSA-N 382.247 2.983 0 50 GFAA CC(C)OC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccccc3Br)C[C@@]23C=C[C@H]1O3 100833621 GOUMLHLYFWBNID-FSZRXZPDSA-N 392.249 2.687 0 50 GFAA biogenic COc1ccc(CN2CCN(CC(C)(C)C)[C@H](CCO)C2)c(OC)c1OC 104344188 DMHGUYGQBPSKBX-QGZVFWFLSA-N 380.529 2.627 0 50 GFAA COc1ccc(C(=O)Nc2ccnn2C2CCN(c3ncc(F)cn3)CC2)cc1 67714129 PTUILIONGPCEEG-UHFFFAOYSA-N 396.426 2.915 0 50 GFAA COc1ccc(OC)c(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)c1 22851327 XBKMPEYOPWNMFO-OAQYLSRUSA-N 384.520 2.815 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3nonc3c2)CCN1CCCc1ccccc1 20203632 XUYSSIKSRHIGFI-HXUWFJFHSA-N 380.492 2.724 0 50 GFAA O=C(Nc1ccnn1C1CCN(C[C@H]2CCCO2)CC1)c1ccc2c(c1)OCO2 67514576 WTTZADUHOSPUBS-QGZVFWFLSA-N 398.463 2.680 0 50 GFAA CCN(Cc1c(F)cccc1Cl)C(=O)c1cn(C[C@@H]2CCCNC2)nn1 67587811 SAWOBYXJVZRSLS-CYBMUJFWSA-N 379.867 2.733 0 50 GFAA C[C@H](C(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)n1c(S)nnc1-c1cccs1 151173918 BLWSQEOYKKCFLK-DNIRFERGSA-N 378.523 2.786 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@@H]2CCC[C@H](C3CC3)C2)[C@@H]1c1cnn(C)c1C 328633696 SUIJNPILKUNEOS-PSHVLCQKSA-N 388.556 2.823 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc4ccccc4[nH]3)CC2)C1 67920224 NNPNIDVNQSCXQB-IBGZPJMESA-N 398.551 2.607 0 50 GFAA CN(C[C@@H]1C[C@H](F)CN1c1ccnc(N(C)C)n1)C(=O)c1ccc2c(c1)CCC2 329954019 JSKDLZWRYFEKHA-OALUTQOASA-N 397.498 2.720 0 50 GFAA COc1ccc2ccccc2c1CNC(=O)C[C@@H]1C(=O)NCCN1CC(C)(C)C 12203306 CTRSTZLAXPPBJV-LJQANCHMSA-N 397.519 2.701 0 50 GFAA O=C(NC[C@H]1CCCN(c2ccccc2S(=O)(=O)C(F)F)C1)c1ccco1 367164264 HCWULJWUCDJOPH-CYBMUJFWSA-N 398.431 2.922 0 50 GFAA Cc1cc(N2CCO[C@H](C(=O)NCCc3ccncc3)C2)c2ccccc2n1 72411273 JPTDFGFUEXLSCP-NRFANRHFSA-N 376.460 2.502 0 50 GFAA Cc1cc(C(=O)NCCN2CCc3ccccc3C2)cc(C)c1OCC(=O)O 237864938 AKFSUHHUSBMUJO-UHFFFAOYSA-N 382.460 2.555 0 50 GFAA CCCOc1ccc2c(c1)CCN(C(=O)[C@@H]1CC13CCS(=O)(=O)CC3)C2 284339612 XMSVKNWEIPZTBP-SFHVURJKSA-N 377.506 2.575 0 50 GFAA C[C@@H](CN(C(=O)c1ccc(S(=O)(=O)c2ccccc2)s1)C1CC1)C(=O)O 262209099 PLUITPWJYAJQGL-LBPRGKRZSA-N 393.486 2.906 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CCC(N2CCCCC2=O)CC1 133658030 RKVFGMOAVQDKEU-UHFFFAOYSA-N 398.507 2.896 0 50 GFAA CN(C)[C@@H]1CCN(CCCN2CC3(CCN(C4CCCCC4)CC3)OC2=O)C1 72410110 KKUMVYSJMPMILE-HXUWFJFHSA-N 392.588 2.632 0 50 GFAA C[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1nc(Cc2ccccc2)no1 175328856 PATZEQQRVYWGRJ-HNNXBMFYSA-N 392.463 2.544 0 50 GFAA CN1C[C@@]2(CCCN(C(=O)NCc3nc(-c4ccccc4)cs3)C2)OC1=O 426719966 OUQBUPYHWWDSEM-LJQANCHMSA-N 386.477 2.936 0 50 GFAA CCN(Cc1nc(-c2ccc(C)cc2)no1)C(=O)N[C@H](C)c1nncn1CC 426580973 PDJIJVSYZPNATM-CQSZACIVSA-N 383.456 2.949 0 50 GFAA O=C(c1cccc(CO)n1)N1CCC(c2nccn2Cc2ccccc2)CC1 82119939 JTZXDOPGVNMEEV-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA C[C@H](C(=O)O)N1CC2(CCC1=O)CCN(Cc1ccnc3ccccc13)CC2 91651312 BOOIXWOYVNNODS-MRXNPFEDSA-N 381.476 2.913 0 50 GFAA COCCN(Cc1ccccc1F)C(=O)c1cnc(-c2cccnc2)nc1O 91441715 HPCOEHNBLUSAER-UHFFFAOYSA-N 382.395 2.672 0 50 GFAA Cc1cnc(CN2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)s1 180414846 MOQDOSANAHYDRF-UHFFFAOYSA-N 389.905 2.751 0 50 GFAA COc1ccc2ccccc2c1CN1CCN(C2CCN(C)CC2)[C@@H](CCO)C1 97711712 IQKAIMIICRKBCD-NRFANRHFSA-N 397.563 2.811 0 50 GFAA CCC(=O)Nc1ccc(F)c(NC(=O)N(CCOC)C2CCN(C)CC2)c1 96165188 NFEHXQCXIRRRRK-UHFFFAOYSA-N 380.464 2.749 0 50 GFAA COc1cccc(N2CCN(CC(=O)N[C@H](C)c3ccc(C)cc3)CC2=O)c1 91845448 DZEOADWCIGPQTG-QGZVFWFLSA-N 381.476 2.530 0 50 GFAA Cn1ccnc1[C@H](O)C1CCN(C(=O)Nc2ccccc2-n2cccn2)CC1 96160096 LTSMBYBUSGDTPM-GOSISDBHSA-N 380.452 2.583 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@H]1C2)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 245237941 LUZDIWKBUUVMDS-OKYOBFRVSA-N 376.522 2.533 0 50 GFAA CC(C)(C)c1cc(CN2C(=O)CC[C@@H](n3cc4c(O)cccc4n3)C2=O)no1 1875358684 FLRKUXMOKLTPSF-OAHLLOKOSA-N 382.420 2.918 0 50 GFAA CCOC(=O)c1cc(S(=O)(=O)N[C@@H]2CCC(C)(C)c3ccccc32)n[nH]1 1875349197 PXZDTZYPTSPMJQ-CQSZACIVSA-N 377.466 2.677 0 50 GFAA CC(C)(C)OC(=O)N1CC[C@]2(C(=O)Nc3c[nH]nc3OCC(F)(F)F)C[C@H]12 1875321813 WLPDXKVBUNZLEG-BONVTDFDSA-N 390.362 2.689 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCC(c2nc3ccc(F)cc3[nH]2)CC1 952973825 YQCXDLHFWPGJBN-UHFFFAOYSA-N 378.429 2.875 0 50 GFAA COc1ccccc1/C=C/CN1CC[C@@H](Oc2ccnc(CNC(C)=O)c2)C1 886044859 IDBXUXQMLBWOGK-GZNAHNRGSA-N 381.476 2.893 0 50 GFAA O=C(Cn1ccc(C(F)(F)F)n1)NCc1ccncc1OCC(F)(F)F 281049385 GIIAKOYEPIENOY-UHFFFAOYSA-N 382.264 2.554 0 50 GFAA Cc1cc(N2CCN(CC(=O)N(C)[C@@H](C)c3cc4ccccc4o3)CC2)n[nH]1 187160288 YKOIJHHDIHJUGN-INIZCTEOSA-N 381.480 2.806 0 50 GFAA CSc1nc(-c2ccco2)nc(C)c1C(=O)N1CC[S@](=O)C[C@@H](C)C1 225460972 PTPLDUYCFQSIFC-FTJNGKRUSA-N 379.507 2.608 0 50 GFAA O=C(NCc1nnc2n1CCC2)Nc1cc2ccccc2nc1Br 225443313 BLOAQWNZOKZFFB-UHFFFAOYSA-N 387.241 2.857 0 50 GFAA CN1CCN(Cc2ccc(C(=O)N3CC(C)(C)OC4(CCCC4)C3)cc2)CC1 189950947 FHJUGTNQZIEFOT-UHFFFAOYSA-N 385.552 2.998 0 50 GFAA O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1nc2cccnc2s1 193984788 HOALKVWOTQBLJG-HNNXBMFYSA-N 380.473 2.655 0 50 GFAA CCCCc1ncc(CN2CCCN(C(=O)Cc3csc(C)n3)CC2)[nH]1 1529113133 BYIPQIYUZHNRNF-UHFFFAOYSA-N 375.542 2.794 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3csc(-c4ccccc4)n3)C[C@@H]12 1704299118 NTRRZYDMVBNYKC-UZLBHIALSA-N 385.489 2.821 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@H](C)n3cnc4ccccc4c3=O)CC2)c1C 5302422 XDFXWOULOCGEKZ-SFHVURJKSA-N 390.487 2.923 0 50 GFAA CCCOC(=O)c1ccc(NC(=O)C(=O)NCCCN(CCC)CCC)cc1 5591209 PEQJHSUKQPMXDP-UHFFFAOYSA-N 391.512 2.820 0 50 GFAA C[C@H](O)CNC(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 11878712 SSJZYMHEBWYYEC-SFHVURJKSA-N 382.504 2.883 0 50 GFAA COc1cc(CNCCC(C)C)ccc1OC[C@@H](O)CN1CCSCC1 11879554 UJGFXHDMQCCYMU-SFHVURJKSA-N 382.570 2.619 0 50 GFAA Cc1nc(CN(C)C[C@@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)cs1 12470823 XRUWFUXLBXJXET-IBGZPJMESA-N 377.485 2.576 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C3CCOCC3)C2)c(OC)c1 14953119 MTCDSUDLTIGRNP-QGZVFWFLSA-N 390.524 2.991 0 50 GFAA COc1cc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c(C)cc1Br 16578916 YMPIWVGNRHIZOR-QWRGUYRKSA-N 378.288 2.564 0 50 GFAA O=C(c1ccc[nH]1)N1CCC(n2cc(-c3nc(-c4ccccc4)no3)nn2)CC1 169777549 SDWWIZGLLGKJLB-UHFFFAOYSA-N 389.419 2.801 0 50 GFAA Cc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)N[C@H](C(=O)O)C(C)C)cc1 2827363 ZFKAXWWHOZVLRG-BIRYMOPTSA-N 380.444 2.991 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCc3cnc(C)cn3)sc12 1857692560 KKXAEQOYJOCPGJ-UHFFFAOYSA-N 386.521 2.660 0 50 GFAA Cc1cc(C[C@@H]2CN(c3ccnc(-c4ccc5c(c4)OCO5)c3)C[C@H]2O)on1 1857710477 YZJYPUAAFBKFDU-DNVCBOLYSA-N 379.416 2.814 0 50 GFAA COc1ccc2c(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)cc(C)nc2c1 1857717315 QZFWLZRGJNOXRN-IERDGZPVSA-N 377.444 2.622 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H]3[C@H](CNC(=O)C4CCC4)[C@H]4CC[C@]3(C2)O4)cc1C 1857723687 QRMUNBQKDYXRGX-DZCCDHAISA-N 382.504 2.839 0 50 GFAA COc1cccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)c1F 1857729179 MBSOXYILLACNPE-CECAUBDESA-N 396.418 2.749 0 50 GFAA COc1cc(CCC(=O)N2CCC[C@H]2C(=O)O)ccc1OCC(F)(F)F 262716712 SBRJCKSUWDCCLG-LBPRGKRZSA-N 375.343 2.645 0 50 GFAA COc1cc(/C=c2\sc3nc4c(C)c(C)ccc4n3c2=O)cc(OC)c1O 1024560 WEMXAFLQUDLHTP-SXGWCWSVSA-N 382.441 2.797 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCCc2cnn(C)c2)CC[C@H]1NC1CCCC1 2100483314 ZLBAPMLUKOEZAW-DFQSSKMNSA-N 376.545 2.575 0 50 GFAA COc1ccc(CNC(=O)c2sc3nc4c(cc3c2N)CN(C)CC4)cc1 19853454 UCOFVDRFNNKIGZ-UHFFFAOYSA-N 382.489 2.805 0 50 GFAA COCCn1cc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)nn1 907367824 COSOCFUMMRQKMN-INIZCTEOSA-N 383.496 2.896 0 50 GFAA CCOc1ccc(N[C@@H]2CC(=O)N(c3ccc(N4CCOCC4)cc3)C2=O)cc1 101129160 ADSQONFATAPHQG-HXUWFJFHSA-N 395.459 2.666 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)cc1OC 1142664 FQFIUOGUFLWGRQ-UHFFFAOYSA-N 378.450 2.643 0 50 GFAA C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)CF 2584033 ASXVEBPEZMSPHB-QAPCUYQASA-N 386.423 2.567 0 50 GFAA in-vitro CN(C[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CCn1cncn1 11843567 OADUESSKJLBWDQ-SFHVURJKSA-N 389.931 2.735 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc2c(c1)OCO2)NCc1nnc2n1CCC2 11998669 OZPNLQXHWKPZNL-QGZVFWFLSA-N 390.443 2.791 0 50 GFAA CC(=O)NCCC(=O)N1CCC[C@H](C(=O)c2ccc3c4c(cccc24)CC3)C1 12052894 IIYCRQACAWFTBP-SFHVURJKSA-N 378.472 2.886 0 50 GFAA O=C(N[C@H]1CCOC1)c1ccccc1OC1CCN(Cc2ccccn2)CC1 12436223 XLUJFOXWXWFVCJ-SFHVURJKSA-N 381.476 2.644 0 50 GFAA O=C(NCc1ccccc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 12906693 NKXKVZURKKOZPW-UHFFFAOYSA-N 376.453 2.930 0 50 GFAA COc1ccc(NC(=O)[C@H]2CC(O)=Nc3nc(N4CCCCC4)nc(N)c32)cc1 13690957 AIPJJISWFWBLKH-AWEZNQCLSA-N 396.451 2.772 0 50 GFAA C[C@H](c1ccccc1)n1nccc1NC(=O)Cn1cc(-c2cnn(C)c2)cn1 23312408 YKTGSVLZZFVLFM-OAHLLOKOSA-N 375.436 2.728 0 50 GFAA CC(=O)N1CCN(C(=O)Cn2ccc3cc(OCc4ccccc4)ccc32)CC1 36359887 SQIFYOYKEQENIY-UHFFFAOYSA-N 391.471 2.911 0 50 GFAA Cc1nn(C[C@H](O)CO)c2nc3ccccc3c(NCCc3ccccc3)c12 43191062 OAQHCUINGLIUAN-KRWDZBQOSA-N 376.460 2.901 0 50 GFAA CCC(=O)Nc1ccc(OCC(=O)N(C)C[C@@H]2CCN(CC(C)C)C2)cc1 55120056 XCVXEGXEQWBKIP-KRWDZBQOSA-N 375.513 2.850 0 50 GFAA Cc1nn(CCO)c(C)c1CN1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1 65466304 BVAZRFPNEFHPAQ-JTHBVZDNSA-N 379.504 2.996 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](N)CN1C(=O)c1cc(C)nc2c(C)cc(C)cc12 67805663 XCSKILIONZJZPC-APWZRJJASA-N 382.508 2.570 0 50 GFAA O=C(NC[C@@H](O)c1ccccc1C(F)(F)F)c1cccc(-n2cnnc2)c1 91526824 DDLCRKWDTYLVQE-MRXNPFEDSA-N 376.338 2.750 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)c3ccc4c(c3)ncn4CCO)C2)c1 95363809 HYSOJZQEEMNULC-GOSISDBHSA-N 393.443 2.747 0 50 GFAA COc1cccc2c1OC[C@@H](CNC1CCN(C(=O)c3cccnc3)CC1)C2 95508216 NNYZAPGUEFMHPQ-MRXNPFEDSA-N 381.476 2.536 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@@H](C(=O)Nc2ccc(-c3ccn[nH]3)cc2)C1 95509924 XHGGWZVBCSRIDA-MRXNPFEDSA-N 377.448 2.906 0 50 GFAA CN[C@H](C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1)c1ccccc1 95510806 MXRRDHHHXQGXEU-NRFANRHFSA-N 389.503 2.993 0 50 GFAA Cc1ccc(NC(=O)N2CCC(N3CCN(CCO)CC3)CC2)cc1C(C)C 96133547 VYGZZGBZHWVWFM-UHFFFAOYSA-N 388.556 2.725 0 50 GFAA COCCn1cnnc1CN(C)C(=O)Nc1cc(OC)cc(C(F)(F)F)c1 96138493 HRTFVIFQCYOWDQ-UHFFFAOYSA-N 387.362 2.616 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(C(=O)CCn3ccccc3=O)CC2)C1 96166965 CVFBJSLWBNTZFC-OAQYLSRUSA-N 393.531 2.967 0 50 GFAA CC(C)NC(=O)c1cc(NC(=O)N[C@@H](C)c2nnc(N)s2)ccc1Cl 97823027 GYKLETNKKFQUDJ-QMMMGPOBSA-N 382.877 2.795 0 50 GFAA CC(C)[C@H](NC(=O)CN1CCN(C[C@H]2CCCCN2C)CC1)c1ccccc1 109752135 QJZDVBLBKOSPOY-GGAORHGYSA-N 386.584 2.602 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCC[C@H]3CCC[C@@H]32)c(Br)o1 115753080 KSUZZVWBRITFSP-BDAKNGLRSA-N 378.244 2.694 0 50 GFAA Cc1cc(C(=O)NCCc2nnc3n2CCCCC3)c2cnn(C(C)C)c2n1 121800805 BBOJNKHZLBQRHT-UHFFFAOYSA-N 381.484 2.611 0 50 GFAA Cc1ccccc1-c1nc(CN2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)no1 127031804 OTODYNGVUVPRLY-KRWDZBQOSA-N 397.523 2.610 0 50 GFAA CC(=O)Nc1cccc(C(=O)NCc2nnc3ccc(-c4ccccc4)nn23)c1 169778383 PMFUQMBJJSAEBL-UHFFFAOYSA-N 386.415 2.680 0 50 GFAA COCCOCCOCCCNC(=O)[C@H]1CCCCN1Cc1cccc(C)c1 170597537 LRFQAMILCZTJFI-OAQYLSRUSA-N 392.540 2.535 0 50 GFAA CNC[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2Br)C1 178973605 PBSDARBIMWBLNP-NSHDSACASA-N 375.694 2.939 0 50 GFAA Cc1cc(C(=O)NC2CCN(C(=O)C[C@@](C)(O)c3ccccc3)CC2)c(C)o1 182313113 YGOBUPLOGUARBZ-JOCHJYFZSA-N 384.476 2.915 0 50 GFAA Cc1ccc2[nH]cc(C(=O)N3CCC([C@@H](O)c4ccccn4)CC3)c(=O)c2c1 220178520 INYIQNAINGWYPY-HXUWFJFHSA-N 377.444 2.817 0 50 GFAA Cc1nc(C(=O)N2CCC[C@@H](CCC(=O)O)C2)nn1-c1ccc(Cl)cc1 237826920 SFCPHATWJUJLAW-ZDUSSCGKSA-N 376.844 2.946 0 50 GFAA Fc1ccc(N2CCN(c3ccc(-c4noc([C@@H]5CCNC5)n4)cn3)CC2)cc1 261716594 JHELZIPMYHYUGF-MRXNPFEDSA-N 394.454 2.674 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cnc(OCC4CC4)cn3)CC2)oc1C 284324488 PZMGYWVQOLFEFI-UHFFFAOYSA-N 399.495 2.512 0 50 GFAA Cn1ncnc1[C@@H]1COCCN1Cc1csc(COc2ccc(F)cc2)n1 284861425 SCJMWKJKQIMRPI-INIZCTEOSA-N 389.456 2.563 0 50 GFAA CCc1nc2ccc(Cl)cn2c1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 292269804 WSJLDJSMLQHSQC-UHFFFAOYSA-N 398.776 2.816 0 50 GFAA COc1ccc(CNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cc1C(=O)O 299741102 CTKMIYBCYVHMLU-QGZVFWFLSA-N 385.416 2.881 0 50 GFAA CN(Cc1ccccc1)[C@@H]1CCN(C(=O)C2CCN(C(=O)N3CCCC3)CC2)C1 363271259 LJULTGNVZGRGFV-OAQYLSRUSA-N 398.551 2.647 0 50 GFAA O=C(CCCN1CCN(c2ccccc2)CC1)NC[C@H](CO)c1ccc(F)cc1 412719364 UZARHFPPEGMYRG-HXUWFJFHSA-N 399.510 2.620 0 50 GFAA CCc1cccc2c(C(C)=O)cn(CC(=O)N3CCC(n4cnnc4)CC3)c12 426392784 JYZBIHSRNFKODE-UHFFFAOYSA-N 379.464 2.862 0 50 GFAA Cn1cncc1-c1cccc(C(=O)N2CCCN(Cc3cccnc3)CC2)c1 426414729 RUAORBROUMQXEY-UHFFFAOYSA-N 375.476 2.830 0 50 GFAA COc1ccccc1-c1ncc(CN=c2cc([C@H]3CCOC3)nc(N)[nH]2)s1 426477179 IATNMHRTRQVOSZ-LBPRGKRZSA-N 383.477 2.729 0 50 GFAA Cc1nnnn1-c1ccc(C(=O)N2CCCN(c3ccccc3F)CC2)c(F)c1 451715342 WXKATJPQGYDCFG-UHFFFAOYSA-N 398.417 2.601 0 50 GFAA Cc1csc([C@](O)(CC(=O)N2CCC(c3cn[nH]c3)CC2)C(F)(F)F)n1 735931370 ZRWBKPBPHZWNDS-OAHLLOKOSA-N 388.415 2.721 0 50 GFAA C=CC(=O)N(CC)CC(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1C 900082719 DHLQFURCJKAZPJ-UHFFFAOYSA-N 381.480 2.953 0 50 GFAA CC1(C)COc2c(S(=O)(=O)NCc3ccc(-c4cccnc4)cc3)cnn2C1 914208309 MPEYMGPLMXZZQY-UHFFFAOYSA-N 398.488 2.842 0 50 GFAA Cc1ccccc1-n1cc(CN2CCNC(=O)[C@@H]2c2ccccc2Cl)nn1 952845620 ICFGTZCKNBVGOA-IBGZPJMESA-N 381.867 2.902 0 50 GFAA Cc1ccc(NC(=O)CN2CCC(CNC(=O)c3ccccn3)CC2)c(C)c1 952975772 YQFVSGFBCQLLTN-UHFFFAOYSA-N 380.492 2.779 0 50 GFAA CN(C[C@H]1CCN(c2ccccc2)C1)S(=O)(=O)CCOc1ccc(F)cc1 952981423 MNLVMCTVLUWPIF-QGZVFWFLSA-N 392.496 2.993 0 50 GFAA CC(C)N(CCN(C)C(=O)CC(F)(F)F)C(=O)Cc1c[nH]c2ncccc12 1775997233 YLASCKQLHAYWJS-UHFFFAOYSA-N 384.402 2.753 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)N[C@@H](C)c3cnn(C)c3)sc12 1857681649 BGVASMFAQZBUOQ-AWEZNQCLSA-N 388.537 2.856 0 50 GFAA O=C(c1ccc2nccnc2c1)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857690417 BNOYDATWIKZELJ-QFIPXVFZSA-N 388.427 2.519 0 50 GFAA COc1nc2c(cc1Cn1ccnc1-c1nccn1C)C(=O)N(C1CCCC1)C2 1857701309 ORMIDEZVNFLNMG-UHFFFAOYSA-N 392.463 2.634 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c2ccc(F)cc2n1 1857709959 AOQXAJASMFFWQL-JQVVWYNYSA-N 397.450 2.880 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CCCOc3ccccc3)C[C@]23CC[C@H]1O3)C1CCC1 1857713192 KJTANVBXRGWNSV-ZZLPTCMGSA-N 384.520 2.851 0 50 GFAA O=C(c1csc(Cc2ccccc2)n1)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1857717755 WVCBDSFYAIQSSI-IEBWSBKVSA-N 383.517 2.669 0 50 GFAA O=C(CC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@H]2CO[C@H](C3CC3)CN2C1 1857726329 LYGCJOAAFLAFDO-VABKMULXSA-N 397.563 2.657 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4nccs4)C[C@]34CC[C@H]2O4)cc(C)n1 1857732040 ZIMCFYJOVITJGE-XKGFGPFHSA-N 398.532 2.564 0 50 GFAA Cn1ccc(C(=O)Nc2ccc([C@H]3CN(C(=O)c4ccn(C)c4)CCO3)cc2)c1 1875297143 DPRRNGAMKNVDLY-HXUWFJFHSA-N 392.459 2.830 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N[C@H]2CCN(c3cccc(C)c3)C2=O)cc1 1875373550 FOLRMNQBHVWBMS-IBGZPJMESA-N 377.444 2.679 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)NCc1cc2ccccc2o1 1875401815 SSFZRYFKVKNSPO-RDJZCZTQSA-N 381.436 2.950 0 50 GFAA O=C(NCc1ccnc(Oc2ccccc2F)c1)c1cnc2c(c1)CCNC2 2325856127 BPUHVVIAMMPNHZ-UHFFFAOYSA-N 378.407 2.984 0 50 GFAA CC(C)c1ccccc1CC(=O)N1CCOC[C@H]1CN(C)C(=O)c1ccccn1 2325872134 JWXNDEUEZFQRDJ-LJQANCHMSA-N 395.503 2.747 0 50 GFAA CN1CCC[C@@]2(CCCN2S(=O)(=O)c2cc(Cl)ccc2Cl)C1=O 2356136601 ATZQHGJWMVTYJV-OAHLLOKOSA-N 377.293 2.769 0 50 GFAA O=C(c1cccc2c3c([nH]c12)CCCC3)N1CCC[C@]12CCCN(CCO)C2=O 2356137686 VJFIMRSKVZMSQR-QHCPKHFHSA-N 395.503 2.636 0 50 GFAA COc1ccc(-c2cnc3c(N4CC[C@H](O)C4)nccn23)c2ccc(C)nc12 2356157761 PPLWPGMDGRUVJJ-AWEZNQCLSA-N 375.432 2.833 0 50 GFAA O=C(CCc1nc(-c2ccncc2)no1)N1CC2(COc3ccccc3C2)C1 2356161870 NFZURHJYFWGFTA-UHFFFAOYSA-N 376.416 2.528 0 50 GFAA CC(=O)c1cccc(NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)c1 1152659 WWTRMTBXAIFAPG-UHFFFAOYSA-N 380.853 2.947 0 50 GFAA CS(=O)(=O)N(Cc1ccc(C(=O)NCc2ccncc2)cc1)c1ccccc1 1206790 MXZDRPODNQVXSJ-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O)c1cccs1 2493511 DNOCCNKQRHBONF-CQSZACIVSA-N 375.372 2.621 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)COc2ccccc2)c1C(=O)OC(C)C 2843679 HSLQCZDCRHXWFQ-UHFFFAOYSA-N 376.434 2.738 0 50 GFAA Cc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C(C)(C)C)cc2)no1 2885063 GDZSAOJOFCKTOH-UHFFFAOYSA-N 396.494 2.643 0 50 GFAA CS(=O)(=O)Nc1cccc(C(=O)NCCSCc2ccccc2F)c1 10112065 DZONCYTUKRJNGM-UHFFFAOYSA-N 382.482 2.860 0 50 GFAA CC[C@@H](COC)NC(=O)c1cnn(-c2ncc3c(n2)-c2ccccc2CC3)c1C 12048010 RZQMEPYKLRTAHJ-KRWDZBQOSA-N 391.475 2.891 0 50 GFAA Cc1ncoc1C(=O)N1CCc2c(c(C(=O)NC3CCCC3)nn2CC(C)C)C1 14532894 RHZZQOXLOAUYSM-UHFFFAOYSA-N 399.495 2.706 0 50 GFAA CN(C[C@H]1Cc2ccccc2O1)C(=O)CC[C@]1(Cc2ccco2)CCC(=O)N1 14989278 RFHKRNSSBWLFIX-GCJKJVERSA-N 382.460 2.713 0 50 GFAA CCCc1cc(C(=O)N2CCC[C@@H]3CN(Cc4ccccn4)CC[C@@H]32)n(C)n1 23311922 LAMCHIPUAJCOTA-XLIONFOSSA-N 381.524 2.894 0 50 GFAA COC(=O)CN1C(=S)N(C)C(=O)/C1=C/c1cc(C(C)C)c(OC)cc1C 32122932 FSDWASLQYBUJLH-DHDCSXOGSA-N 376.478 2.700 0 50 GFAA CC(=O)c1cc(C(=O)N(C)Cc2nc(-c3cccc(C)c3)no2)c(=O)[nH]c1C 55414354 MPGPFHLFMAPALF-UHFFFAOYSA-N 380.404 2.517 0 50 GFAA COc1cc2c(cc1O)NC(=O)C[C@@H]2c1ccc(OC)c(Cn2cncn2)c1 65373014 PMDUNDSINMGXSG-CQSZACIVSA-N 380.404 2.523 0 50 GFAA Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)N3CCOCC3)cc2C)cc1 67339120 GWNUBSGAGCWEPG-UHFFFAOYSA-N 388.489 2.601 0 50 GFAA Cc1nn(C)cc1[C@H](C)Nc1ccc(C(=O)NCc2noc(C(C)C)n2)cn1 67674890 BAUBRLKJUFNSPS-LBPRGKRZSA-N 383.456 2.733 0 50 GFAA Cc1cc(CNc2ccc(C(=O)N(C)C[C@@H]3COc4ccccc4O3)cn2)on1 67967323 LDRUQKJJQZXUJR-QGZVFWFLSA-N 394.431 2.902 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(c3nc4ccccc4o3)CC2)C1)N1CC=CC1 71662760 DHDUTPQVCVXMIH-QGZVFWFLSA-N 380.492 2.907 0 50 GFAA O=C(CCSCc1ccc(F)cc1)N1CCC(N2CCC[C@@H](O)C2)CC1 72133675 RPFSKKRWCRKABC-LJQANCHMSA-N 380.529 2.897 0 50 GFAA CN(CC(=O)NCc1cc2n(n1)CCN(C1CCCCC1)C2)c1ccccc1 91625844 LONOSHCAJGOPPQ-UHFFFAOYSA-N 381.524 2.784 0 50 GFAA Cc1ccccc1[C@@H](CNC(=O)c1cnc(-c2ccccn2)nc1O)N(C)C 91746044 NVSXLRYGJFULBO-GOSISDBHSA-N 377.448 2.585 0 50 GFAA CCc1nc2ccccc2n1[C@H](CC)C(=O)N(C)C1CCS(=O)(=O)CC1 95366111 SBDOGJDGENHJQL-MRXNPFEDSA-N 377.510 2.585 0 50 GFAA Oc1nc(CN2C[C@H]3CC[C@@H]2CN(Cc2cscn2)C3)nc2ccsc12 95383216 YLWGKGMSACEGQN-GXTWGEPZSA-N 387.534 2.950 0 50 GFAA O=C(c1ccn(C(F)F)n1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95386384 DJTSSRRKKRICCR-WMLDXEAASA-N 386.446 2.982 0 50 GFAA CN(C)CCN1C[C@@]2(CCCN(C(=O)c3cnc4ccccc4c3)C2)CCC1=O 95513187 JDNBZLLXBVBYGJ-HSZRJFAPSA-N 394.519 2.641 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NCCc1csc(CSC)n1)C2 95516706 MIWBHPDXYPYSAR-CYBMUJFWSA-N 378.519 2.925 0 50 GFAA COc1ccc(CN2CCC(F)(F)CC2)c(OC[C@@H](O)CN2CCCC2)c1 95523984 ZGYULKKPIDTRJB-KRWDZBQOSA-N 384.467 2.762 0 50 GFAA Cc1c(-c2ccccc2)n[nH]c1C(=O)N(Cc1ccccn1)C[C@@H]1CCC(=O)N1 97766332 BARDCSCTWJPJBN-SFHVURJKSA-N 389.459 2.701 0 50 GFAA COc1ccc(CN2CCN(Cc3ccccc3OC)C[C@H]2CCO)c(F)c1 104354398 AJQRBXGWMBSXHR-LJQANCHMSA-N 388.483 2.912 0 50 GFAA C[C@H](C(=O)Nc1ccccc1F)N1CCN(c2ncnc3ccsc23)CC1 124374080 KKAIOCDHWXRVDM-CYBMUJFWSA-N 385.468 2.980 0 50 GFAA O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)N1CCCc2cccc(O)c21 155575520 CSNWSTZLJQUBSA-UHFFFAOYSA-N 381.400 2.910 0 50 GFAA Nc1cccc(CSc2nnc(N3CCOCC3)n2-c2cccc(F)c2)n1 170613007 XSFALEHTRZWZOV-UHFFFAOYSA-N 386.456 2.513 0 50 GFAA COc1ccc([C@H](CN2C(=O)[C@@H]3Cc4ccccc4CN3C2=O)N(C)C)cc1 170613691 USOXKHBRWBJRLW-PMACEKPBSA-N 379.460 2.687 0 50 GFAA COc1cccc(CNC(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)n1 170616883 IDOMARZIUNOKGI-OAHLLOKOSA-N 378.473 2.631 0 50 GFAA CS(=O)(=O)c1ccc(F)c(C(=O)N2CCC(C(=O)c3ccccc3)CC2)c1 172726746 KHJZRRHQICCGKD-UHFFFAOYSA-N 389.448 2.964 0 50 GFAA CC(C)c1nc([C@@H]2CCCN2C(=O)CCn2cnc3sccc3c2=O)no1 173079757 OSCPVRFLCXVFIT-ZDUSSCGKSA-N 387.465 2.718 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1Cn1cncn1 173687940 CADIWPAYHBRRLJ-GOSISDBHSA-N 395.850 2.515 0 50 GFAA CC(C)CCN1CCC(CNC(=O)NCc2ccnc(-n3cccn3)c2)CC1 175363001 LFCBOJFCIPZUCE-UHFFFAOYSA-N 384.528 2.825 0 50 GFAA O=C(NC[C@@]1(CCO)CCOC1)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 182478916 JBMODNNYCMSNNQ-QGZVFWFLSA-N 398.385 2.802 0 50 GFAA CCCc1ncc(CN2C[C@@H]3OC(=O)N(CCc4ccc(F)cc4)[C@@H]3C2)cn1 248157591 DYSKHIVAJRKFCA-MOPGFXCFSA-N 384.455 2.816 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCN(c3ccccc3OC)C2)c(F)c1 252492140 MEBMXZLRQNUPER-CQSZACIVSA-N 394.468 2.648 0 50 GFAA CC[C@H](C)[C@@H](c1nc2ccccc2[nH]1)n1cc(C(=O)OC)c2n[nH]c(=O)c-2c1 263587906 MRYHUCLOERIKIE-GTNSWQLSSA-N 379.420 2.975 0 50 GFAA Cc1nc2sccn2c1CN(C)C(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C 267526644 OGTGMQVLRAMZIX-GFCCVEGCSA-N 383.477 2.753 0 50 GFAA O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@H](c2noc(C3CC3)n2)C1 270089802 TVAZNFWBZMCSRI-JKSUJKDBSA-N 382.468 2.510 0 50 GFAA CCOc1ccc(-c2nc(CN3CCOC[C@@H]3c3ncnn3C)cs2)cc1 283942955 AGASTWMHHPQFTN-QGZVFWFLSA-N 385.493 2.911 0 50 GFAA Cc1cc(-c2cccc(C(=O)N3CCC[C@H](c4nccn4C)C3)c2)nc(N)n1 299802416 ZQJXAXRNMBUXND-KRWDZBQOSA-N 376.464 2.788 0 50 GFAA CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1 374851489 FHHRSOYNIQGWFT-ZDUSSCGKSA-N 383.427 2.937 0 50 GFAA CC(C)O[C@H]1CN(C(=O)NCc2cc(-c3ccc(Cl)cc3)no2)C[C@@H]1O 584893176 CZOCLMWFZCNNTH-IRXDYDNUSA-N 379.844 2.675 0 50 GFAA NC(=O)c1csc(S(=O)(=O)NCC[C@H](c2ccccc2)c2ccco2)c1 670465129 AZDDIWDUHYAWJX-OAHLLOKOSA-N 390.486 2.941 0 50 GFAA CC[C@H]1c2cc(F)c(F)cc2CCN1C(=O)c1nnn([C@@H]2CCNC2)c1C 888101951 RIURSXWLIADHBL-DYVFJYSZSA-N 375.423 2.549 0 50 GFAA O=C(C[C@@H](O)C(Cl)(Cl)Cl)NCc1ccc(-n2ccnc2)c(F)c1 906406494 BWASHPMDKRHRRU-GFCCVEGCSA-N 380.634 2.749 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccccc2F)CN(C(=O)[C@H]2C[C@@]23CCNC3)C1 952892725 BWYOFYWDILBMGR-OPAMFIHVSA-N 382.483 2.922 0 50 GFAA Oc1nc2ccc(-c3noc([C@H]4CCc5nnn(C6CCC6)c5C4)n3)cc2[nH]1 952895934 YFLCSHFMPJSDSK-NSHDSACASA-N 377.408 2.908 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCC[C@]2(CC1)CNC(=O)O2 952981740 WCAVPENYLBOFDO-SFHVURJKSA-N 379.844 2.793 0 50 GFAA C[C@H](C(=O)Nc1cccc(-n2cccn2)c1)N(c1ccccc1)S(C)(=O)=O 952991904 XCQMHDJUJPMJPS-OAHLLOKOSA-N 384.461 2.666 0 50 GFAA CCCNS(=O)(=O)c1ccc(C(=O)Nc2ccnn2C2CCCC2)cc1 1529145667 DWTLHSGOFOFVPX-UHFFFAOYSA-N 376.482 2.939 0 50 GFAA O=C(CCN1CCCCCC1=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12 1529158407 BRNMILSAXBNVAU-WIYYLYMNSA-N 395.503 2.701 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cccc(OCC(N)=O)c2)C[C@@H](c2ccccc2)O1 1529167059 DUMPGJVVESGNAJ-UXHICEINSA-N 382.460 2.789 0 50 GFAA O=C(CCC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1)Nc1ccc2c(c1)CCC2 1529174462 UPKLNVJVJGWWBO-TZIWHRDSSA-N 393.487 2.663 0 50 GFAA Cc1nn(CCO)c(C)c1CN1CC[C@H](c2ccc3ccccc3c2)[C@@H](O)C1 1565527021 BVAZRFPNEFHPAQ-GGAORHGYSA-N 379.504 2.996 0 50 GFAA CC(C)c1nc(CCNC(=O)Cn2nc(-c3ccccc3)nc2[C@H](C)N)cs1 1857686791 IBYLHXVGJTZFRV-AWEZNQCLSA-N 398.536 2.904 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)N1CCc2ncccc2C1 1857726848 FXEUTEHNWDDYQW-OAHLLOKOSA-N 377.448 2.809 0 50 GFAA CC(=O)N1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NCCc2nccs2)C1 1857738155 TWUGTDITVBQVKQ-NRFANRHFSA-N 397.548 2.713 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(c4ncccc4C)C[C@]34CC[C@H]2O4)cnc1C 1875249570 CNTGLSWTBNYODH-DZCCDHAISA-N 392.503 2.816 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nc2cccc3c2CCCN3C(N)=O)cc1 1875373691 KVMRKAAWHTTZEC-UHFFFAOYSA-N 378.432 2.919 0 50 GFAA COc1ncc(Br)cc1CNC(=O)c1n[nH]c2c1C[C@H](C)O[C@@H]2C 1875394990 FMYSDQDQOICCJJ-DTWKUNHWSA-N 395.257 2.528 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)c1cccc(-c2cc[nH]n2)c1 1875401313 IJSSMHQJVZQSQA-WBVHZDCISA-N 378.436 2.524 0 50 GFAA O=C(CCc1ccccn1)N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403370 UVFIXLCRAAQSRP-IOMROCGXSA-N 390.487 2.834 0 50 GFAA Cc1c(NC(=O)Cn2cc([C@@H]3CCOC3)cn2)cccc1C(=O)N1CCCC1 2325771212 FVKGQCDDRCHLID-MRXNPFEDSA-N 382.464 2.570 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CC[C@@H](c2ccon2)C1 2325774505 QOCGOXZLUYGJAK-BDJLRTHQSA-N 392.818 2.772 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCCC[C@@H]1c1cnc(=N)[nH]c1)c1ccc(C)cc1 2325879068 GQFQCQXRPBDZFH-RBUKOAKNSA-N 381.480 2.519 0 50 GFAA O=C(NCc1cn2ccsc2n1)c1cc2c(s1)C1(CCNCC1)OCC2 2356139460 YAKNDWZBWQQCNS-UHFFFAOYSA-N 388.518 2.539 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)Cn2c(C(C)C)nc3ccccc32)CC[C@@H]1O 2356144788 MFNFOLLNZLNLGF-LAUBAEHRSA-N 387.480 2.624 0 50 GFAA Cc1nn(Cc2nnc3n2[C@@H](C)C(=O)N(Cc2cccc(F)c2)C3)c(C)c1C 2356156545 GZICNJIQURSWSB-HNNXBMFYSA-N 382.443 2.691 0 50 GFAA O=C(Nc1nc2ccc(S(=O)(=O)N3CCCCC3)cc2s1)[C@H]1CCCO1 1118975 DAMOOGIJYSKQLK-CQSZACIVSA-N 395.506 2.588 0 50 GFAA CC(C)(C)NC(=O)CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1 2812446 LBCHFKUTFQNHEJ-UHFFFAOYSA-N 378.469 2.931 0 50 GFAA CC(=O)N1CCN(c2ccccc2NC(=O)COc2cc(C)cc(C)c2)CC1 4933399 WEBAHRXBOHWZRW-UHFFFAOYSA-N 381.476 2.989 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3cccnc3)n2CC)s1 4996681 NXBULKLSUMDCDO-UHFFFAOYSA-N 375.483 2.505 0 50 GFAA CC[C@H](C(=O)N1N=C(C(F)F)C[C@]1(O)C(F)F)n1nc(C)c(Cl)c1C 6555273 JHZHZDBHJPVTFV-OTYXRUKQSA-N 384.761 2.912 0 50 GFAA O=C(Cc1ccncc1)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 12304554 SLFIUUJSOCHYAB-QFIPXVFZSA-N 381.451 2.805 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(C)C[C@@H]2CCCCN2C)no1 12434437 IAGGBLQJCXTKCE-INIZCTEOSA-N 381.480 2.937 0 50 GFAA Cc1c(CN(C)C(=O)C[C@H]2C(=O)NCCN2CCC(C)C)[nH]c2ccccc12 12442775 FOBJQKJHBOWIAT-FQEVSTJZSA-N 384.524 2.671 0 50 GFAA COc1cc2c(cc1NC(=O)CSc1nc(N)cc(=O)[nH]1)oc1ccccc12 12858200 FFIOAJDDNHFNTE-UHFFFAOYSA-N 396.428 2.991 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCC(=O)N(Cc3ccc(F)c(F)c3)CC2)CC1 15066972 XHYUKVSHDIWWHB-MRXNPFEDSA-N 395.450 2.620 0 50 GFAA O=S(=O)(Nc1ncccn1)c1ccc(NC(=S)NC2CCCCC2)cc1 17080008 KBQWXHPJBFPCDH-UHFFFAOYSA-N 391.522 2.897 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CNCCn2ccnc2)cc1 20859835 XGMSYXSTRBEUCO-QFIPXVFZSA-N 394.519 2.545 0 50 GFAA COCC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3ccccc3F)n2)C1 20863619 LLUWNMDJXUKOEF-UHFFFAOYSA-N 382.395 2.777 0 50 GFAA COc1ccc([C@@H](C)NC(=O)N2CCC(n3cc(C(C)(C)N)nn3)CC2)cc1 23428719 SRTGSCUXPSAVSF-CQSZACIVSA-N 386.500 2.588 0 50 GFAA O=C(NCc1cccnc1)c1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1 33088429 ALZUKHHENTVVAI-UHFFFAOYSA-N 388.309 2.728 0 50 GFAA OC1CCN([C@@H]2CCN(c3ccnc4c(C(F)(F)F)cccc34)C[C@H]2O)CC1 71755045 LROMJZDCTPIBKF-QZTJIDSGSA-N 395.425 2.650 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)c4ccccc4Cl)CC3)nn2)n1 72119428 GXJNOUYLONVVFR-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA O=C(CCCn1ccnc1)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2 72477152 ASSBWBPMIDQQFA-UHFFFAOYSA-N 380.492 2.705 0 50 GFAA O=C1CCC2(CCN(c3cnc4ccccc4n3)CC2)CN1CCc1c[nH]cn1 91768753 ZSTRXHONYUUFCK-UHFFFAOYSA-N 390.491 2.805 0 50 GFAA CCCO[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91906596 QRYQJBJHMRPDFX-SFHVURJKSA-N 387.524 2.670 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)c3nc4ccccc4[nH]c3=O)C2)cc1 95373681 USSGAWPPMULHFB-OAHLLOKOSA-N 377.400 2.641 0 50 GFAA O=C(C1CCCC1)N1CC[C@]2(O)CCN(CCn3cnc4ccccc43)C[C@@H]2C1 95373900 KVJBIKYZEKVYEI-AUSIDOKSSA-N 396.535 2.512 0 50 GFAA O=C(CN1CCC[C@H](c2ccccc2)C1)NCCc1nc(-c2cccnc2)no1 95387131 RSTNTGQUDGQREM-IBGZPJMESA-N 391.475 2.670 0 50 GFAA c1ccc(-n2nnnc2N2CCC(c3nccn3Cc3ccccn3)CC2)cc1 95500844 SZBCEPSVINPLRU-UHFFFAOYSA-N 386.463 2.686 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)c2ccc(Cl)cc2C)CN1C1CCCC1 96142034 MQQXZAVPDXXJFL-YJBOKZPZSA-N 377.916 2.900 0 50 GFAA Cc1ccc([C@H](CNC(=O)c2ccccc2-c2ncc[nH]2)N2CCOCC2)o1 97474991 BVRHEOKNEXCWMS-SFHVURJKSA-N 380.448 2.781 0 50 GFAA CNC(=O)c1ccc(CNCc2ccccc2CN2C[C@H](C)O[C@H](C)C2)cc1 123447297 LATVDZLPNPHCRD-HDICACEKSA-N 381.520 2.945 0 50 GFAA CCc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cc(C2CCOCC2)[nH]n1 136298917 BAZHXKJKCJBDAG-UHFFFAOYSA-N 377.466 2.522 0 50 GFAA CCCCN1CCC(NC(=O)N2CCC(NC(=O)c3ccccc3)CC2)CC1 158611373 MXFGMFXZPSPRCM-UHFFFAOYSA-N 386.540 2.855 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1 170596459 VEJUXPDCSVLEGA-QWHCGFSZSA-N 380.297 2.975 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@@H](c3ccc(F)cc3)C2)c1 170615280 DZOLLZUJSGSSID-GOSISDBHSA-N 378.425 2.954 0 50 GFAA O=S(=O)(C[C@H]1CCCO1)Nc1cccc(-c2nnc3n2CCCCC3)c1 171806014 IIDOEIRSNSNNHH-MRXNPFEDSA-N 376.482 2.592 0 50 GFAA C[C@H](NC(=O)NC1CCN(C(C)(C)C)CC1)c1ccc(S(C)(=O)=O)c(F)c1 175758526 WXEAJVVWANXNTN-ZDUSSCGKSA-N 399.532 2.852 0 50 GFAA COc1ccc(-c2nc(CN(C)[C@H]3CCN(Cc4ccccc4)C3=O)no2)cc1 191753888 OGUMZBMZXKSCLZ-IBGZPJMESA-N 392.459 2.978 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)c1cccs1 237962118 VLVGCUXOAUHIFR-GWCFXTLKSA-N 394.399 2.711 0 50 GFAA O=S(=O)(CCN1CCCN2CCC[C@H]2C1)c1cc(Cl)ccc1Cl 247299052 DPWUTCDGLHTHCO-AWEZNQCLSA-N 377.337 2.937 0 50 GFAA C[C@@H]1[C@H](N2CCOCC2)CCN1C(=O)c1ccc(N(C)c2ccccc2)nc1 291462581 OJAUMFJNUIPFHW-YLJYHZDGSA-N 380.492 2.785 0 50 GFAA O=C1NCCCN(Cc2nc(-c3ccc(F)cc3)no2)[C@@H]1Cc1ccccc1 292954221 KUZGIMPMNDQTPS-GOSISDBHSA-N 380.423 2.809 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)CC1 367641536 DLTFPOYIHYSTDB-KRWDZBQOSA-N 389.544 2.892 0 50 GFAA CN1C(=O)[C@@H]2CCC[C@H]1CN(C(=O)NCCc1cccc(C(F)(F)F)c1)C2 426493032 AWKJJKCFFWRTGU-ZBFHGGJFSA-N 383.414 2.900 0 50 GFAA C[C@H](CNC(=O)c1ccc2nn[nH]c2c1)Oc1cccc(Br)c1 464666827 TWXBFFNGOOSYFO-SNVBAGLBSA-N 375.226 2.918 0 50 GFAA CCN1C(=O)[C@@H]2CN(C(=O)c3sccc3-c3ccc(F)cc3)CCN2C1=O 752509402 OMNUDTZELURJEV-HNNXBMFYSA-N 387.436 2.663 0 50 GFAA O=C(c1ccc(Cn2cc(Cl)c(C(F)(F)F)n2)cc1)N1CCOCCN1 821003698 GIICGECUXLAWPT-UHFFFAOYSA-N 388.777 2.581 0 50 GFAA CCCn1cc(S(=O)(=O)N(Cc2cccc(C)c2)C[C@@H]2CCCO2)cn1 823033018 HNJDMRGYFROWMJ-SFHVURJKSA-N 377.510 2.971 0 50 GFAA O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H](c2c[nH]c3ncccc23)C1 825118476 KNTBQSYUVOPANS-KRWDZBQOSA-N 391.475 2.814 0 50 GFAA O=C(N[C@H]1CCCN(Cc2cccs2)C1)c1ccccc1N1CCOCC1 828182388 UTHOENRYOCAJGK-KRWDZBQOSA-N 385.533 2.979 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCN(Cc4ccccc4CO)CC3)n[nH]2)cc1 828831899 XIVBJBCGWFKXIN-UHFFFAOYSA-N 390.487 2.835 0 50 GFAA c1cc2c(cc1-c1noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n1)CCO2 952892710 BWKLAAHUGGCJEY-HNNXBMFYSA-N 393.447 2.887 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N1CCCO[C@@H](CN2CCCCC2)C1 952970529 PLTXXYNOCIWTCQ-IBGZPJMESA-N 384.524 2.838 0 50 GFAA C[C@@H](c1ccccn1)N(C)Cc1cnc(NS(=O)(=O)c2ccccc2)nc1 952984812 NJLXYOHZRXQBKO-HNNXBMFYSA-N 383.477 2.865 0 50 GFAA Fc1cnc(NCc2nc(-c3ccccc3Cl)no2)nc1N1CCOCC1 1529142930 XOZTUUHGFFXESX-UHFFFAOYSA-N 390.806 2.768 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCN3[C@@H](c4ccccc4)COC[C@H]3C2)c1C 1529167412 IOLYVYCPVARTGS-RTBURBONSA-N 381.476 2.732 0 50 GFAA COc1cc(C(=O)N2CCCN(C(=O)[C@@H](C)c3ccccc3)CC2)ccc1O 1529191942 KEECPKOIOKHQFW-INIZCTEOSA-N 382.460 2.879 0 50 GFAA O=C1O[C@H]2CN(c3ccc(C(F)(F)F)cn3)C[C@H]2N1CCN1CCCCC1 1565511326 GHCIVNMTTRFVGM-CABCVRRESA-N 384.402 2.596 0 50 GFAA COc1ccccc1-c1nc(CN2C[C@H](O)[C@H](Cc3cc(C)no3)C2)c(C)o1 1704302996 VCNLGBWHTQPCSE-BEFAXECRSA-N 383.448 2.990 0 50 GFAA C[C@H]1CC(=O)Nc2cc(C(=O)NCCC3CC3)ccc2N1C(=O)N1C[C@H]2C[C@@H]2C1 1775964563 CKFRXCBNKKOFGO-IAOVAPTHSA-N 396.491 2.825 0 50 GFAA Cn1cccc1C(=O)N[C@H]1CCC[C@@H](CNC(=O)C2Cc3ccccc3C2)C1 1857692512 ISKBTAIUZFMETE-UZLBHIALSA-N 379.504 2.845 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)[C@@H](O)Cc1ccccc1)CC2 1857710788 PUHKSCTXSTVKLF-NRFANRHFSA-N 375.472 2.618 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N(C)CCc1noc(C(C)C)n1 1857711235 PBWOKUHWGDOCIT-UHFFFAOYSA-N 386.481 2.984 0 50 GFAA COCC1(CNC(=O)[C@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)CCC1 1857719937 ZGWMSMUFVFCDFO-AWEZNQCLSA-N 387.505 2.891 0 50 GFAA O=C(NCc1cc(O)ncn1)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857726781 CCUKDDUPMRVBNL-LLVKDONJSA-N 387.827 2.510 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)N1CCC(c2ncc[nH]2)CC1 1857731762 OHLWHKQYALGYOO-HNNXBMFYSA-N 394.479 2.959 0 50 GFAA Cn1c(-c2nc3ccc(O)cc3s2)nnc1N1CCn2ncc(Cl)c2C1 1875280664 KOUKAMLOOYJQBN-UHFFFAOYSA-N 387.856 2.668 0 50 GFAA O=C(NCc1nc(C(F)(F)F)n2c1CCCC2)N1CC[C@H](CO)CC12CC2 1875301290 JETFDMHJGXMXKB-LBPRGKRZSA-N 386.418 2.685 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(F)cc1F)C[C@H](C)O[C@@H]2C 1875314915 ZSKGPIFWJMCXEP-NWDGAFQWSA-N 379.407 2.760 0 50 GFAA CC(C)n1ncc2cc(C(=O)N3Cc4cccc(F)c4C[C@H]3C(=O)O)cnc21 1875320348 PRTKKBPGTMBICA-KRWDZBQOSA-N 382.395 2.803 0 50 GFAA O=C(NC[C@@H]1CCN(C(=O)c2ccc(F)c3ccccc23)C1)c1ccnnc1 1875328028 VGKDQUOFGRPFGY-AWEZNQCLSA-N 378.407 2.661 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2Cc3ccccc3[C@@H](C(=O)OC)C2)cc1 1875372153 XYUDWTSSNZZWQY-IBGZPJMESA-N 378.428 2.748 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(c4c(F)cccc4F)CC3)n[nH]c21 1875394124 WTKIYHAAPQANHG-NEPJUHHUSA-N 391.418 2.834 0 50 GFAA Cc1c(CC(=O)N2CCC(c3ncc[nH]3)CC2)nnn1-c1cccc(Cl)c1 2325703881 PGNJBYZMMZVAJJ-UHFFFAOYSA-N 384.871 2.901 0 50 GFAA COc1ccccc1[C@H](O)C(=O)N[C@H](C)[C@H](O)c1ccc(Br)cc1 2325762360 XRYMIIFZPRUIER-NVGVWMPQSA-N 394.265 2.729 0 50 GFAA CC(=O)NC[C@@H]1CN(C(=O)C/C=C/c2ccc(C)cc2)C[C@H]1c1cncn1C 2325782615 NVLXCCXDRHVWBD-WEPWYQGCSA-N 380.492 2.510 0 50 GFAA O=C(C[C@H]1CN(C(=O)C2=CCCC2)C2(CCC2)CO1)N1CCC[C@H]1c1ncc[nH]1 2325785067 AAXKKCHMJPLLRO-ROUUACIJSA-N 398.507 2.724 0 50 GFAA Cn1nccc1-n1nc(C2CCOCC2)nc1-c1cnc(-c2ccccc2)n1C 2356151042 NUBAUZKHZZHVDK-UHFFFAOYSA-N 389.463 2.962 0 50 GFAA COC(=O)c1cc(C)nc(N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)n1 2356168097 PDKAZPNBLZTOBW-BEFAXECRSA-N 378.432 2.789 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2cccc(N3CCCC3=O)c2)C1=O 2356169050 JVRLVWAPMCTQDG-JOCHJYFZSA-N 383.492 2.821 0 50 GFAA COc1ccc(CCN(CC(C)C)S(=O)(=O)Cc2ccon2)cc1OC 462140065 OLCWZJIOEIFMBB-UHFFFAOYSA-N 382.482 2.722 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(C)c(Cl)c2)cc1 1141569 XKGMWFOONFBVOQ-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@@H](C)CC3 2520600 IZCPPOVZLXYGBM-SWLSCSKDSA-N 387.455 2.568 0 50 GFAA CN1CCC(Oc2ccccc2Nc2nccc(N3CCC[C@H](O)C3)n2)CC1 2356143500 KIWFXUMOTPDKCH-INIZCTEOSA-N 383.496 2.654 0 50 GFAA COC1(CN(C)C)CCN(Cc2ccc(O[C@@H](C)C(=O)O)c(Cl)c2)CC1 2356158520 NJQCDTUTUHQHLI-AWEZNQCLSA-N 384.904 2.735 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)Nc1ccc(N2CCOCC2)c(Cl)c1 4414609 BVQRRLVFZYAMMD-UHFFFAOYSA-N 387.823 2.723 0 50 GFAA CCn1ncc(NC(=O)Cn2cc(-c3ccc(-c4csc(N)n4)cc3)cn2)n1 23153448 IWEQDEORSXXGGP-UHFFFAOYSA-N 394.464 2.506 0 50 GFAA COc1ccccc1Cn1ncc2c1NC(=O)C[C@H]2c1ccc2c(c1)nnn2C 65406991 KKDVLTQUHGXATH-HNNXBMFYSA-N 388.431 2.696 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3ccccc3-n3cccn3)CC2)c1 20860004 AQJWSDAIQQUBBF-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)CSC)C3)C2=O)c1 11955394 CVYXYTRKDFACGT-IBGZPJMESA-N 380.485 2.538 0 50 GFAA Cc1n/c(=N/CC(=O)Nc2ccn(C)n2)c2cc(-c3ccccc3)sc2[nH]1 119931521 GWAFBSUTNMAHCB-UHFFFAOYSA-N 378.461 2.873 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC[C@H](CN)C3)nc2)cc1 67934627 JTDFYYYONSIEEB-GOSISDBHSA-N 382.508 2.628 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(F)cc1F)[C@@H]1SCCc2ccccc21 121426983 OHPUYYWJUPUTPA-MRXNPFEDSA-N 383.441 2.941 0 50 GFAA O=C(Cn1c(S)nc2ccccc2c1=O)NCCC1Cc2ccccc2C1 152344755 XSRXUQUYNJYMHZ-UHFFFAOYSA-N 379.485 2.607 0 50 GFAA CCN(Cc1nonc1C)C(=O)c1ccnn1COc1ccc(Cl)cc1 2800548 YWLAUSDQDHDUKV-UHFFFAOYSA-N 375.816 2.927 0 50 GFAA CCOC(=O)c1c(NC(=O)c2cc(C(=O)OCC)n(C)n2)sc(C)c1C 2807745 CTBXLPNFCSOMMG-UHFFFAOYSA-N 379.438 2.704 0 50 GFAA O=C(NCc1cccnc1N1CCc2ccccc2C1)c1c[nH]c(=O)c(Cl)c1 67603527 CFGKXHQBCCVJEX-UHFFFAOYSA-N 394.862 2.916 0 50 GFAA Cn1nnnc1CN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 363968403 ZXYRBEKXOWGVJO-UHFFFAOYSA-N 381.415 2.552 0 50 GFAA Cc1cc2nc(-c3c(C(=O)N4CCOCC4)nc4ccccn34)[nH]c2cc1C 71765200 AZYVJILDSAKNNU-UHFFFAOYSA-N 375.432 2.967 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3[C@@H](C)CC[C@H]3C)[C@H]4C2=O)cc1C 77519708 GRFRXBMIOQVCBE-SCPLQFNXSA-N 394.515 2.985 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C[C@H]2OCCc3ccccc32)cc1 129657976 DMDPXNGJHNGCKK-OXQOHEQNSA-N 387.501 2.978 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cccc(CC3CCNCC3)c2)on1 72148309 XSMSRVGRVGFOCH-CTNGQTDRSA-N 383.492 2.513 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1CCC[C@H](c2cccc(C(=O)O)c2)C1 95366548 XUDCWYFRIISNQK-SFHVURJKSA-N 385.464 2.946 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@@H](CO)C3)csc2C1 426503430 REMUIJFHPGKKLX-OAHLLOKOSA-N 389.521 2.756 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2cc(F)cc(F)c2)C3)[nH]n1 91625642 ZWDIIQADELLZPJ-UHFFFAOYSA-N 388.418 2.651 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@@H](Cc2ccc(CO)cc2)C1 95370738 HEMXEYMMDLZIPZ-SFHVURJKSA-N 379.460 2.663 0 50 GFAA Cc1ccsc1CCNC(=O)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 426628360 XCVMKXSJARZJAL-JKSUJKDBSA-N 388.489 2.888 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3cccc(-n4cnnc4)c3)C[C@H]2N(C)C)cc1 95531117 GEHQJPKKTLAMHO-LEWJYISDSA-N 375.476 2.746 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)N(Cc1c(C)nn(C)c1C)C1CC1)CC(=O)N2 97785255 FDHMSKGIMZOGJA-QGZVFWFLSA-N 382.464 2.663 0 50 GFAA CNC(=O)c1ccc(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)cc1 237221818 IEZQXHZATSCFFZ-IRXDYDNUSA-N 395.503 2.585 0 50 GFAA COc1ccc2cc(S(=O)(=O)N[C@H]3CCCN(C(=O)C(C)C)C3)ccc2c1 824758367 YFDQHRGSIMVQCR-KRWDZBQOSA-N 390.505 2.774 0 50 GFAA COC(=O)Nc1ccc(NC(=O)C(=O)N[C@H]2C[C@@]23CCc2ccccc23)cc1 1875276044 GOSAHJFQNMIZBP-LAUBAEHRSA-N 379.416 2.576 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2Cc3c(cnn3C)N(C(=O)OC(C)(C)C)C2)cc(C)n1 1875295189 SQXSMLFMCHSRBW-MRXNPFEDSA-N 399.495 2.662 0 50 GFAA COc1cc(CNC(=O)N2CC[C@H](C)C2)ccc1CNC(=O)N1CC[C@H](C)C1 1875272648 CDPHKWZEFONLGU-HOTGVXAUSA-N 388.512 2.798 0 50 GFAA CC(C)N(Cc1cnn(C)c1)S(=O)(=O)c1cc2c(cc1Cl)CCC(=O)N2 1875253675 NYGISCDKFLXSSO-UHFFFAOYSA-N 396.900 2.558 0 50 GFAA Cc1cccc(CN(C(=O)c2nc(C)c(C)c(N3CC[C@@H](N)C3)n2)C2CC2)c1 1875398505 SZFGMHLLBVGEAU-GOSISDBHSA-N 379.508 2.744 0 50 GFAA Cc1cc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)c2ncccc2c1 952973393 ZUPHBUOYVUEUII-UHFFFAOYSA-N 399.472 2.673 0 50 GFAA Cc1ccnc(-c2noc(CC3CCN(C(=O)Cc4cncs4)CC3)n2)c1 881653285 HIWRDWGLFAWZOA-UHFFFAOYSA-N 383.477 2.920 0 50 GFAA COc1cccc(-n2cc(C(=O)Nc3ccc(-n4cncn4)c(Cl)c3)nn2)c1 1360482222 XDWGSMWLKSQLHX-UHFFFAOYSA-N 395.810 2.762 0 50 GFAA Cc1ccnc(-n2nc(C)cc2NC(=O)N[C@H]2CCCO[C@@H]2c2cnn(C)c2)c1 278361779 BAPWNHOVHFJIII-QFBILLFUSA-N 395.467 2.659 0 50 GFAA C[C@H]1c2ccccc2CCN1C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 171507164 QKOQTMDCACBKOU-INIZCTEOSA-N 399.516 2.628 0 50 GFAA O=S(=O)(c1ccc(Cl)s1)N1CCCN(CC[C@@H]2CCCO2)CC1 188970870 BQNGYOZWJBVZJJ-ZDUSSCGKSA-N 378.947 2.667 0 50 GFAA O=C(NC[C@@]1(O)CCOC1)Nc1ccnn1Cc1ccc(Cl)cc1Cl 189449004 JJURIACUVZOZCJ-INIZCTEOSA-N 385.251 2.511 0 50 GFAA C[C@]1(c2cccnc2)NC(=O)N(Cc2ccn(-c3ccc(F)cc3F)n2)C1=O 192141372 CLNGGBYTMLSFOF-LJQANCHMSA-N 383.358 2.513 0 50 GFAA Cc1ccccc1C[C@]1(CO)CCCN(C(=O)Cn2nc3ccccc3n2)C1 12030014 WAMBKMMKKOQHTQ-JOCHJYFZSA-N 378.476 2.584 0 50 GFAA CCN(Cc1ccccc1)[C@H]1CCc2c(c(C(=O)N3CCSCC3)nn2C)C1 14748929 WOMODPIMCGQYNV-SFHVURJKSA-N 398.576 2.989 0 50 GFAA CCOC(=O)[C@H]1CCCN(Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)C1 17252053 MNWJZOZMMDIQRO-LBPRGKRZSA-N 390.875 2.626 0 50 GFAA CCN1CCN(CCOc2ccccc2-c2nccn2-c2cnn(C)c2C)CC1 1857686079 GYHUPCLPYNFPIT-UHFFFAOYSA-N 394.523 2.598 0 50 GFAA Cn1c(CNC(=O)[C@@]2(C)CC23CCNCC3)nc2cc(C(F)(F)F)ccc21 1857687482 SYWVFXLBQXQIPV-QGZVFWFLSA-N 380.414 2.988 0 50 GFAA Cc1nc[nH]c1CC(=O)N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857713267 NYROTPVGUBKHAM-NRFANRHFSA-N 383.496 2.560 0 50 GFAA Cc1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cnc1C 1857720385 RGVBSSDZGNUKPP-KNKQGSTJSA-N 377.444 2.613 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H]3OC(=O)N(CCc4cccc(Cl)c4)[C@@H]3C2)n1 211228906 DBEXFJKDMWQXSS-MSOLQXFVSA-N 385.851 2.931 0 50 GFAA COCCc1cc(=O)[nH]c(-c2cccc(CN(C)Cc3c(C)n[nH]c3C)c2)n1 23232116 LEOFRTRKDTVAQE-UHFFFAOYSA-N 381.480 2.598 0 50 GFAA CC(C)C(=O)N1CCC[C@@H]1C(=O)N1CCN(Cc2ccccc2Cl)CC1 161322549 RGTXEPSDWBFQJF-GOSISDBHSA-N 377.916 2.631 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CSCCS1)C2 826753047 KQUYPTCTPUDGOG-XQLPTFJDSA-N 386.583 2.987 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](n3c(CCCCO)nc4ccccc43)C2=O)cc1 100183384 AFJCCTXJVFVHQQ-LJQANCHMSA-N 393.443 2.865 0 50 GFAA O[C@@]1(c2nc(Cc3ccno3)no2)CCc2cc(Br)ccc2C1 2325758237 GTSIHBVXVHHHAH-INIZCTEOSA-N 376.210 2.787 0 50 GFAA Cc1ccc2[nH]c(C(=O)N3CCN[C@H](Cc4ccc(F)cc4)C3)cc(=O)c2c1 2325773944 DZQLKYRBQNKVBV-QGZVFWFLSA-N 379.435 2.632 0 50 GFAA Cn1cc(CCNC(=O)c2ccc3c(c2)CC[C@H](N)C(=O)N3)c2ccc(F)cc21 2325795404 DMWLUSBKQVKTHD-SFHVURJKSA-N 394.450 2.502 0 50 GFAA CS(=O)(=O)c1cccc(-c2cn(Cc3cc4ccc(F)cc4nc3O)nn2)c1 2325860933 ZKWMCNCRURUBNL-UHFFFAOYSA-N 398.419 2.790 0 50 GFAA CC1(C)CNC(=O)[C@@H]1NC(=O)CCc1nc2ccccc2n1-c1ccccc1 912635195 IZMKDQVCNMWNQD-FQEVSTJZSA-N 376.460 2.599 0 50 GFAA COc1ccc(CCNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 626450 OYDLZTSMGBJYJX-IBGZPJMESA-N 380.444 2.675 0 50 GFAA biogenic O=C(NC[C@@H]1CCCO1)c1nc2nc(-c3ccccc3)cc(C(F)(F)F)n2n1 826514 ZQKWJJGAXDDVOV-LBPRGKRZSA-N 391.353 2.719 0 50 GFAA CS(=O)(=O)Nc1ccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1 4742445 CYZZPEWEIDROLV-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA O=C1COc2ccc(C(=O)COC(=O)c3cnc(Cl)c(Cl)c3)cc2N1 6596423 NDKCXTFQBIRVIP-UHFFFAOYSA-N 381.171 2.759 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)[C@@H]2C3CCC(CC3)[C@H]2C(=O)O)CC1 6715189 SLONXHAASRIKPK-YEYPGUGLSA-N 386.492 2.871 0 50 GFAA O=C(c1cc(Br)ccc1O)N1N=C(C(F)F)C[C@@]1(O)C(F)F 8376949 KZZLCWLDNBFCAY-GFCCVEGCSA-N 385.111 2.575 0 50 GFAA Cc1cnc(-n2ncc(C(=O)N(C)CCO)c2C(C)C)nc1-c1ccc(F)cc1 11872758 SVUMLCFMTQANCF-UHFFFAOYSA-N 397.454 2.965 0 50 GFAA CN(CCc1ccccc1)C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 11934873 BHACVWDOYIYDCK-OAQYLSRUSA-N 397.563 2.801 0 50 GFAA NC(=O)[C@@H]1CCCN(Cc2ccc3c(c2)CN(Cc2ccccc2)CCO3)C1 11970400 WCRJLQLCMSFPIL-HXUWFJFHSA-N 379.504 2.779 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)[C@H]2CC(CCc3ccccc3)=NO2)C1 12097206 QEEDTWHYYWJGSN-AZUAARDMSA-N 385.508 2.871 0 50 GFAA Cc1cc(C)n(CCCNC(=O)[C@@H]2CCCN(C3CCN(C(C)C)CC3)C2)n1 12433073 SFOVAHJREVXFEQ-HXUWFJFHSA-N 389.588 2.591 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@@H]2NC(=O)CCn1cncn1 12577709 UVDZAMIMVXCNRM-KRWDZBQOSA-N 378.480 2.992 0 50 GFAA Cc1ccc(CCNC(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)cc1 12704285 JKKIOFNINFKYIQ-OAQYLSRUSA-N 397.563 2.767 0 50 GFAA CC(C)(C)CN1CCC[C@@]2(CCN(C(=O)c3ccc(Cn4cnnn4)cc3)C2)C1 12712020 IYIDFHQLLVUUFL-JOCHJYFZSA-N 396.539 2.696 0 50 GFAA COC(=O)c1cc(-c2c(C)nn(C)c2C)nc2c(Br)c(C)nn12 13645403 LQGDACKSKYSDNN-UHFFFAOYSA-N 378.230 2.604 0 50 GFAA CCCS(=O)(=O)NCc1cccnc1N1CCN(c2ccccc2C)CC1 15063027 AWZBRQHCEHGQAH-UHFFFAOYSA-N 388.537 2.546 0 50 GFAA CNc1ncc(CN2CCC[C@H](c3nc(-c4cccs4)cc(=O)[nH]3)C2)cn1 19592386 ZSXCVAIJFUEGJR-AWEZNQCLSA-N 382.493 2.710 0 50 GFAA in-vitro CN1CCc2nc3sc(C(=O)c4ccc5c(c4)OCCO5)c(N)c3cc2C1 20000568 XUNNFURHZUBNPW-UHFFFAOYSA-N 381.457 2.869 0 50 GFAA CNC(=O)CN(C)c1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)cn1 67724949 PULTWQILKOAPRM-SFHVURJKSA-N 380.492 2.674 0 50 GFAA CN1CCCC[C@H]1CCNC(=O)c1ccc(N2CCc3ncccc3C2)nc1 67786273 AMQOXMXBBXMSGL-IBGZPJMESA-N 379.508 2.644 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)N1CCC(O)(c2ccc(Cl)cc2)CC1 71283597 ILXRXLBWKCZABL-UHFFFAOYSA-N 397.862 2.560 0 50 GFAA CC[C@H]1CN(C(=O)c2cnn3ccccc23)CCC(=O)N1Cc1ccccc1 71575192 QOUQYZBPJYWVMR-SFHVURJKSA-N 376.460 2.988 0 50 GFAA CC(C)C(=O)NCC(=O)N1CCCN(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71736037 UQOFPIYSTBKEON-IBGZPJMESA-N 377.504 2.657 0 50 GFAA COc1cc(-c2cn(Cc3csc(-c4ncccn4)n3)nn2)cc2c1OCO2 82121397 FALFZWULMFJGRV-UHFFFAOYSA-N 394.416 2.644 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)NCCc1csc(-c3cnccn3)n1)CO2 91997121 RPVDGPFORMIAIP-CQSZACIVSA-N 396.472 2.519 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@H](c3nccn3Cc3ccccn3)C2)cn1 95503860 RWYBNQXLMBTJTQ-INIZCTEOSA-N 376.464 2.699 0 50 GFAA Cc1cc(C)nc(N2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)n1 96161822 QBWZCZOZAMFDST-UHFFFAOYSA-N 378.484 2.649 0 50 GFAA O=S(=O)(CCN1CCn2nc(Cc3ccccc3)cc2C1)c1ccccc1 97360224 MYJGUWVWFCZOLH-UHFFFAOYSA-N 381.501 2.763 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cnn(CC(F)(F)F)c1 118347322 CRHMCRJYLOLKFN-MRXNPFEDSA-N 393.369 2.613 0 50 GFAA O=C(O)CCN(Cc1cccc(F)c1F)C(=O)c1ccc2c(c1)CCC(=O)N2 119069445 KYNNBVOIZNWBDK-UHFFFAOYSA-N 388.370 2.967 0 50 GFAA O=C(NCc1cccc(NC(=O)C2CCC2)c1)N[C@@H]1c2ccccc2C[C@H]1O 123560535 GNTDEOMXSAEEIX-WOJBJXKFSA-N 379.460 2.883 0 50 GFAA O=C1Nc2ccc(S(=O)(=O)Nc3nncn3-c3ccccc3)c3cccc1c23 126778068 QLGXONDAJVABDL-UHFFFAOYSA-N 391.412 2.787 0 50 GFAA Cc1nc(N2CCN(C(=O)Cc3ccc(F)cc3)CC2)cc(C(F)(F)F)n1 169772306 USDYGPLBXUHHCO-UHFFFAOYSA-N 382.361 2.834 0 50 GFAA COc1cccc(N[C@@H](CNC(=O)CS(=O)(=O)C(C)(C)C)C(C)(C)C)c1 170599097 VHVPYTFBXVWDIW-INIZCTEOSA-N 384.542 2.851 0 50 GFAA Cc1nn(-c2ccccc2)c2sc(C(=O)N3CCC[C@@H]4C(=O)NC[C@H]43)cc12 170609910 ARRRYDQWBYPUPZ-GOEBONIOSA-N 380.473 2.746 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N1CCC(OC[C@@H]2CCCCO2)CC1 175050052 KNRGJXSWRWEVQF-INIZCTEOSA-N 389.452 2.839 0 50 GFAA O=C(NCc1cccc(N2CCCS2(=O)=O)c1)N1CC[C@@H](c2ccccc2)C1 184299990 RWHCREXBKZSAKD-LJQANCHMSA-N 399.516 2.926 0 50 GFAA O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccc(F)cc2)CC1 225270221 CPXYBHKBWSXUDM-VDZJLULYSA-N 394.512 2.672 0 50 GFAA Brc1ccc(C2(c3nc(Cn4cncn4)no3)CCOCC2)cc1 225551403 WRBZRQFSGHFZNK-UHFFFAOYSA-N 390.241 2.568 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N[C@@H](C(=O)O)c3ccccc3)cc2)C[C@@H](C)O1 237416285 HGGONKLSTKVCMH-JXXFODFXSA-N 382.460 2.852 0 50 GFAA COC(=O)[C@@H]1[C@@H](c2ccccc2)[C@H](C(=O)N2CCN(C)CC2)[C@H]1c1ccccc1 245377161 HZUPVYCEFDDLAF-COPRSSIGSA-N 392.499 2.747 0 50 GFAA O=C([C@H]1COc2ccccc2O1)N1CCC(N2CCc3ccccc3C2)CC1 299303541 AFWUTBDJVVJBIX-JOCHJYFZSA-N 378.472 2.876 0 50 GFAA CC[C@@H](C)n1nccc1NC(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 299782424 HEYKOSNJHVXHIJ-OAHLLOKOSA-N 385.468 2.933 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N1CCC(OC[C@@H]2CCOC2)CC1 363744329 BKGHSUVOFCVWSD-GOSISDBHSA-N 384.480 2.981 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3ccc(CS(C)(=O)=O)cc3)c2)n1C 378214989 PKJUWRXRFMTQHW-UHFFFAOYSA-N 384.461 2.587 0 50 GFAA CC(C)NC(=O)Nc1cccc(C(=O)N[C@H](c2ccccc2)c2nc[nH]n2)c1 378528460 IRMMNBSNNIDJSX-QGZVFWFLSA-N 378.436 2.854 0 50 GFAA Cc1noc(C)c1CSc1nnc(C2CCNCC2)n1C[C@H]1CCCO1 426478147 RHDMEFRIAZGUFK-OAHLLOKOSA-N 377.514 2.821 0 50 GFAA C[C@H]1CN(S(=O)(=O)Cc2cccc(S(C)(=O)=O)c2)[C@@H]1c1ccccc1 451285367 QTRXTOLKRYRSAV-KSSFIOAISA-N 379.503 2.613 0 50 GFAA COc1ccc2[nH]cc(CCNC(=O)c3ccccc3N3CCOCC3)c2c1 733172698 FHBILCLNLWDGIV-UHFFFAOYSA-N 379.460 2.986 0 50 GFAA C[C@H](NC(=O)N1CC(O)(c2cccc(Br)c2)C1)c1cncc(F)c1 856883812 ODEJQYBBTVMJRT-NSHDSACASA-N 394.244 2.957 0 50 GFAA CCCc1ncc(CNC(=O)N2CC(O)(c3cccc(Br)c3)C2)o1 856912775 RWJBBLCSVOIZAB-UHFFFAOYSA-N 394.269 2.803 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)cc1 1468981265 SDONRLWCCFDFPX-DOTOQJQBSA-N 385.464 2.893 0 50 GFAA Cc1ccc([C@@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)cc1F 1506416140 IJLZQGKKLIJPAG-IBGZPJMESA-N 385.439 2.683 0 50 GFAA CN(CC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)C1CCC1)C2)Cc1ccc(F)cc1 1565527326 DZDGKZOEJVYBFU-XLIONFOSSA-N 387.499 2.507 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(CCCc2ccccc2)C3)c(O)n1 1565529117 SKBSANRJDDGFSO-MOPGFXCFSA-N 380.492 2.660 0 50 GFAA COc1ccc(-c2onc(NC[C@H]3CC4(CCNCC4)CO3)c2C(=O)O)cc1 1704336491 WXGMVXHMXYDGSB-OAHLLOKOSA-N 387.436 2.619 0 50 GFAA C[C@@H]1CN(Cc2ccc(Sc3nncn3C)o2)CCN1c1ccc(F)cn1 1857680907 QXACDLKPWOHIPW-CYBMUJFWSA-N 388.472 2.804 0 50 GFAA CCCc1ccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)NCC)C[C@]34CC[C@H]2O4)cc1 1857725635 GSTPBVBLWWADAD-JZJXAQOMSA-N 385.508 2.578 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4cccc5ccccc45)[C@@H]2CC(=O)N13 1857731821 PWYCFGSRZXHVIJ-MZKRTTBSSA-N 378.472 2.967 0 50 GFAA O=S(=O)(NC1CCCCC1)N1CCN(Cc2cncc3ccccc23)CC1 1875255632 WDNOMRVSSFYHFH-UHFFFAOYSA-N 388.537 2.520 0 50 GFAA O=C(O)C[C@@H]1CCN(C(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)C1 1875277208 DMFVLNZFNOWHIM-LPHOPBHVSA-N 380.444 2.871 0 50 GFAA O=C(C[C@H]1COc2ccccc2O1)NS(=O)(=O)Cc1ccc(Cl)c(F)c1 1875289486 VWNCQRXYRJTKPU-LBPRGKRZSA-N 399.827 2.655 0 50 GFAA C[C@@H](CC(=O)N1CC[C@@](O)(CNC(=O)CC2(C)CC2)C1)c1cccc(F)c1 1875305024 CLURAUQKXHMIJU-YCRPNKLZSA-N 376.472 2.589 0 50 GFAA O=C(c1cc(C(F)(F)F)nn1C1CC1)N1CCC[C@H](N2CCCCC2=O)C1 1875307013 UCNNGRDSKANKCT-ZDUSSCGKSA-N 384.402 2.854 0 50 GFAA O=C(Cn1cc(-c2ccccc2)c(I)n1)N1CCCC1 1875340091 KSQNSZGZEQENEN-UHFFFAOYSA-N 381.217 2.777 0 50 GFAA O=C(c1cnc2c(=O)[nH]ccc2c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2 2325773410 VCFIKEUAQQPWQB-ROUUACIJSA-N 375.428 2.578 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CC[C@H](c2ccon2)C1 2325774507 QOCGOXZLUYGJAK-MEDUHNTESA-N 392.818 2.772 0 50 GFAA CCC(CC)CN1C[C@@H](CC(=O)NC2(c3cncn3C)CC2)OCC12CCC2 2325785374 TXDZHJMYNZFCKD-GOSISDBHSA-N 388.556 2.975 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)C1 2325889262 HVZRFVWXNUGMCN-QRWLVFNGSA-N 376.884 2.575 0 50 GFAA Cc1nn(C(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)c(C)c1Br 827996 ZPKBAFZZJJOWFU-SNVBAGLBSA-N 376.210 2.587 0 50 GFAA CCCN1C(=O)c2ccc(-c3nc4cc(OC)c(OC)cc4c(=O)o3)cc2C1=O 1144175 GJYQLMNGAJCXPS-UHFFFAOYSA-N 394.383 2.878 0 50 GFAA COC(=O)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCc2ccccc2)cc1 1160141 GQKWTLXBJGVDQW-SFHVURJKSA-N 380.400 2.845 0 50 GFAA O=C(CN1C(=O)COc2ccccc21)N1CCc2cc(Br)ccc21 8391253 NAGXVRNMOXZJDM-UHFFFAOYSA-N 387.233 2.764 0 50 GFAA CN1CCC(N2CCN(C/C(Cl)=C/c3ccccc3)C[C@H]2CCO)CC1 105276482 WGZAFJFJUYKEML-OHUBLEDJSA-N 377.960 2.729 0 50 GFAA Cc1nc(C)c(C(=O)N2CCN(c3ccc(Nc4ccncc4)nn3)CC2)s1 67604499 ZUPVCBRHKWOJQX-UHFFFAOYSA-N 395.492 2.651 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(-c2nc(CC(=O)Nc3ccccc3)no2)c1C 136370013 VJVVTWTXKAHJKS-UHFFFAOYSA-N 385.445 2.938 0 50 GFAA O=C(c1cccc(O)c1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 67771863 LRZNNZHJITUQNJ-ZWKOTPCHSA-N 386.835 2.934 0 50 GFAA OCC[C@H]1CN(Cc2cccc(-n3cccn3)c2)CCN1Cc1ccccc1 20997218 CBEJDQANZKCNQB-QHCPKHFHSA-N 376.504 2.941 0 50 GFAA CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)C(=O)Nc1ccccc1N1CCCCCC1 121844027 JJDDNUKJIZUXGE-IPELMVKDSA-N 385.508 2.935 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)cc1 67621024 AJSVYDDYZARHOY-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3ccc(C(F)(F)F)nc3O)CC2)nc1 67446711 LHIGMNUETCXDJZ-UHFFFAOYSA-N 381.354 2.633 0 50 GFAA NC(=O)c1ccc(-c2nc3c([nH]2)CCN(c2noc(-c4ccccc4)n2)C3)cc1 219518325 BOCAIDGXFWMRFO-UHFFFAOYSA-N 386.415 2.788 0 50 GFAA CCn1ncc(-n2c(S)nnc2Cn2nc(C)c(Br)c2C)c1C 8339753 NPCDRONCWOWTKA-UHFFFAOYSA-N 396.318 2.705 0 50 GFAA COc1ccc2cc(NC(=O)N3CCCN(Cc4nccn4C)CC3)ccc2n1 365390906 LKVZAMCGNFMFCB-UHFFFAOYSA-N 394.479 2.717 0 50 GFAA CN1Cc2ccccc2C[C@H]1CNc1nc(-c2ccncc2)nc2c1cnn2C 72418891 WLBZRUWFJYVVOD-SFHVURJKSA-N 385.475 2.894 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cccc(Cl)c1Cl 129473148 PRCFWKNLTYCDAA-JTQLQIEISA-N 391.280 2.545 0 50 GFAA CCS(=O)(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H]1CCCc2ccccc21 239403188 RPEMJERXWCIMSU-LEWJYISDSA-N 398.528 2.957 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC(c2ccnc(-c3ccccc3)n2)CC1 14981143 OERJHHCZAFZADL-FQEVSTJZSA-N 378.476 2.861 0 50 GFAA COc1ccc(N2CCN(Cc3ccccc3Cn3cccn3)CC2=O)cc1 82120946 NJYKMPWAQUSZGX-UHFFFAOYSA-N 376.460 2.789 0 50 GFAA Cn1nc(-c2cccs2)cc1C(=O)N[C@H]1CCCN(Cc2cccnc2)C1 220318360 XPZLMRLXLGDIJP-INIZCTEOSA-N 381.505 2.938 0 50 GFAA C[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)C1 229711734 DKEYPSKULQUOPY-CVEARBPZSA-N 389.562 2.542 0 50 GFAA O=C(O)c1ccc(CNC(=O)N2CCC([C@@H](O)Cc3ccccc3)CC2)cc1 426701592 KLLCZZIFNGBRTB-FQEVSTJZSA-N 382.460 2.910 0 50 GFAA Nc1ccnc(-c2ccc(C(=O)N3CCC[C@@H](C(=O)N4CCCC4)C3)cc2)c1 426537839 ZGWREBIXGVNANR-GOSISDBHSA-N 378.476 2.805 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3cccc(N4CCOCC4)c3)C2)N1CC1CCC1 95355300 BDCBARMOEQNKHB-RBBKRZOGSA-N 383.536 2.746 0 50 GFAA O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)Oc1cccc2cccnc12 239121238 JNZQRBWGCFZPOE-BVBVUKCESA-N 388.423 2.583 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@H](Cc2ccc(CO)cc2)C1 95370737 HEMXEYMMDLZIPZ-GOSISDBHSA-N 379.460 2.663 0 50 GFAA CCN1CC[C@]2(CCC1=O)CN(C(=O)c1csc3c1CCCC3)CCN2C 95503656 SGKGJDPHFAKQRN-OAQYLSRUSA-N 389.565 2.786 0 50 GFAA CCOc1ccccc1N1C[C@@H](C(=O)Nc2nncn2-c2ccccc2)CC1=O 181122181 UKLPIYVXATWTEX-HNNXBMFYSA-N 391.431 2.658 0 50 GFAA CCc1cc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)no1 95385386 MLAXDNDLYUDNNQ-ZLGUVYLKSA-N 395.459 2.668 0 50 GFAA CC(C)(C)C(=O)COC(=O)c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 239174164 PKAUUKDVIYWDQE-RPLLJCPNSA-N 381.428 2.770 0 50 GFAA CN1CCN(Cc2cc(Cl)ccc2OC[C@H](O)CN2CCCCCC2)CC1 95524539 TZYHKZUQMDNJAH-HXUWFJFHSA-N 395.975 2.703 0 50 GFAA Cc1[nH]c2c(CN3CC[C@H](N4CCN(C)CC4)[C@H](CCCO)C3)cccc2c1C 91845832 GYEXNEWWZYIACY-OFNKIYASSA-N 398.595 2.995 0 50 GFAA COC(=O)c1cc2c(Cl)nc(Cl)nc2n1S(=O)(=O)c1ccccc1 242614850 PKHCQAGHQIACFK-UHFFFAOYSA-N 386.216 2.762 0 50 GFAA COc1ccc(CNC(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)cc1C(=O)O 299748714 HYGYHYWPPUBTTB-RHSMWYFYSA-N 396.443 2.619 0 50 GFAA Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N1CCC[C@H]1C(=O)O 299741081 CPTKLDHZBKLIGU-AWEZNQCLSA-N 396.369 2.521 0 50 GFAA CCOc1ccc(-c2csc3ncn([C@@H](C)c4nc(N)n[nH]4)c(=O)c23)cc1 584889579 IVZZFDCEIHHHIT-JTQLQIEISA-N 382.449 2.833 0 50 GFAA C[C@H](Cc1ccc(F)cc1Cl)N[C@@H]1C[C@@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875311541 DUCROZJLHMDVIS-GWIYSAMLSA-N 395.862 2.734 0 50 GFAA CCCc1cc(C(=O)N[C@@H]2CCN(c3ncnc(CC)c3F)C[C@@H]2CC)n[nH]1 1875334108 YHIUTHXQBSFVCN-XJKSGUPXSA-N 388.491 2.889 0 50 GFAA FC1(F)CC(Cc2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)C1 952893798 KHQLAFMLNYAAHG-GFCCVEGCSA-N 379.411 2.873 0 50 GFAA CCNc1nc(C)c(C(=O)NCCN2N=C(c3ccccc3)CCC2=O)s1 952969173 PPVYFFAIINGKOD-UHFFFAOYSA-N 385.493 2.640 0 50 GFAA O=C(N[C@H]1CCCN(C(=O)c2cccs2)C1)c1ccccc1N1CCOCC1 952981247 LFCWZXPDTQGWKT-INIZCTEOSA-N 399.516 2.619 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H](CNc3ncccn3)C3(CCOCC3)C2)cc1F 888103543 LOJXGFCVLFKVRM-QGZVFWFLSA-N 384.455 2.905 0 50 GFAA OCCN1CCN(Cc2csc(-c3ccc(Br)cc3)n2)CC1 302835052 ZWMRVAIQEUITFT-UHFFFAOYSA-N 382.327 2.683 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 192145071 WMALQYKDBDMBAN-HNNXBMFYSA-N 375.856 2.899 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NC[C@H](CO)Cc2ccco2)s1 1506417169 LHFCZRQMWPPXJD-CYBMUJFWSA-N 396.490 2.742 0 50 GFAA C[C@@H](C(=O)N1CCN(c2cccc(Cl)c2)CC1)n1cnc2ccccc2c1=O 5272265 LNERNDYXBKGBTC-HNNXBMFYSA-N 396.878 2.960 0 50 GFAA CN(C)CC(=O)N(C)C[C@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1 11958739 XUROOCWVTHWYTL-QGZVFWFLSA-N 385.474 2.980 0 50 GFAA O=C(CCC1CCN(Cc2nc3c(s2)CCCC3)CC1)N1CCOCC1 12076022 OCXYFOJSYPASEE-UHFFFAOYSA-N 377.554 2.873 0 50 GFAA Cc1ccc2[nH]c(C3CCN(C(=O)[C@H]4CCC(=O)N(C5CC5)C4)CC3)nc2c1 12306724 QKWRZMAYTYMTFV-INIZCTEOSA-N 380.492 2.978 0 50 GFAA C[C@H](NC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1)c1ccncn1 15065392 UXCGQAXHPAOCSR-NSHDSACASA-N 376.342 2.626 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)Cc4cccc(Cl)c4)CC3)nn2)n1 169780426 VSAMFPRZXNUUFR-UHFFFAOYSA-N 386.843 2.696 0 50 GFAA Cc1nc(-c2cn([C@@H]3CCCN(C(=O)c4cc5ccccc5[nH]4)C3)nn2)no1 169780960 BGUHVHCJDNAWDG-CQSZACIVSA-N 377.408 2.595 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2CC[C@@]34OCCN3C(=O)C[C@@H]24)cc1F 1857715994 RDAGQRIWGPUPQP-OFNKIYASSA-N 394.446 2.898 0 50 GFAA Cc1nc(N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)c2cnn(C)c2n1 1857717077 LWZWAIVYMSPHMO-IEBWSBKVSA-N 393.491 2.923 0 50 GFAA CCCC(CCC)C(=O)NC[C@H]1[C@H]2CN(c3noc(C)n3)C[C@]23CC[C@H]1O3 1857722445 IDGRPUBGYHNYBN-TVKQPGBESA-N 376.501 2.694 0 50 GFAA COCCN(C(=O)N=c1cc(Br)n(C)[nH]1)[C@@H](C)c1ccccc1 2325731987 LDPLXRMPLNKDTI-LBPRGKRZSA-N 381.274 2.846 0 50 GFAA C[C@H](CCNC(=O)c1ccc(-c2nc(=O)o[nH]2)s1)N(C)Cc1ccccc1 2325821852 GGPSLYQPNMPBCE-CYBMUJFWSA-N 386.477 2.732 0 50 GFAA Cn1ncc(Br)c1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 20046092 RWENHIVQRBOVEX-VMPITWQZSA-N 389.297 2.654 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)N1CCC[C@]2(CCc3c[nH]nc32)C1 2356158276 GVBYZEWUAJAFAA-FQEVSTJZSA-N 381.436 2.882 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)cs1 6681555 QQJXAYPHLYYTRI-UHFFFAOYSA-N 375.269 2.671 0 50 GFAA Cc1oc2ncn(CC(C)C)c(=O)c2c1C(=O)NCCCN1CCC(C)CC1 8596592 GKKYDOXJIILKRN-UHFFFAOYSA-N 388.512 2.806 0 50 GFAA O=C(NCCCOc1ccc2[nH]c(=O)ccc2c1)N(C1CC1)[C@@H]1CCCC[C@H]1O 1894982 ULGNGSQNNMKROG-WOJBJXKFSA-N 399.491 2.775 0 50 GFAA investigational CCOC(=O)c1sc(NC(=O)CSc2nc(SC)ns2)nc1C 10059012 FIQKRXHUYLHDRK-UHFFFAOYSA-N 390.537 2.932 0 50 GFAA COCCN1CCCN(C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)CC1=O 252494647 OAUUFOJPVPGBCX-UHFFFAOYSA-N 399.495 2.510 0 50 GFAA COCc1nc2n(n1)C[C@@H](NCc1c(-c3ccccc3)nc3ccccn13)CC2 124695467 YQXMQKFKJNWXSX-KRWDZBQOSA-N 388.475 2.844 0 50 GFAA O=C([C@H]1CCCN(C2CCN(c3cnc4ccccc4n3)CC2)C1)N1CCCC1 71746697 UFJDCRJRFOXNMJ-SFHVURJKSA-N 393.535 2.933 0 50 GFAA COc1cccc(C[C@H]2CN(C(=O)c3ccc(Cn4ccnc4)o3)CCO2)c1 71761955 QBRZRZPELPBWTE-IBGZPJMESA-N 381.432 2.617 0 50 GFAA CN(C)C(=O)c1cc(NC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)ccn1 363247874 WSUNFTUGPAFGOK-GOSISDBHSA-N 395.507 2.817 0 50 GFAA O=C(/C=C/c1ccc(S(=O)(=O)NC2CC2)cc1)N1CC2(CCC2)[C@@H]1C1CC1 366337416 WBNJBRQWBZGYIV-FZBXERKRSA-N 386.517 2.932 0 50 GFAA O=C(O)CCN(Cc1cccc(F)c1F)C(=O)[C@@H]1CC(=O)Nc2ccccc21 238146328 JGOUZFDTVSTMBP-CQSZACIVSA-N 388.370 2.894 0 50 GFAA CCN1CCC[C@@H]1CN1Cc2ccc(C(=O)NCc3nccs3)cc2C1=O 72448119 QSSLQQJKQPBOSF-MRXNPFEDSA-N 384.505 2.513 0 50 GFAA CN(C[C@@H](c1cccs1)N1CCOCC1)C(=O)c1cc(F)cc2[nH]cnc12 176544590 UGMAAIJNDCVIFP-INIZCTEOSA-N 388.468 2.909 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)N(C)C[C@@H]2CCCC[C@@H]2O)C1 245973602 OIDNBQZLAYUGRP-AOIWGVFYSA-N 375.513 2.714 0 50 GFAA CN(CC1CCN(CCO)CC1)C(=O)c1cccc(-c2ccc(CO)cc2)c1 426445633 PJVPMYCEBZXARY-UHFFFAOYSA-N 382.504 2.622 0 50 GFAA Cc1cc(C)c(NS(=O)(=O)c2cn(C)nc2C(F)(F)F)c(C(=O)O)c1 295960760 MRKQAUFYCMTQAL-UHFFFAOYSA-N 377.344 2.555 0 50 GFAA CCc1cccc(OCCCN(C)C(=O)[C@H]2CCCN(C(=O)N(C)C)C2)c1 95385021 ZFPGULUPXOPUDI-SFHVURJKSA-N 375.513 2.870 0 50 GFAA Cc1ccc(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)cc1Cl 91504842 WOAYDRAQSJCSKN-MJGOQNOKSA-N 380.916 2.584 0 50 GFAA CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 181175670 DOVOOSANLPYDPP-SFHVURJKSA-N 386.473 2.651 0 50 GFAA CN1Cc2ccccc2C[C@@H]1CNC(=O)Nc1ccc(N2CCCC2=O)cc1 96180225 YRGHEKDLHMCJEN-HXUWFJFHSA-N 378.476 2.992 0 50 GFAA COC[C@@H](c1ccccn1)N(C)C(=O)Nc1ccc(Cc2nc(C)n[nH]2)cc1 96136343 KLZGGAFSIXWBFY-SFHVURJKSA-N 380.452 2.950 0 50 GFAA Cc1nc(CCNC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)sc1Cl 96139248 UKDVAIUVEBPYQX-UHFFFAOYSA-N 379.873 2.660 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccc1)C2 95355233 HZJLKKGVCZSYOQ-PKOBYXMFSA-N 380.492 2.722 0 50 GFAA CC(C)c1nccn1[C@H](C)C(=O)N1CCC2(CC1)Nc1ccccc1NC2=O 91304567 ZJJQKYBYAXVWBG-OAHLLOKOSA-N 381.480 2.993 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCN(C(=O)c4ccc[nH]4)CC3)cc2nc1C 95526874 DEWZQCYHZJPAOW-UHFFFAOYSA-N 378.436 2.565 0 50 GFAA O=C(O)C[C@H](NC(=O)CN1C(=O)CSc2ccccc21)c1ccc(F)cc1 299749061 JAMUTJUPUHDIDO-AWEZNQCLSA-N 388.420 2.597 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)c1ccc2nnc(-c3cccn3C)n2c1 1940197184 XVGUBQDAYNRVPL-UHFFFAOYSA-N 389.463 2.609 0 50 GFAA CCCOc1ccc(CCNC(=O)N2CCC[C@@]3(CCNC3)C2)cc1OC 822983411 HLQISHVBXCEAGK-NRFANRHFSA-N 375.513 2.812 0 50 GFAA COc1ccc(OC)c([C@@H](O)[C@H](C)NC(=O)C23CCC(OC)(CC2)CC3)c1 1875271771 LMECSZZUKWSQPO-FBIORPFZSA-N 377.481 2.981 0 50 GFAA CON(C)C(=O)[C@H](C)NC(=O)C1(Sc2ccc(Br)cc2)CC1 1875345557 BKXWPHDNZFKPIX-JTQLQIEISA-N 387.299 2.598 0 50 GFAA O=C(O)[C@H](c1ccc(Cl)c(F)c1)N1CCC2(CCS(=O)(=O)CC2)C1 1875304545 NITFWIMOFKUFKB-AWEZNQCLSA-N 375.849 2.506 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)Cn3ccnc3-c3ccccc3)CC2)nc1 952868655 QYFRRPQVCSNPMI-UHFFFAOYSA-N 376.460 2.764 0 50 GFAA O=C(CCNc1nc2ccccc2cc1CO)N1CCOc2ccccc2C1 169991141 XFYZHSDIFVKDPS-UHFFFAOYSA-N 377.444 2.950 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C)CC1 186638132 UTEGLOXZSLGFCL-CQSZACIVSA-N 382.888 2.813 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)NS(=O)(=O)Cc1ccccc1Cl 170656506 DICFLZCRIVYNQJ-KRWDZBQOSA-N 379.865 2.990 0 50 GFAA COc1ccc(S(=O)(=O)N2C[C@@H](CO)[C@H](c3ccsc3)C2)c(C)c1F 188874469 DVFCDUNCYMRWGB-KBPBESRZSA-N 385.482 2.601 0 50 GFAA Cc1csc([C@@H]2CN(C(=O)NCc3cccc(Cn4ccnc4)c3)CCO2)n1 194066771 XUKIBRAJVFZJQG-SFHVURJKSA-N 397.504 2.979 0 50 GFAA CCOc1ccc(S(=O)(=O)NC[C@H](C)N2CCCCC2=O)c2ccccc12 194597968 GYNZNFXXTZZSFF-HNNXBMFYSA-N 390.505 2.918 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N3CCC[C@H](c4cc[nH]n4)C3)o2)c1C 1506406902 HHHWQIDPUGWIMN-ZDUSSCGKSA-N 376.438 2.843 0 50 GFAA CN(Cc1cccc2cnccc12)C(=O)[C@H]1CC(=O)N(c2cccc(O)c2)C1 1506399477 GMTMNFIMIQWPFP-KRWDZBQOSA-N 375.428 2.952 0 50 GFAA CCCOc1ccc(C(=O)N2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)cc1Cl 1704353586 FZXOBDPIHQLWHS-RHSMWYFYSA-N 377.872 2.836 0 50 GFAA COC(=O)[C@@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1)C(C)C 1772718253 UXDICGDLIWRWJZ-RBUKOAKNSA-N 398.459 2.968 0 50 GFAA CC(=O)N1CC[C@@]2(C1)Cn1c(nnc1-c1csc(-c3ccccc3)n1)CO2 1772710146 OTGXAWYYTGRRNU-LJQANCHMSA-N 381.461 2.590 0 50 GFAA O=C1CN(C(=O)COc2ccc(Cl)c(Cl)c2)C[C@H](Cc2ccccc2)N1 1772710880 SWWWYFKAQFCARG-AWEZNQCLSA-N 393.270 2.942 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(OC)cc3OC)n2)cc1 5388842 SWGCIGQMSKPQJQ-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)N[C@H]1CCCN(c2ncccn2)C1 11814134 NLKFDDWPOVLEAY-INIZCTEOSA-N 379.489 2.928 0 50 GFAA Cc1nc(N2CCCCCCC2)ncc1[C@H](C)NC(=O)CCCn1cncn1 12466127 SIBGGMJSNXHLIV-INIZCTEOSA-N 385.516 2.805 0 50 GFAA O=C(c1c[nH]c2c(F)cccc2c1=O)N(Cc1ccccn1)C[C@@H]1CCCO1 19663927 WHSYUPTXADXLTB-HNNXBMFYSA-N 381.407 2.884 0 50 GFAA COc1ccc(CNC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCCC4)cc1 169778353 GWLHUYYSDKQNPF-UHFFFAOYSA-N 394.475 2.558 0 50 GFAA COC[C@H](NC(=O)C1CCN(c2nc3nc(C)ccc3o2)CC1)c1ccccn1 1857701615 RLQCPTPHEIXFPR-KRWDZBQOSA-N 395.463 2.647 0 50 GFAA Cc1nc(CN2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)cn1C 1857715638 ATSVOSDXQVZLFT-JOCHJYFZSA-N 390.491 2.766 0 50 GFAA O=S(=O)(c1cnn([C@@H]2CCOC2)c1)N1CCC[C@H]1C[C@H]1C[C@H]2CC[C@H]1C2 333437848 JCRJNAFIELAJKM-IECFSIQFSA-N 379.526 2.824 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccc2)c(O)c1 247823550 DVZHWUMJABLGNN-SJORKVTESA-N 380.444 2.664 0 50 GFAA C[C@@H]1CN(C(=O)Cn2cc(NC(=O)NC(C)(C)c3ccccc3)cn2)C[C@@H](C)O1 363311462 XHRAOGOZBCFRMP-HZPDHXFCSA-N 399.495 2.576 0 50 GFAA CC1(C)C[C@@H](C(=O)N2CCC(O)(c3cc[nH]n3)CC2)CN1Cc1ccccc1 2325807856 YJLYDLAPCPGVAJ-GOSISDBHSA-N 382.508 2.520 0 50 GFAA CC[C@]1(NC(=O)c2cc3c(C)cc(Br)cc3[nH]2)CCC(=O)NC1=O 2325898889 BWLYJURGSRTNCW-KRWDZBQOSA-N 392.253 2.554 0 50 GFAA Nc1nc(CN2CCN(Cc3nc4cc(F)ccc4o3)CC2)nc2ccccc12 132615704 PHASNHOXMULDEU-UHFFFAOYSA-N 392.438 2.810 0 50 GFAA COc1cccc(S(=O)(=O)NCc2ccc(C(=O)Nc3cccnc3)cc2)c1 630860 RITASYQGCCWSGR-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA O=C(Nc1ccccc1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 805473 DTAIZJQSVBKFLE-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA Cc1cc2c(=O)n(NC(=O)[C@H](C)n3nc(C(F)(F)F)cc3C)c(C)nc2s1 2776950 VOKZUWBWFKHVLF-VIFPVBQESA-N 399.398 2.930 0 50 GFAA CCn1c(SCC(=O)Nc2nnc(C3CC3)s2)nnc1-c1ccncc1 4993482 GZEMGYMFNIFIRH-UHFFFAOYSA-N 387.494 2.820 0 50 GFAA COCCCn1c(C(=O)N2CCC[C@H](C)C2)cc2c(=O)n3ccccc3nc21 5270832 WZVWCTBTKNORRG-HNNXBMFYSA-N 382.464 2.558 0 50 GFAA CN(c1ccccc1)S(=O)(=O)c1nnc(NC(=O)c2cccs2)s1 6818282 AWISRXIETPJQLZ-UHFFFAOYSA-N 380.476 2.677 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNC3C4CC5CC(C4)CC3C5)C2=O)c1 11839239 HCTMHOIROZSZSR-XVSOBFGFSA-N 398.547 2.963 0 50 GFAA Cc1c(C(=O)NC(C)(C)CO)sc2ncnc(NCCc3ccccn3)c12 12218310 LOOKTORNYHCACE-UHFFFAOYSA-N 385.493 2.550 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)CCC(=O)OC 12298313 QKQCSTHCDPZSBO-IBGZPJMESA-N 390.524 2.751 0 50 GFAA COc1cccc(CN2C[C@@H](C(=O)N(C)CCC3CCOCC3)CCC2=O)c1 12438710 OFWHTUTVTAXRFZ-IBGZPJMESA-N 388.508 2.709 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCOCC2)c2c1CC[C@@H](NCc1ccccc1)C2 14539143 ARSPNFJMLSKTKM-LJQANCHMSA-N 396.535 2.659 0 50 GFAA CC(C)Cc1cc(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccc(F)cc2)n[nH]1 20119266 QTETUCKKAWIBHH-VQTJNVASSA-N 386.471 2.995 0 50 GFAA C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@@H]1CCN1CCCC1=O 20861168 CRWJBJOYWYRKSA-HZPDHXFCSA-N 388.464 2.576 0 50 GFAA CCc1ccc(CN2CCN(CC(=O)Nc3cccc4nonc34)CC2)cc1 22752075 PDLVPNNKCFHGJL-UHFFFAOYSA-N 379.464 2.542 0 50 GFAA Cc1csc(NC(=O)C2CCN(c3ccc4nnc(C(C)C)n4n3)CC2)n1 32072627 OQZZLASBDYINTQ-UHFFFAOYSA-N 385.497 2.868 0 50 GFAA CC(C)CCn1c(CN(C)Cc2ccncn2)cnc1S(=O)(=O)C(C)C 55042114 WWJMNLNBGKOBJY-UHFFFAOYSA-N 379.530 2.533 0 50 GFAA CN(Cc1ccc(C(=O)NCc2cccnc2)cc1)S(=O)(=O)c1ccccc1 65363735 IOPFKIODDDJDIL-UHFFFAOYSA-N 395.484 2.832 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)CCNC(N)=O)C2 67714403 HBGLMLJAUUVVOT-UHFFFAOYSA-N 389.477 2.512 0 50 GFAA CC[C@H]1CN(C(=O)c2coc(COc3ccc4sc(C)nc4c3)n2)CCN1 67867337 CGGMKKINTCVQMC-ZDUSSCGKSA-N 386.477 2.996 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N[C@H]2CCCNC2)Cc2ccccc2C1 72142202 VJIMRJMOCTVSKW-QFIPXVFZSA-N 377.532 2.567 0 50 GFAA O=C(O)c1ccc(C[C@H]2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)cc1 72433078 HIVRKAAZLLXKSV-OAHLLOKOSA-N 376.412 2.931 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccnc(OC)c3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95374314 ZTKCUZLNSRCRDE-KSEOMHKRSA-N 393.487 2.801 0 50 GFAA c1ccc(OCc2nc([C@H]3CCNC3)n(-c3ccc4c(c3)OCCO4)n2)cc1 96141770 RPQRSVFSPSAANA-HNNXBMFYSA-N 378.432 2.694 0 50 GFAA NC(=O)c1ccc(C(=O)N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cn1 122314247 OICAZPXPVWRWEN-SNVBAGLBSA-N 384.383 2.676 0 50 GFAA COc1ccc([C@@H](O)CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1 134125626 WXAKFKOVVWPKJM-UXHICEINSA-N 382.460 2.540 0 50 GFAA COc1ccc([C@@H]2CC(c3cc(OC)cc(OC)c3)=NN2S(C)(=O)=O)cc1 170615376 UUSDPFNSYWKANR-IBGZPJMESA-N 390.461 2.823 0 50 GFAA CO[C@@H](C)c1noc(CN2CCCN(Cc3nc4c(F)cccc4[nH]3)CC2)n1 177464569 SQULKJDGRFRNEC-ZDUSSCGKSA-N 388.447 2.500 0 50 GFAA C[C@@H]1CN(C2CCN(C(=O)Nc3ncn(C4CCCCC4)n3)CC2)CCO1 184550188 OAFVUZLLXVQDNL-OAHLLOKOSA-N 376.505 2.500 0 50 GFAA O[C@H](CN1CCN(Cc2nc(-c3cccs3)no2)CC1)C1CCCCC1 190371086 CCYOVAPJFPFIMX-MRXNPFEDSA-N 376.526 2.857 0 50 GFAA C[C@H](C(=O)NCCc1noc(-c2ccccc2)n1)n1c(=O)oc2ccccc21 221431130 RFNGUSGSKLUCKW-CYBMUJFWSA-N 378.388 2.564 0 50 GFAA CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)NC[C@@H](CO)CC1CCCC1 225622535 XBUZBVZKFHENKQ-LPHOPBHVSA-N 378.488 2.885 0 50 GFAA COc1cccc(Cl)c1CNC(=O)N1CCO[C@](C)(c2cnn(C)c2)C1 239667645 BQZIJIPPJGRNMG-SFHVURJKSA-N 378.860 2.539 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCCN2C(=O)c2ccncc2)c1)c1ccncc1 252504540 VJYFODHCOMZRDU-LJQANCHMSA-N 390.447 2.620 0 50 GFAA Cn1cc(C(=O)C[C@H]2CCCN2C(=O)[C@H]2CCCN2Cc2ccccc2)cn1 269403685 DKUAXRBKBIIHFI-WOJBJXKFSA-N 380.492 2.649 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CC[C@@H](n2cc(Cl)cn2)C1 291000427 QZLLQULRBFNNEF-QZTJIDSGSA-N 386.883 2.544 0 50 GFAA Cc1cc(N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)nc(-c2cccnc2)n1 299715132 WVUTUABPVZWQEO-RTBURBONSA-N 380.540 2.842 0 50 GFAA CCN1CCN(Cc2nc([C@H]3C[C@@H](c4ccccc4)N4CCC[C@H]34)no2)CC1 299756546 GUKBRZYGVVUYMA-ZCNNSNEGSA-N 381.524 2.900 0 50 GFAA Cc1noc([C@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(C3CCCCC3)cc2)n1 328633083 SKGOELBEDXSAEJ-FUHWJXTLSA-N 391.493 2.922 0 50 GFAA Cc1c(NC(=O)N2CC[C@H]3OCCN(C)[C@@H]3C2)cccc1OCC(F)(F)F 332614766 QNRNFUGFCJAXSO-GDBMZVCRSA-N 387.402 2.873 0 50 GFAA Cc1noc(-c2ccc(N3CCN(C(=O)c4ccc(F)cc4F)CC3)nc2)n1 364885497 KREHDISXGBOZPA-UHFFFAOYSA-N 385.374 2.681 0 50 GFAA C[C@@H]1CN(c2ncc(Cn3cc(Br)cn3)s2)C[C@]2(CCOC2)O1 366487941 DQUJSGKGFCEMDF-ABAIWWIYSA-N 399.314 2.535 0 50 GFAA CN(C)CCOc1ccccc1C(=O)N1CC[C@@H](c2ccccc2)[C@@H](CO)C1 376114900 MSVQMUFTQZXZMB-UXHICEINSA-N 382.504 2.865 0 50 GFAA Cc1ccc(S(=O)(=O)N2CC[C@@H](c3nccn3C)C2)cc1Br 407997891 MXIRTUCRQKGAPH-GFCCVEGCSA-N 384.299 2.669 0 50 GFAA CCN1CCN(C(=O)c2ccc(-c3ccc(-c4c[nH]c(=N)[nH]4)cc3)cc2)CC1 426590034 TZCDPFCKIYCMNC-UHFFFAOYSA-N 375.476 2.934 0 50 GFAA NC(=O)C1(NC(=O)NCC[C@@H]2CCCCN2Cc2ccccc2)CCCCC1 426604251 HFIMHIVEYAXRFF-IBGZPJMESA-N 386.540 2.919 0 50 GFAA CCCO[C@H]1CCCN(C(=O)c2cccc(-c3cnn(C)c3C(=O)OC)c2)C1 534585006 FGQUJOLSEYYAPZ-KRWDZBQOSA-N 385.464 2.905 0 50 GFAA CN1CCN(c2ccc(C(=O)N[C@@H]3CCCN(Cc4cccs4)C3)cc2)CC1 823792762 QDICKGNUDOTORB-LJQANCHMSA-N 398.576 2.894 0 50 GFAA O=C(c1ccccn1)N1CCC(N[C@@H](Cn2cccn2)c2ccccc2)CC1 828184289 XAMORPVVWZLBNJ-NRFANRHFSA-N 375.476 2.914 0 50 GFAA C[C@@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCC(=O)O)cc1 906911084 DBBWILVEUSWPIA-INIZCTEOSA-N 391.489 2.666 0 50 GFAA O=C(C1CCC1)N1CCCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1 1506405371 BFTOVWUHMJGMHD-JOCHJYFZSA-N 385.552 2.612 0 50 GFAA O[C@H]1CN(CCCC(F)(F)F)CC[C@@H]1N1CCN(CCc2ccccc2)CC1 1614377259 SRFGJZBWKKIDBD-PMACEKPBSA-N 399.501 2.624 0 50 GFAA O=C(c1ccnc(N2CC[C@@](C(=O)O)(c3ccccc3)C2)c1)N1CCCCC1 1704304850 OKPSOCZYTHYLSA-QFIPXVFZSA-N 379.460 2.940 0 50 GFAA CCn1cc(Cl)cc1C(=O)N1CCN(C(=O)C2CC2)C2(CCOCC2)CC1 1775962887 SLXQQBBNRDNTCF-UHFFFAOYSA-N 393.915 2.795 0 50 GFAA Cc1cccnc1C(=O)N1CC2(CCC2)C[C@H]1CNC(=O)C[C@H]1CCCCO1 1775997494 LHUHHJJYTPCWKK-ZWKOTPCHSA-N 385.508 2.850 0 50 GFAA CC(=O)NCCC(=O)N[C@H]1CCCC12CCN(C(=O)/C=C/c1ccccc1)CC2 1857668303 DGACRHMTUIUHTJ-XTXLJPNXSA-N 397.519 2.504 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](NC(=O)c3c(C)noc3C)C2)s1 1857670665 XAAIIPCVUSCARR-ZIAGYGMSSA-N 397.522 2.681 0 50 GFAA CC(=O)N1CCC[C@]2(C1)CN(C1CCN(c3cccc(C)c3)CC1)CC[C@H]2O 1857686124 JDESOYABUYEKCU-PKTZIBPZSA-N 385.552 2.659 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cccc(-n4cccn4)c3)C1)CC2 1857728486 DBWUONFCOPSIOS-JOCHJYFZSA-N 389.459 2.797 0 50 GFAA CCOC1CCN(C(=O)[C@@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)CC1 1857732199 HEYYQHKTLLLSLV-CQSZACIVSA-N 387.505 2.985 0 50 GFAA Cc1nc(CC(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)cs1 1857736366 QRAKTEKKAGSJGK-BPQIPLTHSA-N 391.924 2.978 0 50 GFAA C[C@@H]1CCCN(c2cc(N[C@@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)C1 1857797754 LRONAABOSXWKCB-GDBMZVCRSA-N 379.464 2.597 0 50 GFAA CNC(=O)[C@H](C)SCc1cc(OC)c(C(=O)OC)cc1Br 1875272325 IFLRFELQTVTACK-QMMMGPOBSA-N 376.272 2.612 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H](C)c2ccc(N3CCCOC3=O)cc2)CC1 1875365078 POWYXSFMXLXOOC-OAHLLOKOSA-N 385.464 2.635 0 50 GFAA Cc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NS(C)(=O)=O)cc1C 1875390278 SMBSKEMZVNWKFY-UHFFFAOYSA-N 383.473 2.905 0 50 GFAA Cn1cc(C(=O)N2CCC[C@@H](NC(=O)C(C)(C)C)C2)c(CCC(F)(F)F)n1 2325798472 SQPVECYUTUBBQP-GFCCVEGCSA-N 388.434 2.682 0 50 GFAA Cc1cc(=NC(=O)Cc2ccnc(CN)c2)[nH]n1-c1ccc(Cl)cc1Cl 2325857352 YPZATLQTRJVWIM-UHFFFAOYSA-N 390.274 2.944 0 50 GFAA COCCn1cncc1CN1CCC[C@@]12CCCN(c1ccc(C)cc1)C2=O 2356135260 WKUKMBBOKGDNKP-QFIPXVFZSA-N 382.508 3.000 0 50 GFAA CCCOc1c(CN2CCC3(CC2)CNC(=O)CO3)cc(Cl)cc1OC 2356160308 MASJCZCBVZREIX-UHFFFAOYSA-N 382.888 2.618 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cc(OC)c(OC)c(OC)c2)CC1 655480 VZXZRWMCGPZELL-UHFFFAOYSA-N 386.448 2.683 0 50 GFAA O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NC[C@@H]1CCCO1 969091 WQGRPEKHFFBEDR-HNNXBMFYSA-N 384.461 2.915 0 50 GFAA CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1 1074655 ZHFJTBDJYFVVNM-SFHVURJKSA-N 387.505 2.702 0 50 GFAA NC(=O)c1ccccc1NC(=S)NC(=O)c1ccccc1Br 1162670 DMCZGSIHSVWCJC-UHFFFAOYSA-N 378.251 2.675 0 50 GFAA CCOc1cc(Br)ccc1S(=O)(=O)N1C[C@H](C)O[C@@H](C)C1 3105215 SMBZALNWEANWTM-QWRGUYRKSA-N 378.288 2.646 0 50 GFAA CCOC(=O)c1c(NC(=O)N2CCN(C(=O)OCC)CC2)sc2c1CCC2 6757395 MIINOAGYSUJBED-UHFFFAOYSA-N 395.481 2.720 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)Nc2ccc(Br)cc2F)CC1 8477113 WDRBAMOFPQDWIO-UHFFFAOYSA-N 393.278 2.588 0 50 GFAA CC(C)(C)CN1CCC[C@@]2(CCN(C(=O)Cn3c(=O)oc4ccccc43)C2)C1 11879659 BLWNQIKAJAGKHK-JOCHJYFZSA-N 385.508 2.955 0 50 GFAA COc1ccccc1C(=O)N1CC[C@H]2[C@H](CCC(=O)N2Cc2cccnc2)C1 12026797 RSOWIVYLVBPISQ-MJGOQNOKSA-N 379.460 2.744 0 50 GFAA Cc1ccc2nc(N3CCC(C(=O)N4CCC[C@@H](CO)C4)CC3)nc(C)c2c1 12218047 DCOKHWHNVNRCHY-QGZVFWFLSA-N 382.508 2.694 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CNC[C@H]1CCCO1 12306550 MNKFHWVEKYXYAZ-QGZVFWFLSA-N 398.532 2.979 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)[C@@H]2CCCO2)CC1 12459159 VGJYXPFJVQUTOJ-SFHVURJKSA-N 375.465 2.589 0 50 GFAA COc1cccc(CN[C@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)c1 14733192 GWQKPVLHIRPUHX-KRWDZBQOSA-N 382.508 2.702 0 50 GFAA Cc1nc(C(=O)NC[C@H]2CCC3(CCN(Cc4ccoc4)CC3)O2)cs1 14882481 ZDVPMIKZHHZDRG-MRXNPFEDSA-N 375.494 2.988 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](O)C2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 14965070 RBVCAMGGAIKSBC-KRWDZBQOSA-N 384.451 2.639 0 50 GFAA C[C@@H](C1CCN(Cc2nc(Cc3cccc(F)c3)no2)CC1)N1CCOCC1 19229293 LBAKMJMVOJYEKO-INIZCTEOSA-N 388.487 2.732 0 50 GFAA CN(C[C@H]1CCCO1)c1ccc(C(=O)N2CCC(CCn3cccn3)CC2)cn1 20601682 IIQQNNBDXUNABG-HXUWFJFHSA-N 397.523 2.836 0 50 GFAA NC(=O)C1CCN(C(=O)CCn2ccc3cc(Br)ccc32)CC1 41105537 IMRKQPMOIUZKAR-UHFFFAOYSA-N 378.270 2.518 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccccc2OC)CN1Cc1cccc(C)c1 64084262 HNEUGVBYLCOWDE-HKUYNNGSSA-N 382.460 2.550 0 50 GFAA O=C1NC[C@@H](c2ccc(F)cc2)Cc2[nH]c(Cc3cnc4ccccn34)nc21 65386789 FUXZDQKMBKWKAK-AWEZNQCLSA-N 375.407 2.857 0 50 GFAA CC(=O)NCCN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67673366 ILRMTZZFOROBSL-UHFFFAOYSA-N 383.473 2.999 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(C)cc3C)CC2)C1 67803033 OXKGTDKENXZWSX-OAQYLSRUSA-N 387.568 2.742 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNCc3ccccc3C)C2=O)c1OC 71315504 MZSWNOKUIGIIFV-QHCPKHFHSA-N 398.503 2.656 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC(Cc2ccccc2Cl)(C(=O)O)CC1 71759182 ZIPAZASQYXHASG-KRWDZBQOSA-N 392.883 2.587 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)cc1 72437257 GOZSRUVFPFENJW-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CN(CC1CCN(Cc2ccccc2)CC1)C(=O)c1cnc(C2CC2)[nH]c1=O 77343043 JILIGQMYZBWRQO-UHFFFAOYSA-N 380.492 2.632 0 50 GFAA Cc1ccc(Cl)c(C(=O)N2CCC3(CCC(=O)N(CCCO)C3)CC2)c1 91724687 FWGNKJAQNGPEIT-UHFFFAOYSA-N 378.900 2.876 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)cnc1C 91933205 DTPFAPUIDQFSAO-LJQANCHMSA-N 385.508 2.722 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cnc(Nc3ccccc3)nc2)on1 95361861 BHZXLFIVLZLLHB-KDOFPFPSSA-N 379.420 2.504 0 50 GFAA Cc1ccc(OCCCN(C)C(=O)[C@@H]2CCCN(C(=O)N(C)C)C2)c(C)c1 95363916 DRMMHEOOOKUESZ-GOSISDBHSA-N 375.513 2.924 0 50 GFAA Cn1c(CN2C[C@@H]3CC[C@H](C2)N(Cc2ccccn2)C3=O)nc2ccccc21 95528541 VAJLXIJUOWENFC-FUHWJXTLSA-N 375.476 2.591 0 50 GFAA CC[C@@H](NC(=O)c1cc(OC)cc(C(=O)O)c1)c1ccc(S(C)(=O)=O)cc1 97547572 UOBMQVHRXSBXQJ-QGZVFWFLSA-N 391.445 2.678 0 50 GFAA Cc1cnn(-c2ccc(S(=O)(=O)N[C@@H](c3nc(C)no3)C(C)C)cc2F)c1 125321016 CHEISDYZOIDSGX-MRXNPFEDSA-N 393.444 2.687 0 50 GFAA Cc1ccc(Cn2cccc(NC(=O)c3n[nH]c4ccccc4c3=O)c2=O)cc1 132981410 PBFSHCPXYWIMLM-UHFFFAOYSA-N 386.411 2.694 0 50 GFAA CC(C)(CNC(=O)Nc1ccnn1C[C@H]1CCOC1)N1CCc2ccccc2C1 159266536 JRLLJZMBAZICLS-QGZVFWFLSA-N 397.523 2.878 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)CCc4ccccc4)C3)nn2)n1 169778146 AJPHGEZEGNMTEC-MRXNPFEDSA-N 380.452 2.858 0 50 GFAA CCCOc1cc(C)ccc1NC(=O)N[C@@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 170591913 QAZWQYCCXWQXAW-DNVCBOLYSA-N 396.509 2.642 0 50 GFAA Cc1n[nH]c(=O)c(C(=O)NC2CCN(c3cccc(C(F)(F)F)c3)CC2)c1C 170614584 GIBHWRFXPKYCGI-UHFFFAOYSA-N 394.397 2.804 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CC[C@@H](OCc3csc(C)n3)C2)cc1 170619738 CRRWJCNIZRRGLK-MRXNPFEDSA-N 382.507 2.830 0 50 GFAA CCN(C(=O)CN1CCO[C@@H](c2cnn(CC)c2)C1)c1nc2ccccc2s1 190829236 LESKZLRBAJDVCY-QGZVFWFLSA-N 399.520 2.939 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(CO)[C@@H]3CC[C@@]21C 253595422 DDRIWSPLTXTFNE-FOJZZASLSA-N 378.509 2.577 0 50 GFAA Cc1nsc(NC(=O)c2cc(S(=O)(=O)N3CCCC[C@@H]3C)ccc2C)n1 266560622 MRPURMNQHVXURI-LBPRGKRZSA-N 394.522 2.970 0 50 GFAA CO[C@H](CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)C(C)C 266695026 OHUZXSJAIHZAOM-GDBMZVCRSA-N 384.423 2.680 0 50 GFAA COC1(c2nc(CC(F)(F)F)no2)CCN(Cc2nnc(C(C)C)o2)CC1 284631578 YWHAWDBBXYJNMD-UHFFFAOYSA-N 389.378 2.819 0 50 GFAA Cc1cnc2c(C(=O)NC[C@@H](C)Cn3nc(C)cc3C(F)(F)F)cnn2c1 299782796 MWGYXEAXWBBJBR-LLVKDONJSA-N 380.374 2.628 0 50 GFAA Cc1c(NC(=O)N2CC[C@H]3OCCN(C)[C@H]3C2)cccc1OCC(F)(F)F 332614767 QNRNFUGFCJAXSO-GOEBONIOSA-N 387.402 2.873 0 50 GFAA O=S(=O)([C@H]1CCCN(c2ccnc3ccncc23)C1)N1CCc2ccccc21 333219697 RNRTVLVURFAFMG-KRWDZBQOSA-N 394.500 2.991 0 50 GFAA O=C(NC[C@@H]1CCN(C(=O)Cc2ccccc2)C1)Nc1ccc2c(c1)COC2 372435912 OEZZKKABHQZOGE-KRWDZBQOSA-N 379.460 2.930 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)NCc3cnc(-c4ccc(Cl)cc4)s3)C2)CN1 375226561 IUTKBAPOZIOWLF-SFHVURJKSA-N 390.896 2.885 0 50 GFAA Cc1c(-c2ccccc2)oc2c(C(=O)N3CCO[C@H](C(=O)O)C3)cccc2c1=O 408513461 QMNYXLXFRIOLFT-KRWDZBQOSA-N 393.395 2.694 0 50 GFAA Cc1c(Cl)c(C(=O)N(C)C[C@@H]2OCCN(C)[C@H]2c2ccccc2)nn1C 421539254 ILNSGDZVICBDNG-YJBOKZPZSA-N 376.888 2.526 0 50 GFAA CN1Cc2ccccc2C[C@@H]1CNC(=O)N1CC(OCc2ccccc2F)C1 426387844 KTJFIINZQUCSMV-LJQANCHMSA-N 383.467 2.793 0 50 GFAA Cc1oc(-c2cccs2)nc1CC(=O)N[C@@H](CO)[C@@H](O)C1CCCCC1 913047657 AOZJSFSZTCVOCX-YJBOKZPZSA-N 378.494 2.672 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@H]2c2nccn2-c2ccc(F)cc2)cccc1=O 952890581 FBXOUZLVZZOKEX-GOSISDBHSA-N 380.423 2.933 0 50 GFAA CN(Cc1ccc(CN(C)S(C)(=O)=O)o1)C[C@@H]1CCN(c2ccccc2)C1 952977225 XLWUSXXICCLBQI-KRWDZBQOSA-N 391.537 2.629 0 50 GFAA Cc1ncsc1CN(Cc1ccccc1)C(=O)NC[C@H]1CCS(=O)(=O)C1 952980360 KBOMJJISUMGROU-MRXNPFEDSA-N 393.534 2.598 0 50 GFAA C[C@@H]1CN(c2ccncc2)CCN1C(=O)c1cnnn1-c1ccccc1Cl 1462850456 DEBJMNFFLVQJMP-CQSZACIVSA-N 382.855 2.667 0 50 GFAA CCc1oc(C(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)cc1CN1CCCC1 1529151919 HGVSQAWGEVJUCA-RTBURBONSA-N 383.492 2.820 0 50 GFAA Cc1nc(-c2nnn(C)c2CO)ccc1O[C@H]1CCC[C@H](C(=O)OC(C)C)C1 1775953505 PYRSQORHSAQHOW-GJZGRUSLSA-N 388.468 2.567 0 50 GFAA O=C([C@@H]1CC2CCN1CC2)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 1775978154 BVVMKHSUUCPJRW-KRWDZBQOSA-N 382.426 3.000 0 50 GFAA Cc1cccnc1C(=O)N1CC2(CCC2)C[C@H]1CNC(=O)C[C@@H]1CCCCO1 1775997493 LHUHHJJYTPCWKK-ROUUACIJSA-N 385.508 2.850 0 50 GFAA CSc1ccc2cc(-c3nccn3[C@H]3CCS(=O)(=O)C3)c(O)nc2c1 1857692550 KBRFBZLERXJFFL-LBPRGKRZSA-N 375.475 2.885 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc12 1857693697 IMGNMHMYHFGRMC-GASCZTMLSA-N 378.538 2.881 0 50 GFAA CCCCn1nc(Cc2ccc(OC)c(OC)c2)nc1[C@H]1CC[C@@H](O)[C@H](N)C1 1857719911 XFDHSBPXDSGFQS-GVDBMIGSSA-N 388.512 2.642 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccncc4)C[C@]34CC[C@H]2O4)cnc1C 1857730937 DDYNOZHJPJARBH-ZZLPTCMGSA-N 392.503 2.503 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)Nc1nnc(-c2ccccc2F)s1 1875242895 HFTQTHNXDMCGBR-UHFFFAOYSA-N 397.439 2.970 0 50 GFAA COc1ccc(Nc2cc(N3CCC[C@H](C(=O)N(C)C)C3)ncn2)c(OC)c1 1875258474 MNNOTMYPXYWISE-AWEZNQCLSA-N 385.468 2.542 0 50 GFAA COc1ccc(C)cc1-n1cnc(C(=O)NS(=O)(=O)c2ccc(C)cc2)c1 1875263201 YFOCXAPNEPGAFG-UHFFFAOYSA-N 385.445 2.616 0 50 GFAA Cn1cc([C@@]2(C(=O)NCc3ccc(Oc4ccccc4)cn3)CCCO2)cn1 1875272219 DBBIWMRTEDVERV-OAQYLSRUSA-N 378.432 2.930 0 50 GFAA Cc1ccc(-c2csc(=O)n2CC(=O)N2C[C@@H]3CCCC[C@]3(CN)C2)cc1 1875287432 KHSATXRXUFYUNY-UWJYYQICSA-N 385.533 2.863 0 50 GFAA CCn1c(SCCc2c(C)nc3n(c2=O)CCCC3)nnc1-c1cccnc1 1875310301 LZUQPRVRRAQSRQ-UHFFFAOYSA-N 396.520 2.896 0 50 GFAA CC(C)n1cc(-c2cn(C3CC(C(=O)NCCOc4ccccc4)C3)nn2)cn1 1875318836 WKELEGWDHCZRQL-UHFFFAOYSA-N 394.479 2.869 0 50 GFAA Cc1noc(C)c1COc1ccc(CN[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc1 1875399575 DBRYHIUMZGHHSM-VLCRHTCISA-N 396.491 2.996 0 50 GFAA Cc1ccnc2ccc(C(=O)N[C@@H]3CN(C(=O)[C@]4(C)CCCOC4)C[C@H]3C)cc12 2325793971 MUZBHEZVZGYKHW-AYPBNUJASA-N 395.503 2.937 0 50 GFAA CCCc1cccc(S(=O)(=O)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C)c1 2325826808 NCWXUEGKBLLMBB-GOSISDBHSA-N 382.526 2.631 0 50 GFAA CCCN1C[C@H](c2nc(-c3ccc(N(C)C)cc3)nn2[C@H]2CCOC2)CC1=O 2325839645 AASIBVVJPGEZER-AEFFLSMTSA-N 383.496 2.698 0 50 GFAA CC(C)c1cc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)no1 2356152381 GWYKRTOWCYLZGB-OAQYLSRUSA-N 382.464 2.990 0 50 GFAA COC(=O)c1ccc(OCC(=O)Nc2cc(OC)ccc2OC)c(OC)c1 1141191 XLLNIAPZLWYKRF-UHFFFAOYSA-N 375.377 2.517 0 50 GFAA O=C(Nc1ccccc1)O[C@H]1CS(=O)(=O)C[C@@H]1OC(=O)Nc1ccccc1 1183686 ZBFBPBSFROGYCR-HOTGVXAUSA-N 390.417 2.649 0 50 GFAA COC(=O)CN1C(=O)[C@@](O)(CC(=O)c2ccc3ccccc3c2)c2ccccc21 4555343 BBCQSBSWPVSGBN-HSZRJFAPSA-N 389.407 2.820 0 50 GFAA COc1ccc(NC(=O)Cn2nc(-c3ccc(OC)c(OC)c3)ccc2=O)cc1 5388647 JBVBJKARLMHCKJ-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA COc1ccc(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)cc1OC 5617958 HUKRHRZVNGLWHM-GZTJUZNOSA-N 379.441 2.691 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@]2(CCCN(CCCc3ccccc3)C2)C1 11661772 DTGYUAURJVGJGM-QHCPKHFHSA-N 379.504 2.881 0 50 GFAA O[C@@H]1CN(Cc2ccc(Cl)s2)CC[C@H]1N1CCN(c2ccccn2)CC1 11718284 ZTNVRAWVBGKCQC-IAGOWNOFSA-N 392.956 2.554 0 50 GFAA O=C(CCc1ccccc1)Nc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 12138114 GHCLIZVMVLSQTN-GOSISDBHSA-N 388.489 2.715 0 50 GFAA O=C(NCCc1nc(-c2ccccc2)no1)[C@@H]1CCC(=O)N(C2CCCC2)C1 12708001 QRGPUTYSOSRGPZ-MRXNPFEDSA-N 382.464 2.577 0 50 GFAA COc1ccccc1CC(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 13692339 DPJLDCJGRUIFHW-UHFFFAOYSA-N 377.444 2.704 0 50 GFAA O=C(NC[C@@H]1CCS(=O)(=O)C1)c1ccc2oc(CCc3ccccc3)nc2c1 14952268 SFCXKFPGMIOVSV-INIZCTEOSA-N 398.484 2.778 0 50 GFAA CCOC(=O)[C@@]1(CCCc2ccccc2)CCCN(C(=O)CCn2cncn2)C1 14955059 AWDDGOXUFHLUHH-QFIPXVFZSA-N 398.507 2.863 0 50 GFAA O=C(NCc1ccccc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1F 16625648 ACWWMSDPMJZHDT-UHFFFAOYSA-N 376.453 2.930 0 50 GFAA CC(C)CCn1c(CN(C)C[C@H]2CCCN2C)cnc1S(=O)(=O)C(C)C 19300869 IGFHDAVOWLCMLD-QGZVFWFLSA-N 384.590 2.637 0 50 GFAA COc1ccc(-c2nc3ccccc3c(=O)n2CCCN2CCOCC2)cc1 20258361 JPSWTDQZWDFEFY-UHFFFAOYSA-N 379.460 2.794 0 50 GFAA COC(=O)[C@@H]1CCCN1c1ccc(-c2nc(Cc3ccc(OC)cc3)no2)cn1 20537712 HWOARBVOPMGGPX-KRWDZBQOSA-N 394.431 2.873 0 50 GFAA CCn1cc(S(=O)(=O)N(CCc2ccccc2)Cc2ccnn2CC)cn1 20602545 YLLDVGPCJMENTC-UHFFFAOYSA-N 387.509 2.553 0 50 GFAA COc1ccc(CN2CCN(Cc3cnn(C(C)C)c3)C[C@H]2CCO)c(F)c1 39490309 GASSWJVZHDIAPJ-LJQANCHMSA-N 390.503 2.681 0 50 GFAA Cc1ccccc1OC[C@@H](C)NC(=O)N1CCN(C(=O)c2ccccc2)CC1 56860479 LAKYDAIVMPWHDF-GOSISDBHSA-N 381.476 2.930 0 50 GFAA CCN1CCN(c2ccc(C(=O)N3CCC[C@@H](C(=O)CC(C)C)C3)cn2)CC1 67920869 SOTKJDWHJAKCHR-LJQANCHMSA-N 386.540 2.691 0 50 GFAA OCC1CCN(Cc2cc3n(n2)CCN(Cc2ccc4occc4c2)C3)CC1 72134385 FPZYNDXMTRHFGU-UHFFFAOYSA-N 380.492 2.849 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCN(C23CC4CC(CC(C4)C2)C3)CC1 72435060 JOJRQHLBKCPMIL-UHFFFAOYSA-N 379.508 2.764 0 50 GFAA O=C1CCC(C(=O)N[C@@H]2CCCCN(Cc3ccc4ccccc4c3)C2)=NN1 82120447 OJBASZDPRWJJCH-LJQANCHMSA-N 378.476 2.577 0 50 GFAA Cn1c(CN2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)cc2ccccc21 91847070 ZIHMFDSVQFZFHC-NQIIRXRSSA-N 385.508 2.566 0 50 GFAA Cc1cccc(-n2ncc3c2CCC[C@H]3NC(=O)c2c[nH]c(=O)cc2O)c1C 91871671 AQACUTYUJKLHNR-MRXNPFEDSA-N 378.432 2.690 0 50 GFAA COc1cc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)ccn1 91908246 RHCGLEJVXPPSHO-UHFFFAOYSA-N 394.475 2.530 0 50 GFAA COC(=O)C1=C(C(=O)OC)[C@H](c2ccc(Cl)cc2)c2sc(=O)[nH]c2S1 95004881 KKRMXMIVAMHZQX-VIFPVBQESA-N 397.861 2.928 0 50 GFAA O=C(N1CCCC1)N1CC[C@]2(O)CCN(c3ncc(Cl)cc3Cl)C[C@@H]2C1 95372757 DFGDFCBFLLLGDL-FZKQIMNGSA-N 399.322 2.867 0 50 GFAA Cc1c(CC(=O)N2CCNC(=O)C2)c2c(n1C1CCCCC1)CC(C)(C)CC2=O 95516710 FTLPFHCYQGPERC-UHFFFAOYSA-N 399.535 2.958 0 50 GFAA COCCN1C(=O)[C@H]2CC[C@@H]1CN(C(=O)c1[nH]c3ccc(Cl)cc3c1C)C2 96132836 SYYVBIBMAKJCGI-DZGCQCFKSA-N 389.883 2.839 0 50 GFAA O=C(c1ccc(-c2ccccc2)[nH]c1=O)N(Cc1cocn1)Cc1cocn1 96149526 QOVMMSFDIRLDKY-UHFFFAOYSA-N 376.372 2.861 0 50 GFAA O=c1c2ccccc2c(Cc2ccccc2)nn1Cc1nc([C@@H]2CCOC2)no1 96152313 HRQZTUNCYNKHKX-MRXNPFEDSA-N 388.427 2.923 0 50 GFAA Cc1nc2c(c(N3CCN(C(=O)CC(C)C)CC3)n1)Cc1ccccc1OC2 97546646 FQZBYTIFHOLMEU-UHFFFAOYSA-N 380.492 2.963 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)Nc2snnc2-c2ccccc2)on1 97681700 DYXVWKWCTDDIOA-HIFRSBDPSA-N 385.449 2.881 0 50 GFAA CN(C)Cc1ccc(N2CCN(C(=O)c3cc(F)c(F)c(F)c3F)CC2)nc1 114413831 PYODZFIZFIGZPS-UHFFFAOYSA-N 396.388 2.662 0 50 GFAA CCC(CC)C(=O)N1CCC(NC(=O)CCc2nc(-c3ccncc3)no2)CC1 130223902 HQLPCCLBGOZIFB-UHFFFAOYSA-N 399.495 2.608 0 50 GFAA C[C@H]1CC[C@H](C)N1CCN1CCN(C(=O)c2ccccc2-n2cccn2)CC1 133560605 WSOYMCSHNXRLJZ-OALUTQOASA-N 381.524 2.503 0 50 GFAA NC(=O)c1cccnc1N1CCN(C(=O)C2(c3ccc(Cl)cc3)CCC2)CC1 161629831 SNDHPQQXPWRJNE-UHFFFAOYSA-N 398.894 2.604 0 50 GFAA O=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1cccs1 169775660 DROSGBYWYLQPQI-UHFFFAOYSA-N 382.420 2.794 0 50 GFAA Cc1ccc(-n2c(C3CCN(C(=O)Cc4ccc(F)cc4)CC3)n[nH]c2=O)cc1 169779745 HMIWXVMAQHXKMU-UHFFFAOYSA-N 394.450 2.957 0 50 GFAA COc1cc(C(=O)NC(C)(C)c2noc(C(C)(C)C)n2)cc2c1OCCO2 170599665 YKMGWBFTQLTCLV-UHFFFAOYSA-N 375.425 2.812 0 50 GFAA Cc1ccc(N2CCC[C@@H](NC(=O)c3ccccc3Cn3cncn3)C2=O)cc1 174040516 QOMAMOUVKRSMQZ-HXUWFJFHSA-N 389.459 2.560 0 50 GFAA O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CCC[C@H](c2ccn[nH]2)C1 177284131 RFEQMJKBJQKIIY-HNNXBMFYSA-N 391.431 2.942 0 50 GFAA CNS(=O)(=O)c1ccc(CNC(=O)N[C@@H]2CCCc3ccc(C)cc32)s1 179400348 KLFNMQIYDJZOKU-MRXNPFEDSA-N 393.534 2.841 0 50 GFAA CN1CCc2ccc(NC(=O)N3CCN(Cc4nccn4C(F)F)CC3)cc21 180289999 ZJUVUWYTOYGONZ-UHFFFAOYSA-N 390.438 2.620 0 50 GFAA CC(C)c1ccnc(N2CCN(S(=O)(=O)Cc3c(F)cccc3F)CC2)n1 184271013 FSDVMWZSWMTZIB-UHFFFAOYSA-N 396.463 2.530 0 50 GFAA CCn1cc([C@@H]2CN(Cc3nc(-c4ccc(OC)cc4OC)no3)CCO2)cn1 190800676 PXILYVMQXHBWBK-SFHVURJKSA-N 399.451 2.544 0 50 GFAA CN1CCN(CCOc2ccc(NC(=O)c3coc(C4CCC4)n3)cc2)CC1 192652129 DNRPNQDIVBPDNU-UHFFFAOYSA-N 384.480 2.821 0 50 GFAA CCc1ccccc1CN1C[C@H]2CN(C(=O)c3cccc(C)n3)C[C@@]2(C(=O)O)C1 215863999 GPNFWXXCWROQJV-CVDCTZTESA-N 393.487 2.611 0 50 GFAA COc1ccc(CCC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1F 229687670 CWHZEKZBOCHRHP-XYJFISCASA-N 378.488 2.867 0 50 GFAA O=C(Cc1nc(CN2CC(=O)N[C@@H]3CCCC[C@H]32)cs1)Nc1ccccc1 246405703 BTUAGZXZKQDNFW-IAGOWNOFSA-N 384.505 2.567 0 50 GFAA C[C@@H]1[C@H](N(C)CCO)CCN1C(=O)/C=C/c1cc(Br)ccc1F 253420173 WYBGZQNNWXYBDM-WTTQEFJQSA-N 385.277 2.515 0 50 GFAA NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(C(=O)O)cc2F)c1 262389393 MORRAYQDBUHJHU-UHFFFAOYSA-N 385.395 2.865 0 50 GFAA CC(C)(C)CCOc1cnccc1CNC(=O)C[C@@H]1CCCS(=O)(=O)C1 294032606 OIJNUMNFDKOPKC-HNNXBMFYSA-N 382.526 2.728 0 50 GFAA O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)[C@H]1C[C@H]1C(=O)O 299752932 WAUGDAWTEPVNME-NWDGAFQWSA-N 381.215 2.863 0 50 GFAA CCC(=O)Nc1cc(NC(=O)N(CCO)Cc2c(C)nn(C)c2C)ccc1C 299775046 KOAAURZSXDSULA-UHFFFAOYSA-N 387.484 2.720 0 50 GFAA Cc1nnc([C@@H]2CN(C(=O)c3nc(C)n(-c4ccccc4C(C)C)n3)CCO2)o1 372380509 NOBFHABNSSGPKS-KRWDZBQOSA-N 396.451 2.604 0 50 GFAA COc1cccnc1-c1cccc(C(=O)NCCS(=O)(=O)CC(C)C)c1 426504633 RFWFAZLCGRATID-UHFFFAOYSA-N 376.478 2.558 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3cnn(-c4cccc(F)c4)c3)C2)no1 426523346 CSNGEOCNRFCPEI-OAHLLOKOSA-N 384.415 2.792 0 50 GFAA CC[C@@H](Cn1ccnc1)NC(=O)N1CCC(c2nnc3n2CCCCC3)CC1 426698493 VOLQPXHEAIMSDZ-KRWDZBQOSA-N 385.516 2.569 0 50 GFAA Cc1c(C(=O)NCc2ccccc2C(F)(F)F)cnn1-c1ccc(O)nn1 499233727 VMLZQCRKPYTHIN-UHFFFAOYSA-N 377.326 2.625 0 50 GFAA Cc1cc(C)cc(-c2nn3c([C@H]4CCCN(S(C)(=O)=O)C4)nnc3s2)c1 825131931 CLGPVZFTOOAXIV-ZDUSSCGKSA-N 391.522 2.609 0 50 GFAA C[C@@H]1CN(c2ccc(C(=O)Nc3ccc([C@H](C)CC(N)=O)cc3)cn2)C[C@@H](C)O1 888928582 WPQLPQHVXBVUPC-BZUAXINKSA-N 396.491 2.926 0 50 GFAA Cc1ccc2occ(CC(=O)N3C[C@H](c4cnn(C)c4)C[C@@H](C(=O)O)C3)c2c1 902496861 YJPFKVVCGDJLNC-HUUCEWRRSA-N 381.432 2.734 0 50 GFAA CCc1nc(CN2CC[C@@](c3nc(-c4ccncc4)no3)(C(F)(F)F)C2)n[nH]1 952891517 FJLMFUCSBPLTDP-MRXNPFEDSA-N 393.373 2.518 0 50 GFAA CN(C[C@@H](O)CN1CCC(c2nccc(-c3cccc(F)c3)n2)CC1)C1CC1 952893672 UZSZQUDHKBDKDY-HXUWFJFHSA-N 384.499 2.917 0 50 GFAA Cc1ncnc(N2CCN(Cc3cnc(NCc4ccccc4)nc3)CC2)c1C 952977130 OXIGCHMOTWKNNY-UHFFFAOYSA-N 389.507 2.818 0 50 GFAA CN(C)C[C@]1(CO)CCCN(S(=O)(=O)c2cccc3cccc(Cl)c23)C1 952984094 ZRMYFWGKZYYHBL-LJQANCHMSA-N 396.940 2.818 0 50 GFAA NS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCc3sccc32)cc2c1CCC2 1338096327 MKVFWCUFNYGOBA-OAHLLOKOSA-N 376.503 2.692 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2C[C@H]3CCC[C@](O)(c4ccccc4)[C@H]3C2)CC1 1704340839 NLRQKKFJJYJRDW-RFWXGWTQSA-N 399.535 2.526 0 50 GFAA Cc1ccc(CN2C[C@@H]3CN(C4CCOCC4)C[C@@]3(CCC(=O)O)C2)s1 1772703345 ZSTCMDBAWGYLOX-OXQOHEQNSA-N 378.538 2.834 0 50 GFAA COc1ccc([C@H]2[C@H](CNC(=O)NCc3ccnc(N(C)C)c3)CCN2C)cc1 1775996459 XYVTWCZVIZIVOT-RXVVDRJESA-N 397.523 2.648 0 50 GFAA CCOc1cccc(C(=O)N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)c1 1857708051 RNWYEHUOYSVJQF-SFTDATJTSA-N 394.471 2.727 0 50 GFAA O=C(c1ccn2nccc2c1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857714536 CRBRPHMNUDSKTR-JOCHJYFZSA-N 389.459 2.828 0 50 GFAA OCC[C@H]1CN2C[C@@H](n3ccnc3-c3ccc4cccc(F)c4n3)C[C@H]2CO1 1857729980 LOGQBKNHPPXUOQ-ULQDDVLXSA-N 382.439 2.634 0 50 GFAA O=C([C@H]1C[C@@H](O)C1)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1875245413 YOLSVCWPGFZGPI-KJNZLNQQSA-N 381.428 2.827 0 50 GFAA Cc1ccc(C)c(O[C@H](C)C(=O)N2CCN(c3nc(C)nc4[nH]ccc34)CC2)c1 1875264095 GSNNRFZLLLVVTM-MRXNPFEDSA-N 393.491 2.999 0 50 GFAA Cc1c([C@@H]2CCCN2C(=O)c2cc(-c3ccc4c(c3)OCCO4)[nH]n2)cnn1C 1875283598 XHSKGDMDIGQLEC-SFHVURJKSA-N 393.447 2.867 0 50 GFAA CC(C)N(CC(=O)Nc1ccc(F)cc1)C(=O)c1ccc2[nH]nc(C(=O)O)c2c1 1875299954 CZYLTWHSAVLBSA-UHFFFAOYSA-N 398.394 2.890 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc(O)c3)C[C@H]2C(=O)O)cc1 1875300985 ZDECRMXDEHLCMV-ZGXWSNOMSA-N 381.428 2.831 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2c(C)cccc12)C(=O)N[C@@H]1CN(C)C2(CCCC2)C1 1875309809 OTMKBAZWJOBRRA-AZUAARDMSA-N 396.535 2.657 0 50 GFAA O=C(NCC12CC3CC(CC(C3)C1)C2)N1CC(C2CCS(=O)(=O)CC2)C1 1875309843 QBEQUCBXEHAHJA-UHFFFAOYSA-N 380.554 2.669 0 50 GFAA CCn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)COc3ccc(C)cc3C)CC1)O2 1875394409 IBXWLABFCAXELS-QGZVFWFLSA-N 399.491 2.776 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N[C@@H](C(=O)O)[C@H](O)c3ccncc3)ccc2c1 2325876189 MNGFXDHLPRCGOR-CJMONDIMSA-N 394.427 2.650 0 50 GFAA COc1cc2c(cc1CN1CCC[C@@]3(CCc4cnc(N(C)C)nc43)C1)OCO2 2356136886 AETADZIEDAHDKX-JOCHJYFZSA-N 396.491 2.760 0 50 GFAA COc1c(Cl)cc(C(=O)N(C)[C@H]2C[C@H]3C[C@@H](O)C[C@H]3C2)c(OC)c1OC 2356149562 ITSPWPHPWMMYNA-MPZDIEGVSA-N 383.872 2.987 0 50 GFAA C[C@H]1CCc2nc(NC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)sc2C1 1195993 JAJKPZDJEPWBKI-NSHDSACASA-N 379.507 2.771 0 50 GFAA CCOC(=O)c1sc(NC(=O)c2ccc(OC)c(OC)c2)c(C(N)=O)c1C 1199939 KWGNNJIEGMWRRP-UHFFFAOYSA-N 392.433 2.602 0 50 GFAA CCn1ncc(CNC(=O)[C@]2(C)CC2(Br)Br)c1C 2091255 JEHAFAMBLFGMDN-NSHDSACASA-N 379.096 2.724 0 50 GFAA O=C(N[C@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O)c1cccs1 2493509 DNOCCNKQRHBONF-AWEZNQCLSA-N 375.372 2.621 0 50 GFAA CCn1cc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 2809385 DOLNZHMTHIGWGW-LSDHHAIUSA-N 390.484 2.795 0 50 GFAA Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3cccnc3)cc2)n1 3211104 ICSGQZJXUQPWFN-UHFFFAOYSA-N 383.433 2.542 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)NC(C)=C1C(=O)OCCOc1ccccc1 4189482 LPCUQDDOSZTIGD-IBGZPJMESA-N 382.416 2.945 0 50 GFAA CCCCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCOC)cc1OC 4845077 GMHNEDGHGVBEHM-SFHVURJKSA-N 392.452 2.692 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)NCc2ccc(Cl)cc2Cl)CC1 8477073 ZTAMIAWROCGKPI-UHFFFAOYSA-N 379.309 2.671 0 50 GFAA COCCCNc1nc2nonc2nc1N(C)Cc1cccc2ncccc12 12301966 XSEGVSGCJVKVMF-UHFFFAOYSA-N 379.424 2.646 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)CCN2CCCO2)C1 12439867 AFNHXHJWCQGSFT-NRFANRHFSA-N 392.471 2.568 0 50 GFAA CN(Cc1ccccc1)Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)no1 15068280 CXTYCBUBHGWBTM-UHFFFAOYSA-N 391.475 2.664 0 50 GFAA Cc1ccc(-c2csc(NC(=O)CN3CCN(c4ncccn4)CC3)n2)cc1 35802435 NVWLZLBMEMVPEG-UHFFFAOYSA-N 394.504 2.669 0 50 GFAA COc1cc(CN2CCN(CC3CCCCC3)[C@H](CCO)C2)cc2c1OCO2 39461444 YKIVTSZVDXGOOG-LJQANCHMSA-N 390.524 2.873 0 50 GFAA O=C(Nc1ccnn1C1CCN(C[C@@H]2CCCO2)CC1)c1ccc2c(c1)OCO2 67514574 WTTZADUHOSPUBS-KRWDZBQOSA-N 398.463 2.680 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cccc([C@@H](C)OC)c2)c1 71639314 NLGBOVINZLDKMQ-CYBMUJFWSA-N 393.461 2.684 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72161921 OUUOYTRBKWFQRI-IOMROCGXSA-N 380.467 2.740 0 50 GFAA CCCN(CCC)C(=O)C[C@H]1C(=O)NCCN1Cc1c(F)cccc1Cl 72173902 HUJMHAJNENENBH-KRWDZBQOSA-N 383.895 2.818 0 50 GFAA CCc1n[nH]cc1C(=O)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2ccccc2)C1 72433381 UHDZCCZOUJJTIB-FXAWDEMLSA-N 380.492 2.668 0 50 GFAA Cc1c(CN2CCC3(CC2)CN(CCOc2ccccc2)C(=O)O3)cnn1C 72462965 KWHNCPRUCGMIBX-UHFFFAOYSA-N 384.480 2.594 0 50 GFAA CSCC[C@@H](O)C(=O)N1CCC2(CCC(=O)N(Cc3ccccc3)C2)CC1 91845930 LHMFASGDZDCXPI-GOSISDBHSA-N 390.549 2.532 0 50 GFAA CN(Cc1nnc(-c2ccccc2)o1)C[C@H]1[C@@H]2CN(C(=O)c3ccco3)C[C@H]12 102451619 XPJDWKBKJQNIBB-OSYLJGHBSA-N 378.432 2.780 0 50 GFAA CCCc1noc(-c2ccn3c(CNC(=O)c4ccc(OC)cc4)nnc3c2)n1 169780180 ANVHFBAWKBMPEC-UHFFFAOYSA-N 392.419 2.670 0 50 GFAA O=C(CCc1nc(-c2ncccn2)no1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 176319344 WEEFPFZLKVEAAW-CQSZACIVSA-N 398.854 2.508 0 50 GFAA CCN1CCN(C(=O)CCc2nc(-c3ccc(F)c(C)c3)no2)C(C)(C)C1=O 188164329 QYMWALDPZLNGCP-UHFFFAOYSA-N 388.443 2.586 0 50 GFAA O=C1C[C@H](c2ccccc2)N(C(=O)Nc2cccc(C(=O)NC3CC3)c2)CCN1 195447570 JJAUVGXPGDJIJX-LJQANCHMSA-N 392.459 2.674 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)n(-c2ccccc2)n1 237980892 LUBGLDCZGHJEHK-LJQANCHMSA-N 395.390 2.923 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Nc1ccccc1C(F)(F)F 239038806 DYHZTLSTMQNXRE-YCBBYDHLSA-N 390.361 2.697 0 50 GFAA O=C(COC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1cccc(Cl)c1Cl 239309221 HIJAFHPBJXZJSR-UYILFSFOSA-N 384.215 2.673 0 50 GFAA CCN1CCC(N(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccnc2)CC1 242346955 ZKOWLIRKPCQQET-WMQCIHAUSA-N 398.551 2.798 0 50 GFAA O=C(c1cccc(-c2ccc(O)cc2)c1)N1CC[C@@H]2OCc3cnnn3[C@H]2C1 299797961 UASGLPZSXXJBHW-PMACEKPBSA-N 376.416 2.637 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3cnc4ccccn34)CC2)cn1 328628863 HRDHBLOJZLELHW-MRXNPFEDSA-N 378.480 2.902 0 50 GFAA Cc1nc(C)n(C[C@H]2CN(c3ncc(C)c(-c4ccccc4F)n3)CCO2)n1 328723866 YGRFDUFPHFRIHX-MRXNPFEDSA-N 382.443 2.705 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCN1C(=O)Cc1cccs1)[C@H](O)c1cccc(F)c1 363720332 GWBJPWYLRRSKPQ-IRWQIABSSA-N 390.480 2.659 0 50 GFAA CN1CCN(CCNC(=O)N(C)Cc2ccc(Oc3ccccc3)cc2)CC1 426538088 LNKNCPFXVWGJSF-UHFFFAOYSA-N 382.508 2.868 0 50 GFAA COc1cc([C@@H](C)NC2CCN(c3nccs3)CC2)ccc1OCCO 463078851 UFZLFCINUSNFDG-CQSZACIVSA-N 377.510 2.842 0 50 GFAA NC(=O)CCn1cc(-c2cccc(C(=O)N(Cc3ccncc3)C3CC3)c2)cn1 534578276 LEWVTYUQQQVIHN-UHFFFAOYSA-N 389.459 2.625 0 50 GFAA Cc1cc(S(=O)(=O)NC(=O)c2cnn(CCC(F)(F)F)c2)ccc1Cl 847858423 QTIVCLBKDVFNPX-UHFFFAOYSA-N 395.790 2.916 0 50 GFAA O=[S@](c1ccc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)cc1)C(F)(F)F 865856714 KJDCECNHQZRUCZ-QKFKETGDSA-N 381.441 2.719 0 50 GFAA Cc1nc(C)c(CNC(=O)[C@@]2(O)CCc3cc(Br)ccc3C2)o1 888100417 LLKZBCASGLMXNM-QGZVFWFLSA-N 379.254 2.590 0 50 GFAA CN(C)CC1(O)CCN(C(=O)c2cccc(OCCc3ccccc3)c2)CC1 952969885 DEWAOUMRWMVBEI-UHFFFAOYSA-N 382.504 2.837 0 50 GFAA CC1(C)CC(CC(=O)N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)CC(C)(C)N1 952983714 XAIBMIDNYTWTOC-MRXNPFEDSA-N 375.488 2.994 0 50 GFAA CN(CC[C@H]1CCCCO1)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506398099 LAMIHXDWPWTWNF-SNVBAGLBSA-N 379.837 2.757 0 50 GFAA COCCCN(C(=O)c1cc(O)c2cccc(F)c2n1)C1CCN(C)CC1 1506415228 MMFSFCCNHWDGEV-UHFFFAOYSA-N 375.444 2.652 0 50 GFAA CC(=O)N[C@H]1CN(Cc2cccc(Cn3cccn3)c2)C[C@@H]1c1ccc(C)o1 1565507722 PXZGDJXRBULLBL-SFTDATJTSA-N 378.476 2.937 0 50 GFAA Cn1cnc2c(N3Cc4ccc(CNC(=O)C5(F)CCCC5)cc4C3)ncnc21 1775993256 YKVWMUISLWBQBC-UHFFFAOYSA-N 394.454 2.782 0 50 GFAA CN1CCN(CCCOc2ccccc2-c2nccn2C2CCOCC2)CC1 1857667449 SGKALYIJXBHTPM-UHFFFAOYSA-N 384.524 2.918 0 50 GFAA COc1ccc(CN2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cc1C(=O)O 1857672980 CAIKPGNNVDYGNC-QFIPXVFZSA-N 396.443 2.643 0 50 GFAA CC[C@@]1(C(=O)NCCc2cccnc2)C[C@@H]2CC[C@H]1N2Cc1cnn(C)c1C 1857698270 JEUMLFCSHSKRSE-TUNNFDKTSA-N 381.524 2.616 0 50 GFAA CO[C@H]1C[C@@H](c2nc(-c3c[nH]nc3C)nn2-c2cc(F)cc(F)c2)CC[C@@H]1N 1857718365 GHBTXDMLCJHJQF-GOPGUHFVSA-N 388.422 2.854 0 50 GFAA COC(=O)CCNC(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857729215 AHOIEJSITPDDTQ-LBPRGKRZSA-N 379.844 2.767 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1857732695 BEAOSRSXTDKQAR-NHCUHLMSSA-N 378.472 2.910 0 50 GFAA O=C(O)CCNC(=O)CCCNC(=O)N1Cc2ccccc2-c2ccccc2C1 1875309416 PXDFKAIANVLHMQ-UHFFFAOYSA-N 395.459 2.750 0 50 GFAA Cc1ccc(CCC(=O)N2C[C@H]3C[C@H]2[C@@H]3c2ocnc2C(=O)N(C)C)c(C)c1 1875394419 IGMBEYXASGJFEL-ZIFCJYIRSA-N 381.476 2.940 0 50 GFAA O=C(NC1CC(c2ccc(F)c(Cl)c2)C1)c1cccc(N=c2nn[nH][nH]2)c1 2325869203 CBGINVZYODBCIT-UHFFFAOYSA-N 386.818 2.834 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCC[C@@]4(CN(C)C(=O)O4)C3)cc2)ccc1O 2356140148 WGRSHTKZXPFOOJ-OAQYLSRUSA-N 381.432 2.819 0 50 GFAA O=C1OCc2ccc(CN3CCN4[C@@H](C5CC5)COC[C@H]4C3)c3cccc1c23 2356155130 YJUOITMBWBFNAJ-WIYYLYMNSA-N 378.472 2.805 0 50 GFAA CCc1ccc(C(=O)COC(=O)CNC(=O)c2ccc(Br)o2)cc1 1838393 FJOLRFPRNZHBTG-UHFFFAOYSA-N 394.221 2.760 0 50 GFAA C[C@H]1OC[C@H]2O[C@@H](O)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2O1 3956778 BALYQVSNDKYQHO-LOZMKZQPSA-N 386.444 2.636 0 50 GFAA COC(=O)[C@](NC(C)=O)(Nc1ccc(OC(F)(F)Cl)cc1)C(F)(F)F 4543874 MSFHLNCVURDBHW-NSHDSACASA-N 390.692 2.834 0 50 GFAA Cc1cc(C(=O)Nc2ccc(S(=O)(=O)Nc3onc(C)c3C)cc2)no1 4756601 NRDSOBURBHLBJC-UHFFFAOYSA-N 376.394 2.641 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCC(C(=O)NC2CCCCC2)CC1 10302780 DXOKZGLQIWMTOU-UHFFFAOYSA-N 398.500 2.684 0 50 GFAA COCCCNCc1c(C(=O)N(C)CCc2ccccc2)nc2sccn12 11932746 GCSAKKPQFUYQES-UHFFFAOYSA-N 386.521 2.837 0 50 GFAA COc1ccc(C)cc1NC(=O)c1cccc(N2C(=O)[C@@H](C)CS2(=O)=O)c1 12003964 SSPQWTJHLRHYGL-ZDUSSCGKSA-N 388.445 2.568 0 50 GFAA CC(C)[C@H](NC(=O)c1csc2nc(-c3ccccc3Cl)cn12)C(N)=O 12315239 FLKYHSWGXPXGSE-AWEZNQCLSA-N 376.869 2.956 0 50 GFAA Cc1nc(N2CCCCCCC2)ncc1[C@H](C)NC(=O)CCN1CCCC1=O 14970116 QAVDOVYIIQYQFO-INIZCTEOSA-N 387.528 2.745 0 50 GFAA CO[C@H]1CCCN(C2CCN(c3ccc(CC(=O)N4CCCC4)cc3)CC2)C1 14984432 HJHIIJXJUOGPEP-QFIPXVFZSA-N 385.552 2.931 0 50 GFAA O=C([C@@H]1C[C@@H](n2cnnn2)CN1Cc1ccc(Cl)cc1)N1CCCCCC1 20271613 PQPQIIQKPPEDHM-MSOLQXFVSA-N 388.903 2.545 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@H]2CCOC2)n1CCCc1ccccc1 23366697 AGVCKKMTFLAOHC-SFHVURJKSA-N 391.537 2.530 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NCc2cccc(O)c2)CN1Cc1ccccc1Cl 32565440 WEVFLWGCJDXPDU-PXNSSMCTSA-N 387.911 2.914 0 50 GFAA Cc1cnccc1N1CCCN(Cc2c(C)n(CC(N)=O)c3ccccc23)CC1 65507474 KUQJTPVFXUDDPE-UHFFFAOYSA-N 391.519 2.851 0 50 GFAA COc1ccccc1C(=O)NCc1cc2c(nc1OC)CN(C1CCCC1)C2=O 71751031 OEWPJNLEFCZOGJ-UHFFFAOYSA-N 395.459 2.927 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)C(=O)c3cccn3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72169258 FQHZJPHLLHTBRM-CEWLAPEOSA-N 377.488 2.605 0 50 GFAA CN(Cc1nc2ccccc2s1)C(=O)c1cn(CC[C@H]2CCCCN2)nn1 77407987 KWDMOBKCRYCHPE-CQSZACIVSA-N 384.509 2.692 0 50 GFAA CCS[C@@H](C)C(=O)N1CCC2(CC1)CN(CCN(C)CC(C)C)C(=O)O2 77524254 VLHXTMDYFIQSBY-INIZCTEOSA-N 385.574 2.529 0 50 GFAA Cc1ccc(OCCN2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)c(Cl)c1 91664373 WGNPJUXFTXSEPN-FQEVSTJZSA-N 379.932 2.656 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccc(F)c(Cl)c3)C2)CCC1=O 91858160 AXPOIFNRPFBOSS-LJQANCHMSA-N 382.863 2.970 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)NCc1nn(C)c3ccc(C)cc13)CC(=O)N2 91985837 SEHRPQPVYKGFNS-OAHLLOKOSA-N 378.432 2.633 0 50 GFAA Cc1ccccc1COC1CN(Cc2cc(O)c3cc(C(N)=O)ccc3n2)C1 92080840 FWKDFIMQHODOJS-UHFFFAOYSA-N 377.444 2.749 0 50 GFAA COc1cccc(OC)c1[C@H](C(=O)O)N1CCN(Cc2cccs2)CC1 95362654 BPKDMZUDXZMSDZ-GOSISDBHSA-N 376.478 2.709 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2cccc(O)c2)CC3)cn1 95376347 GKSCBRPBMXNXRD-UHFFFAOYSA-N 394.475 2.536 0 50 GFAA CN(C1CCOCC1)S(=O)(=O)c1cccc(C(=O)N2CCCCCC2)c1 95382730 LDIZYGJHNKSDJO-UHFFFAOYSA-N 380.510 2.502 0 50 GFAA CCCn1c(C)c(CC(=O)NCc2nnc3n2CCC3)c2c1CC(C)(C)CC2=O 95498680 XRKVEDUSWZSBNO-UHFFFAOYSA-N 397.523 2.758 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)C1CC1)N1CCc2[nH]c(-c3ccccc3)nc2C1 95505675 JSWPYLGSDWLOOG-IBGZPJMESA-N 378.476 2.753 0 50 GFAA C[C@H]1CCCN(C(=O)c2ccc(NC(=O)NCCSc3ncn[nH]3)cc2)C1 97679899 VLBZTNOZZLIJOC-ZDUSSCGKSA-N 388.497 2.591 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1ccc(Cl)cc1Cl 101127890 JTZFHKVDVOTUHR-HBJVGIJOSA-N 377.227 2.835 0 50 GFAA O=C(NCc1cccnc1-n1cccn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 109348215 LCWNTVVQYLRIMN-LJQANCHMSA-N 393.466 2.935 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1ccc(-n3nc(C)cc3C)c(F)c1)CC2 114863526 BLMCXSVGUKQTOI-HNNXBMFYSA-N 382.443 2.527 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)N[C@H]1c2ccccc2C[C@H]1O 124410397 FFJORJDDFHKVFX-MSOLQXFVSA-N 378.436 2.701 0 50 GFAA Cn1cc(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)c(C(C)(C)C)n1 127537477 SAAXZNODVLUOKA-HXUWFJFHSA-N 398.551 2.893 0 50 GFAA C[C@H](c1ccsc1)N1CCN(C(=O)c2ccc(=O)n(-c3ccccc3)n2)CC1 128660425 KKKUXLZJDZXYIO-MRXNPFEDSA-N 394.500 2.813 0 50 GFAA COc1cc(F)cc2sc(NC(=O)c3cc(N4CCOCC4)ccn3)nc12 130803892 ZYHZWBAHROVPQP-UHFFFAOYSA-N 388.424 2.928 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1C[C@H](CO)OC[C@@H]1C 154165429 LXIUWVDQQKTXQO-XHDPSFHLSA-N 396.896 2.906 0 50 GFAA C[C@H](O)C[C@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 155878963 ILCQCVGMEDDINB-LZWOXQAQSA-N 396.434 2.655 0 50 GFAA CC(C)Cc1ccc(S(=O)(=O)N2CCC([C@@H](O)c3ncc[nH]3)CC2)cc1 170619752 RWMNMNBVTHQGFG-GOSISDBHSA-N 377.510 2.743 0 50 GFAA COc1ccc(CNC(=O)c2c(O)c3cccc4c3n(c2=O)[C@H](C)C4)cc1OC 170624703 IOSXMFVPHNQBRQ-GFCCVEGCSA-N 394.427 2.771 0 50 GFAA Cn1c(S)nnc1CCNC(=O)C1(c2cccc(C(F)(F)F)c2)CCC1 170640889 YIMSGOLMYOKTDQ-UHFFFAOYSA-N 384.427 2.903 0 50 GFAA Cc1ccc([C@@H](NC(=O)c2cccc[n+]2[O-])c2cccc(S(C)(=O)=O)c2)cc1 170643534 JQNYVAYNRHWAGN-HXUWFJFHSA-N 396.468 2.551 0 50 GFAA CN(C(=O)NCc1nnc2n1CCCCC2)[C@@H]1CCCN(Cc2ccccc2)C1 174122434 AMEZKHWRIREREB-LJQANCHMSA-N 396.539 2.811 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1ccc(OC2CCCC2)nc1 175915032 DVWZCLAJFIXEBR-UHFFFAOYSA-N 381.480 2.559 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N(C)C[C@H]2CCCC[C@H]2O)CC1 182533817 JOYYZWQZVQLUFQ-VQIMIIECSA-N 375.513 2.857 0 50 GFAA O=C(NOC[C@H]1CCOC1)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 188320686 NDCYIBMOJJLPAN-XHDPSFHLSA-N 387.263 2.682 0 50 GFAA Cc1nn(C)c(C)c1[C@@H]1CCCN1S(=O)(=O)CCc1ccc2c(c1)CCO2 189598425 GASOEQIJAYMYBE-SFHVURJKSA-N 389.521 2.681 0 50 GFAA Cc1cc(C(=O)N2CC[C@@](C)(C(=O)O)C2)nn1-c1ccc(Br)cc1 237707487 GXJCFGDLQMTJGY-QGZVFWFLSA-N 392.253 2.880 0 50 GFAA NCC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CC1 237839732 ARTXIZUCUDUOIU-IBGZPJMESA-N 389.499 2.808 0 50 GFAA COc1ccc2c(c1NC(=O)N(C)CC1CCN(C[C@@H](C)O)CC1)CCC2 242287989 YKBWWCHAHPNATI-OAHLLOKOSA-N 375.513 2.740 0 50 GFAA CCOc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccccc2)cc1 245232003 NSVJBXXWSGHFDE-SLFFLAALSA-N 377.444 2.621 0 50 GFAA C[C@H](O)C[C@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 246512252 ILCQCVGMEDDINB-SQWLQELKSA-N 396.434 2.655 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(Nc3cccc(N4CCCC4=O)c3)c2c1 252492675 MSCMEIYBOKEEMG-UHFFFAOYSA-N 382.445 2.904 0 50 GFAA Cc1ccc(-c2cncc(C(=O)Nc3nc(C4CCNCC4)nn3C)c2)cc1 262440248 SSDQEJZOXMTQGJ-UHFFFAOYSA-N 376.464 2.905 0 50 GFAA O=C(CC1(n2cccc2)CCSCC1)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 263586543 VOALZHPKFCWSOX-MSOLQXFVSA-N 397.544 2.908 0 50 GFAA biogenic COc1ccc(-c2cc3c(=O)n(C[C@H](O)c4cccc(OC)c4)ccn3n2)cc1 263616245 HTFQEIZXZYRFOQ-NRFANRHFSA-N 391.427 2.914 0 50 GFAA O=C(Nc1ccccc1Cn1cncn1)N1CCCN2c3ccccc3C[C@H]2C1 290392599 LOSSUSFYYKXKGF-IBGZPJMESA-N 388.475 2.995 0 50 GFAA CC(C)C(=O)Nc1cc(C(=O)Nc2ccn(CCc3ccncc3)n2)ccn1 293442957 OUIYMDSIUSRGSJ-UHFFFAOYSA-N 378.436 2.763 0 50 GFAA CCC(=O)Nc1cc(NC(=O)N2CCN(C(=O)c3ccc[nH]3)CC2)ccc1C 299781481 RHEIQOZLCRDZNW-UHFFFAOYSA-N 383.452 2.662 0 50 GFAA CCCS(=O)(=O)N1C[C@H]2CCC[C@@]2(c2nc(Cc3ccccc3)no2)C1 328606278 QXIZFHPYJQTGKK-VQIMIIECSA-N 375.494 2.754 0 50 GFAA COc1ccc2cc(NC(=O)N3CCC[C@]4(CCS(=O)(=O)C4)C3)ccc2n1 333205925 IXMFBAPGOHFMIZ-IBGZPJMESA-N 389.477 2.676 0 50 GFAA NC(=O)NCCCCC(=O)NCC1(c2ccc(Br)s2)CCC1 368608643 QPVSKLZXOSVWCF-UHFFFAOYSA-N 388.331 2.887 0 50 GFAA CN1Cc2ccccc2[C@@H](NC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 378277620 OIRBASNJFUJJCH-NQIIRXRSSA-N 395.478 2.981 0 50 GFAA CN1CCN(CC[C@H]2CCCCN2C(=O)NCc2ccc(F)c(F)c2)CC1 426726739 JANADICJICWSKF-QGZVFWFLSA-N 380.483 2.666 0 50 GFAA O=C(NCCCc1nnc2ccccn12)N1CCCN(c2ccccc2)CC1 489491990 CQJVDHQEGOQKRC-UHFFFAOYSA-N 378.480 2.584 0 50 GFAA Cc1nc(O)[nH]c1C(=O)NCc1c(-c2ccc(F)cc2)nc2ccc(F)cn12 1472036827 JUXKOLRVWJQHOQ-UHFFFAOYSA-N 383.358 2.947 0 50 GFAA O=C(NCCc1ccccc1)C1CCN(C(=O)c2cnc(O)c(Cl)c2)CC1 1506400683 OLVPCWIRDCUMPF-UHFFFAOYSA-N 387.867 2.652 0 50 GFAA Cc1ncc(C(=O)N2C[C@H]3C[C@H](c4ccccc4)CC[C@@]3(C(=O)O)C2)c(O)n1 1565505606 BTUZJTFJUXFHKL-WHSLLNHNSA-N 381.432 2.601 0 50 GFAA O[C@H]1CN(c2ncc(F)c(N3CCCC3)n2)C[C@H]1Cc1ccnc2ccccc12 1704306631 QOBYBMILXJOMIB-UZLBHIALSA-N 393.466 2.804 0 50 GFAA Cc1ccc(NC(=O)C[C@H]2Cn3nc(-c4ccncc4)nc3NC2=O)cc1Cl 1848442407 GGXMOVHWZSQTKY-ZDUSSCGKSA-N 396.838 2.899 0 50 GFAA O=C(c1ccccc1OCc1ccccc1)N1C[C@@H]2CCOC[C@]2(C(=O)O)C1 1857668886 XMWVRXDOCUXWPN-HTAPYJJXSA-N 381.428 2.829 0 50 GFAA CCCNC(=O)N1CCC2(CC1)CC(=O)N(C/C=C/c1ccccc1)CCO2 1857689776 XSXPFEXDZMAFRT-RMKNXTFCSA-N 385.508 2.903 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(F)c3F)C[C@]23CC[C@H]1O3)C1CCC1 1857715917 NYZIGHRFGISHJL-LTVCHDBBSA-N 376.447 2.861 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NCc1ncon1 1857723341 BDHDAHRDAUFYSE-NSHDSACASA-N 375.816 2.787 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCc1nc2ncccc2o1 1857730933 DAEPJLDNGOXEFY-ZDUSSCGKSA-N 392.419 2.682 0 50 GFAA O=C(N=c1ccn(-c2ncccc2Cl)[nH]1)N[C@H]1CCO[C@@H](c2ccncc2)C1 1875265761 ZHPYKQKISAHQAC-GOEBONIOSA-N 398.854 2.779 0 50 GFAA O=C(NC12COC(CO)(C1)C2)c1cc(-c2ccccc2)nc2onc(C3CC3)c12 1875299317 HLHGGUXJDKXFJZ-UHFFFAOYSA-N 391.427 2.791 0 50 GFAA Cn1cc(C(F)(F)F)c(C(=O)NCCc2nc(-c3ccccn3)cs2)n1 1875316423 PWBSMPFLERSDOG-UHFFFAOYSA-N 381.383 2.930 0 50 GFAA Brc1cncc(-c2nccc(=NC[C@H]3COc4ccccc4O3)[nH]2)c1 1875332769 JPBOAHQKHWIVIU-AWEZNQCLSA-N 399.248 2.975 0 50 GFAA OCCCc1nc([C@@H]2CCCc3nc[nH]c32)n(-c2ccc(OC(F)F)cc2)n1 1875348708 ZPXLKHXHBJXXSE-CQSZACIVSA-N 389.406 2.985 0 50 GFAA CCn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)CCNc3ccccc3)CC1)O2 1875394875 ZMEDQTSWSGNJKU-QGZVFWFLSA-N 384.480 2.582 0 50 GFAA NC(=O)C1CCC2(CC1)CC(NC(=O)NC[C@@]1(c3ccccc3)CCCO1)C2 2325780654 FRCFEJZEYFHVKS-POJJPYAWSA-N 385.508 2.816 0 50 GFAA O=C(NCc1cn2cc(Cl)cc(Cl)c2n1)c1cc2n(n1)CCCC2=O 2325781309 BVSGTTKAUOFOST-UHFFFAOYSA-N 378.219 2.744 0 50 GFAA O=C(Oc1cccc2c(OC(=O)N3CCOCC3)cccc12)N1CCOCC1 795453 RDSMFLQNDFZPDD-UHFFFAOYSA-N 386.404 2.502 0 50 GFAA COc1cccc(CCNC(=O)C[C@H]2Sc3ccccc3NC2=O)c1OC 912762 TUCJPGOSIRSSLQ-QGZVFWFLSA-N 386.473 2.866 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)c(C)cc1C 1115231 LAVCMPNLBQRSNU-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(OC)c(OC)c1 1133035 NWKRYCAPFRMKPH-UHFFFAOYSA-N 375.377 2.760 0 50 GFAA CN(CCC1CCOCC1)C(=O)[C@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356141902 VIOPTMIXEKKKNI-BOCKYXSRSA-N 397.519 2.593 0 50 GFAA O=C(/C=C/c1ccccc1)OCCCCNC1=NS(=O)(=O)c2ccccc21 2978662 GQZYLTJOBVBXKT-OUKQBFOZSA-N 384.457 2.762 0 50 GFAA O=C(N[C@H](O)C(Cl)(Cl)Cl)c1ccc(I)cc1 3051320 RZMYARORPGMOFJ-MRVPVSSYSA-N 394.423 2.710 0 50 GFAA C[C@H](C(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1)c1cc2ccccc2o1 225716221 HVWAKAABCONMBQ-GOEBONIOSA-N 376.478 2.563 0 50 GFAA CC(=O)Nc1ccc2nc(NC(=O)CN3C(=O)COc4ccccc43)sc2c1 8390976 IMFLTSMBKIULJI-UHFFFAOYSA-N 396.428 2.619 0 50 GFAA COc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccn2)cc1OC 8685066 BEWXCXQDLTWMRK-QGZVFWFLSA-N 384.461 2.530 0 50 GFAA COc1ccc(Cc2nnc(SCc3nc4ccccc4c(=O)[nH]3)n2C)cc1 8762917 XKYGRKSUOZSBSN-UHFFFAOYSA-N 393.472 2.943 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CC1 20177284 ZTIDWPJQXJXFFH-UHFFFAOYSA-N 399.882 2.579 0 50 GFAA C[C@@]12CC3CC(C(=O)NCCCN4CCC(C(N)=O)CC4)(C1)C[C@](C)(C3)C2 55154193 FRSUOJUVTQTRSC-NJMHRBNOSA-N 375.557 2.687 0 50 GFAA C[C@@]12C(=O)N(c3ccc(I)cc3)C(=O)[C@H]1[C@H]1C=C[C@H]2C1 100809922 RFKPHBPWISGQRV-DRFYQUMISA-N 379.197 2.993 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)NC[C@@H]2OCCc3ccccc32)[nH]n1 67654335 JIXXQETXOWXMNF-IBGZPJMESA-N 379.464 2.822 0 50 GFAA O=C(CCc1nc(-c2ccccn2)no1)N1CCN(c2ccccc2F)CC1 21523952 BVUDOCUOKPQDGW-UHFFFAOYSA-N 381.411 2.552 0 50 GFAA COc1ccccc1[C@@H]1CNC(=O)c2nc(CCn3nccc3C3CC3)[nH]c2C1 65397202 CWYLJRGQMFTCMA-HNNXBMFYSA-N 391.475 2.805 0 50 GFAA CN(Cc1ccco1)C(=O)c1coc(CN2CCN(Cc3ccccc3)CC2)n1 67805097 WQRVHJWRYNIXBF-UHFFFAOYSA-N 394.475 2.858 0 50 GFAA Cc1cccc(CN2CCC[C@@](O)(CN(C)Cc3ccc4nonc4c3)C2=O)c1 67649500 YURKHZZIMZJYNO-JOCHJYFZSA-N 394.475 2.517 0 50 GFAA O=C(c1ccno1)N1CCC[C@@]2(CCN(Cc3cccn3-c3cccnc3)C2)C1 67757251 BDDZOVTWDMYAHC-QFIPXVFZSA-N 391.475 2.989 0 50 GFAA Cc1cc(CNC[C@@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)cnc1C 67851292 HTFCQHLSSTYYGT-NRFANRHFSA-N 389.446 2.620 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cccc3cnccc23)c1 72161856 GSAMJDQOTMKPKS-UHFFFAOYSA-N 386.429 2.525 0 50 GFAA CCn1cc(S(=O)(=O)Nc2ncccc2C(=O)c2cc(F)cc(F)c2)cn1 253427808 DIKVGSCHMDVFRL-UHFFFAOYSA-N 392.387 2.608 0 50 GFAA O=C(NCC1CCN(C(=O)c2ccccc2)CC1)c1ccc(-n2ccnc2)nc1 150792351 ZPIRRDUKEMCOAD-UHFFFAOYSA-N 389.459 2.550 0 50 GFAA O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(-c2cccnc2)cc1 363430837 IFDGZZUSIYMRQQ-OALUTQOASA-N 377.444 2.540 0 50 GFAA C[C@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@@H](O)c1ccc(F)cc1 173610637 CRRVETGCYCYTDU-IFXJQAMLSA-N 383.427 2.904 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCCc2cn[nH]c2)Cc2ccccc2C1 72161566 ZNZUZLCRENALFB-UHFFFAOYSA-N 388.515 2.781 0 50 GFAA Cc1n[nH]c(C)c1[C@@H](C)C(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C 131619992 MZSUULJSIPXYCR-GFCCVEGCSA-N 392.525 2.523 0 50 GFAA C[C@H]1CN(C(=O)c2nc3ccc(Cl)cn3c2CN2CC=CCC2)C[C@@H](C)O1 71681438 RMIDFCJOZAAXDW-GASCZTMLSA-N 388.899 2.999 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)COc1ccc(CN2CCCOCC2)cc1 95513127 NTQFTIAFODHMNA-JOCHJYFZSA-N 384.520 2.781 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)c2ccccc2C)CC1 96140593 MOCNTIJQVJJIDA-UHFFFAOYSA-N 378.480 2.871 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N(CCCO)Cc3ccccc3)c(=O)[nH]2)cc1 91858365 BDYLTAAUUXYEKG-UHFFFAOYSA-N 377.444 2.770 0 50 GFAA CCNc1ccc(-c2ccc(C(=O)N3CCN(CCSC)CC3)cc2)nn1 534663286 IOXKSOAMAAEJEC-UHFFFAOYSA-N 385.537 2.696 0 50 GFAA CC(C)(C)OC(=O)CCOCCOCCOCCC(=O)OCc1ccccc1 575409780 DXVVQGGYMXXZME-UHFFFAOYSA-N 396.480 2.902 0 50 GFAA O=C(Cc1cc2c(cc1Cl)OCCO2)NCc1ccc2nsnc2c1 670467193 QVEYXVHVQBRVND-UHFFFAOYSA-N 375.837 2.975 0 50 GFAA C[C@@H](N=c1nc2sccc2c(N)[nH]1)c1cc(F)ccc1N1CCC(O)CC1 1875286575 YXNXBBLYALKLRT-LLVKDONJSA-N 387.484 2.969 0 50 GFAA O=C(CCCc1nn[nH]n1)N[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 1875302637 ZWIDZAIOMKPGQD-GFCCVEGCSA-N 381.280 2.961 0 50 GFAA COC(=O)C(C)(C)n1ccc(=NC(=O)c2ccc(O)c(-c3ccccc3)c2)[nH]1 1875320635 ILYBAQDIQWQZAH-UHFFFAOYSA-N 379.416 2.838 0 50 GFAA COCCn1nc2c(c1C(=O)N(C)Cc1ccc(F)cc1)C[C@H](C)O[C@@H]2C 1875314871 XQIAAHLAVXDWBS-UONOGXRCSA-N 375.444 2.963 0 50 GFAA c1ccc(-n2nccc2CNC23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)cc1 952986388 FKNINQRSXDCVMC-AGXSTUJCSA-N 375.480 2.697 0 50 GFAA Cc1cc(N2CCN(CCCn3cccn3)CC2)nc(-c2ccccc2O)n1 952971188 IWGSDFMQJZCHPR-UHFFFAOYSA-N 378.480 2.566 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3cc4nc(C)cc(C)n4n3)C[C@@H]2N(C)C)cc1 1565527416 KOXSLXJBKXHGNA-QUCCMNQESA-N 377.492 2.824 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 1322524642 SHPWAKKCBDBRLD-QHCPKHFHSA-N 391.471 2.719 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(N4CCCC4)ccn3)C2)nc1 188674862 CFRKPKQLJKYJBV-KRWDZBQOSA-N 393.491 2.876 0 50 GFAA COC[C@H](NC(=O)c1ccc(-n2nc(C)c(CCC(=O)O)c2C)cc1)C1CC1 191610975 OZMXLHULIYZLFP-IBGZPJMESA-N 385.464 2.661 0 50 GFAA CCN(CCc1nc2cccc(C)c2[nH]1)C(=O)c1ccccc1-c1nn[nH]n1 1506420156 WIFBBBHYGCPQME-UHFFFAOYSA-N 375.436 2.756 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)NC[C@H]1CN(Cc2ccccc2)CCCO1 1506420637 JDJPEXYMFLPKBD-IBGZPJMESA-N 396.535 2.628 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(c3ncc(F)c(N4CCCC4)n3)C1)CC2 1704303307 GPOHPDQXPCFAKD-OAQYLSRUSA-N 397.502 2.556 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3cc(OC)ccc3OC)n2)c1 5400087 ZXKJEMPCCSXYBI-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)Cc2nc(C)cs2)CCC1=O 11873588 LMRPPJJKIIOEKW-INIZCTEOSA-N 387.505 2.857 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1Cc2cccc(-c3ncccn3)c2O1 12079695 XBCBNLJZTFQAQA-INIZCTEOSA-N 389.411 2.535 0 50 GFAA COc1cccc(CNC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCCC4)c1 169778354 HEMSVNNESLMFJE-UHFFFAOYSA-N 394.475 2.558 0 50 GFAA O=C(C[C@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1ccc(F)c(F)c1F 206234287 YORJUIHOAOUKRV-CQSZACIVSA-N 391.349 2.596 0 50 GFAA CCNc1ncc(C(=O)N[C@H]2C[C@@H](Cn3cc(Cl)cn3)C[C@@H]2O)cc1Cl 1857531449 WFPTWGJGWDUZPR-ONERCXAPSA-N 398.294 2.586 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)N3CCC(Cc4cccnc4)CC3)C2)n(C)n1 333764934 WMIPRMNFWWGRGP-FQEVSTJZSA-N 396.539 2.757 0 50 GFAA COc1cc2c(cc1OC)CN([C@@H]1CCCN(CCCn3cccn3)C1)CC2 20785614 HWEUCLGYUXCQNC-HXUWFJFHSA-N 384.524 2.813 0 50 GFAA Cc1nc2c(cc1C(=O)N[C@@H](C)c1ccc3c(c1)CC(=O)N3C)c(C)nn2C 263989721 HIZJEHIHJIYJNX-NSHDSACASA-N 377.448 2.595 0 50 GFAA CC(C)(C)n1cc(CN2CCN(C(=O)CC3CCC(C(=O)O)CC3)CC2)cn1 911773763 RAGRAGZZGSBHRU-UHFFFAOYSA-N 390.528 2.563 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@@]3(C)CCO[C@H]3C3CC3)nn2C)cc1OC 935367543 SHTWHCKHURMOPS-FPOVZHCZSA-N 385.464 2.792 0 50 GFAA COC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc(C)c(CC(C)C)[nH]1 4625822 FVGVMNSOPRLGNS-KRWDZBQOSA-N 389.521 2.909 0 50 GFAA COc1ccc(-c2ccncc2)cc1CN[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O 2325785590 FLCDTGXJBXZGLB-ZLGUVYLKSA-N 378.476 2.883 0 50 GFAA C[C@@H]1Cc2c(Br)cccc2CN1C(=O)[C@H]1CCn2cnnc2C1 2325811644 LUESUTOHVNXSOY-NEPJUHHUSA-N 375.270 2.576 0 50 GFAA CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1-c1cccnc1 779282 GHEWRJFTJRBOPS-UHFFFAOYSA-N 397.460 2.862 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 2802710 HTRJSQPFJZSOEN-HNNXBMFYSA-N 394.443 2.682 0 50 GFAA Cc1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1C 3598427 QKOOCZZQFTUFDH-UHFFFAOYSA-N 392.452 2.716 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1I 4831862 QLZSAJZRSOWDKL-UHFFFAOYSA-N 395.262 2.720 0 50 GFAA COc1ccc(C2=NO[C@@H](C(=O)N3CCN(c4ccccc4OC)CC3)C2)cc1 4904163 JYDGFASODPDZDY-OAQYLSRUSA-N 395.459 2.546 0 50 GFAA O=C(OC[C@@H]1OC(=O)C(F)(F)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 4975972 SHHNEUNVMZNOID-LSDHHAIUSA-N 376.311 2.630 0 50 GFAA COC(=O)c1c(NC(=S)Nn2c(C)nnc2C)sc2c1CC[C@H](C)C2 6234719 JCXUSNIXBYMIKO-QMMMGPOBSA-N 379.511 2.808 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2n[nH]c(N)n2)sc2c1CCCCC2 6783914 QSBAMGVOZDHZDP-UHFFFAOYSA-N 395.510 2.625 0 50 GFAA O=C(Cc1cccs1)N1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2)C1 11879599 VVNPKHWHHXJING-KRWDZBQOSA-N 392.546 2.649 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@]2(CCCN(CCCc3ccccc3)C2)C1 12058505 YUAMNLUDVQLANS-QHCPKHFHSA-N 385.552 2.961 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCC(Oc2cccnc2)CC1 12207562 UMSARFZAKAOXOC-UHFFFAOYSA-N 377.448 2.599 0 50 GFAA C[C@H](CCn1cccn1)NC(=O)c1cc(COc2cncc(Cl)c2)on1 12475270 DWMUPECKICMYCL-GFCCVEGCSA-N 375.816 2.707 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@H](C(=O)NCC4CCOCC4)C3)nc2c1 14879440 SYTQVASBSONCKI-KRWDZBQOSA-N 398.507 2.706 0 50 GFAA COC(=O)CCC(=O)N1CCC(n2nccc2NC(=O)c2ccccc2C)CC1 14973058 MEYRLDNGVFERFW-UHFFFAOYSA-N 398.463 2.561 0 50 GFAA Cc1ccc(CCC(=O)NCCc2nnc(SC[C@@H]3CCCO3)n2C)cc1 14985701 XRMXDFBVUOYJCP-KRWDZBQOSA-N 388.537 2.686 0 50 GFAA C/C=C(\C)C(=O)N1CCC([C@@H](Cc2ccccc2)N(C)C(=O)CN(C)C)CC1 14994640 LPROUQYEMHYWEO-POCMVBEYSA-N 385.552 2.823 0 50 GFAA CC(=O)NCC(=O)N1CCC([C@H]2CCN(Cc3ccc(Cl)cc3)C2)CC1 15075370 NQRXMBBVGIDZGU-SFHVURJKSA-N 377.916 2.537 0 50 GFAA COCCCNC(=O)c1nn(C)c2c1CN(Cc1cc3ccccc3s1)CC2 20389564 DBKRATCCGRPOPM-UHFFFAOYSA-N 398.532 2.959 0 50 GFAA O=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCO[C@H](c2ccccc2)C1 40266875 ABAXMNQHHLMLFM-FQEVSTJZSA-N 375.428 2.510 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c1C 65364050 STPRLVFHQGJIQV-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CCn1cc(NC(=O)c2ccc(CN3CCC[C@H]3c3nc(C)no3)cc2)nn1 65371188 UVMJLIZYBOTURV-INIZCTEOSA-N 381.440 2.579 0 50 GFAA Cc1ccc(CN(CCN(C)C)C(=O)c2ccccc2NCC(=O)O)s1 65499144 XDVBQIXJSQGKCN-UHFFFAOYSA-N 375.494 2.757 0 50 GFAA Cc1c(C(=O)N2CCCC3(CCN(C)CC3)CC2)nnn1Cc1ccccc1 67489933 FQZPYIYKUVFNIU-UHFFFAOYSA-N 381.524 2.973 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3CCn4nc(CCC(=O)O)cc4C3)[nH]n2)cc1 72417943 CCONOIRSLLLOTI-UHFFFAOYSA-N 393.447 2.509 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)cc1 72446885 QIOFHSBGUJHZBQ-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1ccc(-n2nc(-c3ccccc3)n(CC(=O)N[C@@H](C)C3CC3)c2=O)cc1 77518304 KDPGAPURILULNK-HNNXBMFYSA-N 392.459 2.624 0 50 GFAA C[C@@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)c1c[nH]c(=O)c(Cl)c1 82126919 ATCOMTVUYFQRJL-SNVBAGLBSA-N 380.231 2.559 0 50 GFAA CN(C)CCN1C[C@@H](C(=O)NCc2cccc(Oc3ccccc3)c2)CC1=O 95362179 WLNMGWPMALRZDX-SFHVURJKSA-N 381.476 2.505 0 50 GFAA Cc1nc(CN2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)n(C)n1 95362460 FTIMUZAZQVUTTQ-UHFFFAOYSA-N 381.524 2.571 0 50 GFAA C[C@H](NC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1)C1=CCCCC1 96179672 ANHFAETYOXTDRT-INIZCTEOSA-N 387.480 2.935 0 50 GFAA CCCN(CC)c1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1 116108356 IQXMDEBCQLDYBS-UHFFFAOYSA-N 387.524 2.634 0 50 GFAA CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](N3CCCC3)C2)c1 127935490 NJARJGOTZTZYBS-FXAWDEMLSA-N 386.540 2.985 0 50 GFAA COc1cccc([C@H]2CN(C(=O)CNC(=O)c3ccc(C)c(C)c3)CCO2)c1 151353377 UBIIWRLNZPDSLP-HXUWFJFHSA-N 382.460 2.642 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1 170614969 GOXYNQATWDTYDL-XJKSGUPXSA-N 393.484 2.598 0 50 GFAA CC(C)c1nc(C(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)nn1-c1ccccc1F 174541423 NHGQRJGAYLRDGS-CYBMUJFWSA-N 387.459 2.659 0 50 GFAA COc1ccc([C@@H](NC(=O)NC2CCC(S(C)(=O)=O)CC2)C2CC2)cc1 174735218 PGHGNMVGEVZNEJ-VJFUWPCTSA-N 380.510 2.801 0 50 GFAA CS(=O)(=O)CC1(CC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)CC1 176514067 RWNFJYZMKSTCBL-UHFFFAOYSA-N 384.461 2.574 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)c2cc3c(cc2C)OCCO3)n1 222609752 WDRFMUSBLZZYHW-UHFFFAOYSA-N 381.354 2.856 0 50 GFAA CC(=O)c1cn(CC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c2ccccc12 225418398 KQEMDKDJLZBOBE-SJORKVTESA-N 389.455 2.652 0 50 GFAA biogenic COc1cc2oc(=O)cc(-c3ccccc3)c2cc1CCC(=O)N[C@H](C)CO 230208961 GROIRGFETZAWAX-CQSZACIVSA-N 381.428 2.898 0 50 GFAA biogenic Cc1ccc(-n2nc(C)c(CC(=O)N3CC[C@H](C(=O)O)C3)c2C)cc1Cl 237838779 YKLFPWWFZQYCRH-AWEZNQCLSA-N 375.856 2.927 0 50 GFAA CCc1ccc(CCNS(=O)(=O)c2ccc(CCNC(=O)OC)s2)cc1 252490903 LENRBXLYVURYIY-UHFFFAOYSA-N 396.534 2.730 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1nnn2c1CO[C@H](c1ccccc1)C2 263615932 GBTCFPAWBAVHGQ-SFHVURJKSA-N 378.388 2.573 0 50 GFAA Cc1ccc(C)n1-c1nc(CC(=O)N2CCN[C@@H](c3ccncc3)C2)cs1 367087176 WXHULWARFZEBKK-GOSISDBHSA-N 381.505 2.661 0 50 GFAA CCOC(=O)c1c(C)oc2nc(CN3CCC[C@@]4(CCCCO4)C3)nc(N)c12 369676570 QODIRUIXEIWIGF-FQEVSTJZSA-N 388.468 2.825 0 50 GFAA CN1C[C@]2(CCCN(C(=O)NCc3cc4cc(Cl)ccc4[nH]3)C2)OC1=O 426597229 NITRHBAIJFKTNF-SFHVURJKSA-N 376.844 2.948 0 50 GFAA COC(=O)c1csc(S(=O)(=O)N(C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1 433486139 JXUPXOVEWQVEHO-XHDPSFHLSA-N 381.475 2.547 0 50 GFAA O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)[C@@H](O)Cc2ccccc2)C1 474946584 NCIWXBLVLCQVCR-WBVHZDCISA-N 387.867 2.516 0 50 GFAA CN(C[C@H](O)COCc1ccc2c(c1)OCO2)C(=O)Nc1cccc(F)c1 888093119 XORDUFPNFWNDBO-INIZCTEOSA-N 376.384 2.596 0 50 GFAA C[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H](CC(=O)O)C(=O)N1 958528068 TXUUSELCFZFGJP-BFUOFWGJSA-N 394.427 2.599 0 50 GFAA CCn1c([C@@H]2Cc3cc(F)ccc3NC2=O)nnc1N1C[C@H](OC)CC[C@H]1C 1356270301 LNKKUAMUFIOSCX-WQVCFCJDSA-N 387.459 2.719 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)NC2(Cc3ccccc3)CC2)OCC(=O)N1C 1529099198 SYWBYJSSWKAMLS-RTWAWAEBSA-N 378.472 2.785 0 50 GFAA CCCn1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c(C)n1 1704298904 OIPZHDMEZRZCTD-OAQYLSRUSA-N 382.512 2.578 0 50 GFAA O=C(NCCC[C@@H]1CCOC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704311393 HSMRQIPFMTZLRU-MRXNPFEDSA-N 385.464 2.725 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)c2nn(C)cc2Cl)CC1 1704342353 NQUZVWLUXYWIDU-UHFFFAOYSA-N 375.856 2.786 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ccc(O)cn3)C1)CC2 1857714172 URPDXQWGBCMSKC-NRFANRHFSA-N 382.464 2.701 0 50 GFAA CNc1nccnc1N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857730118 YUQROSXJERENGH-NRFANRHFSA-N 389.463 2.560 0 50 GFAA Cc1ccc(CCC(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)cc1 1875246096 IHIZLSQILOJZNN-NFBKMPQASA-N 381.472 2.835 0 50 GFAA Cc1ccc(Cn2nc(C)c(CCC(=O)N3C[C@H]4CCC(=O)N[C@H]4C3)c2C)cc1 1875295931 AUPCCDRLESGIHX-CTNGQTDRSA-N 394.519 2.526 0 50 GFAA Cc1nc([C@@H]2CN(C)CC23CN(c2nnc(C(C)C)cc2C(F)(F)F)C3)n[nH]1 1875392021 RUYALUNOUBFLAS-ZDUSSCGKSA-N 395.433 2.581 0 50 GFAA CCn1cc(CN2CC[C@H]3[C@@H]2CCN3Cc2nc(-c3ccccc3)no2)cn1 2356135355 AORQUDKSVIMBHU-OALUTQOASA-N 378.480 2.802 0 50 GFAA N=c1cc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)c(-c2ccncc2)c[nH]1 2356151629 QNAHZCGHZWCFEB-UHFFFAOYSA-N 389.459 2.607 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N3CCC[C@@]4(CC3)CNC(=O)O4)cc2)c1C 2356157598 MNIGJLRGZAHAMR-OAQYLSRUSA-N 380.448 2.865 0 50 GFAA O=C(c1cc(-c2ccccc2)[nH]n1)N1CCc2nc(Cc3ccccc3)nn2CC1 2356170052 SHNMRIHZIOQIND-UHFFFAOYSA-N 398.470 2.958 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccn2)cc1C(=O)NC1CCCCC1 645326 AHPCVWWXBAGOLW-UHFFFAOYSA-N 389.477 2.954 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c(OC)cc1Cl 851091 ZFIDJHSKXQDIJJ-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA CC(=O)c1ccc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)cc2)cc1 1130680 ZCFFCIODCPZFDN-IBGZPJMESA-N 386.473 2.989 0 50 GFAA Cc1nnc(SCC(=O)Nc2nc(C)c3c(n2)CC(C)(C)CC3=O)s1 9052741 SSOJQAGHQDUQHN-UHFFFAOYSA-N 377.495 2.831 0 50 GFAA CC(=O)N[C@@H](C)C(=O)N1CCC[C@@H](c2nc(C)ncc2-c2ccc(F)cc2)C1 12217225 QVDQYUAUDFUVPF-SUMWQHHRSA-N 384.455 2.822 0 50 GFAA COCc1ccc(CN2CCC(N3CCC(C(=O)N4CCCC4)CC3)CC2)o1 12439754 ZGVWMKUGOMIMGE-UHFFFAOYSA-N 389.540 2.725 0 50 GFAA CCCCn1c(CN2C[C@H](C)O[C@H](C)C2)cnc1S(=O)(=O)CC1CCC1 20599181 CWQZOEZEYAUVAO-IYBDPMFKSA-N 383.558 2.866 0 50 GFAA COc1ccccc1N1CCN(Cc2c(C)n(C)n(-c3ccccc3)c2=O)CC1 23281685 ABYGUTOBLKCMAE-UHFFFAOYSA-N 392.503 2.815 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3nc4c(s3)CCC4)n2)c1 61718175 QYZQMUBFHKHNKI-UHFFFAOYSA-N 382.445 2.503 0 50 GFAA Cc1cc(C)c2nc(-c3cncnc3)cc(C(=O)N[C@@H](C)Cn3cncn3)c2c1 63833858 OIGVKONKPKJRKY-HNNXBMFYSA-N 387.447 2.719 0 50 GFAA Cc1cc(C(=O)N2CCOc3c(O)cc(-c4nc(C)cnc4C)cc3C2)[nH]n1 67756129 PSWLCOITPIZXSF-UHFFFAOYSA-N 379.420 2.532 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c(F)c1 67894767 QBVFQDFWHVLJRU-QGZVFWFLSA-N 389.515 2.789 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCN(c2ccc(OC)cc2)C(=O)[C@@H]1C 72150134 CFBICXKCAFJOOO-ZDUSSCGKSA-N 376.888 2.882 0 50 GFAA O=C1CC2(CCN(C(=O)[C@H]3CCOC3)CC2)CN1Cc1ccc(Cl)cc1 77357111 YQORTOGZLREPOA-INIZCTEOSA-N 376.884 2.718 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CCCn3ccnc3C)CC2)OC1=O 77375456 VXSXZSRXJNFTOX-INIZCTEOSA-N 376.501 2.974 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2C[C@@H](N(C)C)[C@H](c3ccc(C)cc3)C2)c1C 77457157 WCENXBDZRHPPHW-VQTJNVASSA-N 382.508 2.567 0 50 GFAA C[C@H](NS(C)(=O)=O)C(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1 91644587 QMCIFJKRGZLJLB-KRWDZBQOSA-N 386.517 2.533 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C[C@H]3CCCO3)CC2)c(Cl)c1 95501888 KDAAMLICAGRNEA-QGZVFWFLSA-N 396.915 2.738 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95519158 QYKNCWBJVZICPP-SFHVURJKSA-N 382.489 2.895 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)nc1 125166819 NALWUFPWLFIQEP-LBPRGKRZSA-N 380.231 2.781 0 50 GFAA O=C(Nc1ccccc1N1CCCC1=O)N[C@@H]1CCN(c2ncccc2F)C1 130374337 BSGAAIOMNXWSFQ-CQSZACIVSA-N 383.427 2.748 0 50 GFAA O=C(NC1CCN(CC(F)F)CC1)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 148458730 XSSCRPVEEREXHA-GFCCVEGCSA-N 385.842 2.539 0 50 GFAA CN(C)Cc1cccc(C(=O)N2CCN(C(=O)c3ccc(F)cc3F)CC2)c1 156140749 HGJYVFWQPGOECV-UHFFFAOYSA-N 387.430 2.625 0 50 GFAA C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)c3ccccc3)s2)[C@H]1CN 156631818 HGCRYQGRVRAIPS-ZFWWWQNUSA-N 378.519 2.780 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@H](CCO)C1CCCCC1 179401461 JXRCSWRUYKESPW-LJQANCHMSA-N 398.507 2.520 0 50 GFAA CCN(Cc1ccc(C(=O)N(C)C)cc1)c1nc2c(cnn2C(C)(C)C)c(=O)[nH]1 189703843 QMDMDOFHHCSBKD-UHFFFAOYSA-N 396.495 2.603 0 50 GFAA O=C(CN1CCC[C@@H]1C(=O)O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 238093110 AHKRMOLLHWCPFL-WIYYLYMNSA-N 391.471 2.965 0 50 GFAA CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1C=Cc3ccc4cccnc4c3N1[C@H]2C(C)=O 245255095 FMMIIWJTGVIPNO-CEAOBCPFSA-N 389.455 2.808 0 50 GFAA CCCNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 248027244 WLMPPYHRXPUOIQ-KUDNYVPYSA-N 376.840 2.941 0 50 GFAA O=C(CCOc1ccccc1-c1ccccc1)N1CCOC[C@@H]1c1nc[nH]n1 253416769 WFBVSAJRHFDSLE-GOSISDBHSA-N 378.432 2.841 0 50 GFAA CC(C)c1nnc([C@H]2CN(S(=O)(=O)C[C@H](C)c3ccccc3)CCO2)o1 328626324 LOFROOKBNOLEMB-GOEBONIOSA-N 379.482 2.700 0 50 GFAA Cc1nn(-c2ccccc2)c(N)c1-c1cccc(C(=O)N2CCCNCC2)c1 426369952 OKCALKHAGCVYIC-UHFFFAOYSA-N 375.476 2.865 0 50 GFAA COc1ccc(OCCCN)c(C(=O)N(C)Cc2n[nH]c3c2CCCCC3)c1 426533782 KYTYHXYUCWFRBL-UHFFFAOYSA-N 386.496 2.687 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)Cc3ncon3)csc2C1 426571603 LOMXGWYUUGLBTK-UHFFFAOYSA-N 387.465 2.566 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@H](C)CN(C)C)csc3C2)nc1 426582719 BSJLGDSSSQKZAB-OAHLLOKOSA-N 386.565 2.944 0 50 GFAA CC(C)c1nc(-c2ccc(C(=O)N3CCC[C@]4(CC3)CNC(=O)O4)cc2)no1 426698495 VSEAVGOYZOWWGQ-FQEVSTJZSA-N 384.436 2.965 0 50 GFAA O=C(NC[C@H]1CCN(Cc2ccccc2F)C1)N1CCC(Cn2ccnc2)CC1 584902995 UPXNWHIDTZWDJS-LJQANCHMSA-N 399.514 2.966 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)C12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2 670458873 KXRUGMKLXATCBU-MBWAJUJLSA-N 394.523 2.882 0 50 GFAA CC[C@H](C)C(=O)Nc1ccccc1NC(=O)c1ccc(Cn2cnnn2)cc1 822559930 GELKBVRTRIHOKQ-AWEZNQCLSA-N 378.436 2.958 0 50 GFAA O=S(=O)(CC1CCOCC1)N1CCC[C@@H](Cn2cnc3ccccc32)C1 919356677 NVBKQZZFOBKYHK-KRWDZBQOSA-N 377.510 2.505 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)NCCCN2CCC(O)CC2)c1C 1506428165 XSFVRNRAOACRKJ-UHFFFAOYSA-N 382.570 2.726 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)[C@H](N)Cc2ccccc2)CC1 1704300108 UVWNCCDOHSULJC-OAQYLSRUSA-N 380.488 2.656 0 50 GFAA O=S(=O)(N1CCCC1)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704312480 CYXHXIHPXVHCMA-NRFANRHFSA-N 398.532 2.764 0 50 GFAA Cc1oc(C(=O)N[C@H]2C[C@@H](Cn3cccn3)C[C@@H]2O)cc1COc1ccccc1 1857532729 NHFYWTZQIQHISY-UXPWSPDFSA-N 395.459 2.933 0 50 GFAA COCCn1cnnc1[C@H](C)n1ccnc1-c1cc2cc(C)ccc2nc1O 1857686639 ANGDPZGZNWVIGL-AWEZNQCLSA-N 378.436 2.960 0 50 GFAA O=C1C[C@H]2N(Cc3ccc(OCCc4ccccc4)cc3)CC[C@]23OCCN13 1857712742 FWCVHJAWRIXSNK-GGAORHGYSA-N 378.472 2.841 0 50 GFAA CCCOc1ccc(C(=O)N2C[C@@H](O)[C@]3(C2)[C@H](c2ccccc2)[C@H]3CO)cc1 1857721772 FPNOUXXCIHQHLR-YYTDSSBASA-N 381.472 2.684 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)C3(C)CCCCC3)CC(=O)N2[C@H]1c1ccccc1 1857734984 BDUKYHWHHQDULR-BJLQDIEVSA-N 398.503 2.930 0 50 GFAA Oc1nc(C2CC2)nc2c1CCC21CCN(c2nnnn2-c2ccccc2)CC1 1857737775 CFVVSCZUKKJIFB-UHFFFAOYSA-N 389.463 2.520 0 50 GFAA CCc1nnc2n1C[C@H](NC(=O)N1CCC[C@@H](c3cc(O)cc(F)c3)C1)CC2 1875293917 HSCDANQGMMUKQZ-CZUORRHYSA-N 387.459 2.589 0 50 GFAA COc1ccc([C@@H](NC(=O)[C@H](C)Oc2ccc3c(c2)CCC3)C(=O)O)cc1O 1875322800 IMFBMTLMOIYNSY-HXPMCKFVSA-N 385.416 2.599 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@H]2Cc3n[nH]cc3[C@@H](C(F)(F)F)C2)cc1 1875368901 DOPNHNUHGZEMAM-OCCSQVGLSA-N 378.354 2.925 0 50 GFAA CCn1c(=O)n(CC)c2cc(NS(=O)(=O)c3cnc(C4CC4)o3)ccc21 2325808571 CPDYTGQFGDAPEI-UHFFFAOYSA-N 376.438 2.509 0 50 GFAA C[C@@H]1CCc2nc(NC(=O)CSc3nnnn3-c3ccccc3)sc2C1 1262540 IOCYTRHTIGRUAY-LLVKDONJSA-N 386.506 2.974 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cs1 2356145417 AZHXJXIZISDQGT-HXUWFJFHSA-N 385.537 2.747 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@@H]3CC(C)=C(C)C[C@H]3C(=O)O)CC2)c1 6727038 NMRKHYOCKIUMBD-WOJBJXKFSA-N 386.492 2.787 0 50 GFAA O=C(Nc1cccc(F)c1)OC1CN(c2cc(C(F)(F)F)nc3ncnn23)C1 225815002 DYSFTSSNMJADQX-UHFFFAOYSA-N 396.304 2.720 0 50 GFAA O=C(c1ccc2nnc(S)n2c1)N1CCC[C@@H]1c1cccc2c1OCCO2 225803032 ZTLRDFLCSQDCBR-CQSZACIVSA-N 382.445 2.767 0 50 GFAA CN(C)C(=O)CN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67847452 YQWHDDOCHKSYEX-UHFFFAOYSA-N 383.473 2.952 0 50 GFAA CN1C(=O)C[C@H](c2nc(-c3nc[nH]n3)no2)[C@H]1c1ccc(Cl)c(Cl)c1 350191235 NHKUEHYIOREKBM-QPUJVOFHSA-N 379.207 2.849 0 50 GFAA CCOC(=O)c1ccc(C(=O)OCC)c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c1 5871087 LMIYGGSMPMMYTQ-KBPBESRZSA-N 389.404 2.646 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cnn2ccccc12 71278780 PRVGTWGVIXSNEN-UHFFFAOYSA-N 386.459 2.733 0 50 GFAA CN(C)c1nc(-c2ccccc2)nc2c1CCN(C(=O)c1n[nH]cc1Cl)C2 72121087 BNOXKBNMRBXQIJ-UHFFFAOYSA-N 382.855 2.785 0 50 GFAA C[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)c1ccc2nnn(C)c2c1 253417902 LRSRRYWARJTRFC-ZDUSSCGKSA-N 375.473 2.782 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)o1 363237418 KHDRRZINHUQMLJ-QGZVFWFLSA-N 381.436 2.706 0 50 GFAA Cc1cc(-c2noc([C@@H](C)NC(=O)NCC3CCN(C)CC3)n2)ccc1F 363853297 JUIZBSXGXVWPOD-CYBMUJFWSA-N 375.448 2.886 0 50 GFAA COc1ncc(CN2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 71747752 LZSWUSJOMWFIJN-IBGZPJMESA-N 386.471 2.883 0 50 GFAA Cc1nc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3CCc3ccccc3)C2)c(C)o1 72469004 GZNHPGLAIODXCB-RBUKOAKNSA-N 381.476 2.987 0 50 GFAA COc1cccc(C[C@H]2CN(C(=O)c3cc4c(nc3OC)CCC4)CCO2)c1 71751193 HJRVWSCWZMWCEE-SFHVURJKSA-N 382.460 2.671 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(N)nc2)CCC(=O)N1Cc1ccc(F)cc1 71747827 SCXARXZAYZVZME-SFHVURJKSA-N 384.455 2.702 0 50 GFAA Cc1[nH][nH]c(=O)c1CC(=O)N[C@@H]1CCCN(Cc2ccc(CC(C)C)cc2)C1 72161764 DLUYPLOLIDDLAG-LJQANCHMSA-N 384.524 2.533 0 50 GFAA Cc1ccc2[nH]c(C3CCN(c4cc(C5CC(N)C5)nc(N)n4)CC3)nc2c1 219810022 RVUPTFBQHXWIEJ-UHFFFAOYSA-N 377.496 2.832 0 50 GFAA COCCCn1cnnc1[C@H](C)NC(=O)c1cc2c(Cl)cccc2n1C 216104456 PPWQZSAKFKJFQP-LBPRGKRZSA-N 375.860 2.951 0 50 GFAA COC(=O)c1cn([C@@H]2CCCC[C@H]2OC(=O)c2ccc(N(C)C)cc2F)nn1 240278279 DPZPDRPUHPGAAB-IAGOWNOFSA-N 390.415 2.611 0 50 GFAA COc1cccc(-c2noc(CCCC(=O)N3CCC[C@@H]3c3n[nH]c(C)n3)n2)c1 426428692 CCJJSPGHAYWCED-MRXNPFEDSA-N 396.451 2.858 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)N[C@@H](C)c3ccc(C)nc3)CC2)c1 426422929 NFBTXIYYPWRIFM-INIZCTEOSA-N 382.464 2.627 0 50 GFAA Cc1ccn2cc(CNC(=O)N(C)C[C@H]3CC(=O)N(C4CCCC4)C3)nc2c1 426428320 MHTCREIFQUJXPD-MRXNPFEDSA-N 383.496 2.575 0 50 GFAA CN(CC(=O)N1C[C@H]2CC[C@@H]1CN(Cc1ccc(F)cc1)C2)Cc1cccnc1 95377191 VGIWKMBGSAKMMP-RBBKRZOGSA-N 396.510 2.776 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ccc[nH]1 95519689 LPJKMFDMMGCCBU-SFHVURJKSA-N 381.520 2.983 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccc(F)cc3)C2)CN1CCc1c[nH]cn1 91304151 FTKWWFITKHTTRI-NRFANRHFSA-N 384.455 2.636 0 50 GFAA Cc1ncnc(N[C@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)c1C 91518793 FCVQDIRXBSPRSL-KRWDZBQOSA-N 382.512 2.970 0 50 GFAA CCS[C@@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91504033 ZGFPWLCVLDPDIJ-INIZCTEOSA-N 375.538 2.954 0 50 GFAA Cc1ccccc1-c1cccc(C(=O)N2CCN(CCn3cncn3)CC2)c1 240825164 QNPBMIRVNNWFMV-UHFFFAOYSA-N 375.476 2.712 0 50 GFAA O=C(Cc1cccs1)N1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 244701153 KBDGXDRFIKFOQC-QAQDUYKDSA-N 390.549 2.825 0 50 GFAA CC[C@@H](C)[C@@H](CO)NC(=O)C1CCC(Cn2cnc3ccccc3c2=O)CC1 252484086 FOFNAKDSIJPAQC-FLAIETJXSA-N 385.508 2.726 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCc3ccccc3Cn3cccn3)C2)no1 371524810 UWROQJDSDMYFKY-GOSISDBHSA-N 380.452 2.712 0 50 GFAA C[C@H](NC(=O)C(=O)N[C@@H]1C[C@H]2C=C[C@H]1CC2)c1ccc(-c2cncnc2)cc1 1875271404 FNOQEZABRPAZKR-BPQOCRPUSA-N 376.460 2.792 0 50 GFAA COc1ccc(CN2CCC[C@H]2c2nc3ccccc3[nH]2)cc1OCC(N)=O 1875261978 OXSIXZKMKYCGBB-KRWDZBQOSA-N 380.448 2.773 0 50 GFAA CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cncc(C(=O)O)c1 1875268912 KPRBMZHDVHSCFG-IBGZPJMESA-N 381.476 2.983 0 50 GFAA Cn1cc2c(n1)[C@@H](O)CC1(CCN(Cc3cnc(-c4ccccc4)nc3)CC1)O2 1875394028 YQVUVBFUESYNJB-SFHVURJKSA-N 391.475 2.728 0 50 GFAA C[C@@H](NC(=O)c1cc2c(cc1F)CCNC2)c1ccccc1N1CCOCC1 1875304240 DQNXTJMQCOPDBH-OAHLLOKOSA-N 383.467 2.799 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2ccc(NC(=O)OCC)cc2Cl)[C@@H](C)C1 1875381295 PXLJIHNUOAYHHJ-LBPRGKRZSA-N 379.844 2.767 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N2CCC[C@]23CCC[S@@](=N)(=O)C3)c1 1875395952 QUDGZUAMLOWHMZ-NIYFSFCBSA-N 377.510 2.594 0 50 GFAA O=C1NCCCC[C@H]1Cc1nc(-c2ccc(OCCN3CCCC3)cc2)no1 952845613 GURBFAWIURIBAY-KRWDZBQOSA-N 384.480 2.670 0 50 GFAA NC(=O)c1cccnc1N1CCN(C(=O)C2c3ccccc3-c3ccccc32)CC1 952870309 VOXGFBHFLFSTRB-UHFFFAOYSA-N 398.466 2.642 0 50 GFAA CC(C)=CC(=O)N1CCC(N(Cc2ccccn2)C(=O)c2cc(C)ncn2)CC1 1775997204 XZYBNJBPMHPJGJ-UHFFFAOYSA-N 393.491 2.780 0 50 GFAA O=C(CN1[C@H](C(=O)O)C[C@H]2CCCC[C@@H]21)Nc1ccc(Br)cn1 274715139 AWPZCEMQTYBTFZ-WXHSDQCUSA-N 382.258 2.500 0 50 GFAA Cc1noc([C@H]2CCCN(C(=O)C(=O)N3CC4(CCC4)c4c(F)cccc43)C2)n1 407987908 FWYYWYXPRLSISN-AWEZNQCLSA-N 398.438 2.692 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)Nc3cccc(-c4noc(C)n4)c3)C2)n(C)n1 277913615 PDYXVJUZPIKJJF-QGZVFWFLSA-N 395.467 2.877 0 50 GFAA CC(C)(C)C(=O)Nc1ccncc1C(=O)N[C@H]1CCCN(c2ccccc2)C1=O 170595223 JCMRAKUPPPHWGS-SFHVURJKSA-N 394.475 2.992 0 50 GFAA CCNC(=O)N1CCc2ccc(NC(=O)c3cn(-c4cccc(C)c4)nn3)cc21 170640352 QJOQFHTUQXSGRR-UHFFFAOYSA-N 390.447 2.920 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1)C2 171799597 FYYNSRHSGICUAD-VQTJNVASSA-N 397.519 2.959 0 50 GFAA O=C1CC[C@H](NC23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)CCN1CC1CC1 1506415737 CAJLIUMMCXIGCE-ITPHGFLGSA-N 383.540 2.707 0 50 GFAA C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1ccc2c(c1)ncn2CCO 1506401485 SAPRZMXCNRRODK-AWEZNQCLSA-N 381.432 2.633 0 50 GFAA CN(CC1CCN(Cc2ccccc2)CC1)c1nccc(N2CCC[C@@H](O)C2)n1 1529195945 RYLYRTNRVHRGEK-OAQYLSRUSA-N 395.551 2.786 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCC(c4nc(C(C)C)no4)CC3)c12 1529172449 MFAWCIWPHYPUKR-UHFFFAOYSA-N 384.440 2.865 0 50 GFAA CSCCCN1C(=O)CC[C@@H]2CN(C(=O)c3cccc(C)c3O)CC[C@@H]21 219681561 MJSPTCWWDQLMSV-WBVHZDCISA-N 376.522 2.907 0 50 GFAA CC[C@H]1CN(C(=O)c2c(NCCOC)noc2-c2ccc(Cl)cc2)CCN1 1704329689 AUJAYOUFNSBHCY-HNNXBMFYSA-N 392.887 2.877 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2nc3ccccc3[nH]2)cc1OC 1704280519 RBWLXJZTLZFCQV-TZIWHRDSSA-N 383.448 2.515 0 50 GFAA O=C(c1scc2c1OCCO2)N1CCCN(Cc2cn3ccccc3n2)CC1 1772704394 LYOZSGSOEMFOAN-UHFFFAOYSA-N 398.488 2.515 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCCC[C@@H]3CO)no2)c(Cl)c1 12056034 WULWYDLBRUPZRG-GFCCVEGCSA-N 380.828 2.903 0 50 GFAA COc1cccc(OCc2cc(C(=O)N(C)Cc3n[nH]c4c3CCCC4)n[nH]2)c1 12300517 DVQJNVSICCFQCH-UHFFFAOYSA-N 395.463 2.871 0 50 GFAA Cc1ccc2nc(CNC(=O)[C@H]3CCC(=O)N(Cc4ccccc4F)C3)cn2c1 12301356 AJVZXAHPESHOGN-KRWDZBQOSA-N 394.450 2.837 0 50 GFAA CCN1CCc2c(c(C(=O)NCc3ccccn3)nn2CCc2ccccc2)C1 14535546 GADWXEWQCWRORG-UHFFFAOYSA-N 389.503 2.829 0 50 GFAA CN(C[C@H]1Cc2ccccc2O1)C(=O)CC[C@@]1(Cc2ccco2)CCC(=O)N1 14989272 RFHKRNSSBWLFIX-XMSQKQJNSA-N 382.460 2.713 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N[C@H]3C[C@H]4CO[C@@H](CCO)CN4C3)cc2)c1 1857706030 HHJOSYRSLBVSOM-IPJJNNNSSA-N 396.487 2.741 0 50 GFAA O=C(COc1ccc(-c2nccn2C2CCOCC2)cc1)NC[C@@H]1CCCO1 1857709809 SKXGKVUXAUFFTD-IBGZPJMESA-N 385.464 2.576 0 50 GFAA N[C@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@H]1CCCN(c3nc4cc(Cl)ccc4o3)C1)C2 1857727282 PADDOYIGRSOVFX-AHXJXLJNSA-N 388.899 2.893 0 50 GFAA Cc1ccc2c(c1)CCCN2C(=O)CN1C(=O)[C@]2(CCNC2)c2ccccc21 1875247158 YBEMGGAVRBTISD-QHCPKHFHSA-N 375.472 2.552 0 50 GFAA COc1ccc(-c2noc(C3=NN(Cc4ccc(F)cc4)C(=O)CC3)n2)cn1 109591802 MAPCZAUXZPCRAN-UHFFFAOYSA-N 381.367 2.806 0 50 GFAA COc1cccc(-c2cc(C(=O)N[C@@H]3CCN(C(=O)C4CCCC4)C3)[nH]n2)c1 127188090 KHTYAKMSLOWQBO-MRXNPFEDSA-N 382.464 2.606 0 50 GFAA COc1ccc(Cl)cc1-n1c(S)nnc1Cn1ncc2ccccc2c1=O 5796242 LNOWFVCLBSNYEQ-UHFFFAOYSA-N 399.863 2.976 0 50 GFAA O=C(N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1cnn([C@@H]2CCS(=O)(=O)C2)c1 2325779851 KMUQLKNILRRIGL-KBRIMQKVSA-N 393.896 2.572 0 50 GFAA O=C(N[C@@H](c1ccccc1)[C@H](O)c1ccccc1)C1=NN[C@H](C(F)(F)F)C1 2325804469 RENKAEHHOWYDHR-YESZJQIVSA-N 377.366 2.858 0 50 GFAA COCCOCCCc1nc(-c2nc3cc(Br)ccc3[nH]2)no1 2325806713 CADPLNZSXPSKRB-UHFFFAOYSA-N 381.230 2.971 0 50 GFAA Cc1cc(-c2cccc3c2OCC(=O)N3)ccc1C(=O)N1CCC[C@H](C(=O)O)C1 2325806732 CYNUNNLEAOEIIB-HNNXBMFYSA-N 394.427 2.930 0 50 GFAA CC(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)NC(=O)CC1CCCCCC1 2325878995 DROUGKUAQXVXJH-SFHVURJKSA-N 381.561 2.909 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)CC1 2325888440 SOJKGSYNOQDOLL-QGZVFWFLSA-N 380.847 2.804 0 50 GFAA Nc1c(C(=O)NCCc2ccccc2)nnn1-c1cccc(C(F)(F)F)c1 2957666 KWTVIZHDUUGIAH-UHFFFAOYSA-N 375.354 2.841 0 50 GFAA O=C(NCC(=O)N1CCN(c2ccccc2F)CC1)c1ccc(Cl)cc1 6703962 GGUHPUIGPKYZNF-UHFFFAOYSA-N 375.831 2.558 0 50 GFAA O=C(O)COc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccccc3)C2)cc1 414338692 RTGYUNNRLHCRTJ-MRXNPFEDSA-N 375.446 2.718 0 50 GFAA Cc1noc(CCNC(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)n1 112449940 PLWAXFFRBFWILW-OAHLLOKOSA-N 382.424 2.907 0 50 GFAA Cc1ccnc(S[C@H]2CC(=O)N(c3ccc(Br)cc3)C2=O)n1 100115771 PHMQTEFASBURGQ-LBPRGKRZSA-N 378.251 2.972 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cn(C)c4ccccc34)C[C@H]2CCO)CC1 104636293 OVRIJMIJXVOYRH-JOCHJYFZSA-N 398.595 2.920 0 50 GFAA O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(OC(F)F)cn1 469866197 LVGNGNSZVVGMLQ-KRWDZBQOSA-N 391.418 2.704 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCN(C(=O)c4ccco4)CC3)cc2)n1 27970422 OYLXATSQBJNJSP-UHFFFAOYSA-N 392.459 2.739 0 50 GFAA O=C(c1cc(CN2CCC(O)CC2)on1)N1CCC(Cc2ccccc2)CC1 67740006 LARYNZOQPFKLFH-UHFFFAOYSA-N 383.492 2.726 0 50 GFAA C[C@H](c1ccccc1)N1C[C@H](C(=O)N2CCC(c3ccnn3C)CC2)CC1=O 124354710 HKFAMGOWBOMOIE-VQIMIIECSA-N 380.492 2.736 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)CCc2nnc(CCc3ccccc3)o2)n1 11817708 KGPWBABTFHHXHZ-MRXNPFEDSA-N 381.480 2.806 0 50 GFAA CCn1c(NC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)nc2cccnc21 477391813 ILKIDLLTZPYDAV-UHFFFAOYSA-N 384.827 2.887 0 50 GFAA Cc1ccc(CN2CCN(C(=O)c3nc4cc(C)ccn4c3F)CC2=O)cc1 77487481 HAHDZHVVODNJHC-UHFFFAOYSA-N 380.423 2.575 0 50 GFAA CCc1nc(CN(C)Cc2nc(-c3cc(OC)c4c(c3)OCO4)oc2C)no1 72473440 QUSRXGLBUBWATQ-UHFFFAOYSA-N 386.408 2.965 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@@H](C(=O)N3Cc4ccccc4C3)C2)CC1 71747791 JKEJCBSJPXSZKK-HXUWFJFHSA-N 381.520 2.642 0 50 GFAA Cc1cnc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 71754491 PCPOWNUSTLOHTH-IBGZPJMESA-N 384.455 2.823 0 50 GFAA CNC(=O)c1cccc(S(=O)(=O)N[C@H]2CCCN(C3CCCCCC3)C2)c1 72143669 DBFKWXUFQSKVOW-KRWDZBQOSA-N 393.553 2.512 0 50 GFAA O=C(O)C1(Oc2ccccc2)CCN(c2nc3ccccc3n2CCO)CC1 82096643 NXQJGLLOULHWOI-UHFFFAOYSA-N 381.432 2.531 0 50 GFAA Cc1cnc(C)c(-c2ccc(C(=O)N3CCN(C4CCCC4)C(=O)C3)cc2)n1 426563056 PEQPUWJDLLBEQE-UHFFFAOYSA-N 378.476 2.987 0 50 GFAA CC[C@@]1(CNC(=O)c2ccccc2OCC(=O)N(C)C)OCCc2ccccc21 291205793 LPDOTYAYXSLTNZ-QHCPKHFHSA-N 396.487 2.762 0 50 GFAA Cn1nnnc1SCCNC1CCN(c2cccc(-c3ccco3)c2)CC1 82039611 UCXLWIFJXFOQEX-UHFFFAOYSA-N 384.509 2.821 0 50 GFAA CSCC[C@@H](NC(=O)N(C)Cc1cnn(-c2cccc(C)c2)c1)C(=O)O 426489729 XQHRFPSLKSXKFT-MRXNPFEDSA-N 376.482 2.528 0 50 GFAA Cc1ccc(-c2cccc(C(=O)NCCCN3CCC(C(N)=O)CC3)c2)cc1 426411590 XNYDWRWCLUGING-UHFFFAOYSA-N 379.504 2.979 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)c3cncnc3C)C2)cc1 95504476 ONYJVPIPAFHVFP-IBGZPJMESA-N 382.508 2.820 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1ccc(-n3cccn3)cc1)C2 91440558 KAMBDIZRUCDGOU-OXJNMPFZSA-N 378.476 2.735 0 50 GFAA Cc1cc2cc(C(=O)N3C[C@H]4CC[C@@H]3CN(C(=O)c3cnccn3)C4)ccc2o1 95371668 UZYHQZQPBLPUPC-MAUKXSAKSA-N 390.443 2.908 0 50 GFAA CC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(Cl)s1)CC2 92045862 SZEHSNIHSDEHNN-UHFFFAOYSA-N 378.885 2.661 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@]3(CCC(=O)N(C4CC4)C3)C2)cc1C 91254588 SSDFZSQYRSEUEE-FQEVSTJZSA-N 376.522 2.859 0 50 GFAA Cn1c2c(cc(C(=O)N3CCC[C@@H](c4ccc(C(=O)O)cc4)C3)c1=O)CCCC2 95367565 QWQMWHBRNJMXKI-GOSISDBHSA-N 394.471 2.982 0 50 GFAA Cc1ccc([C@H]2COCCN2C(=O)c2ccc(-n3ncc(C(=O)O)c3C)cc2)o1 237665232 ITDMGGPVVBCXBZ-GOSISDBHSA-N 395.415 2.994 0 50 GFAA COc1ccc(CNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)cc1C(=O)O 299741101 CTKMIYBCYVHMLU-KRWDZBQOSA-N 385.416 2.881 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N2CC[C@@H](N)C[C@H]2C)cc1Cl 299739434 OHLPVXQOQYASSV-RKDXNWHRSA-N 397.722 2.611 0 50 GFAA C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N(CCC(=O)O)C1CCOCC1 299751328 QKAVOYUUMMZFNS-GFCCVEGCSA-N 389.370 2.955 0 50 GFAA O=C(O)CN1CCC(NC(=O)N2CCC(CCCc3ccccc3)CC2)CC1 827910712 XKMBEDFISKVPJV-UHFFFAOYSA-N 387.524 2.980 0 50 GFAA O=C(c1nnc(O)c2ccccc12)N1CCN([C@@H]2CCc3ccccc3C2)CC1 828210169 VWRWITSACQCTOI-GOSISDBHSA-N 388.471 2.651 0 50 GFAA O=C1C[C@@H](NC(=O)N2CCCN(c3ccccc3)CC2)CN1Cc1ccccc1 584890159 WLYYXFXQOAYULZ-HXUWFJFHSA-N 392.503 2.709 0 50 GFAA O=C1NCCCC[C@@H]1Cc1nc(-c2ccc(OCCN3CCCC3)cc2)no1 952845614 GURBFAWIURIBAY-QGZVFWFLSA-N 384.480 2.670 0 50 GFAA COc1ccc(OC)c([C@H](O)[C@H](C)NC(=O)C23CCC(OC)(CC2)CC3)c1 1875271772 LMECSZZUKWSQPO-UXSQBNGPSA-N 377.481 2.981 0 50 GFAA CNC(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(F)c(C(F)F)c1)C2 1875394341 FZTOFMJVULFKLV-ZWKOPEQDSA-N 379.338 2.739 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@H]([C@H]3CCCCN3c3ncc(F)cn3)C2)n1 1875312494 MZQWPSSIJDGHNP-MAUKXSAKSA-N 386.475 2.743 0 50 GFAA CC(C)(C)OC(=O)N1CCS[C@H]1C(=O)NCCC(=O)OC1CCCCC1 1875305759 HDEPCADQOUFFFS-INIZCTEOSA-N 386.514 2.679 0 50 GFAA COc1ccnc(N2CCC[C@@H](CNC(=O)c3cc(Cl)ccc3F)C2)n1 952991000 KXEKTUQLXPWSLL-LBPRGKRZSA-N 378.835 2.924 0 50 GFAA O=C(Nc1ccc2ncsc2c1)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@@H]3C2)C1 888102295 PAFPWZRFHWKHRO-VNQPRFMTSA-N 399.520 2.646 0 50 GFAA CCc1nnc([C@H]2C[C@@H](O)CN2C(=O)c2csc(Cc3ccc(C)cc3)n2)o1 1775959326 WFURWYPOEJWRDN-GDBMZVCRSA-N 398.488 2.936 0 50 GFAA Cc1cccc(S(=O)(=O)N2C[C@@H]3CC[C@H]2CN(Cc2c(C)noc2C)C3)c1 1565531023 MCFQGLJQUXJTSS-MSOLQXFVSA-N 389.521 2.885 0 50 GFAA COc1cc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc(OC)c1C 1324216299 BNMJMMOPSXOKIN-UHFFFAOYSA-N 376.434 2.698 0 50 GFAA CN(CC(=O)O)C1CCN(C(=O)c2cc(Br)ccc2Cl)CC1 186626576 DWWOEHJEFUDABH-UHFFFAOYSA-N 389.677 2.724 0 50 GFAA CCN1C(=O)CCc2cc(NC(=O)N[C@H]3CCCO[C@@H]3c3nccn3C)ccc21 276003304 PFWCXFZBBSBCHL-LPHOPBHVSA-N 397.479 2.761 0 50 GFAA CC(C)(C)c1cnc(CN2CCC[C@@H](c3[nH]ncc3CN3CCOCC3)C2)o1 276124402 XZBIBJQUFAIRBU-MRXNPFEDSA-N 387.528 2.907 0 50 GFAA C[C@H]1CN(Cc2ccccc2NC(=O)N2CCc3ccnc(O)c3C2)C[C@H](C)O1 276949519 OOGPBYFVZCGBIV-HOTGVXAUSA-N 396.491 2.987 0 50 GFAA O=C1C[C@H](Cc2ccccc2)C(=O)N1C[C@H](O)COc1cccc2[nH]ccc12 191403129 MFKYYGNFNMMXCC-IRXDYDNUSA-N 378.428 2.525 0 50 GFAA OC[C@H]1CCCN(c2cc(NCc3ccc(-n4ccnc4)c(F)c3)ncn2)C1 110280455 VGFGCQCGMVWHFC-INIZCTEOSA-N 382.443 2.622 0 50 GFAA CCc1nnc(-c2cccc(NC(=O)C3=C(C)N(C)c4ncnn4[C@@H]3C)c2)o1 195291091 GERIAJYYUNQBPL-GFCCVEGCSA-N 379.424 2.814 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NCc2cn3c(n2)SCC3)s1 1506400113 TWZWVNYBDIVDNV-UHFFFAOYSA-N 396.519 2.801 0 50 GFAA C[C@@H]1C(=O)N2CCC[C@H]2CN1Cc1ccccc1CS(=O)(=O)c1ccccc1 1772703349 FMBYTKLWNLLHKB-XLIONFOSSA-N 398.528 2.856 0 50 GFAA Cc1c(CNC(=O)c2cc(COc3ccc4ncccc4c3)on2)cnn1C 11662143 PTRMXCUZEQLERW-UHFFFAOYSA-N 377.404 2.774 0 50 GFAA CN1CCC(N2CCC(Oc3cccc(C(=O)N4CCCCO4)c3)CC2)CC1 11933841 PIVQERVWULWBIN-UHFFFAOYSA-N 387.524 2.792 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CCC[C@H](O)C1 12446515 LLDVQTJVLMRIDZ-SFHVURJKSA-N 378.476 2.563 0 50 GFAA CC1CCN(S(=O)(=O)c2ccc(OCC(=O)NC3CCCC3)cc2)CC1 16527313 YELZGJSIGDMSKP-UHFFFAOYSA-N 380.510 2.545 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3ccc(Cl)cc3)C2)c1C 1857531465 YOTRTGYYCLRHPH-QGZVFWFLSA-N 387.915 2.817 0 50 GFAA CCSCC(=O)N1CC[C@@H](O)[C@]2(CCCN(C(=O)CC3CCCCC3)C2)C1 1857694329 LIGHMHQNJXWTDZ-NQIIRXRSSA-N 396.597 2.912 0 50 GFAA O=C(CNc1ccc(F)cc1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857718294 RYCGDAMXTAZZIU-JQVVWYNYSA-N 395.434 2.539 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@]23CC[C@H]1O3)c1ccccn1 1857736395 RSVNUDKIFNKQKZ-XHYAQGIWSA-N 381.451 2.630 0 50 GFAA COC(C)(C)CC(=O)N1CCC2(CC1)C[C@H](O)c1nn(C3CCCC3)cc1O2 1875394372 HDXWLNWPUORFEK-INIZCTEOSA-N 391.512 2.990 0 50 GFAA Cc1sc2ccc(Cl)cc2c1S(=O)(=O)N1CC[C@@H](N2CCNCC2)C1 262350105 UIWPNOMJNQDYRQ-CQSZACIVSA-N 399.969 2.531 0 50 GFAA Cc1ccc([C@H](O)[C@@H](C)NC(=O)CCn2cc(Br)cn2)cc1F 2325800233 YZTUBTBCLWFHOU-BDJLRTHQSA-N 384.249 2.722 0 50 GFAA O=C(CN1CCCS1(=O)=O)NC1(Cc2ccc(Cl)cc2Cl)CCC1 2325820216 HDHVPBKTGFPYSZ-UHFFFAOYSA-N 391.320 2.610 0 50 GFAA COc1ccc(C(=O)NCCc2nc3ccc(C(=O)O)cc3[nH]2)c2ccncc12 2325875340 OHXBUYQGCIAWSN-UHFFFAOYSA-N 390.399 2.790 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccccc1)c1cccc(Br)c1 821141 QFAXTUISQZHAGA-UHFFFAOYSA-N 383.267 2.854 0 50 GFAA COc1ccc(CONS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1Cl 1125121 NGEVBVBZRCYKHK-UHFFFAOYSA-N 384.841 2.717 0 50 GFAA O=C(O)CCCNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1Cl 2982107 BNRYRSDHLOTUQX-RVDMUPIBSA-N 376.796 2.685 0 50 GFAA CCc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)N2CCOCC2)c1 6697498 JEAKHYOAAPEASR-UHFFFAOYSA-N 388.489 2.831 0 50 GFAA CCCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2cccc(Br)c2)C1 6743775 OEKOEPJEDVWRCU-GFCCVEGCSA-N 389.315 2.839 0 50 GFAA Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CN4CCCCC4=O)C3)C2)c1 12073193 GYXWUSRIRGPXCY-HSZRJFAPSA-N 383.536 2.822 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(N(C)Cc3nccn3CC)nc2)CCN1C(C)C 12302742 PQTHPWYUMXITNP-IBGZPJMESA-N 398.555 2.879 0 50 GFAA Cc1nonc1[C@H]1CCCN1C(=O)c1coc(Cn2cnc3ccccc32)n1 12434946 OFPRJAZCXUTESP-MRXNPFEDSA-N 378.392 2.741 0 50 GFAA COC[C@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CC2CCCCC2)C1 12446451 KYJKWDKAPOAUAR-KRWDZBQOSA-N 383.558 2.725 0 50 GFAA COCCN1C(=O)N(CC(C)C)C(=O)C12CCN(CCc1ccccc1)CC2 14532565 XFNOQRZPVFTZLW-UHFFFAOYSA-N 387.524 2.630 0 50 GFAA CCN1CCN(CC(=O)N2CCC[C@H](CCc3ccc(F)cc3F)C2)CC1 20538147 ZTUNZOWNVYRTQI-QGZVFWFLSA-N 379.495 2.774 0 50 GFAA Cc1ccccc1-c1cccc(N2CCC(NCCc3n[nH]c(=O)[nH]3)CC2)c1 23380008 BBGQKJYXSGSVQP-UHFFFAOYSA-N 377.492 2.875 0 50 GFAA Cn1c2c(cc(-c3ccccc3Cl)c1=O)CN(C(=O)c1cnccn1)CC2 23581553 IBFGNWXJHZWUON-UHFFFAOYSA-N 380.835 2.694 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)C1 54104275 AFOURSBHZGYIQY-IAQYHMDHSA-N 399.274 2.900 0 50 GFAA CCNc1cc(N2CCN(C(=O)c3c(F)cccc3Cl)CC2)nc(C)n1 65364572 CFTYHMDMWPSVPT-UHFFFAOYSA-N 377.851 2.972 0 50 GFAA CCc1cc(-c2ccc([C@@H](C)N3CCOCC3)cc2)nc(N2CCOCC2)n1 65527584 NTYPDRCRMDFHRP-QGZVFWFLSA-N 382.508 2.936 0 50 GFAA COC(C)(C)C(=O)N1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67974027 CFAUWQWGRCGGBF-UHFFFAOYSA-N 380.492 2.706 0 50 GFAA O=C(O)c1cc(-c2cccc3ncccc23)cc(S(=O)(=O)N2CCOCC2)c1 71764862 VCGWKXUCWIUGGG-UHFFFAOYSA-N 398.440 2.621 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)CCc3cccnc3)C[C@H]2NC(=O)C2CC2)cc1 77555960 AKQOBVQWZNKUGM-LEWJYISDSA-N 377.488 2.843 0 50 GFAA Cc1cc(C)c(CN2CCC(Cc3nnc(CO)n3C)CC2)c(-n2cccn2)c1 82171028 CXOJPOISGXVKEI-UHFFFAOYSA-N 394.523 2.565 0 50 GFAA CC(=O)c1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3CC(C)C)n(C)c1 91586090 XWPOFNSPYWFUSD-UHFFFAOYSA-N 383.540 2.956 0 50 GFAA Cc1cccc(-n2cc(CNC(=O)c3cnc(-c4cccnc4)nc3O)cn2)c1 91616601 CNOWJABCJVBHLA-UHFFFAOYSA-N 386.415 2.668 0 50 GFAA CCN(CC)S(=O)(=O)N[C@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1 91620519 CMICLMFXZFMOQS-INIZCTEOSA-N 384.452 2.704 0 50 GFAA O=C(NCCc1ccncc1)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 92099656 CXCCPQBBDVFGTP-UHFFFAOYSA-N 378.476 2.605 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)cc1=O)N1CCC(c2ccccc2)CC1 95525537 GJCYFVXLDWSRJP-UHFFFAOYSA-N 380.492 2.640 0 50 GFAA O=C(c1ccn(C(F)F)n1)N1CCC(c2nccn2Cc2cccnc2)CC1 95528127 LGDHXYIYTHDJPE-UHFFFAOYSA-N 386.406 2.938 0 50 GFAA Cn1nc(C(=O)N(CCCn2ccnc2)Cc2cccnc2)c2c1CCCC2 97660664 VRNPLTFJCSABHL-UHFFFAOYSA-N 378.480 2.623 0 50 GFAA O=C1CC[C@@H]2C(=O)N(CC(=O)N(C3CCCCC3)C3CCCCC3)C(=O)[C@@H]2C1 100564893 HFEILMMQYYVLAH-RBUKOAKNSA-N 388.508 2.835 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NC[C@](C)(O)c1ccccc1 114546594 BUGHHVZGBHMNDN-XXBNENTESA-N 396.487 2.714 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H](NS(C)(=O)=O)C2)sc1-c1ccc(F)cc1 116834941 ORPFZHFZTVHRIG-CQSZACIVSA-N 382.482 2.626 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1ccn(-c2ccccc2Cl)n1 158451353 QZJKMMFXSHLMRR-UHFFFAOYSA-N 396.882 2.681 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2cccc(-c3nnc(C)o3)c2)C1=O 163805551 JWPXAOVDWBIYCL-MRXNPFEDSA-N 392.415 2.589 0 50 GFAA O=C(NCc1ncn(Cc2cccc(F)c2)n1)c1cc(-c2ccc(F)cc2)[nH]n1 170602399 FGYBSGVGLOPDNK-UHFFFAOYSA-N 394.385 2.925 0 50 GFAA Cc1nc(Cl)c(=O)n(CC(=O)N(C)Cc2ccccc2Br)c1C 170613171 XWCKYOIOTRPEQW-UHFFFAOYSA-N 398.688 2.935 0 50 GFAA Cc1cc(C(=O)Nc2ccn(CCc3ccncc3)n2)nc(C(F)(F)F)n1 187339344 HTTFSCYAGGWNIG-UHFFFAOYSA-N 376.342 2.890 0 50 GFAA COc1ccccc1CCC(=O)N1CCn2nc([C@@H](O)c3ccccc3)cc2C1 221325780 FIBSHYNMCSEALS-QHCPKHFHSA-N 391.471 2.948 0 50 GFAA COC1(c2nc(Cc3ccccc3)no2)CCN(Cc2ccc(CO)o2)CC1 225839220 VZCUHYORUBQYJK-UHFFFAOYSA-N 383.448 2.883 0 50 GFAA CC[C@H](NS(=O)(=O)CC[C@@H]1CCCCN1C(C)=O)c1ccc(OC)cc1 242164622 WWOKAWYPENNVMX-HKUYNNGSSA-N 382.526 2.857 0 50 GFAA COCc1ncsc1C(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 283282682 DZJWGBYOYJOCQK-INIZCTEOSA-N 395.912 2.746 0 50 GFAA CCc1ccc(S(C)(=O)=O)cc1C(=O)N(CC(C)C)C1CCN(C)CC1 291394119 DATZESRAXGMOCD-UHFFFAOYSA-N 380.554 2.845 0 50 GFAA O=C(c1cn([C@@H]2CCOC2)nn1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 330092723 QYMVOLZNLUJLEZ-DGCLKSJQSA-N 397.262 2.840 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)CNC(=O)c3cccc(Cl)c3)c2)n1C 378214385 FNDPUSKTIPLLJQ-UHFFFAOYSA-N 383.839 2.812 0 50 GFAA CCN(C(=O)c1ccc(-c2ccc3c(c2)OCCC3=O)cc1)[C@H]1COC[C@@H]1O 426689112 GUCGDEOJCNDSOS-ICSRJNTNSA-N 381.428 2.541 0 50 GFAA O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N1CC[C@@]2(CCCOC2)C1 478793500 GIHFJOAEJGRTCF-NRFANRHFSA-N 389.471 2.642 0 50 GFAA CN(C)[C@H]1CCN(C(=O)NCc2ccc(-c3cccc(Cl)c3)o2)C[C@@H]1O 670452972 VRJFBCBGBGGBTO-IRXDYDNUSA-N 377.872 2.806 0 50 GFAA CN(C)Cc1nc(C(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)cs1 1704356965 MZOKFEZWQLUSLU-CRAIPNDOSA-N 396.516 2.740 0 50 GFAA O=C1CC2(CCN(Cc3cccc(F)c3)CC2)OCCN1C[C@H]1CCCO1 1857684292 HMCILTZFLAYJBE-LJQANCHMSA-N 376.472 2.588 0 50 GFAA COc1ccccc1CCC(=O)N1CCC[C@]2(CCc3c(O)nc(C)nc32)C1 1857731605 LZWQVNYWPYUKNW-QFIPXVFZSA-N 381.476 2.938 0 50 GFAA COc1ccccc1CCC(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857734357 IWSFZWYYHUKZHW-JAXLGGSGSA-N 380.488 2.958 0 50 GFAA CCC[C@H](C(=O)N[C@@H](Cc1cccc(OC)c1)c1ccccc1)S(N)(=O)=O 1875267837 YJNAXABCOQCLOZ-RBUKOAKNSA-N 390.505 2.552 0 50 GFAA C[C@H](CC(=O)N1CC[C@@](O)(CNC(=O)CC2(C)CC2)C1)c1cccc(F)c1 1875305022 CLURAUQKXHMIJU-QVKFZJNVSA-N 376.472 2.589 0 50 GFAA CC(C)N(CCN(C)C(=O)Cc1ccc(Cl)s1)C(=O)c1cc(=O)cc[nH]1 1875340775 QWQULCBAYRGWDF-UHFFFAOYSA-N 395.912 2.642 0 50 GFAA O[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1NCc1ccc(OCc2ccncc2)cc1 1875399810 JNKQBFLOVLLNHV-KSEOMHKRSA-N 378.476 2.786 0 50 GFAA O=C(c1cc2c(N3CCNCC3)cccc2s1)N1CC[C@H](c2ncccn2)C1 2325795925 GAKFUKDSYRKJAA-HNNXBMFYSA-N 393.516 2.731 0 50 GFAA C[C@H]1CN(c2cccc(F)c2)CCN1C(=O)c1ccc(-c2nc(=O)o[nH]2)s1 2325821948 OPABPBRIBXSSGJ-NSHDSACASA-N 388.424 2.581 0 50 GFAA C[C@@H]1NCCn2c(C(=O)N=c3[nH]nc(Cc4cccc(Cl)c4)s3)ccc21 2325856325 KYSWFLNTJLQKSW-NSHDSACASA-N 387.896 2.922 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3cc4cccnc4[nH]3)C1)CC2 2356159894 URTFLQHWSYNQSE-OAQYLSRUSA-N 376.464 2.539 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 626472 AKJAQSYAGXVMKK-KRWDZBQOSA-N 380.400 2.733 0 50 GFAA COC(=O)C1=CN(C[C@H]2CCCO2)C=C(C(=O)OC)C1c1cccc(F)c1 717769 KTXCHNSJNZJNMR-OAHLLOKOSA-N 375.396 2.518 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(C(N)=O)cc2)nnc1-c1ccc(F)cc1 1058142 WWBYFXKRFJHBIB-UHFFFAOYSA-N 399.451 2.934 0 50 GFAA Cn1c(=O)c2cn3c(c2n(C)c1=O)[C@H](c1ccccc1)CC(c1ccccc1)=N3 8375797 ZLWUCLYSRCRWMO-KRWDZBQOSA-N 384.439 2.827 0 50 GFAA Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)Cc3ccccc3)CC2)n1 9620693 JNARDLGITQLZTE-UHFFFAOYSA-N 379.508 2.667 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CCC(=O)N(Cc3ccc(OC)cc3)CC2)C1 14990487 NBRMQKUOBROMCV-OALUTQOASA-N 388.508 2.851 0 50 GFAA CC1CCN(S(=O)(=O)c2cc(C(=O)Oc3cccnc3)ccc2F)CC1 16622578 ZTANOAJLAIZRJK-UHFFFAOYSA-N 378.425 2.861 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(C(=O)c3cc4ccccc4n3C)C2)CC1 19635494 UFGBVTYVNUUBGW-GOSISDBHSA-N 396.535 2.585 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3c[nH]c4ccccc34)CC2)cc1 19790165 XEMBFAUMYFIIJN-UHFFFAOYSA-N 385.489 2.683 0 50 GFAA O=c1cc(Cc2cccc(F)c2)nc(-c2ccccc2CN2CCOCC2)[nH]1 20534380 RQXOLWCJMJXSQU-UHFFFAOYSA-N 379.435 2.999 0 50 GFAA CN1CCN(C)C2(CCN(Cc3sc(N4CCCC4)nc3Cl)CC2)C1 67946993 JEEZEIXCRFPYEE-UHFFFAOYSA-N 383.993 2.609 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)c1ccc(Cl)cn1)C2 71715003 YUFLRHGTUMWEKF-UHFFFAOYSA-N 394.866 2.852 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(N4CCCC4)ncn3)CC2)c(C)c1 72115677 ISHULVCZPQOFTJ-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA O=C(C[C@H]1COCCN1C(=O)CCc1cn2ccccc2n1)Nc1ccccc1 72408477 CPSISXFWAKQGCD-IBGZPJMESA-N 392.459 2.523 0 50 GFAA O=C(Nc1ccc(Cl)cc1)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 82230301 BVZDIBBLGCZVGR-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA O=C(CCc1cccnc1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91468322 MURAZVOWJARCAO-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA O=S(=O)(c1cccc(F)c1)N1C[C@H]2CC[C@@H]1CN(Cc1cccnc1)C2 92066321 XVRLVGUAEKZIDN-FUHWJXTLSA-N 375.469 2.506 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(C(=O)c2cc3sccc3[nH]2)C1 95353345 SYMNBOOVPKOMKR-CYBMUJFWSA-N 395.492 2.623 0 50 GFAA Cn1cnnc1CN1CCC[C@@H](CCC(=O)NCc2ccccc2Cl)C1 95498707 IBBHGQLDLDVRRE-HNNXBMFYSA-N 375.904 2.777 0 50 GFAA CC(C)CN1CCc2nc[nH]c2C12CCN(Cc1cccc3nonc13)CC2 95505469 XWXPNRLGMHQPSX-UHFFFAOYSA-N 380.496 2.951 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)N(Cc2ccccc2)C[C@@H]2CCCO2)c1 95519489 WUSJHRQZTPGFMI-KRWDZBQOSA-N 389.477 2.547 0 50 GFAA CN(C(=O)CCc1nc(-c2ccco2)no1)[C@@H]1CCCN(c2ccccc2)C1=O 115502841 JVMGJGBTKIUPMI-MRXNPFEDSA-N 394.431 2.916 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NCc1ccc(O)c(F)c1 132984930 AGZFJGURGXDUHR-KRWDZBQOSA-N 386.423 2.851 0 50 GFAA C=Cc1ccc(Cn2c(=O)c(-c3noc(C)n3)c3n(c2=O)CCCCC3)cc1 169764012 TULGDLDHZDJOEP-UHFFFAOYSA-N 378.432 2.786 0 50 GFAA CC(C)c1nn(C)c2sc(C(=O)N[C@H]3CCN(CC(F)(F)F)C3=O)cc12 173352024 ZRTYTCMADFQZMC-JTQLQIEISA-N 388.415 2.651 0 50 GFAA CC(C)C1CCC(N2CCN(C(=O)c3ccc(-n4cncn4)nc3)CC2)CC1 175507497 AIZNDVJTSYUXIN-UHFFFAOYSA-N 382.512 2.635 0 50 GFAA O=C(c1cnc([C@H]2CCCO2)s1)N1CCC(CCCN2CCOCC2)CC1 180304563 SOMLOAHCYRLVBA-QGZVFWFLSA-N 393.553 2.959 0 50 GFAA CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1ccc2c(c1)N(C)CC2 189303684 MYOWGSWRIJUYCY-QHCPKHFHSA-N 394.519 2.780 0 50 GFAA C[C@H]1CCCCN1Cc1ccccc1CNC(=O)c1cn(C2CCNCC2)nn1 237520999 LFFUEKZUONFNRS-KRWDZBQOSA-N 396.539 2.507 0 50 GFAA O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(N2CCNC2=O)cc1 264337056 UVFQOMUQSLDHAD-IBGZPJMESA-N 392.503 2.511 0 50 GFAA Cn1c(C(=O)N2CCN(CCc3ccccc3)CC2)cc2ccccc2c1=O 285333748 GJZQVWBVZXMGLE-UHFFFAOYSA-N 375.472 2.539 0 50 GFAA COc1ccc([C@H](CC(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)NC(C)=O)cc1 299749875 LXWYRSMJLGIQBN-KANFNMMFSA-N 388.464 2.507 0 50 GFAA CN(Cc1ccccc1)[C@H]1CCN(C(=O)C2CCN(C(=O)N3CCCC3)CC2)C1 363271258 LJULTGNVZGRGFV-NRFANRHFSA-N 398.551 2.647 0 50 GFAA C[C@@H](NC(=O)CC(C)(C)C)C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 363781822 QLSLQEHBFFZZSD-ZIAGYGMSSA-N 381.467 2.848 0 50 GFAA O=C(/C=C/c1cccc(OC2CCCC2)c1)N[C@@H]1CCC(=O)N[C@@H]1[C@H]1CCCO1 365993398 LTEXQBKNKPQPAZ-RMRZITJJSA-N 398.503 2.964 0 50 GFAA Cc1nc(CN2CCCN([C@H](C)C(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)oc1C 370807983 GHSCVWMZEYEERW-XYJFISCASA-N 376.545 2.692 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)Nc1ccccc1CN1CCOCC1)C2 371537581 BNNNUMDWLLVIGL-SFHVURJKSA-N 382.460 2.717 0 50 GFAA CC(C)[C@H](C(=O)N[C@@H]1CCN([C@@H](C(=O)O)C(C)C)C1=O)c1cccc(Cl)c1 478981527 IFVRFUWKNGBWSM-IXDOHACOSA-N 394.899 2.906 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cn(C)c2ccccc12 525207857 UIICHVJTNWJQCU-CQSZACIVSA-N 386.477 2.604 0 50 GFAA COc1ncnc(C)c1-c1ccc(C(=O)N(Cc2cnn(C)c2)C2CC2)cc1 584888990 GJKFHZQNZRJOBS-UHFFFAOYSA-N 377.448 2.999 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)NCCCN1CCCC[C@@H]1CO 670471633 MMCRMRUERNMVTO-OAHLLOKOSA-N 381.904 2.655 0 50 GFAA CCCCc1ncc(CN2CCC3(CC2)CN(c2ccnc(C)n2)CCO3)[nH]1 952971262 XQPFKGZVYJDUJN-UHFFFAOYSA-N 384.528 2.722 0 50 GFAA COc1cccc2c1OC[C@H](NCc1cc3c(nc1OC)CN(C(C)C)C3=O)C2 952982481 LZWKOKYYARVYNT-MRXNPFEDSA-N 397.475 2.556 0 50 GFAA COc1ccc(CN2CCC3(CC2)CNC(=O)CO3)cc1OCc1ccccc1 1144500173 SMUANZHVXLRLDB-UHFFFAOYSA-N 396.487 2.755 0 50 GFAA COc1cccc(OC[C@@H]2CCCN(C(=O)CSc3nnc(C)o3)C2)c1 1506422460 BJILEPKHJFDZAV-CQSZACIVSA-N 377.466 2.796 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)c3nnc(O)c4ccccc34)CC2)c(C)o1 1529142703 QIDKUYIVEFANGS-UHFFFAOYSA-N 394.431 2.534 0 50 GFAA COc1ccc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)cc1OCc1cccc(F)c1 1529144153 OPNNQPUDXVWJEB-ROUUACIJSA-N 389.423 2.681 0 50 GFAA COCC(C)(C)CNC(=O)c1c(N(C)C)noc1-c1ccc(F)c(OC)c1 1704305586 LYZJUGJBWYWXDC-UHFFFAOYSA-N 379.432 2.958 0 50 GFAA O=C(c1cccc(Cl)c1F)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704344424 PYOSICFOIHZYQB-OXQOHEQNSA-N 391.826 3.000 0 50 GFAA CCc1ccccc1C(=O)N1C[C@H]2CN(CCCn3cccc3)C[C@]2(CO)C1 1772709783 NKEYOLDFKKSRPQ-NFBKMPQASA-N 381.520 2.507 0 50 GFAA Cn1c(CO)nnc1C1CCN(C(=O)c2c(Cl)ccc3ncccc23)CC1 1775977423 JABODVINJVRGAJ-UHFFFAOYSA-N 385.855 2.529 0 50 GFAA COc1ccc(CN2CCC[C@]3(CCc4c[nH]nc43)C2)cc1Cn1cncn1 1775984281 MTGDVCNXXDWHTC-NRFANRHFSA-N 378.480 2.538 0 50 GFAA CC[C@@]12COC(=O)N1CCN(C(=O)c1cccc(Cn3nc(C)cc3C)c1)C2 1857677066 WJFGRSWAZMIRMQ-OAQYLSRUSA-N 382.464 2.605 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)CSc1nncn1C 1875248780 OHQVSVNVMKCISQ-UHFFFAOYSA-N 376.873 2.753 0 50 GFAA NS(=O)(=O)c1ccc(CCN(C(=O)OC2CCCC2)c2ccncc2)cc1 1875339580 PFSAFYBAMAPVGI-UHFFFAOYSA-N 389.477 2.857 0 50 GFAA COC1CCN(C[C@@H]2CCC[C@H](NC(=O)c3cccc4c3OCCO4)C2)CC1 2100544841 LMYINDYEQBKNQA-SJORKVTESA-N 388.508 2.857 0 50 GFAA Cc1cc(Br)cc2cc(CNC(=O)c3cnn(CCN)c3)oc12 2325778983 YPKKSMXUHJZJSE-UHFFFAOYSA-N 377.242 2.589 0 50 GFAA CC1=N[C@H](CCS(=O)(=O)C(C)C)C(=O)Nc2ccc(Br)cc21 2325796296 HFNVQNZTBWCLEW-CQSZACIVSA-N 387.299 2.792 0 50 GFAA CC(C)(C)[C@@H]1CC[C@H](NC(=O)C2CCN(c3ccc(-c4nn[nH]n4)cn3)CC2)C1 2325807369 UTUJKQRFARUEON-SJORKVTESA-N 397.527 2.809 0 50 GFAA CCCc1cccc(S(=O)(=O)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)c1 2325826809 NCWXUEGKBLLMBB-SFHVURJKSA-N 382.526 2.631 0 50 GFAA CCn1nccc1C(=O)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356165269 AMNLMRLERJQZJW-QFIPXVFZSA-N 380.492 2.743 0 50 GFAA Cc1cccc(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1C 916836 YFQKHRGODYOBGO-LJQANCHMSA-N 379.460 2.884 0 50 GFAA CS(=O)(=O)N1CCN(C(=O)[C@@H](Sc2ccccc2)c2ccccc2)CC1 1054312 CDFRHBUZRFYXTO-SFHVURJKSA-N 390.530 2.624 0 50 GFAA Cc1cc(Cl)ccc1NC(=S)NCCc1ccc(S(N)(=O)=O)cc1 1153793 HMHSGELCVOCCMT-UHFFFAOYSA-N 383.926 2.825 0 50 GFAA Cc1oc2cc3oc(=O)c(CC(=O)N4CCC(C(N)=O)CC4)c(C)c3cc2c1C 2159555 PGJMHNDZBAUOSQ-UHFFFAOYSA-N 396.443 2.731 0 50 GFAA biogenic CCN(CC)S(=O)(=O)c1cc(C)c(C)cc1OCC(=O)NC1CCCC1 4868393 FKNOZTSNJDKDJJ-UHFFFAOYSA-N 382.526 2.772 0 50 GFAA Cc1ccc(NC(=O)Cc2nnc(SCC(N)=O)n2-c2ccccc2)c(C)c1 8785181 OIDJBEPLNNWPFU-UHFFFAOYSA-N 395.488 2.643 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1Br)n1c(=O)[nH]c2ccccc2c1=O 8994461 APZKQWJAIGYMPQ-JTQLQIEISA-N 388.221 2.652 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1cccc(Cl)c1 11717686 LJEUVTZBMVYSDD-SFHVURJKSA-N 382.855 2.919 0 50 GFAA CCN(CCc1ccncc1)S(=O)(=O)c1ccc(N2CCCCC2=O)cc1 11907611 ZFEGQBWWSNWACM-UHFFFAOYSA-N 387.505 2.852 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@H](CNC(=O)c2cc(C)nn2C)C3)n1 11995244 YREHTSNMDVNFCD-AWEZNQCLSA-N 395.438 2.675 0 50 GFAA CSc1ncccc1C(=O)NC[C@H]1Cc2cccc(-c3cnccn3)c2O1 12079782 NFSLIFUBWRSUIB-CQSZACIVSA-N 378.457 2.994 0 50 GFAA COc1ccc(-c2cc(F)cc3c2O[C@H](CNC(=O)Cc2ccccc2)C3)nn1 12157084 JLIYXKUMQXOGQA-KRWDZBQOSA-N 393.418 2.954 0 50 GFAA Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccc3cc[nH]c3c1)C2 14748442 PPCDTTPYWFMLBO-UHFFFAOYSA-N 391.475 2.772 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2ccc(F)cc2)CN1Cc1c(F)cccc1F 14961546 LXZYVFQFXWBJSV-KSSFIOAISA-N 392.377 2.650 0 50 GFAA Cc1ccc(CNC(=O)C[C@@H]2C(=O)NCCN2CCCc2ccccc2)cc1F 19770156 DKWTXLITMDVOAL-OAQYLSRUSA-N 397.494 2.574 0 50 GFAA COc1ccccc1N1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1 19790792 NDUSJNOYJWUGOE-QGZVFWFLSA-N 376.884 2.911 0 50 GFAA O=C(NCc1ccco1)c1ccc([C@@H]2CCCN2C(=O)Cn2ccnc2)s1 23192602 NLVBTKUEMZAQTF-HNNXBMFYSA-N 384.461 2.831 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccccc3F)n2)c(F)c1 44900586 FITVOMRRFALVNG-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA CC(C)CCN1C(=O)C2(CCN(C(=O)[C@@H]3CCOC3)CC2)Nc2ccccc21 55073695 ONIVZWYEPPSZDM-QGZVFWFLSA-N 385.508 2.889 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccccc1C(F)(F)F)NC1CCCCC1 55120178 LCFWTKVXUUNAHU-QGZVFWFLSA-N 397.441 2.845 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3cccc(Cl)c3)C2)CC1 55195769 RSJKHGFHEDZBCR-QGZVFWFLSA-N 379.888 2.719 0 50 GFAA C[C@H](Cc1cnccn1)N1CCCn2nc(C(=O)Nc3ccccc3)cc2C1 65371097 PIGHYFZYUGYHRS-MRXNPFEDSA-N 376.464 2.762 0 50 GFAA O=C1CN(Cc2ccc(O[C@@]34CCCN(CC3)C4)cc2)CCN1C1CCCC1 67642648 JRSMFCBFFMNVTM-QHCPKHFHSA-N 383.536 2.891 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CC(n4cccn4)C3)nc2)C1 67643027 SJLKSMZJMACTSQ-SFHVURJKSA-N 395.507 2.807 0 50 GFAA COc1ccc(OCc2nc(C(=O)N3CC(N4CCCC[C@@H]4C)C3)co2)cc1 67675870 GBZDWXMCNGLVNX-HNNXBMFYSA-N 385.464 2.961 0 50 GFAA CCc1cnc(NCc2cccnc2N2CCN(c3ccccn3)CC2)nc1 71315354 VBRFGAWOPVINOP-UHFFFAOYSA-N 375.480 2.768 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)c1ccc(O)cc1)C2 72161557 LSUDCHHNINHJJK-UHFFFAOYSA-N 375.432 2.509 0 50 GFAA CC(=O)c1ccc(OCC(=O)N2CC(=O)N(c3ccccc3C)C[C@@H]2C)cc1 82133635 FBTDFLDRPCPDIN-INIZCTEOSA-N 380.444 2.840 0 50 GFAA CC(C)OCCNC(=O)c1cccc(S(=O)(=O)N2CCCCCCC2)c1 95366406 HVSOBRQSWNPTFT-UHFFFAOYSA-N 382.526 2.796 0 50 GFAA O=C(Nc1ccccc1OC[C@H]1CCCO1)N1CCN(c2ccccn2)CC1 95506448 BBHDQBPRUOUCJI-QGZVFWFLSA-N 382.464 2.994 0 50 GFAA O=C(c1cc(=O)n(-c2ccccc2)[nH]1)N1CCC[C@@H](c2nccn2CC2CC2)C1 95526279 VBDFNDYGDORKQJ-QGZVFWFLSA-N 391.475 2.792 0 50 GFAA CSc1nc(N)cc(N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)n1 95531071 MDMGQWCVELYCQS-CQSZACIVSA-N 381.509 2.805 0 50 GFAA Cc1cccc(CN2CCC(c3nnc(Cn4cccn4)n3C3CC3)CC2)n1 96151354 AFPHMTPYQZULJY-UHFFFAOYSA-N 377.496 2.941 0 50 GFAA CCCN1CCC2(CC1)CCN(C(=O)c1cccnc1SC)C[C@H]2CO 97815511 OIDSIBJZGJIRRD-INIZCTEOSA-N 377.554 2.750 0 50 GFAA COc1ccc(CN[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2=O)cc1 100823377 CUPPBXSBGNDUNR-MRXNPFEDSA-N 389.249 2.879 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCN(C(=O)CCCc2csc3ccccc23)C1 119845176 ZIOVQMDXZQQMBC-OAHLLOKOSA-N 380.535 2.764 0 50 GFAA Cc1noc(-c2ccccc2)c1NC(=O)N1CC(=O)NC(=O)C12CCCCC2 126578841 MYSJGYYDIQTSPY-UHFFFAOYSA-N 382.420 2.843 0 50 GFAA O=C(CN1CCCN(C(=O)c2cccc(F)c2)CC1)NCCC1=CCCCC1 126698989 SRRDAQQHIACXQX-UHFFFAOYSA-N 387.499 2.980 0 50 GFAA Cc1nc(CN2CCCN(C(=O)CCc3cn(C)c4ccccc34)CC2)no1 153940045 BYTHQRFXTBXGPI-UHFFFAOYSA-N 381.480 2.537 0 50 GFAA C=C1c2ccccc2C(=O)N1CC(=O)N[C@H]1CCN(c2ccccc2OC)C1 156653610 KOXNTMDWUIRSAD-INIZCTEOSA-N 377.444 2.517 0 50 GFAA CCN1CCN(Cc2nc3cc(OC)c(OC)cc3c(=O)[nH]2)c2ccccc21 170623704 WAEABKDDKRQBPW-UHFFFAOYSA-N 380.448 2.787 0 50 GFAA Cc1ccc([C@@H](CNC(=O)N2CCC(NC(C)C)CC2)N2CCOCC2)s1 174988894 JPSOWPDOFXMRHF-GOSISDBHSA-N 394.585 2.602 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)Nc1ccc2c(c1)S(=O)(=O)CC2 178367803 FOXYKMJGJRFRJS-MRXNPFEDSA-N 399.516 2.755 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N(CCC(=O)O)C3CCOCC3)cc2F)n1 237679782 FUMHZDSJDOGVCP-UHFFFAOYSA-N 389.427 2.724 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)Cc1ccn(-c2ccc(F)cc2)n1 238031828 KIDJATWPCHPJHE-LJQANCHMSA-N 379.391 2.592 0 50 GFAA O=C(OCCCCOC(=O)[C@H]1CCCC[C@H]1C(=O)O)[C@H]1CCCC[C@H]1C(=O)O 239284779 CAOCATZETDLGIH-WCVJEAGWSA-N 398.452 2.635 0 50 GFAA CCN1CCCN(CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1=O 241946694 UNEYLGXFVQUUPB-NRFANRHFSA-N 379.504 2.641 0 50 GFAA Cc1cc(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 252527947 DUMMDWSZDNAXRD-AEFFLSMTSA-N 377.492 2.917 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1ccn(C(C)C)n1)CC2 262799880 OBSQJQSGLPSOSS-INIZCTEOSA-N 387.436 2.696 0 50 GFAA CN(C(=O)c1ccncc1)c1ccc(CNC(=O)C2CCC(C(=O)O)CC2)cc1 262982927 UHJVTLMDPHXGJZ-UHFFFAOYSA-N 395.459 2.865 0 50 GFAA COC(=O)c1cn([C@H]2C[C@H](C(F)(F)F)Oc3ccccc32)cc2c(=O)[nH]nc1-2 263588867 ZJBIPBGXBCBAMV-GXTWGEPZSA-N 393.321 2.766 0 50 GFAA CN(C)c1nc2sc(C(=O)N[C@@H]3CCC(=O)N[C@H]3C(C)(C)C)cc2s1 286569477 MGJVUJZDUFRCSF-NOZJJQNGSA-N 380.539 2.847 0 50 GFAA Cc1sc(=O)n(CCC(=O)N2CCCC[C@H]2c2n[nH]c(C(C)C)n2)c1C 329544388 FYWCXRVLYZVWPY-AWEZNQCLSA-N 377.514 2.912 0 50 GFAA CC(C)(C)C(=O)NCC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 363274430 YOOUIDSHDBOUOT-UHFFFAOYSA-N 399.457 2.948 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 363630274 PLBPGFOWQSLBHR-MRXNPFEDSA-N 396.882 2.501 0 50 GFAA O=C(Cn1ccc2ccccc2c1=O)NCc1ccc(-n2ccnc2)c(F)c1 363938342 NYVXFNQBEXNDKV-UHFFFAOYSA-N 376.391 2.643 0 50 GFAA COC(=O)c1ccc(NC(=O)NC[C@H]2CCN(C(=O)Cc3ccccc3)C2)cc1 366512723 LLSSOBLJHZGERJ-QGZVFWFLSA-N 395.459 2.686 0 50 GFAA O=C(Cc1ccc(Cl)cn1)Nc1cc(N2CCCS2(=O)=O)ccc1F 785924553 KDNRVEFDGDXJFW-UHFFFAOYSA-N 383.832 2.595 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1C[C@@H]2CC[C@H]1CN(Cc1ccccc1)C2 1565516311 WVKVOFYZVBBGDM-MOPGFXCFSA-N 375.476 2.774 0 50 GFAA COc1ccc(F)cc1CN1CC[C@]2(O)CCN(C(=O)C3CCCC3)C[C@@H]2C1 1565517036 VAZQEODQNVYXRZ-AVRDEDQJSA-N 390.499 2.810 0 50 GFAA O[C@H]1C[C@H](c2ccccc2)OC2(CCN(c3cc(-n4cccn4)ncn3)CC2)C1 1857671368 VAEQWFVNPWJWLC-RBUKOAKNSA-N 391.475 2.914 0 50 GFAA CCCc1nc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)cs1 1857674001 WTYHCPDDKFKPNQ-FQEVSTJZSA-N 385.489 2.985 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N[C@H]3CC[C@H](O)CC3)cc12 1857702971 KRPBSFCZEAHIKJ-SHTZXODSSA-N 378.538 2.665 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1cccc2nn[nH]c12 1857713107 XUTFEPUFRMLIHP-RVKKMQEKSA-N 397.866 2.556 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(C(=O)CC3CCCCC3)C[C@]23CC[C@H]1O3)c1ccoc1 1857713971 ZTTPQMFUGCEMBH-JZJXAQOMSA-N 386.492 2.986 0 50 GFAA CCCc1nc(CNC(=O)[C@@H]2CC(=O)N(c3nnc(CCC)s3)C2)cs1 1857716466 NGFWHESJJLOHGM-LLVKDONJSA-N 393.538 2.569 0 50 GFAA CCc1cccc(N2C[C@@H](C(=O)N(C)[C@H](CO)c3cccc(F)c3)CC2=O)c1 1875257335 FRDCMNBXZQKMTA-FXAWDEMLSA-N 384.451 2.933 0 50 GFAA Cc1cccc([C@H](CNC(=O)N2CCOCC[C@@H]2C2CC2)N2CCOCC2)c1 1875300360 AMSZJHZGXPCWPP-RTWAWAEBSA-N 387.524 2.579 0 50 GFAA CC(C)c1ncsc1C(=O)N(C)C1CC(NC(=O)[C@@H](F)C(F)(F)F)C1 1875303199 AWSCBNVSGNIRAD-SHVIVCPWSA-N 381.395 2.886 0 50 GFAA O=C1NC(=O)[C@@]2(CCCC[C@H]2NC(=O)c2ccc(OC3CCC3)cc2Cl)N1 1875328619 CCKWLHZWMKDTFP-BEFAXECRSA-N 391.855 2.522 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N[C@H]2Cc3n[nH]cc3[C@@H](C(F)(F)F)C2)c1 1875367541 MMDUWGSGEUMHOA-OCCSQVGLSA-N 378.354 2.925 0 50 GFAA COc1ccc(-c2ccncc2)cc1CN[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 1875399772 IUHKVBICQDEZAO-ZLGUVYLKSA-N 378.476 2.883 0 50 GFAA O=C(NCC12CC(C(=O)O)(C1)[C@H](c1ccccc1)O2)[C@@H]1CC2(CCCC2)CO1 1875404687 QRPILPWZDMMPJG-UOBYYGQQSA-N 385.460 2.827 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)COc2ccc(C)c3c2C(=O)C[C@@H]3C)s1 2325702853 RNEHDLXKQWZSBK-NSHDSACASA-N 393.486 2.939 0 50 GFAA c1ccc2cc(OCCN3CCN(CCN4CCCOCC4)CC3)ccc2c1 2325710378 BFBBDRULDKSDRM-UHFFFAOYSA-N 383.536 2.559 0 50 GFAA NCc1ncc(C(=O)N2CCC(n3ncc4ccccc43)CC2)c(C(F)F)n1 2325792136 CFXHOPBHBNBYTL-UHFFFAOYSA-N 386.406 2.700 0 50 GFAA CC[C@H](C(=O)N1CC2(CCN(C(=O)C34CCC(CC3)C4)C2)C1)N(CC)CC 2325793519 YGPOYNXFRTXWKN-WUZYXKQASA-N 375.557 2.748 0 50 GFAA C[C@@](NC(=O)c1ccc2c(n1)CCOC2)(C(=O)O)c1ccc(C(F)(F)F)cc1 2325798822 BXYZAOBKZPVSCB-SFHVURJKSA-N 394.349 2.903 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc4cc[nH]c4n3)C1)CC2 2356163141 ZHSPVHFKDVPQEM-NRFANRHFSA-N 376.464 2.539 0 50 GFAA CCN(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C)cc1 1077692 FPVRDQOUOAHASL-UHFFFAOYSA-N 380.897 2.975 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)c1cccc(S(=O)(=O)N2CCCCC2)c1 1113116 GNFARMMBQFXBRC-UHFFFAOYSA-N 388.445 2.842 0 50 GFAA CC(=O)Nc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 1124136 NSRVQXJGJOPUCO-UHFFFAOYSA-N 395.868 2.558 0 50 GFAA COc1cc(/C=C(\NC(C)=O)C(=O)N[C@@H](C)c2ccccc2)ccc1OC(C)=O 2814274 LICFDJBDRRSZSK-YQNUULROSA-N 396.443 2.975 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)Nc2ccccc2C(F)(F)F)ccc1OC 6697519 BAZWUCTUDMAVFI-UHFFFAOYSA-N 388.367 2.874 0 50 GFAA COC(=O)C1CCN(C(=O)[C@@H](C)NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 6701044 QPWJGCJBZHTGGI-XSXQVXRUSA-N 390.524 2.509 0 50 GFAA Clc1cc2c(cc1CN1CCc3nnc([C@@H]4CCCO4)n3CC1)OCO2 20119118 WMBZNDPDDQYDPX-AWEZNQCLSA-N 376.844 2.570 0 50 GFAA C[C@H](NC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1cccc(Br)c1 248375475 AYHKFDUIRQJMMA-NILFDRSVSA-N 393.281 2.802 0 50 GFAA Cc1nc([C@@H](C)NC(=O)c2cc(COc3ccc4ncccc4c3)on2)n[nH]1 67726448 FPRROFNGBNCMMA-LLVKDONJSA-N 378.392 2.719 0 50 GFAA COc1ccc(OC[C@@H](O)CN(C)C)c(CNCCc2cccc(Cl)c2)c1 20208212 WKAPELPKSZDRKN-IBGZPJMESA-N 392.927 2.982 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3CCC[C@@H](c4ccn[nH]4)C3)c2n1 67919953 GBAJJPVSUIJSGB-LLVKDONJSA-N 378.358 2.799 0 50 GFAA C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCS(=O)(=O)C2CCCC2)C1 229625561 FKQGLFGRPLCIQQ-FUHWJXTLSA-N 378.538 2.686 0 50 GFAA O=C(Nc1ccc(F)cc1)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528632 UWRBVLSUXFVUAW-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA CCc1nc(C)c(CN2CCC[C@H](CNC(=O)Cc3ccc(OC)cc3)C2)[nH]1 11936051 RBYMJAKWQQVZRY-GOSISDBHSA-N 384.524 2.860 0 50 GFAA CCOc1ccc(CCNS(=O)(=O)c2ccc(C(=O)O)cc2)cc1OCC 1427787 XAZSEYGNHIDVBS-UHFFFAOYSA-N 393.461 2.703 0 50 GFAA O=C(O)c1ccccc1C(=O)OCCCCOC(=O)c1ccccc1C(=O)O 2972268 SBPPVJGCHFNQOO-UHFFFAOYSA-N 386.356 2.877 0 50 GFAA biogenic CC(C)[C@H]1CN(C(=O)c2cn3cc(Cl)cnc3n2)CCCN1CC1CC1 72146250 MRXFGYRPXBZRJL-QGZVFWFLSA-N 375.904 2.965 0 50 GFAA CCCN1CCC[C@H]1CNC(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 253426562 SZEJXNJWMMLSFT-HNNXBMFYSA-N 386.418 2.975 0 50 GFAA COc1cccc(OC)c1CC(=O)Nc1ccc(F)cc1C(=O)N(C)OC 253416998 SJQDIYIBNNARBZ-UHFFFAOYSA-N 376.384 2.658 0 50 GFAA CCOc1cc(CN(C)C(=O)c2nc(C)c(C)[nH]c2=O)ccc1OC(F)F 154237389 ICUYHJZGUODXIF-UHFFFAOYSA-N 381.379 2.659 0 50 GFAA Cc1nc(S)sc1CC(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 155281336 FXTBXCQGEQJLTC-GJZGRUSLSA-N 378.519 2.634 0 50 GFAA CC[C@H]1CN(C(=O)c2cnn3cc(C)cnc23)CCC(=O)N1Cc1ccccc1 71575548 SINHZEJQXZEXAQ-SFHVURJKSA-N 391.475 2.691 0 50 GFAA CN(Cc1ccc(C(=O)O)cc1)C(=O)CCN1C(=O)CCc2cc(F)ccc21 237022309 FIOGIJGQFSLPIV-UHFFFAOYSA-N 384.407 2.852 0 50 GFAA O=C(CN1CCC[C@H](C[C@H]2CCOC2)C1)Nc1cccc(C(=O)NC2CC2)c1 378395657 MBMYEEJPRYQQJC-IAGOWNOFSA-N 385.508 2.656 0 50 GFAA COc1cccc(CS(=O)(=O)N2CCNC[C@@H]2c2ccccc2Cl)c1 261757349 QSIGYTPBZCNXDZ-GOSISDBHSA-N 380.897 2.825 0 50 GFAA CCc1nccn1CC(=O)N1CCC2(CC1)CN(CC(CC)CC)C(=O)O2 77299602 SXOLWOGPBDFTJK-UHFFFAOYSA-N 376.501 2.695 0 50 GFAA CC[C@H](NC(=O)c1cn(CC2(C)COC2)nn1)c1ncc(-c2ccccc2)[nH]1 371956481 XOBDSUZZPLOPMR-HNNXBMFYSA-N 380.452 2.586 0 50 GFAA CCCNC(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72158386 SPJLNIMXFCUPNT-OAQYLSRUSA-N 379.504 2.535 0 50 GFAA CCOc1nc(C)ccc1C(=O)N[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1 239761713 CKFPUAFAYDYENL-GFCCVEGCSA-N 380.441 2.822 0 50 GFAA CCCN1CCCN(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)CC1=O 239762534 CLYBDKXGWRSXRQ-UHFFFAOYSA-N 394.903 2.653 0 50 GFAA OCCOc1cccc(CN2CCN(CC3CCCCC3)[C@H](CCO)C2)c1 77397507 BBNZZRSPGCNOGL-OAQYLSRUSA-N 376.541 2.507 0 50 GFAA CC(C)OCCN1CCC(NC(=O)C(C)(C)c2ccc3c(c2)OCCO3)CC1 176681676 GUQOOOGIGSGKDT-UHFFFAOYSA-N 390.524 2.741 0 50 GFAA CO[C@@H]1CC[C@@]2(OC)CCN(C(=O)c3cc(-c4cccs4)nn3C)[C@H]2C1 426552175 ZZNHXHPJBPLUQO-XVGQJIODSA-N 375.494 2.947 0 50 GFAA CN(C)[C@@H](C(=O)NCc1coc(-c2ccccc2)n1)c1ccc2c(c1)OCO2 426486035 GREQMLYVUBFVSN-LJQANCHMSA-N 379.416 2.989 0 50 GFAA O=C(NCc1nc2ccc(Cl)cc2[nH]1)N1CCC(N2CCSCC2)CC1 426574798 SGAWNERHBXYYIE-UHFFFAOYSA-N 393.944 2.939 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C(=O)N[C@H]2CCc3ccccc32)CC1 426445654 QVUSENLIJSCDBV-FQEVSTJZSA-N 378.476 2.807 0 50 GFAA COc1ccc(C(=O)N(C)Cc2ccoc2)cc1OC1CCN(C(C)=O)CC1 95528333 TUZIYTMYTOOIKW-UHFFFAOYSA-N 386.448 2.950 0 50 GFAA Cc1cc(CN(C)C(=O)c2ccccc2S(=O)(=O)Cc2ccccc2)n[nH]1 426444485 IEIADDZBBJKQSS-UHFFFAOYSA-N 383.473 2.964 0 50 GFAA Cc1noc([C@H](NC(=O)c2cc(-c3ccc4c(c3)OCCO4)on2)C(C)C)n1 334162359 NDPKYLGCBXSFTR-QGZVFWFLSA-N 384.392 2.931 0 50 GFAA COc1ccc(C(=O)NCc2cccnc2N)cc1OC1CCN(C(C)C)CC1 95518365 GZHRKBUOMCLVDS-UHFFFAOYSA-N 398.507 2.854 0 50 GFAA COc1ccccc1OC1CN(C(=O)Nc2cccc(N3CCOC3=O)c2)C1 96149182 VYWQVXCDIRSLQW-UHFFFAOYSA-N 383.404 2.947 0 50 GFAA COc1cccc2ccc(CN3CCC4(CC3)c3[nH]cnc3CCN4C)nc12 91780893 XOPWGMOYEHWZRV-UHFFFAOYSA-N 377.492 2.946 0 50 GFAA CN1C(=O)[C@@](CC(=O)N[C@H]2CC[C@H](O)CC2)(Cc2ccccc2)c2ccccc21 248000400 AFTKFBYACWFVDN-KHCICDEESA-N 392.499 2.953 0 50 GFAA c1cncc(-c2noc(-c3cc4n(n3)C[C@@H](c3ccc5c(c3)OCO5)OC4)n2)c1 263618049 QZWGCQYZVGFXTO-SFHVURJKSA-N 389.371 2.995 0 50 GFAA COC(=O)c1nn(C)cc1-c1ccc(C(=O)NCc2cc(C3CC3)on2)cc1 534663282 BGLFJARNEDCFLY-UHFFFAOYSA-N 380.404 2.669 0 50 GFAA C[C@H]1CCCN(S(=O)(=O)c2ccc(N3CCC[C@@H](C)C3)c3nonc23)C1 35913016 AUBNAXODWVFDHF-KGLIPLIRSA-N 378.498 2.880 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2n[nH]cc2Cl)CC1 1940193428 DQHKYADNKZHJCK-UHFFFAOYSA-N 389.887 2.976 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1940197258 DGSSWADRZZHOGD-YLJYHZDGSA-N 391.826 3.000 0 50 GFAA Cc1n[nH]c(SCC(=O)NC[C@H](c2ccc(Cl)cc2)N2CCCC2)n1 299789680 ABHIMXGIPLWNHI-OAHLLOKOSA-N 379.917 2.812 0 50 GFAA CNC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2c2nc3cccc(C)c3[nH]2)o1 584884190 PSKNMGYPOFMSGN-OAHLLOKOSA-N 381.436 2.871 0 50 GFAA Cc1noc2nc(-c3ccco3)cc(C(=O)N3C[C@@H](C(=O)O)[C@H](C(F)F)C3)c12 1875266884 KMJUYDLXLUJCRV-GHMZBOCLSA-N 391.330 2.829 0 50 GFAA CCN=c1[nH]cnc2cc(C(=O)N[C@H]3CCO[C@@H](c4ccncc4)C3)ccc12 1875267898 HCSKIWBBLPSXFZ-QFBILLFUSA-N 377.448 2.529 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N[C@@H]2COc3ccc(Cl)cc3C2=O)cc1 1875373577 GQLZOFZHGZBUBD-MRXNPFEDSA-N 384.819 2.863 0 50 GFAA CC1(C)C=Cc2cc(CN[C@@H]3C[C@H](Cn4cc(C(=O)O)cn4)C[C@H]3O)ccc2O1 1875326575 MDNXOZGBNCCWSB-KFKAGJAMSA-N 397.475 2.695 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@H](C)c2ccc(N3CCCOC3=O)cc2)CC1 1875365077 POWYXSFMXLXOOC-HNNXBMFYSA-N 385.464 2.635 0 50 GFAA O=C(Nc1ccc(Oc2nn[nH]n2)cc1)[C@@H]1CCCN1C(=O)C1CCCCC1 952977784 RIGBQZOXCUGCKZ-INIZCTEOSA-N 384.440 2.502 0 50 GFAA CN(Cc1nc(O)c2sccc2n1)C(=O)[C@H]1CCCN(Cc2ccco2)C1 952976074 ULALLFOCXNHHSQ-ZDUSSCGKSA-N 386.477 2.861 0 50 GFAA O=C1C[C@@H](NC(=O)C2(N3CCCC3)CCCC2)CN1c1cccc(Cl)c1 952983836 WHNOJYDDJNBFIO-MRXNPFEDSA-N 375.900 2.970 0 50 GFAA O[C@H]1CN(Cc2ccc(Cl)s2)CC[C@@H]1N1CCN(c2ccccn2)CC1 1565505946 ZTNVRAWVBGKCQC-IRXDYDNUSA-N 392.956 2.554 0 50 GFAA C[C@H]1CN(CCN(C)C(=O)c2ccc(-n3cnc4ccccc43)nc2)C[C@@H](C)O1 194743689 GWIODHNCXWKXSP-CALCHBBNSA-N 393.491 2.602 0 50 GFAA O=C(Cc1cccnc1)NC[C@H]1CCCN(Cc2cccc(-n3cccn3)c2)C1 1506423897 YNZJXPYKQKHZEA-OAQYLSRUSA-N 389.503 2.838 0 50 GFAA COc1ccc(CN(C)c2nccc(N3CCC[C@@H](O)C3)n2)c2cccnc12 1529158530 FVEGKWHUCNFUAE-MRXNPFEDSA-N 379.464 2.631 0 50 GFAA O=C(c1cncs1)N1C[C@@H]2OC(=O)N(CCCc3ccc(F)cc3)[C@@H]2C1 211634235 NRTBHVBIAXGOFK-CABCVRRESA-N 375.425 2.560 0 50 GFAA COc1ccc(OC[C@@H](O)CN(C)C)c(CNCc2cc(F)ccc2F)c1 12057269 NURPWFSNAVKZOO-KRWDZBQOSA-N 380.435 2.565 0 50 GFAA O=C(Nc1ccnn1C1CCN(Cc2ccc3c(c2)CCO3)CC1)[C@H]1CCOC1 12074901 QKOHTSLJYJDWDF-SFHVURJKSA-N 396.491 2.630 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C(=O)c2cccc(F)c2)CC1 19594974 VUFJLOBWHCYWQL-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA Cc1ccc(CNC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1 169768809 KNUMFYRGLWLDLN-UHFFFAOYSA-N 381.505 2.829 0 50 GFAA CC(=O)Oc1ccc(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)cc1 6477817 IMWLXXYCDMWFJK-GZTJUZNOSA-N 377.425 2.599 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857672098 JKCSSIXQJKGUMB-QFIPXVFZSA-N 389.459 2.703 0 50 GFAA O=C(O)[C@H]1CN(Cc2ccncc2)CC12CCN(C(=O)CC1CCCC1)CC2 1857683490 HJSHQXBRJZHXRO-LJQANCHMSA-N 385.508 2.787 0 50 GFAA COCCCn1cnnc1Cn1ccnc1-c1cc2cc(C)ccc2nc1O 1857689627 UHOGEWAOJZVVAD-UHFFFAOYSA-N 378.436 2.789 0 50 GFAA COc1ncccc1C(=O)N1C[C@H](c2ccc(C)cc2)[C@@H](NC(=O)C2CC2)C1 216487119 SHCKJJZOXWYKAX-MOPGFXCFSA-N 379.460 2.533 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@H](Cc1ccccc1)C(=O)O 236826257 SZJPSLQMJNLSKZ-UXHICEINSA-N 378.428 2.763 0 50 GFAA O=C(C1CCNCC1)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704307696 DHMPYKZNPSEILJ-HSZRJFAPSA-N 376.504 2.950 0 50 GFAA CN(C(=O)c1ccnc(C(F)(F)F)c1)[C@H]1CCN(Cc2ccccc2)C1=O 808768143 ZWWYAFSLMDVGSR-HNNXBMFYSA-N 377.366 2.974 0 50 GFAA CC1(C)CN(C(=O)c2nc(N3CCOCC3)ncc2Cl)Cc2ccccc21 2325708149 RWFBXCHYLHFJMY-UHFFFAOYSA-N 386.883 2.900 0 50 GFAA COC(=O)c1ccc2nc(CN(C)C3CCN(c4ccccn4)CC3)cn2c1 2325800902 LWPKEZCBPJLWFZ-UHFFFAOYSA-N 379.464 2.617 0 50 GFAA CC(C)CCc1ncc2c(n1)CCN(C(=O)Cc1ccc3c(n1)NCCC3)C2 2325801832 XYXPMLNFGAADAB-UHFFFAOYSA-N 379.508 2.946 0 50 GFAA O=C(NC(=S)Nc1ncccc1O)c1ccccc1I 678727 OFJGUTWQICGHPB-UHFFFAOYSA-N 399.213 2.519 0 50 GFAA Cc1cc(OCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)ccc1Cl 2861893 QIQRJDZRRQYOAR-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(Cl)cc1 4071067 DXQDJIWIUZLXPO-QGZVFWFLSA-N 392.864 2.884 0 50 GFAA biogenic CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OC(C)C)[C@H]1c1cccc(F)c1 4142487 BUIRXUKDPLWXQU-OOSNJVJTSA-N 394.439 2.769 0 50 GFAA O=C(CSc1nnc(-c2ccccc2O)n1-c1ccccc1)N1CCOCC1 5051265 JEAQKMDRAZGACF-UHFFFAOYSA-N 396.472 2.591 0 50 GFAA O=C(c1nc2ncccn2n1)N1CCc2c([nH]c3ccccc23)[C@@H]1c1ccccn1 11662952 HMZVKCGAHVNUDZ-IBGZPJMESA-N 395.426 2.789 0 50 GFAA COC(=O)c1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccc3F)C2)nc1 11958691 DKQGIKZIXMFYGR-KRWDZBQOSA-N 385.439 2.744 0 50 GFAA COc1ccc(OC)c(C(=O)NC[C@H]2Cc3cccc(-c4cncnc4)c3O2)c1 11974100 KZHSEBDTZNSGSS-QGZVFWFLSA-N 391.427 2.894 0 50 GFAA CCCCNc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc2ccccc12 13786403 RDLUGDUSTYDPRN-UHFFFAOYSA-N 391.475 2.847 0 50 GFAA COCCNC(=O)c1nn(CCC(C)C)c2c1CN(Cc1ccccc1)CC2 14749195 NKKCHGPGSSTIPN-UHFFFAOYSA-N 384.524 2.864 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N[C@H](C)c1cnn(-c2ccccn2)c1C 14980611 RPFGQSNDGWUFRY-CQSZACIVSA-N 386.477 2.932 0 50 GFAA CCCCOc1ccc(/C=c2\sc3nc(-c4cccnc4)nn3c2=O)cc1 19912673 XROYNFNYBCHWMQ-ATVHPVEESA-N 378.457 2.940 0 50 GFAA COc1ccc(-c2nc(CN3CCN(c4nonc4C)CC3)c(C)o2)c(F)c1 55383779 HLVAGFUMTZTJAU-UHFFFAOYSA-N 387.415 2.811 0 50 GFAA COc1c(F)cccc1C(=O)N1CCc2nnc(CCc3ccccc3)n2CC1 67712935 KLGAGNOUOACPDJ-UHFFFAOYSA-N 394.450 2.910 0 50 GFAA O=S(=O)(c1ccc(-c2cnco2)cc1)N1CCCC2(CCNCC2)CC1 67842482 YUTLTOBSMSOXLY-UHFFFAOYSA-N 375.494 2.886 0 50 GFAA CSc1nc2nnc3c(=O)n(-c4ccccc4C(F)(F)F)ccc3n2n1 71376351 ZWZFZDXXLVJOSM-UHFFFAOYSA-N 378.339 2.564 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71776834 OUULMRKIDNZXMR-LJQANCHMSA-N 382.508 2.667 0 50 GFAA COc1ccc([C@@H]2CN(C3CCN(C(C)=O)CC3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95364146 BQOFCFGOPSLXNQ-YTFSRNRJSA-N 383.536 2.568 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCN(c2ncccc2C)CC1 95385908 DXICOGWTCJVURY-QGZVFWFLSA-N 375.856 3.000 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c1 95506943 MDECPHWLRAHCOH-UHFFFAOYSA-N 392.503 2.953 0 50 GFAA CC(C)c1cc(CN(C)C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)no1 95531703 BNHKEXNQQDEAFO-UHFFFAOYSA-N 386.861 2.763 0 50 GFAA COC(=O)C[C@@H]1CCN(C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)C1 97347182 ACPGNCJFFDVVQU-LBPRGKRZSA-N 381.860 2.895 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)c1cnc(-c3ccncc3)nc1)CC2 97717391 HGTOUYUTPSODGT-UHFFFAOYSA-N 376.416 2.754 0 50 GFAA CCOc1ccccc1N1C(=O)C[C@H](Nc2ccc(N3CCOCC3)cc2)C1=O 100622769 AKGUENMWHJKLQR-SFHVURJKSA-N 395.459 2.666 0 50 GFAA C[C@@H]1CCc2ccccc2[C@H]1NC(=O)C1CCN(c2ccc3nncn3n2)CC1 122616950 LXGWDBNSPARLJP-VFNWGFHPSA-N 390.491 2.781 0 50 GFAA CCNS(=O)(=O)c1ccc(CNC(=O)N2CCc3ccccc3[C@@H]2C)cc1 152538677 KDAIJKHJDXTYJX-HNNXBMFYSA-N 387.505 2.814 0 50 GFAA O=C(c1ccc(N2CCCC2)nn1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 179891470 PSUXKXCAVSMMJY-UHFFFAOYSA-N 394.401 2.769 0 50 GFAA O=C(Cc1ccccc1)N1CCN(C(=O)c2cc(F)c(F)c(F)c2F)CC1 192521287 OLSCWEQTTCZCPC-UHFFFAOYSA-N 380.341 2.770 0 50 GFAA Cn1ccnc1CN1CCC(C(=O)Nc2cnn(Cc3ccccc3)c2)CC1 194371038 LZOXHDQNWYPSRU-UHFFFAOYSA-N 378.480 2.516 0 50 GFAA Cn1nccc1[C@H](O)c1cc2n(n1)CCCN(C/C=C/c1ccc(F)cc1)C2 218829351 XCZPLKLSPFTTJK-ZZNNXKBLSA-N 381.455 2.757 0 50 GFAA O=C(OCC(=O)N1CCCCCC1)c1cnn(-c2ccncc2)c1C(F)F 225590037 XZORRAKXHQKJDL-UHFFFAOYSA-N 378.379 2.764 0 50 GFAA CN(CC(=O)Nc1ccc(Br)cc1)C[C@H]1CCn2ccnc2C1 225671994 SXFMMNLCEIYSLS-ZDUSSCGKSA-N 377.286 2.779 0 50 GFAA COC(=O)C[C@H]1CN([C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)CCO1 229423747 WKLRATKCRPGIOR-QWRGUYRKSA-N 375.252 2.584 0 50 GFAA Cc1nc(-c2ccccn2)sc1C(=O)O[C@H](C)C(=O)N1C[C@H](C)O[C@@H](C)C1 229770769 RWTGVJGSQURKGD-SGMGOOAPSA-N 389.477 2.695 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3c4ccccc4[C@@H]([C@@H]4C=CC=C[C@H]34)[C@H]2C1=O)c1ccncc1 229875728 NVMBSBHKEBHUNI-QYFYJVOWSA-N 397.434 2.581 0 50 GFAA CC(=O)N[C@H](CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O)c1ccc(C)cc1 236720694 YLPJKYNZZUJIBR-UXHICEINSA-N 380.444 2.600 0 50 GFAA CCn1ccnc1CN(C(=O)c1cccc2[nH]ncc12)[C@H]1CC12CCNCC2 261913494 XXNHNVWIGRQLJN-SFHVURJKSA-N 378.480 2.564 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC(Nc3cccnn3)CC2)ncn1 275574504 GLZBUGTXJPATLD-UTKZUKDTSA-N 397.527 2.963 0 50 GFAA CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N3CC[C@@]4(CNC(=O)C4)C3)ccc21 279046621 YNAVJABVDYFAKY-GOSISDBHSA-N 394.397 2.988 0 50 GFAA O=C(CCn1nnc2ccccc21)NC[C@H](c1ccc(F)cc1)N1CCCC1 299787741 XQEQTHLKJSFIIK-HXUWFJFHSA-N 381.455 2.914 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H]3CCCC[C@@H]3O)csc2C1 426550673 SEVBCNZFVKGXLG-ROUUACIJSA-N 389.521 2.945 0 50 GFAA O=C(C(=O)N1CC[C@@H]1c1ccc(Cl)cc1)N1CCN(c2ccccc2)CC1 462189167 MWDPEIVDEDMLSL-LJQANCHMSA-N 383.879 2.962 0 50 GFAA O=C1C[C@H](C(=O)N2C[C@H](O)C[C@H]2c2ccc(F)cc2)CN1c1ccc(F)cc1 770185808 FHZTYZYUJCROEE-KYNGSXCRSA-N 386.398 2.652 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)CCn2cnc3ccccc32)n1 827822394 KYVUCDFIAZXUKF-UHFFFAOYSA-N 377.370 2.903 0 50 GFAA O=C(C1CCN(Cc2ccco2)CC1)N1CCN(c2nc3ccccc3o2)CC1 827956751 AJJMEMMTLGEQAI-UHFFFAOYSA-N 394.475 2.982 0 50 GFAA COC(=O)/C=C/c1ccc(OCCOC(=O)[C@@H]2CCO[C@H]2c2ccncc2)cc1 845263970 UUNOOUHFDVPOLM-ZUYNHSBASA-N 397.427 2.968 0 50 GFAA O=C(Nc1cnn(-c2ccc(Cl)cc2Cl)c1)N1C[C@H]2COC[C@@H](C1)O2 888102303 PLYKTBYHXULCCC-BETUJISGSA-N 383.235 2.811 0 50 GFAA Cc1noc(COCC(=O)N2CC(C)(C)[C@@H]2c2nccn2-c2ccc(F)cc2)n1 952890550 CKXZQXALIIJKCU-SFHVURJKSA-N 399.426 2.829 0 50 GFAA Cc1ncnc(C)c1C(=O)NC[C@H]1CCCN(c2nnc(C)c3ccccc23)C1 952970905 XFBXKCIZLCXARE-QGZVFWFLSA-N 390.491 2.991 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N(C)Cc3nncn3C(C)C)o2)c1C 1506418467 RRXUIBZXFKDEEU-UHFFFAOYSA-N 379.442 2.545 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N(C)Cc2cnc(-c3ccccc3)s2)C1 1506419068 WRIXMUQTMGSDEA-OAHLLOKOSA-N 395.550 2.845 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)Cc3c(C)n[nH]c3C)CC2)ccc1Cl 1529154070 XCMWWNDMNATPTO-UHFFFAOYSA-N 388.899 2.906 0 50 GFAA Cc1cnc(CNC(=O)[C@H]2CCc3sc(-c4c(C)noc4C)nc3C2)cn1 1772819965 YSLRCUMKVJPKAB-ZDUSSCGKSA-N 383.477 2.935 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ccccn2)CC[C@@H]1Nc1ncc(F)cn1 1857686862 FXVOZOAWRQIHGR-WBAXXEDZSA-N 387.459 2.703 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1nnc3n1CCCCC3)CC2 1857696040 JGFCMEQWLXZDHC-UHFFFAOYSA-N 390.491 2.646 0 50 GFAA CCc1nccn1CCCNC(=O)C[C@H]1CCCN(c2nc3ncccc3o2)C1 1857698740 GMWMZXZASUCGJN-MRXNPFEDSA-N 396.495 2.795 0 50 GFAA O=C(N1CCCOc2cccc(c2)CC[C@H]2CCCCN2CC1)C1(CO)CC1 1857703373 JQUMUCHUDHWAQS-HXUWFJFHSA-N 386.536 2.857 0 50 GFAA O=C(Cc1cccc(O)c1)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857722337 ILLDKJFPBBZYRU-WSTZPKSXSA-N 386.879 2.919 0 50 GFAA CC[C@@]1(C(=O)NCc2ccccn2)C[C@@H]2CC[C@H]1N2Cc1cccnc1OC 1857728027 KBGPBZSQGIJOIT-NNMXDRDESA-N 380.492 2.935 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)Cc3ccccc3C(F)(F)F)C[C@]23CC[C@H]1O3 1857728101 NQZKEBXLMKRYOZ-KNIMUDFMSA-N 382.426 2.816 0 50 GFAA O=C(Cc1ccccc1F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857732188 GVFFJWMSECHCHQ-KNKQGSTJSA-N 380.419 2.669 0 50 GFAA O=C(CN1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1)NC1CC1 1875247004 IQRGLUXIVVUJEV-LEWJYISDSA-N 380.444 2.809 0 50 GFAA CCn1c(O)nc2cc(C(=O)N3CC[C@H](n4c(=O)oc5ccccc54)C3)ccc21 1875274625 OLHJBUKNVIZBHH-AWEZNQCLSA-N 392.415 2.757 0 50 GFAA CCN(Cc1ccc(Cl)cc1)C(=O)c1nc(C)c(C)c(N2CC[C@@H](N)C2)n1 1875401563 LGJCHVWALWLYGN-QGZVFWFLSA-N 387.915 2.947 0 50 GFAA CN1CCN(C(=O)Cc2ccc(NC(=O)c3ccc4sncc4c3)cc2)CC1 2325784939 VLKOHMPWKBRDKR-UHFFFAOYSA-N 394.500 2.865 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cccc4c3CCC4=O)C1)CC2 2356158707 WBTQUZVYYPXKTE-QHCPKHFHSA-N 390.487 2.792 0 50 GFAA O=C(COc1ccc(Br)cc1)N1CCN(c2ccccn2)CC1 903276 OZCUIFWCWLFUBJ-UHFFFAOYSA-N 376.254 2.572 0 50 GFAA Cc1ccccc1CCC(=O)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356143139 WGBGYXLHFMKYGA-NFBKMPQASA-N 381.472 2.835 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(c4cc[nH]c(=N)n4)C3)[C@@H]3CCCCN23)c1 2356153642 OXRMVCDELXIDGV-ZFMNYDKASA-N 393.535 2.820 0 50 GFAA CCN(C(=O)CSc1nnnn1-c1ccc2c(c1)OCO2)c1ccccc1 2868891 UAHHIRKFNDOCDG-UHFFFAOYSA-N 383.433 2.536 0 50 GFAA COc1cc(S(=O)(=O)Nc2ncccc2C)c(OC)cc1Br 6706866 OAXIQTBFIATCTP-UHFFFAOYSA-N 387.255 2.971 0 50 GFAA COc1ccccc1C(=O)Nc1cc2c(cc1N1CCCC1)n(C)c(=O)n2C 6794685 QCIJLRJBZDBVDB-UHFFFAOYSA-N 380.448 2.738 0 50 GFAA in-vitro Cc1cc(=O)[nH]c(S[C@H](C)C(=O)N(CCN(C)C)Cc2ccc(C)s2)n1 55168884 XOXJZLHOVVAWBL-CQSZACIVSA-N 394.566 2.519 0 50 GFAA Cc1nc2sccn2c1CN1CCN(CCc2ccccc2)[C@@H](CCO)C1 23153311 JYCYWVVUZMNXRS-IBGZPJMESA-N 384.549 2.816 0 50 GFAA C[C@@H](CO)CN(Cc1ccccc1)C(=O)COc1ccc2ccc(=O)oc2c1 55107877 YAWHCOOSVBIODW-MRXNPFEDSA-N 381.428 2.829 0 50 GFAA Cc1cccc2c(C(=O)N(C)C)cc(-c3cnc(N4CCOCC4)nc3)nc12 63882926 BGZVXOKTKMLJRF-UHFFFAOYSA-N 377.448 2.539 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNCc3cc(C)ccc3C)C2=O)c1 67805444 PSLBIWOAMVDLQE-HSZRJFAPSA-N 382.504 2.955 0 50 GFAA Cc1ccc(-c2nnc(SCC(=O)NC[C@H](O)Cc3ccccc3)[nH]2)cc1 152056876 FVGRBYRGJVWTPS-QGZVFWFLSA-N 382.489 2.592 0 50 GFAA CCc1nnc([C@H]2CN(S(=O)(=O)/C=C/c3ccc(Cl)cc3)CCO2)o1 328632765 SDGSRXPLZDCFBW-DNGMOHDESA-N 383.857 2.659 0 50 GFAA COC(=O)[C@H](CCCNC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1 34304975 QLBNCJXLDQTPHC-HNNXBMFYSA-N 380.441 2.759 0 50 GFAA FC(F)(F)[C@H](Nc1nc2nonc2nc1N1CCSCC1)c1ccccn1 11821128 FOMSRBJMPZIQJW-SNVBAGLBSA-N 397.386 2.677 0 50 GFAA CN(Cc1nc(-c2ccco2)no1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 155576048 TUMMORFXQAUDGP-LBPRGKRZSA-N 379.825 2.943 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CSc3ncccn3)CC2)OC1=O 77428649 QUGIXVVUUUCWLC-AWEZNQCLSA-N 378.498 2.571 0 50 GFAA CC(C)N(C)C(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72147054 PVVPUWZSJCGIEH-JOCHJYFZSA-N 393.531 2.876 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(C(=O)c1ccc(N3CCCC3)cc1)C2 72481224 NCVOCDRKBFOSHD-UHFFFAOYSA-N 382.464 2.547 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2C[C@H](C(=O)O)CN(Cc3ccc(F)cc3F)C2)cn1 71523838 NFDOSDNMLOKYPM-CABCVRRESA-N 389.402 2.830 0 50 GFAA Cc1ccc2nc(N3CCC[C@@H](O)C3)c(CN(C)Cc3cnccn3)cc2c1 72447419 HBFSNDWQMIAUGG-HXUWFJFHSA-N 377.492 2.926 0 50 GFAA OC[C@@H](O)c1cc2n(n1)CCCN(CC(c1ccccc1)c1ccccc1)C2 221373667 KCKICXQLMRHMDZ-HSZRJFAPSA-N 377.488 2.947 0 50 GFAA CC(=O)Nc1cc(C(=O)N2CCC(NC(=O)C3CC3)CC2)cc(C(F)(F)F)c1 177870451 ZPZFANLVXCKHCY-UHFFFAOYSA-N 397.397 2.795 0 50 GFAA Cn1cccc1C(=O)C(=O)N1CCC[C@@H](c2nccn2Cc2ccccc2)C1 82097068 WLSWTZBTJLJBFL-GOSISDBHSA-N 376.460 2.859 0 50 GFAA Cc1nnc(-c2cccc(N3CCC(NCCN4CCOC4=O)CC3)c2)s1 82039344 XHJZSTCFLCGXED-UHFFFAOYSA-N 387.509 2.524 0 50 GFAA Cc1c(C(=O)N[C@H]2CCOC3(CCCC3)C2)cnn1CCO[C@@H]1CCCCO1 179327168 MPTTZTSYNGCCBM-PKOBYXMFSA-N 391.512 2.956 0 50 GFAA O=C(c1cc(-c2ccccc2O)n[nH]1)N1CCCN(Cc2ccccn2)CC1 92107361 ZOHWUDBFNJRYPF-UHFFFAOYSA-N 377.448 2.525 0 50 GFAA CNc1ncc(C(=O)N(C)C[C@H]2CCCN(CCc3ccccc3OC)C2)cn1 95512920 OSDQKVLHOBQIJB-QGZVFWFLSA-N 397.523 2.554 0 50 GFAA CN(C)C(=O)c1cc2c(s1)CCN(CCC(=O)Nc1cccc(F)c1)C2 244795209 RBOLSQIHHZQRMQ-UHFFFAOYSA-N 375.469 2.976 0 50 GFAA O=C1C[C@@H](c2ccccc2)N(C(=O)C2CCN(Cc3ccccc3)CC2)CCN1 299303737 SAEMIHVWTZKKDW-QFIPXVFZSA-N 391.515 2.988 0 50 GFAA CCN1CCC(N[C@H]2C[C@@H](C(=O)NC(C)C)N(C/C=C/c3ccccc3)C2)CC1 299764437 WGTFFOWMWTXCOY-GZWJZLGDSA-N 398.595 2.741 0 50 GFAA NC(=O)c1cccc(CN(Cc2ccccc2)C(=O)[C@H](F)C2CCNCC2)c1 1875292159 YQUHRZYNGPVFQA-HXUWFJFHSA-N 383.467 2.652 0 50 GFAA NC(=O)c1csc(CN[C@H](CC(=O)O)Cc2ccc(Br)cc2)c1 1875303801 NJFCYYIOKZRUQX-ZDUSSCGKSA-N 397.294 2.785 0 50 GFAA CC(=O)N1CC2(CCN(C(=O)c3ccc4cnc(C)cc4c3)CC2)[C@@H]2COC[C@@H]21 1875316978 KEXQAOORHYXFQB-RTWAWAEBSA-N 393.487 2.643 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CCC[C@]2(C[C@@H]2C(=O)O)C1 1875304799 VNLYPOWHWFWNCS-GDKCJGSASA-N 387.402 2.879 0 50 GFAA Cn1nccc1S(=O)(=O)N1CC=C(c2cccc(OC(F)(F)F)c2)CC1 888091001 MLVJNLJPAWMCAB-UHFFFAOYSA-N 387.383 2.797 0 50 GFAA C[C@@H](NC(=O)c1cnn2c(-c3cccnc3)ccnc12)c1cc2n(n1)CCCC2 898388195 LOUBHZFZIWSUSX-CQSZACIVSA-N 387.447 2.815 0 50 GFAA CCCS(=O)(=O)NC1CCN(C(=O)NCc2c(C)oc3ccccc23)CC1 186161654 OXSMNCVMJSFPMH-UHFFFAOYSA-N 393.509 2.745 0 50 GFAA CC(C)n1ncc2c1C[C@@H](NC(=O)C[C@@H]1CN(Cc3ccccc3)CCO1)CC2 170681760 RPFOQQWSAGILFI-LEWJYISDSA-N 396.535 2.729 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)cc1 171988721 QJRABYGRKCJWPK-CTNGQTDRSA-N 393.487 2.614 0 50 GFAA COc1ccc([C@H](O)[C@@H](C)NC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)cc1 221998361 SDOOUSACWMLWBM-SEDUGSJDSA-N 386.473 2.980 0 50 GFAA CCCc1nc(C(=O)N2CCOC[C@@]23CCOC3)nn1-c1ccccc1Cl 194403656 DJSPRUVUQXUIMG-IBGZPJMESA-N 390.871 2.505 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCC(=O)N(Cc3cscn3)CC2)c1 1506404400 UAMKZBPMJRQKTB-UHFFFAOYSA-N 397.504 2.572 0 50 GFAA O=C(CSc1ccccn1)N[C@H]1CC(=O)N(CCc2cccc(Cl)c2)C1 11667870 XEXPRBDGVQYTEE-INIZCTEOSA-N 389.908 2.787 0 50 GFAA CCCc1cc(CNC(=O)[C@H]2CCC(=O)N(Cc3ccccc3OC)C2)on1 12057215 SBVCRKWFIKOLEU-INIZCTEOSA-N 385.464 2.691 0 50 GFAA Cc1n[nH]c(C)c1CN(C)Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1 12316296 RVPKUQFOMYYEFT-UHFFFAOYSA-N 393.557 2.839 0 50 GFAA O=C(CCc1nnc(-c2ccc3c(c2)OCO3)o1)NCCc1ccccc1F 12585228 QYQNCRUOXOYURK-UHFFFAOYSA-N 383.379 2.896 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ocnc1C 14976202 URDFKSGCHVWIBG-SFHVURJKSA-N 397.519 2.951 0 50 GFAA O=C1CC2(CCN(c3ncccn3)CC2)OCCN1Cc1cccc(Cl)c1 1857705853 YSOGCRMRWXQFJM-UHFFFAOYSA-N 386.883 2.918 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3C[C@H](C(C)C)[C@@H](NS(C)(=O)=O)C3)oc2c1 216392287 KRHAMKOEQDEPKJ-CVEARBPZSA-N 378.494 2.695 0 50 GFAA O=C(c1c(F)cccc1Br)N1CCC(N2CCCNC2=O)CC1 131209724 BTKLAXWCOXVFAK-UHFFFAOYSA-N 384.249 2.608 0 50 GFAA Cc1cc(C)nc(-n2[nH]c(C(=O)N(C3CC3)[C@@H](C)c3ccccc3)cc2=O)n1 900421274 FJFFLPCPGHBUBC-HNNXBMFYSA-N 377.448 2.938 0 50 GFAA CC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(F)c1 902325 KROXYUUIQCXNNY-UHFFFAOYSA-N 376.453 2.848 0 50 GFAA COc1cc([C@@H]2CC(=O)Oc3c2c(=O)[nH]c2ccccc32)cc(OC)c1OC 4387090 SIINJJJKTOQKEM-ZDUSSCGKSA-N 381.384 2.995 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2ccccc2)nc1 2325785764 MNPUITGWITUXRJ-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA CC[C@@H](C(N)=O)N1CC[C@@]2(CCN(C(=O)c3coc4cc(C)c(C)cc34)C2)C1 2325793777 HMLYZMRKYPXKGA-PGRDOPGGSA-N 383.492 2.852 0 50 GFAA O=C([C@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC[C@H](N2CCCC2)CC1 2325807663 KZDXGUFIXMNDIS-ICSRJNTNSA-N 394.523 2.764 0 50 GFAA OC[C@@]1(NCc2ccc(-n3cncn3)cc2)CCc2cc(Br)ccc21 2325812820 KETBFUQUUXEREX-IBGZPJMESA-N 399.292 2.953 0 50 GFAA COc1cc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c(OC)cc1Cl 911365 BIVIUHLOAVPGTQ-UHFFFAOYSA-N 385.825 2.564 0 50 GFAA O=C(COc1cc2oc(=O)c3c(c2cc1Cl)CCC3)NC[C@H]1CCCO1 1124451 UWLPVZPBSZVZAB-LLVKDONJSA-N 377.824 2.609 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc4c(c3)CCCO4)C1)CC2 2356133950 OWFIUSQSYDUUCS-QHCPKHFHSA-N 392.503 2.988 0 50 GFAA COc1ccc2cc(S(=O)(=O)N3CCC[C@]34CCCN(C)C4=O)ccc2c1 2356152462 KREJIZLEXDYEGH-FQEVSTJZSA-N 388.489 2.624 0 50 GFAA Cc1nonc1[C@H]1CCCN1C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356167177 JIIDIGLCDMKHCB-CQSZACIVSA-N 388.493 2.568 0 50 GFAA CCOC(=O)C(OC(=O)Cn1c(=O)sc2ccccc21)=C(Cl)Cl 3106426 BTAVTFHYFFUTRA-UHFFFAOYSA-N 376.217 2.816 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1C(=O)NC1CCCCC1 4850731 NVWAVKALXFNMIH-MRXNPFEDSA-N 380.510 2.515 0 50 GFAA Cc1cc(C)c(CNC[C@@]2(O)CCCN(CCCc3ccccc3)C2=O)cn1 67947910 JJPTVPWGQUNSQI-QHCPKHFHSA-N 381.520 2.774 0 50 GFAA CCn1c(C2CCN(C(=O)Nc3cc(Cl)nc(Cl)c3)CC2)nn(C)c1=O 67674088 UQKHXOCESORKCR-UHFFFAOYSA-N 399.282 2.715 0 50 GFAA Cc1ccc(O[C@@H]2CCN(S(=O)(=O)Cc3cccc4cccnc34)C2)cn1 328625795 LBYBLQGDSMZWAT-LJQANCHMSA-N 383.473 2.921 0 50 GFAA COc1ccc2[nH]cc(CC(=O)NCC3(N4CCCCC4)CCN(C)CC3)c2c1 172751522 IJXJUCIXSLUAFW-UHFFFAOYSA-N 398.551 2.786 0 50 GFAA Cc1nnc(CNC(=O)Cc2c3c(n(Cc4ccccc4)c2C)CCCC3=O)o1 39454824 MRJHALWHQVYOEM-UHFFFAOYSA-N 392.459 2.914 0 50 GFAA C[C@@H]1C[C@H]1c1ccc(/C=C/C(=O)N2CCN(CC(=O)N3CCCC[C@H]3C)CC2)o1 253418335 OPNBHGFMVUMHFF-HFTIZXJOSA-N 399.535 2.961 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@@H](Cn3cncn3)C2)nn1-c1ccccc1F 173856695 OZYKBCKTHDTNEQ-OAHLLOKOSA-N 397.458 2.503 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCC[C@H](N2CCN(c3ccccc3F)CC2)C1 72172939 HGSOBNFYRMQWCC-KRWDZBQOSA-N 399.514 2.928 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1CCC2(CC1)CN(CCN(C)C)C(=O)O2 77376578 DSJZAQYQQVHCKH-UHFFFAOYSA-N 377.485 2.700 0 50 GFAA CCc1nc(CN2CCC[C@H](NC(=O)[C@H](C)c3c(F)cccc3F)C2)no1 378321303 XLHRQAJOFYPSNR-OLZOCXBDSA-N 378.423 2.795 0 50 GFAA O=C(Cn1nc2c(cc1=O)CN(CCCC1CCCCC1)CC2)N1CCCC1 368568246 PSCLUBGRKCUPEZ-UHFFFAOYSA-N 386.540 2.584 0 50 GFAA CN(CCc1ccc(F)cc1)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C 368646447 VCDNTWQMJCMXRH-WIYYLYMNSA-N 398.482 2.702 0 50 GFAA CC1(C)CC(=O)c2cc(C(=O)N3CCNC[C@H]3c3cccc(F)c3)c(O)nc2C1 261938234 KFGSMHSWKVEXQL-SFHVURJKSA-N 397.450 2.868 0 50 GFAA C[C@H](c1nc(-c2cccnc2)no1)N1CCc2ccc(S(C)(=O)=O)cc2CC1 374813112 XVPQFHVSIPLIMG-CQSZACIVSA-N 398.488 2.697 0 50 GFAA CC(C)CN1C(=O)N(C)C2(CCN(Cc3cccn3-c3cccnc3)CC2)C1=O 14539277 ASOOBAHJJFUKFK-UHFFFAOYSA-N 395.507 2.757 0 50 GFAA CCOCCNC(=O)c1ccc([C@@H]2CCCN2Cc2ccc(CO)o2)s1 82039614 PUWDYWCMUZQURQ-INIZCTEOSA-N 378.494 2.937 0 50 GFAA Cc1cc(NC(=O)Cn2cc(-c3ccnc(N)n3)cn2)n(C2CCCCC2)n1 48224013 ZEDUVKHHXUMCIX-UHFFFAOYSA-N 380.456 2.571 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1ccn(Cc2c(Cl)cccc2Cl)n1 226393899 NOOZLSAWAGEZOY-VDERGJSUSA-N 392.242 2.905 0 50 GFAA Cc1ccc(CN(CCO)C(=O)NC2CCN(Cc3cccnc3)CC2)s1 426582754 FLSSIJJOLBTSFU-UHFFFAOYSA-N 388.537 2.620 0 50 GFAA COc1ccc(CCNC(=O)N2CCC[C@@H](CN3CCCC3)C2)cc1OC 426649684 NTFGZOBRQRXMBS-SFHVURJKSA-N 375.513 2.764 0 50 GFAA CS(=O)(=O)NCCNC(=O)C[C@@H](c1ccccc1)c1ccccc1Cl 95504170 UMIZJIRJCGRGLH-INIZCTEOSA-N 380.897 2.527 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)Cn2nc(C)cc2C)C3)cc1 95387304 JAIBQTIUYDAYGC-VQTJNVASSA-N 382.508 2.632 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@@H]1CCS(=O)(=O)C1)c1ccccc1 334158350 INIPDONOVXROOX-QGZVFWFLSA-N 381.457 2.584 0 50 GFAA Cc1nc(-c2ccccc2)ncc1C(=O)N1CC[C@H](N(C)C)[C@H](CCCO)C1 91452380 CTQPILKIBUMMJO-QUCCMNQESA-N 382.508 2.617 0 50 GFAA O=C(c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O)N1CCSCC1 91663994 CJKLDIVQLJPXPL-UHFFFAOYSA-N 384.288 2.857 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95501066 NWUGYFMGWMNUBO-CYBMUJFWSA-N 382.493 2.620 0 50 GFAA CCc1ccccc1OC1CN(C(=O)[C@H]2CC(=O)N(c3cccc(O)c3)C2)C1 96149307 XRDXGHWMIDNETK-INIZCTEOSA-N 380.444 2.597 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N3CCC[C@@H]3Cn3cccn3)CC2)cc1 534635090 JMFPZDMMYUFZDH-HXUWFJFHSA-N 395.507 2.670 0 50 GFAA O=C(NCCN1CCCC[C@@H]1CO)c1ccc(-c2cnn3ccccc23)cc1 534664749 GGRSENPZPTUXEK-LJQANCHMSA-N 378.476 2.578 0 50 GFAA Cc1nc(C)c(C(=O)NC[C@H]2CCCN(C(=O)c3cccc4c3NCCC4)C2)o1 825268472 GFISESNHZICMCA-MRXNPFEDSA-N 396.491 2.932 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 269027538 KXUPFQWKUYQDET-FQEVSTJZSA-N 387.457 2.597 0 50 GFAA Cc1ccccc1SC1CCN(C(=O)NC2CCN(CCO)CC2)CC1 584884746 QMWFALCYLZXZRX-UHFFFAOYSA-N 377.554 2.718 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)NCc1n[nH]c2c1CCCCC2 670444666 PRFPQRYGFMRKCS-UHFFFAOYSA-N 380.452 2.763 0 50 GFAA Cc1nc(C(=O)N(Cc2ccccc2F)C2CC2)nc(N2CC[C@@H](N)C2)c1C 1875398638 ZSVCKHLHELIIAW-MRXNPFEDSA-N 383.471 2.575 0 50 GFAA COc1nscc1S(=O)(=O)N1CCO[C@H](c2cccc(Cl)c2)[C@H]1C 1875393882 OMLAILNRCQEDLS-YGRLFVJLSA-N 388.898 2.956 0 50 GFAA CCCNC(=O)c1ccc(C)c(NC(=O)CN2CCOc3ccccc3C2)c1 952964910 CCWKMKCIKXACKX-UHFFFAOYSA-N 381.476 2.968 0 50 GFAA COc1cccc2c1OCCCN(C1CCN(C(=O)c3cccnc3)CC1)C2 952971645 MCDDVKRWHRSQLC-UHFFFAOYSA-N 381.476 2.980 0 50 GFAA COc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2cccnc2)C3)c(OC)c1 1565512743 DTBGUMGPYOAMHD-MSOLQXFVSA-N 381.476 2.835 0 50 GFAA O=C([C@@H](Cc1ccccc1)Nc1ncnc2ccc(F)cc12)N1CCOCC1 185511117 RPVMIZBQNDMEQH-LJQANCHMSA-N 380.423 2.651 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@H](Cn3cncn3)C2)ncn1 275653556 KRWBHQVFLOWEEA-QKLQHJQFSA-N 385.516 2.600 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2ccc(Br)cc2C)CC1 186638322 YNDZRXODQNFOMW-UHFFFAOYSA-N 383.286 2.769 0 50 GFAA COC[C@H]1[C@@H](NC(=O)c2ccccc2OC(F)(F)C(F)F)[C@H]2CCO[C@H]21 1074618316 SPTCJMQHKJFVNT-UVLXDEKHSA-N 377.334 2.703 0 50 GFAA COc1ccc(OC)c(CN2CCN([C@@H]3CCc4ccccc4NC3=O)CC2)c1 191916344 NCVZJUOXYPGUSF-OAQYLSRUSA-N 395.503 2.775 0 50 GFAA CCOc1ccccc1C(=O)N1CCN([C@H]2CCc3ccccc3NC2=O)CC1 191948395 QDTBDACLIFNIBZ-FQEVSTJZSA-N 393.487 2.797 0 50 GFAA O=C(NS(=O)(=O)N1CCCC1)c1cc(-c2ccccc2)nc2ccccc12 780324360 NULXXVCJUBODSE-UHFFFAOYSA-N 381.457 2.972 0 50 GFAA COc1cc(C)ccc1CN1CCO[C@H](CO)[C@H]1c1ccc(OC)c(OC)c1 1529173428 VWECXFGHXAOCHN-FGZHOGPDSA-N 387.476 2.955 0 50 GFAA CCOc1ccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)O)NC2=S)cc1 2168006 BBCFTLQEDNEFOD-WJDWOHSUSA-N 398.440 2.811 0 50 GFAA CCc1ccc(OCC(=O)N(Cc2cccs2)[C@H]2CCS(=O)(=O)C2)cc1 5045473 BSGRFYRTEUZPNX-INIZCTEOSA-N 393.530 2.905 0 50 GFAA CC(C)[C@@H]1NC(=O)[C@@H]2C[C@H](NCc3sc4ccccc4c3Cl)CN2C1=O 14539310 ZGTXIKLSKJBLHG-BNLOLNQZSA-N 391.924 2.768 0 50 GFAA COc1ccc(CN2C[C@@H]3C[C@H]2C(=O)N3c2ccc3c(c2)OCO3)c(OC)c1C 14886338 POXVRJOSUWUZAT-IRXDYDNUSA-N 396.443 2.731 0 50 GFAA Cc1c(CC(=O)NCc2ncn[nH]2)c2c(n1CCc1ccccc1)CCCC2=O 15065378 CVPNGWDCTSOMIG-UHFFFAOYSA-N 391.475 2.535 0 50 GFAA O=C([C@H]1CCCCN1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857721538 UQIBLSPZVGXVMQ-GOSISDBHSA-N 392.503 2.798 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4cccc(C(F)(F)F)c4)[C@@H]2CC(=O)N13 1857723054 VHWIUSHNPBLTAG-DAYGRLMNSA-N 382.382 2.903 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)nc1 1857726168 HRRUUUNWGMECLR-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA CCCCN1CCC[C@@]2(CCc3c2nc(C)[nH]c3=NCc2nncn2CCC)C1 1875243044 MZKCXHGXMKFWRT-JOCHJYFZSA-N 397.571 2.900 0 50 GFAA O=C1C[C@H]([C@@H]2CCCCN2C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)CN1 132616658 UVBAAFHZFZTPTH-IRXDYDNUSA-N 380.448 2.745 0 50 GFAA Cc1c(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)nnn1-c1ccccc1Cl 363480159 WXUFDJUOVOYHKM-AWEZNQCLSA-N 386.843 2.857 0 50 GFAA CCC[C@H]1CN(C(=O)Nc2cccnc2N2CCCC2)CCN1CCOC 158756412 ODNRKQRVYMAMSK-KRWDZBQOSA-N 375.517 2.646 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc4nccnc4c3)C1)CC2 1704301069 IPIRZQNZHOPNQO-JOCHJYFZSA-N 388.475 2.606 0 50 GFAA Cc1csc([C@H](C)CNC(=O)C[C@@H]2CN(C(=O)C3CC3)C3(CCC3)CO2)n1 2325785420 XMAFDTWPVOYGNU-CZUORRHYSA-N 391.537 2.621 0 50 GFAA CN(Cc1ccc(CO)cc1)[C@H]1CCCN(C(=O)c2cc3cnccc3[nH]2)C1 2325812089 KIULQLBFRXJODV-IBGZPJMESA-N 378.476 2.792 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2cc(Br)c3c(c2)OCCO3)C1 2325888559 FGDVKFNXXLGDNB-LLVKDONJSA-N 395.253 2.583 0 50 GFAA C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 874889939 QVXBWNBAWXYXHM-LBPRGKRZSA-N 390.436 2.759 0 50 GFAA Cc1ccccc1OCC(=O)NCC(=O)OCc1ccc(Br)cc1 2223488 JLXCMIOWQULPQQ-UHFFFAOYSA-N 392.249 2.996 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(c2noc(-c3ccc(Cl)cc3)c2C(=O)O)C1 2356157069 CYGQEYJZDOXSEL-NSHDSACASA-N 398.868 2.954 0 50 GFAA C[C@@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)Nc1ccccc1 112016532 XTXWYFVUDOEOFU-SJLPKXTDSA-N 379.460 2.682 0 50 GFAA O=c1cc(-c2cccnc2)nc(-c2cccc(CN3CCC(CO)CC3)c2)[nH]1 67713423 GJAWHUFYPUZKSH-UHFFFAOYSA-N 376.460 2.703 0 50 GFAA CN1C(=O)C[C@@H](c2nc(-c3nc[nH]n3)no2)[C@@H]1c1ccc(Cl)c(Cl)c1 350191233 NHKUEHYIOREKBM-PELKAZGASA-N 379.207 2.849 0 50 GFAA NC(=O)[C@@H]1CCN(C(=O)c2cc(N3CCCC3=O)ccc2F)c2ccccc21 119850907 ZHBKDNXYTLNFIU-OAHLLOKOSA-N 381.407 2.572 0 50 GFAA Cc1nc(COc2ccccc2C(=O)NC[C@](C)(CO)Cc2ccccc2)no1 252497944 QRRMISSXXNKPHK-JOCHJYFZSA-N 395.459 2.928 0 50 GFAA CSCCC(=O)N[C@H]1C[C@@H](C(=O)N(C)Cc2cccc3ccccc23)N(C)C1 67740068 LSAVFZGTEFUHGB-ICSRJNTNSA-N 399.560 2.740 0 50 GFAA CC(=O)N[C@@H](CC(=O)NCCCN1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 252528054 DZCRISVAEFNDDJ-KXBFYZLASA-N 395.931 2.524 0 50 GFAA C/C=C(\C)CN1C[C@H](Sc2nc3ccccc3[nH]2)C[C@H]1C(=O)NCCOC 11963116 DKGANCUXDOFWTO-CYJSDHGASA-N 388.537 2.827 0 50 GFAA COc1ccc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCCC3)c2)cc1OC 71681252 RHHURSMUMNOFQX-UHFFFAOYSA-N 391.445 2.854 0 50 GFAA Cn1cc(C(=O)Nc2ccc(-n3ccc(C(N)=O)n3)cc2)c2cc(F)ccc21 435615495 PLNBKROORXZSEQ-UHFFFAOYSA-N 377.379 2.854 0 50 GFAA COc1cccc2ccc(CN3CCCn4nc(CCC(=O)O)cc4C3)nc12 72437948 NLNDYZNUDZGHBR-UHFFFAOYSA-N 380.448 2.863 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3cccc(Oc4nccc(C)n4)c3)CC2)nn1 72441989 RLAWHAIEEJOBIN-UHFFFAOYSA-N 390.447 2.638 0 50 GFAA O=C(c1cc(-c2ccncc2)n[nH]1)N1CCC([C@@H](O)Cc2ccccc2)CC1 77505945 MMKHQEOSENPRDU-NRFANRHFSA-N 376.460 2.928 0 50 GFAA O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)[C@@H]1C[C@H]1C1CCCCC1 159101379 HQRSASTTYSUHMY-JKSUJKDBSA-N 375.450 2.758 0 50 GFAA O=C(c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)N1CCOC2(CCC2)C1 128503683 CPGDFDPKYMPWET-UHFFFAOYSA-N 384.333 2.820 0 50 GFAA O=C1OCCN1c1cccc2c1CCN(C[C@@H](O)COCc1ccccc1)C2 174060888 BPIAGQMFIWHZHO-LJQANCHMSA-N 382.460 2.579 0 50 GFAA O=C(C[C@H]1OCCc2ccccc21)NS(=O)(=O)Cc1c(F)cccc1F 132909707 JWJGBXMXCMULKH-QGZVFWFLSA-N 381.400 2.615 0 50 GFAA CC(C)c1ncc2c(n1)CN(C(=O)Nc1cn(Cc3ccccc3)nn1)CC2 374691042 MHZDUFDPVCXRGZ-UHFFFAOYSA-N 377.452 2.830 0 50 GFAA CSc1cccc(NC(=O)N2CCN(c3cc(N(C)C)nc(C)n3)CC2)c1 33326765 XIGUAFQFWQLORB-UHFFFAOYSA-N 386.525 2.927 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1C[C@@H](c2ccccc2)[C@](F)(CO)C1 452946883 VKBCDWAZHKSCAH-YCRPNKLZSA-N 387.455 2.728 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1cscn1)c1ccc2scnc2c1 219144415 LZSKHNNWBTXUKS-UKRRQHHQSA-N 375.475 2.857 0 50 GFAA O=C(c1ccccc1)[C@@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 82126122 XMORHRCGZCZHHF-GOSISDBHSA-N 382.460 2.847 0 50 GFAA CCS(=O)(=O)c1ccc(-c2ccc(C(=O)N[C@H]3CCN(C)C3)cc2)s1 426431427 VRQRJWVCKWKITK-HNNXBMFYSA-N 378.519 2.643 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1ccc(CO)cc1)c1ccc2ncccc2c1 222427482 SFPFUXLWELESTD-NHCUHLMSSA-N 378.428 2.693 0 50 GFAA COc1ccccc1-n1cc(CNC(=O)N2CCC[C@H]2c2nc(C)no2)cn1 426495884 WQSPXNUQNATVKO-INIZCTEOSA-N 382.424 2.619 0 50 GFAA O=C(COc1ccc(Cl)cc1)N[C@@H]1COCC[C@@H]1OCc1ccccn1 222596980 XGCVKWNQUJWTJK-MSOLQXFVSA-N 376.840 2.604 0 50 GFAA CCCc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2c(C)noc2C)C3)n(C)n1 95378237 SVRHPBVBEKDBPO-FUHWJXTLSA-N 385.512 2.714 0 50 GFAA Cc1ccccc1N1CC[C@@H](CNC(=O)Nc2ccc3c(c2)OCC(=O)N3)C1 97468592 DXWZHXNXBRHNMX-HNNXBMFYSA-N 380.448 2.974 0 50 GFAA Cc1nc(-c2ncc(C(=O)N3CCO[C@@H](c4ccccc4)C3)c(O)n2)cs1 91255364 UMTKMUCXUFLQJW-MRXNPFEDSA-N 382.445 2.828 0 50 GFAA CN1CCC2(CC1)CC(=O)N(CC(=O)N1CCC[C@@H](c3ccccc3)CC1)C2 95518893 XVKTWUUCBUDGIG-HXUWFJFHSA-N 383.536 2.727 0 50 GFAA O=C(c1ccc(CO)cc1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95387759 WWVWMUNILZNNHS-PGRDOPGGSA-N 376.500 2.883 0 50 GFAA C[C@@H]1CCN(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)CC[S@]1=O 297345425 SSOLJNUPEXOXAZ-OKXMYEFYSA-N 383.945 2.861 0 50 GFAA COc1ccc(C(=O)N[C@H]2CC[C@@H](n3cc(C(=O)NCC(C)C)nn3)CC2)cc1 244899829 ZREXDBRXHBMYGZ-CALCHBBNSA-N 399.495 2.586 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1cccc(C(=O)NC)c1 298332287 WWRNHGJGSTVQAD-SFHVURJKSA-N 395.459 2.688 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C(=O)C(C)(C)C)N4N=CC=C[C@H]4[C@@H]3C2=O)c(C)c1 253487327 IPZGPHQTJJWIDX-XSLAGTTESA-N 379.460 2.633 0 50 GFAA CCOC(=O)C1CCN(c2nc3c(C)cccc3cc2CN[C@@H](C)CO)CC1 299760817 KGDFIPXMACRXEZ-INIZCTEOSA-N 385.508 2.793 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3cc(-c4ccc(F)cc4)no3)C2)n[nH]1 584885922 IVVVZCHVXJJXON-AWEZNQCLSA-N 384.415 2.996 0 50 GFAA C[C@@H](CC(=O)NCCc1c[nH]nc1C(F)(F)F)NC(=O)Nc1ccccc1 1875271016 NTYLFYRTHWFZSF-NSHDSACASA-N 383.374 2.688 0 50 GFAA Cc1c(C(=O)N2CCN(C(=O)CC(F)(F)F)CC2)cc(Cl)nc1Cl 1875369210 ALNUBLUKFQMQAO-UHFFFAOYSA-N 384.185 2.934 0 50 GFAA CC1(C)NC(=O)O[C@]12CCN(c1ncc(C(=O)NC3CCCC3)cc1Cl)C2 1875397137 NJODHHUWEZCKRV-IBGZPJMESA-N 392.887 2.875 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)C23CCOC(C)(C2)C3)CC[C@@H]1c1ccc(F)cc1 1875382995 AUBCGCOOYOBNEP-ADCVTAOUSA-N 386.467 2.772 0 50 GFAA Cc1cc(CN2C(=O)CN(CC3(C)CC(F)(F)C3)C2=O)nc(N2CCCC2)n1 1875307666 IVJPWRMJFGGMKJ-UHFFFAOYSA-N 393.438 2.585 0 50 GFAA O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401766 REFLRKYKOFRXCV-FUHWJXTLSA-N 396.495 2.793 0 50 GFAA CN(C)[C@H](C(=O)NC12C[C@@H]3C[C@H](C1)CC(n1cncn1)(C3)C2)c1ccccc1F 952985195 QKHGAFADKIMCJC-VGUSGMIYSA-N 397.498 2.884 0 50 GFAA CCOc1ncccc1C(=O)NCC1CCN(C(=O)c2cc(C)oc2C)CC1 952866980 HUMAVOZCYZNFSC-UHFFFAOYSA-N 385.464 2.972 0 50 GFAA O=C(O)CCC(=O)NCCNC(=O)OCC1c2ccccc2-c2ccccc21 958527872 GBVYMPUSHBCEHZ-UHFFFAOYSA-N 382.416 2.506 0 50 GFAA CCn1cnc2c1CCN(C(=O)CCc1ccccc1OC)C21CCOCC1 1775962836 MNFMYSLWAQZURV-UHFFFAOYSA-N 383.492 2.935 0 50 GFAA COc1cc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)ccc1OCc1ccc(C)cc1 1529120872 QPTGOYKSZLSHBX-RBUKOAKNSA-N 385.460 2.850 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(-c4csc(C)n4)cc3)C(=O)[C@H]2C1 278177774 VEWSIUZLBNCCIN-XJKSGUPXSA-N 385.445 2.839 0 50 GFAA Cc1cc(NC(=O)C(=O)NC2(c3cccc(Br)c3)CCC2)n(C)n1 170633894 UHMINJKFCVGFLK-UHFFFAOYSA-N 391.269 2.625 0 50 GFAA CCN(CC)C(=O)CCCC(=O)NC1CCN(Cc2nc3ccccc3[nH]2)CC1 170636310 OMGBZCAADFKELY-UHFFFAOYSA-N 399.539 2.682 0 50 GFAA COc1ccc(OC)c(CC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)c1 170775373 IFXLGFAFKKJVEB-UHFFFAOYSA-N 396.487 2.976 0 50 GFAA O=C1[C@@H](NC2CCN(Cc3ccccn3)CC2)CCN1Cc1ccc(F)cc1 189047996 HBBRWDKOTDPCRV-NRFANRHFSA-N 382.483 2.576 0 50 GFAA O=C1Nc2ccccc2CC[C@@H]1N1CCCN(C(=O)c2ccc(F)cc2)CC1 191917705 MWCFNFHSUOOGQK-FQEVSTJZSA-N 381.451 2.927 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)C1 779845768 JIRFKRMSRKXJSM-MGPQQGTHSA-N 386.235 2.707 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCC([C@@H](O)c2cccs2)CC1 1506403379 YCIJPPRCUFOFLO-LJQANCHMSA-N 399.520 2.707 0 50 GFAA O=C(c1cccnc1SCCc1ccccc1)N(CCO)Cc1ncc[nH]1 1704306460 NJHDLNZHCJGBLT-UHFFFAOYSA-N 382.489 2.774 0 50 GFAA CN1CCN(CC2CCN(c3noc(-c4ccccc4)c3C(=O)O)CC2)CC1 1772700506 FWSAIMUSBXNZRS-UHFFFAOYSA-N 384.480 2.504 0 50 GFAA O=C(Cc1ccc(F)c(F)c1F)N1CCC(=O)N(Cc2ccccc2)CC1 11783462 ZDRUHJLZFRCNMN-UHFFFAOYSA-N 376.378 2.908 0 50 GFAA COCCN1CCC(CN(Cc2ccc(OC)c(O)c2)C[C@@H]2CCCO2)CC1 11841530 QFAUYFQBKCBYPX-FQEVSTJZSA-N 392.540 2.740 0 50 GFAA COc1cccc(OCc2cc(C(=O)N[C@@H](C)c3c(C)nn(C)c3C)n[nH]2)c1 11935060 CTYBYBPVXBIZDJ-LBPRGKRZSA-N 383.452 2.839 0 50 GFAA Cc1ccccc1CNC(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12443288 ICHYAHSNUUANJW-HXUWFJFHSA-N 383.536 2.724 0 50 GFAA COc1cccc(-c2cc(CC3(O)CCN(Cc4cnn(C)c4)CC3)on2)c1 12579424 XDGFLKQNWFAXKV-UHFFFAOYSA-N 382.464 2.653 0 50 GFAA O=C(Cn1cncn1)N1CCO[C@H](CC(c2ccccc2)c2ccccc2)C1 12593462 JGKDALVQIUEULH-HXUWFJFHSA-N 376.460 2.728 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 12717163 MEJBAYUXHPMTHD-QGZVFWFLSA-N 398.434 2.652 0 50 GFAA CCn1nc(C)c(-c2cc(C(=O)NC[C@@H]3CCCN4CCCC[C@@H]34)n[nH]2)c1C 169680676 OMWBHPIRMTYQED-LPHOPBHVSA-N 384.528 2.904 0 50 GFAA CN1C(=O)C(=Cc2ccc(OCC(=O)O)cc2)c2cc(Br)cnc21 1857529893 CHLDMOIZKLMPIT-UHFFFAOYSA-N 389.205 2.825 0 50 GFAA CCN1CCN(CCOc2ccc(-c3nccn3C3CCOCC3)cc2)CC1 1857696665 KQGBZQJAKWGQKX-UHFFFAOYSA-N 384.524 2.918 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCc3n[nH]c4c3CCCC4)C1)CC2 1857701012 KLJILBTYMIMXFI-JOCHJYFZSA-N 395.507 2.532 0 50 GFAA O=C(c1ccc2scnc2c1)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857715067 ZPXTYBUFEGYMPB-MYKSZAICSA-N 380.469 2.505 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H]1C[C@H]2CO[C@@H](C(C)C)CN2C1 1857715691 CXCJOBTWWNAFMM-CMKODMSKSA-N 383.492 2.806 0 50 GFAA CCn1ncc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c1C 1857716067 VEKMGFBAAYPIHA-ZIFCJYIRSA-N 388.899 2.809 0 50 GFAA Cc1cc(C(=O)NC[C@H](NC(=O)c2cc(C)no2)c2ccc(Cl)cc2)on1 225670044 HPZJEFXXDSGYEM-AWEZNQCLSA-N 388.811 2.834 0 50 GFAA O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N1CC[C@]2(CCOC2)C1 120769693 OWOIUPYDNWBWAK-SFHVURJKSA-N 376.844 2.755 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN1CC[C@@H](CNc2ccccn2)C1 128263458 VFWIGHSKUJWUDR-AWEZNQCLSA-N 383.418 2.999 0 50 GFAA CC(C)(C)c1csc(CCNS(=O)(=O)c2cnn(C3CCOCC3)c2)n1 133047278 NNEPLGMCALQQDR-UHFFFAOYSA-N 398.554 2.510 0 50 GFAA CC(=O)CC(=O)OCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 36399879 YAQPWDDYTVXUQV-UHFFFAOYSA-N 380.488 2.916 0 50 GFAA in-vitro Cc1c(C(=O)NCC2(O)CN(C(=O)OC(C)(C)C)C2)sc2ccccc12 253417602 BECNXJGMNMXXMC-UHFFFAOYSA-N 376.478 2.921 0 50 GFAA CC(C)(C)c1ccc(C(=O)N[C@]2(C(F)(F)F)N=C3SCCN3C2=O)cc1 2504105 KZKDHXYXZCAQBI-INIZCTEOSA-N 385.411 2.918 0 50 GFAA O=S(=O)(Cc1ccccc1Cl)N1CCO[C@@H](COc2ccccc2)C1 4727774 UBMLZHSCPHUAGR-QGZVFWFLSA-N 381.881 2.950 0 50 GFAA COC(=O)[C@@H]1Cc2c([nH]c3ccccc23)CN1C(=O)c1cccc2c1COC2 2100540745 OLKBJWUJTDYSLI-FQEVSTJZSA-N 376.412 2.938 0 50 GFAA Cc1nsc(NC(=O)N[C@@H](C(N)=O)[C@@H](C)c2ccccc2)c1Br 2325804041 RBSHCVPXFCXGTD-QPUJVOFHSA-N 397.298 2.993 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccc(OC(F)F)c3ncccc23)C[C@H]1C 241897167 TWFYDXYNIKKSTJ-OLZOCXBDSA-N 394.422 2.755 0 50 GFAA O=C(NC(=S)Nc1ccccn1)c1ccccc1I 1418811 AHUHOXMYQNSQNF-UHFFFAOYSA-N 383.214 2.813 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC(=O)NC(C)C)c2ccccc2)cc1 2938911 OXLDCQTZFLKAEO-UHFFFAOYSA-N 376.478 2.805 0 50 GFAA COC(=O)Cc1ccc2c(c1)NC(=O)[C@H](CCOC(=O)C1CCCCC1)O2 4038068 SEHXRONZAXHLRD-KRWDZBQOSA-N 375.421 2.615 0 50 GFAA O=C1CC[C@H](C(=O)NC[C@H]2Cc3cc(-c4ccsc4)cc(Cl)c3O2)N1 12048051 ZKXQZZIMUOQUDJ-UKRRQHHQSA-N 376.865 2.767 0 50 GFAA CC(=O)O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@H]21 12379852 BNYMWYFDNNGEAG-JCECYMMASA-N 382.453 2.795 0 50 GFAA biogenic O=C(CCC1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1)N1CCOCC1 20537175 BFXWWODXFVJXJG-QFIPXVFZSA-N 385.552 2.612 0 50 GFAA COc1ccc(Cc2nnc(NC(=O)NCc3ccccn3)s2)cc1OC 23505056 OKLKYGJTUSUCHV-UHFFFAOYSA-N 385.449 2.863 0 50 GFAA CC(C)C[C@H]1CCN(Cc2cn(C3CCN(C4CCOCC4)CC3)nn2)C1 63848262 TUJPELBHGJHRAA-GOSISDBHSA-N 375.561 2.962 0 50 GFAA Cc1nc(N2CCC(Nc3ccccn3)CC2)nc2cc(S(C)(=O)=O)ccc12 67725678 ZMJYQYJOSKKEDT-UHFFFAOYSA-N 397.504 2.818 0 50 GFAA O=C(c1cn(C[C@@H]2CCCNC2)nn1)N(Cc1ccccn1)C1CCCCC1 67790233 DUMMMVANNMEVLA-QGZVFWFLSA-N 382.512 2.648 0 50 GFAA OCCOCCN1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67820685 CKCKZCNQCKAQOH-UHFFFAOYSA-N 386.473 2.872 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(c3ncnc4sccc34)CC2)C1 71721379 JWYAYLKUERHQLW-CQSZACIVSA-N 385.537 2.651 0 50 GFAA COCc1nc(N2CCc3cc(OC)c(OC)cc3[C@@H]2C)c2cnn(C)c2n1 72167412 LMXSCRJPGYQJMA-LBPRGKRZSA-N 383.452 2.651 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)c2c[nH]nc2-c2cccc(F)c2)N1 91350927 YTDIWRQFOZIDKN-KRWDZBQOSA-N 393.422 2.532 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CC[C@@](O)(c3ccccc3C)C2)cn1 91365180 PQYNDDGCLJKWFP-QFIPXVFZSA-N 377.444 2.923 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(C(=O)c2c[nH]c3ccc(OC)cc3c2=O)C1 91943574 ZBOWAFXFAYJKED-CQSZACIVSA-N 380.448 2.773 0 50 GFAA CCN1CCN(C[C@@H]2CN(c3ccnc4cc(Cl)ccc34)C[C@@H]2CO)CC1 95384060 FUTMPEFSIHABQW-IAGOWNOFSA-N 388.943 2.570 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCN(Cc2cccnc2)CC1 95387407 MINHAVXZFDAGOP-SFHVURJKSA-N 375.856 2.687 0 50 GFAA Cc1n[nH]c(SCC(=O)N2CCC[C@@](C)(Cc3ccc4c(c3)OCO4)C2)n1 95496877 AJJMJDFUJYZKBI-IBGZPJMESA-N 388.493 2.805 0 50 GFAA Cc1nnc(SCCCNC(=O)Nc2ccc3oc(=O)n(C)c3c2)s1 96132831 PZBMNSPKNOPOSM-UHFFFAOYSA-N 379.467 2.595 0 50 GFAA Cc1nc(CN2CCC(c3nnc(Cn4ccnc4)n3C3CC3)CC2)n(C)c1C 96153390 BLYAIAMMWBAESN-UHFFFAOYSA-N 394.527 2.588 0 50 GFAA Cc1ccccc1CN1CCN(Cc2ccc3c(c2)OCCO3)C[C@H]1CCO 104405319 AAWCAHDAUPAGLA-OAQYLSRUSA-N 382.504 2.835 0 50 GFAA O=C(Nc1ccn(-c2ncccc2C(F)(F)F)n1)N[C@H]1CCc2[nH]ncc2C1 164441310 AETKGYRBILSFBW-NSHDSACASA-N 391.357 2.688 0 50 GFAA CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NCCCc1cc[nH]n1 170606086 SORQOYJWBJEDQT-QPRVAFDKSA-N 386.540 2.816 0 50 GFAA COc1ccc(S(=O)(=O)NC2(c3noc(C4CC4)n3)CCCC2)cc1F 177583460 IAKWLAAUEROZAT-UHFFFAOYSA-N 381.429 2.843 0 50 GFAA COCCC1(CNC(=O)N2CCN([C@@H](C)c3nc(C)no3)CC2)CCCCC1 186283671 WICJLYACIMQDOQ-INIZCTEOSA-N 393.532 2.753 0 50 GFAA CC(C)COc1ccc(CC(=O)N2CCC[C@H](N(C)CC(=O)O)CC2)cc1 186647453 ZQTWKKRXRGNPQT-SFHVURJKSA-N 376.497 2.661 0 50 GFAA CS(=O)(=O)N1C[C@H]2CC[C@@H](C1)N(C(=O)c1cccc(-c3ccccc3)c1)C2 247510259 IDTGODFGPZOJFU-UZLBHIALSA-N 384.501 2.850 0 50 GFAA COCCn1ccc2c(OCC(=O)NCc3nc4ccccc4[nH]3)cccc21 263588149 PSMAEGYTBBMSHG-UHFFFAOYSA-N 378.432 2.859 0 50 GFAA COC(=O)c1cn([C@H](c2ccc(OC)c(OC)c2)C(C)C)cc2c(=O)[nH]nc1-2 263588618 WGQLJFAEIKDHKK-SFHVURJKSA-N 385.420 2.725 0 50 GFAA C[C@H]1c2cccn2CCN1C(=O)/C=C/C=C/C(=O)N1CCn2cccc2[C@@H]1C 281176757 NLDLPYVWGSRQKZ-MJINZYEWSA-N 378.476 2.909 0 50 GFAA CCc1n[nH]c(=O)c(CNC(=O)c2cc3c(C(F)F)nn(C)c3s2)c1CC 281662714 SNNSETUTUKWPKW-UHFFFAOYSA-N 395.435 2.711 0 50 GFAA CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C(=O)c2ccc(-c3ccccc3F)o2)C1 284620600 PBZSKOXGQJYWMH-YOEHRIQHSA-N 386.423 2.938 0 50 GFAA Cc1noc([C@@H]2CN(C(=O)Nc3cccnc3-c3ccccc3)CCN2C)n1 286128771 WZHPMKTUELVCTE-KRWDZBQOSA-N 378.436 2.961 0 50 GFAA CS(=O)(=O)C[C@H]1CCCN(CC(=O)N(Cc2ccco2)c2ccccc2)C1 298592705 ZOCADMKTJMCDJQ-KRWDZBQOSA-N 390.505 2.569 0 50 GFAA COc1ccc(CCNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cc1OC 298974531 OSOMJNXKDXYMFG-MRXNPFEDSA-N 386.448 2.650 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)c1 299338352 FTDAEVZVCXJBFP-LKTVYLICSA-N 385.869 2.601 0 50 GFAA C[C@H]1CCC(=O)N1c1cccc(NC(=O)N2CCN(c3ccccn3)CC2)c1 299762629 VNBNRGFSPUSGQB-INIZCTEOSA-N 379.464 2.951 0 50 GFAA Cc1cnc2c(C(=O)NC[C@H](C)Cn3nc(C)cc3C(F)(F)F)cnn2c1 299782824 MWGYXEAXWBBJBR-NSHDSACASA-N 380.374 2.628 0 50 GFAA CC(C)c1nnc([C@@H]2CN(S(=O)(=O)C3=Cc4ccccc4CC3)CCO2)o1 328625919 LDGKLXNYEQGLTH-KRWDZBQOSA-N 389.477 2.883 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@@H](O)COCc2cccs2)n1C 328629621 IKPWLQGGXKCJTO-CRAIPNDOSA-N 391.537 2.551 0 50 GFAA CN(C[C@H](O)COc1ccccc1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1 328634358 MQYOQIMFXCIGFB-GJZGRUSLSA-N 383.414 2.836 0 50 GFAA NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@]3(CCCCc4ccccc43)C2)o1 363967295 MXTINCISFROQFR-FQEVSTJZSA-N 388.489 2.827 0 50 GFAA Cc1cc(Cl)ccc1OCCN1CCN(C(=O)NC[C@@H]2CCCO2)CC1 426545124 QGQYSOISCGCKFS-KRWDZBQOSA-N 381.904 2.533 0 50 GFAA C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2ncnc3[nH]ccc23)CC1 450787907 IHSBTIJSOCECQZ-CQSZACIVSA-N 399.520 2.999 0 50 GFAA Cc1ccc(NC(=O)c2cc(-c3ccccn3)no2)cc1C(=O)N1CCOCC1 488185916 RIJXVFQBIWUIRN-UHFFFAOYSA-N 392.415 2.770 0 50 GFAA O=C(NCCc1csc(N2CCCC2)n1)N1CCOc2cc(O)ccc2C1 498163052 OVQPWQCIBLPGDB-UHFFFAOYSA-N 388.493 2.596 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3cccc(O)c3)CC2)cc1Cl 542748679 ORISJLUGEMQLDZ-UHFFFAOYSA-N 382.869 2.565 0 50 GFAA CCN(C(=O)c1cccc(-c2nc(C)nc3ccccc23)c1)[C@H]1COC[C@@H]1O 584901667 ASOGUPGZFOATGU-PMACEKPBSA-N 377.444 2.827 0 50 GFAA CN(C)c1ncc(/C=C/C(=O)NC[C@H](c2ccccc2)N2CCCCC2)cn1 823741950 DYRPSUULOUWTFV-YVNCXZRQSA-N 379.508 2.899 0 50 GFAA Cc1cc(C)cc(CC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)c1 827848275 BTFOPQPPTLDJKD-UHFFFAOYSA-N 382.460 2.722 0 50 GFAA COc1cc(OC)c2c(c1)C(=O)N(Cc1ccccc1OC1CC1)S2(=O)=O 863330804 BIIRFTNGCMMGAR-UHFFFAOYSA-N 389.429 2.590 0 50 GFAA FC(F)(F)[C@]1(c2nc(-c3ccncc3)no2)CCN(Cc2cnns2)C1 952891508 FHPKUVJQMNAHDL-CQSZACIVSA-N 382.371 2.689 0 50 GFAA C[C@@H](O)c1cnc(CN2CCC(c3nccc(-c4cnn(C)c4)n3)CC2)s1 952891874 JSFXOIYETKUEBZ-CYBMUJFWSA-N 384.509 2.767 0 50 GFAA CN(C[C@H]1CCN(c2ccccc2)C1)C(=O)CCn1cnc2ccccc2c1=O 952962348 ASDXLIOVTGBSQD-GOSISDBHSA-N 390.487 2.772 0 50 GFAA Cc1cc(N2CCN(C(=O)c3cncs3)CC2)nc(-c2ccccc2O)n1 952975525 WHLINYVZRDWNON-UHFFFAOYSA-N 381.461 2.577 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)c(N2CCCC2)nn1C 1506400323 CQMCKNUDFKJQPB-DLBZAZTESA-N 387.528 2.696 0 50 GFAA O=C(C1CCC1)N1CCCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1 1506405379 BFTOVWUHMJGMHD-QFIPXVFZSA-N 385.552 2.612 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3c(C)n(C)c4ccc(OC)cc34)CCN12 1529139345 PZEYFJCIKJJVHC-DLBZAZTESA-N 385.508 2.821 0 50 GFAA O=c1c2c(-c3ccccc3Cl)csc2ncn1C[C@H]1CCNC[C@@H]1O 1565515084 OBITUDUIPZZQJQ-ABAIWWIYSA-N 375.881 2.749 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@@H]3CCC[C@H](N)C3)CC1)OCC2 1704300680 YGHFLEWBPXYWQH-SJORKVTESA-N 388.508 2.612 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)Cc3ccc(F)cc3F)C1)CC2 1704303450 ZFQFNTCEXVKMIX-NRFANRHFSA-N 386.446 2.870 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(c2nnnn2-c2ccccc2)CC1 1704339032 BAIAMYDEZCSFOS-UHFFFAOYSA-N 377.448 2.739 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2CCC3(CC2)C[C@@](C)(O)CCO3)n[nH]1 1704344937 QSJSIEKWDPJXBA-FQEVSTJZSA-N 385.464 2.622 0 50 GFAA CCc1ccc(CN2CCC3(CC2)CN(C(=O)C2CCCC2)C[C@@H]3C(=O)O)nc1 1857690355 IDERNURPRUEPBO-HXUWFJFHSA-N 399.535 2.959 0 50 GFAA O=C(c1cccc2c1NCCC2)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857715559 XRNNVRLYFBTYSV-REWPJTCUSA-N 398.478 2.612 0 50 GFAA Cc1cc2c(cc1CN1CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]14)OCO2 1857724749 BCDNWRSMLDMGRN-XJUOHMSHSA-N 392.455 2.998 0 50 GFAA Nc1ncccc1CNC(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857726165 HOIQHQBMWHPTAR-CYBMUJFWSA-N 385.855 2.991 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)NCc1coc(-c2ccccc2)n1 1875241422 WMBYEAJRHGPIPF-UHFFFAOYSA-N 384.461 2.873 0 50 GFAA CC[C@H]1CC[C@@](O)(C(=O)N2CCC(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1875271775 SYTDCQSAEPOXSH-JXFKEZNVSA-N 379.522 2.701 0 50 GFAA CCCOc1ccc2[nH]cc(CC(=O)NC[C@H](CO)Cc3ccncc3)c2c1 1875274301 GRMKBFXKQVMLJO-QGZVFWFLSA-N 381.476 2.862 0 50 GFAA Cc1cc(C(=O)NCC2(n3ccnn3)CC2)c2cc(Br)ccc2n1 1875302141 BGCGDGZJJGLMAU-UHFFFAOYSA-N 386.253 2.816 0 50 GFAA COc1ccc([C@@H]2NC(=O)[C@H](C3CC4(CCC4)C3)NC2=O)cc1Br 2325776905 MWYNDMUWVDPDEN-GJZGRUSLSA-N 393.281 2.694 0 50 GFAA Cc1ccc([C@]23C[C@H]2CN(C(=O)/C=C/c2ccc(OCC(N)=O)cc2)C3)cc1 2325783122 ZIUZLTGWHZBUQB-SWMHYREXSA-N 376.456 2.672 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2ccc3nc(C)sc3c2)C1=O 2356142499 VBWYGCVIMDIHOH-HXUWFJFHSA-N 387.505 2.848 0 50 GFAA O=C1N(C2CC2)CCC[C@]12CCCN2S(=O)(=O)c1ccc(F)cc1Cl 2356169737 XSJMKGMRXXYQMT-KRWDZBQOSA-N 386.876 2.787 0 50 GFAA NC(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CCC3 1162439 OOHFKHIRMMDRAJ-UHFFFAOYSA-N 385.514 2.767 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1CCC[C@@]2(CCc3c[nH]c(=N)nc32)C1 2356146664 PJYSLOUZNCGKLR-JOCHJYFZSA-N 375.476 2.728 0 50 GFAA COc1ccc(-c2onc(N3CCC[C@H](C(=O)N4CCCC4)C3)c2C(=O)O)cc1 2356159696 NDVCENSIIHAWJD-HNNXBMFYSA-N 399.447 2.887 0 50 GFAA COc1ccccc1NC(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 2850969 QFYLEJBCVDKQQY-UHFFFAOYSA-N 376.478 2.953 0 50 GFAA CN1C[C@H]2C[C@@H](N(C)C(=O)c3cnc(Nc4ccccc4)nc3)C[C@H]2CC1=O 2356164679 CFGHPNXCBPBNJN-DAYGRLMNSA-N 379.464 2.549 0 50 GFAA C[C@@H](Sc1nnc(-c2ccncc2)n1C)C(=O)Nc1ccc2c(c1)OCO2 4736162 NWHBXPRKURQKEI-LLVKDONJSA-N 383.433 2.725 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1ccccn1)c1cccc(Cl)c1 4973533 VSGBWGVOZBMFDS-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@H]23)o1 248179761 XURXPNLCGDDBRJ-CAEXGNQWSA-N 380.510 2.911 0 50 GFAA O=c1cc(CCn2cccn2)nc(-c2ccc(CN3C[C@H]4CC[C@H]3C4)cc2)[nH]1 102599113 MCWLVJIOIMPJFG-PXNSSMCTSA-N 375.476 2.860 0 50 GFAA COc1ccccc1N1CC[C@H](Nc2ncnc3ccc(S(C)(=O)=O)cc23)C1 252497952 QRWHWPRBOHXNSF-AWEZNQCLSA-N 398.488 2.733 0 50 GFAA CCn1c(C)ccc(C(=O)NCc2cccnc2Oc2ccc(C)nc2)c1=O 67895652 SQZSWAINFGAWFR-UHFFFAOYSA-N 378.432 2.997 0 50 GFAA Cc1cccnc1CNC(=O)[C@H]1C[C@@H](C(=O)O)N(C)[C@H]1c1cccc(Cl)c1 67818390 GIEZSVGAEUZQDQ-SZMVWBNQSA-N 387.867 2.806 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)Nc2cc(C)ccc2NC(C)=O)CC1=O 68026788 ILWKBNJPQFTMIA-HNNXBMFYSA-N 381.432 2.954 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2C(=O)Cc2ccc(C(F)(F)F)cc2)O1 252535695 GPFKJJXEHUOTTM-SRMUXQRQSA-N 385.382 2.958 0 50 GFAA CCn1cc(NC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)O)c(C(=O)NCC(C)C)n1 4465828 AYLKFRZVXMXFIJ-LSDHHAIUSA-N 390.484 2.675 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 126405093 APGBLPZJCNTXFY-KFWWJZLASA-N 392.912 2.961 0 50 GFAA Cc1nc(CNC(=O)c2cnc3c(c2)nc(-c2ccccc2Cl)n3C)n[nH]1 77407450 WPFXAKLIZJDMTP-UHFFFAOYSA-N 381.827 2.645 0 50 GFAA CCCc1cc(C(=O)N2CCC3(CC2)CN([C@@H](C)CCC)C(=O)O3)n(C)n1 77538603 CCYISDWATRYBGC-HNNXBMFYSA-N 376.501 2.988 0 50 GFAA Cc1ccc2nc(N3CCC[C@H](O)C3)c(CN(C)Cc3nnc(C)o3)cc2c1 72418113 MTFQBXGZVRYOHG-SFHVURJKSA-N 381.480 2.828 0 50 GFAA Cc1ccc(N2CCC(C(=O)N3CCOC[C@H]3c3nnc(C(C)C)o3)CC2)nc1 370439952 VUQOZNKRRIKZGM-KRWDZBQOSA-N 399.495 2.713 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)N1CCC(c2cccc(F)c2F)CC1 372222435 NSFJIFAYVWPXPT-UHFFFAOYSA-N 383.402 2.889 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCC(C)(C)CO)Cc2ccccc2C1 72144123 LRUVSAUJTQKYQX-UHFFFAOYSA-N 380.532 2.833 0 50 GFAA COCc1cc(CN2CCN(Cc3cccs3)[C@H](CCO)C2)ccc1OC 39447103 JMMIHDPZNUFRIU-LJQANCHMSA-N 390.549 2.972 0 50 GFAA O=C(O)c1cccc(CNC(=O)[C@H]2CCCN2c2ncnc3ccccc23)c1 378453030 MEDDLQFSTGHAEY-GOSISDBHSA-N 376.416 2.613 0 50 GFAA C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCCc1cn2ccccc2n1 287129545 ONSXHMHPXTYJDS-HNNXBMFYSA-N 393.495 2.912 0 50 GFAA CN(C)C(=O)NCc1cc2n(n1)CCCN(Cc1cccc(Cl)c1F)C2 82160699 JUUGVMAYEXWEPE-UHFFFAOYSA-N 379.867 2.853 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)NCC1(N2CCOCC2)CCCCCC1 82157071 AHKQTTKGIXLSIG-UHFFFAOYSA-N 376.545 2.511 0 50 GFAA CS(=O)(=O)N1CCC(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 178266752 VGEAGWMBCLNMEU-MRXNPFEDSA-N 392.443 2.834 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCC(Cc3nccn3C)CC2)[C@H]1c1ccccc1 178621457 ZQPYSVKSYUJQOO-SIKLNZKXSA-N 394.519 2.811 0 50 GFAA CC(=O)O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@@H]2OC3(CCCCC3)O[C@H]21 229997847 BNYMWYFDNNGEAG-IECFSIQFSA-N 382.453 2.795 0 50 GFAA biogenic CNC(=O)CCc1ccccc1NC(=O)N1CCC(Oc2cccnc2)CC1 97696374 QHIKSDAYNKQUMN-UHFFFAOYSA-N 382.464 2.836 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCc1nc(-c3ccccc3)no1)C2 91860595 GTAMCWNREFCXSB-INIZCTEOSA-N 379.416 2.655 0 50 GFAA NCc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)cc1 91724897 CXVLAHXQEWDDPI-UHFFFAOYSA-N 392.503 2.585 0 50 GFAA COc1ccc(CNC(=O)Nc2cc3c(cc2C)n(C)c(=O)n3C)cc1OC 96139628 HTVHPUZWZHQGKR-UHFFFAOYSA-N 384.436 2.524 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 95502067 QPQIPLJSKRULNW-CQSZACIVSA-N 380.539 2.793 0 50 GFAA CCn1ccnc1C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 91737159 IHJFDNJBJCOPCF-UHFFFAOYSA-N 391.493 2.633 0 50 GFAA Nc1ccc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)cn1 95354822 YKBSNPWVORNHRT-CWFSZBLJSA-N 384.430 2.644 0 50 GFAA CCc1ocnc1C(=O)N1CCC[C@H]1C(=O)Nc1ccc(-n2ccnc2C)cc1 95517795 BTAKKKNYMNRUHC-KRWDZBQOSA-N 393.447 2.974 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(S(=O)(=O)c2ccc3c(c2)OCO3)CC1 242956500 HIARGHIKWOWTEI-UHFFFAOYSA-N 394.880 2.888 0 50 GFAA Cn1cc(-c2cc(CNc3ccccc3CN3CCC(CO)CC3)on2)cn1 184002457 XBPUHSPSDBRKJR-UHFFFAOYSA-N 381.480 2.892 0 50 GFAA CNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1c(C)noc1-c1ccccc1)CC2 184816035 GWIBFPFFDQQCEC-UHFFFAOYSA-N 397.456 2.761 0 50 GFAA Cc1c(CNC(=O)c2cccc(-c3nccnc3N3CCCC3)c2)cnn1C 299794578 JZIQPKLUGYFMJL-UHFFFAOYSA-N 376.464 2.716 0 50 GFAA Cc1cccnc1C[C@@H](C)NC(=O)c1cccc(-c2nc(N(C)C)n(C)n2)c1 299776806 LZPJDKNEENKMFB-OAHLLOKOSA-N 378.480 2.613 0 50 GFAA CC(C)Cn1cncc1CNC(=O)c1cccc(OCC(=O)N2CCCCC2)c1 821502265 ZQHYWHFMEJNKFF-UHFFFAOYSA-N 398.507 2.860 0 50 GFAA Nc1ncccc1-c1ccc(C(=O)N2CCCN(C(=O)C3CCC3)CC2)cc1 584894629 PRKFOFHUUQUPDL-UHFFFAOYSA-N 378.476 2.805 0 50 GFAA C[C@@H](C1CC1)N(C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)C1CC1 185633414 CQGHPWLVDPDFBC-AWEZNQCLSA-N 377.510 2.699 0 50 GFAA CCc1cccc(N2C[C@H](C(=O)N(C)[C@H](CO)c3cccc(F)c3)CC2=O)c1 1875257338 FRDCMNBXZQKMTA-YLJYHZDGSA-N 384.451 2.933 0 50 GFAA O=C(N=[S@]1(=O)CCC[C@@]2(CCCN2)C1)c1cccc(Oc2cnccn2)c1 1875392983 CDSHFDCRTBOKIJ-PPHZAIPVSA-N 386.477 2.793 0 50 GFAA CCc1nc(C)cc(N2CC[C@H]([C@H](C)NC(=O)c3cccc4[nH]ncc34)C2)n1 1875358288 QGJFZSVOIJSPNZ-GJZGRUSLSA-N 378.480 2.869 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)Nc2ccc(C)c(-n3nnnc3C)c2)cc1 1875373642 JBIJFBSMRKSXLW-UHFFFAOYSA-N 376.420 2.680 0 50 GFAA CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1CC(n2cccn2)C1 1875320425 CNLIVAODCARDFL-LBXVMSDZSA-N 393.491 2.568 0 50 GFAA O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401768 REFLRKYKOFRXCV-WMZOPIPTSA-N 396.495 2.793 0 50 GFAA COc1cc(OC)c2[nH]c(C(=O)Nc3ccccc3OCCC(N)=O)cc2c1 1875254613 PLNIFYZIKPHGQH-UHFFFAOYSA-N 383.404 2.692 0 50 GFAA Cc1cc(C)n2ncc(CN3CCC(C(=O)NCCc4ccccc4)CC3)c2n1 952984209 OYZFFVLPERULIW-UHFFFAOYSA-N 391.519 2.917 0 50 GFAA CCN1C[C@H](CN(C)S(=O)(=O)c2ccc(-c3csc(C)n3)s2)CC1=O 952967903 FFFYHQHTWWKDDK-LBPRGKRZSA-N 399.563 2.669 0 50 GFAA COc1ccccc1C1(CNC(=O)N2CCCN(C(=O)C3CC3)CC2)CCC1 186654475 GXOILNXGFVPNFI-UHFFFAOYSA-N 385.508 2.771 0 50 GFAA CC[C@H]1CN(CC(C)(C)O)[C@H](CC)CN1C(=O)c1cc(NC(C)=O)ccc1F 170606124 RIBVUFGMGYEQJI-SJORKVTESA-N 393.503 2.870 0 50 GFAA COc1ccc(CCC(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)c(OC)c1OC 221905031 GPWLENJHLDOFTK-PMPSAXMXSA-N 391.464 2.889 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN1C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 194537377 KNJRJMAJHRNGLQ-OAHLLOKOSA-N 381.354 2.950 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cccc(OC)c2F)cc1OC 1529172212 ABZISRPQHRAMGU-TZIWHRDSSA-N 391.439 2.786 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2ccc(F)c(C)c2)cc1OC 1529186621 IUMROSIRFCVMBP-WOJBJXKFSA-N 389.423 2.726 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CC[C@H](CN(C)C)C2)ccc1F 1704330230 GOIXNMPMMWVAHJ-CYBMUJFWSA-N 390.459 2.579 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3cc(C)on3)C2)o1 11771367 FBXYJCLEMIGSMQ-ZDUSSCGKSA-N 377.466 2.721 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(N3CCCCCC3)nc2)CC1 14974013 JVVRSAGFIGFJQP-UHFFFAOYSA-N 384.524 2.937 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1ccccc1Cl 15062493 YVSCCTYDXPVNFG-GOSISDBHSA-N 382.855 2.919 0 50 GFAA CC(C)N1CC[C@@H](CN(C)C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)C1 15074192 QJSXWBPMMXCASH-INIZCTEOSA-N 380.496 2.610 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)N1CCC(c2cccnc2)CC1 1857528785 VQQVUINOFSRCOP-QTGUNEKASA-N 394.519 2.998 0 50 GFAA CCc1nc([C@H]2CN(C(=O)CCCc3ccc(OC)cc3)Cc3c[nH]nc32)n[nH]1 1857528808 ZSPQKNVDXQIHTA-KRWDZBQOSA-N 394.479 2.596 0 50 GFAA COc1ccc(-c2nccn2C[C@@H]2CC(=O)N(C3CC3)C2)cc1Cn1cccn1 1857678035 AEMCTPYWCHLMJZ-INIZCTEOSA-N 391.475 2.814 0 50 GFAA Cc1cccc(CN2CCOC3(CCN(Cc4cnsc4)CC3)CC2=O)n1 1857684002 VDHHFJZKQVSWDA-UHFFFAOYSA-N 386.521 2.630 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)CCc3nc4ccccc4[nH]3)C1)CC2 1857727958 GYMQQYIEXHDIOI-QFIPXVFZSA-N 391.475 2.806 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)NCC3(c4ccccc4)CCCC3)CC2=O)s1 1857733696 VAKPRPSQEJWADF-OAHLLOKOSA-N 384.505 2.828 0 50 GFAA O=C(c1c[nH]nc1[C@H]1CCOC1)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 330320490 FDYKBWCSLQTNNI-CVEARBPZSA-N 392.463 2.719 0 50 GFAA Cc1ccc(C)c(-n2ncc(C(=O)N3CCC[C@H]3CN3CCOCC3)c2C)c1 124949749 MVBGWMTZSFPZTB-IBGZPJMESA-N 382.508 2.734 0 50 GFAA Cc1c(NC(=O)c2cc3c(s2)CCOC3)cccc1C(=O)N1CCOCC1 264030436 UUKJKMOFZKHKGB-UHFFFAOYSA-N 386.473 2.854 0 50 GFAA O=C(NC1CC(CO)(CO)C1)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1 913315738 IUUMIHLTUUYGRZ-UHFFFAOYSA-N 385.851 2.542 0 50 GFAA COc1ccc(C(=O)C[C@]2(O)C(=O)N(C)c3ccc(Br)cc32)cc1 1023597 XQZPZQVYZYAMID-GOSISDBHSA-N 390.233 2.895 0 50 GFAA Cc1cn2nc(C(=O)N3CCC(Oc4ccc(Cl)cc4)CC3)cc2c(=O)[nH]1 2325782193 CDSMLQUBFBCQLM-UHFFFAOYSA-N 386.839 2.668 0 50 GFAA Cc1ccc([C@]23C[C@@H]2CN(C[C@@H](O)Cn2cc(Br)cn2)C3)cc1 2325800463 JGVVDTUPXPSQGU-KBAYOESNSA-N 376.298 2.588 0 50 GFAA Cn1nc(C(=O)N2C[C@H](c3cc(F)cc(F)c3)[C@@H](C(=O)O)C2)c2ccccc21 2325808177 BJXYYHIPKMOYCV-CVEARBPZSA-N 385.370 2.792 0 50 GFAA O=C(NC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc2nc(O)nc(O)c2c1 2325850811 IKKDDGTZSOWROA-AWEZNQCLSA-N 393.321 2.523 0 50 GFAA C[C@@H]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]4C=C[C@@H]3O4)C[C@H]2N1C(=O)[C@@H]1CC[C@H]2C[C@@H]1C2(C)C 2325872391 VSGPSPMPPAVEFQ-KKQRFQACSA-N 398.547 2.850 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccnc2)S(=O)(=O)c2ccccc2)cc1 778593 NBVOGNIUNMSXLC-UHFFFAOYSA-N 397.456 2.924 0 50 GFAA CSCC[C@H](NC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 2876715 FSWIZRWICPPRCU-INIZCTEOSA-N 386.473 2.948 0 50 GFAA O=C(c1cccc(F)c1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 6335596 DHBKDNXLZIENOW-UHFFFAOYSA-N 388.873 2.687 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3cccnc3)CC2)cc1 8088683 ZJOJBOJCEHFHFN-UHFFFAOYSA-N 387.505 2.526 0 50 GFAA CCS(=O)(=O)N1CCc2cc(C(=O)Nc3ccc(OC)cc3OC)ccc21 8586808 XWWXCEBZOGRJSO-UHFFFAOYSA-N 390.461 2.668 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@H]3CCCN(Cc4ccccn4)C3)[nH]n2)cc1 11663342 OHPAUBFIHCFNTK-SFHVURJKSA-N 391.475 2.875 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@@H](C)Cc3cccc(C)n3)CC2)CC1 11821302 UGQIEQNOOQGOSA-FQEVSTJZSA-N 386.584 2.977 0 50 GFAA O=C(Nc1ccnn1C1CCN(C2CCOCC2)CC1)c1ccc2c(c1)OCO2 12387689 KCLOAMBTDRCPON-UHFFFAOYSA-N 398.463 2.680 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@]3(CCN(C(=O)C4=NNC(=O)CC4)C3)C2)cc1 12576426 KQXLGVTUGJFYSL-HSZRJFAPSA-N 396.535 2.891 0 50 GFAA CC(C)CCNC(=O)C1CCN(S(=O)(=O)CCCc2ccccc2)CC1 13677835 IUCRLBLXTFFYHS-UHFFFAOYSA-N 380.554 2.823 0 50 GFAA CCn1nc(C(=O)N2CCOCC2)c2c1CC[C@@H](NCCC1=CCCCC1)C2 14753815 KCVHTCAEAGDBFH-GOSISDBHSA-N 386.540 2.713 0 50 GFAA O=C(c1ccc2nc(N3C(=O)CCC3=O)sc2c1)N(CCO)c1ccccc1 16212373 TUUBHSMOGCUWRT-UHFFFAOYSA-N 395.440 2.589 0 50 GFAA CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 16605067 PAHABBNNSMSOQL-UHFFFAOYSA-N 379.309 2.872 0 50 GFAA Cc1nn2c(ncc3c(=O)n(NC(=O)c4cccnc4)ccc32)c1-c1ccccc1 40396344 HBVKIZGIWZETEE-UHFFFAOYSA-N 396.410 2.799 0 50 GFAA Cc1ccc(Cn2nccc2NC(=O)Cn2nc(C)c(-c3cncnc3)c2C)o1 48345624 GLJCABUXZVADML-UHFFFAOYSA-N 391.435 2.742 0 50 GFAA COc1ccccc1CNC(=O)Cn1nc(-c2ccccc2Cl)ccc1=O 49548675 DTTPRVJHZZNCAQ-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA CC(C)c1cc(C(=O)N2CCn3nc(-c4nc5ccccc5[nH]4)cc3C2)[nH]n1 67431973 LPPKQJYYWNXMLV-UHFFFAOYSA-N 375.436 2.929 0 50 GFAA Cc1nc(CNC(=O)[C@H]2CCC(=O)N(CCc3cccc(F)c3)C2)sc1C 67643544 KGSPXPVKQPDTGI-INIZCTEOSA-N 389.496 2.997 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)c2ccc([C@H]3CCCO3)s2)CC1 67674171 PVKOQQNZWIOUPT-MRXNPFEDSA-N 386.521 2.676 0 50 GFAA COc1cccc(-c2nccn2Cc2ccc3c(c2)n(C)c(=O)n3C)c1OC 71712267 FYFPTNRSLGBIMH-UHFFFAOYSA-N 378.432 2.806 0 50 GFAA CCN(C(=O)C[C@H]1C(=O)NCCN1CCc1ccccc1)C1CCCCCC1 72130703 SDBFAWHGNZWQEZ-NRFANRHFSA-N 385.552 2.991 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCN(c2ccc(OC)cc2)C(=O)[C@H]1C 72150135 CFBICXKCAFJOOO-CYBMUJFWSA-N 376.888 2.882 0 50 GFAA CN(C)c1nc(-c2ccncc2)nc2c1CCN(C(=O)[C@@H]1C[C@@H]3C=C[C@H]1C3)C2 72172726 ULWNQLBNKFOLGM-UWWQBHOKSA-N 375.476 2.702 0 50 GFAA Cc1cc(CNC(=O)c2ccc3c(c2)CN(CCc2ccncc2)C3=O)no1 72454626 STWFDWJYBUIEGY-UHFFFAOYSA-N 376.416 2.507 0 50 GFAA CC[C@H](c1cccnc1)N(C)C(=O)c1cnc(COc2ccccc2)[nH]c1=O 91381491 ONGNHDFPIVWVMD-GOSISDBHSA-N 378.432 2.967 0 50 GFAA O=C(c1cnccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1ccc(Cl)s1)C2 95358915 XGBOYBZZLRJWPW-NWDGAFQWSA-N 376.869 2.568 0 50 GFAA CN(Cc1ccon1)S(=O)(=O)c1cccc(C(=O)N2CCCCCC2)c1 95369721 ZCFBOLFVXMJLAS-UHFFFAOYSA-N 377.466 2.512 0 50 GFAA Cc1noc(-c2ccc(NC(=O)N[C@H]3CCCN(c4cnccn4)C3)cc2)n1 95523949 ZPDLGZYJLNNALC-INIZCTEOSA-N 379.424 2.626 0 50 GFAA COc1ccc(CN2CCC(c3nnc(Cn4cccn4)n3C)CC2)c(F)c1 96138677 BAJMSMVAWYNGNI-UHFFFAOYSA-N 384.459 2.587 0 50 GFAA O=C(NC1CCN(c2ccccc2)CC1)N1CCN(c2cccc(O)c2)CC1 97215949 AJPHEUGKKGAOJT-UHFFFAOYSA-N 380.492 2.893 0 50 GFAA CCCN1C(=O)[C@H]2[C@@H](c3ccc(O)c(OC)c3)N(c3ccccc3)O[C@H]2C1=O 101962982 NYPLHDDUBFFRLX-IPMKNSEASA-N 382.416 2.657 0 50 GFAA COc1cccc(-c2nsc(NC(=O)N[C@@H]3c4ccccc4C[C@@H]3O)n2)c1 121404160 IOQVWCDJFLTXSZ-JKSUJKDBSA-N 382.445 2.994 0 50 GFAA COc1cccc([C@H](NC(=O)c2cc3c(cn2)OCCC3)c2nccn2C)c1 170593860 CPVUOWDKGNMLCB-IBGZPJMESA-N 378.432 2.668 0 50 GFAA CCOC(=O)c1sc2nc(CN(C)C)nc(N(C)C3CCOCC3)c2c1C 170647923 ZMAWAIJRZFOSCV-UHFFFAOYSA-N 392.525 2.853 0 50 GFAA O=C1O[C@H](C(=O)N2CCC(O)(c3ccccc3Cl)CC2)Cc2ccccc21 192403098 MNGJHNBZTCKGAK-SFHVURJKSA-N 385.847 2.932 0 50 GFAA CCOc1ncccc1NC(=O)C(=O)N1CCC(c2nc3ccccc3o2)CC1 193950895 CRKUGHNENZLKOH-UHFFFAOYSA-N 394.431 2.966 0 50 GFAA CCN(C[C@H]1CCCO1)C(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 225517982 ZRBZVINPPOURTE-CQSZACIVSA-N 389.521 2.754 0 50 GFAA CC(=O)N[C@H](CC(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21)c1c(F)cccc1F 236720904 WRRCIMHBXJEQAH-IEAZIUSSSA-N 394.418 2.776 0 50 GFAA Cc1c(C(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)nnn1C1CCNCC1 236723338 PWPWXZDSRZALOP-QGZVFWFLSA-N 381.484 2.514 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N[C@@H](c2ccccn2)[C@H]2C[C@@H](O)C2)c1 241081943 YSXLAZGLHSORQC-QEEYODRMSA-N 378.432 2.722 0 50 GFAA O=C(O)c1ccc(CN2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 261932124 LFNNVAZTDWYQLR-UHFFFAOYSA-N 394.880 2.545 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@H](NCc2ccccc2OC)CNC3=O)cc1 263618976 WJBINPUMUBJFCL-FQEVSTJZSA-N 378.432 2.599 0 50 GFAA COc1cc(OC)cc([C@@H](O)CNC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1 265417387 DVIQAQYEJXIRKK-SGTLLEGYSA-N 384.436 2.674 0 50 GFAA COc1ccccc1O[C@H](C)CNC(=O)Nc1ccc(S(C)(=O)=O)cc1 266374340 MDOZWJDCLVAAEY-CYBMUJFWSA-N 378.450 2.688 0 50 GFAA Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)Nc1cc2n(n1)CCCC2 287071722 HKSJYAUQJNAVMT-QGZVFWFLSA-N 383.452 2.781 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3c(C(C)C)nn(C)c3Cl)CC(=O)N2C)cnn1C 328641894 YFQIYKKZVIXCDG-SCLBCKFNSA-N 392.935 2.548 0 50 GFAA Cc1csc(=O)n1CCC(=O)N1CCC[C@@H](Cn2cnc3ccccc32)C1 364973199 GPYOQYQHWOFMKO-MRXNPFEDSA-N 384.505 2.897 0 50 GFAA Cc1nc(N2CC[C@@](O)(c3cn(C(C)C)nn3)C2)c2c3c(sc2n1)CCC3 375262538 UXFPBBFWRNVIHO-IBGZPJMESA-N 384.509 2.759 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCC(c3ncc[nH]3)CC2)cc1)C1CCC1 408521454 UZAWWYFHPCRXSM-UHFFFAOYSA-N 388.493 2.717 0 50 GFAA CC1(C)Cc2cc(CNC(=O)N3CCCN(c4ncccn4)CC3)ccc2O1 426530748 FWCQBBXLKZJRKM-UHFFFAOYSA-N 381.480 2.612 0 50 GFAA Cc1cnccc1-c1ccc(C(=O)N2CCN(C3CCN(C)CC3)CC2)cc1 426602573 XMUWQACGMFJQBM-UHFFFAOYSA-N 378.520 2.909 0 50 GFAA CCc1ccccc1OC1CN(C(=O)c2cccc(-c3ccc(=O)n(C)n3)c2)C1 534676681 JYKMYDKMIRKLNA-UHFFFAOYSA-N 389.455 2.913 0 50 GFAA Cc1cc(N2CCC(CNC(=O)C3=Cc4ccccc4OC=C3)CC2)nc(N)n1 825149689 CLVZZFVJNPHNBJ-UHFFFAOYSA-N 391.475 2.690 0 50 GFAA COc1cc2c(cc1OC)[C@@H](NC(=O)[C@@H](C)n1cnc3ccccc3c1=O)CC2 888105475 BUFFYWYYCSRTHZ-ACJLOTCBSA-N 393.443 2.778 0 50 GFAA COc1ccccc1[C@H](CNC(=O)c1ccnc(C)n1)NC(=O)OC(C)(C)C 918164355 SUFDDNMTTSSSOL-INIZCTEOSA-N 386.452 2.789 0 50 GFAA O=C(Cc1ccccc1Cl)NC[C@H]1CCCN(C(=O)Cc2ccncc2)C1 952985698 IVUDGHUDGWYOKJ-QGZVFWFLSA-N 385.895 2.875 0 50 GFAA COc1ncc(Br)cc1CNC(=O)c1n[nH]c2c1C[C@@H](C)O[C@H]2C 1857530954 FMYSDQDQOICCJJ-BDAKNGLRSA-N 395.257 2.528 0 50 GFAA COc1ccc(Cc2nc(-c3cc(C4CC4)n(C)n3)n(CCCO)n2)cc1OC 1857709052 BIOGHNVVXPGLOK-UHFFFAOYSA-N 397.479 2.546 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cc(-c3ccccn3)[nH]n2)[C@H]1c1ccccc1 1857736611 NZJJNLJSIMEHSP-SFTDATJTSA-N 391.475 2.616 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875245349 WDGSJIQSCOPXDD-ICSRJNTNSA-N 391.899 2.584 0 50 GFAA Cc1cccc([C@H](CNC(=O)N2CCOCC[C@H]2C2CC2)N2CCOCC2)c1 1875300361 AMSZJHZGXPCWPP-SFTDATJTSA-N 387.524 2.579 0 50 GFAA Cc1cccc(OCc2ccccc2)c1NC(=O)N1CCn2c(O)nnc2C1 1875301397 ILRXOJWHQVYZJE-UHFFFAOYSA-N 379.420 2.919 0 50 GFAA C=CC(=O)N1CCC(C(=O)OCc2ccc(I)cc2)CC1 1875324225 MXCFBRZYBAUEMU-UHFFFAOYSA-N 399.228 2.759 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@]2(Cc2ccccc2)C(=O)OCC)CC1 1875365459 ZQENHIKFWXSSKI-QHCPKHFHSA-N 398.503 2.578 0 50 GFAA Cn1cc(C[N@@]2C[C@H]2COc2cccc(C(=O)NCc3ccccc3)c2)cn1 1875385189 OBKSQORBDSQECO-FNZWTVRRSA-N 376.460 2.613 0 50 GFAA CCN=S1(=O)CCC2(CC1)CN(C(=O)N[C@H](C)c1cc(C)ccn1)CCO2 1875395322 AQYDWJYOBLQSLQ-GITGVNTFSA-N 394.541 2.513 0 50 GFAA O=C(O)[C@@H]1CN(Cc2csc(C34CC5CC(CC(C5)C3)C4)n2)CC[C@H]1O 2100534868 XVCJTCLHQRQGQW-XXTONSQESA-N 376.522 2.878 0 50 GFAA O=C(C[C@@H](c1ccccc1)C1CC1)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 2325798209 WKJSNNAZZAMQHL-INIZCTEOSA-N 384.457 2.935 0 50 GFAA O=C(NC1CCCCC1)[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)NCC3)C1 2325842598 BTBKKXFXALLFGK-MRXNPFEDSA-N 391.537 2.504 0 50 GFAA C=CC(=O)N1CCC(C(=O)N(C)[C@@H]2c3cc(Cl)cc(Cl)c3C[C@H]2O)CC1 2325883983 PIQAGJZHWXCZHR-SJLPKXTDSA-N 397.302 2.835 0 50 GFAA CCCn1nc(N(Cc2ccc(N3CCCC3=O)cc2)S(C)(=O)=O)cc1C 2356141899 VDWDRWWEOROJLK-UHFFFAOYSA-N 390.509 2.695 0 50 GFAA O=C1CO[C@H](C(=O)N2CCC3(CCc4ccccc43)CC2)[C@@H](c2ccccc2)N1 2356149201 PBZKHWXCGCEPLT-YADHBBJMSA-N 390.483 2.749 0 50 GFAA O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1)NCc1ccco1 655584 ADODOIQCZAIPFZ-UHFFFAOYSA-N 388.420 2.930 0 50 GFAA CCCn1c2ccccc2c2nnc(SCC(=O)Nc3ncccn3)nc21 716542 UHAOHBUKFTWMLL-UHFFFAOYSA-N 379.449 2.910 0 50 GFAA Cc1cccc(OCCNC(=S)NC(=O)c2cncc(Br)c2)c1 2121726 ORLTVFDSQKMYPZ-UHFFFAOYSA-N 394.294 2.836 0 50 GFAA Cc1c(Cl)c(C(=O)Nn2c(C)nc3sc4c(c3c2=O)CCCC4)nn1C 2778091 WBMRYXTUDBZFDN-UHFFFAOYSA-N 391.884 2.724 0 50 GFAA COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1O 3782246 RFDMNXDDRXVJTM-RQUSPXKASA-N 384.384 2.615 0 50 GFAA biogenic,in-vitro COc1cccc(OC[C@H](O)CNC(=O)c2ccc3nc(C4CC4)oc3c2)c1 12090693 RQNSRMAFUUMVGG-OAHLLOKOSA-N 382.416 2.884 0 50 GFAA COc1ccc(CNCc2ccsc2)c(OC[C@@H](O)CN2CCCC2)c1 12195983 ITNOXOQDYAZKJQ-SFHVURJKSA-N 376.522 2.882 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)N[C@@H]3C=CS(=O)(=O)C3)cs2)cc1 12389198 NWESILYXZCXAES-OAHLLOKOSA-N 376.503 2.903 0 50 GFAA CSCC(=O)N1CCC(Oc2cccc(C(=O)NCc3cccnc3)c2)CC1 12436253 VFLHLMQSPXBXCT-UHFFFAOYSA-N 399.516 2.744 0 50 GFAA COC[C@H](C)NC(=O)c1sc2ncnc(N(C)CCc3ccccn3)c2c1C 14989041 NAHWBIYRXZNQGC-ZDUSSCGKSA-N 399.520 2.838 0 50 GFAA CCN1CCN(C[C@H](O)COc2cccc(CNC3CCCCCC3)c2)CC1 19228546 DOHDNOJEBZQTAC-QFIPXVFZSA-N 389.584 2.876 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(F)(F)F)cc(-c3cnn(C)c3)nc21 20605457 TZTOGYADMMVYLL-UHFFFAOYSA-N 385.371 2.520 0 50 GFAA Cc1ccc([C@H]2OC[C@@H]3O[C@H](c4ccc(C)cc4)O[C@H]([C@H](O)CO)[C@@H]3O2)cc1 38189452 LQAFKEDMOAMGAK-HJEMKOJISA-N 386.444 2.553 0 50 GFAA CC(C)[C@H]1C(=O)NCCN1Cc1ccccc1-c1nc2c(c(=O)[nH]1)CCCCC2 63869722 AFCAZZIDNVAYTO-FQEVSTJZSA-N 394.519 2.662 0 50 GFAA O=C(CCn1ccccc1=O)N1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1 65432006 GBFNPVOYHXDEDB-LEWJYISDSA-N 376.456 2.769 0 50 GFAA O=C(c1cccc(O)c1)N1CCC[C@@H](N2CCN(c3ccccc3F)CC2)C1 72147464 RJQHHLSPPUVFTL-GOSISDBHSA-N 383.467 2.958 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccccc3O[C@H](C)C(=O)O)CC2=O)cc1 72167113 PPZHIZXAJSHZTH-QGZVFWFLSA-N 382.460 2.691 0 50 GFAA CCCC[C@@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)c1cnn(CC)c1 82121525 MUEJYJUOQWYVTK-QGZVFWFLSA-N 384.480 2.959 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCC2(CCC(=O)N(C[C@@H]3CCCO3)C2)CC1 91547280 YFIUCMWXWNCYPC-IBGZPJMESA-N 388.483 2.778 0 50 GFAA O=C(NCc1ccon1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91769980 ABMFDKMFGHHVOM-UHFFFAOYSA-N 379.203 2.586 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccn(C)n3)CC2)C[C@@H](c2ccccc2)C1=O 92036952 CSJRXAORILEQLU-SFHVURJKSA-N 380.492 2.679 0 50 GFAA O=C(CCn1cccn1)N1CCC2(CC1)CC(=O)N(CCCc1ccccc1)C2 95382940 QBRGMPJPRGGBLV-UHFFFAOYSA-N 394.519 2.747 0 50 GFAA CN(c1ccc(C(=O)N[C@@H]2CCCC[C@H]2O)cc1)S(=O)(=O)c1ccccc1 104836180 BSXBHHRLIYNZHV-RTBURBONSA-N 388.489 2.545 0 50 GFAA CC(C)Oc1ccc([C@H](C)NS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1 116330090 FQTBHSUAWFNIEE-AWEZNQCLSA-N 388.489 2.799 0 50 GFAA C[C@H](OC1CCCCCC1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 126908438 MBHGQUUPNKYRHC-INIZCTEOSA-N 394.537 2.988 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)Nc1nnc(CC(C)C)s1 129590453 CRIODNIRASWVIN-UHFFFAOYSA-N 394.522 2.837 0 50 GFAA O=C(c1ccoc1)N1CC[C@H](n2cc(-c3nc(-c4ccccc4)no3)nn2)C1 169778005 SUEFXFRKBUHTCA-HNNXBMFYSA-N 376.376 2.675 0 50 GFAA CCOc1ccc(NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCC4)cc1 169779268 RPWQEGKSFXRIOB-UHFFFAOYSA-N 380.448 2.880 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)N(CC)CCCN2CCCC2)cc1 170607649 IXJCPTNWUZTBPS-QGZVFWFLSA-N 395.569 2.711 0 50 GFAA Cc1nn(-c2ccccc2)c(N)c1[C@@]1(O)C(=O)Nc2ccc(Br)cc21 170625875 HQCLWXJRFDKCFI-GOSISDBHSA-N 399.248 2.713 0 50 GFAA CCn1cc(S(=O)(=O)NC(=O)C(C)(C)c2ccc(OCC(C)C)cc2)cn1 170652618 ATXVNMKZYNWPBN-UHFFFAOYSA-N 393.509 2.721 0 50 GFAA CCOc1ccc(C(=O)N2CCC(N[C@@H](C(N)=O)c3ccc(F)cc3)CC2)cc1 171119513 FMBNPGYQVFXWMI-HXUWFJFHSA-N 399.466 2.645 0 50 GFAA Cn1cc([C@H]2CCN(C(=O)NC3CCN(CCc4ccccc4)CC3)C2)cn1 172113452 AKKSJEWHWFPYSK-IBGZPJMESA-N 381.524 2.626 0 50 GFAA CC[C@H]1CN(C(=O)C2CCN(c3nccc(OC)n3)CC2)c2ccccc2O1 172686706 XXFABWPSQFFAEP-INIZCTEOSA-N 382.464 2.906 0 50 GFAA Cc1nc(C)c(S(=O)(=O)Nc2ccccc2-c2nnnn2C(C)C)s1 181796795 UUFCNTSAUSCUPH-UHFFFAOYSA-N 378.483 2.795 0 50 GFAA CN1C(=O)C[C@@H](C(=O)N2CCN(C3CC3)c3ccc(F)cc32)[C@@H]1c1cccnc1 187368059 KAPRVDZFGKGFNN-UTKZUKDTSA-N 394.450 2.756 0 50 GFAA CN(C)[C@H](CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 193069733 FQTIIZPUZMYAJP-OAQYLSRUSA-N 394.519 2.893 0 50 GFAA CC1(C)Cc2cccc(NC(=O)NCc3cccnc3N3CCOCC3)c2O1 252485761 HDFZUZINJOMABW-UHFFFAOYSA-N 382.464 2.953 0 50 GFAA CC[C@@](NC(=O)C1CCN(C(=O)N(C)C)CC1)(C(=O)O)c1ccc(Cl)cc1 262667914 PSGODSDLQRAFNJ-IBGZPJMESA-N 395.887 2.540 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@H](c2ccc(OC)cc2)C3)cc1 263616793 KOCLKZBFDRCZHA-SFHVURJKSA-N 380.404 2.819 0 50 GFAA CCNC(=O)N1CCc2ccc(NC(=O)N3CCC(c4nc(C)no4)CC3)cc21 266046043 ZUEJMTARIACABV-UHFFFAOYSA-N 398.467 2.882 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCCc1nc(O)c2ccccc2n1 268953177 USAGAUPNLUZWAI-COXVUDFISA-N 383.448 2.902 0 50 GFAA O=S1(=O)CCC[C@H](CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1 293399270 RCQALJOYCMOINF-HXUWFJFHSA-N 376.566 2.799 0 50 GFAA O=C(c1cc(C(F)(F)F)ccc1Cl)N1CC[C@@H]2OCc3cnnn3[C@H]2C1 299782777 QISFQUYFGGZZNJ-KBPBESRZSA-N 386.761 2.936 0 50 GFAA CCOc1cc2c(cc1/C=C/C(=O)N(CC(=O)O)C1CCOCC1)O[C@H](C)C2 328594996 ICPCRSPDHVTYHA-ISZGNANSSA-N 389.448 2.514 0 50 GFAA O=S(=O)(N[C@H]1CCCn2ncnc21)c1cc(Br)sc1Cl 328608804 BGRXETOIBIJPED-LURJTMIESA-N 397.707 2.569 0 50 GFAA NC(=O)[C@@H](NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1 363830086 WZEWTTJUHHVKKS-PXNSSMCTSA-N 398.482 2.564 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1C 373140178 MDWVHQCPRANTJL-IRXDYDNUSA-N 380.510 2.781 0 50 GFAA CCc1nc(CN2CCC[C@H](NC(=O)[C@@H](C)c3c(F)cccc3F)C2)no1 378321305 XLHRQAJOFYPSNR-STQMWFEESA-N 378.423 2.795 0 50 GFAA COCCN(Cc1c(C)nn(C)c1C)C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 419598304 IHSKTCDFDUFDEJ-AWEZNQCLSA-N 384.484 2.832 0 50 GFAA CCN1CCC[C@H](CNC(=O)N2CCCN(Cc3cccc(F)c3)CC2)C1 426722697 UBTHRANQTJFDAB-LJQANCHMSA-N 376.520 2.775 0 50 GFAA O=C(O[C@@H]1CCN(c2ccccc2Cl)C1=O)c1nnc(O)c2ccccc12 732323810 UIRSSXPTNNFSBI-OAHLLOKOSA-N 383.791 2.951 0 50 GFAA C[C@@H](NC(=O)c1coc(CN2CCOCC2)c1)c1ccccc1-n1cccn1 828207338 CQHNAQRJTPARHJ-MRXNPFEDSA-N 380.448 2.789 0 50 GFAA COc1ccc(C(=O)N2CCC(NC(=O)N[C@@]34CCC[C@H]3C4)CC2)c(OC)c1 888101719 NBHXQDXNLGMFLY-LHSJRXKWSA-N 387.480 2.550 0 50 GFAA CCC1(CC)CNC(=O)[C@H]1NC1CCN(C(=O)c2ccccc2Cl)CC1 897344378 BJZDPOORGZNDTB-QGZVFWFLSA-N 377.916 2.839 0 50 GFAA CCNC(=O)C[C@H]1CCCCN1C(=O)c1cnn2c(-c3cccs3)ccnc12 952845512 KRDDGBCIYVPVES-CQSZACIVSA-N 397.504 2.979 0 50 GFAA CN1CCN(CC2CCN([C@H](C(=O)O)c3cc4ccccc4s3)CC2)CC1 1529099226 USMDPHVCDMRSCZ-FQEVSTJZSA-N 387.549 2.986 0 50 GFAA O=C(COc1ccc(Cl)cc1)N1CC[C@H](O)[C@](CO)(Cc2ccccc2)C1 1529101647 JLYDWUIAMZFGAM-PZJWPPBQSA-N 389.879 2.533 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1ccccn1)c1ccccc1-n1cccc1 1565528952 AJOBAVWKUHYNNJ-FPOVZHCZSA-N 377.444 2.976 0 50 GFAA O=C(Nc1ccccc1)N1CCC(Nc2cncc(C(=O)N3CCCC3)n2)CC1 1704352389 XCKWLEWSJWORNO-UHFFFAOYSA-N 394.479 2.821 0 50 GFAA CCN1CCC[C@H](n2ccnc2-c2ccc(OCCN3CCOCC3)cc2)C1 1857727017 IBXSUHOKUOUWIJ-FQEVSTJZSA-N 384.524 2.918 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CC(N5CCCC[C@H]5C)C4)CC3)nc2n1 1857730000 MDQGXTWTSPBACK-MRXNPFEDSA-N 397.523 2.833 0 50 GFAA O=C(N=c1cc[nH]cc1)C1CCN(C(=O)C[C@@H](c2ccc(O)cc2)C2CC2)CC1 1875265946 ZYDXJBGJWUVOBZ-OAQYLSRUSA-N 393.487 2.970 0 50 GFAA C[C@@H]1CCNC(=O)[C@H]1CNC(=O)NCc1c(F)cc(C(F)(F)F)cc1F 1875313133 HVHWPRGPZGKTOK-SCZZXKLOSA-N 379.329 2.555 0 50 GFAA Cn1c(CNS(=O)(=O)CCc2cccc(Cl)c2)nnc1-c1ccccc1 1875317958 HSHDEAOPGRHLHN-UHFFFAOYSA-N 390.896 2.798 0 50 GFAA C[C@@H]1CCN(c2cc(C(=O)NC3CCSCC3)c(Cl)cn2)C[C@H]1CO 1875360728 HXRKYGZKVNRSPS-OLZOCXBDSA-N 383.945 2.815 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)CC1 1875365572 BSUBBEZMHZWTIL-UHFFFAOYSA-N 379.464 2.645 0 50 GFAA N=[S@@]1(=O)CCC[C@@]2(CCCN2C(=O)c2cnn(-c3ccccc3F)c2)C1 1875395352 BQFXEMYUIUEGQS-HFJWLAOPSA-N 376.457 2.827 0 50 GFAA O=C(c1ccc(N2CCCCC2)cc1)N1CC[C@H](O)[C@](CC2CC2)(C(=O)O)C1 1940196352 FIBWBDWVLVEQDO-SIKLNZKXSA-N 386.492 2.755 0 50 GFAA CCCCCN1C(=O)[C@]2(CCN(C(=O)c3ccc(=O)n(C)c3)C2)c2ccccc21 2100547365 HRADEPWNPOZENN-QHCPKHFHSA-N 393.487 2.706 0 50 GFAA Cn1ncc2c1CCC[C@H]2N=c1[nH]c2ccccc2n1CCCn1ccnc1 2325773961 IQTSKPVXHMYROF-QGZVFWFLSA-N 375.480 2.968 0 50 GFAA O=C(CCC(=O)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1)c1ccccc1 2356161646 CWQNJNOVURYIPW-NFBKMPQASA-N 395.455 2.556 0 50 GFAA O=S(=O)(c1ccc(Br)cc1)N1CCN(c2ccccc2)CC1 831044 QGXNVCFMUCORAL-UHFFFAOYSA-N 381.295 2.960 0 50 GFAA Cc1nnc(NC(=O)[C@@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)s1 921088 WFGYUMMNQUKCDG-MRXNPFEDSA-N 392.440 2.693 0 50 GFAA COc1ccc(S(=O)(=O)NC2CCCCC2)cc1I 1111028 YWDVDMFSPCNUQI-UHFFFAOYSA-N 395.262 2.911 0 50 GFAA CCOC(=O)c1ccc(NC(=S)NCCn2cc(Br)cn2)cc1 2809114 BELQYZUTSNWFDE-UHFFFAOYSA-N 397.298 2.809 0 50 GFAA CCN1C(=O)[C@](O)(CC(=O)c2ccc3c(c2)OCCO3)c2cc(Cl)ccc21 4840952 VGLZLCCXEWMBPL-FQEVSTJZSA-N 387.819 2.938 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(CC(=O)NC1CC1)c1ccc(C)cc1 4867431 ZMNJRBPWQKMEQD-UHFFFAOYSA-N 388.489 2.786 0 50 GFAA O=C1N[C@H]2CN(Cc3ccc(-c4ccccc4F)o3)CC[C@@H]2N1C1CCNCC1 415143257 SLNRWKWWNHXFHO-PMACEKPBSA-N 398.482 2.806 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)CNC[C@@H](O)c2ccccc2Cl)cc1 65380557 SXYPDHVSZIMLSI-GOSISDBHSA-N 375.856 2.584 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)NC3CC(C)(C)NC(C)(C)C3)cnn2c1 67726502 MAVDHMUOJPWBND-UHFFFAOYSA-N 386.544 2.610 0 50 GFAA Cc1ccc2nc(CN(C)C(=O)[C@@H]3CCCN(C4CCN(C)CC4)C3)[nH]c2c1 71767860 KZQKMISQMDLYPU-QGZVFWFLSA-N 383.540 2.636 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)c4ccc[n+]([O-])c4)C3)C2)c1 12458389 GLELZTAYEFDHQN-QFIPXVFZSA-N 399.466 2.596 0 50 GFAA COc1cccc(C(=O)NCC(=O)N[C@H](c2ccccc2)C2CCOCC2)c1 363708847 DZHHLLAONISVNF-OAQYLSRUSA-N 382.460 2.709 0 50 GFAA COc1ccc(C[C@H]2CN(Cc3cnc(-c4ccccn4)nc3)CCO2)cc1 71614073 AOQPJIMVHVJMGG-FQEVSTJZSA-N 376.460 2.991 0 50 GFAA Cc1nnnn1-c1cc(NC(=O)N2CCCC[C@@H]2c2ccnn2C)ccc1F 370725289 QSJVELZNRYCYLM-MRXNPFEDSA-N 384.419 2.602 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(C(=O)N3C[C@@H](C)O[C@H](CC)C3)o2)C[C@H](C)O1 124424394 IYDWRCRGYLXHTF-QKPAOTATSA-N 378.469 2.559 0 50 GFAA CCn1cc(CN2CCCN(C(=O)c3cnn(CC(C)C)c3C3CC3)CC2)cn1 156122604 GGDYKFJTUDUREK-UHFFFAOYSA-N 398.555 2.981 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)nn1 376572393 GGKKGHZEFHCWJJ-SQNIBIBYSA-N 382.464 3.300 0 50 GFAA Cc1cc([C@@H]2CN(C(=O)C3CCN(c4ncccn4)CC3)CCO2)ccc1F 128592544 GJAIBYPBDWQRBL-IBGZPJMESA-N 384.455 2.741 0 50 GFAA C[C@H](CNC(=O)N(Cc1ccncc1)C1CCN(C)CC1)Oc1cccnc1 426431395 SPLTWLPJAOXSLN-QGZVFWFLSA-N 383.496 2.550 0 50 GFAA CCN1CCC[C@H](CN2CCC(Oc3ccccc3OC)(C(=O)O)CC2)C1 82108846 FHJJLUKHUOPFEI-KRWDZBQOSA-N 376.497 2.725 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1 426623375 WQFGYQMPLBVYKP-CYBMUJFWSA-N 377.489 2.516 0 50 GFAA Cc1nc([C@H]2CCOC2)cc(N2CCCN(C3Cc4ccccc4C3)CC2)n1 426383137 NFVKSWHHMAWGJW-FQEVSTJZSA-N 378.520 2.968 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccc4ncccc4c3)CC2)CN1C[C@H]1CCCO1 95360663 FPQSFHQGIFZRFG-LJQANCHMSA-N 393.487 2.869 0 50 GFAA O=C(NCCc1cccnc1)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 91943639 YPEWFIWRBOZYCC-UHFFFAOYSA-N 378.476 2.605 0 50 GFAA CCNC(=O)c1ccnc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)c1 95501404 HOGVMQMUTKHTRN-LJQANCHMSA-N 390.491 2.855 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(CC(=O)Nc3ccn(C)n3)CC2)C1 96166849 QMQSOYRYGZUIJA-IBGZPJMESA-N 381.524 2.560 0 50 GFAA Cc1cccc([C@H](CNC(=O)CCn2c(CO)nc3ccccc32)N(C)C)c1 97776149 PVHPWDGLXLDIDN-FQEVSTJZSA-N 380.492 2.646 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)c3cncnc3C)CC2)cc1 95498238 IEYBILCQTGSSIX-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA CCN1CCC(CNC(=O)N(C)[C@H](C)c2ccc(OC)cc2)(N(C)C)CC1 534576241 UWUKNJRGAXMELT-QGZVFWFLSA-N 376.545 2.814 0 50 GFAA CC(C)c1c(C(=O)N2CCN(C)CC2)cnn1-c1nccc(-c2cccs2)n1 299772466 YRYIQAYWMATIBW-UHFFFAOYSA-N 396.520 2.902 0 50 GFAA O=C(O)[C@@H]1C[C@H](NCc2cn(Cc3ccccc3)nc2-c2ccccc2)CN1 1875306329 AFLJOXQQVJDKKC-PMACEKPBSA-N 376.460 2.503 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)c1cnc(-c3ccccn3)nc1)OCCO2 1506398132 HFDLKWFRPOAESY-UHFFFAOYSA-N 376.372 2.765 0 50 GFAA C[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H](CC(=O)O)C(=O)N1 958528071 TXUUSELCFZFGJP-YJYMSZOUSA-N 394.427 2.599 0 50 GFAA CCCCn1c(CN2CCN(c3ncccc3C(N)=O)CC2)nc2ccccc21 952872392 NROJPZVZJVNGBO-UHFFFAOYSA-N 392.507 2.653 0 50 GFAA O=C(CCc1ccncc1)NCC1CCN(C(=O)COc2cccc(F)c2)CC1 952969559 FIFWYAGUMCWARA-UHFFFAOYSA-N 399.466 2.587 0 50 GFAA COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)CCC(=O)Nc1nncs1 952969113 HQAHSOHISLNHRV-CYBMUJFWSA-N 390.465 2.684 0 50 GFAA O=C([C@@H]1CCCN1C(=O)c1cccc(-c2cccc(F)c2)c1)N1CCOCC1 952981166 COMCPWAMYROKII-FQEVSTJZSA-N 382.435 2.956 0 50 GFAA C[C@H]1CN(C(=O)[C@@H]2CCC[C@@H](C(=O)N3C[C@@H](C)OC(C)(C)C3)C2)CC(C)(C)O1 222156827 KUTBNEJIWOKSET-XMTFNYHQSA-N 394.556 2.845 0 50 GFAA OCCn1c(N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)nc2ccccc21 1529189131 IACYBIRHKVTYEQ-VGSWGCGISA-N 388.471 2.617 0 50 GFAA CCCn1nc(C)cc1NC(=O)C[C@H]1COc2ccc(C(=O)N(C)C)cc2N1C 1529110046 JRBQLMIEQUNEMB-INIZCTEOSA-N 399.495 2.529 0 50 GFAA COc1ccc2c(c1)c(C(=O)N(CCN(C)C)Cc1[nH]cnc1C)c(C)n2C 1704316540 UCAWVLXCTUJAPT-UHFFFAOYSA-N 383.496 2.731 0 50 GFAA CCc1cc(NC[C@H](c2cccnc2)N2CCCCC2)nc(N2CCOCC2)n1 1704301068 IOVZQPYVPUAJAT-HXUWFJFHSA-N 396.539 2.910 0 50 GFAA CN1CCN(NC(=O)c2cc(-c3ccccn3)nc3ccc(Cl)cc23)CC1 5048699 IINKCBWHTFNXAW-UHFFFAOYSA-N 381.867 2.842 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 11934049 XUDQCSJFUODSEK-FQEVSTJZSA-N 389.402 2.916 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)N3CCCc4ccccc43)c2)C1=O 12003718 WHHBSDRLRXLGKR-AWEZNQCLSA-N 384.457 2.592 0 50 GFAA COC[C@@H](C)NC(=O)c1sc2ncnc(NCCc3ccccn3)c2c1C 12152061 HPHAHKAFQSTENK-GFCCVEGCSA-N 385.493 2.814 0 50 GFAA COC(=O)c1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3cc(C)[nH]n3)C2)cc1 12218894 OCGXCFBOSGBPGQ-QUCCMNQESA-N 396.491 2.631 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)NCCCCc2ccccn2)CCC1=O 12304908 XBVQAKOWPHXBKG-IBGZPJMESA-N 395.503 2.968 0 50 GFAA CCN1CCN(c2ccc(C(=O)NCCCc3ccc(OC)cc3)cn2)CC1 12704067 LHFAILLQKHOQSU-UHFFFAOYSA-N 382.508 2.595 0 50 GFAA O=C(c1c[nH]c2c(F)cccc2c1=O)N(Cc1ccccn1)C[C@H]1CCCO1 19663930 WHSYUPTXADXLTB-OAHLLOKOSA-N 381.407 2.884 0 50 GFAA COc1ccc(NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCC4)cc1Cl 169778244 GIZSRRMOBYJZBH-UHFFFAOYSA-N 386.839 2.753 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)N2CCC3(CCCO3)CC2)C[C@H]1NC(=O)C1CC1 1857689720 WALPOZQWOOYNTM-IPMKNSEASA-N 392.540 2.648 0 50 GFAA Cc1nc(CC(=O)NC[C@H]2[C@H]3CN(C4CCCC4)C[C@]34CC[C@H]2O4)cs1 1857721976 ATJUYJQZOJXRNF-JRBPQWBISA-N 375.538 2.532 0 50 GFAA Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N(CCC(=O)O)C1CCOCC1 237728509 YYVAZEFPZADDEV-UHFFFAOYSA-N 391.855 2.930 0 50 GFAA Cc1cc(S[C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)ncn1 12000679 JSNBWMRMUOVFOA-JTQLQIEISA-N 376.507 2.944 0 50 GFAA Cc1nccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 363439577 JJTSTIBKXVBHLS-GOSISDBHSA-N 378.398 2.856 0 50 GFAA COC[C@H]1CN(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCO1 266330539 DXVBUNRMRAONLI-OAHLLOKOSA-N 375.450 2.880 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@H]2CCCc3c2cnn3C)(c2ccccc2)CC1 847333067 WCXRVCZHCKPEFT-IBGZPJMESA-N 392.503 2.660 0 50 GFAA COC(=O)c1nc(N2CCN(c3cccc(OC)c3)CC2)c2sccc2n1 2325802314 ZANAIPRSFMHWHB-UHFFFAOYSA-N 384.461 2.813 0 50 GFAA COc1ccc(COC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)c(OC)c2)cc1 716223 ITNSGLCHRFJDOV-LJQANCHMSA-N 398.415 2.781 0 50 GFAA C[C@]1(c2ccco2)NC(=O)N(C[C@@H](O)CO[C@H]2CCCc3ccccc32)C1=O 246685189 QWPNBFIURFSRDJ-LDBYXDLTSA-N 384.432 2.502 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)Oc3cccc(N4C(=O)CCC4=O)c3)CC2=O)cc1 1124134 OLMPBROJNFBFQJ-OAHLLOKOSA-N 392.411 2.607 0 50 GFAA COc1c(C)cccc1C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCC2 2827388 VLFYUFOHKWIYLG-UHFFFAOYSA-N 389.502 2.780 0 50 GFAA CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 4941341 KMKIXUXCIIBRJX-UHFFFAOYSA-N 390.461 2.741 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)CCN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2=O)cc1 100394899 CLGNYRFBYDAFII-LNMJFAINSA-N 398.459 2.612 0 50 GFAA Cc1cc(NC(=O)N2CCCO[C@H](Cn3cccn3)C2)n(-c2ccccc2)n1 102540172 VESZCSHGOAVPMM-SFHVURJKSA-N 380.452 2.700 0 50 GFAA C[C@@H](Cc1noc(CNc2ccccc2C(N)=O)n1)N(C)C(=O)OC(C)(C)C 253431612 SLHVMPHBPZHFMX-LBPRGKRZSA-N 389.456 2.579 0 50 GFAA CCn1cc(Br)c(C(=O)NC(=S)Nc2ccc(OC)cc2)n1 2801844 VMINCOUDOSDZTD-UHFFFAOYSA-N 383.271 2.801 0 50 GFAA CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3ccc4c(c3)[nH]c(=O)n4C3CCCC3)[C@@H]2C1 126208985 FSKNPEBFMBFIMO-AHRSYUTCSA-N 399.491 2.853 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCN(c2ccncc2)CC1 121899920 LCZWWMZNRKUXDF-FQEVSTJZSA-N 379.508 2.578 0 50 GFAA CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C 332900586 UTKRUJSBTCAXFB-AFYVEPGGSA-N 383.492 2.535 0 50 GFAA COc1ccc([C@@H](OC)[C@H](C)NC(=O)NCc2ccc(-n3ccnc3)nc2)cc1 378383351 PUAUXNQTJDLQNC-YWZLYKJASA-N 395.463 2.851 0 50 GFAA CC1(C)CCC[C@@H]1NC(=O)N1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1 176618190 QWXKOFARCGRLNW-ZDUSSCGKSA-N 399.479 2.563 0 50 GFAA O=CN[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)NC1CCN(CC2CC2)CC1 242047876 VQTOMCAAFZMDDD-SFHVURJKSA-N 398.334 2.641 0 50 GFAA CCOc1ccc(C(=O)CCC(=O)N2CCn3nc([C@@H](C)O)cc3C2)cc1C 223446749 DGMNSGRCRGSWSG-OAHLLOKOSA-N 385.464 2.649 0 50 GFAA Cn1nc(CO)c2c1CCN(C(=O)c1ccc(-c3ccc4c(c3)CCO4)cc1)C2 426412492 VKZZINDVVIOWCY-UHFFFAOYSA-N 389.455 2.713 0 50 GFAA CC1(C)CN(c2ccc(C(N)=O)nn2)C[C@H](c2cccc(C(F)(F)F)c2)O1 293201179 URJDOXMVDKCHHG-CQSZACIVSA-N 380.370 2.951 0 50 GFAA Cc1noc(-c2ccc(N3CCC[C@H](c4nccn4CCN(C)C)C3)nc2)n1 95512637 PNLSTKZGDCOMQR-KRWDZBQOSA-N 381.484 2.582 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)Nc1ccc2[nH]nnc2c1 96151224 FXGOVOLNYJETHN-UHFFFAOYSA-N 378.436 2.906 0 50 GFAA COC(=O)[C@H]1[C@H]2C=C[C@@]3(CN(C(c4ccccc4)c4ccccc4)C(=O)[C@H]13)O2 238997499 AJYDXIPSQULZLA-XQQXVUDOSA-N 375.424 2.731 0 50 GFAA Cc1c(CN2CC[C@H](N3CCOCC3)[C@H](CCCO)C2)[nH]c2ccc(F)cc12 91460020 FOTOSBOQOTWGCT-VGSWGCGISA-N 389.515 2.911 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95353950 HVQVYMGODCDJKG-MAUKXSAKSA-N 376.504 2.602 0 50 GFAA O=C(Cn1cc(C(F)(F)F)ccc1=O)NC[C@H]1CCOc2ccccc2C1 97674467 GTUXZJNYLODLKQ-ZDUSSCGKSA-N 380.366 2.625 0 50 GFAA Cc1c(CC(=O)N2C[C@@H]3CNC[C@@H]3C2)c2c(n1CC(C)C)CC(C)(C)CC2=O 95511245 FIFJUTWOTDSVLB-CALCHBBNSA-N 385.552 2.828 0 50 GFAA O=C1CC2(CCN(C(=O)N3CCCC3)CC2)CN1Cc1ccc(F)c(F)c1 91620330 BDTHVVVEINQZTK-UHFFFAOYSA-N 377.435 2.995 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)c(C)n1 95386477 TUMGDHIKAJLOMP-OAHLLOKOSA-N 382.493 2.815 0 50 GFAA COCCn1c(C)cc(C)c(C(=O)NCCCn2ccc3ccccc32)c1=O 253410495 NKORKOXYVQDVCD-UHFFFAOYSA-N 381.476 2.886 0 50 GFAA C[C@@H](Cn1cncn1)C(=O)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1 299769544 XZBZMUBJLZICNA-INIZCTEOSA-N 378.480 2.634 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)[C@H]1CC(=O)N(c2ccc(O)cc2)C1 827696417 KXEJMMKTDAOWDX-HNNXBMFYSA-N 377.400 2.717 0 50 GFAA CC1(C)[C@@H](c2cccc(C(F)(F)F)c2)CCN1C(=O)c1cn(CCN)nn1 877256373 UHSMIEOKHYDYSZ-CQSZACIVSA-N 381.402 2.664 0 50 GFAA Fc1cccc(-n2cc(CNCc3cnc(NC[C@H]4CCCO4)nc3)cn2)c1 952965709 SUZSUBPOKDWMJJ-LJQANCHMSA-N 382.443 2.682 0 50 GFAA CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 271596641 TVNLRDCOZNVTLO-DAYGRLMNSA-N 375.448 2.615 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H]2CC[C@H](C1)CN2Cc1nc(-c2ccccc2)no1 1073380807 XJJBHSNOVWKRAT-AEFFLSMTSA-N 378.480 2.865 0 50 GFAA O=C(c1cc(F)c(N2CCOCC2)c(F)c1)N1CCOc2cccc(F)c21 410565845 CPTQQEFJPHFDTH-UHFFFAOYSA-N 378.350 2.980 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCC[C@@H]3CO)ncn2)CC1 171884650 ZLXRWXKJNLYOEI-QGZVFWFLSA-N 383.496 2.527 0 50 GFAA Cc1ccccc1-n1cc(CN(C)c2cc(N3CCC(O)CC3)ncn2)cn1 1529172013 CTMGZLUZDLVPMY-UHFFFAOYSA-N 378.480 2.568 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)NCCc3ccccc3)C1)CC2 1704316338 MSORHRHVQMTNRC-QFIPXVFZSA-N 379.508 2.775 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N[C@H]3COC[C@H]3Cc3ccncc3)o2)CC1 1615965687 MNNGQQKRCINPSP-QUCCMNQESA-N 383.492 2.894 0 50 GFAA COc1ccc([C@H](CC(=O)NCCCO)c2ccc3cccnc3c2O)cc1 1776111822 RVYYKHCMPWPIGM-IBGZPJMESA-N 380.444 2.970 0 50 GFAA Cc1nc(C)n(CCCNC(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)n1 1772808691 YMWRKSPQQVEGST-INIZCTEOSA-N 396.520 2.725 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N[C@H]1CCCN(Cc3ccccn3)C1)n2C 11662420 PFPRSZPKCKZKPQ-SFHVURJKSA-N 378.476 2.976 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N1CCc2onc(-c3ccccc3F)c2C1 12075742 YGJRENCGSYXMEU-UHFFFAOYSA-N 390.440 2.578 0 50 GFAA COc1ccc(CNCCc2ccccn2)cc1OC[C@H](O)CN(C)C(C)C 12205142 LFLRHDMDSCZPAH-HXUWFJFHSA-N 387.524 2.502 0 50 GFAA O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857680776 ORJYEDWYXSPQRZ-QGZVFWFLSA-N 392.503 2.795 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3cnn(-c4cccc(C)c4)c3)C[C@]23CC[C@H]1O3 1857720188 ILGRKVWZCMNSNQ-ZZLPTCMGSA-N 394.519 2.686 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccco4)C[C@]34CC[C@H]2O4)c(C)n1 1857732177 GFZMTFVRGWZXMN-GPQLQYNLSA-N 381.476 2.701 0 50 GFAA Cc1ccnn1CCC(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857734583 VTLIHZRUXTWOBH-GBESFXJTSA-N 388.899 2.566 0 50 GFAA CC(C)(C)CCN1CC2(CCN(c3noc(C4CC4)n3)CC2)OCCC1=O 1857740467 OSRTWMPOXOIUCD-UHFFFAOYSA-N 376.501 2.971 0 50 GFAA Cc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3ccncc3)[C@H]3CC[C@]2(C1)O3 1875249025 FQTHZHKCBAFZMF-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3cccc(CN4CCCC4=O)c3)C2)n1 116777552 JKBDLSKPCRBHRW-IBGZPJMESA-N 395.507 2.570 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1C[C@H]2CC[C@@H](C1)N(CC1CCC1)C2 247872415 RIAIDWMTYISWNE-PXNSSMCTSA-N 377.492 2.875 0 50 GFAA COc1ccc([C@@H](CNC(=O)C[C@@H](CN)OC)c2c[nH]c3ccccc23)cc1 262971443 XQXBVTUBPDVUEG-PKOBYXMFSA-N 381.476 2.788 0 50 GFAA CC(=O)N1CCC(CNC(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1 264313063 MGUFXEGTBMRDAB-OAQYLSRUSA-N 386.540 2.599 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CC[C@H](O)[C@@](Cc2ccccc2)(C(=O)O)C1 1704335331 DHVPRPUGKVMVHN-REWPJTCUSA-N 395.455 2.532 0 50 GFAA COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc(OC)c(Br)cc1OC 717464 YINBWJOIYPWKCU-AWEZNQCLSA-N 399.241 2.609 0 50 GFAA O=C(CCn1ccc2ccccc21)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785547 DHRGXVQQRALTGO-POZUXBRTSA-N 386.883 2.837 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccnc(Oc2ccccc2F)c1 2325797089 IFJLMTKSXFDUHB-ZTFGCOKTSA-N 396.422 2.779 0 50 GFAA N=c1n(CCN2CCCCC2)c2ccccc2n1C[C@H](O)COc1ccccc1 847463 YZVGXJBXRGLPRH-IBGZPJMESA-N 394.519 2.848 0 50 GFAA O=C(OC/C=C/c1ccccc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 2451266 OJWWSACMOXIITD-QPJJXVBHSA-N 387.457 2.578 0 50 GFAA Cc1[nH]nc(O)c1C(c1ccc(O)c(Br)c1)c1c(O)n[nH]c1C 4113135 PDEZOGHRYPBKOQ-UHFFFAOYSA-N 379.214 2.809 0 50 GFAA O=C(O)CCCCCN1C(=O)c2cccc3c(N4CCOCC4)ccc(c23)C1=O 5046826 KKPZLGLERKAWPF-UHFFFAOYSA-N 396.443 2.917 0 50 GFAA CCOCCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(CC)cc3)C2)s1 9426631 FPCILPBZKBMTFW-AWEZNQCLSA-N 388.493 2.671 0 50 GFAA O=C1C[C@@H](N2CCC(Oc3ccc4c(c3)OCO4)CC2)C(=O)N1c1ccccc1 9482286 ZPWYLVIFBYSQDN-GOSISDBHSA-N 394.427 2.591 0 50 GFAA COCCN(C)Cc1cccc(OC[C@H](O)CN2CCc3ccccc3C2)c1 11704072 PPWLMXZSUDBVLL-JOCHJYFZSA-N 384.520 2.563 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)c3ccsc3)C2)cc1 12297982 QGFPGDJAJXTHSQ-CQSZACIVSA-N 394.518 2.587 0 50 GFAA O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc2oc(CCCc3ccccc3)nc2c1 12590035 DMFWUIPJGUQOFH-KRWDZBQOSA-N 398.484 2.920 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2C)CCCN(C(=O)c2cc[n+]([O-])cc2)C1 12595034 HVLYYBINIQJLEB-QFIPXVFZSA-N 382.460 2.657 0 50 GFAA C[C@H](NC(=O)c1cn(CCNC(=O)CC2CCCC2)nn1)c1cccs1 15070312 LPKFITNODCITRE-ZDUSSCGKSA-N 375.498 2.527 0 50 GFAA COc1cc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc(OC)c1OC 16624782 DHRPPUFGNIEYCG-UHFFFAOYSA-N 378.469 2.936 0 50 GFAA CCOC(=O)N1CCN(CCC(=O)Nc2cccc(Br)c2)CC1 19811414 LSZFDOVWASJLSQ-UHFFFAOYSA-N 384.274 2.552 0 50 GFAA O=C(c1ccc(NCc2ccccc2)nc1)N1CCCN(c2ncccn2)CC1 20455275 XJSAPNTVMZRFRD-UHFFFAOYSA-N 388.475 2.836 0 50 GFAA CCOCCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccoc3)nn2CC)C1 20878261 XTRZOTPNHRLVBG-QGZVFWFLSA-N 388.512 2.642 0 50 GFAA CC(C)[C@H]1CN(c2cc(N(C)C)ncn2)CCC(=O)N1Cc1ccc(F)cc1 71760204 VXPMHRLLPAWGQH-GOSISDBHSA-N 385.487 2.945 0 50 GFAA O=C(c1ccc(CSc2ncccn2)o1)N1CCC(N2CCCC2=O)CC1 71779930 UIXIKAGFIPAYIK-UHFFFAOYSA-N 386.477 2.589 0 50 GFAA CC(=O)OC[C@@]12CC[C@@H](C)[C@](C)(CCC3=CC(=O)OC3)[C@H]1C[C@H](O)C=C2CO 71789553 XXSSNTKMBVTREV-DDHROXKOSA-N 392.492 2.535 0 50 GFAA biogenic,in-vitro CCn1c(C)ccc(C(=O)N2CCC[C@@H](N3CCc4ccccc4C3)C2)c1=O 72144537 JGIDMCAVZJXKPC-HXUWFJFHSA-N 379.504 2.840 0 50 GFAA CCNC(=O)N1CCc2cc(S(=O)(=O)N[C@H](C)c3ccccc3)ccc2C1 77298348 XOSFXNXJDOWLAA-OAHLLOKOSA-N 387.505 2.814 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)NCc1nc(C)cc(C(F)(F)F)n1)CC(=O)N2 91677804 KVCXVWDWVGCOBN-GFCCVEGCSA-N 394.353 2.555 0 50 GFAA Cn1c(=O)c(CN2CC[C@]3(CCCN(CC4CC4)C3=O)C2)cc2ccccc21 91808617 KWBDPAZKVOMFJW-HSZRJFAPSA-N 379.504 2.763 0 50 GFAA CSc1nc(N)cc(N2CCC(c3nccn3Cc3ccccn3)CC2)n1 95503116 UWCRWTJOOYDBBO-UHFFFAOYSA-N 381.509 2.805 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)c2cc(=O)cc(C)o2)C1 95519135 WPBPIOZWABFALF-SFHVURJKSA-N 398.503 2.984 0 50 GFAA COc1ccc(CN2CCC(F)(F)CC2)c(OC[C@H](O)CN2CCCC2)c1 95523983 ZGYULKKPIDTRJB-QGZVFWFLSA-N 384.467 2.762 0 50 GFAA CC[C@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)O)cc3OC)nc2N1C(C)C 95628817 QNLSHJVWZNHSED-AWEZNQCLSA-N 399.451 2.897 0 50 GFAA in-vitro CCn1c(CN(C)C)nnc1C1CCN(c2nc(-c3ccccc3)no2)CC1 96160430 NWXXYOOJQXAOAY-UHFFFAOYSA-N 381.484 2.794 0 50 GFAA COC(=O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC 97756777 UZWANLHAUYTFHZ-SFHVURJKSA-N 383.400 2.630 0 50 GFAA Nc1ncnc2c1C(=O)N(c1ccc([C@H]3CC[C@@H](CC(=O)O)CC3)cc1)CCO2 116139756 GEVVQZHMFVFGLN-HDJSIYSDSA-N 396.447 2.847 0 50 GFAA in-vitro O=C(Nc1ccc(Br)cn1)N1CCN(Cc2ccccn2)CC1 121909363 KSAOWVHPKGRGJH-UHFFFAOYSA-N 376.258 2.589 0 50 GFAA CCCCC1CCC(NC(=O)N2CCN(c3ccc4nncn4n3)CC2)CC1 152498340 XLFQYKMKNKXLAV-UHFFFAOYSA-N 385.516 2.705 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@](C)(CO)C1CCCCC1 157852985 SRVHMHVSKBMGID-JOCHJYFZSA-N 398.507 2.520 0 50 GFAA CCNS(=O)(=O)c1cccc(C(=O)N[C@H](CC)c2ccc(OC)cc2)c1 170615787 UGPYIQRODKIYJU-GOSISDBHSA-N 376.478 2.875 0 50 GFAA Cc1cc(F)cc(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)c1 175306134 HXSUWRZOFPMKMA-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA C[C@@]1(O)CCN(C(=O)c2cc(Br)c(O)c(Br)c2)C1 179528466 RWUKVKCDKWIODR-GFCCVEGCSA-N 379.048 2.514 0 50 GFAA COc1cc(N2CCN(C(=O)Nc3ccc(CC(F)(F)F)cc3)CC2)ncn1 184404257 ZURYGRRWXRIWEC-UHFFFAOYSA-N 395.385 2.944 0 50 GFAA O=C(NCCOc1ccccc1-c1ccccc1)N1CCO[C@@]2(CCOC2)C1 187232751 ZYWGHQKNMXOVCZ-QFIPXVFZSA-N 382.460 2.933 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)NCCc1csc(-c2ncccn2)n1 223410814 XVUANBYGRZRULA-UHFFFAOYSA-N 382.445 2.620 0 50 GFAA CCn1cc([C@@H]2C[S@](=O)CCN2C(=O)Cc2ccc(C(F)(F)F)cc2)cn1 225417513 ADPMENDGTIKJMW-RKOGDMNLSA-N 399.438 2.797 0 50 GFAA Cc1cc(N[C@H](c2ccc(Br)cc2)[C@@H](C)CO)n2ncnc2n1 225607042 XUAJAYXQAGTHLR-BONVTDFDSA-N 376.258 2.977 0 50 GFAA COc1ccc(-n2ccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)O)n2)cc1 237446623 VDRORITYBKLWLC-IBGZPJMESA-N 377.400 2.533 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@H](O)c3ccc(OC)cc3)c2C)cc1 252480232 BYTLXUVAPKPQOA-FQEVSTJZSA-N 394.475 2.669 0 50 GFAA C[C@@H]1NCCN(C(=O)c2cccc(NC(=O)c3ccc4[nH]cnc4c3)c2)[C@H]1C 262773526 KJXUKAXYQYOHQV-KBPBESRZSA-N 377.448 2.638 0 50 GFAA Cc1noc(C[C@@H](NC(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc2)n1 277052449 CLKUECVIJGXRMF-CYBMUJFWSA-N 379.342 2.694 0 50 GFAA CCCc1ccc(C(=O)NCc2cc3n(n2)CCN(C(=O)C2CCC2)C3)cc1 299784334 HQWIHORETIAIKR-UHFFFAOYSA-N 380.492 2.908 0 50 GFAA CCc1ccc(-n2cnnc2)cc1NC(=O)N[C@@H](CC(C)C)c1ncnn1C 426506830 PGHDNTWEGCGFAY-KRWDZBQOSA-N 382.472 2.867 0 50 GFAA CCOc1cc(CN(C)C(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC 426538376 NXTMHRXYYVKXGK-MRXNPFEDSA-N 391.512 2.882 0 50 GFAA O=C(c1sccc1F)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 498534450 OIDWUDNTFLONFF-CQSZACIVSA-N 394.493 2.884 0 50 GFAA COC[C@@H]1CCCN1S(=O)(=O)N(Cc1ccccc1)Cc1scnc1C 952980014 BUCWQNKYYQNRGL-KRWDZBQOSA-N 395.550 2.809 0 50 GFAA CCn1c([C@@H]2Cc3cc(F)ccc3NC2=O)nnc1N1C[C@H](OC)CC[C@@H]1C 1356270296 LNKKUAMUFIOSCX-MAZHCROVSA-N 387.459 2.719 0 50 GFAA CCN1CCNC(=O)[C@H]1CC(=O)N(C)Cc1sc2ccccc2c1Cl 1506399057 XWXHUNWJVZAKDF-CYBMUJFWSA-N 379.913 2.724 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CCCN(C(=O)c2cccs2)CC1 1772708147 CNSFONMTYWDGFX-UHFFFAOYSA-N 386.473 2.784 0 50 GFAA Cc1cn2cccc(C(=O)N3CCN4C(=O)OC[C@@]4(Cc4ccccc4)C3)c2n1 1857678551 MWFIHCSQZYKDOB-JOCHJYFZSA-N 390.443 2.532 0 50 GFAA O=C(c1ccncc1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857696930 RFANSWKCXHOHOS-QFIPXVFZSA-N 387.443 2.759 0 50 GFAA CN1CC[C@]2(C(=O)NC3CCCC3)CCCN(Cc3nc4ccccc4[nH]3)[C@H]2C1 1857705795 WGAJKHLJQMIERW-NZQKXSOJSA-N 395.551 2.908 0 50 GFAA COc1ccccc1OCc1nc([C@H]2C[C@@H](N)[C@H](O)C2)n(-c2ccc(F)cc2)n1 1857736660 VOTGKSZGTCVVAI-IAOVAPTHSA-N 398.438 2.560 0 50 GFAA O=C(O)C[C@@H](NC(=O)CCn1cnc2ccccc2c1=O)c1ccc(Cl)cc1 1875259644 IWNIDNJNPJIBKK-QGZVFWFLSA-N 399.834 2.772 0 50 GFAA O=C(CCCc1ccc2c(c1)CC(=O)N2)NC[C@]1(O)CCc2cc(F)ccc21 1875266569 GICPKHYGMMKIQR-JOCHJYFZSA-N 382.435 2.593 0 50 GFAA CCN(CC)CCOc1ccc(CNC(=O)c2c(N)nn3ccccc23)cc1 1875349613 DVYIKTMWFQSMGY-UHFFFAOYSA-N 381.480 2.567 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)C2(C)Cc3ccccc3C2)CC[C@@H]1C(F)(F)F 1875386255 LVYGPKPWQXJXED-JKSUJKDBSA-N 380.410 2.873 0 50 GFAA CCCOc1cccc(C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C)cc2O3)c1 1875394840 YPHYGPVFXGSUER-KRWDZBQOSA-N 385.464 2.700 0 50 GFAA COc1cccc2cc(C(=O)N[C@H](C)C(=O)Nc3nc(C(C)=O)cs3)oc12 2325854005 KMHAZJDHGJRQRU-SECBINFHSA-N 387.417 2.858 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2ccc(OC(F)(F)F)cc2)CC[C@H]1O 2356162060 VVGZDTWJZRMMIS-CZUORRHYSA-N 375.343 2.663 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@H]1c1ccc(OC(C)=O)cc1 851995 VJKDFJMVWMQYBX-KRWDZBQOSA-N 388.445 2.825 0 50 GFAA Cc1cccnc1C[C@@H](C)NC(=O)c1cc2c(s1)CCOC21CCNCC1 2356142805 IQTSSBKWIOQJOY-OAHLLOKOSA-N 385.533 2.964 0 50 GFAA CN(Cc1cnc2c(-c3ccccc3)cnn2c1)[C@@H]1C[C@@H]2CNC(=O)C[C@@H]2C1 2356145500 DMYRSGMBSOSDIF-OTWHNJEPSA-N 375.476 2.743 0 50 GFAA COc1ccc(Cl)cc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1 2846264 SPNAWFPFBWDZEG-LBPRGKRZSA-N 382.869 2.963 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)cc1Cl 2878174 VKJFWJGBXGJVJE-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA COc1ccc(CN2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc1C(=O)O 2356156786 QZGZOCBIQVKKLV-JOCHJYFZSA-N 396.491 2.729 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCc3ccnn3C)C2=O)cc1 2356163455 DSQRLEITOHSPBS-JOCHJYFZSA-N 380.492 2.849 0 50 GFAA Cc1cccc(N(CC(=O)N(C)Cc2csc(C(C)C)n2)S(C)(=O)=O)c1 55414316 FXCLFEJXSUEGBG-UHFFFAOYSA-N 395.550 3.000 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 21005588 INIVRCKFVCEOOY-MRXNPFEDSA-N 378.425 2.535 0 50 GFAA Cc1c[nH]c(=O)n1-c1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCCC[C@H]2C)cc1 251021968 PHJCFPZLWMIBMP-SIIHOXLZSA-N 385.464 2.714 0 50 GFAA COc1coc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1=O 282243891 ICVZCKBWYIGJNB-NSHDSACASA-N 383.231 2.964 0 50 GFAA O=C(c1ccc([C@H]2CCCN2C(=O)c2cscn2)s1)N1CCOCC1 20233235 CTCVBUDRTFDFTH-CYBMUJFWSA-N 377.491 2.654 0 50 GFAA O=C(c1cc2n(n1)CCCN(Cc1ccc(-c3cc[nH]n3)o1)C2)N1CCCC1 67756557 BFXJDXTUECIZKO-UHFFFAOYSA-N 380.452 2.508 0 50 GFAA COC(=O)c1c(NC(=O)COc2ccccc2C)sc(C(=O)N(C)C)c1C 1002367 WEWNKELGHZZARJ-UHFFFAOYSA-N 390.461 2.871 0 50 GFAA O=C1C[C@@H](NC(=O)c2nc(N3CCCC3)nc3c2CCCC3)c2ccccc2N1 12314671 WLUSJHDWDWHQKS-GOSISDBHSA-N 391.475 2.769 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)O)c(C(=O)NCC(C)C)n1 5962259 AYLKFRZVXMXFIJ-HUUCEWRRSA-N 390.484 2.675 0 50 GFAA O=C(O)[C@H]1C[C@@H](C(=O)NCc2ccncc2)CN(Cc2cc3ccccc3o2)C1 71765167 HAXNVDUCOFXNLV-MSOLQXFVSA-N 393.443 2.667 0 50 GFAA Nc1ccc(C(=O)N2C[C@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 72134673 YVUIEURUMUPBKE-MISYRCLQSA-N 384.430 2.644 0 50 GFAA Cn1nc(NC(=O)c2ccc3c(c2)CCO3)c2c(N3CCOC3=O)cccc21 77357473 MRHUIHHPXPPPKJ-UHFFFAOYSA-N 378.388 2.717 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNCc3ccccc3C)C2=O)c1OC 71315502 MZSWNOKUIGIIFV-HSZRJFAPSA-N 398.503 2.656 0 50 GFAA COc1nc2c(cc1CNC(=O)COc1ccccc1)C(=O)N(C1CCCC1)C2 71662783 HSMSMDREYNDSMZ-UHFFFAOYSA-N 395.459 2.684 0 50 GFAA CN1C(=O)CC[C@@H]1C(=O)N1CC(C)(C)[C@@H]1C1CCN(Cc2ccccc2)CC1 452451652 MGHZHUUPJKOLPG-CTNGQTDRSA-N 383.536 2.756 0 50 GFAA COc1ccc(CNS(C)(=O)=O)cc1NC(=O)N1CC2(CCC2)C[C@@H]1C 455825503 LRQASJSVSULBAI-ZDUSSCGKSA-N 381.498 2.541 0 50 GFAA COc1ccc(OC2CCN(C(=O)c3csc(CN(C)C)n3)CC2)cc1 82156434 QFGYHOHNFCHRTP-UHFFFAOYSA-N 375.494 2.897 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 246257393 GYGHBWABXYSNGH-IACUBPJLSA-N 385.386 2.880 0 50 GFAA CN1C[C@@]2(CCN(C(=O)CC(c3ccccc3)c3ccccc3)C2)OCC1=O 426549861 CTVOABLLSAKHFE-HSZRJFAPSA-N 378.472 2.668 0 50 GFAA CCOc1ccccc1C(=O)NCCNC(=O)c1nc(C2CCCCC2)no1 20190006 VNCNKDOOUDAWAQ-UHFFFAOYSA-N 386.452 2.676 0 50 GFAA O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@@H](Oc2cccnc2)C1 179748620 FRGMXIQVKULNSO-HXUWFJFHSA-N 381.480 2.556 0 50 GFAA COc1ccc(CCNC(=O)N2CCC[C@H](CN3CCCC3)C2)cc1OC 426649682 NTFGZOBRQRXMBS-GOSISDBHSA-N 375.513 2.764 0 50 GFAA O=C(c1nc(O)c2ccccc2n1)N1CCC(c2nccn2CC2CC2)CC1 95531613 QMAYLDDJCNPRJL-UHFFFAOYSA-N 377.448 2.962 0 50 GFAA O=C(Cc1ccncc1)N1CCC(Oc2ccc(C(=O)N3CCCC3)cc2)CC1 95503404 KDZZOIZPTWRLBI-UHFFFAOYSA-N 393.487 2.930 0 50 GFAA COCCN1C[C@@H](C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CC1=O 181181190 GFANMXYRMWHRLR-SFHVURJKSA-N 380.444 2.722 0 50 GFAA O=C(CN1C[C@@H](Cc2ccccc2)CC1=O)N1CC(OCc2ccccc2)C1 95522443 PUTBHYUUBSAOPC-FQEVSTJZSA-N 378.472 2.505 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)cc1 91550983 ZIYSLMKWTAJPJJ-UHFFFAOYSA-N 380.492 2.806 0 50 GFAA COc1cccc(CC(=O)N2CCc3ccc(NC(=O)C4CC(=O)C4)cc32)c1 183526011 YJQLVWUSBLKOOX-UHFFFAOYSA-N 378.428 2.745 0 50 GFAA CCn1nc(C)c([C@H](C)NC(=O)CCCn2nnc(-c3ccc(F)cc3)n2)c1C 823593262 FKRONDVMEQBFLS-ZDUSSCGKSA-N 399.474 2.970 0 50 GFAA NC(=O)[C@@H]1CCCN(CCCNC(=O)c2ccc(-c3ccccc3F)cc2)C1 670467428 BRGPWLOWMHTLMI-GOSISDBHSA-N 383.467 2.810 0 50 GFAA O=C(NC[C@H](c1ccccc1)C(F)F)N[C@@H](CCc1ccncc1)C(=O)O 1875291003 LEDVTDYDPXPINH-CVEARBPZSA-N 377.391 2.816 0 50 GFAA O=C(NCCc1ccccc1Cl)N1CC[C@@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401774 RJGGXYWMHMKFAA-ZFWWWQNUSA-N 375.860 2.889 0 50 GFAA O=C(Cc1cccs1)NC[C@@H]1CCCN(C(=O)CSc2ccccn2)C1 952990087 FYGNVGKPVBQHRW-HNNXBMFYSA-N 389.546 2.833 0 50 GFAA CCc1nnsc1C(=O)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565530301 DMNJZSDRGCUEMG-PBHICJAKSA-N 382.533 2.804 0 50 GFAA O=C(CN1CCN(c2ccc(C(F)(F)F)nn2)CC1)Nc1ccc(Cl)cc1 301976446 WGMYKDFCIFTGOF-UHFFFAOYSA-N 399.804 2.910 0 50 GFAA CCc1cc(NC(=O)N2CC[C@H](Oc3cccnc3N3CCCC3)C2)n(C)n1 275594122 SQSQEWGUFDELNS-INIZCTEOSA-N 384.484 2.663 0 50 GFAA CN(c1ccccc1)c1ccc(C(=O)N[C@H]2CCN(CC(F)(F)F)C2=O)cn1 171816725 FTVVSOWCVPSFOL-HNNXBMFYSA-N 392.381 2.743 0 50 GFAA Cc1cc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)cc(S(N)(=O)=O)c1C 190278481 QNBYEBRINUUEHL-UHFFFAOYSA-N 399.476 2.513 0 50 GFAA O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2c(=O)[nH]1 192215280 KYJTZFIOFMZUTI-IBGZPJMESA-N 391.471 2.549 0 50 GFAA CCC(CC)(CO)CN(C)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506404456 DOWOKARYIZTJNR-UHFFFAOYSA-N 381.853 2.597 0 50 GFAA Cc1nc(CN2C[C@H]3CN(C(=O)C4CCC4)C[C@@]3(CCc3ccccc3)C2)n[nH]1 1772708424 BGVIIWLSJLGYEM-NZQKXSOJSA-N 393.535 2.806 0 50 GFAA O=C(c1cc[nH]c1)N1C[C@H]2CN(Cc3cnc[nH]3)C[C@]2(CCc2ccccc2)C1 1772814717 PKCHJJKTNCSCCR-NFBKMPQASA-N 389.503 2.945 0 50 GFAA COc1ccccc1-n1nnc(C(=O)Nc2ccc(-n3nncc3C)cc2)c1C 11690153 NDGFLIOGDSKXST-UHFFFAOYSA-N 389.419 2.726 0 50 GFAA CC[C@H](C)C(=O)NCc1nnc2n1CCN(Cc1cc(C)c(OC)cc1C)CC2 12041778 SBUBNZVVEQCRHW-HNNXBMFYSA-N 399.539 2.624 0 50 GFAA COc1cc(CN2CC[C@@H](N3CCCCCC3)[C@H](O)C2)cc(OC)c1OC 12050286 NYSMRDMLEXXHHQ-QZTJIDSGSA-N 378.513 2.524 0 50 GFAA Cc1c(CN2CCC[C@H](CCC(=O)NC3CC3)C2)c(=O)n(-c2ccccc2)n1C 12092987 PLPQVVRRDAWKLN-GOSISDBHSA-N 396.535 2.755 0 50 GFAA CC1CCN(C(=O)[C@H]2CC(=O)c3sc(NC(=O)c4ccco4)nc3C2)CC1 12100186 LIZJULQNPXCXKX-GFCCVEGCSA-N 387.461 2.992 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)Cn2nc(C)cc2C)C1 12472594 AAVRSFUTESHWLJ-FQEVSTJZSA-N 398.551 2.922 0 50 GFAA Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@H](N1CCSCC1)C2 14542999 UHEMIJUUPCXFFO-SFHVURJKSA-N 396.560 2.525 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(C(=O)CCCc3ccccc3)C2)CC1 15074289 FZZPIPGKWWAIAF-NRFANRHFSA-N 385.552 2.802 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H]3CCCO3)n1)CCN(C(=O)c1ccc[nH]1)C2 19223073 RFZJZMQEKQYIFW-MRXNPFEDSA-N 379.420 2.818 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2ccccn2)C[C@H]1Nc1ncnc2sccc12 1857690891 TXHIDGJXUDNVOV-IAOVAPTHSA-N 397.504 2.998 0 50 GFAA Cc1ccc2ncccc2c1-c1nccn1[C@H]1C[C@H]2CO[C@@H](CCO)CN2C1 1857730126 KAHYLKFPHBPBMM-BZSNNMDCSA-N 378.476 2.803 0 50 GFAA CCn1cc(C(=O)N2C[C@H](c3ccc(Br)cc3)[C@@H](C(=O)O)C2)cn1 425253889 KKOFWMKFQBGSOR-CABCVRRESA-N 392.253 2.606 0 50 GFAA CNC[C@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 237316755 VNQOAKFADKBAGN-SNVBAGLBSA-N 381.723 2.723 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3nnn(C4CCNCC4)c3C)CC2)cc1C 237942451 FEKPIKXVYNUODP-UHFFFAOYSA-N 397.523 2.811 0 50 GFAA O=C1NCN(c2ccccc2)C12CCN(C(=S)NCc1cccs1)CC2 1428047 BOPYKYXLJWLBFC-UHFFFAOYSA-N 386.546 2.551 0 50 GFAA O=C(O)C1CCC(CC(=O)N2CCN(C(=O)CCc3ccccc3)CC2)CC1 2325755017 AFPXXTWBDXEESW-UHFFFAOYSA-N 386.492 2.571 0 50 GFAA O=C(NCc1cnn(-c2ccc(Br)cc2)c1)[C@H]1CCCNCC1 2325795621 PVHKNQTUDZOPDP-AWEZNQCLSA-N 377.286 2.641 0 50 GFAA CC(=O)N[C@@H]1CN(C(=O)c2ccc3c(c2)nc(C)n3C)C[C@H]1c1ccccc1F 2325873825 VCFHFZZBIQGIHC-FXAWDEMLSA-N 394.450 2.765 0 50 GFAA O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(I)cc1)C2=O 778004 UGFIHUWBELUFCP-UHFFFAOYSA-N 393.136 2.790 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O 1130924 YKTJPZCBKHSSBD-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)N1CCOCC1 1144442 CBYSBXCXQDSAMT-UHFFFAOYSA-N 380.473 2.885 0 50 GFAA COc1ccc(C)cc1N1C[C@@H](C(=O)N2CCN(c3ccccc3)CC2)CC1=O 9266237 BIXGNDAQYBHUIH-SFHVURJKSA-N 393.487 2.705 0 50 GFAA CN(C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)c1ccccc1 10287187 UVOZICXFRFUMMR-UHFFFAOYSA-N 394.880 2.638 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NC(=O)CN2CCOC2=O)cc1 11818515 WLPKYFLHBFUTEH-QGZVFWFLSA-N 382.464 2.763 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N[C@H](C)CCn3cccn3)no2)c1 12440622 LLFZJWNSHAESCT-CQSZACIVSA-N 382.420 2.861 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccccc2F)C1)C(=O)CCc1cnccn1 12575184 YCNXCUCEARLRFD-GOSISDBHSA-N 384.499 2.961 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1)NC1CCC1 12595437 JNPZVLNEJHAFSV-OAQYLSRUSA-N 377.488 2.713 0 50 GFAA COCCN(Cc1ccc(OC)c(OC[C@@H](O)CN(C)C(C)C)c1)C(C)C 15072976 PYQGHCJZOARWHN-IBGZPJMESA-N 382.545 2.632 0 50 GFAA COc1cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc(OC)c1OC 20051275 CQXAHFXGFCXZLQ-UHFFFAOYSA-N 386.448 2.797 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)cc3F)C[C@@H]2CCO)CC1 22919404 GAPQAKLBBWOITG-FQEVSTJZSA-N 381.511 2.706 0 50 GFAA O=c1[nH]c(-c2ccc(CN3CCC[C@H]3Cn3ccnc3)cc2)nc2c1CCC2 23379817 KUEMVMACLJPBKB-SFHVURJKSA-N 375.476 2.787 0 50 GFAA NC(=O)C1CCN(C(=O)c2cc(-c3ccccn3)nc3cc(F)ccc23)CC1 32091591 NAWUFMXQICGSFT-UHFFFAOYSA-N 378.407 2.773 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@@H](C(=O)NCCc4cccs4)C3)nn12 32093375 DKSHKHJWLJXVDO-OAHLLOKOSA-N 398.536 2.885 0 50 GFAA Cc1ccc(NC(=O)CC(=O)NCCc2nc(C)c3c(n2)CCCC3)c(C)c1 55225040 CCCWFYCHWKIAGH-UHFFFAOYSA-N 380.492 2.968 0 50 GFAA O=C1CCCCN1CCC(=O)N1CC[C@H](c2ccnc(-c3ccncc3)c2)C1 67713767 QMWQVBOSPSULBH-IBGZPJMESA-N 378.476 2.862 0 50 GFAA CCn1nccc1NC(=O)c1cccc(CN2CCc3nc(N)sc3C2)c1 67854891 VVDUZVGLIJVADX-UHFFFAOYSA-N 382.493 2.752 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CNCc3cccc(C)c3)C2=O)c1OC 67934701 MUOVDFMPBXEWGM-HSZRJFAPSA-N 398.503 2.656 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(c3ncnc4[nH]cnc34)C2)cc1OC 72152284 HJWIOKSVLVNHFS-INIZCTEOSA-N 396.495 2.513 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)[C@H]1CCCO1 77378672 UDYOMJXIWKRADB-HFSMHLIXSA-N 392.455 2.857 0 50 GFAA CCc1nnc(CN(C)C(=O)[C@@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)o1 91563209 KBQDEQIWSKVVFQ-CQSZACIVSA-N 390.871 2.683 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(c3ncccn3)C2)c(OC)c1 95497940 HRIGXSCRSZBTCN-MRXNPFEDSA-N 384.480 2.807 0 50 GFAA COC(=O)C(NC(=O)OCc1ccccc1)=C1CN(C(=O)OC(C)(C)C)C1 96028345 GTVRHHXWQJPRNC-UHFFFAOYSA-N 376.409 2.591 0 50 GFAA O=C(O)[C@H]1c2nc[nH]c2CCN1C(=O)c1ccc(CN2CCCCCC2)cc1 96141838 GAJQHNKLJGETRB-LJQANCHMSA-N 382.464 2.610 0 50 GFAA CCOC(=O)C1CCN([C@@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 96301124 BBUYYEQLPZLOEY-OAHLLOKOSA-N 399.274 2.900 0 50 GFAA O=C1N[C@@H](CC(=O)N2CCN(C/C=C/c3ccccc3)CC2)c2ccccc21 97179443 PLHWTZZBHSVMHJ-JLXBBBJOSA-N 375.472 2.719 0 50 GFAA COc1ccc(CN2CCN(Cc3cc(C(C)C)[nH]n3)C[C@H]2CCO)cc1C 104312992 UMUZSCISSZNPAK-HXUWFJFHSA-N 386.540 2.919 0 50 GFAA O=C(Cc1c[nH]c2ncccc12)NCC1CCN(C[C@H](O)c2ccccc2)CC1 124821268 SPIPDFOPJGUFJA-NRFANRHFSA-N 392.503 2.667 0 50 GFAA Cc1cc(O)cc(=O)n1CC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 128103837 NTBLBVLGIKAXSB-CQSZACIVSA-N 387.505 2.604 0 50 GFAA COc1cc(CNC(=O)c2ccc3c(c2)N(C)[C@@H]2CCCN2C3=O)cc(OC)c1 169766046 LXIDZPQMTZJRIF-FQEVSTJZSA-N 395.459 2.646 0 50 GFAA CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 170596162 RUCQOCCYDZRMGC-PXNSSMCTSA-N 399.516 2.560 0 50 GFAA CCCc1cc(C(=O)N2CCN(Cc3coc(-c4ccccc4)n3)CC2)[nH]n1 170605902 VGOFNCMULWOAAF-UHFFFAOYSA-N 379.464 2.975 0 50 GFAA COc1ccc(C(=O)N2CCC(NCc3cnn4ccccc34)CC2)cc1OC 172419202 NSATYQRPWHHKHF-UHFFFAOYSA-N 394.475 2.746 0 50 GFAA C[C@H]1CCC[C@H](C)N(C(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)C1 176614642 IRUQYTGFTPWFHL-STQMWFEESA-N 381.436 2.739 0 50 GFAA Cc1cc2c(N3CCN(C(=O)NC[C@@H]4CCC(C)(C)O4)CC3)ncnc2s1 186704085 DQJFXLHNYPZWAA-AWEZNQCLSA-N 389.525 2.789 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@H]2[C@H](CCC(=O)N2CCc2cccs2)C1 219512361 XQNVRLRRWSTELJ-MJGOQNOKSA-N 383.517 2.768 0 50 GFAA CC(C)c1ccc(N2C[C@@H](C(=O)N3CCC(c4ncn[nH]4)CC3)CC2=O)cc1 221165969 UBGDETKIMNWFTM-KRWDZBQOSA-N 381.480 2.687 0 50 GFAA CC(=O)N[C@H](CC(=O)NCCCN1CCCO[C@H](C)C1)c1ccc(Cl)cc1 225462161 DZCRISVAEFNDDJ-DNVCBOLYSA-N 395.931 2.524 0 50 GFAA Cc1ccc(C)c(OC2CCN(C(=O)c3nnn(C4CCNCC4)c3C)CC2)c1 237854491 HKRXBARGBOLANM-UHFFFAOYSA-N 397.523 2.811 0 50 GFAA COc1cccc([C@H]2CN(Cc3nc(C(C)C)no3)C[C@@H]2C(=O)O)c1OC 248188767 JCFDDRQQCJKVJW-KGLIPLIRSA-N 375.425 2.510 0 50 GFAA COc1cc(CN(C)CN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)ccc1OC(F)F 252444218 TZDAMZVYKRTHEV-ZIAGYGMSSA-N 380.391 2.637 0 50 GFAA CCN(CC)CCNC[C@@H](O)CN1CCn2c3c(c4cc(C)ccc42)CCC[C@H]31 252633964 WIWRJIZZYKIADD-AUSIDOKSSA-N 398.595 2.935 0 50 GFAA c1cc(-c2noc(-c3cc4n(n3)C[C@@H](c3ccc5c(c3)OCO5)OC4)n2)ccn1 263618585 UMQIHNCJJNMBLI-SFHVURJKSA-N 389.371 2.995 0 50 GFAA O=C(NCC1(c2ccc3c(c2)OCO3)CCCCC1)[C@H]1CCc2[nH]nnc2C1 283190681 YQPZENNKRCLJGB-AWEZNQCLSA-N 382.464 2.657 0 50 GFAA O=C(Cn1c(=O)cnc2ccccc21)N1CCO[C@@H](c2ccc(Cl)cc2)C1 294115685 KDWAYNQFSMUBBF-GOSISDBHSA-N 383.835 2.650 0 50 GFAA O=C(CN1CCCCC1)NC[C@H]1Cc2cc(-c3cnccn3)cc(Cl)c2O1 299759918 PBBUYKMMTALJHI-MRXNPFEDSA-N 386.883 2.703 0 50 GFAA Cc1cccc(CN2CCN(c3ncnc4ccc(S(C)(=O)=O)cc34)CC2)c1 302755596 IMGIEUKYNPFOCO-UHFFFAOYSA-N 396.516 2.664 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@H]1c1nc(COCC(F)(F)F)no1 365804050 YYFPCASFFUOKGB-LBPRGKRZSA-N 391.371 2.674 0 50 GFAA COc1cc(NC(=O)N2CCCC[C@@H]2c2cc[nH]n2)cc(S(C)(=O)=O)c1 376776575 HVDQNVGZEZIZIG-MRXNPFEDSA-N 378.454 2.581 0 50 GFAA Cn1nc(C(=O)N2CCCC[C@H]2Cc2cccc(Br)c2)ccc1=O 421718733 PGVJCJIOMDNQML-HNNXBMFYSA-N 390.281 2.780 0 50 GFAA O=C(NCC1(N2CCCC2)CCCC1)c1cccc(-c2cnc(O)nc2O)c1 426374171 KFZQPJSBRVSTGR-UHFFFAOYSA-N 382.464 2.693 0 50 GFAA O=C(NCCc1nc(Cc2ccccc2)no1)N1CCC[C@H](Cn2ccnc2)C1 534669359 YRSVLJZHSHHFFY-GOSISDBHSA-N 394.479 2.521 0 50 GFAA CCCOc1ccccc1CCNC(=O)N1CCC[C@]2(CN(C)C(=O)O2)C1 584899019 RXVUTLQWNDUXSU-FQEVSTJZSA-N 375.469 2.644 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCc3nc[nH]c3[C@@H]2c2ccccn2)o1 825647685 HCSJTGKCYCCTLN-SFHVURJKSA-N 393.476 2.825 0 50 GFAA Cc1cccc2nc(COCC(=O)NCc3nncn3C3CCCCC3)[nH]c12 828032031 IZZICPBOQIFWGE-UHFFFAOYSA-N 382.468 2.801 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N(C)Cc3nncn3C(C)C)c(C)s2)n[nH]1 1506399075 JWAFLYJFSMXXJP-UHFFFAOYSA-N 394.526 2.748 0 50 GFAA CO[C@H]1CN(C2CCN(C(=O)c3ccccc3)CC2)C[C@H]1Cc1cc(C)no1 1529180559 KFJLTBSFZVDRDT-NQIIRXRSSA-N 383.492 2.777 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1ccc(CO)cc1)c1ccc2ncccc2c1 1565516470 SFPFUXLWELESTD-SFTDATJTSA-N 378.428 2.693 0 50 GFAA Cc1cc(C)n(CCC(=O)N[C@@H]2COC[C@H]2Cc2ccnc3ccccc23)n1 1616074462 YPPHBEIZVQUXEJ-WIYYLYMNSA-N 378.476 2.812 0 50 GFAA CC[C@H](C(=O)N[C@H]1CC[C@H](NC(=O)[C@@H](CC(C)C)OC)CC1)N(CC)CC 1775986881 NIYLAKDBPFDGFB-NCXUSEDFSA-N 383.577 2.712 0 50 GFAA CCCc1nc(C(=O)N2CCC([C@H]3CCCN3C(=O)c3cn(C)cn3)CC2)co1 1775996699 FBYINNWBGINCHQ-GOSISDBHSA-N 399.495 2.518 0 50 GFAA COc1cccc(CC(=O)N=c2cc(-c3cc(OC)c(OC)c(OC)c3)[nH][nH]2)c1 1875249992 PYLKIGKNYBNYBS-UHFFFAOYSA-N 397.431 2.714 0 50 GFAA O=C([C@@H]1CCN(C[C@H]2CCCc3ccccc32)C1)N1CCc2c(O)ncnc2C1 1875261819 KGRBSTPDFGOMMD-QZTJIDSGSA-N 392.503 2.509 0 50 GFAA CCn1nc(C(=O)N2CCOc3ccc(OC)cc3C2)c2c1[C@H](C)O[C@H](C)C2 1875404143 WSONLCWMVMIHMZ-KGLIPLIRSA-N 385.464 2.969 0 50 GFAA COCCN(C)C[C@H]1CCCN1c1ncnc2c1cnn2-c1ccccc1F 2325825256 JVUIVXUEQIUNMY-OAHLLOKOSA-N 384.459 2.502 0 50 GFAA O=C1C[C@@H](C(=O)N2[C@H]3CCC[C@@H]2C[C@H](O)C3)CN1c1nc2ccccc2s1 2356147878 VHPUWZKOZNPZSG-KBXIAJHMSA-N 385.489 2.554 0 50 GFAA O=C(c1cncc(F)c1)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 2356161681 FLXVOTFSONXVQT-WIYYLYMNSA-N 386.423 2.521 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2cc(C(C)C)on2)CC[C@H]1NC(=O)NCC 2356163214 SJAAUCSEMMEWKQ-YXJHDRRASA-N 394.516 2.697 0 50 GFAA O=S(=O)(C1CC1)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2356163777 QLAUBHJDFWMROL-OAQYLSRUSA-N 386.517 2.917 0 50 GFAA CN(C)Cc1ccc(-c2ccc(C(=O)N(C)Cc3cc[nH]n3)cc2)c(CO)c1 2356167929 JDSOGHKSMZQSMX-UHFFFAOYSA-N 378.476 2.903 0 50 GFAA CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc(OC)c(O)c1 628560 CBKXUHBWDZNIAE-UHFFFAOYSA-N 375.421 2.762 0 50 GFAA Cc1cc(C(F)(F)F)nn1CC(=O)Nc1sc2c(c1C(N)=O)CCCC2 997682 PHLXSNIEQIKENK-UHFFFAOYSA-N 386.399 2.888 0 50 GFAA Cc1ccc(S(=O)(=O)NCC(=O)OCC(=O)c2cccc3ccccc23)cc1 1839180 XHYPZVBWCCHONJ-UHFFFAOYSA-N 397.452 2.853 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)NCc3cccc(Cl)c3)n2)cc1 3055701 AQZPDYXMHUWJSS-UHFFFAOYSA-N 383.835 2.889 0 50 GFAA COc1cc(OC)c2c(C)c(CC(=O)NCc3ccccc3OC)c(=O)oc2c1 4540675 FHCGALLPGGCHIL-UHFFFAOYSA-N 397.427 2.986 0 50 GFAA biogenic CCCCOc1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)OCCOC)cc1 4917839 BATCAFGCSPYUJR-KRWDZBQOSA-N 378.494 2.848 0 50 GFAA CC(C)Cn1c(CN(C)Cc2ccco2)cnc1S(=O)(=O)C[C@H]1CCCO1 11662086 XHKLUHSRJXRVKB-GOSISDBHSA-N 395.525 2.717 0 50 GFAA COc1c(C)cc(C(=O)[C@H]2CCCN(C(=O)Cn3nc(C)nc3C)C2)cc1C 11760997 SFNHSGULGCQFKJ-KRWDZBQOSA-N 384.480 2.642 0 50 GFAA O=C(N[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1)c1coc2c1C(=O)CCC2 12373028 NPOXVPVLAHRKGR-CYBMUJFWSA-N 386.835 2.983 0 50 GFAA CC1=C(C(=O)N[C@H]2CCCc3c2cnn3-c2ccc(F)cc2F)OCCO1 12373709 JASKGCLCCSBLCZ-HNNXBMFYSA-N 375.375 2.922 0 50 GFAA COc1cc(OC)cc(C(=O)NC[C@@H]2CCCN(Cc3nccs3)C2)c1 12589658 NXMALNRMDLHVJN-AWEZNQCLSA-N 375.494 2.802 0 50 GFAA CCOC(=O)C1CCN(C(=O)c2coc(COc3ccccc3F)n2)CC1 12711919 BPISESPKHGHBLI-UHFFFAOYSA-N 376.384 2.808 0 50 GFAA CC[C@@H](C)N1CCC2(CC1)C(=O)N(CCOC)C(=O)N2CCc1ccccc1 14534355 HZRYDFZEDRKTIF-GOSISDBHSA-N 387.524 2.773 0 50 GFAA COCCn1cnc2sc3c(c2c1=O)CC[C@H](NC1Cc2ccccc2C1)C3 14952988 AAZINGXQMMYNGN-INIZCTEOSA-N 395.528 2.719 0 50 GFAA COc1ccc(-c2noc(CN3CCC(CCN4CCCC4=O)CC3)n2)cc1 14956532 CXMOLXIRPDVVGK-UHFFFAOYSA-N 384.480 2.970 0 50 GFAA O=C(c1ccc(NC2CCCCC2)nc1)N1CCCN(c2ncccn2)CC1 14957076 WSHIPZMUAJTUFR-UHFFFAOYSA-N 380.496 2.969 0 50 GFAA O=C(O)c1ccc(NCc2cccnc2)c(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 16246996 JNYJLYZTBDSDPA-IYBDPMFKSA-N 377.400 2.848 0 50 GFAA O=C(Nc1cccnc1)[C@@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2)C1 19860846 YMFHAXJYGBZSIT-OAHLLOKOSA-N 393.896 2.916 0 50 GFAA CN(CCO)Cc1c(C(=O)N2CCc3ccccc3C2)nc2ccc(Cl)cn12 20136547 MXEBYUNLDUHFBK-UHFFFAOYSA-N 398.894 2.610 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)NC(=O)N[C@H]1c1cc(C)ccc1C 20482059 PBDPJZQVQVIBGS-SFHVURJKSA-N 389.521 2.523 0 50 GFAA Cn1ccnc1SCCNC(=O)c1cc(COc2c(F)cccc2F)on1 20515382 YOQDIOVMMJNZQD-UHFFFAOYSA-N 394.403 2.787 0 50 GFAA O[C@@H](COc1ccc2c(c1)OCO2)CN1CCN(c2cccc(Cl)c2)CC1 22298796 NCCCZHSXDKVARM-QGZVFWFLSA-N 390.867 2.631 0 50 GFAA O=C(C1CCN(C2CCN(Cc3ccc4c(c3)CCO4)CC2)CC1)N1CCCC1 36385644 XFKNEUSXWSKLRK-UHFFFAOYSA-N 397.563 2.920 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3ccc(F)cc3)[C@H](CCO)C2)c1 39364789 QGXYRTJWBBYSEV-HXUWFJFHSA-N 388.483 2.912 0 50 GFAA Cc1nc(-c2ccc(CN3CCN(c4cccnc4)CC3)cc2)[nH]c(=O)c1C 48224049 ZFKXDYCPOIWRGZ-UHFFFAOYSA-N 375.476 2.771 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)Nc2nnc(C(F)(F)F)s2)CC1 59749667 OVZCZZCQUVEDHD-UHFFFAOYSA-N 379.408 2.669 0 50 GFAA CC(C)(C)c1ccc(C(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1 67620670 UVIPVPHCXXYXDB-UHFFFAOYSA-N 390.491 2.922 0 50 GFAA O=C(c1cnc(-c2cccnc2)nc1)N1CCO[C@H](Cc2cccc(F)c2)C1 71419510 QXAOIFDSSVIDIQ-LJQANCHMSA-N 378.407 2.761 0 50 GFAA Cc1ccc([C@H](NC(=O)C2CCN(S(=O)(=O)N(C)C)CC2)C(C)C)c(C)c1 72437626 VLEHGCKFCCXIRX-LJQANCHMSA-N 395.569 2.635 0 50 GFAA CN(Cc1ccc(Oc2ccccc2)cc1)C(=O)[C@@H]1CCCN(CC(N)=O)C1 77288013 TVMMBDVGFPDREJ-GOSISDBHSA-N 381.476 2.635 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3ccnc(N4CCCC4)n3)CC2)cc1 82230438 DYMMEAIQDLYUFN-UHFFFAOYSA-N 380.496 2.993 0 50 GFAA O=C(COc1ccccc1O)N[C@@H]1CCCc2nc(-c3cccnc3)ncc21 91381771 PBBCCFWQOMEVHH-MRXNPFEDSA-N 376.416 2.817 0 50 GFAA Cn1cccc1-c1cc(C(=O)N[C@@H](CCn2cncn2)c2ccccc2)[nH]n1 91678557 GEAXHCUACBEVQD-INIZCTEOSA-N 375.436 2.568 0 50 GFAA O=C(c1cccc(S(=O)(=O)NC2CCOCC2)c1)N1CCCCCCC1 95377256 OZEJAVZCNPVDKN-UHFFFAOYSA-N 380.510 2.550 0 50 GFAA CSc1nccc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95392102 OISMHWGCRIPMHB-CWFSZBLJSA-N 396.516 2.994 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)Nc1cccc(Cn2cncn2)c1 95501202 FGKVAVUZGNJPDV-UHFFFAOYSA-N 379.468 2.982 0 50 GFAA O=C(CCC1CCN(C(=O)c2ncc(F)cc2F)CC1)NCc1cccnc1 95507165 LLAGOSWZGWJFSC-UHFFFAOYSA-N 388.418 2.704 0 50 GFAA CCCNC(=O)c1cccc(S(=O)(=O)N(C)Cc2noc3c2CCCC3)c1 97514222 IZCMGUAGTVQSIL-UHFFFAOYSA-N 391.493 2.514 0 50 GFAA CC1(C)C(=O)Nc2ccc(S(=O)(=O)N3CC[C@@H](Nc4ccccc4)C3)cc21 119146913 LEPTUNGWTOIVSC-OAHLLOKOSA-N 385.489 2.791 0 50 GFAA NC(=O)c1ccc(C(=O)N2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cn1 122314083 OICAZPXPVWRWEN-JTQLQIEISA-N 384.383 2.676 0 50 GFAA CCOc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@H](N)C2)cc1OCC 132590123 NXBZXEHYSQJZEI-INIZCTEOSA-N 382.460 2.888 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4c(F)cccc4F)nnc3c2)n1 169776157 JLJYJYJBVSHPIT-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA COc1cccc(C2=NN(S(C)(=O)=O)[C@H](c3ccc(OC)cc3OC)C2)c1 170614150 HYJZUXTWPXBNIO-SFHVURJKSA-N 390.461 2.823 0 50 GFAA NS(=O)(=O)c1ccc(NCCOc2ccc3c(c2)CCC3)c2ncccc12 170633602 OAPFETWAUZWETC-UHFFFAOYSA-N 383.473 2.862 0 50 GFAA CCc1cnc(NC(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)s1 174231425 USCZHUVLSYGONJ-UHFFFAOYSA-N 391.472 2.633 0 50 GFAA Cc1nc(-c2ccc3c(c2)CCN3C(=O)CN(C)Cc2cnccn2)cs1 174640369 JMYPZJSQJLLMQD-UHFFFAOYSA-N 379.489 2.930 0 50 GFAA O=C(Cn1cc(C2CC2)nn1)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 184001436 GTWSSQWURHTOOT-MRXNPFEDSA-N 380.370 2.774 0 50 GFAA Cc1ccc(N2CCC(NS(=O)(=O)Cc3noc4ccccc34)CC2)nc1 185841074 RNDOTHXPCXIBAQ-UHFFFAOYSA-N 386.477 2.620 0 50 GFAA C[C@H]1CN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)CCN1CC(C)(C)O 188648257 GBVSRQLQESIOMA-LBPRGKRZSA-N 399.413 2.984 0 50 GFAA C[C@H]1CCS(=O)(=O)CCN1C(=O)c1cc(-c2ccncc2)nc2ccccc12 191792709 NYQJVYBGAIPQBB-HNNXBMFYSA-N 395.484 2.946 0 50 GFAA O=C(c1ccccc1)N1CCCN(C(=O)[C@H]2CCCN(CC(F)(F)F)C2)CC1 194124046 NOBQLPWYDHUJNY-KRWDZBQOSA-N 397.441 2.635 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@@H](C)[C@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237481774 ACVVRMGSLVHFKT-IFXJQAMLSA-N 385.464 2.804 0 50 GFAA O=C(NCc1ccc(F)cc1)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263617047 LVRLEGJIBCYCNZ-UHFFFAOYSA-N 392.434 2.699 0 50 GFAA CN(Cc1nccc(N)n1)[C@H]1CCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 275560979 FRWILZCBJBDCLP-LBPRGKRZSA-N 380.279 2.712 0 50 GFAA Cc1cccc(CC2(O)CCN(C(=O)N[C@@H](C)c3nnc4ccccn34)CC2)c1 279548537 DGSXHWBEYOOCNB-KRWDZBQOSA-N 393.491 2.878 0 50 GFAA O=S(=O)(N[C@@H]1CCCn2ncnc21)c1cc(Br)sc1Cl 328608805 BGRXETOIBIJPED-ZCFIWIBFSA-N 397.707 2.569 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@H]2CCc3nc(C(F)(F)F)cn3C2)cc1F 328618940 FGKALWBQKSCGCW-LLVKDONJSA-N 391.390 2.890 0 50 GFAA CCc1cc(C(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)c2c(C(C)C)noc2n1 328824775 SFHANYSPHTZOSK-AWEZNQCLSA-N 391.493 2.700 0 50 GFAA O=C(NCc1ccc(Cn2cccn2)cc1)Nc1cnn(C[C@H]2CCCO2)c1 363098318 LARVIVSGFZWWSP-LJQANCHMSA-N 380.452 2.629 0 50 GFAA C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)c1ccc(S(N)(=O)=O)cc1 421928490 WTGDIEZILOMYOK-IBGZPJMESA-N 376.453 2.711 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3cn[nH]c3)csc2C1 426693709 JXNDPEFOIXPQHC-UHFFFAOYSA-N 385.493 2.607 0 50 GFAA CCS(=O)(=O)c1cccc(CNC(=O)N2Cc3ccccc3O[C@@H](C)C2)c1 490317771 WCRWGCRWRROZHH-HNNXBMFYSA-N 388.489 2.973 0 50 GFAA CC(C)CCOc1cccc(CCNC(=O)N2CCC[C@@](O)(CO)CC2)c1 584901344 YRYXZHPEYGFJCS-NRFANRHFSA-N 378.513 2.573 0 50 GFAA CCN(Cc1nc(C)no1)C(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2)C1 584902660 QOKBNIZDNYZVMK-QGZVFWFLSA-N 375.448 2.713 0 50 GFAA Cc1nc2ccc(Cl)cn2c1NC(=O)c1cccc(N2CCN(C)CC2)n1 912533211 AXCZQCGCHCBLOV-UHFFFAOYSA-N 384.871 2.695 0 50 GFAA c1ccc(C23CN4CCN(CC(C4)[C@@H]2Nc2ncnc4sccc24)C3)cc1 952964133 BJTXZUYOBHTFRZ-GFBDMGBSSA-N 377.517 2.671 0 50 GFAA CCCc1cc(=O)n(-c2ccc(C(=O)N(C)C[C@H]3CCCN(CC)C3)cc2)[nH]1 1506397002 NUVCFTFYRDPVOF-QGZVFWFLSA-N 384.524 2.922 0 50 GFAA OCCN1CCN(C2CCN(Cc3ccccc3-c3ccccc3)CC2)CC1 1529168219 ZOMDJNKMFHSPAN-UHFFFAOYSA-N 379.548 2.928 0 50 GFAA COc1cc(C)c(S(=O)(=O)N2CCC3(CC2)C[C@@](C)(O)CCO3)c(C)c1C 1704326333 VGULTRWJDRHDPC-IBGZPJMESA-N 397.537 2.705 0 50 GFAA Cc1csc(CCNC(=O)CC2(N3Cc4ccccc4C3=O)CCOCC2)n1 1772500830 MNVSHBNTPROBIP-UHFFFAOYSA-N 399.516 2.706 0 50 GFAA COCCC(=O)N1C[C@@H]2CN(C(=O)c3cc[nH]c3)C[C@@]2(CCc2ccccc2)C1 1772707080 YIXFYWRFUGWSSW-NFBKMPQASA-N 395.503 2.585 0 50 GFAA O=C(c1cc(-c2cccnc2)nc2ccccc12)N1CCC([C@H](O)CO)CC1 1772710972 VAKVUWSBDWBSBQ-OAQYLSRUSA-N 377.444 2.502 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCc3cn[nH]c3)C1)CC2 1857697183 ZTGKYATVMCQMKI-OAQYLSRUSA-N 383.496 2.642 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)C2C(C)(C)C2(C)C)cn1 1857730707 VIIHLMMJFAGMLK-ROUUACIJSA-N 388.556 2.857 0 50 GFAA CC(=O)N[C@@H](Cc1ccc2c(c1)OCO2)C(=O)N[C@H]1C[C@H](c2ccccc2C)C1 1875252065 DBVKWZHKPGFHRC-BJLQDIEVSA-N 394.471 2.833 0 50 GFAA CCOc1ccc(-n2nc(Cn3cncn3)nc2Cc2ccc(C)nc2)cc1 1875347641 ARVXUBBKEPMADX-UHFFFAOYSA-N 375.436 2.600 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cnoc1Cc1ccccc1)c1ccc2c(c1)CCO2 2325825131 FYBNLVPRARBFFT-FQEVSTJZSA-N 392.411 2.844 0 50 GFAA COc1cc(CN2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)cc(OC)c1 2356161133 HKWQCYFWDKNGHQ-IFMALSPDSA-N 385.460 2.584 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)nn1C(C)C 2356159288 UMBYYFTXZPFCAD-OAQYLSRUSA-N 382.512 2.749 0 50 GFAA CCn1c(C)cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)c1C 134262460 JLHOBRXUWAGDJP-OAQYLSRUSA-N 383.448 2.783 0 50 GFAA C[C@@H]1[C@@H](N(CC(=O)N2CCOCC2)Cc2ccc3c(c2)OCO3)CCC[C@H]1C 248147148 IFFDLLDLBFSSBX-AOIWGVFYSA-N 388.508 2.901 0 50 GFAA CC(C)(CO)N(Cc1ccco1)C(=O)[C@@H]1CCCN1C(=O)C1CCCCC1 55054537 STHYOPLSEMOKHA-SFHVURJKSA-N 376.497 2.950 0 50 GFAA Cc1ccc(CN2CCN(Cc3cc(O)c4ccccc4n3)C[C@H]2CCO)o1 104346497 TVRVZYOULGILBW-GOSISDBHSA-N 381.476 2.911 0 50 GFAA C[C@@H]1CCC[C@@H](NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)CC1 468092996 BAGAJSHKQJWJRF-HZPDHXFCSA-N 381.542 2.898 0 50 GFAA COc1ccc(-c2nc(CNC(=O)N3CCC[C@H]3c3ccncc3)n[nH]2)cc1 120601933 PDBQOMPXBIIRQB-KRWDZBQOSA-N 378.436 2.922 0 50 GFAA O=C(CCN1CCC[C@@H](c2nnc3ccccn23)C1)N1CCc2ccccc2C1 65470305 OKTIAGRKSJHYST-HXUWFJFHSA-N 389.503 2.884 0 50 GFAA C[C@H](C(N)=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 67850241 PDMXHOFGGMBVDL-GFCCVEGCSA-N 390.875 2.691 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)c1cc(C)n(C)n1)CC2 328652309 WIJJYQWDLWHMGC-SFHVURJKSA-N 386.521 2.833 0 50 GFAA Cc1ccc(N2CCC(CNC(=O)c3ccccc3-n3cccn3)CC2)nn1 1506425197 ODFKUCRSRNMADN-UHFFFAOYSA-N 376.464 2.617 0 50 GFAA Cc1oc(-c2ccccc2Cl)nc1CN1CCC(NS(C)(=O)=O)CC1 72424676 UYHKRVJTHFXVEQ-UHFFFAOYSA-N 383.901 2.817 0 50 GFAA CCc1cnc(N2CCN(CC(=O)Nc3nc(CC)c(C)s3)CC2)s1 444204760 JIUCTDVDKHEJRV-UHFFFAOYSA-N 379.555 2.794 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@H](c1cccc(F)c1)CC(=O)N2 33271390 HAXAUELTKHPMEL-AWEZNQCLSA-N 377.383 2.540 0 50 GFAA COc1ccc(OC)c([C@H]2CCCN2C(=O)c2cc3c(O)ncnc3cn2)c1 364479325 YZNRREKDXYVTOX-QGZVFWFLSA-N 380.404 2.725 0 50 GFAA COc1cc(OCc2ccccc2)ccc1CN1CCOC[C@@H]1CC(=O)N(C)C 72477491 LLGNEQGMHLQMLR-FQEVSTJZSA-N 398.503 2.953 0 50 GFAA O=C(NCCc1c[nH]c2cc(F)ccc12)[C@@H]1CCS(=O)(=O)c2ccccc21 284613090 INUQQUIVDCDBRQ-QGZVFWFLSA-N 386.448 2.927 0 50 GFAA O=C(Cc1ccccc1F)N1CCN(CCc2nc(-c3ccccc3)no2)CC1 157650564 NVLWRAAADRYEAR-UHFFFAOYSA-N 394.450 2.805 0 50 GFAA C[C@@H]1CN(C2CCN(C(=O)Nc3nnc(-c4ccsc4)s3)CC2)CCO1 131511025 VOPAIRWPCXVMRI-GFCCVEGCSA-N 393.538 2.984 0 50 GFAA Cc1cc(OC[C@H](O)CNC(=O)NCC(C)(C)N2CCCC2)ccc1Cl 426422034 TYEPLQHPYNNCOA-OAHLLOKOSA-N 383.920 2.562 0 50 GFAA CCn1cc(-c2cc(C(F)F)c3c(=O)[nH]c(=S)n(CCOC)c3n2)cn1 20615566 ISSPAKUWRJLALY-UHFFFAOYSA-N 381.408 2.921 0 50 GFAA CC1CCN(c2ccc(C(=O)NCc3ccnc(O[C@@H]4CCOC4)c3)cn2)CC1 162628216 BSMJICBGWLKUJG-LJQANCHMSA-N 396.491 2.811 0 50 GFAA CCOc1ccc(C(C)=O)cc1NC(=O)N1CCC(c2ccnc(N)n2)CC1 426434880 RRTFWCOPLHLIBF-UHFFFAOYSA-N 383.452 3.072 0 50 GFAA CN1CCN(c2ccc(C(=O)N3CCC[C@@](CC4CC4)(C(=O)O)C3)cc2)CC1 91269997 QAYWLVNTDQYAIB-QFIPXVFZSA-N 385.508 2.546 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@H]4CC[C@@H](N)C4)csc3C2)nc1 426584136 VHQFAQMYGAZMHX-CVEARBPZSA-N 384.549 2.873 0 50 GFAA Cc1nc(C(=O)N2CCC[C@@H](CCC(=O)O)C2)nn1-c1ccccc1Cl 237826961 CAIVADIFEMSQKK-ZDUSSCGKSA-N 376.844 2.946 0 50 GFAA C[C@@H](NC(=O)c1cc(C(=O)O)nn1-c1ccccc1)[C@@H]1COc2ccccc21 237494084 WRZUACKPQQCZIU-CJNGLKHVSA-N 377.400 2.865 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1cc(C(C)(C)C)[nH]n1)CC2 91829848 IVGTUVMMHVPPMW-UHFFFAOYSA-N 376.545 2.948 0 50 GFAA O=C1COc2cc(NC(=O)N[C@H]3CCCN(Cc4cccs4)C3)ccc2N1 97173355 POMVSZLQVJXTAX-AWEZNQCLSA-N 386.477 2.865 0 50 GFAA O=C(Nc1ccc(CNS(=O)(=O)CC2CC(F)(F)C2)cc1)c1cccnc1 295646094 GXZZHOSXVQWPKH-UHFFFAOYSA-N 395.431 2.799 0 50 GFAA C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc(-c2ncn[nH]2)cc1 184239809 MNIKEJNTCJKYRX-CYBMUJFWSA-N 384.461 2.708 0 50 GFAA CCOC(=O)[C@@H]1C[C@@]2(C(=O)Nc3ccc(Br)cc32)N2CCC[C@H]12 55243787 OROIOIPZEJZPSI-JDSLSITLSA-N 379.254 2.644 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N1CC[C@H](C2CC2)[C@@H]1c1nnc(O)n1C 1875401945 WZQNAHCWTHVJPD-SJKOYZFVSA-N 381.436 2.624 0 50 GFAA O=S(=O)(c1ccc2nn[nH]c2c1)N1CCCc2cccc(OC(F)F)c21 952845140 YYWVDUSROMXISD-UHFFFAOYSA-N 380.376 2.701 0 50 GFAA C[C@@H](O)C[C@H](NC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)C(=O)O 1875313907 XJTOVGNOFFREGG-MFKMUULPSA-N 380.441 2.567 0 50 GFAA C[C@H](c1ccc(F)cc1)N1C[C@H](C(=O)N[C@H]2CCc3cc(CN)ccc32)CC1=O 1875301155 BQEIAZPFELDXED-IQVOZAENSA-N 395.478 2.998 0 50 GFAA C=CC(=O)N[C@H](C)[C@@H]1CN(C(=O)c2cc(-c3ccc(Cl)cc3)on2)CCO1 1875386210 LCYALKHVWGSHHE-PXAZEXFGSA-N 389.839 2.527 0 50 GFAA CNC(=O)C[C@@H]1CN(C/C=C/c2ccc(OCc3ccccc3)cc2)C[C@H]1O 1875398235 HYKTUYWJHZBLTM-WENHOXRWSA-N 380.488 2.708 0 50 GFAA C=CC(=O)N1C[C@H](NC(=O)[C@H]2C[C@@H]2c2cnn(C(C)C)c2)Cc2ccccc21 1875389601 UWNDWPJMTYQYQI-QRVBRYPASA-N 378.476 2.828 0 50 GFAA CCc1ccccc1C(=O)NC[C@@H]1CCCN(C(=O)c2ccc(C)nc2O)C1 952991284 NAWNIVXTXGTCLS-INIZCTEOSA-N 381.476 2.940 0 50 GFAA Cc1cc(O)nc(N2CCN(C(=O)CCc3c[nH]c4c(C)cccc34)CC2)n1 899500379 FQINBOKGYJSUTR-UHFFFAOYSA-N 379.464 2.562 0 50 GFAA CCNc1nc(C)c(C(=O)N2C[C@H]3c4ccccc4OC[C@@]3(C(=O)O)C2)s1 1565531310 MXIOLJPLXKWQPR-DJJJIMSYSA-N 387.461 2.586 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)cn2)C[C@@H](C)O1 279356980 PBUORTUJIYWBMB-HLLBOEOZSA-N 399.495 2.575 0 50 GFAA Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)[C@@H]1CCCN1S(C)(=O)=O 221864901 SNNOXTFWVRZQBB-QAPCUYQASA-N 379.526 2.736 0 50 GFAA Cc1nc2cc(F)c(F)cc2n1CC(=O)N(C)[C@H]1CCN(c2ccccc2)C1=O 225420114 KZQQJDLECUJGEH-SFHVURJKSA-N 398.413 2.887 0 50 GFAA CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)NC1CC(N2CCCCC2)C1 225436808 ABHDRSYJQHRDQR-RJYAGPCLSA-N 375.488 2.713 0 50 GFAA O=C(Nc1cccc2c1CN(CC(F)(F)F)C2)N[C@H]1CCc2[nH]ncc2C1 190743858 YBWWKLHKFVUYJY-ZDUSSCGKSA-N 379.386 2.967 0 50 GFAA CN(C)c1nc(N)cc(N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)n1 1704313874 MEHXIAHGFUFOAI-UHFFFAOYSA-N 378.480 2.675 0 50 GFAA COCCN1C(=O)[C@@H](CC(=O)Nc2ccc(C)cc2)Cn2c1nc1ccccc12 1848443072 UMOICYPIBPCNRJ-INIZCTEOSA-N 392.459 2.983 0 50 GFAA CC[C@@H](C)[C@@H](NC(=O)COc1ccc2c3c(c(=O)oc2c1)CCCC3)C(=O)O 5235473 RIVJPCNBZYSPSH-CWTRNNRKSA-N 387.432 2.666 0 50 GFAA biogenic COc1cccc(C(=O)N2CC[C@@H]3[C@H](CCCN3C(=O)c3cc(C)nn3C)C2)c1 12037800 IRTSCUVVDYHLCW-IEBWSBKVSA-N 396.491 2.504 0 50 GFAA Cc1ccc(Cn2cnc3sc4c(c3c2=O)CC[C@@H](N(C)CCO)C4)cc1 12470180 HGPHDTBBAFODGK-MRXNPFEDSA-N 383.517 2.596 0 50 GFAA Cc1ccc(C)c(OCc2cc(C(=O)N3CCN(c4cnccn4)CC3)no2)c1 15072996 LYUJRGPDECCWOF-UHFFFAOYSA-N 393.447 2.623 0 50 GFAA CO[C@@H](CNS(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1Cl 206852927 ZOWOOBDOCQADHA-KRWDZBQOSA-N 383.853 2.777 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3csc(-c4ncccn4)n3)C[C@H]12 1857667505 UUPGKVRMIMOIRO-YXWQFLTLSA-N 398.488 2.674 0 50 GFAA Cc1nc(C2CCN(C(=O)[C@]3(Cc4ccccc4)C[C@@H]4CC[C@H]3N4)CC2)n[nH]1 1857673253 QONWWPRCAPOICY-NNMXDRDESA-N 379.508 2.573 0 50 GFAA CC(C)[C@H]1CN2C[C@@H](N=c3[nH]c(-c4ccccc4)nc4c3CCC4)C[C@H]2CO1 1857686659 BCSVTWKFIBHOPY-BBTUJRGHSA-N 378.520 2.964 0 50 GFAA COc1ccc(Cc2nc([C@@H]3CCc4ncnn4C3)n(C(C)(C)C)n2)cc1OC 1857695427 JEYZEKIZTLYPMS-OAHLLOKOSA-N 396.495 2.963 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)CCc2cc(Cl)no2)CC1 1857723458 GSCVXDRUISISRS-UHFFFAOYSA-N 376.844 2.571 0 50 GFAA CN(C)CCCOc1ccc(-c2nccn2C2CCS(=O)(=O)CC2)cc1 1857728996 IWUBYCCDIZHLIM-UHFFFAOYSA-N 377.510 2.630 0 50 GFAA COc1cc(CCC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O)cc(OC)c1 262200154 VWFSBEFQKHWRGZ-HXUWFJFHSA-N 396.443 2.930 0 50 GFAA Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@H](CO)[C@H](O)C1CCCCC1 913048883 LGPYUDUXRFKZLA-SJLPKXTDSA-N 391.899 2.866 0 50 GFAA O=C(Nc1c(Cl)cccc1Cl)c1cnc(NCCN2CCOCC2)nc1 242837706 FUDCELQBRWMWMN-UHFFFAOYSA-N 396.278 2.780 0 50 GFAA Cn1cc(CCNC(=O)c2ccc3c(c2)CC[C@@H](N)C(=O)N3)c2ccc(F)cc21 2325795403 DMWLUSBKQVKTHD-GOSISDBHSA-N 394.450 2.502 0 50 GFAA Cc1ccc(C)c(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1 796323 IXDPJMWPFRJKBC-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA O=C(CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC[C@H]1CCCO1 810030 WBYSQASDQFMFIO-GOSISDBHSA-N 394.537 2.525 0 50 GFAA NS(=O)(=O)c1ccc(NC(=O)c2cccc(NC(=O)c3ccccc3)c2)cc1 1129406 KIRCWSDHOCSZJM-UHFFFAOYSA-N 395.440 2.839 0 50 GFAA Cc1cc(Br)ccc1S(=O)(=O)NCc1ccc2c(c1)OCO2 1196747 AMROLBJYYWKJFY-UHFFFAOYSA-N 384.251 2.965 0 50 GFAA CCn1c(SCC(=O)n2nc(C)cc2C)nnc1-c1ccc2c(c1)OCO2 1468049 BYJJHFIWAHEROK-UHFFFAOYSA-N 385.449 2.940 0 50 GFAA CNc1nc(Nc2nc(C)cc(C)n2)nc(OC(C(F)(F)F)C(F)(F)F)n1 3039799 ISCDKMUFENWGEX-UHFFFAOYSA-N 397.283 2.936 0 50 GFAA biogenic COc1ccc(-n2nnnc2SCC(=O)Nc2cccc(C(C)=O)c2)cc1 3501763 LNACABNUJGCZTE-UHFFFAOYSA-N 383.433 2.604 0 50 GFAA CCOc1ccc(-c2noc(CCCC(=O)NC[C@@H]3CCCO3)n2)cc1OC 4838272 AJZHZSFQJLVVRM-HNNXBMFYSA-N 389.452 2.762 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)N(Cc2cnn(C)c2)C(C)C)n[nH]1 11664211 VCLOBAKJJQFTIY-UHFFFAOYSA-N 391.479 2.900 0 50 GFAA O=C([C@@H]1CCCO1)N(Cc1cc2ccc(F)cc2nc1N1CCOCC1)C1CC1 11910820 FNDQTMPPJKLSGR-FQEVSTJZSA-N 399.466 2.881 0 50 GFAA CCn1nc(C)c(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(F)c3)C2)c1C 12474550 ATBMLPRFENIMAH-KRWDZBQOSA-N 386.471 2.714 0 50 GFAA COc1ccc(CCNC(=O)c2cnc3sc4c(n3c2=O)CCCC4)cc1 16661428 UEVLRXHCYSTVEL-UHFFFAOYSA-N 383.473 2.616 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3Cl)CC2)cc1 19841728 YMRZQYDKWFPJTL-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@]1(O)CN1CCN(C2CCCC2)CC1 23359020 VFKLWSJDAPCXTE-DEOSSOPVSA-N 399.579 2.533 0 50 GFAA CCN1CCN(C(=O)c2cc(COc3cccc(C(F)(F)F)c3)[nH]n2)CC1 55253009 MDJICXJLTKDMGU-UHFFFAOYSA-N 382.386 2.785 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCC(C)(CO)CC3)C2=O)cc1 67654415 QXGIZIAJJKZPNI-HSZRJFAPSA-N 388.552 2.758 0 50 GFAA CC(C)c1nc(CNC(=O)c2ccc(NCc3nccn3C(C)C)nc2)no1 67771850 UUFTVFLGDFQFFL-UHFFFAOYSA-N 383.456 2.908 0 50 GFAA CN(Cc1cc[nH]n1)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71479484 ARXHPDUAANHDGG-QHCPKHFHSA-N 388.471 2.915 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCCOCC1 71551650 JAEBGCKTGCFFIS-UHFFFAOYSA-N 398.532 2.933 0 50 GFAA CCc1[nH]c2ccc(CNc3cncc(C(=O)N4CCOCC4)n3)cc2c1C 71748841 AHWSYOMRFXEUSR-UHFFFAOYSA-N 379.464 2.913 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@@H](C(=O)c3cccc(OC(C)C)c3)C2)n[nH]1 72129749 SUDIJYXUEXSVMJ-QGZVFWFLSA-N 384.480 2.954 0 50 GFAA CCN1CC2(CCN(C(=O)CCc3nc4ccc(C)c(C)c4[nH]3)CC2)CC1=O 72409213 JLDMBBAQNPXACJ-UHFFFAOYSA-N 382.508 2.973 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc(CC4CCCC4)[nH]3)CC2=O)cc1 72430908 PNGRYZIJKYXUQV-UHFFFAOYSA-N 382.508 2.995 0 50 GFAA COc1ccc(CN2CC[C@@]3(CC(=O)NC3=O)C2)cc1OCc1ccccc1 82115360 XWKDAIPPZLROSM-JOCHJYFZSA-N 380.444 2.513 0 50 GFAA CCN(Cc1noc(C)n1)C(=O)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91713934 BANJQHFDSUDHTJ-HNNXBMFYSA-N 390.871 2.819 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCc1csc(-c3ncccn3)n1)C2 95367381 DVNINKLJUFHUKR-CQSZACIVSA-N 396.472 2.519 0 50 GFAA CCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(C)c(N3CCNC3=O)c2)C1 95508271 GCMYMHTZIYLLJB-KRWDZBQOSA-N 381.480 2.761 0 50 GFAA Cc1nc(CCNC(=O)Nc2cccc(NC(=O)C3CCCC3)c2)cc(=O)[nH]1 95527188 KRIMPUWWMACKAU-UHFFFAOYSA-N 383.452 2.571 0 50 GFAA CCc1nc(N2CCC(c3nnc(Cn4ccnc4)n3CC)CC2)ncc1C 96161691 FJLMFBDKPBZUEE-UHFFFAOYSA-N 380.500 2.588 0 50 GFAA O=C(Nc1cccc(-c2nnnn2C2CC2)c1)c1ccc(OCC(F)F)nc1 119958253 RMWTZLUEMLGVHC-UHFFFAOYSA-N 386.362 2.966 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)co1 153013500 QTSJUVDOZFMIAM-MFKMUULPSA-N 386.832 2.608 0 50 GFAA CC[C@H]1CN(C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)CCO1 171893980 CRIRSLWPJXGLRT-IBGZPJMESA-N 386.496 2.616 0 50 GFAA CCOc1ccnc(N2CCN(C(=O)[C@@H](C)c3cn(C)c4ccccc34)CC2)n1 185392834 MIFKWSIJYIXJAY-INIZCTEOSA-N 393.491 2.819 0 50 GFAA CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1nnc(C(F)F)s1 188741398 USYCDWJIXALWTI-QGZVFWFLSA-N 397.451 2.576 0 50 GFAA CSCC[C@@H](NC(=O)Cn1ccc2c(Br)cccc21)C(=O)O 206412597 AYBCTIZFXYEMCW-GFCCVEGCSA-N 385.283 2.726 0 50 GFAA C/C(=C\C(=O)N1CCOC[C@H]1c1noc(-c2cnn(C)c2)n1)c1ccccc1F 222232945 RISATRIQTWLYCY-VEMDQMBVSA-N 397.410 2.613 0 50 GFAA CC[C@H]1CCN(CC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)[C@H]1C 239352085 ABAQACVEQNENAL-STQMWFEESA-N 387.933 2.649 0 50 GFAA CCCCOC[C@@H](O)CN(C)C[C@@H](O)COc1ccccc1C(F)(F)F 252549314 RDTMYQSWXRHQEB-LSDHHAIUSA-N 379.419 2.555 0 50 GFAA CN(C)C(=O)COc1ccccc1C(=O)NC1CCC(O)(c2ccccc2)CC1 273702283 JNJOSYBAGYOJPE-UHFFFAOYSA-N 396.487 2.714 0 50 GFAA COc1cccc([C@H]2C[C@H](O)CN2C(=O)NCc2ccc3c(c2)OCCCO3)c1 282117268 GBODIUOQNHDLKX-PKOBYXMFSA-N 398.459 2.874 0 50 GFAA O=C(O)[C@H]1C[C@H]1C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 299752931 WAUGDAWTEPVNME-NEPJUHHUSA-N 381.215 2.863 0 50 GFAA O=C(N1CCCC1)N1CCC[C@H](NS(=O)(=O)c2ccc(C3CC3)cc2)C1 333711539 PXNZMOSOWIRUAJ-KRWDZBQOSA-N 377.510 2.523 0 50 GFAA O=C(NCc1cccc(-n2cncn2)c1)NCc1ccc(-n2ccnc2)c(F)c1 363546648 SXZYSIWKPFPTCJ-UHFFFAOYSA-N 391.410 2.592 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)N1CCC[C@@H](Cn2ccnc2)C1 426502831 CPQBIZMQASBXCD-SFHVURJKSA-N 381.480 2.632 0 50 GFAA CC(C)OC(=O)N1CCC(NCCc2csc(-c3cnccn3)n2)CC1 534649262 BFANVLDRCYRINB-UHFFFAOYSA-N 375.498 2.742 0 50 GFAA CCn1ncnc1CN1CCC[C@H](CNC(=O)c2ccc(OC)c(Cl)c2)C1 824716485 MVZLMVWYVPHHON-CQSZACIVSA-N 391.903 2.602 0 50 GFAA COc1ccccc1CC(=O)N1CCC(NCc2cccc3c2CCNC3)CC1 903924472 DJHSWYWAMAZIGB-UHFFFAOYSA-N 393.531 2.664 0 50 GFAA O=C(NCC1CCN(c2noc(C3CC3)n2)CC1)c1cc(-c2ccccc2)[nH]n1 952970645 TZUJXCLFYNEPRE-UHFFFAOYSA-N 392.463 2.984 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C2)n1 952984078 ZNAUUMDIRONGKT-AWEZNQCLSA-N 397.454 2.806 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N(C)Cc1cc(-c2ccccc2)no1 1506396514 JDCCBBGHIPZDRE-UHFFFAOYSA-N 390.447 2.987 0 50 GFAA CCCN(Cc1ccc(CC)cc1)C(=O)[C@H]1OCC(=O)N[C@@H]1c1cccnc1 1529173356 VJNUEIHKNITCRS-RTWAWAEBSA-N 381.476 2.639 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(C(=O)c3cnc(Nc4ccccc4)nc3)CCN21 1616078056 YGVCPJUTWMQCMD-MOPGFXCFSA-N 381.480 2.546 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1n[nH]c2c1CCCC2 1704338539 FLWDMYKCSCAMON-FOIQADDNSA-N 376.460 2.824 0 50 GFAA Cc1cnccc1-n1nc(-c2ccccc2)nc1[C@H]1CCCN(C(=O)CO)CC1 1772804174 IHKIWMTVUPRXCW-SFHVURJKSA-N 391.475 2.726 0 50 GFAA O=C1CC2(CCN(C(=O)C3(c4ccc(Cl)cc4)CCC3)CC2)OCCN1 1857683680 ZEBRNPMIFMTSHK-UHFFFAOYSA-N 376.884 2.659 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCCC[C@@H]1CCc1cccc(O)c1 1857685307 HMZXQNHJASBHCR-QGZVFWFLSA-N 385.464 2.844 0 50 GFAA CCOCCC(=O)N1CCC[C@@]2(CN(Cc3ccccc3CC)CC[C@H]2O)C1 1857690159 CJJUWGUGIXHEPW-FYYLOGMGSA-N 388.552 2.851 0 50 GFAA CCN1CC(=O)N2[C@H](c3ccccc3)[C@H](C(=O)N3CCCC4(CC4)C3)C[C@@H]2C1 1857691882 ZWONNODYXFALKD-SFHLNBCPSA-N 381.520 2.683 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3ccc(-c4nc[nH]n4)cc3)CC2)O1 1857697043 SIJARXQGSYMLLQ-QZTJIDSGSA-N 384.480 2.642 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N[C@H](C)c3cnn(C)c3)cc12 1857699616 WMQHCUBUMFOJDN-CQSZACIVSA-N 388.537 2.856 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)CCc2cccnc2)CC1 1857702118 ANFVQXUWECEBPI-UHFFFAOYSA-N 386.473 2.865 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2Cc1ccccc1OCCCN1CCOCC1 1857732060 AOGIIYVNZQSDJR-WWNPGLIZSA-N 388.552 2.913 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCCc2nc3ccc(F)cc3[nH]2)CC[C@@H]1N 1857736750 UEHXEWUYHGJGKE-YEWWUXTCSA-N 376.476 2.673 0 50 GFAA CO[C@@H]1CCO[C@H](CNC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C1 1875296563 DEWZFMBCQCUDGP-KGLIPLIRSA-N 394.269 2.763 0 50 GFAA Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1C(=O)NS(C)(=O)=O 1875390795 LNJSWUMBQCMYRU-UHFFFAOYSA-N 396.683 2.889 0 50 GFAA O=C(Cc1ccccc1C(F)(F)F)N1CC[C@@H](O)[C@](CC2CC2)(C(=O)O)C1 1940196406 JAXKODMLLINJTC-CRAIPNDOSA-N 385.382 2.712 0 50 GFAA N=c1[nH]cncc1C(=O)NCCc1cccc(OCCCc2ccccc2)c1 2325745889 AZWOVYFBUWSXOY-UHFFFAOYSA-N 376.460 2.873 0 50 GFAA COc1ccc([C@@H]2NC(=O)[C@H](C3CC(C)(C)C3)NC2=O)cc1Br 2325776893 MBCPNAWGMGKBBG-KBPBESRZSA-N 381.270 2.550 0 50 GFAA O=C(N[C@H](CNC(=O)[C@@H]1CCCC12CC2)C1CCCC1)c1cnn2ncccc12 2325794433 BJFJBHMBBPWFBE-ZWKOTPCHSA-N 395.507 2.714 0 50 GFAA COc1ccc(-c2onc(NCc3nc(-c4ccncc4)n[nH]3)c2C(=O)O)cc1 2356143954 DHOUTNLNZJJFJB-UHFFFAOYSA-N 392.375 2.841 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCC[C@H](c2ncc[nH]2)C1 2356145745 UKXATOGOCWIHEI-HNNXBMFYSA-N 386.521 2.642 0 50 GFAA COc1cc2c(NCCCCCCO[N+](=O)[O-])ncnc2c(OC)c1OC 1575107 ZPVDBXACOLKADU-UHFFFAOYSA-N 380.401 2.836 0 50 GFAA Cc1ncc(C(=O)N2CCC3(CC2)OCCc2c3[nH]c3ccccc23)c(O)n1 2356145119 BUMUJGQHOZQARH-UHFFFAOYSA-N 378.432 2.676 0 50 GFAA CCc1ccc(OCCNC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1 2947324 JYDKGYCSPJBTET-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA C[C@]1(O)CC2(CCN(C(=O)c3cccc(-c4ccccc4)c3)CC2)OC[C@@H]1O 2356158829 BGAAPGGIFUAGMB-UNMCSNQZSA-N 381.472 2.861 0 50 GFAA CCOCCc1nnc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)s1 9340947 GFCOXOKSUHUJDB-UHFFFAOYSA-N 388.493 2.608 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)N1CCN(C2Cc3ccccc3C2)CC1 54991972 PRDUWZOEJMUFPB-UHFFFAOYSA-N 376.909 2.814 0 50 GFAA CC(C)C[C@H]1CN(c2ccc(C(=O)NCc3noc(C(C)C)n3)cn2)CCO1 67785211 QJXUQIDVHVBPCJ-INIZCTEOSA-N 387.484 2.769 0 50 GFAA Cc1cccn2c(NC(=O)N3C[C@H](CO)OC[C@@H]3C)c(-c3ccccc3)nc12 119109942 UFLCKBYGIPAFPE-DOTOQJQBSA-N 380.448 2.923 0 50 GFAA CN(C)C(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2c2nccs2)c1 175385277 CUUFHVGDDCRFGY-OAHLLOKOSA-N 379.507 2.761 0 50 GFAA CC(=O)N1CCCN(C(=O)c2ccc(CS(C)(=O)=O)cc2)c2ccccc21 173991854 ZBJGJXKGUBOLOW-UHFFFAOYSA-N 386.473 2.635 0 50 GFAA O=C1CC[C@H](Cn2nnc(-c3ccc(Br)cc3C(F)(F)F)n2)O1 864097108 KNTHXTYYFZSFPJ-MRVPVSSYSA-N 391.147 2.827 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)Cc3ccc(O)cc3)C[C@H]2NC(=O)C2CC2)cc1 77426796 UJXVIEDNCKJDOH-LEWJYISDSA-N 378.472 2.764 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@H]2[C@H](O)CC[C@H]2C1 329765451 XAFAXMGTGXKZKV-APHBMKBZSA-N 398.463 2.978 0 50 GFAA Cc1nc2c(c(N(C)C)n1)CCN(C(=O)c1c(C)n(C)c3ccc(O)cc13)C2 72167307 DNSZECVUFGEJBA-UHFFFAOYSA-N 379.464 2.555 0 50 GFAA Cc1cc(N2CCN(C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)CC2)nc(C(C)C)n1 155246746 FOQRJCHCJQVLIA-JQHSSLGASA-N 387.528 2.554 0 50 GFAA C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)c2ccccc2-n2cccn2)CC1 133560420 WSOYMCSHNXRLJZ-KDURUIRLSA-N 381.524 2.503 0 50 GFAA O=C(OC[C@@H]1CCCCN1C(=O)NCCc1cnccn1)N1CCCCCC1 370666560 VWIMUMFKDVRQPB-SFHVURJKSA-N 389.500 2.596 0 50 GFAA Cc1nc2cc(C(=O)N3CCOC[C@@H]3CC(=O)NCC3=CCCCC3)ccc2[nH]1 72125488 YDCUYZZZFJJHCL-SFHVURJKSA-N 396.491 2.719 0 50 GFAA COc1cccc(C[C@H]2CN(C(=O)c3c(C)[nH]c4c3C(=O)CCC4)CCO2)c1 71523529 VIHZJARLVCELNI-KRWDZBQOSA-N 382.460 2.934 0 50 GFAA COc1ccc(N2CCN(C(=O)COc3ccccc3C(F)(F)F)CC2)nc1 456983282 PIOGWXBOTUKNEB-UHFFFAOYSA-N 395.381 2.837 0 50 GFAA COc1cccc([C@@H]2CCCCN2C(=O)NCCCN2CCC(O)CC2)c1 426477342 GSKYJPUXQRBPEF-FQEVSTJZSA-N 375.513 2.779 0 50 GFAA CC(=O)c1c(C)nn([C@H](C)CC(=O)NCCc2nc(C)c3c(n2)CCC3)c1C 426441755 KTIGXQAGUNSFNO-GFCCVEGCSA-N 383.496 2.600 0 50 GFAA CSC[C@@H]1CCCN(C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)C1 97492618 AUFICQQCVHSRCL-CYBMUJFWSA-N 376.482 2.692 0 50 GFAA CCc1cc(N2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)nc(N(C)C)n1 95527773 MNNZJQBRXPNLFP-LJQANCHMSA-N 387.503 2.536 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](Cc2ccc(CO)cc2)C1 91441053 SEHLNSGPGMKQKO-GOSISDBHSA-N 375.490 2.749 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC(c2nccn2Cc2cccnc2)CC1 95530787 DFZUOAZWDMJVCY-UHFFFAOYSA-N 386.459 2.994 0 50 GFAA CC1(C(=O)NCCNC(=O)c2ccccc2)CCN(Cc2ccccc2)CC1 184625422 PNNCCPLAHPUAOA-UHFFFAOYSA-N 379.504 2.835 0 50 GFAA CCc1cnccc1C(=O)N(Cc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 184754939 PAWMIOZPPWOUGY-MRXNPFEDSA-N 376.453 2.613 0 50 GFAA CC[C@@H](OC)c1nc(CC(N)=O)nn1-c1cc(C)c2ccc(SC)cc2n1 1940197224 AIVRDKJYCRGBEP-OAHLLOKOSA-N 385.493 2.971 0 50 GFAA CNc1nc(C)ccc1C(=O)N1CC[C@H](C2CC2)[C@H]1c1nnc(O)n1C(C)C 1875401952 XDHBXYFFGIVOFH-ZBFHGGJFSA-N 384.484 2.923 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)CCn1ccc2ccccc21 1875401268 HPPMPZKWIMTFGP-APWZRJJASA-N 379.464 2.865 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1cc(OC)ccc1F)C[C@H](C)O[C@@H]2C 1875315700 DTNBFCQPAWYEBZ-QWHCGFSZSA-N 391.443 2.629 0 50 GFAA O=C1COc2c(cc(C(F)(F)F)cc2NC(=O)N2CC[C@H](n3cccn3)C2)N1 886063008 ZRHGKMHJCIDQRL-NSHDSACASA-N 395.341 2.712 0 50 GFAA CC(=O)NCc1cc(O[C@H]2CCN(c3nc(C(C)(C)C)ns3)C2)ccn1 886028009 OGOFSNHHAHKUNS-HNNXBMFYSA-N 375.498 2.524 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)N[C@@H]3[C@@H]4Cc5cc(F)ccc5[C@@H]43)CC2=O)c1 888101836 PIAGIEXYRFAJGG-MLCUKSTJSA-N 395.434 2.577 0 50 GFAA O=C(OCCc1cnc(O)nc1)C1CCN(C(=O)c2ccc(Cl)s2)CC1 1343568367 NDZDGEHZMIOCEH-UHFFFAOYSA-N 395.868 2.535 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@@H]2CCc3nccn3C2)sc1Br 275358233 VDHJQCBQSRIQAC-JTQLQIEISA-N 390.328 2.556 0 50 GFAA Cc1c(C(=O)NC2CCN(Cc3ccncc3)CC2)nnn1CC1CCCC1 278984426 JVCZHVYGWPWBNL-UHFFFAOYSA-N 382.512 2.566 0 50 GFAA C[C@@H](CC(=O)N1CCCN(C(=O)c2ccccc2)CC1)NC(=O)C1CCCCC1 171367179 MLCWGQOMGCHLCF-SFHVURJKSA-N 399.535 2.836 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)c2cc(N3CCNC3=O)ccc2F)CC1 172326319 QHJSKIZQGMSUAU-UHFFFAOYSA-N 396.466 2.622 0 50 GFAA CC(C)Cc1cc(C(=O)NC[C@@H](c2cccnc2)N2CCCCC2)nc(O)n1 1506421546 IJGXMRQUZRHRSD-IBGZPJMESA-N 383.496 2.733 0 50 GFAA CCCn1cc(C(=O)N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)c(C)n1 1615738289 OLYYLZBVTHYLCO-UWJYYQICSA-N 378.476 2.825 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N[C@H](C)CCn2cccn2)o1 11813889 FZFFIEFMJMUMIS-MRXNPFEDSA-N 397.479 2.588 0 50 GFAA COc1cc(C(=O)N[C@H](C)c2cn(C)nc2C)ccc1OC1CCN(C)CC1 12028286 AKBJVJOSKMYKHI-CQSZACIVSA-N 386.496 2.701 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1ccc(Cl)s1 12200430 ALYHZUWKYBGIQM-HNNXBMFYSA-N 388.884 2.980 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccc(O)nc4)C3)C2)c1 12703463 WEMNIGDXQPCPES-QFIPXVFZSA-N 381.476 2.924 0 50 GFAA CN(C)C(=O)c1nn(CC2CCCCC2)c2c1C[C@@H](NCC(C)(C)CO)CC2 14751714 RVXXJWYFEBMVJP-KRWDZBQOSA-N 390.572 2.631 0 50 GFAA O=C(c1ccccc1-c1ncn[nH]1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 19335346 GZJWEPYMFDGNRO-UHFFFAOYSA-N 388.431 2.592 0 50 GFAA Cc1nnc(CNC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)o1 1857697930 REWVJQMHWZQEDP-LLVKDONJSA-N 375.816 2.705 0 50 GFAA Cc1ccc2ncnc(N3CCN4C(=O)OC[C@]4(Cc4ccccc4)C3)c2n1 1857700176 BGVDVQSROBPMLT-NRFANRHFSA-N 375.432 2.587 0 50 GFAA O=C(NCCOc1ccccc1)[C@@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857700361 GAOZJKAVVPBZKU-CQSZACIVSA-N 381.457 2.844 0 50 GFAA O=C(O)[C@@H]1CN(Cc2nccs2)CC12CCN(Cc1cccc(O)c1)CC2 1857702735 BBKMCFBRLLGLOS-KRWDZBQOSA-N 387.505 2.648 0 50 GFAA Cc1nc2ccc(CC(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)cc2[nH]1 1857727889 DRULCMOVWLILHY-XQBPLPMBSA-N 390.487 2.744 0 50 GFAA COc1ccc2ccccc2c1CN1C[C@@H]2[C@H](CNC(C)=O)[C@H]3CC[C@]2(C1)O3 1857733161 XVAZFUJSLRQBEW-CVNLYIMZSA-N 380.488 2.964 0 50 GFAA CC(C)C(=O)Nc1cc(-c2nc(-c3cccc(-n4ccnc4)n3)no2)ccn1 815677198 RFSNNXYCXJGFLT-UHFFFAOYSA-N 375.392 2.974 0 50 GFAA CS(=O)(=O)CCn1ccc(NC(=O)N[C@@H]2CCCc3ccc(Cl)cc32)n1 860691474 MCXJKKVIZHSAMZ-OAHLLOKOSA-N 396.900 2.780 0 50 GFAA O=C(NS(=O)(=O)c1ccc(Cl)cc1Cl)c1ccc2oc(O)nc2c1 2325874597 TUAXKEVMAPFTGT-UHFFFAOYSA-N 387.200 2.959 0 50 GFAA COc1cc(C(=O)NCCc2nc3ccc(C(=O)O)cc3[nH]2)cc2c1O[C@H](C)C2 2325875410 QVHMUOWTKCPJNK-LLVKDONJSA-N 395.415 2.566 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(OC)c1 862482 YCBIZMWFMPEQCR-IBGZPJMESA-N 397.431 2.979 0 50 GFAA COc1ccc(-n2nnnc2SCC(=O)Nc2ccc(F)cc2F)cc1 1131906 DHZBKGZDAXXGTR-UHFFFAOYSA-N 377.376 2.680 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1OC 1476163 WGGZYHVAZPZHQG-QGZVFWFLSA-N 386.423 2.649 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)NC[C@H](O)c1cccc(O)n1 2356145766 VRWXBBBVDBQISS-IBGZPJMESA-N 378.428 2.759 0 50 GFAA CCCNC(=O)CN(Cc1ccccc1F)S(=O)(=O)c1ccc(C)cc1 2830710 YLWDSGOJHFISKP-UHFFFAOYSA-N 378.469 2.851 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCC[C@]12CCCN(C1CC1)C2=O 2356166843 BQNNFACESSQWSS-QFIPXVFZSA-N 394.475 2.815 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CCC[C@H](c2cc[nH]n2)C1 2356167866 GKJOSPIOKDWAQV-KRWDZBQOSA-N 392.459 2.707 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1 247947827 PIAKUFKWYZRDCW-RKVPGOIHSA-N 379.526 2.671 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCN(CC=C(C)C)[C@@H](CCO)C2)cc1 20234582 POIDVRWXZNQFTJ-FQEVSTJZSA-N 384.524 2.920 0 50 GFAA COc1ccc(C[C@@H](C)C(=O)NCC2(N3CCCCC3)CCN(C)CC2)cc1 136132157 NTXQJKYDWGKJIW-LJQANCHMSA-N 387.568 2.940 0 50 GFAA C[C@@H](C(=O)N1CCC2(CC1)NCCNC2=O)c1ccc(-c2ccccc2)c(F)c1 67589028 AJMYOGOYMAADTG-MRXNPFEDSA-N 395.478 2.677 0 50 GFAA CC(C)N1C[C@@H](Nc2nc3ccccc3nc2N2C[C@H](C)O[C@H](C)C2)CC1=O 229961512 NPGYZSSTAONNLL-XHSDSOJGSA-N 383.496 2.665 0 50 GFAA Cc1nn(C)c2ncc(C(=O)N[C@H](C)[C@@H]3CCN(Cc4ccccc4)C3)cc12 252535714 GRALOZNBSAJZSJ-CRAIPNDOSA-N 377.492 2.917 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(N2CCO[C@@H](c3nccs3)C2)n1 328635673 NOQDKIZJQYWXJJ-INMHGKMJSA-N 389.525 3.127 0 50 GFAA O=S(=O)(NC1CCCC1)[C@@H]1CCCN(c2ncnc3c2CCCCC3)C1 329711777 PASFBSVUCUOUQI-MRXNPFEDSA-N 378.542 2.576 0 50 GFAA CN1C(=O)NC2(CCN(Cc3ccc(OCc4ccccc4)cc3)CC2)C1=O 362065943 UBVNQFLPPZOLQI-UHFFFAOYSA-N 379.460 2.782 0 50 GFAA CCSCCC(=O)N1CCC(c2nnc(CN3CCCCC3)n2C)CC1 77298909 ZBXZTYZETSQMAQ-UHFFFAOYSA-N 379.574 2.650 0 50 GFAA COc1cccc(C(=O)NCCNc2nc(C)cc(N3CCCCC3)n2)c1OC 72119318 VDMSZYSZTABNOU-UHFFFAOYSA-N 399.495 2.634 0 50 GFAA CN1CC[C@H](NC(=O)NCC(=O)Nc2ccccc2)[C@H]1c1ccc(F)c(F)c1 245674630 KXOWILMVFMIXSZ-PKOBYXMFSA-N 388.418 2.648 0 50 GFAA COC(=O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)c2ccccc21 159345277 AEKHBDVUQXVMBH-MRXNPFEDSA-N 383.379 2.767 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1CC[C@H](C)[C@@H](n2ccnc2)C1)c1ccc2c(c1)OCCO2 129708147 BNDDBLWYCSSWKF-DWRORGKVSA-N 398.507 2.803 0 50 GFAA CCn1ccc(C(=O)N2CCc3c(nc(-c4ccccc4)nc3N(C)C)C2)n1 71714861 HKUJHIKAGBKGAF-UHFFFAOYSA-N 376.464 2.625 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2cc(-c3ccncc3)n[nH]2)CCC(=O)N1CC1CC1 71589574 VIYMHAZUVUZJDB-IBGZPJMESA-N 381.480 2.581 0 50 GFAA COC(=O)c1cccc(CS(=O)(=O)Nc2cncnc2-c2ccccc2)c1 494551529 AIQUESNGVZFAKV-UHFFFAOYSA-N 383.429 2.872 0 50 GFAA CC(C)Oc1ccc2ccccc2c1CNC(=O)N1CCS(=O)(=O)C[C@@H]1C 241776820 RSZIHHHZLQLCLQ-HNNXBMFYSA-N 390.505 2.956 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1nc(Cc2ccccc2)no1 175328874 PATZEQQRVYWGRJ-OAHLLOKOSA-N 392.463 2.544 0 50 GFAA Cn1ncc(C(=O)O)c1C(=O)Nc1ccn(Cc2c(Cl)cccc2Cl)n1 20614496 MEYGOQFWBSJMKA-UHFFFAOYSA-N 394.218 2.922 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC(c2nccn2Cc2ccncc2)CC1 95499310 SIAUPCXCYFYEAE-UHFFFAOYSA-N 382.489 2.895 0 50 GFAA Cn1cnnc1CN1CCC[C@H](CCC(=O)NCc2ccccc2Cl)C1 95498706 IBBHGQLDLDVRRE-OAHLLOKOSA-N 375.904 2.777 0 50 GFAA COCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1cc3ccccc3o1)CC2 95530731 BKCHCKBUVUWLDD-UHFFFAOYSA-N 394.475 2.678 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(Cc1cccc(Cn3cccn3)c1)CC2 91794142 PMJYWYILWPUATM-UHFFFAOYSA-N 376.508 2.634 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)N1CCN(c3cc(C)nc(C)c3)CC1)C2 95352763 PGALPGCKNXBGKL-SFHVURJKSA-N 381.476 2.607 0 50 GFAA C[C@@H](CCC(=O)N1CCC(c2nccn2CC2CCC2)CC1)N1CCOCC1 91830707 WSQCFAWNMHLQJK-SFHVURJKSA-N 388.556 2.890 0 50 GFAA CN(C)C[C@H]1C[C@H](CO)CN(C(=O)c2cc(C(F)(F)F)ccc2Cl)C1 91657305 WMTWXDWDHFFHSX-NEPJUHHUSA-N 378.822 2.991 0 50 GFAA Cn1cnnc1CN1CCCC[C@H]1C(=O)Nc1ccc(Oc2ccccc2)nc1 95527650 RAKYNKHIHXCWGP-SFHVURJKSA-N 392.463 2.996 0 50 GFAA CCNC(=O)COc1cccc(CNC(=O)N2CC[C@@H](c3ccccc3)C2)c1 299315093 IIPRCNQKHMNDMH-LJQANCHMSA-N 381.476 2.901 0 50 GFAA COCc1nnc(NC(=O)[C@@H]2N3C(=O)c4ccccc4[C@@H]3SC2(C)C)s1 253414580 XWPFPLCLEDAUJE-WFASDCNBSA-N 390.490 2.672 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CC[C@H](CN)C3)cc2Br)on1 299740405 ZHXSYHUVUVHOTE-GFCCVEGCSA-N 394.269 2.745 0 50 GFAA CN=c1cc(-c2ccc(C(=O)N3CCC(c4ccncc4)CC3)cc2)nc(N)[nH]1 534582537 IMUNYWLZDPJNIS-UHFFFAOYSA-N 388.475 2.604 0 50 GFAA COc1ccccc1N1CCN(C(=O)CC2(n3cccc3)CCOCC2)CC1 263587472 HHWVMLFIAJQFNV-UHFFFAOYSA-N 383.492 2.741 0 50 GFAA COC(=O)c1ccc(C)c(NC(=O)N2CCCO[C@@H](CN3CCCC3)C2)c1 299798517 QZIYBKQYDFKQQQ-KRWDZBQOSA-N 375.469 2.500 0 50 GFAA Cc1cc(C)nc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)n1 827696052 IVFQXFYWVOFMQF-SFHVURJKSA-N 380.492 2.929 0 50 GFAA Cc1cc(NC(=O)N2CCN(c3ncccc3F)CC2)ccc1C(=O)N(C)C 270496884 CNTLORUGUOQUOL-UHFFFAOYSA-N 385.443 2.585 0 50 GFAA O=C(c1cc2c(N3CCNCC3)cccc2s1)N1CCC[C@@]2(C1)OC[C@@H]1C[C@@H]12 1875394080 UKQPJUCIRCXIPM-YHEJKZAPSA-N 397.544 2.952 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)N(C)C 888101864 PPDISVSRWBBEQI-GOSISDBHSA-N 385.512 2.815 0 50 GFAA CCCNc1ncc(CN2C[C@@H]3CC[C@H]2CN(Cc2c(C)noc2C)C3)cn1 1565525584 UQFJUASRWOGLFX-MJGOQNOKSA-N 384.528 3.000 0 50 GFAA O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2c(=O)[nH]1 192215274 KYJTZFIOFMZUTI-LJQANCHMSA-N 391.471 2.549 0 50 GFAA O=C1OCC2(CCN(C(=O)[C@H]3CCc4sc(-c5ccncc5)nc4C3)CC2)O1 1772810454 HCKDHGXWLOAEII-AWEZNQCLSA-N 399.472 2.838 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSCc1ccccc1)c1ccc(F)cc1 5746704 LTPRNVVMXFWGHI-UHFFFAOYSA-N 396.509 2.641 0 50 GFAA Cc1nnc(SCCNC(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)s1 12203279 BOLIIJWHZBDVDD-HNNXBMFYSA-N 396.582 2.874 0 50 GFAA COCCC(=O)N[C@@H](C)c1nnc2n1CCN(Cc1ccc(C(C)C)cc1)CC2 12245732 AQYNBCMJRNQFBP-KRWDZBQOSA-N 399.539 2.674 0 50 GFAA COc1ccc(C(=O)NCC(C)(C)CO)cc1OC1CCN(C(C)C)CC1 12592591 MRBQNFKNJPDPFE-UHFFFAOYSA-N 378.513 2.695 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccoc4)C3)C2=O)c1OC 12613083 UBHRMJMJHSISLT-JOCHJYFZSA-N 398.459 2.952 0 50 GFAA CN1CCC(N(C)C(=O)CC[C@@H]2CCCN(C3CSCCSC3)C2)CC1 12704584 QYWPJKWSTAEUPD-KRWDZBQOSA-N 399.670 2.880 0 50 GFAA COc1ccc(OC)c(C(=O)NC[C@@H]2Cc3cc(-c4cnccn4)ccc3O2)c1 14883056 FFLPDXWIRLRXCU-KRWDZBQOSA-N 391.427 2.894 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)NCc2cc(C(C)C)no2)CCC1=O 14956239 KMEGYEQPSQDGMU-INIZCTEOSA-N 385.464 2.862 0 50 GFAA O=C(NCCc1cccs1)c1cc2n(n1)C[C@@H](c1ccc3c(c1)OCO3)OC2 169759888 WXANNKWNVYPWNZ-IBGZPJMESA-N 397.456 2.917 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)Cc4cccc(C)c4)CC3)nn2)n1 169777417 QNKZOOIPXLOROW-UHFFFAOYSA-N 394.479 2.995 0 50 GFAA COc1ccc(-c2ccc3nnc(CNC(=O)c4ccccc4F)n3n2)cc1 169778546 UKNKSBFSGYANGR-UHFFFAOYSA-N 377.379 2.869 0 50 GFAA COC(=O)C[C@H](c1ccc(F)c(Cl)c1)c1c(O)n2ccccc2nc1=O 205973895 XNFUMMZYDMGHNR-LLVKDONJSA-N 376.771 2.888 0 50 GFAA CCCOc1ccc(Cl)cc1C(=O)NC1CCN([C@H]2CCN(C)C2=O)CC1 332329044 SBTBGLYWUMVJDZ-KRWDZBQOSA-N 393.915 2.554 0 50 GFAA Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N2CCC[C@](C)(O)C2)cc1 134118782 FZMVUJVRQVVESD-QFIPXVFZSA-N 377.444 2.681 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2ccc(Cn3ccnc3)cc2)C1 163703126 SRFSTJCOMUIQNQ-IBGZPJMESA-N 376.460 2.949 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CC[C@@H](O)CC(C)(C)C2)(c2ccccc2)CC1 848199323 LUZKKKXEAOUHGA-LJQANCHMSA-N 384.520 2.742 0 50 GFAA Cc1sc2nc(SCc3ccc(C(=O)NCCO)cc3)nc(N)c2c1C 1794218 VONLBOPKYNWFMV-UHFFFAOYSA-N 388.518 2.905 0 50 GFAA CC(C)(CN)CC1CN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C1 2325813118 MUFZKSPBTSOLCY-SFHVURJKSA-N 379.495 2.977 0 50 GFAA CC(C)[C@@H](NS(=O)(=O)C1CC1)C(=O)OCc1cccc(-c2cccnc2)c1 861220320 UBQJKORCBSJJIJ-LJQANCHMSA-N 388.489 2.898 0 50 GFAA Fc1cc(F)cc(N2CCC[C@H](Nc3cc(N4CCOCC4)ncn3)C2)c1 2332239243 ACKKKOUAGAQSGT-INIZCTEOSA-N 375.423 2.672 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccccn3)CC2)C(=O)N1c1cccc2ccccc12 4188166 BGYIKDHEQDYLOZ-HXUWFJFHSA-N 386.455 2.689 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CCCC3)CC2)cc1 6702519 KHRUGGDLSZFGOD-UHFFFAOYSA-N 380.510 2.545 0 50 GFAA COc1cccc(CN2CCN(Cc3ccc4nsnc4c3)C[C@H]2CCO)c1 104451274 HQIHRGCOJNMVAW-GOSISDBHSA-N 398.532 2.769 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)N(C)Cc2ccon2)[C@H](c2ccccc2C)N1C 55109035 ZQLJIHMQVFXBST-WFXMLNOXSA-N 385.464 2.566 0 50 GFAA Cc1cc(C)nc(N[C@@]2(C(F)(F)F)N=C(O)N(CCc3ccccc3)C2=O)n1 65363119 PQZRADVXNGAVMC-QGZVFWFLSA-N 393.369 2.763 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)Cc1ccccc1O 67739679 HVUJUOCTBZXKGB-UHFFFAOYSA-N 376.460 2.720 0 50 GFAA COc1cccc(CNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c1OC 140964896 RGKCYAQNRQIIJC-GOSISDBHSA-N 382.460 2.554 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2cc(-n3cccn3)ncn2)CC1 23144588 OMSFEOAHLLKBSM-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)C(=O)Nc3ccccc3)C[C@H]21 230214504 DIHVVYGVJHFMOP-USXIJHARSA-N 387.480 2.777 0 50 GFAA Cc1noc(C)c1CN1CCN(Cc2ccccc2N2CCO[C@@H](C)C2)CC1 253425015 NWBZPKBOTYEMEW-KRWDZBQOSA-N 384.524 2.834 0 50 GFAA Cc1cc(CN2CCCC2)ccc1Oc1cncc(C(=O)N2CCOCC2)n1 67787355 PZUYFRHDRPBREQ-UHFFFAOYSA-N 382.464 2.646 0 50 GFAA COc1cc(C(=O)NS(=O)(=O)c2cnc(Cl)c(Cl)c2)ccc1C 253424696 JUOCLHMCQPFZFF-UHFFFAOYSA-N 375.233 2.824 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@H](C)CN(C)c4ccccc43)ccc21 173506772 GDVMQPXDWJHAIE-OAHLLOKOSA-N 399.516 2.877 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)c4ccc(F)cc4F)CC3)ncn2)c1C 72437591 XKECABVXJJKKHU-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA O=c1c2c3c(sc2ncn1CCN1CC[C@H](c2ccccc2)C1)CNCC3 77424759 VTQTXYDKMHRHRK-INIZCTEOSA-N 380.517 2.593 0 50 GFAA O=C(/C=C/c1cccc(OC2CCCC2)c1)N[C@@H]1CCC(=O)N[C@H]1[C@@H]1CCCO1 365993395 LTEXQBKNKPQPAZ-IAQRDVHISA-N 398.503 2.964 0 50 GFAA CN(Cc1cn(C)nc1C(F)(F)F)C(=O)c1cccc(N2CCOC2=O)c1 125935674 YZPUYRHNDONJJL-UHFFFAOYSA-N 382.342 2.668 0 50 GFAA Cc1cnc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)cn1 71754492 PCPOWNUSTLOHTH-LJQANCHMSA-N 384.455 2.823 0 50 GFAA Cc1nccn1CCN(C)Cc1cc2n(n1)CCCN(C(=O)c1ccccc1)C2 72430529 JNRGCTAOLASOTI-UHFFFAOYSA-N 392.507 2.566 0 50 GFAA CN(CC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)c1ncnc2[nH]cnc12 376157699 MDQNEDKHBOVXOM-BRWVUGGUSA-N 376.464 2.584 0 50 GFAA Cc1ccccc1[C@H](CC(=O)O)NC(=O)Cc1ccc(N2CCCC2=O)cc1 237653615 WZYZZZQNNWWWMS-IBGZPJMESA-N 380.444 2.997 0 50 GFAA CCNC(=O)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1 129554940 BOEHEFJYNKPMRI-FQEVSTJZSA-N 393.487 2.747 0 50 GFAA Cn1nccc1[C@@H](O)c1cc2n(n1)CCN(Cc1cccc(-c3ccco3)c1)C2 219182633 QTYOEDVVZVVIAV-QFIPXVFZSA-N 389.459 2.974 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)Nc4ccc(F)cc4)CC3)ncn2)c1C 72442511 BMIHKKWPCNLSRG-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA CN1C[C@@H](NC(=O)CCc2nc3ccccc3n2-c2ccccc2)CCC1=O 133731491 JCHMFYAPNIDHSD-INIZCTEOSA-N 376.460 2.695 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cc1OC 179505832 ZEUKYTQWCHRUKZ-HIFRSBDPSA-N 399.495 2.906 0 50 GFAA CC(C)c1nc(-c2ccc(C(=O)N3CCC[C@@]4(CC3)CNC(=O)O4)cc2)no1 426698496 VSEAVGOYZOWWGQ-HXUWFJFHSA-N 384.436 2.965 0 50 GFAA Cc1cnc(-c2ccc(C(=O)N(C)C[C@]3(C)CCN(C)C3)cc2)nc1N(C)C 426615174 PTPGCEUVNMKBJM-JOCHJYFZSA-N 381.524 2.932 0 50 GFAA COCCCN1CCC[C@]2(CCN(C(=O)c3ccccc3SC)C2)C1=O 91974137 LLHUJIGOCZMVLM-HXUWFJFHSA-N 376.522 2.900 0 50 GFAA COc1ccc(CN2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)c(F)c1 95370013 OJMZKIIDVIFHCF-MRXNPFEDSA-N 384.459 2.587 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)[C@@H]1CCc3ccccc3C1)CC2 95520635 YUBVNGPCRUNYBF-LJQANCHMSA-N 378.520 2.911 0 50 GFAA O=C(CCC1CCN(Cc2c[nH]cn2)CC1)N[C@@H]1CCN(Cc2ccccc2)C1 95526103 PMZQXVBVCLBLJB-OAQYLSRUSA-N 395.551 2.793 0 50 GFAA Cc1ccn2ncc(C(=O)NCc3ccccc3CN3CCC[C@@H]3CO)c2c1 295666753 JGILKFOBKRWMRG-LJQANCHMSA-N 378.476 2.529 0 50 GFAA CN1CCC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(F)cc4)CC3)CC[C@H]21 246605316 DFUHJMZNFFDIBM-GHTZIAJQSA-N 388.531 2.916 0 50 GFAA CC(C)COc1ncc(C(=O)N2CCC(c3nncn3C)CC2)cc1Cl 182060095 YYPDZNXWPVGVNG-UHFFFAOYSA-N 377.876 2.918 0 50 GFAA COc1ccc(CNC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)cc1C(=O)O 299748505 HGRWHCWBUVMLBZ-LJQANCHMSA-N 396.443 2.546 0 50 GFAA CC[C@@H](NC(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cccnc1 534656625 DDDHSKUGDBJLTP-GOSISDBHSA-N 382.464 2.789 0 50 GFAA Cc1noc(C)c1CN1CCc2nc(C(=O)NCC3=CCCCC3)cn2CC1 1940195025 JGSKTIHSRJJVOW-UHFFFAOYSA-N 383.496 2.776 0 50 GFAA CC(C)c1ccc(N2C[C@@H](C(=O)N(CCO)Cc3nccs3)CC2=O)cc1 828754189 MPHCAGSQUYAORV-INIZCTEOSA-N 387.505 2.641 0 50 GFAA O=c1[nH]c2cc(F)c(S(=O)(=O)N3[C@H]4CC[C@H]3CC(CC(F)F)C4)cc2o1 921771518 ROLCERGMCDNYSZ-UWVGGRQHSA-N 390.383 2.847 0 50 GFAA CCc1cc(C(=O)Nc2ccc(-n3nnnc3O)cc2)ccc1Br 1296434308 LENPTWXLHWUPEB-UHFFFAOYSA-N 388.225 2.945 0 50 GFAA C[C@@H]1c2ccccc2CCN1C(=O)NCc1cccc(CNS(C)(=O)=O)c1 1875295827 RTYBZBSSMNSSMM-OAHLLOKOSA-N 387.505 2.565 0 50 GFAA CCc1nc(=NC(=O)NCC2(c3ccc(Br)cc3)CCC2)[nH]n1C 1875266780 KODDGUJTBSZOJN-UHFFFAOYSA-N 392.301 2.805 0 50 GFAA CN(C(=O)c1cccc2ccn(Cc3ccccc3)c12)[C@H]1CCS(=O)(=O)C1 1875271911 LWBMAFRVZIRERB-SFHVURJKSA-N 382.485 2.949 0 50 GFAA COC(=O)/C=C/C(=O)N1[C@H]2CC[C@H]1CC(O)(Cc1nc(C(C)(C)C)cs1)C2 1875380261 KCRBYLXBWDHPAC-SWICKSTGSA-N 392.521 2.597 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N1CCCN(c2ccncc2C)CC1 952982734 MHLAKDXMYFVBQK-QGZVFWFLSA-N 394.475 2.563 0 50 GFAA CC1=NO[C@H](C(=O)N2CCC(CNC(=O)c3scc4c3CCCC4)CC2)C1 952979547 YTNUFSSNGWDLCA-KRWDZBQOSA-N 389.521 2.760 0 50 GFAA CN(C)C(=O)[C@@H]1CN(C(=O)c2cccc(-n3cccc3)c2)c2ccccc2O1 1775996349 JESVLHHYUHYRCM-FQEVSTJZSA-N 375.428 2.973 0 50 GFAA Cc1cnn(CCC(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)c1 1565530671 LXSJCSJANMQYRS-NQIIRXRSSA-N 378.520 2.672 0 50 GFAA CC(=O)O[C@H]1C[C@H]2C(=O)O[C@H](c3ccoc3)C[C@@]2(C)[C@@H]2C[C@@H]3C[C@@H](C(=O)O3)[C@@H]12 169643320 DYSOIAQEKRDXRB-LKMUTLMISA-N 388.416 2.793 0 50 GFAA O=C(NCc1ccc(CN2CCOCC2)o1)[C@@H]1C[C@H]1c1cccc(F)c1F 170595052 HBLGASAMKCYBIC-DLBZAZTESA-N 376.403 2.810 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)Nc3csc4nc(=O)c(C)nn34)c2)n1 1506429159 VRGVQLUXDBBGJT-UHFFFAOYSA-N 394.460 2.573 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(C(=O)NC(C)C)C[C@@]2(CCc2ccccc2)C1 1772808003 DXUXSRXSUCQVMN-DENIHFKCSA-N 387.524 2.534 0 50 GFAA Cc1nnc(CN(C)C(=O)[C@@H]2CCc3sc(-c4c(C)noc4C)nc3C2)o1 1772808967 HNARAQDLNSRTNY-GFCCVEGCSA-N 387.465 2.870 0 50 GFAA Cc1ccc(C)c(-c2ccc(=O)n(CC(=O)Nc3ccc4c(c3)OCO4)n2)c1 5410013 VPXNPZHWUQFFKT-UHFFFAOYSA-N 377.400 2.895 0 50 GFAA CCOC(=O)C1(CCc2ccccc2)CCN(C(=O)[C@@H](C)n2cncn2)CC1 11839997 DTFUSQQWYVLZEC-QGZVFWFLSA-N 384.480 2.644 0 50 GFAA O=C(NCCc1nc(-c2ccccc2)cs1)c1cn(C[C@H]2CCCO2)nn1 11933807 ACKFREGJVVWQDW-OAHLLOKOSA-N 383.477 2.553 0 50 GFAA CCOCCCNC(=O)c1sc2ncnc(NC[C@@H]3CCCO3)c2c1C 12217476 RAEYRAJBGZKHIP-ZDUSSCGKSA-N 378.498 2.747 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1CC1CCCCC1)NCc1ccccc1Cl 12593776 KBONJTDBPZSYBU-SFHVURJKSA-N 377.916 2.727 0 50 GFAA COc1ccc(CN2C(=O)N(C)C3(CCN(Cc4cccnc4)CC3)C2=O)cc1 14732240 MRDCHLSFTVQUHM-UHFFFAOYSA-N 394.475 2.519 0 50 GFAA O=C(c1cc(F)ccc1F)N1CC[C@@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778200 VUNAXPWWYYIKSF-GFCCVEGCSA-N 386.362 2.571 0 50 GFAA O=C(CCC(F)(F)F)N1CC[C@@]2(C1)CN(c1ncc3c(n1)CCCC3)CCO2 1857681520 MHVCRDWMSOQHHX-GOSISDBHSA-N 398.429 2.506 0 50 GFAA O=C(CCc1cccnc1)N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1nc3ccccc3[nH]1)C2 1857690511 LNIIRHHNLAZTQF-CYGODWOOSA-N 389.503 2.917 0 50 GFAA COc1nccnc1N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857731246 DMEWMQMLYJOFOU-OAQYLSRUSA-N 390.447 2.527 0 50 GFAA CCc1[nH]nc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c1C 1857733861 BXKSWTZMRHZUDE-XYJFISCASA-N 388.899 2.878 0 50 GFAA O=C(N[C@@H](C(=O)O)c1ccccc1)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 238026196 BAVVXCOFWGUXKC-FXAWDEMLSA-N 398.434 2.549 0 50 GFAA O=C1NC(=O)[C@](CCc2ccccc2)(C2CCN(Cc3ccncc3)CC2)N1 11880957 FKWDZXSPVHPRAM-QFIPXVFZSA-N 378.476 2.505 0 50 GFAA Cc1nn(C)c(N2CCOCC2)c1CN1CC[C@@H](COCc2ccccc2)C1 131191245 JMZDDZRYNPDAIB-HXUWFJFHSA-N 384.524 2.604 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3ccc(CC(=O)O)c(F)c3)cn2)C[C@@H](C)O1 909847113 PRLSEWASUHYHHF-BETUJISGSA-N 387.411 2.714 0 50 GFAA COC[C@@H](NS(=O)(=O)C[C@@H]1CCC2(CCC2)O1)c1ccc2[nH]ccc2c1 2325783954 NUTMBXJYJDJRAR-FUHWJXTLSA-N 378.494 2.877 0 50 GFAA C[C@H]1Cc2ccccc2N(S(=O)(=O)c2cn(C)nc2Br)[C@@H]1C 2325829551 MNXWPZPCXMJHTC-WDEREUQCSA-N 384.299 2.959 0 50 GFAA C[C@@H]1CN(c2ncnc3sc(-c4ccccc4)cc23)CCN1S(C)(=O)=O 853854888 MFFMEFMXAVZXHG-CYBMUJFWSA-N 388.518 2.828 0 50 GFAA CC[C@H](CC(=O)N1CC2(C[C@@H](NC(=O)c3ncoc3C)c3nccn32)C1)C(C)C 2332238091 YOPVIMUBQXDRBC-HZPDHXFCSA-N 399.495 2.664 0 50 GFAA COC(=O)c1ccccc1NC(=O)CCC(=O)Nc1ccccc1C(=O)OC 998653 RKKKUPADLXJSHK-UHFFFAOYSA-N 384.388 2.617 0 50 GFAA COc1ccccc1N(C(=O)C(Cl)(Cl)Cl)[C@@H]1C=CS(=O)(=O)C1 1217559 IHHVWHFVTHZLMO-SECBINFHSA-N 384.668 2.709 0 50 GFAA COc1ccc(N[C@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccc(Cl)cc2)cc1 1275996 LGRQAOZPZCZMGN-IRXDYDNUSA-N 395.864 2.783 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)c(C)n1C 2356134695 YEKGEFICLORSSB-SPEDKVCISA-N 387.524 2.543 0 50 GFAA O=C(O)c1cccc2nc(Nc3ncc(F)c(N4CCOCC4)n3)sc12 2356143705 SXDVFUQAWOQVQU-UHFFFAOYSA-N 375.385 2.504 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)c3ccccc3-c3ccc(F)cc3)CC2)[C@H]1O 2356157047 BXHBYZNRLVXORE-FCHUYYIVSA-N 399.462 3.000 0 50 GFAA CCCCn1nc(CC(C)C)c2c(NCCN3CCC(CO)CC3)ncnc21 2356169181 WHJAXCAAYXLWJL-UHFFFAOYSA-N 388.560 2.941 0 50 GFAA COc1ccc(-c2cc(C(F)(F)F)nc(N3CCN(C)CC3)n2)cc1OC 4757763 QZTGRXWLETZUEB-UHFFFAOYSA-N 382.386 2.931 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)c3cc4ccccc4n3C)CC2)c1 20729962 CJKJMJLTKWEMHW-UHFFFAOYSA-N 377.444 2.785 0 50 GFAA CCCn1cnnc1[C@@H](C)NC(=O)CCSc1ccc2c(c1)OCCO2 55152778 LDOHNOAOWPUTQG-CYBMUJFWSA-N 376.482 2.819 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(C)cc3)[C@@H](CCO)C2)cc1CO 23145871 DPLBKSOUUPSYAJ-QHCPKHFHSA-N 398.547 2.955 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccccc1C(F)(F)F)N(C1CC1)[C@H]1CCS(=O)(=O)C1 249112705 OMEKZOHMKYJEEU-AEGPPILISA-N 387.423 2.987 0 50 GFAA Cc1cc(C)c2oc(C(=O)N3CCN(CCc4ccccn4)CC3)cc(=O)c2c1 21659717 BNODSNDBELGYOO-UHFFFAOYSA-N 391.471 2.805 0 50 GFAA CCN1CCN([C@H]2CCc3c(sc4ncn(CCC(C)C)c(=O)c34)C2)CC1 23363039 ZGKCUQDZWWJNOT-INIZCTEOSA-N 388.581 2.999 0 50 GFAA N[C@@H]1CCCN(c2c(Br)cnc3[nH]cc(NC(=O)C4CC4)c23)C1 114234635 BAZRWWGASYWYGB-SNVBAGLBSA-N 378.274 2.601 0 50 GFAA Cn1c(S)nc2cc(C(=O)NCCOC3CCCCCC3)ccc2c1=O 118360721 YUZSRPRSKKPZGG-UHFFFAOYSA-N 375.494 2.691 0 50 GFAA COC[C@H](O)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1Cl 252490488 KUWIBJXTTIERNM-RHSMWYFYSA-N 384.904 2.941 0 50 GFAA CC(C)Cc1cn(C[C@H]2CCCN(C(=O)c3cccc4nccnc34)C2)nn1 67673440 LIXXAYUEUFNEDO-INIZCTEOSA-N 378.480 2.972 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)C(=O)c2ccco2)CCO3)n1 67726403 CTWBBYUZPITRBS-UHFFFAOYSA-N 393.399 2.663 0 50 GFAA CN1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)C[C@H]1c1ncc[nH]1 328616782 CAGQCOWMECTBFO-AWEZNQCLSA-N 389.308 2.535 0 50 GFAA Cc1ccc(F)cc1S(=O)(=O)N1CCN(c2ncnc3ccsc23)CC1 173298395 WCJRKPSEQLBDAP-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA CN1CC[C@@H](CNC(=O)[C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 245822422 WHZMSAWQLLHOTB-BLLLJJGKSA-N 384.307 2.666 0 50 GFAA O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCC[C@@H]1Cn1ccnc1 177761025 SJDABDRXUJFWPB-CYBMUJFWSA-N 390.369 2.787 0 50 GFAA COc1cccc(C(=O)N2CCN(C(=O)NC3(c4ccccc4)CC3)CC2)c1 426533792 MTLYCTDZRILWQE-UHFFFAOYSA-N 379.460 2.852 0 50 GFAA COc1cccc(N2CCN(C(=O)c3cc(-c4ccccc4)on3)CC2=O)c1 82137118 BTBSAHZDZMIXCZ-UHFFFAOYSA-N 377.400 2.839 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@H](CN)C3)cc2)c(C)c1Br 178579047 IWRSLYXYMLOOPQ-CYBMUJFWSA-N 377.286 2.672 0 50 GFAA O=C(NC[C@H]1CC(=O)N(c2ccccc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1 426628714 DZXRCYBNALTUPH-CQSZACIVSA-N 378.407 2.999 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)CSC(C)C)C3)CCC2=O)cn1 91645845 ULHAVYZHXJPLHQ-HXUWFJFHSA-N 390.553 2.658 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4ccccn4)C3)C2)cn1 95499246 HEFAURHPMPVILE-HSZRJFAPSA-N 392.503 2.873 0 50 GFAA CC(C)[C@@]12O[C@H]3[C@H]4C[C@@H]([C@H](C(=O)N1c1ccc(Br)cc1)[C@H]42)[C@H]3O 238900253 IFAYFRXLRHFRHC-USZWEYKBSA-N 378.266 2.790 0 50 GFAA Cc1ccc(C(=O)NC[C@@H]2CCOc3ccccc3C2)cc1N1CCNC1=O 95354156 QUBZBJONVFDKPG-MRXNPFEDSA-N 379.460 2.896 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCC2(CCC(=O)N(CCc3ccccn3)C2)CC1 91707014 JQLGQRPJAAYTHF-UHFFFAOYSA-N 380.492 2.806 0 50 GFAA CCC1(CC)CN(C(=O)[C@@H]2CCC(=O)N(Cc3ccccc3F)C2)CCO1 91586843 KUBBPUUHTOJPGA-QGZVFWFLSA-N 376.472 2.982 0 50 GFAA CN(C)CCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(Cl)cc2O)C1 95392497 PGFBCIPAUNHWRC-AWEZNQCLSA-N 376.888 2.824 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc(C(N)=O)s2)cc1N1CCNC1=O 23251767 LBOWDPRSMREYMP-CQSZACIVSA-N 398.488 2.662 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)c1ccc(CO)o1)CC2)c1ccccn1 95527592 LAJOKYNGSNBYCE-UHFFFAOYSA-N 377.400 2.618 0 50 GFAA O=C1COc2cc(C(=O)NCc3ccc(Cl)nc3)c(Br)cc2N1 183167535 WGKPOUSPIXHNKQ-UHFFFAOYSA-N 396.628 2.758 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 252495704 OWWSANSNNQTDAN-OAHLLOKOSA-N 394.387 2.556 0 50 GFAA O=C(c1cn[nH]c1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940196275 XFTIANPOOYFATF-UHFFFAOYSA-N 375.432 2.693 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1CC(C2=NOCC2)C1 1875301382 HMAXFPOTKQWZQU-UHFFFAOYSA-N 397.435 2.983 0 50 GFAA O=C(NC[C@H]1CCCc2cccnc21)N1CCc2c(nnn2-c2ccccc2)C1 1875295182 SKNAQVYREUDSAR-QGZVFWFLSA-N 388.475 2.850 0 50 GFAA O=C(NC[C@]1(O)CCc2ccccc21)N[C@H]1Cc2n[nH]cc2[C@@H](C(F)(F)F)C1 1875278176 GEKMZXZQANEZAC-HNJNHCNJSA-N 394.397 2.504 0 50 GFAA CC[C@@H]1CCO[C@@H]1C(=O)NS(=O)(=O)c1c(Cl)cccc1Br 888101086 AUAGIXKLOQTEDV-KCJUWKMLSA-N 396.690 2.723 0 50 GFAA O=C(N[C@@H](CO)C(=O)OCc1ccccc1)c1c[nH]nc1-c1cccc(Cl)c1 1320248915 LJBHPUAEJJDTDN-KRWDZBQOSA-N 399.834 2.564 0 50 GFAA c1ccc2nc(N3CC[C@H](OCc4ccncc4)C3)c(N3CCOCC3)nc2c1 192903860 PIMIJHKEPNRHQA-SFHVURJKSA-N 391.475 2.657 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCc2csc(-c3ccccc3)n2)C1 1506396740 FWYXHKTZHIRINV-AWEZNQCLSA-N 381.523 2.503 0 50 GFAA O[C@H]1CCCN(c2ccnc(NCCc3csc(-c4cccnc4)n3)n2)C1 1704337898 HMLGVEMIOBGSGA-INIZCTEOSA-N 382.493 2.611 0 50 GFAA Cc1cnc(CNC(=O)[C@@H]2CCc3sc(-c4c(C)noc4C)nc3C2)cn1 1772819964 YSLRCUMKVJPKAB-CYBMUJFWSA-N 383.477 2.935 0 50 GFAA Cc1cccc(CN2C[C@H]3CN(CCOc4ccc(F)cc4)C[C@]3(CO)C2)c1 1772807461 NVAATZAAWPJKFW-NFBKMPQASA-N 384.495 2.939 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3cccc(C(C)=O)c3)n2)c1 5400254 XEMRHVPXFGXDFI-UHFFFAOYSA-N 377.400 2.760 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 12302575 SAIWUGQAIPAPEX-NRFANRHFSA-N 390.455 2.510 0 50 GFAA CC[C@H](O)CNC(=O)c1cc(OC)ccc1OC1CCN(C2CCCC2)CC1 12612441 OCMLPOWKTLTZKQ-KRWDZBQOSA-N 390.524 2.982 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)[C@H]3CCCN3C(=O)CCC(N)=O)c2)c1 12596681 NOSRZHOCQFNXLG-LJQANCHMSA-N 379.460 2.857 0 50 GFAA CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(C)c1 13612541 DCYDOSDFNFASBH-UHFFFAOYSA-N 376.434 2.931 0 50 GFAA CC[C@@H](C(=O)NCc1ccncc1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712285 LPGKFPKPMNWGTA-INIZCTEOSA-N 381.885 2.596 0 50 GFAA O=S(=O)(c1ccccc1)n1cc(I)c2cccnc21 14401003 ZYGPVHZEYCZWNX-UHFFFAOYSA-N 384.198 2.878 0 50 GFAA CCN1C(=O)N(CCCc2cccnc2)C(=O)C12CCN(Cc1ccoc1)CC2 14750148 BHLKZJTWMQXVLR-UHFFFAOYSA-N 396.491 2.926 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NC(=O)CCN3CCOCC3)C2)cc1 15080716 DPRQUSMETAAYPW-JOCHJYFZSA-N 387.568 2.688 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)N1C[C@@H]2CNC[C@@H]2C1 1857728685 LXIMTQNHJLDTJZ-SOUVJXGZSA-N 388.899 2.766 0 50 GFAA Cc1nsc2ncc(C(=O)NCc3nnc4n3C[C@@H](C(F)(F)F)CC4)cc12 2325700249 CUPAGSQJDHTMNV-JTQLQIEISA-N 396.398 2.646 0 50 GFAA CN(C)c1cc(NC(=O)NCc2nc3ccccn3c2Br)ccn1 2325859253 SMKHOAYBUPOERS-UHFFFAOYSA-N 389.257 2.880 0 50 GFAA O=C(NCc1ccco1)c1ccc(NC(=O)[C@H]2COc3ccccc3O2)cc1 1129253 YBVSKAXIDLPZGL-LJQANCHMSA-N 378.384 2.988 0 50 GFAA COC(=O)Cc1ccc(NC(=S)N2CCN(c3cccc(O)c3)CC2)cc1 2199962 VCJCJBNRGRCLHK-UHFFFAOYSA-N 385.489 2.627 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc(SC)c2)cc1 2871902 XPZQLXBEAPORMC-LBPRGKRZSA-N 380.491 2.723 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N=c2[nH][nH]c3nccc(-c4ccccc4)c23)c1 2356169650 GFLXCKFOQUNNSY-UHFFFAOYSA-N 392.440 2.703 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(Br)c(C(=O)O)c2)cc1 4841252 GSXCMCSXYUOQMI-UHFFFAOYSA-N 386.223 2.957 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCN(c2ccc(-c3ccccc3)nn2)CC1 1398842 OVOVZTCQOOQGPD-UHFFFAOYSA-N 398.463 2.794 0 50 GFAA C[C@@H](CN1CCOCC1)NC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 112439318 MGKFVHHPUKRHLZ-FUHWJXTLSA-N 399.495 2.694 0 50 GFAA Cc1ncc(C[n+]2csc(CCOC(=O)[C@H]3C[C@H]4CC[C@H]3C4)c2C)c(N)n1 101834506 CYBLJVGBDWMZJC-ZOBUZTSGSA-N 387.529 2.595 0 50 GFAA O=C1CCN(Cc2cnn(-c3ccccc3)c2)CCN1CCOc1ccccc1 20854302 GHOQDQPYSBGXIQ-UHFFFAOYSA-N 390.487 2.986 0 50 GFAA Nc1nnc(CCNC(=O)c2csc3nc(-c4ccccc4F)cn23)s1 67934551 LZUXQIMOOAOYPS-UHFFFAOYSA-N 388.453 2.608 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc(C)ccc3C)CC2)C1 67756998 IPLQMZSJIHHAGJ-FQEVSTJZSA-N 387.568 2.742 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3c2cnn3Cc2cccnc2)cc2c1OCO2 65452763 YNVPFQGEBZXLKE-AWEZNQCLSA-N 378.388 2.538 0 50 GFAA Cc1cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)nc(N2CCCC2)n1 64799721 DSYXVMARWNXQKA-UHFFFAOYSA-N 387.434 2.626 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N(C)Cc3cc(C)cc(C)n3)cnn2c1 67974245 AWILICRZSVIPCJ-UHFFFAOYSA-N 380.496 2.855 0 50 GFAA CNC(=O)c1cccnc1N1CCC(n2cc(-c3ccc(F)cc3)nn2)CC1 63868935 PEDREFHFSSLZFX-UHFFFAOYSA-N 380.427 2.680 0 50 GFAA O=c1oc2cccnc2n1CCN1CCCN(Cc2ccc(Cl)cc2)CC1 123223840 QGYVGEZPEHPXGW-UHFFFAOYSA-N 386.883 2.851 0 50 GFAA O=C(Nc1cc(Cl)ccn1)C1CCN(S(=O)(=O)c2cccs2)CC1 953307 PUPLKRFQMLWBLI-UHFFFAOYSA-N 385.898 2.836 0 50 GFAA O=C(Cc1cccc(C(F)(F)F)c1)N1CCC(CO)(CN2CCCC2)CC1 219356768 PKSSOGSHDDWVNY-UHFFFAOYSA-N 384.442 2.945 0 50 GFAA CSCC[C@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccc2c(c1)OCO2 218321180 DQJNYIPQJDIJKT-HNNXBMFYSA-N 388.493 2.672 0 50 GFAA CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(-c2nnc(S)o2)cc1 127726907 PDSACGQHCXUTRE-ODZUORAKSA-N 379.507 2.835 0 50 GFAA O=C(C[C@H]1C(=O)Nc2c(-c3ccccc3)cnn21)Nc1ccc2c(c1)OCCO2 71375462 DBLRYYPXGJZOGW-INIZCTEOSA-N 390.399 2.843 0 50 GFAA CCc1nccn1[C@H]1CCCN(CCOc2cccc(S(C)(=O)=O)c2)C1 154947751 PSBLGSODGPMMHB-INIZCTEOSA-N 377.510 2.565 0 50 GFAA COc1ccccc1N1CCN(CC(=O)N2N=CC[C@H]2c2ccccc2)CC1 35851842 GESMSPMOADOPTA-IBGZPJMESA-N 378.476 2.777 0 50 GFAA CN1CCC(=O)Nc2cc(C(=O)Nc3cnn(Cc4ccccc4)c3)ccc21 155715220 KOPAFRRZEVCOAU-UHFFFAOYSA-N 375.432 2.962 0 50 GFAA Cc1cc(C)c(C(=O)N2c3ccccc3CC[C@H]2C(=O)N2CCN(C)CC2)o1 175615375 FAEFOLBRKABPQI-IBGZPJMESA-N 381.476 2.632 0 50 GFAA Cc1cnc(CNC(=O)N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)s1 176058964 KZGPKCZWHUNFPL-UHFFFAOYSA-N 396.875 2.912 0 50 GFAA Cc1cccc(-c2ncc(C(=O)N(C)CC[C@@H](O)c3ccccc3)c(=O)[nH]2)c1 82107040 RAIMHWNRPPIYRJ-LJQANCHMSA-N 377.444 2.941 0 50 GFAA NC(=O)[C@@H]1CCCN(Cc2cc(Cl)ccc2OCCCn2ccnc2)C1 223797912 HEFQWIUCYCMLMJ-OAHLLOKOSA-N 376.888 2.703 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 290717321 RQFIHZZRQQFXPX-LBPRGKRZSA-N 380.330 2.813 0 50 GFAA COc1ccccc1-c1c2c(=O)n(Cc3cccnc3)ccc2nc2ncnn12 40398199 BHMWTULBGXPNCI-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA COCCN1C[C@@]2(CCCN(Cc3ccc(-c4cc[nH]n4)s3)C2)CCC1=O 91412514 CIRWXIUWBGISPS-FQEVSTJZSA-N 388.537 2.989 0 50 GFAA C[C@H]1CN(Cc2ccccc2)C[C@@H]1c1nc2c(cnn2C2CCOCC2)c(=O)[nH]1 95080372 RVEJWGYZBXCGGM-KXBFYZLASA-N 393.491 2.707 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccc3nsnc3c1)C2 95353289 LPGMMYMTIWJCIB-HZPDHXFCSA-N 379.489 2.823 0 50 GFAA CCc1nc2ccccc2n1C1CCN(C(=O)NCC(=O)N2CCCCC2)CC1 180308273 AXOBXAPKHYANHQ-UHFFFAOYSA-N 397.523 2.958 0 50 GFAA Cc1noc(C)c1CN1CCC(c2nnc(Cn3cccn3)n2C2CC2)CC1 96132368 NTLIWUINFTXJQZ-UHFFFAOYSA-N 381.484 2.842 0 50 GFAA Cc1ccc(CNC(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)cc1 95365551 RPIFBZGRIJYJOL-AZUAARDMSA-N 378.476 2.836 0 50 GFAA Cc1nc(C(C)(C)Oc2ccc3c(c2)CCC3)n([C@H]2CCS(=O)(=O)C2)n1 96139362 WYJCKLATSIMHNT-INIZCTEOSA-N 375.494 2.749 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1S(=O)(=O)N1CCC[C@@]2(CCOC2)C1 95375245 STIUIFVDIXNQHU-LJQANCHMSA-N 375.494 2.680 0 50 GFAA COc1ccc(CN[C@H]2CNC(=O)c3cc(-c4ccc(F)cc4)nn32)c(OC)c1 263615793 FFZJZYUPBGINQP-HXUWFJFHSA-N 396.422 2.738 0 50 GFAA O=C1CCN(C(=O)Cc2c(F)cccc2Cl)CCN1CCN1CCCCC1 299792691 FQYRRFGKELPDOT-UHFFFAOYSA-N 395.906 2.568 0 50 GFAA O=C(CSCc1ccccc1Cl)N1CC[C@@H]2OCc3cnnn3[C@@H]2C1 1076084689 OGXLCTXFRBWHSG-CVEARBPZSA-N 378.885 2.537 0 50 GFAA O=C(CO[C@H]1CCCNC1)N1Cc2cc(Br)ccc2C2CC1C2 1875307419 XYOPSRJFOZYNHZ-MOQPWLNLSA-N 379.298 2.806 0 50 GFAA C=CC(=O)NCC1(c2ccccc2)CCN(C(=O)Cn2cc(C3CC3)cn2)CC1 1875386542 SQMBRWAWHMXPFV-UHFFFAOYSA-N 392.503 2.623 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)CC1 1875369297 GDSDHAWDSBLLDZ-UHFFFAOYSA-N 377.872 2.540 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c1nn(C)c2C(=O)N1CCC(c2ccccc2CO)CC1 1875314740 PMDBWBXJVFZPJS-CABCVRRESA-N 383.492 2.954 0 50 GFAA Cc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1CN1CCc2ccccc21 1875254965 PHHIWEQTGWJFEM-LJQANCHMSA-N 377.488 2.779 0 50 GFAA O=C(NCc1ccncc1)c1ccc(NC(=O)c2cccc(-n3ccnn3)c2)cc1 170606048 DXQZCBMEJKOFFA-UHFFFAOYSA-N 398.426 2.845 0 50 GFAA Cc1nc(CNC(=O)c2ccc(N3N=C(Cc4ccccc4)CC3=O)cc2)no1 225474352 CRTZGOBILMRFHS-UHFFFAOYSA-N 389.415 2.643 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCCc3c(O)cccc32)cc(C)c1C 190262371 MHHUWSMQCQAQAQ-QGZVFWFLSA-N 388.489 2.725 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CN(Cc3cnc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772808392 OWJAYHSFQZSHIU-REWPJTCUSA-N 390.535 2.710 0 50 GFAA CC(=O)N1CCC(C(=O)N(C)[C@@H]2CCCN(Cc3ccccc3F)C2)CC1 11947666 XITJIKKQRRPYPQ-LJQANCHMSA-N 375.488 2.507 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCCC[C@@H]2CCn2cccn2)nn1 11951176 LQNKTEZZDVHVRL-LJQANCHMSA-N 378.480 2.916 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@@H]1CC(=O)NCCc1ccccc1Cl 12314414 AGZNCNFVLKKAEN-FQEVSTJZSA-N 399.922 2.698 0 50 GFAA CN1CCC[C@H](CN(CCc2ccccc2)C(=O)CCN2CCCCC2=O)C1 12712128 PLPOWXNAEVLUCY-NRFANRHFSA-N 385.552 2.802 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@]2(CCCN(Cc3ccccc3F)C2)C1 14950745 NIBSOJAHYLSHMH-NRFANRHFSA-N 376.472 2.984 0 50 GFAA CCN1CCN(C[C@@H](O)COc2cccc(CNC3CCCCCC3)c2)CC1 19228545 DOHDNOJEBZQTAC-JOCHJYFZSA-N 389.584 2.876 0 50 GFAA COC(=O)C[C@@H](c1cccc(OC(F)F)c1)c1c(O)n2ccccc2nc1=O 205974086 VVMZNTZUOVERNI-ZDUSSCGKSA-N 390.342 2.697 0 50 GFAA O=C(Cc1ccccc1F)N1CCC[C@]2(C1)CN(c1ccncc1)CC[C@H]2O 1857691787 CYLGPLWSKFNTDZ-IFMALSPDSA-N 383.467 2.643 0 50 GFAA O=C(CCc1ccccc1Cl)N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)[C@H]1CCOC1)C2 1857702568 OESFBXSBWFJEHL-PFRQMTDMSA-N 390.911 2.662 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2csc3ccccc23)[C@H]1c1cnn(C)c1 1857735624 ICBPISKDOHENTC-HKUYNNGSSA-N 384.505 2.779 0 50 GFAA O=C(c1cc(-n2cccn2)ccc1Cl)N1C[C@@H](O)[C@H](Cc2ccncc2)C1 1875243676 RWXOFJNPKVKOBU-DNVCBOLYSA-N 382.851 2.596 0 50 GFAA CCn1ncc(S(=O)(=O)N2C[C@H](C(C)C)O[C@H](c3ccccc3)C2)c1C 1875246210 AUUMXMKPPDRNBF-MSOLQXFVSA-N 377.510 2.998 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@H]2C[C@H]1/C(=C/OC)C(=O)OC 17003397 DAXYUDFNWXHGBE-RVRFFASCSA-N 384.476 2.700 0 50 GFAA biogenic CCOc1nc2ccc(C(=O)N3CCN(C(=O)c4ccc(C)cc4)CC3)cc2[nH]1 469504827 KTEBJRUVSWPCTR-UHFFFAOYSA-N 392.459 2.868 0 50 GFAA CCn1cnnc1C1CCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)CC1 264395638 MTQCUNKRPKIVNU-HXUWFJFHSA-N 381.524 2.916 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC2CC2)CC[C@H]1NC(=O)CCc1cccc(O)c1 2100482525 GEUHWXBALGPJIM-PWIZWCRZSA-N 388.508 2.684 0 50 GFAA Cc1nc(CCCNC(=O)c2ccc3nnc([C@H](O)C(C)C)n3c2)sc1C 2100534327 CXDDUCYRDWNHPV-QGZVFWFLSA-N 387.509 2.855 0 50 GFAA Cn1c(=O)c2c(nc(Oc3ccc(F)cc3)n2Cc2ccc(F)cc2)n(C)c1=O 877395 CUHLTVYENMFDKG-UHFFFAOYSA-N 398.369 2.553 0 50 GFAA biogenic Cc1cccc(CN2CCN(Cc3c(F)ccc(F)c3F)C[C@H]2CCO)n1 104340919 VHPUWCYHKBRBNL-MRXNPFEDSA-N 379.426 2.876 0 50 GFAA OCc1ccccc1CN1CCN(Cc2ccccc2Cn2cccn2)CC1 55325250 KOKZCRLRENERKC-UHFFFAOYSA-N 376.504 2.742 0 50 GFAA CC(C)Nc1cc(N2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)ncn1 106972087 ZYKWMPLCJPNFJM-INIZCTEOSA-N 391.466 2.648 0 50 GFAA O=C(CN1C(=O)CSC1=O)N1Cc2ccccc2O[C@@H](c2ccccc2)C1 12281703 MKXJNQKRCJMSGB-QGZVFWFLSA-N 382.441 2.844 0 50 GFAA CCOc1cc([C@@H]2NC(=O)c3nn(CC)cc3N2)c(Br)cc1O 2779258 PJBRZRXZRVIROP-AWEZNQCLSA-N 381.230 2.624 0 50 GFAA Cc1ccc([C@@](O)(CC(=O)Nc2ccc(N3CCOCC3)cn2)C(F)(F)F)o1 123360466 OLPCJEFDKPRAPF-KRWDZBQOSA-N 399.369 2.598 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCCn3nc([C@H](O)C4CCC4)cc3C2)s1 219579259 XPEDFJBULUFPGE-QGZVFWFLSA-N 381.523 2.681 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)c1scnc1C1CC1 126286640 SLRTWSNMZLVWJO-GFCCVEGCSA-N 392.506 2.706 0 50 GFAA CCN(CC)C[C@H](O)COc1cc(CN(C)CC2CCOCC2)ccc1OC 12612266 GCDQEXLLWHBKKJ-FQEVSTJZSA-N 394.556 2.635 0 50 GFAA C[C@H](O)C(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 71681270 NEDUTMYFUPKYLA-LBPRGKRZSA-N 391.859 2.725 0 50 GFAA Cc1ccccc1OC[C@H]1CCCN(C(=O)c2ccc(-n3cnnn3)cc2)C1 77393441 QWNQVWWBPSQUAM-KRWDZBQOSA-N 377.448 2.902 0 50 GFAA COc1ccccc1C(=O)N1CCC[C@H](Cn2cc(-c3cccnc3)nn2)C1 71763380 AITLRNQWAFZECH-INIZCTEOSA-N 377.448 2.901 0 50 GFAA CCN(CCNC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)c1cccc(C)c1 241135386 JOXQWFJRQLTPPG-RTBURBONSA-N 385.508 2.503 0 50 GFAA O=S(=O)(NCc1ccccc1)NC[C@@H](c1ccc(F)cc1)N1CCCC1 71746856 RLTMTBOFPQASIK-IBGZPJMESA-N 377.485 2.587 0 50 GFAA CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1CC[C@@H](C(=O)O)C1 263302316 XAFRYDVKFGPXQO-QKCSRTOESA-N 385.258 2.641 0 50 GFAA C[C@@H]1[C@@H](C(=O)NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 242167630 WYDGKHCOZBRDDA-NXHRZFHOSA-N 376.497 2.742 0 50 GFAA C[C@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1c2ccccc2C[C@H]1C 456625619 JYFQUMWOOVDHSJ-IGCXYCKISA-N 395.434 2.734 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)Cc2csc(N3CCCC3=O)n2)o1 133804749 HWMMVXLKZHQAGE-OAHLLOKOSA-N 389.477 2.568 0 50 GFAA Cc1oc2c(C)c3oc(=O)c(CCC(=O)N4CCNC(=O)C4)c(C)c3cc2c1C 40313043 VJGIQYQBWUAWSP-UHFFFAOYSA-N 396.443 2.664 0 50 GFAA biogenic CN(C)[C@H](C(=O)NCc1coc(-c2ccccc2)n1)c1ccc2c(c1)OCO2 426486033 GREQMLYVUBFVSN-IBGZPJMESA-N 379.416 2.989 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CC[C@H](CN)C2)[C@@H]1c1ccccc1OC 178584454 DABVYYFAZJAKIN-MMOPVJDHSA-N 387.524 2.582 0 50 GFAA CN(C)CCOc1ccc(CNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)cc1 293080001 QJMWIFRMUJBEIZ-UHFFFAOYSA-N 381.476 2.787 0 50 GFAA CCc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(-n3ccnc3C)cc2)on1 95523219 XLABMCZJMGFRRP-SFHVURJKSA-N 393.447 2.974 0 50 GFAA Cc1cccc(CC(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)c1 91930968 NMCRSCHKVYCHFA-UHFFFAOYSA-N 394.519 2.735 0 50 GFAA COCCCn1cnnc1[C@@H](C)Nc1ncnc2c1Cc1ccccc1OC2 97756330 UNQJBVHWCWZEQO-CQSZACIVSA-N 380.452 2.761 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](c2cccc(C(=O)O)c2)C1 95392495 KJUCMAIHCZXBAY-IBGZPJMESA-N 388.489 2.941 0 50 GFAA Cc1cc(OC(F)F)ccc1NC(=O)N1CCN(C2CCN(C)CC2)CC1 97819634 JYCKWJNTRVGPPJ-UHFFFAOYSA-N 382.455 2.840 0 50 GFAA CC[C@@H](CNC(=O)N1CCC(Oc2ccc(C)cc2)CC1)N1CCOCC1 534644187 ZTIOXZJSMXCFML-SFHVURJKSA-N 375.513 2.659 0 50 GFAA O=C(CSc1nc(-c2ccco2)n[nH]1)NCCN1CC[C@@H](c2ccccc2)C1 670436322 GCQSLEPPRFBFCO-MRXNPFEDSA-N 397.504 2.763 0 50 GFAA COc1ccc(CN2CCC[C@@H]2c2nc3ccccc3[nH]2)cc1OCC(N)=O 1875261979 OXSIXZKMKYCGBB-QGZVFWFLSA-N 380.448 2.773 0 50 GFAA CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NCCCc1cc[nH]n1 170606087 SORQOYJWBJEDQT-PQGQHUGISA-N 386.540 2.816 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)[C@@H]3COCCO3)cc2C(F)(F)F)C[C@@H](C)O1 170620830 YSEZLZFSBGFKMJ-OZVIIMIRSA-N 388.386 2.673 0 50 GFAA O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(n2ccnc2)CC1 170890270 SDDHZRCNQGACHR-UHFFFAOYSA-N 381.524 2.937 0 50 GFAA CC1(C)CCN(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)CCS1(=O)=O 194174288 LGHRKLQEUINUTL-OAHLLOKOSA-N 399.944 2.527 0 50 GFAA Cc1noc2nc3c(c(C(=O)Nc4c(N5CCCC5)nn(C)c4C)c12)CCC3 1529194568 ADAWKGRCLCHXNJ-UHFFFAOYSA-N 380.452 2.914 0 50 GFAA COc1ccc(CN2CCOC[C@H](C(=O)O)C2)cc1OCc1cccc(F)c1 1772808717 ZLFPXDJIWGDBLX-QGZVFWFLSA-N 389.423 2.946 0 50 GFAA Cn1cc(-n2nc(C3CCOCC3)nc2-c2cn3cc(Cl)ccc3n2)cn1 1772814079 ITBYQJVRFMTDTH-UHFFFAOYSA-N 383.843 2.863 0 50 GFAA O=C(NCc1ccncc1)c1ccc(N2CCCCS2(=O)=O)cc1Cl 5381142 ZLRZZFMVJBWNHX-UHFFFAOYSA-N 379.869 2.595 0 50 GFAA O=C(NC1CCCCCC1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 11874130 STTNIRJWNFKGEX-SFHVURJKSA-N 375.557 2.938 0 50 GFAA O=C(NCCN1CCNC1=O)c1ccc2oc(CCCc3ccccc3)nc2c1 12074065 HLTUEOYDUXPQTN-UHFFFAOYSA-N 392.459 2.758 0 50 GFAA CCCCn1c(CN2CC[C@@H](COC)C2)cnc1S(=O)(=O)CC1CCC1 15071626 UWGHPSOCTDQZFZ-QGZVFWFLSA-N 383.558 2.725 0 50 GFAA Cc1cccc(Cc2c(C)[nH]c3[nH]n(-c4nc(C)cc(C)n4)c(=O)c3c2=O)c1 18063691 GOBULNRMJTYBDA-UHFFFAOYSA-N 375.432 2.622 0 50 GFAA CC(=O)NC[C@H]1[C@H]2CN(Cc3cccc(F)c3C(F)(F)F)C[C@]23CC[C@H]1O3 1857712788 SNPBWKJWWXVUNP-GARXJVFOSA-N 386.389 2.960 0 50 GFAA CCCC1(NC(=O)[C@H]2CC(=O)N(c3nnc(Cc4ccccc4)s3)C2)CC1 1857716979 HPIVTZDALUKBRQ-HNNXBMFYSA-N 384.505 2.931 0 50 GFAA CCOC(=O)CCNC(=O)C[C@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857718098 NSJJMXKXHKTLKB-CQSZACIVSA-N 389.452 2.512 0 50 GFAA CC(=O)c1ccc(N2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)nc1 1857727556 TYUACDZBJLDBRX-JZJXAQOMSA-N 385.508 2.820 0 50 GFAA Cc1c(Cl)c(C(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)nn1C 421500094 CPZHJCWJTHFPPF-AWEZNQCLSA-N 396.825 2.581 0 50 GFAA C[C@@H](c1nccs1)N1CCN(C(=O)c2csc(-c3cnn(C)c3)n2)CC1 329689534 CPRZTKFFGWSQIM-LBPRGKRZSA-N 388.522 2.519 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@]3(C)CCO[C@H]3C3CC3)nn2C)cc1OC 935367544 SHTWHCKHURMOPS-PZJWPPBQSA-N 385.464 2.792 0 50 GFAA CCc1ccc(N2C(=O)NC(=O)[C@H](Cc3ccc(OC)c(OC)c3)C2=O)cc1 1067809 CLCFTJMOSFZBJZ-INIZCTEOSA-N 382.416 2.708 0 50 GFAA Cc1ccc(N(CC(=O)NCc2ccccn2)S(=O)(=O)c2ccccc2)cc1 778589 HOHRDJBJQDXSIZ-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA O=C(Nc1ccc(Cl)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 1518092 LXPOTYIZKUSUPH-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N(C)[C@@H]3C[C@@H]4CNC(=O)C[C@@H]4C3)c2)n1 2356136882 ADXXZIKWVKUOEO-ZCNNSNEGSA-N 380.492 2.535 0 50 GFAA COCCCNC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 2837846 KINKWBWTXHXHJA-UHFFFAOYSA-N 376.478 2.586 0 50 GFAA O=C(CSc1nc(O)cc(=O)n1-c1ccccc1)N1CCc2ccccc21 2859698 YKRQOXKXOSASAY-UHFFFAOYSA-N 379.441 2.620 0 50 GFAA COc1ccccc1N1C(=O)C[C@@H](SCC(=O)Nc2ccc(F)cc2)C1=O 2861136 AFEBEZGLZIQIHP-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)c1nnc(NC(=O)c2ccccc2)s1 6818408 NHSDRRAMZAULJE-UHFFFAOYSA-N 388.474 2.611 0 50 GFAA C[C@]1(C(=O)NCCN2CCc3sccc3C2)CCCN1C(=O)c1ccccc1 116734152 DBTBUOQSUFVOHD-JOCHJYFZSA-N 397.544 2.917 0 50 GFAA O=C(NCc1ccccc1)C1CCN(S(=O)(=O)Cc2ccc(F)cc2)CC1 24609711 GEKLBVQVMFREPG-UHFFFAOYSA-N 390.480 2.684 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN(C)CCc3cn[nH]c3)C2=O)cc1 67981741 YUGCANHZBLLZKN-JOCHJYFZSA-N 384.524 2.561 0 50 GFAA O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)N1CCC[C@@H](N2CCNCC2=O)C1 249108652 ANAYRIZGINRFFV-VNQPRFMTSA-N 396.318 2.520 0 50 GFAA O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)N[C@H]1CCN(CC(F)(F)F)C1 252458471 KBEHLFOPQVPXOI-HIFRSBDPSA-N 388.409 2.588 0 50 GFAA COc1ccc2c(C(=O)N(C)Cc3nonc3C)cc(-c3cnn(C)c3)nc2c1 63844962 NZRLPLNAHACFAP-UHFFFAOYSA-N 392.419 2.608 0 50 GFAA Cc1cc(NC(=O)CSc2nnc(-c3ccc[nH]3)n2-c2ccccc2)no1 328599679 SVDZJCCNAMLRNU-UHFFFAOYSA-N 380.433 3.290 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)C1(N2CCOCC2)CCCCC1 216433513 VRPZWIUOOFBWOK-UHFFFAOYSA-N 382.508 2.583 0 50 GFAA NC(=O)[C@@H](NC(=O)NC[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1 363663832 GSLYTCAFJGNPHA-BEFAXECRSA-N 384.455 2.568 0 50 GFAA COCc1nc2ncc3c(=O)n(-c4ccc(Cl)cc4Cl)ccc3n2n1 71385324 BYPKGAFFQMAWRT-UHFFFAOYSA-N 376.203 2.882 0 50 GFAA COc1cccc(OC[C@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCC4)C2)c1 72422330 KJPDMZBXEAKWIT-HNNXBMFYSA-N 382.460 2.803 0 50 GFAA O=C(NCc1ccccc1F)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 31688789 XIJMYMPXBJIXSL-UHFFFAOYSA-N 390.480 2.684 0 50 GFAA O=C([C@@H]1Cc2ccccc2S1)N1CCN(c2ncnc3ccccc23)CC1 72428139 WPNVCAXNFFOJGM-IBGZPJMESA-N 376.485 2.995 0 50 GFAA O=S1(=O)CCC[C@@H](CS(=O)(=O)N2CCC[C@@H]2CCC2CCCCC2)C1 333375402 DUITZYXTVRHPOW-QZTJIDSGSA-N 391.599 2.966 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1ccccc1Cl)CC(=O)N2 33011456 HFKQOBZSTCJBGT-LBPRGKRZSA-N 379.811 2.746 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)cc1 72139179 AWUXRRCOACYXEH-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA O=C(Cn1c(Cc2ccccc2)nn(-c2ccccc2Cl)c1=O)N1CCCC1 77389556 YPBABMXPGBGQIE-UHFFFAOYSA-N 396.878 2.901 0 50 GFAA Cc1[nH]c(C(=O)N2CC3(CCCC3)c3cccc(F)c32)c(C)c1S(N)(=O)=O 241301019 LPSATUINPCLKSV-UHFFFAOYSA-N 391.468 2.890 0 50 GFAA CN(CC(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)S(=O)(=O)c1ccc(F)cc1 242339188 ZFRDOOZVMDEQHL-YQQAZPJKSA-N 382.501 2.921 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@@H]1COCC[C@@H]1OCC1CC1 223849957 ZMEOFOJUONCHAG-RTWAWAEBSA-N 383.492 2.732 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)Nc1ccc(C[C@@H]3CC(=O)NC3=O)cc1)CCO2 287242871 SWIQLKIIDBLXDH-MRXNPFEDSA-N 393.443 2.627 0 50 GFAA CCCOc1c(CN2CCC(CNS(C)(=O)=O)CC2)cccc1OCC 289348206 ITNDMLNBWFHWLX-UHFFFAOYSA-N 384.542 2.635 0 50 GFAA CCc1cc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)no1 82127264 ZDRMMOZFGUXBOW-NRFANRHFSA-N 382.464 2.677 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)N[C@@H](CCn1cncn1)c1ccccc1 426613582 HAXYFHQEPOCYLZ-IBGZPJMESA-N 381.484 2.634 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C(=O)C3(C)CC3)CC2)c(Cl)c1 95501611 KETPWYNPJIYCPH-UHFFFAOYSA-N 394.899 2.886 0 50 GFAA Cc1nnsc1C(=O)N1CCC[C@H](CNC(=O)c2cc3ccccc3[nH]2)C1 95513396 HDONZNBUZVTSKY-CYBMUJFWSA-N 383.477 2.610 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)N2CC[C@@H](N)C2)cc1 237399968 QLPJRUKZLWXITH-GOSISDBHSA-N 376.460 2.650 0 50 GFAA CC(C)C[C@H](NC(=O)[C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1)C(=O)O 238901813 MVJMLJLSYBIQBG-BXWFABGCSA-N 399.491 2.818 0 50 GFAA CCN(C[C@H](O)c1cccc(O)c1)C(=O)NCc1ccc2c(c1)OCCCO2 426632963 YGHVEZHXFMPCJC-SFHVURJKSA-N 386.448 2.819 0 50 GFAA CC(C)SCC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91707517 ZZANCBXAOJADEX-UHFFFAOYSA-N 375.538 2.954 0 50 GFAA COCc1cc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)ccc1OC 23375502 RDLHVRFBBSKBMX-QHCPKHFHSA-N 398.547 2.953 0 50 GFAA Cc1ccn(CC(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n1 95356291 INLFLALTMILQAW-ZLGUVYLKSA-N 386.446 2.559 0 50 GFAA COCCN1Cc2cc(C(=O)Nc3cc(C)ccc3OC)ccc2OCC1=O 263618063 RBTXORISLYFWHD-UHFFFAOYSA-N 384.432 2.623 0 50 GFAA COc1ccc(-c2cc3c(=O)n(C[C@H](O)c4ccc(OC)cc4)ccn3n2)cc1 263615804 FHBUSIRIPMVQDT-NRFANRHFSA-N 391.427 2.914 0 50 GFAA Cc1nn(C)cc1CN(C)[C@H](Cc1ccccc1F)C1CCN(CCO)CC1 299801570 ZKTFVSBVRANEBT-JOCHJYFZSA-N 388.531 2.615 0 50 GFAA CC[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)OCc1nnc2c(=O)[nH]ccn12 1875270165 DYLDEXOJPCHOHT-OAHLLOKOSA-N 384.436 2.616 0 50 GFAA COc1ccc([C@@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)cc1 1875397511 CJOUZNDBHNOSPN-SJLPKXTDSA-N 397.523 2.733 0 50 GFAA CCc1oc2ccccc2c1C(=O)N1CC[C@H](CNC(=O)c2cccc(O)n2)C1 1875310560 UNKWJHPOWPVCLI-CQSZACIVSA-N 393.443 2.988 0 50 GFAA CNc1nc(C)ccc1C(=O)N1CC[C@H](C2CC2)[C@@H]1c1nnc(O)n1C(C)C 1875401949 XDHBXYFFGIVOFH-GDBMZVCRSA-N 384.484 2.923 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)Cn2cnc3ccsc3c2=O)cc1 952873082 FXNGTEXQJYRMRB-LBPRGKRZSA-N 382.445 2.612 0 50 GFAA CCCc1noc(CN(C)C(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2C)n1 952962128 ARMWKHXTVVAECK-MRXNPFEDSA-N 386.452 2.720 0 50 GFAA Cc1cc(N)n(CC(=O)N(Cc2ccc(F)cc2)Cc2ccc3c(c2)OCO3)n1 952963329 JMLLBTITKMOHAL-UHFFFAOYSA-N 396.422 2.871 0 50 GFAA O=C(NCC1CCN(C(=O)Cc2c(F)cccc2Cl)CC1)[C@@H]1CCCO1 952967839 CENDOINSONGYGD-KRWDZBQOSA-N 382.863 2.555 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(c1ncnc(Oc3cccnc3C)c1C)C2 1565512532 CLTIWNKGELBDIN-ROUUACIJSA-N 383.496 2.828 0 50 GFAA CC1(C)CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2O)CC2(CCCC2)O1 189959933 OTXXHEXRXITEOG-QGZVFWFLSA-N 386.492 2.947 0 50 GFAA Cc1oc(-c2cc[nH]n2)cc1S(=O)(=O)N1CCC[C@@H](C(=O)CC(C)C)C1 1506414690 SIYNAWDFISDALI-CQSZACIVSA-N 379.482 2.994 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3nn(C)c4ccccc34)C1)CC2 1704345011 ZFLDEGZNDJWLGU-QFIPXVFZSA-N 390.491 2.550 0 50 GFAA CC1(C)NC(=O)N(CCOCCOc2ccccc2OCc2ccccc2)C1=O 5065616 LJJHLLILQYFGNH-UHFFFAOYSA-N 398.459 2.991 0 50 GFAA CC(C)NC(=O)C1CCN(C2CCN(Cc3cnn(C(C)C)c3)CC2)CC1 11879189 PULXEAIFHRZWDU-UHFFFAOYSA-N 375.561 2.665 0 50 GFAA Cc1ccc(CN(C)C[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)o1 12298204 MZBVHFJXSMFWPA-HXUWFJFHSA-N 378.419 2.852 0 50 GFAA COc1ccccc1/C=C(/NC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)O 12437204 AYYDDGSZHAXAIB-NTEUORMPSA-N 387.388 2.577 0 50 GFAA COc1ccccc1CCN[C@H]1CCc2c(c(C(=O)N3CCCCC3)nn2C)C1 14538087 JPWZPAMBZSBBFP-SFHVURJKSA-N 396.535 2.744 0 50 GFAA COc1ccc(-c2nc(CN3CCN(c4ncccn4)CC3)c(C)o2)cc1OC 14972823 DGQUCFWNCULBIK-UHFFFAOYSA-N 395.463 2.779 0 50 GFAA CC(C)CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cnc3ccccn3c2=O)C1 14981924 IRLZDFOZZMAWSU-IEBWSBKVSA-N 382.508 2.667 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4cccc(F)c4)c2=O)CCCCC3)no1 169763948 SVSXFJVRSNQPSE-UHFFFAOYSA-N 384.411 2.536 0 50 GFAA O=C(C[C@H]1NC(=O)N(CCc2ccccc2)C1=O)Nc1cc(F)c(F)c(F)c1 206232389 JPFNLRJCQBADRU-OAHLLOKOSA-N 391.349 2.596 0 50 GFAA O=C1[C@H](n2cc(CNc3nccs3)nn2)CCN1c1c(F)cccc1F 1857527125 IMJJWOCJLCHEPE-CYBMUJFWSA-N 376.392 2.603 0 50 GFAA O=C(CCc1ccccn1)N[C@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@@H]1O 1857527364 UVFIXLCRAAQSRP-QMMLZNLJSA-N 390.487 2.834 0 50 GFAA Cc1cc2c(cc1C(=O)N[C@@H]1C[C@H]3CO[C@@H](c4ccccc4)CN3C1)OCCO2 1857694759 WQXJTDIDVKEYIE-KGVIQGDOSA-N 394.471 2.710 0 50 GFAA CC(C)=CCN1CCC2(CC1)CN(C(=O)CCC(F)(F)F)C[C@@H]2C(=O)O 1857698969 CMTNORQXGZUSFY-CQSZACIVSA-N 376.419 2.920 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CC[C@@]23OC[C@@H](C(C)C)N2C(=O)C[C@@H]13 1857714890 RCJUMWUFKXLPGM-JKSBSHDWSA-N 394.475 2.583 0 50 GFAA Cc1n[nH]c(C)c1CCCNC(=O)[C@H]1CC(=O)N(c2nc3ccccc3s2)C1 1857722068 DBVXYDWVJFXLSM-AWEZNQCLSA-N 397.504 2.738 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCc4c(NC5CC5)nc(C)nc43)C2)cn1 1875244513 MTIYPZSTIDVZMU-QFIPXVFZSA-N 393.491 2.883 0 50 GFAA O=C([C@H]1CSCN1C(=O)c1cnc(OCC2CC2)c(Cl)c1)N1CCCC1 329618507 DYSJVLSTFJSUNC-OAHLLOKOSA-N 395.912 2.661 0 50 GFAA COc1ccc(-c2nc(C(=O)N3CCC[C@H](Cn4ccnn4)C3)cs2)cc1 124702104 NTNVWERMXJRMDD-AWEZNQCLSA-N 383.477 2.963 0 50 GFAA O=C(N[C@@H]1COc2c(Cl)cccc21)c1ccc(=O)n(-c2ccc(F)cc2)n1 365945730 JKHGEMGVFLHULO-MRXNPFEDSA-N 385.782 2.889 0 50 GFAA CC[C@](O)(C(=O)N1CCN(C(=O)c2ccco2)CC1)c1cccc(Cl)c1 800378380 IAHJCJAUMXURRS-LJQANCHMSA-N 376.840 2.515 0 50 GFAA C[C@H](CCO)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCC(=O)O)cc1 906911085 DBBWILVEUSWPIA-MRXNPFEDSA-N 391.489 2.666 0 50 GFAA Cc1cc(-c2nnc(N3CC[C@H](OC(F)F)C3)n2CC(C)C)c2ncnc-2[nH]1 2325769133 KFFRJLXQKQAWJJ-LBPRGKRZSA-N 391.426 2.950 0 50 GFAA Cc1cc(Br)cn2c(CN[C@H](Cc3ccoc3)C(=O)O)cnc12 2325791870 FLXNTGOHMILUOE-CQSZACIVSA-N 378.226 2.784 0 50 GFAA C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 878590706 WIPDQZAKWVKRSM-VLIAUNLRSA-N 391.475 2.542 0 50 GFAA CN1CCC(N(Cc2ccco2)C(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)CC1 124179774 NKMWESKMKXKGLH-SFHVURJKSA-N 385.439 2.968 0 50 GFAA Cc1cccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC(C)CC3)n2)c1 1857797811 VCSDVJOSQJPXGC-KRWDZBQOSA-N 393.491 2.905 0 50 GFAA O=C(NCc1ccccn1)c1ccc(OC2CCN(Cc3c[nH]cn3)CC2)cc1 12317647 ATOUGFYLCKLLKS-UHFFFAOYSA-N 391.475 2.778 0 50 GFAA Oc1ccc(-c2cnc3c(N4CCC(O)CC4)nccn23)cc1OC(F)(F)F 2356158712 WGWOZXGUFKTZDJ-UHFFFAOYSA-N 394.353 2.962 0 50 GFAA COCCCNC(=O)c1ccc(N(Cc2ccc(C)cc2)S(C)(=O)=O)cc1 2818216 HPHCFWWOANSHCX-UHFFFAOYSA-N 390.505 2.728 0 50 GFAA CCOC(=O)C(Sc1nnc2c3ccccc3n(CC)c2n1)C(=O)OCC 2831125 GRUQHCUGUXJBLD-UHFFFAOYSA-N 388.449 2.586 0 50 GFAA COc1ccccc1CCNC(=O)c1cc2c(s1)CCOC21CCNCC1 2356163367 ZKRALPDSYGMFBS-UHFFFAOYSA-N 386.517 2.881 0 50 GFAA Cc1ccccc1-n1c(=O)c2cc3c(=O)n(-c4ccccc4C)c(=O)c3cc2c1=O 4955120 DJXFKECZAVDAJT-UHFFFAOYSA-N 396.402 2.508 0 50 GFAA O=C(Nc1cccnc1)[C@H]1CCCN(c2ncnc3c2nc2n3CCCCC2)C1 6899838 OCKLQHLECHUIKW-HNNXBMFYSA-N 391.479 2.803 0 50 GFAA CC[C@@H](CO)N(Cc1ccccc1C)C(=O)Cn1cnc2ccccc2c1=O 55341650 FZHDPUQFTLJKNI-SFHVURJKSA-N 379.460 2.505 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)c2cccc(N3CCNC3=O)c2)C[C@H]1O 65405419 LKJMKWJQQVACAJ-IAGOWNOFSA-N 385.489 2.577 0 50 GFAA O=C(NCc1ccco1)c1ccc([C@H]2CCCN2C(=O)Cn2ccnc2)s1 23192599 NLVBTKUEMZAQTF-OAHLLOKOSA-N 384.461 2.831 0 50 GFAA NC(=O)CCN1CCN(Cc2c[nH]nc2-c2ccc(-c3ccccc3)cc2)CC1 20777238 YVFOOAVLSJTKMM-UHFFFAOYSA-N 389.503 2.737 0 50 GFAA COc1cc(NC(=O)[C@H]2CC(=O)Nc3nc4ccccc4n32)cc(OC)c1OC 8996388 NRMJSMJPZKRXPX-CQSZACIVSA-N 396.403 2.584 0 50 GFAA Cc1cc([C@@H](C(=O)O)N(CCN2CCOCC2)Cc2ccco2)ccc1F 63856433 ODXZSCRPCAJGNG-IBGZPJMESA-N 376.428 2.687 0 50 GFAA C[C@H](Cn1cncn1)C(=O)N1CCC(c2[nH]ncc2-c2cccc(F)c2)CC1 67872827 LLCZVQXXRFRRFR-CQSZACIVSA-N 382.443 2.850 0 50 GFAA CCN1CCC[C@H]1CN(C)C(=O)N[C@H](c1ccccc1OC)c1nccn1C 363592791 LDWIXMYFRNGWQT-QFBILLFUSA-N 385.512 2.644 0 50 GFAA NC(=O)[C@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)c1ccc(F)cc1 363820249 MLLFWLGIDKDGDF-LJQANCHMSA-N 390.503 2.696 0 50 GFAA CC(C)n1ccnc1CN1CCCN([C@@H](C)C(=O)N2CCCCCC2)CC1 370791368 VVKKOIDHCROMCJ-IBGZPJMESA-N 375.561 2.763 0 50 GFAA COc1ccc([C@H]2CC(O)=Nc3c2cnn3C2CCCC2)cc1OCC(N)=O 72115792 NWODOKSQEVTTTK-CQSZACIVSA-N 384.436 2.995 0 50 GFAA O=C(COc1ccc(Cl)c2cccnc12)N1CCC[C@H]1CN1CCOCC1 174475186 IKHZBAXYLLFGJJ-HNNXBMFYSA-N 389.883 2.590 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCn2cncc2C1 72121913 BNOWFCYLJJYXMB-UHFFFAOYSA-N 381.457 2.513 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)Nc3cnc4c(c3)COCC4)CC2)cc1 374883627 SLZRPORNMAHYQJ-UHFFFAOYSA-N 396.491 2.903 0 50 GFAA CSc1cccc(CN2CCOC[C@H]2CC(=O)NCCc2ccncc2)c1 72422655 RORCFNKTPUBBMT-LJQANCHMSA-N 385.533 2.753 0 50 GFAA C[C@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1)[C@@]1(C)CCCO1 239636960 BHUSKJQLELFQKN-KMGZYFLFSA-N 396.535 2.998 0 50 GFAA CC[S@](=O)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(-c2nnc(S)o2)cc1 241588500 PDSACGQHCXUTRE-IEBYYPBYSA-N 379.507 2.835 0 50 GFAA C[C@H]1CCCN(c2cc(C(=O)NCCc3cccc(C(=O)N(C)C)c3)ccn2)C1 291838354 BMRNBKZTTIBBEY-KRWDZBQOSA-N 394.519 2.992 0 50 GFAA NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCn2ccnc2)cc1 177079212 WTWNGZAPDMIZTH-UHFFFAOYSA-N 379.420 2.986 0 50 GFAA CN1CCN(c2ccc(C(=O)N(C)Cc3nc4ccccc4n3C)cc2)CC1 223942519 BMJMSRXIUIKOPL-UHFFFAOYSA-N 377.492 2.597 0 50 GFAA CN(CCN1CCCCC1=O)C(=O)c1cccc(-c2ccccc2C(N)=O)c1 426727312 CFBPJVXZOLRQGN-UHFFFAOYSA-N 379.460 2.537 0 50 GFAA CC(C)C(=O)N1CCn2nc(CNC(=O)c3scc4c3CCCC4)cc2C1 426612352 IMUXPPZXNIGSRC-UHFFFAOYSA-N 386.521 2.752 0 50 GFAA Cc1cc(C(F)(F)F)nn1CC(=O)NCCc1ccn(-c2ccc(F)cc2)n1 290974974 ZIVZEPMEUPDUNL-UHFFFAOYSA-N 395.360 2.894 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2ccnnc2)C1)NCc1ccc(F)c(F)c1 95497405 CVBILJRRQAKKCO-CQSZACIVSA-N 388.418 2.704 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)N1CCCN(c2ccccc2)CC1 95508696 BILKKIOUDJWMHI-FQEVSTJZSA-N 377.488 2.741 0 50 GFAA Cc1nc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)cs1 95375576 UNMDFQBLCWCSRU-UHFFFAOYSA-N 398.532 2.934 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)N(C)Cc2ncc(Cl)n2C)C1 181495030 XNSZORJRUIDARR-CYBMUJFWSA-N 377.876 2.502 0 50 GFAA CC1([C@H]2CCCN(C(=O)NC3CCN(Cc4ccccc4)CC3)C2)OCCO1 182463820 XLMYMLCAICGCSY-IBGZPJMESA-N 387.524 2.836 0 50 GFAA C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CCCN3Cc3ccccc3)cn2)CCO1 299152711 NJEQFOVTBTUYPL-WIYYLYMNSA-N 394.519 2.588 0 50 GFAA CCOc1ccc(C[C@@H](CNC(=O)c2ncoc2[C@@H]2CCCO2)C(=O)O)cc1 299753728 ZDQFHPQUBRKIPF-HOCLYGCPSA-N 388.420 2.598 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)c2nnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)C1 299740711 BHFQHIQIOFNRTO-LLVKDONJSA-N 394.353 2.710 0 50 GFAA CSCC[C@H](C(=O)N1CCN(Cc2c(C)noc2C)CC1)n1cccc1 263588595 WBLCIQWTPKGYKT-GOSISDBHSA-N 376.526 2.732 0 50 GFAA Cn1ncc2ncc(C(=O)N[C@@H]3COC[C@H]3Cc3ccnc4ccccc34)cc21 1940198026 IKIWBKDWLYMNCA-OXQOHEQNSA-N 387.443 2.504 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccc2ccccc2n1 827968293 OCXPPIDOJLWKRT-UHFFFAOYSA-N 391.427 2.725 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3cncc(Br)c3C)CCN2)c1 870154283 IPRDOSHARHVFHZ-QGZVFWFLSA-N 390.281 2.948 0 50 GFAA O=C(OCc1cc(F)cc(-c2cccnc2)c1)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2 1875293447 QRXTYLFKUIDTAL-DCXXXQMHSA-N 383.375 2.652 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N1CC[C@H](CCC(=O)O)C1 1875300594 JTXFODDENAIWMU-MFKMUULPSA-N 375.391 2.879 0 50 GFAA C=CC(=O)N1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2cnn(C(C)C)c2)Cc2ccccc21 1875389600 UWNDWPJMTYQYQI-GUDVDZBRSA-N 378.476 2.828 0 50 GFAA CC(=O)N1CCc2ccc(-c3ccc(S(N)(=O)=O)c(C(F)(F)F)c3)cc2C1 1875304430 KDEPFHHJNFLZPJ-UHFFFAOYSA-N 398.406 2.924 0 50 GFAA COCC[C@@H]1CNCCN1C(=O)c1cc(-c2ccccc2C(F)(F)F)no1 1875315587 AHCMEMBMUYZENX-GFCCVEGCSA-N 383.370 2.811 0 50 GFAA C[C@H](NC(=O)C1=NO[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1cncs1 889505783 AUPGTZBHUDKJQS-SGTLLEGYSA-N 394.497 2.866 0 50 GFAA O=C(c1cccc2[nH]cnc12)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 275732972 UVAHUSCHZHCTAZ-HNNXBMFYSA-N 377.448 2.852 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)Cc1cc(C)[nH]n1)CC2 275814268 VPRFRPZNFNHGBL-SFHVURJKSA-N 386.521 2.752 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)Cc2nnc[nH]2)cc1 170636156 AWWZOBJVFBMPQP-UHFFFAOYSA-N 388.431 2.938 0 50 GFAA CCN(CC)C(=O)c1sc2ncn(C[C@@H]3CCCC[C@@H]3O)c(=O)c2c1C 212422709 DPEAAUDVHAZFQE-KBPBESRZSA-N 377.510 2.800 0 50 GFAA COc1cc(I)c(I)cc1OC 4798986 FFMFMRCSTBQCTI-UHFFFAOYSA-N 389.958 2.913 0 50 GFAA in-vitro CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@@H](NC(=O)c2cccs2)C1 11817324 LWHRASUASFFHHR-HNNXBMFYSA-N 386.521 2.943 0 50 GFAA C[C@@H]1CS(=O)(=O)N(c2cccc(C(=O)NCCC3=CCCCC3)c2)C1=O 12002686 KVWXLLRFDSZXNP-CQSZACIVSA-N 376.478 2.619 0 50 GFAA CN(C)CC(=O)N[C@@H]1CC(C)(C)Cc2nc(N(C)Cc3ccccc3)ncc21 12470672 MYXCJQZYVYHFAT-GOSISDBHSA-N 381.524 2.804 0 50 GFAA CCc1c(C(=O)N2CCN(S(=O)(=O)c3cccs3)CC2)csc1C 13745144 XZERLJQDGSRLST-UHFFFAOYSA-N 384.548 2.827 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1 19789252 FIILFJBXWCRCPA-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA COC(=O)C[C@@H](c1ccc(OC(C)C)cc1)c1c(O)n2ccccc2nc1=O 205948750 BCJPQQHPGQQEQM-INIZCTEOSA-N 382.416 2.882 0 50 GFAA O=C(O)c1cc(N2C[C@H](O)[C@]3(C2)[C@H](c2ccccc2)[C@H]3CO)nc2ccccc12 1857718287 RTCHSZNWOZKAAS-GUBFDYSESA-N 390.439 2.506 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)NS(=O)(=O)Cc1cccc(F)c1F 842872706 GSRLKLKDEXVZCB-INIZCTEOSA-N 381.400 2.615 0 50 GFAA CCOC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)OCC)[C@@H]1c1ccc(Cl)cc1 4016851 SNYBQIIVGREIAE-NNFUDEMPSA-N 382.840 2.506 0 50 GFAA in-vitro Cc1c(NCc2nnc(-c3ccccc3)n2C)cccc1S(=O)(=O)NC1CC1 125692887 GQXFSLAEQMIDCN-UHFFFAOYSA-N 397.504 2.843 0 50 GFAA CCN(CC)C(=O)c1cn([C@@H]2CCCN(Cc3ccc(NC(C)=O)cc3)C2)nn1 14976836 KYYJNJCKBCKUGO-LJQANCHMSA-N 398.511 2.556 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CSCCS1)C2 826753045 KQUYPTCTPUDGOG-AJNGGQMLSA-N 386.583 2.987 0 50 GFAA O=C(NCCCCc1ccccc1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1 2999451 VYSMTOZAAFQCCN-FQEVSTJZSA-N 386.517 2.979 0 50 GFAA O=C(CCc1ccc2ccccc2n1)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785688 JDPAJZFZPOMVHK-JSNMRZPZSA-N 398.894 2.973 0 50 GFAA c1cc(Sc2nnnn2C2CCOCC2)nc(-n2cnc3ccccc32)c1 2325790476 NZZPGNPPHAERHH-UHFFFAOYSA-N 379.449 2.910 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccc(Cl)c2)S(C)(=O)=O)cc1OC 652555 QQJUDLBKFZHRNN-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CCN(CC)S(=O)(=O)c1csc(C(=O)OCC(=O)c2ccccc2)c1 1138572 RIGQZWYXKOFOJX-UHFFFAOYSA-N 381.475 2.818 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4F)CC3)C2)n1 55211770 KBBXRYXZAQAMFB-GOSISDBHSA-N 382.483 2.956 0 50 GFAA C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C[C@H]1COc2ccccc2O1 248006250 OPBSCUMSGVPVTO-HOTGVXAUSA-N 395.459 2.522 0 50 GFAA C[C@@H]1CCC[C@@H]2CCCN(C(=O)CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)[C@@H]12 248333784 KNCPRYOJDOYNGA-NPDZVAPOSA-N 395.503 2.807 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(C)c(C)c3)CC2)cc(-n2ccnc2)n1 65362237 UZKHDNKHSSHECF-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=C(C[C@@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O)Nc1ccccc1 170625652 QCTLGECNXOINQV-SFHVURJKSA-N 376.416 2.660 0 50 GFAA CN(Cc1cccnc1)C(=O)[C@H]1C[C@@H](C(=O)O)N(C)[C@H]1c1cccc(Cl)c1 67771667 GCUXKKHXOZVQPQ-BZSNNMDCSA-N 387.867 2.840 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1Cc2ccc(-c3cccc(S(N)(=O)=O)c3)cc2C1 863714112 WPINMUWWTHCEFQ-QGZVFWFLSA-N 388.489 2.993 0 50 GFAA COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)N[C@@H]2CCNC2)c1 127021355 KSLJLCSAUKQCRM-OAHLLOKOSA-N 392.459 2.648 0 50 GFAA O=C(c1cccc(CN2CCOCC2)c1)N(CCO)Cc1ccc(Cl)cc1 252487915 IEFXQNORCRJDIL-UHFFFAOYSA-N 388.895 2.807 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3cc(C(C)=O)n[nH]3)CC2)OC1=O 77408323 FQADEJXNHSNFPW-UHFFFAOYSA-N 376.457 2.620 0 50 GFAA Cc1nc(C)n(C[C@@H](C)C(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)n1 72409057 QQXLCASNPRDWKL-YPKGZJBQSA-N 385.556 2.644 0 50 GFAA O=C(CCN1CCCCC1=O)N[C@H]1CCCc2c1cnn2-c1ccccc1F 12704849 IGTKIOYTJGOEQA-KRWDZBQOSA-N 384.455 2.908 0 50 GFAA COc1cc2c(cc1-c1nccn1C[C@H]1CCCN(S(C)(=O)=O)C1)CCC2 77321617 CHJJXNKZZMQICV-OAHLLOKOSA-N 389.521 2.719 0 50 GFAA O=C(Nc1cnn(-c2ncccn2)c1)NC1CCN(Cc2ccc(F)cc2)CC1 156275879 XOVNWHCCJWEUOG-UHFFFAOYSA-N 395.442 2.588 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1ncccc1OCC(F)(F)F 156610215 IZMRZJGLSQNYFJ-CQSZACIVSA-N 399.413 2.934 0 50 GFAA O=C(NCCCc1nnc2ccccn12)c1cnc2cc(Cl)ccc2c1O 218213390 YSMVJJARQYMHIF-UHFFFAOYSA-N 381.823 2.999 0 50 GFAA CSCC[C@H](C(=O)Nc1nc(C)c(C)s1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 241277573 LHFPNBBPTJRWSX-MGPQQGTHSA-N 395.550 2.995 0 50 GFAA O=C(NC[C@H]1CN(Cc2ccccc2)CCCO1)N1CCC(c2ccn[nH]2)CC1 190733427 MAOUJDKXWTUBHQ-FQEVSTJZSA-N 397.523 2.590 0 50 GFAA C[C@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)Cc1cnc2ccccn12 82120294 HKDOIIHDUXXFFL-AWEZNQCLSA-N 382.851 2.794 0 50 GFAA COc1cc(-c2ccccc2)sc1C(=O)N1CCN(c2cnn(C)c2)C(=O)C1 177836109 AJTBFWPCPDZFDK-UHFFFAOYSA-N 396.472 2.646 0 50 GFAA Cn1ccnc1[C@H](O)c1cc2n(n1)CCN(Cc1cc(F)cc(Cl)c1)C2 223260205 NNOXGCZNORZHCC-QGZVFWFLSA-N 375.835 2.507 0 50 GFAA Cc1nc(-c2cccs2)sc1C(=O)N1CCN(C[C@H]2CCOC2)CC1 178087339 KCDRWFIIDYKENR-CQSZACIVSA-N 377.535 2.974 0 50 GFAA CCc1ncc(CN2CCC3(CC2)CCN(Cc2ccoc2)C[C@@H]3CO)cn1 97527795 CVBPYJLKCVOCQF-HXUWFJFHSA-N 384.524 2.729 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)N2CCn3c2nc2cc(C)c(C)cc23)cc1 334162603 CEULCHJABUIFTI-UHFFFAOYSA-N 384.461 2.880 0 50 GFAA COc1ccccc1-n1cc(C(=O)NC[C@@H]2Cc3ccccc3CN2C)cn1 91662965 BHXCTGXNPMPOAB-IBGZPJMESA-N 376.460 2.667 0 50 GFAA CN(C)C[C@H](c1ccccc1)N(C)C(=O)c1cnc(-c2ccccc2)[nH]c1=O 91664627 BVZGWOYEGADNSR-LJQANCHMSA-N 376.460 2.812 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)c2c(C)cc(C)[nH]c2=O)C3)c1 96139354 CNMFBIGZJFIDPO-UHFFFAOYSA-N 378.432 2.589 0 50 GFAA Cc1cc(C2CCC2)nc(-c2ccc(C(=O)NCCc3ncnn3C)cc2)n1 534655100 ZWHNSHACBUTIJU-UHFFFAOYSA-N 376.464 2.821 0 50 GFAA Cc1nonc1CN(C)C(=O)c1cc([C@@H](C)Cc2ccc3c(c2)OCO3)no1 299782501 GAOMRSTUBXNFES-NSHDSACASA-N 384.392 2.713 0 50 GFAA O=C(N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCC2(CCCO2)CC1 584900590 PHTMXWRBLWPXLM-CQSZACIVSA-N 377.872 2.800 0 50 GFAA CCOc1ccc(CCCNC(=O)N2CCN(C(=O)c3ccc[nH]3)CC2)cc1 584890575 CDOVYPCYDCRXIW-UHFFFAOYSA-N 384.480 2.514 0 50 GFAA Cc1cc(CNC(=O)[C@H]2Cc3c(cnn3C)N(C(=O)OC(C)(C)C)C2)cc(C)n1 1875295188 SQXSMLFMCHSRBW-INIZCTEOSA-N 399.495 2.662 0 50 GFAA O=C([C@@H](Cc1ccc(F)cc1)c1ccccc1)N1CC[C@@](CCO)(C(=O)O)C1 1875313921 XYNOFRIUDSATHP-UGKGYDQZSA-N 385.435 2.838 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]2C)n1 1875309968 WQMIQOSWHUTXGF-UONOGXRCSA-N 397.454 2.804 0 50 GFAA CCOc1cccc(C(=O)NCC2CCN(C(=O)[C@@H](O)c3ccccc3)CC2)c1 952979690 FFLDATISHFMSED-NRFANRHFSA-N 396.487 2.787 0 50 GFAA COc1ccc(CN2C[C@H]3c4ccc(OC)cc4OC[C@@]3(C(=O)O)C2)c(F)c1 1565526780 MTYZEVPNYYTKGD-UWJYYQICSA-N 387.407 2.906 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O 170091709 XDURUSXDDGFTMN-HNNXBMFYSA-N 385.351 2.853 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1ccc(O[C@@H]2CCOC2)cc1 279108701 YIERTZGQMWDGBL-OAQYLSRUSA-N 381.476 2.644 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)NCc3cnn(Cc4ccccc4)c3)C2)n1 194474350 MEJGSMKXVOXCJI-GOSISDBHSA-N 380.452 2.712 0 50 GFAA CCC1=NO[C@H](CN2CCC(CNC(=O)c3c(OC)cccc3OC)CC2)C1 1506417506 LCLUCLNWBQSZIZ-KRWDZBQOSA-N 389.496 2.701 0 50 GFAA O=C(c1cnc2ccccc2n1)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529101184 AXGYFHGBNQFNNU-OPAMFIHVSA-N 384.439 2.854 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N[C@H]2CCCN(C)C2)cc1 1704304281 CJOCCAIFVSCEJU-INIZCTEOSA-N 384.480 2.774 0 50 GFAA Cn1cncc1CN1C[C@@H]2CN(C(=O)c3csc(-c4ccccc4)n3)CC[C@@H]21 1775982949 VVPLVJOVJSGJEC-LPHOPBHVSA-N 393.516 2.890 0 50 GFAA CC1(C)O[C@@H]2O[C@H](COC(=O)c3ccccc3Cl)[C@@H]3OC(C)(C)O[C@H]3[C@H]2O1 5043351 LBWVFYWBICENNB-YCCFLXJFSA-N 398.839 2.893 0 50 GFAA COc1cc(C(=O)NCCCOC(C)C)ccc1OC1CCN(C(C)=O)CC1 11708630 KCMJTVPYPHBVOT-UHFFFAOYSA-N 392.496 2.630 0 50 GFAA COC(=O)[C@@H](NC(=O)c1coc(COc2cccc3cccnc23)n1)C(C)C 11753989 DTTVPTWYHJCQGT-KRWDZBQOSA-N 383.404 2.729 0 50 GFAA COCCN[C@@H]1CCc2c(sc3ncn(Cc4ccc(F)cc4)c(=O)c23)C1 11872042 RARUXQZHGCQNAR-OAHLLOKOSA-N 387.480 2.739 0 50 GFAA Cc1c(C(=O)N(C)Cc2ccco2)sc2ncnc(N3CCN(C)CC3)c12 12330462 QYANUPSLHIVNAI-UHFFFAOYSA-N 385.493 2.617 0 50 GFAA Cc1nc2ncccn2c1C(=O)N(C)[C@H]1CCCN(CCc2ccccc2)C1 12433527 PQBSYMAGCHEWBA-IBGZPJMESA-N 377.492 2.817 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)c1cn(Cc2ccccc2Cl)nn1 12445165 PSRTZKGDMZXVJV-UHFFFAOYSA-N 384.871 2.854 0 50 GFAA CC(C)N1CCC(N2CCC[C@H](C(=O)NCc3cn4ccsc4n3)C2)CC1 15066935 IHXQJMOEUVHKKQ-INIZCTEOSA-N 389.569 2.597 0 50 GFAA CC1CCN(S(=O)(=O)c2cc(C(=O)NCc3ccco3)ccc2F)CC1 16622898 XLMOTGFNBFTAKJ-UHFFFAOYSA-N 380.441 2.769 0 50 GFAA O[C@@H](CN1CCNCC1)Cn1c2ccccc2c2cc(Br)ccc21 19288089 XVXPAKUWKWBDDA-HNNXBMFYSA-N 388.309 2.823 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)N3CCC(OC)CC3)cc12 1857693309 QXQBFWXCTOFZGB-UHFFFAOYSA-N 378.538 2.883 0 50 GFAA CC(C)c1nnc(N2C[C@H](C(=O)NCCCOC3CCCCC3)CC2=O)s1 1857711716 DGNIPZIKJZSQKR-CQSZACIVSA-N 394.541 2.870 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCc2ccc(C)c(C)c2)C[C@H]1NC(=O)c1ccc[nH]1 1875240455 SMNRWKAJMKOJHC-DFQSSKMNSA-N 383.492 2.861 0 50 GFAA C[C@H](N)[C@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2Br)C1=O 262743332 JPWMAGHQRAHVDJ-GZBFAFLISA-N 394.313 2.530 0 50 GFAA O=C(Cc1coc(-c2ccc(Cl)cc2)n1)Nc1cnn(CC(=O)NC2CC2)c1 264238425 KUTXAGJTOAEXQN-UHFFFAOYSA-N 399.838 2.651 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(Br)c1 4113627 VYEOTFUHABBIMZ-CQSZACIVSA-N 383.242 2.657 0 50 GFAA CCc1ncc(CNC(=O)c2cn3cc(Cl)cc(Br)c3n2)[nH]1 2325856782 BVPIVNHQDAZXPG-UHFFFAOYSA-N 382.649 2.966 0 50 GFAA CCc1ccc(N([C@@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2ccccc2)cc1 1077574 KXAKABIBRZJVRC-QGZVFWFLSA-N 377.487 2.755 0 50 GFAA CCOC(=O)Cc1nnc(NC(=O)CSc2nc3ccccc3s2)s1 2783373 CKQIMLNQAFMKCP-UHFFFAOYSA-N 394.503 2.984 0 50 GFAA CCCN1CCC(N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)CC1 4703378 MXBXTSWTXIQPJA-UHFFFAOYSA-N 385.961 2.521 0 50 GFAA CCOC(=O)c1c(N)sc2c1C[C@@H]1C(=O)N(C3CCCCC3)C(=O)[C@@H]1C2 100589652 IVTNTJZTVUXIDR-NWDGAFQWSA-N 376.478 2.540 0 50 GFAA O=C(NC1CCN(Cc2ccc(CN3CCOCC3)cc2)CC1)c1ccsc1 420905328 RAVFKCXWBXLNJJ-UHFFFAOYSA-N 399.560 2.975 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCc3[nH]nc(-c4ccccc4)c3C2)nc(=O)[nH]1 67758227 HGUZXAFLKWZEJO-UHFFFAOYSA-N 377.448 2.557 0 50 GFAA O=C(NCCc1ccc(Cl)nc1)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 151204210 CYAWUZSRBDTZGB-GOSISDBHSA-N 385.895 2.875 0 50 GFAA O=C1O[C@@H]2CN(Cc3c[nH]nc3-c3ccccc3)C[C@@H]2N1Cc1ccccn1 67804956 NWOAKSPVHSWVLE-RBUKOAKNSA-N 375.432 2.677 0 50 GFAA CC[C@@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C12CC3CC(CC(C3)C1)C2 6555366 ULXREXXJWKQMRF-ZVQXUQNISA-N 382.570 2.769 0 50 GFAA O=C(NC1CC1)C1CCN(C2CCN(C(=O)c3cccc(Cl)c3)CC2)CC1 77252003 SCVCLAZRWKIHSQ-UHFFFAOYSA-N 389.927 2.935 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CNS(=O)(=O)Cc3cc(Cl)ccc3F)O2)n1 328614608 WHRXCIIENKYTKJ-OCCSQVGLSA-N 389.836 2.510 0 50 GFAA CCOc1ccc(CN2CCN(C3CCCCC3)[C@H](CCO)C2)cc1CO 39387786 XICDBHDLDJWHRB-OAQYLSRUSA-N 376.541 2.779 0 50 GFAA Cc1cnn(C[C@@H]2CN(C(=O)Nc3cnn(-c4ccccc4F)c3C)CCO2)c1 157238713 FESOSWNALUMWOZ-INIZCTEOSA-N 398.442 2.758 0 50 GFAA CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccccc2S[C@@H](C)C(=O)O)C1 262393094 AQTUIKCYOIQPBK-LSDHHAIUSA-N 392.521 2.876 0 50 GFAA CC(C)[C@@H]1N(C(=O)NCc2cccc(N3CCOCC3)c2)CC12CCOCC2 334116159 HIZDTJNBKGXWEO-FQEVSTJZSA-N 387.524 2.870 0 50 GFAA COc1ccc(NC(=O)Cn2nc(-c3ccc(F)cc3OC)ccc2=O)cc1 49546770 IBTVARKALNUXNT-UHFFFAOYSA-N 383.379 2.705 0 50 GFAA Cc1ccc(N2CC[C@@H](Nc3cc(C(=O)N4CCOCC4)ccc3C)C2=O)cc1 177209813 WYSMXRPKMRBHKT-HXUWFJFHSA-N 393.487 2.993 0 50 GFAA CN(C)c1ccc(C(=O)N2CCn3nc([C@@H](O)c4ccccc4)cc3C2)cc1 222519517 YOBJJZLUYQSRHO-NRFANRHFSA-N 376.460 2.687 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)Cc1cccs1 40625577 JKRSMDOEVZEULQ-UHFFFAOYSA-N 380.491 2.722 0 50 GFAA Cc1cccc(-n2cc(CNC(=O)N3CCC[C@H](Cn4ccnc4)C3)cn2)c1 426386912 OHAWNFZMWZQUCK-GOSISDBHSA-N 378.480 2.999 0 50 GFAA CCN(CC)CC(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 426435089 YIXWHADXHOYYPX-OAQYLSRUSA-N 393.478 2.648 0 50 GFAA CCOC(=O)Cc1ccc(NC(=O)N2CCN(c3cccc(O)c3)CC2)cc1 95522941 LJVAFTNGICUCIM-UHFFFAOYSA-N 383.448 2.852 0 50 GFAA Cc1nc(N)sc1C(=O)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95499197 JFDIFIYTACJPMZ-LBPRGKRZSA-N 388.522 2.755 0 50 GFAA CC[C@@H]1CN(C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)CCN1 95525293 GMYJURCHRZXDFB-LJQANCHMSA-N 380.492 2.875 0 50 GFAA Cc1cc(C(=O)N2C[C@H](CO)[C@H](CN3CCCCC3)C2)c2ccc(F)cc2n1 91468862 PBNBPOMGCSAJTE-IAGOWNOFSA-N 385.483 2.849 0 50 GFAA CCn1nc(-c2csc(C)n2)nc1C1CCN(C(=O)[C@H]2CCCO2)CC1 96140783 NOPKIPLXUDCGHQ-OAHLLOKOSA-N 375.498 2.615 0 50 GFAA O=C1CCCN1C[C@H]1CCCN(c2ncnc3c2Cc2ccccc2OC3)C1 96148133 UPMMXUQYOZUDNA-MRXNPFEDSA-N 378.476 2.799 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccc(C[C@@H]4CCCNC4)cc3)CC2)CC1=O 95531086 IAAQYDDHNFXNQP-IBGZPJMESA-N 383.536 2.703 0 50 GFAA O=C(CCc1cncc(F)c1)N1CCC(C(=O)N2CCc3ccccc32)CC1 180877162 GFADSWIXVCERQQ-UHFFFAOYSA-N 381.451 2.981 0 50 GFAA CN1CCN(C[C@@H]2CN(Cc3ccc(-c4ccccc4)s3)C[C@@H]2CO)CC1 95365913 PCHWQNCEARXFDT-WOJBJXKFSA-N 385.577 2.703 0 50 GFAA CCc1n[nH]c(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)c1C 91548672 WMIRVFVYTCLZOF-UHFFFAOYSA-N 395.507 2.721 0 50 GFAA COCCN1CCC(CN(Cc2ccncc2)C(=O)c2csc(C)n2)CC1 95510725 NQBISLSRLCJFOC-UHFFFAOYSA-N 388.537 2.847 0 50 GFAA OC[C@H]1CN(C2CCN(c3ccccc3F)CC2)C[C@H]1CN1CCCCC1 91655847 OJTBWBMFVITGRR-RTBURBONSA-N 375.532 2.821 0 50 GFAA CCN1CCC[C@H]1Cn1c(=O)n(Cc2ccccn2)c2cc(C(=O)OC)ccc21 95528826 PAAXIHXJXANBPF-SFHVURJKSA-N 394.475 2.517 0 50 GFAA CC[C@@H](NS(=O)(=O)c1cccc(C(=O)N(CC)CC)c1)c1nc(C)c[nH]1 95352338 MUQSBIKXXVJTBH-MRXNPFEDSA-N 378.498 2.630 0 50 GFAA O=C([C@H]1CC(Cc2ccc3c(c2)OCO3)=NO1)N1CCC[C@H]1c1nccs1 299778729 NDNOURHHAHQBOJ-WMLDXEAASA-N 385.445 2.923 0 50 GFAA COc1ccc(C(=O)N[C@@H](c2nc(-c3nnc[nH]3)no2)C(C)C)cc1Cl 293424924 IAXPPNFQZLNBPD-GFCCVEGCSA-N 376.804 2.644 0 50 GFAA Cc1c(NC(=O)CN2C[C@H](c3ccccc3)CC2=O)cccc1-c1nncn1C 828070055 HOAZWLIDQWXGKI-QGZVFWFLSA-N 389.459 2.745 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N[C@@H]1CCCN(C(=O)c2ccco2)C1 827860807 IXGWMVACLIAFOZ-MRXNPFEDSA-N 392.459 2.928 0 50 GFAA CNC[C@@H]1CCCN(C(=O)COc2ccc(Br)cc2Cl)C1 269117719 VYKBBXAGGPXWGV-NSHDSACASA-N 375.694 2.939 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1NCc1cc(Cl)c2c(c1)OCCCO2 1875399919 MCUIDSVVOPUNOV-USXIJHARSA-N 377.872 2.627 0 50 GFAA C[C@@H]1CN(c2ccc(F)cn2)CCN1C(=O)c1cc(F)c2nc(O)ccc2c1 1875313764 TWIUTICPCDIQEB-GFCCVEGCSA-N 384.386 2.965 0 50 GFAA CN(CCCC(=O)O)C(=O)c1cncc(-c2cn(CCc3ccccc3)nn2)c1 1875326120 AZDIZYJYRFCVLE-UHFFFAOYSA-N 393.447 2.520 0 50 GFAA CC(C)n1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3ccnn3C(F)F)CC1)O2 1875394861 ZBQWHAWSUZHFDY-ZDUSSCGKSA-N 395.410 2.547 0 50 GFAA CCc1nc([C@H]2CN(C(=O)c3cccc4c3OCC4(C)C)Cc3c[nH]nc32)n[nH]1 1875393996 XFEDISCFIFYJNU-AWEZNQCLSA-N 392.463 2.548 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)NC[C@@H]3C[C@@H](CO)CO3)cc12 1875298481 BXICFMRCDNZBHP-WFASDCNBSA-N 389.452 2.662 0 50 GFAA Cc1ccc(OCCN(C)S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)cc1 952861117 DHNGYFAIOFPONN-UHFFFAOYSA-N 375.450 2.986 0 50 GFAA O=S(=O)(C[C@H]1CCCO1)Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1 171806581 MILAQEMBNDHNLU-CQSZACIVSA-N 394.472 2.731 0 50 GFAA O[C@@H](COc1ccccc1)CN1CCN(Cc2cnc3ccccc3c2)CC1 225535164 UWZNUWIAWKYFHC-OAQYLSRUSA-N 377.488 2.792 0 50 GFAA COc1ncccc1NC(=O)C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1 187622310 PZULFRDYWIHDDT-UHFFFAOYSA-N 394.431 2.885 0 50 GFAA C[C@H]1CN(S(=O)(=O)c2ccc3c(c2)C(=O)NCC3)c2cccc(Cl)c2O1 190411580 IPADDSCSQGTRDR-NSHDSACASA-N 392.864 2.602 0 50 GFAA CCN(Cc1ccccc1)C(=O)[C@H]1OCC(=O)N(C2CC2)[C@@H]1c1cccnc1 1529113775 IRIQORGWJJWDNX-RTWAWAEBSA-N 379.460 2.561 0 50 GFAA COc1cccc(N2CCN(c3cc(C)nc(N4CCCCC4)n3)CC2=O)c1 1704297118 HQCNDFYBHSBZLD-UHFFFAOYSA-N 381.480 2.637 0 50 GFAA O=C(c1cncc(NCCc2csc(-c3cccnc3)n2)n1)N1CCCC1 1704354078 ZEFBVKMZIVIQEH-UHFFFAOYSA-N 380.477 2.886 0 50 GFAA CCCC(=O)N1CCC(N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)CC1 1616082393 HYGZDHDMROHMLU-AVRDEDQJSA-N 381.520 2.861 0 50 GFAA Cc1ccccc1-c1nc(CS(=O)(=O)CC(=O)NCc2ccco2)c(C)o1 5058468 UMGPRPVUBPDSBU-UHFFFAOYSA-N 388.445 2.783 0 50 GFAA CCn1ccnc1CNC(=O)c1cc(COc2cccc3cnccc23)on1 11661708 PDBPMTBCJQXKSI-UHFFFAOYSA-N 377.404 2.948 0 50 GFAA CC(=O)c1cc(C(=O)N(C)C[C@H]2CCCN(CCc3ccccc3F)C2)[nH]n1 11819106 WHJGRUCQPUJYID-MRXNPFEDSA-N 386.471 2.778 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@H]2CC(=O)NCc2ccccc2Cl)cc1 11844230 FIJXBRYQSBRNHZ-LJQANCHMSA-N 385.895 2.655 0 50 GFAA O=C1C[C@H](NCc2ccc(-n3cccn3)cc2)CN1CCc1ccc(F)cc1 11879075 XOAARGWQIOQLQB-FQEVSTJZSA-N 378.451 2.945 0 50 GFAA CC(=O)N1CCN(C(=O)[C@@H]2CC(C(c3ccccc3)c3ccccc3)=NO2)CC1 12181821 QSDLUXLQPJCTLT-NRFANRHFSA-N 391.471 2.654 0 50 GFAA CCOC(=O)[C@@]1(CCc2ccccc2)CCCN(C(=O)CCN2CCCO2)C1 12586479 PPXAZKGXOMQKIR-JOCHJYFZSA-N 388.508 2.819 0 50 GFAA Cn1nc(C(=O)NCc2ccccc2F)c2c1CC[C@@H](NCc1cccnc1)C2 14740348 IDSGQXWDHMHNLW-QGZVFWFLSA-N 393.466 2.531 0 50 GFAA COc1cc(C(C)=O)ccc1OCc1cc(C(=O)N2CCSCC2)no1 15065882 AJQBDTMSOOLCEU-UHFFFAOYSA-N 376.434 2.654 0 50 GFAA Cc1nn(C)c(C)c1CN(C)c1ccc(C(=O)NCc2noc(C(C)C)n2)cn1 19837556 ISPUXGLMWUUWCI-UHFFFAOYSA-N 397.483 2.505 0 50 GFAA COc1ccc(-c2nc(-c3nnn4c3CO[C@H](c3ccc(C)cc3)C4)no2)cn1 169769348 OKHMCBXTKZRPGX-INIZCTEOSA-N 390.403 2.979 0 50 GFAA Cn1ccnc1C(=O)N[C@@H]1CCCC12CCN(C(=O)Cc1cccc(F)c1)CC2 1857673078 FWYCTNLERJVWQF-GOSISDBHSA-N 398.482 2.693 0 50 GFAA COc1ccc2oc(N3CCC[C@H](Cc4nc(C)nn4CCCO)C3)nc2c1 1857674220 YLSNJYYKONPBLW-OAHLLOKOSA-N 385.468 2.578 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)N(C)Cc1ccccc1 1857674871 BKKYUJJYNGTNIK-YQVWRLOYSA-N 380.510 2.559 0 50 GFAA Nc1cccc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3ccc4scnc4c3)C2)n1 1857689721 WBMYQKKRJWBRDD-ZIAGYGMSSA-N 395.488 2.745 0 50 GFAA O[C@@H](CN1CCOCC1)C1CCN(c2ccnc3cc(Cl)ccc23)CC1 1857706649 YCHSMKXEMIJSFS-FQEVSTJZSA-N 375.900 2.798 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)O 2384755 JZLZDBGQWRBTHN-NSHDSACASA-N 391.205 2.812 0 50 GFAA biogenic,in-vitro O=C(NCc1ccccn1)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 119276698 OGNMQBDOWJUBCX-OAHLLOKOSA-N 375.375 2.604 0 50 GFAA CN(C(=O)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1)C1CCCC1 328806478 NJRSPQNIRDXUSI-GOSISDBHSA-N 391.537 2.838 0 50 GFAA C[C@H]1CN(Cc2ccc(C(=O)N[C@@H](C(=O)O)c3ccccc3)cc2)C[C@@H](C)O1 237628356 HGGONKLSTKVCMH-GQIGUUNPSA-N 382.460 2.852 0 50 GFAA COc1ccc2cc([C@H](C)C(=O)N(C)Cc3cnn4c3CNCC4)ccc2c1 2325759884 LRWHSMPEGCJRPP-HNNXBMFYSA-N 378.476 2.910 0 50 GFAA COc1ccc2c(c1)CC[C@@]2(O)CNC(=O)c1cnn(C)c1Cc1ccccc1 2325791075 QUMNODCMCGQXBY-HSZRJFAPSA-N 391.471 2.583 0 50 GFAA COc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1O 2325796793 MGRDMBPNKKVVMT-QGZVFWFLSA-N 397.427 2.822 0 50 GFAA COC(=O)c1cc(=NC(=O)N[C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)[nH]n1C 2325819154 WPVCAFHKHWTDGL-ZIAGYGMSSA-N 376.844 2.740 0 50 GFAA CCN1C(=O)[C@H](CC(=O)Nc2ccc(OC)cc2)N(Cc2ccco2)C1=S 1112399 NHWOYRRCLXNRCZ-INIZCTEOSA-N 387.461 2.635 0 50 GFAA Cc1ccc(CN2CCN(N=Cc3ccccc3OCC(=O)O)CC2)c(C)c1 2705048 MJUYXQUWGROUCM-UHFFFAOYSA-N 381.476 2.919 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1Br 4118658 KWJOJWBRBSATIB-UHFFFAOYSA-N 375.270 2.605 0 50 GFAA N=C1S/C(=C\c2c[nH]nc2-c2ccc(Cl)cc2)C(=O)N1c1nonc1N 4123583 GOWLSAODTZBVFZ-RXQKXVAWSA-N 387.812 2.751 0 50 GFAA CCNC(=O)CCc1nc(-c2cc(Br)c(OC)c(OCC)c2)no1 4839712 INHOIYIAIJEJQC-UHFFFAOYSA-N 398.257 2.975 0 50 GFAA CCCNC(=O)C1CCN(S(=O)(=O)c2ccc(OCC)c(Cl)c2)CC1 6703370 NNMZZXWCDOMRGU-UHFFFAOYSA-N 388.917 2.666 0 50 GFAA CC(=O)Nc1ccc(OCc2nnnn2-c2ccc(Br)cc2)cc1 6764302 GNSBFPZWYBIPBO-UHFFFAOYSA-N 388.225 2.962 0 50 GFAA CCCn1c(C)c(CC(=O)N[C@H]2CCCCNC2=O)c2c1CC(C)(C)CC2=O 11879197 OVFZAGBENRBJNL-INIZCTEOSA-N 387.524 2.689 0 50 GFAA O=C(CC[C@@]1(Cc2ccco2)CCC(=O)N1)NCc1ccc2nsnc2c1 12452874 CNGBQESEFORAJD-IBGZPJMESA-N 384.461 2.572 0 50 GFAA CC(=O)N1CCN(Cc2nc(C(c3ccccc3)c3ccccc3)no2)CC1 13636958 XXOJZYXCOODBFQ-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA CNC(=O)c1nn(CCc2ccccc2)c2c1C[C@H](NCc1ccco1)CC2 14748700 CJHBOBGFBJLGOJ-QGZVFWFLSA-N 378.476 2.726 0 50 GFAA CO[C@@H]1CCCO[C@@H]1O[C@@H]1[C@H](OC)CO[C@H](Sc2ccccc2)[C@@H]1OC 43199109 PMVNXXXRJLDLRS-MGYGNFHQSA-N 384.494 2.702 0 50 GFAA CCN1CCC[C@@H]1Cn1c(=O)n(C[C@@H]2CCCCO2)c2cc(C(=O)O)ccc21 55283500 YOIJEDREJXBJAM-SJORKVTESA-N 387.480 2.555 0 50 GFAA CN1CC[C@](C)(CNC(=O)c2coc(COc3cccc4cccnc34)n2)C1 67473142 WCEDCRBYRRSJAK-OAQYLSRUSA-N 380.448 2.873 0 50 GFAA COc1ccccc1CN1CC=C(c2cnn([C@H]3CCS(=O)(=O)C3)c2)CC1 67872707 SJEOESGFSZSCOF-IBGZPJMESA-N 387.505 2.541 0 50 GFAA Cc1cccc(C)c1OC1CN(c2ncnc3c2CCN(C(=O)C2CC2)C3)C1 71748774 LWICCEWNZSZFQR-UHFFFAOYSA-N 378.476 2.656 0 50 GFAA CN(C)C(=O)c1ccc2c(c1)N(C)[C@@H](CC(=O)NCCCc1ccccc1)CO2 71764267 JCHMOFNVFUUEHX-IBGZPJMESA-N 395.503 2.725 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4cccc(Cl)c4)CC3)nn2)n1 72115607 JILKHZPJTGWUFB-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA Cc1cc2nc(C(=O)N3CCC([C@@H](O)Cc4ccccc4)CC3)cc(C)n2n1 77284794 MMVOFUOPAAOVLB-FQEVSTJZSA-N 378.476 2.802 0 50 GFAA c1cn(C2CCN(C[C@H]3CCCO3)CC2)c(-c2cnc(N3CCCC3)nc2)n1 77320124 SFNFQIMWXMDKRH-LJQANCHMSA-N 382.512 2.756 0 50 GFAA CN(C)C[C@H]1C[C@@H](CO)CN(C(=O)c2ccccc2OC(F)(F)C(F)F)C1 91306198 BYYQZLZPTCVHTG-CHWSQXEVSA-N 392.393 2.556 0 50 GFAA Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@]2(CCC(=O)N(C3CC3)C2)C1 91381419 KIMVBDRIGFLSIA-IBGZPJMESA-N 380.485 2.690 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(O)(c3cccnc3)CC2)cc1Cl 95383784 PTKYCRXYQNLBMX-KRWDZBQOSA-N 376.840 2.853 0 50 GFAA COCCOc1cccc(NC(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)c1 96140664 LZJRFLMMNNJVOA-SFHVURJKSA-N 383.448 2.634 0 50 GFAA O=C1[C@@H]2[C@H](C(=O)N1c1ccc(I)cc1)[C@H]1C=C[C@H]2C12CC2 101362858 SXBUIFRWYXAUGI-SYQHCUMBSA-N 391.208 2.993 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@@H]1c1ccc(OC(F)(F)F)cc1 120932854 JPAAYWNQQPKMPV-KGLIPLIRSA-N 386.351 2.589 0 50 GFAA C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1cccc(NC(=O)CCn2ccnc2)c1 124106060 FVPXGRYXNVLIIZ-YJBOKZPZSA-N 396.447 2.747 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)[C@H]1c1ccccc1 171851958 YRNCZPMYJUSSIA-RBBKRZOGSA-N 393.487 2.651 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccccc3)C2)cc1 172062295 VLNBPRITKJJWDH-QGZVFWFLSA-N 387.505 2.558 0 50 GFAA CCCc1nc(C(=O)Nc2cccc3c2C(=O)NC3)nn1-c1ccccc1F 173025715 XRYZRFLNZRNKOD-UHFFFAOYSA-N 379.395 2.855 0 50 GFAA Cc1cccc(N2CCN(CCC(=O)N3CCC(c4nc(C)no4)CC3)CC2)c1 174723108 QOCNFYTWUYTSSL-UHFFFAOYSA-N 397.523 2.605 0 50 GFAA O=C(O)c1ccc(C(=O)N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)cn1 237989502 YYGSHOUJRSBHJY-UHFFFAOYSA-N 394.353 2.546 0 50 GFAA CN1CC[C@H](NC(=O)NC2CCN(Cc3ccncc3)CC2)[C@H]1c1ccccc1 245696883 YJFPBKJERAXYDO-FCHUYYIVSA-N 393.535 2.791 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3c(Cl)cccc3Cl)CC2)nn1 283574049 OOULHMAUTYSXHI-UHFFFAOYSA-N 381.263 2.750 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@@H](c2cccc(Br)c2)N2CCCC2)C1 299742823 KSNHMXBOGXHBJH-UKRRQHHQSA-N 381.270 2.519 0 50 GFAA O=C(CCc1nc(-c2ncccn2)no1)N1CCC[C@@H]1Cc1ccc(F)cc1 363463384 JNOPSVBFAXTUKU-MRXNPFEDSA-N 381.411 2.832 0 50 GFAA CN1CCN(c2ccc(NC(=O)CC3(n4cccc4)CCOCC3)cc2)CC1 409413295 HDONQTZZABQPIM-UHFFFAOYSA-N 382.508 2.774 0 50 GFAA CCc1ncc2c(n1)CN(C(=O)CCCc1nc(-c3cccc(OC)c3)no1)C2 426510423 TVJXYCJMFUBYQP-UHFFFAOYSA-N 393.447 2.963 0 50 GFAA Cc1cc(-c2ccc(C(=O)NC[C@H]3CC(=O)N(C4CC4)C3)cc2)c(O)nc1C 534654257 FLTMOHZXSXESEO-OAHLLOKOSA-N 379.460 2.812 0 50 GFAA CN(C)[C@@H](C(=O)N1CCN(c2nc3ccccc3o2)CC1)c1ccccc1F 826626337 ZZVGSBBPJVABOE-LJQANCHMSA-N 382.439 2.918 0 50 GFAA CC(C)c1ncsc1C(=O)N[C@]1(c2ccc(S(C)(=O)=O)cc2)CCOC1 888100901 WVEZDHDDCPEZMI-GOSISDBHSA-N 394.518 2.716 0 50 GFAA O=C(c1cc(-c2ccc(Br)s2)[nH]n1)N1CCc2nc[nH]c2C1 888103878 HSAAJZQYPZYJJG-UHFFFAOYSA-N 378.255 2.822 0 50 GFAA COCc1ccc(C(=O)N2CCC3(CC2)CNC(=O)c2ccccc2O3)cc1F 928111800 ZZXMIBKWCPRRES-UHFFFAOYSA-N 398.434 2.769 0 50 GFAA Cc1cc(S(=O)(=O)NCCc2nc(C)c3c(n2)CCC3)c(Cl)cc1F 1506403967 YGDCDACBSBUPFQ-UHFFFAOYSA-N 383.876 2.896 0 50 GFAA CN(Cc1nc(-c2ccncc2)no1)C1CCN(C(=O)c2cccs2)CC1 1506408720 OVNAHWYPILAZCQ-UHFFFAOYSA-N 383.477 2.930 0 50 GFAA CCn1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)c1C 1565506822 PAJQCNRCKKTCTE-XLIONFOSSA-N 378.520 2.915 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CCN2[C@H](COC[C@H]2C2CC2)C1 1616084065 USXGYPGHOUBYKU-FPOVZHCZSA-N 377.488 2.992 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cncnc4)C[C@@H]2CN(Cc2ncc[nH]2)C3)cc1 1772809341 TYDRSXCGVHOULL-GGAORHGYSA-N 388.519 2.767 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)N1CC[C@@H]2C[C@H]2C1 1857527649 ZSAJVIGHSYXNOV-TYNCELHUSA-N 383.370 2.742 0 50 GFAA COc1ccccc1CN1CC[C@@H](O)[C@]2(CCCN(C(=O)c3ccoc3)C2)C1 1857706836 SJQHYORQGJYHRT-IFMALSPDSA-N 384.476 2.777 0 50 GFAA O=C(NCC1(c2ccccc2Cl)CCOCC1)[C@H]1CNCC[C@]12CCOC2 1875277090 GFCOMBKLQIEYBK-DYESRHJHSA-N 392.927 2.521 0 50 GFAA O=CN[C@@H](Cc1ccsc1)C(=O)N1CCC2(CC1)OCCc1ccsc12 1875321665 QJLUZGSXUJGTQL-INIZCTEOSA-N 390.530 2.557 0 50 GFAA O=C(NCc1ccccc1N1CCCC1)N1CC[C@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1875401765 REFLRKYKOFRXCV-AEFFLSMTSA-N 396.495 2.793 0 50 GFAA CCc1nccn1CCC(=O)N[C@H]1CCC[C@@H](CN2CCN(C(C)C)CC2)C1 2100543049 KXQQWRWNDUPMJM-UXHICEINSA-N 389.588 2.537 0 50 GFAA Cc1ccc(CN2CC[C@H](CN(C)C(=O)c3nc4ccccc4[nH]c3=O)C2)s1 2325780325 YMTVWIOHIRKIPI-OAHLLOKOSA-N 396.516 2.887 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H]3CN(C(=O)c4ccc5cccnc5c4)C[C@H]32)no1 2325787024 WMYRFHPVZOBQFF-FXAWDEMLSA-N 390.443 2.908 0 50 GFAA Oc1cc([C@@H]2CCCN(Cc3cn4cccc(Br)c4n3)C2)[nH]n1 2325803844 GEQYBSKFAXOVSV-LLVKDONJSA-N 376.258 2.905 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3c[nH]c(=N)s3)C2)c2cccc(=O)n21 2356145339 LWDWFSIDKQKQBQ-YCPHGPKFSA-N 386.521 2.954 0 50 GFAA O=C(c1ccc(Cn2cc(Cl)cn2)o1)N1N=C(C(F)F)C[C@]1(O)C(F)F 655451 YLOOYXKTHAVQGA-AWEZNQCLSA-N 394.712 2.599 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1cc2c(cc1Br)OCO2 831841 JJFXFBJLWNSDMU-SNVBAGLBSA-N 382.210 2.618 0 50 GFAA CS(=O)(=O)N(CC(=O)NCc1ccco1)c1cc(Cl)cc(Cl)c1 886846 ZTNNCDQOGNBNJA-UHFFFAOYSA-N 377.249 2.669 0 50 GFAA COC(=O)c1cc(NC(=O)Nc2cc(OC)ccc2OC)cc(C(=O)OC)c1 1121333 RJQZWKYIISZZOL-UHFFFAOYSA-N 388.376 2.921 0 50 GFAA COC(=O)c1c(NC(=S)Nn2c(C)nnc2C)sc2c1CC[C@@H](C)C2 6234718 JCXUSNIXBYMIKO-MRVPVSSYSA-N 379.511 2.808 0 50 GFAA CCC(=O)[C@@H]1CCCN(C(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)C1 11814892 BLFBIXPQOJFXQG-CQSZACIVSA-N 385.420 2.616 0 50 GFAA O=C(NCCN1Cc2ccccc2O[C@H](c2ccccc2)C1)c1cnsn1 11996266 KREHKFRGUMKOOQ-IBGZPJMESA-N 380.473 2.904 0 50 GFAA O=C(c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)N1CCC[C@@H](O)C1 12436299 VNODPEFGVDAFHJ-HXUWFJFHSA-N 395.503 2.722 0 50 GFAA COC(=O)c1cc(C)sc1NC(=O)CSc1nnc(-c2ccco2)n1C 17080136 FSEBVINSDDRPGM-UHFFFAOYSA-N 392.462 2.962 0 50 GFAA Cc1ccc(C)c(OCc2cc(C(=O)N(C)CCCN3CCOCC3)no2)c1 20997075 NKUGTFDHTMQWRH-UHFFFAOYSA-N 387.480 2.665 0 50 GFAA CCN1CCN(Cc2cccc(OC[C@@H](O)CN(C)C3CCCCC3)c2)CC1 22920186 WSQGDUKZGMPSPP-QFIPXVFZSA-N 389.584 2.828 0 50 GFAA CCN(Cc1ccncc1)[C@@H]1CCCN(C(=O)CSc2nnc(C)s2)C1 23128599 GXIRMMIEAKFIRA-MRXNPFEDSA-N 391.566 2.847 0 50 GFAA CCn1ccnc1CN1CCN(Cc2ccc(OC)c(C)c2C)[C@@H](CCO)C1 23373960 FEQALAXBUNAZGR-FQEVSTJZSA-N 386.540 2.597 0 50 GFAA CCn1cc(CN2CCC[C@H](CNC(=O)c3cccc(OC)c3OC)C2)cn1 39430504 TVUOHUFFLPFWEW-MRXNPFEDSA-N 386.496 2.562 0 50 GFAA CCCC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)N(CC(C)C)C2)cc1OC 55576396 IGDHJGRFAXOUPZ-CQSZACIVSA-N 375.469 2.877 0 50 GFAA CC(C)NC(=O)CNC(=O)c1csc2nc(-c3ccc(Cl)cc3)cn12 67935315 VZFXDJXQOIJWBM-UHFFFAOYSA-N 376.869 2.971 0 50 GFAA CCNC(=O)c1ccc(N2CCC(=O)N(Cc3ccccc3)[C@@H](CC)C2)nc1 71774411 DSQIDKNFJCVKKA-IBGZPJMESA-N 380.492 2.849 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccc(O[C@H](C)C(=O)O)cc3)CC2=O)cc1 72133086 DDFXVXQZEPLGTR-QGZVFWFLSA-N 382.460 2.691 0 50 GFAA CCCc1nc(N[C@H](c2ccccc2)c2nnc(N)s2)c2cnn(C)c2n1 72153815 FSYMWHXAWNBUDU-CQSZACIVSA-N 380.481 2.951 0 50 GFAA O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1CCC2(CC1)C(=O)Nc1ccccc12 72156849 RXADITDWEYCLMX-UHFFFAOYSA-N 388.427 2.908 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)N(C)C)C3)c2ccc(F)cc2n1 95352153 QNDVKAUKOLNTMH-GOEBONIOSA-N 384.455 2.900 0 50 GFAA O=C(c1cccc(S(=O)(=O)N2CCC[C@@H]2c2nccs2)c1)N1CCCC1 95359598 GPCOMFGCEPNQAY-MRXNPFEDSA-N 391.518 2.905 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)c1ccc(C)c(Cl)c1)CCN2C 95380743 XTYYSBRBKHHFCD-FQEVSTJZSA-N 377.916 2.807 0 50 GFAA CCc1nc(CN2CCC(Oc3ccc(C(=O)N4CCCC4)cc3)CC2)no1 95502063 PFNQVPKTNHKOMO-UHFFFAOYSA-N 384.480 2.911 0 50 GFAA COc1ccc(C(=O)N2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)cc1F 95502892 ZQLZCBJBWIKOHI-KRWDZBQOSA-N 392.471 2.762 0 50 GFAA Cc1noc([C@@H](C)NC(=O)c2cccc(OC3CCN(C(=O)C4CC4)CC3)c2)n1 95529594 PKBYEDXLTDATPD-CYBMUJFWSA-N 398.463 2.649 0 50 GFAA COc1ccc(NC(=O)N(C)C2Cc3ccccc3C2)cc1NS(C)(=O)=O 96165990 GNGJRNQYNVGMQB-UHFFFAOYSA-N 389.477 2.698 0 50 GFAA O=C(N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1)C1(c2ccccc2)CC1 169779712 VOLUGNVZOCWTNJ-UHFFFAOYSA-N 388.471 2.998 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)N2CCC(Cc3ccccn3)CC2)CC1=O 171612331 FGGFKWBDBOXXQF-SFHVURJKSA-N 393.487 2.924 0 50 GFAA Cc1cc(C)c(CC(=O)N(Cc2cccnc2)[C@@H]2CCS(=O)(=O)C2)c(C)c1 180203472 MWWFDFMDNDNKMS-LJQANCHMSA-N 386.517 2.765 0 50 GFAA O=C(CCOCC(F)(F)C(F)F)N[C@H]1CCCN(c2ccccc2F)C1=O 189864711 XQSVRDFTQHPTBX-LBPRGKRZSA-N 394.340 2.744 0 50 GFAA CCc1csc([C@H]2CCCN(CC(=O)N3CC(=O)Nc4ccccc43)C2)n1 195382258 CVZNLDXHHHAILB-AWEZNQCLSA-N 384.505 2.870 0 50 GFAA COC(=O)/C(=C/c1cc(-c2ccccc2Cl)on1)CN1CCN(C)CC1 214082523 JMKPHWJLORZEQP-SDNWHVSQSA-N 375.856 2.799 0 50 GFAA CCNc1nc(C)c(C(=O)N[C@@H](c2ccc(OC)nc2)C2CC(O)C2)s1 222921237 ANMNJXKYLNYTPM-PIMMBPRGSA-N 376.482 2.529 0 50 GFAA Cc1ccccc1CNC(=O)COc1ccc(Br)cc1CCO 225653273 HRIDDJFSAMWPNB-UHFFFAOYSA-N 378.266 2.988 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)CN2C(=O)c1n[nH]c2ccccc12 251919698 AGRDABQJYHGXDW-CVEARBPZSA-N 379.464 2.904 0 50 GFAA O=C(NCc1nccs1)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252491239 LJIHOITZSCCZAF-UHFFFAOYSA-N 380.495 2.686 0 50 GFAA O=C(C[C@H]1N=C(O)N(CCc2c[nH]c3ccccc23)C1=O)NC1CCCCC1 252536713 JFWSUMCZLUCWTQ-GOSISDBHSA-N 382.464 2.674 0 50 GFAA O=C(Nc1ccc(Oc2cccc(Cl)c2)cc1)C(=O)N1CC(n2ccnn2)C1 253393752 MXUSXLVTRDPGIT-UHFFFAOYSA-N 397.822 2.746 0 50 GFAA COc1ccc([C@H](CNC(=O)C[C@H](CN)OC)c2c[nH]c3ccccc23)cc1 262971442 XQXBVTUBPDVUEG-MJGOQNOKSA-N 381.476 2.788 0 50 GFAA Cc1nscc1C(=O)N1C[C@@H]2CCCN(C(=O)c3csnc3C)[C@@H]2C1 272974940 ZYXBWIZOQQPFHI-SWLSCSKDSA-N 376.507 2.593 0 50 GFAA CN(CCc1noc(C2CC2)n1)C(=O)Cc1cc2c(cc1Cl)OCCO2 299802823 QODHJLFCYBKFBB-UHFFFAOYSA-N 377.828 2.615 0 50 GFAA Cc1nnc([C@@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc3c(c2)COC3)o1 329184391 OHLUFOJRJWEQDY-IBGZPJMESA-N 397.456 2.897 0 50 GFAA C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2C(=O)[C@H]2CSCN2C(=O)C2CCCC2)C1 408260101 DCHCXDIXVODQDK-WRNCNIFXSA-N 394.581 2.866 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 426505942 WBPDQULUAUIADD-QFIPXVFZSA-N 383.492 2.531 0 50 GFAA NC(=O)c1cncc(N2CC[C@]3(CCCN(CCCc4ccccc4)C3)C2)n1 426571675 VJLUCVGTBBBESJ-QFIPXVFZSA-N 379.508 2.501 0 50 GFAA COc1cccc(-c2cc(CNC(=O)Cn3nc(C)c(C(C)=O)c3C)on2)c1 584893997 IDWOMLOYZQMVAI-UHFFFAOYSA-N 382.420 2.683 0 50 GFAA Cc1cncc(N2CCC3(CC2)CN(Cc2nc4ccccc4[nH]2)CCO3)n1 952973818 BNNLXEHEBVUJRI-UHFFFAOYSA-N 378.480 2.533 0 50 GFAA OC[C@]12CNC[C@H]1CN(Cc1nc3ccccc3n1Cc1ccccc1Cl)C2 1772700425 ARSKLWAWYBXBMK-HTAPYJJXSA-N 396.922 2.752 0 50 GFAA O=C(CC1=CCCC1)N1C[C@H]2CN(Cc3c(F)cccc3F)C[C@@]2(CO)C1 1772819766 SIQBZHHYRRNFSI-IERDGZPVSA-N 376.447 2.718 0 50 GFAA COc1ccc(-c2nccn2-c2ccc3c(c2)nnn3C)c(C(=O)O)c1OC 1775982450 VOBOBAMLHRKPGC-UHFFFAOYSA-N 379.376 2.536 0 50 GFAA COc1cc(S(=O)(=O)n2nnc3cc(C)ccc32)ccc1Br 1776003959 HBQLGYKXUVIJJD-UHFFFAOYSA-N 382.239 2.748 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)CCCc3ccc(OC)cc3)Cc3c[nH]nc32)n[nH]1 1857528809 ZSPQKNVDXQIHTA-QGZVFWFLSA-N 394.479 2.596 0 50 GFAA Cn1ccnc1C(=O)N[C@H]1CCCC12CCN(C(=O)Cc1cccc(F)c1)CC2 1857673079 FWYCTNLERJVWQF-SFHVURJKSA-N 398.482 2.693 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(Cc3nnc(-c4ccccc4)o3)CCN12 1857693896 RCRZYTSQUPBIND-QFIPXVFZSA-N 390.443 2.986 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)CCc1csc(=N)[nH]1)CC2 1857700690 JYMYSEKXZBHGAP-UHFFFAOYSA-N 381.505 2.516 0 50 GFAA CN(C)[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)Nc3ccccc3-c3ccccc3)C[C@@H]12 1857732568 WIUUNLUODSZSBD-SXLOBPIMSA-N 399.516 2.545 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cc(F)cc(F)c3F)C[C@]23CC[C@H]1O3)C1CC1 1857737975 MBXHLTAYLXCPLK-DKYLXPRQSA-N 380.410 2.610 0 50 GFAA C[C@@H](C(=O)NS(=O)(=O)[C@H]1CCc2ccccc21)n1ccc(C(F)(F)F)n1 1875285470 ODZRFVIPOPSQQJ-GWCFXTLKSA-N 387.383 2.596 0 50 GFAA Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NC[C@@]12CC[C@@](C(=O)O)(CO1)C2 1875300910 VRERLZCWSIGFAZ-OALUTQOASA-N 389.839 2.588 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2C[C@H](C[C@H]2O)C1 1875307936 WWIMTCAOIXJQHJ-DVOMOZLQSA-N 398.463 2.978 0 50 GFAA COc1ccccc1C(=O)N1CC[C@@H](C)[C@H](CNC(=O)C23CCC(CC2)O3)C1 1875315185 KOQYWIAJXCSCOY-UBODTHMXSA-N 386.492 2.621 0 50 GFAA Cc1ccc(-c2nc(-c3cnn(CCO)c3)nn2C2C[C@H](C)O[C@@H](C)C2)cn1 1875340540 HEVZRVSPBACQJP-GJZGRUSLSA-N 382.468 2.633 0 50 GFAA CN1CCc2nc(O)c(CNC(=O)c3cc(-c4cccs4)cnc3O)cc2C1 1875396745 UCPLDSANHWYQEH-UHFFFAOYSA-N 396.472 2.534 0 50 GFAA CC[C@@H](C)CC(=O)N1CCc2c(ncn2C)[C@]12CCN(C(=O)Cc1ccco1)C2 2325776822 CKJRZMPXXSWKHW-OPAMFIHVSA-N 398.507 2.504 0 50 GFAA CC1(C)O[C@]2(CCCN(C(=O)[C@]3(c4ccccc4)C[C@H]3C(F)(F)F)C2)NC1=O 2325784334 VHTVHDWVLWDNEA-CCKFTAQKSA-N 396.409 2.750 0 50 GFAA C[C@H]1CCCN(c2cc(N[C@@H]3CCC(=O)NC3=O)nc(-c3ccccc3)n2)C1 1857797755 LRONAABOSXWKCB-GOEBONIOSA-N 379.464 2.597 0 50 GFAA NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Br)cc1 634676 HWYLVEJBOPSQEF-UHFFFAOYSA-N 390.262 2.726 0 50 GFAA O=C(c1cccc(Cl)c1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 1175650 MTCFBMPDMKALQZ-UHFFFAOYSA-N 378.881 2.628 0 50 GFAA CCCCNC(=O)c1nn2cc(Br)cnc2c1Br 2496902 HIZFJNRXCAZKQD-UHFFFAOYSA-N 376.052 2.784 0 50 GFAA O=C(c1ccc2ccccn12)N1CCN2C(=O)OC[C@@]2(Cc2ccccc2)C1 2356155356 DGKJCOPPJPYHLR-JOCHJYFZSA-N 375.428 2.829 0 50 GFAA CN(Cc1nc2ccccc2[nH]1)C[C@]1(O)CCCN(CC2CCCCC2)C1=O 53523807 RPXQREWGGHHZFA-JOCHJYFZSA-N 384.524 2.929 0 50 GFAA CCOc1ccc(CN2CCN(C3CCN(C(C)C)CC3)C[C@H]2CCO)cc1 104641522 QTQJRLKUQTXECR-JOCHJYFZSA-N 389.584 2.827 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2cccnc2OC(C)C)N2CCOCC2)o1 121659730 BDCIFMYFTMZSIQ-KRWDZBQOSA-N 388.468 2.965 0 50 GFAA Cc1ccc([C@H](NC(=O)c2cc3n(n2)CCN(C)C3)c2cccnc2)cc1C 65408994 UVZWXZXZYPRGKB-NRFANRHFSA-N 375.476 2.860 0 50 GFAA COc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)N3CCCC3)cc2)cc1 67338809 BOKTWSCFEUVYIK-UHFFFAOYSA-N 388.489 2.752 0 50 GFAA O=S(=O)(C[C@@H]1CCCCO1)Nc1ccccc1-c1nnc2n1CCCCC2 150840069 OWHOCWNTSCMPFJ-HNNXBMFYSA-N 390.509 2.982 0 50 GFAA COc1ccc(CN2CCN(CCCc3ccccc3)[C@H](CCO)C2)cc1O 39461035 RPAHUKRJHLNHSQ-OAQYLSRUSA-N 384.520 2.902 0 50 GFAA O=C(NCC1(N2CCOCC2)CCCCC1)Nc1cccc(N2CCC2=O)c1 363933790 UYHJMVBDJSWKFJ-UHFFFAOYSA-N 386.496 2.580 0 50 GFAA NC(=O)C[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)C1 175567266 IUMXZWNRUYDOMJ-CABCVRRESA-N 378.904 2.606 0 50 GFAA CCOc1ncccc1C(=O)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1OC 72478008 JHAWZSXWVKTIJY-MOPGFXCFSA-N 381.476 2.601 0 50 GFAA C[C@H]1CCCN(C(=O)c2cccc(S(=O)(=O)Cc3ccccc3)c2)[C@@H]1CN 237656324 BOMCJDSDVWXLMH-OXJNMPFZSA-N 386.517 2.860 0 50 GFAA COCc1ccccc1CNC(=O)N1CCn2c(nnc2-c2ccccc2)C1 173811585 DGBXXQKJOLNCDY-UHFFFAOYSA-N 377.448 2.817 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2ccc3c(c2)CCO3)c2ccccc2C12CCNCC2 72453668 FOJAGLHEZGSOHU-RTWAWAEBSA-N 378.472 2.742 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc(N2CCNC2=O)ccc1Cl 262424817 QXLMQWGUWWIXKB-LYRGGWFBSA-N 391.855 2.728 0 50 GFAA CC1(C)CC(=O)c2cc(NC(=O)CCc3nc(-c4ncccn4)no3)ccc2O1 375819766 MFLHWIJVRZLRGC-UHFFFAOYSA-N 393.403 2.842 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2ccc3[nH]cnc3c2)c2ccccc2C12CCNCC2 72431243 KUJYWBYZCGPVDB-UXHICEINSA-N 376.460 2.684 0 50 GFAA Cc1ccc(CNC(=O)N2CCOc3cc(O)ccc3C2)c(O[C@H]2CCOC2)c1 376874104 MWOJWKYYUXVSIM-IBGZPJMESA-N 398.459 2.973 0 50 GFAA Cc1c(NC(=O)[C@@H]2CCO[C@@H](c3ccccc3)O2)c(=O)n(-c2ccccc2)n1C 240333206 FCHAZXJKNFRNAS-PGRDOPGGSA-N 393.443 2.927 0 50 GFAA CC(C)C[C@H](C(=O)N[C@@H]1COc2ccccc21)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 241368066 MJTSXZARNDNXQG-JOCBIADPSA-N 382.460 2.602 0 50 GFAA C[C@H](C(=O)NC1CCN(Cc2ccccc2)CC1)N(C)C[C@H]1CCCC[C@H]1O 241588046 OZERHNRGFYBTHG-SYYKKAFVSA-N 387.568 2.639 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@H]1CC(=O)N(C2CC2)C1 176779469 LYOISWPCMKBQJZ-ZDUSSCGKSA-N 389.452 2.663 0 50 GFAA CCOc1nc2ccccc2nc1N1CCC[C@@H](C(=O)NCc2cccnc2)C1 44803624 FAPBYLABAKNNAC-QGZVFWFLSA-N 391.475 2.956 0 50 GFAA COc1cccc2ccc(N3CCC[C@@]4(CCC(=O)N(CCCO)C4)C3)nc12 82121028 DYYSKPDBLWOZJY-JOCHJYFZSA-N 383.492 2.835 0 50 GFAA Cc1ccc2c(c1)cc(C(=O)N(Cc1ccccn1)C[C@@H]1CCC(=O)N1)n2C 97744882 JEEUJKSVDBTFTE-SFHVURJKSA-N 376.460 2.803 0 50 GFAA CCn1ccnc1[C@H]1CCCN(C(=O)c2c[nH]c3ccc(OC)cc3c2=O)C1 91943575 ZBOWAFXFAYJKED-AWEZNQCLSA-N 380.448 2.773 0 50 GFAA CCc1ccc(CN2CCC[C@@H](c3nnc(CN4CCOCC4)n3C)C2)cc1 426584696 MGRKFSBDUAOYGA-HXUWFJFHSA-N 383.540 2.589 0 50 GFAA O=C(c1cnc(N2CCOCC2)nc1)N1CCCC[C@H]1CCc1ccccc1 95386426 KLUMNJKUXDDBER-FQEVSTJZSA-N 380.492 2.941 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3ccc(-c4ccccc4)[nH]c3=O)CC2)nc1 91679673 FESSONYQDROCDW-UHFFFAOYSA-N 389.455 2.869 0 50 GFAA CC(C)CN1CCO[C@@H](CNC(=O)N[C@@H]2CCCOc3c(F)cccc32)C1 182120732 OUZSFSQCJJWNQX-MAUKXSAKSA-N 379.476 2.695 0 50 GFAA Cc1ccc2[nH]c(CCCNC(=O)c3ccc(N(C)CCO)cc3)nc2c1C 244795743 RMVCOKFJWKMHQV-UHFFFAOYSA-N 380.492 2.971 0 50 GFAA C[C@H]1Oc2ccccc2N(CCC(=O)N[C@H](CC(=O)O)c2cccs2)C1=O 299744020 NIRFWNHIUQTLBB-CHWSQXEVSA-N 388.445 2.584 0 50 GFAA Cc1ccc(OC[C@@H](C)NC(=O)N2CCN(Cc3ccccc3)C(=O)C2)cc1 534629975 GERKRTRNHVBBSM-GOSISDBHSA-N 381.476 2.816 0 50 GFAA COCCn1ccc2c(OCC(=O)NCc3ccc4c(c3)OCO4)cccc21 263587258 DXLURPZEUHXYIX-UHFFFAOYSA-N 382.416 2.712 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN(c2nccn3nc4c(c23)CCCC4)C1 263616056 GTAZWUOOENTANU-HNNXBMFYSA-N 379.464 2.734 0 50 GFAA COc1ccc(C(=O)N[C@H](c2nc(-c3nnc[nH]3)no2)C(C)C)cc1Cl 293424925 IAXPPNFQZLNBPD-LBPRGKRZSA-N 376.804 2.644 0 50 GFAA COCc1nnc([C@]23CC[C@H]2CCN3Cc2nc(-c3ccc(F)cc3)no2)o1 1875404491 KTHIEUXJXWTELU-DJJJIMSYSA-N 385.399 2.916 0 50 GFAA CCc1nnc2n1C[C@@H](NC(=O)N1CCC[C@@H](c3cc(O)cc(F)c3)C1)CC2 1875293916 HSCDANQGMMUKQZ-CJNGLKHVSA-N 387.459 2.589 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(c2nccc(-c3ccccc3F)n2)C1 1875286736 CJQBEUXLQOTLSC-DYVFJYSZSA-N 391.410 2.687 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)N3CC(N4CCCC[C@@H]4C)C3)CC2)cc1 952965079 FKWXHQYKAYEBLE-SFHVURJKSA-N 383.536 2.932 0 50 GFAA Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)Cn2ncc3ccccc32)c1 170632933 WPCLIKHVKJRLIG-GOSISDBHSA-N 380.473 2.885 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Cn2ccc3ccccc3c2=O)CC1 280056155 GOBOKUZRKFPZCA-UHFFFAOYSA-N 391.471 2.795 0 50 GFAA NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171951574 FEBVYIQSVPUSJD-NRFANRHFSA-N 388.471 2.666 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC(=O)NC3CCN(CC4CC4)CC3)cn2)n1 193688132 BSDDRBMJBUCFOS-UHFFFAOYSA-N 382.512 2.558 0 50 GFAA Cn1c(CN2CCN(Cc3ccc(Cl)s3)CC2)nc2ccccc2c1=O 195323887 ZSVKASJTTABRCF-UHFFFAOYSA-N 388.924 2.966 0 50 GFAA CC(C)c1cc(C(=O)N2CCC([C@@H](O)c3cccs3)CC2)nc2ncnn12 1506418284 PNNRZPZNDGQPNO-QGZVFWFLSA-N 385.493 2.895 0 50 GFAA C[C@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)C1 1704338488 CWVODWSAQKDMOK-HNNXBMFYSA-N 377.865 2.564 0 50 GFAA Nc1ncc2c(n1)[C@]1(CCCN(C(=O)CCc3c[nH]c4ccccc34)C1)CC2 1704350787 OPULGJWPYSILLK-JOCHJYFZSA-N 375.476 2.979 0 50 GFAA CCOC(=O)C1(CCOc2ccccc2)CCN(C(=O)c2ccnn2C)CC1 11953421 GBPLVCAPHNWSSP-UHFFFAOYSA-N 385.464 2.675 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCCc3cccc(F)c3)CCC2=O)cc1 12075928 BFCWLTJVASKBLO-LJQANCHMSA-N 398.478 2.974 0 50 GFAA O=C(N[C@@H]1CCOC1)c1ccccc1OC1CCN(Cc2ccccn2)CC1 12436221 XLUJFOXWXWFVCJ-GOSISDBHSA-N 381.476 2.644 0 50 GFAA COCCCNc1nc2nonc2nc1N(C)[C@@H](C)c1nc(C)sc1C 12439736 ZDFOTIVFZLDVRD-VIFPVBQESA-N 377.474 2.732 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)CCCCC1 12593974 FQNSFQDAFPNDCX-QGZVFWFLSA-N 375.557 2.938 0 50 GFAA CC(=O)N1CCC[C@H]1C(=O)N1CCC(CCC(=O)Nc2cccc(C)c2)CC1 12716349 CMPFPXUSEKSOEP-FQEVSTJZSA-N 385.508 2.963 0 50 GFAA CO[C@H](C)C(=O)N1CCC2(CC1)OCCc1cc(C(=O)NC(C)(C)C)sc12 1857692498 HNQFAMZBBFXDQB-CYBMUJFWSA-N 394.537 2.702 0 50 GFAA O=C(c1ccc(-c2ccccc2F)cc1)N1CC[C@H](O)[C@@]2(CCCNC2=O)C1 1857693025 FKXFMHGBHFUDFI-SIKLNZKXSA-N 382.435 2.596 0 50 GFAA COCC1(C(=O)NC[C@H]2[C@H]3CN(Cc4cccs4)C[C@]34CC[C@H]2O4)CCC1 1857714653 FZLOXGSBNVTRJD-XKGFGPFHSA-N 390.549 2.660 0 50 GFAA O=C(Cc1noc2ccccc12)N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857716676 DIXKSJIUQBCMHQ-XGHQBKJUSA-N 377.444 2.701 0 50 GFAA Cc1ccc2c(C(=O)N3C[C@@H](O)[C@H](Cc4ccnc5ccccc45)C3)cnn2c1 1857720606 BLNBFBSBKCTASD-VGOFRKELSA-N 386.455 2.867 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)ccc1F 1857736479 QMZPHUUZSNXMGC-ZDUSSCGKSA-N 376.457 2.778 0 50 GFAA CCCO[C@@H]1CC[C@H](c2nc(-c3c[nH]nc3C)nn2-c2ccccn2)C[C@H]1N 1857736728 SLNDFHYCLHVJQC-USXIJHARSA-N 381.484 2.751 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)c1ccc(I)cc1 2870212 ZBZLPJBDOBJPFJ-UHFFFAOYSA-N 381.169 2.950 0 50 GFAA CCN1CCC(N2C[C@@H]3OC(=O)N(CCc4cccc(Cl)c4)[C@@H]3C2)CC1 249691102 KYZDFLUAHFOMJD-MOPGFXCFSA-N 377.916 2.872 0 50 GFAA Cc1cc(C(=O)NC2CCN(C(=O)C(C)(C)C)CC2)cc(C)c1OCC(=O)O 832863556 REIVFMZXPLIGOB-UHFFFAOYSA-N 390.480 2.534 0 50 GFAA COc1cc(C(=O)Nc2cccc(S(=O)(=O)N(C)c3ccccc3)c2)ncn1 1264173514 VIKKHOUQKCHHNZ-UHFFFAOYSA-N 398.444 2.563 0 50 GFAA CCO[C@@H](C(=O)NC1(CC)CCN(C(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)CC1)C1CC1 2325794171 TUWDTZAWPCCHCP-INDMIFKZSA-N 392.540 2.504 0 50 GFAA Nc1ncnc2c1ncn2[C@@H]1CCN(Cc2csc(Br)c2)C1 2325803851 GMXIEZQNZCEEMP-SNVBAGLBSA-N 379.287 2.680 0 50 GFAA CCCCOC(=O)c1ccc(NC(=O)CN2C(=O)c3ccccc3C2=O)cc1 1782780 CYKZPWGFWMJOHB-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA COC(=O)c1cc(NC(=S)NCCc2ccc(F)cc2)cc(C(=O)OC)c1 2237676 TVNAASCSXQRRQI-UHFFFAOYSA-N 390.436 2.928 0 50 GFAA COC(=O)Cc1ccc2c(c1)NC(=O)[C@@H](CCOC(=O)C1CCCCC1)O2 4038071 SEHXRONZAXHLRD-QGZVFWFLSA-N 375.421 2.615 0 50 GFAA c1ccc(CCN2CN(CCN3CCOCC3)c3nc4ccccc4n3C2)cc1 6660881 ADCCLQPJVIDXGR-UHFFFAOYSA-N 391.519 2.648 0 50 GFAA CC(=O)N1CCN(Cc2nc3cc(NC(=O)c4cccs4)ccc3n2C)CC1 12379410 ZUEHWDFFDLPHMP-UHFFFAOYSA-N 397.504 2.551 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccco4)C3)C2=O)c1OC 12431317 JNLQWVXITIDSFA-QFIPXVFZSA-N 398.459 2.952 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2CCCO2)CC1)Nc1ccc2c(c1)OCCO2 12719080 WMALTXXQRZPEAN-GOSISDBHSA-N 388.464 2.594 0 50 GFAA CCNC(=O)c1cn(CC(C)C)cc(C(=O)N2CC[C@@H]3CCCC[C@H]3C2)c1=O 14879064 HEUZJSYECUUHBI-IRXDYDNUSA-N 387.524 2.906 0 50 GFAA COCCN(C(=O)CCc1nnc(CCc2ccc(OC)cc2)o1)C(C)C 14967757 QGNQXPNTUYFQTB-UHFFFAOYSA-N 375.469 2.679 0 50 GFAA CC(C)[C@H]1CN(C)CCN1C(=O)c1cn(Cc2cccc3ccccc23)nn1 15072971 FVHANCALONOODH-OAQYLSRUSA-N 377.492 2.892 0 50 GFAA CC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)c1 19636192 UIGARGGLIGTSFC-QHCPKHFHSA-N 387.568 2.631 0 50 GFAA OCC[C@H]1CN(Cc2cccn2-c2cccnc2)CCN1CCc1ccccc1 20206488 UHWOEHCIQOUCFD-QHCPKHFHSA-N 390.531 2.984 0 50 GFAA C[C@@H](NC(=O)CSc1nnc([C@@H](O)c2ccccc2)n1C)c1ccccc1 30953050 IRVFNKDIZOHQER-KDOFPFPSSA-N 382.489 2.866 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@@H](C(=O)NCCc4ccccc4)C3)nn12 32094332 SWHXLIKWIMRFSJ-GOSISDBHSA-N 392.507 2.823 0 50 GFAA O=C(NCc1nc(-c2ccccc2)cs1)[C@H]1CC(=O)N(Cc2ccccn2)C1 52820944 OUUUWNPVZJZHGH-INIZCTEOSA-N 392.484 2.870 0 50 GFAA O=S1(=O)CC[C@H](n2cnc(-c3ccccc3)c2-c2cnn3cccnc23)C1 65434555 IUYAGEXFVDJRGM-HNNXBMFYSA-N 379.445 2.619 0 50 GFAA OCCn1c(N2CCN(Cc3cccc4[nH]ccc34)CC2)nc2ccccc21 67756494 VZCRYRZCLWCONJ-UHFFFAOYSA-N 375.476 2.832 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)COCc2nc3ccccc3[nH]2)C[C@H]1O 67981654 JTYYWFGBCBHEKD-RHSMWYFYSA-N 385.489 2.826 0 50 GFAA CN(Cc1cc(C(C)(C)C)n[nH]1)c1nc(-c2ccccn2)nc2c1CCNC2 72144601 JHGVAKRRYRSPGX-UHFFFAOYSA-N 377.496 2.841 0 50 GFAA NC(=O)c1cccc(C[C@@H]2CCN(C(=O)CCN3Cc4ccccc4C3)C2)c1 72168204 UOQHVAUWMRPAKG-SFHVURJKSA-N 377.488 2.582 0 50 GFAA CCc1nccn1CCC(=O)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 72171188 OTJVIZSOAZKALR-UEVCKROQSA-N 378.520 2.924 0 50 GFAA Cc1nn(C)c2nc(-c3ccccn3)nc(N3CC[C@@]4(O)CCCC[C@H]4C3)c12 72421596 SSUPUYQSGMEUAG-BTYIYWSLSA-N 378.480 2.865 0 50 GFAA CC(C)Cc1nc(CN2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)no1 91643353 CCGCSCSNUBCNNF-KRWDZBQOSA-N 390.528 2.652 0 50 GFAA O=C(CCc1cc2n(n1)CCN(Cc1nc3ccccc3[nH]1)C2)NC1CCCC1 91965505 YKRWLTUKFFDDSZ-UHFFFAOYSA-N 392.507 2.767 0 50 GFAA CN(C)[C@H](C(=O)NCCc1csc(-c2cnccn2)n1)c1ccc(F)cc1 95356459 FGKVVVQIIGTLSC-KRWDZBQOSA-N 385.468 2.701 0 50 GFAA Cc1ccn(CCC(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)n1 95530473 BAUKXJBANMYSNC-UHFFFAOYSA-N 378.480 2.628 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1C(=O)N1CCCCC1 101785639 DJYKBYCMIDUIAN-RLFYNMQTSA-N 392.521 2.788 0 50 GFAA Cc1cccc2[nH]cc(CCNC(=O)NC3CCN(C[C@H]4CCOC4)CC3)c12 132919944 LTUOCWRRPRUVJW-QGZVFWFLSA-N 384.524 2.819 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)[C@@H]2C[C@H]2c2cccnc2)c1 133960108 MRRBWDZMAUFKGK-UONOGXRCSA-N 378.837 2.546 0 50 GFAA CCC(=O)N1CC[C@@H](NC(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)C1 151645855 IOJWBCMGZRLVNA-QGZVFWFLSA-N 397.479 2.637 0 50 GFAA CCOc1cc(N2CCN(C(C)C)CC2)ccc1NC(=O)COCC1CC1 170606063 CNFOMCJBUZJAOM-UHFFFAOYSA-N 375.513 2.981 0 50 GFAA CCN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](c3ccn[nH]3)C2)CC1 171138072 RQTFIRVMRXHKEL-QGZVFWFLSA-N 382.512 2.963 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)c1cc2ccccc2[nH]1 173048507 GHHGLUSFGHMMCX-GOSISDBHSA-N 391.427 2.990 0 50 GFAA O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCN(C2CC2)CC1 187499739 YFNDDHYROGMLFR-UHFFFAOYSA-N 378.904 2.915 0 50 GFAA O=C(NOC[C@H]1CCOC1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 188320715 NDCYIBMOJJLPAN-NHYWBVRUSA-N 387.263 2.682 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NC3C[C@@H]4CC[C@H](C3)N4)cc2)cc1 237955738 ZXRSKXWJYMTSHL-YOFSQIOKSA-N 398.528 2.982 0 50 GFAA O=C(O)c1cc(C(=O)N2CCO[C@@H](c3cccc(F)c3)C2)n(-c2ccccc2)n1 237980938 XMLWXBHWDCPZLA-LJQANCHMSA-N 395.390 2.923 0 50 GFAA C[C@H](NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1)[C@H]1C[C@H]2CC[C@H]1C2 239306111 GLBFXFWCXUATLV-AYMQEEERSA-N 384.929 2.901 0 50 GFAA Cc1cc(C)n(C(=O)[C@H](Cc2ccccc2)N2C(=O)[C@@H]3CCCC[C@H]3C2=O)n1 239439359 ZUPWIBSQWPGFOD-QRVBRYPASA-N 379.460 2.927 0 50 GFAA CCn1nc(C)c(CN2CCN(S(=O)(=O)c3ccccc3Cl)CC2)c1C 252500926 TZLKOUZVHMFHNO-UHFFFAOYSA-N 396.944 2.680 0 50 GFAA CC(C)N(CCN1CCCCCC1)C(=O)c1ccc(F)c(NS(C)(=O)=O)c1 253419888 DBKWWHANWQEALO-UHFFFAOYSA-N 399.532 2.924 0 50 GFAA Cc1ccc(/C=C/C(=O)N2CCN(c3nccn4nc5c(c34)CCCC5)CC2)o1 253475291 QZODGRBFEGLJIQ-CMDGGOBGSA-N 391.475 2.872 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1 265614305 VVONJKITOIPXJF-GOSISDBHSA-N 384.407 2.894 0 50 GFAA CC(C)S(=O)(=O)c1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)cc1 268937429 HPSFBVMQKSECPG-SFHVURJKSA-N 387.457 2.520 0 50 GFAA Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3ccc4c(c3)NC(=O)CNC4=O)C2)cc1 295378592 OWQIGVFMSHMSQS-PBHICJAKSA-N 377.444 2.695 0 50 GFAA CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(F)cc2C(F)(F)F)C1 298921395 ATSQIUFTFIXPAN-LBPRGKRZSA-N 396.406 2.522 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)Nc3ccnn3-c3ccccc3)CC2)n1 299779996 QWNDPTAKYSXFFQ-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CC(C)n1cc(C[C@@H]2N=C(O)N(Cc3csc(Br)c3)C2=O)nn1 328610683 ITLLUMSWSIOTTJ-NSHDSACASA-N 398.286 2.551 0 50 GFAA COc1ccccc1[C@H]1CCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)C1 363418238 FITLSTYEKRRPKA-RBUKOAKNSA-N 393.487 2.959 0 50 GFAA CC(=O)N1CCC(NC(=O)CN2CCC3(CC2)C2CC4CC(C2)CC3C4)CC1 364544469 WSSZTVBLLXEWCV-UHFFFAOYSA-N 387.568 2.652 0 50 GFAA COc1ccc([C@@H](OC)[C@@H](C)NC(=O)NCc2ccc(-n3ccnc3)nc2)cc1 378383350 PUAUXNQTJDLQNC-QRWLVFNGSA-N 395.463 2.851 0 50 GFAA Cc1ccnc(C[C@@H](C)N(C)C(=O)c2ccc(-c3ccc(=O)n(C)n3)cc2)c1 534643551 YGRHPBMSKDETFT-MRXNPFEDSA-N 376.460 2.854 0 50 GFAA O=C(Cn1cnc2ccsc2c1=O)Nc1ccccc1OC[C@@H]1CCCO1 827861321 CLXYQJCFXQRENF-ZDUSSCGKSA-N 385.445 2.655 0 50 GFAA O=C(c1ccccn1)N1CCC(N[C@H](Cn2cccn2)c2ccccc2)CC1 828184290 XAMORPVVWZLBNJ-OAQYLSRUSA-N 375.476 2.914 0 50 GFAA O=C(NS(=O)(=O)c1cc(Br)cs1)[C@@H]1CCOC2(CCC2)C1 893013311 KKIRNLLPUSNYOX-SECBINFHSA-N 394.312 2.665 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@H](c3nccn3C)C3CC3)o2)c1C 1506399263 LGVJOOJHEBLREZ-HNNXBMFYSA-N 376.438 2.715 0 50 GFAA O=C(NC[C@@H]1CCCN(c2ncc(Cl)cc2F)C1)c1cc2ncccn2n1 1506420526 HJAYXJVOZKFXKY-LBPRGKRZSA-N 388.834 2.563 0 50 GFAA CCOc1ccc(CN(C2CC2)S(=O)(=O)N2CCC[C@H](COC)C2)cc1 1506420964 FDFLIKGLERTPAV-KRWDZBQOSA-N 382.526 2.653 0 50 GFAA CCCNc1ccccc1C(=O)N1CCCN(C(=O)CCn2cc(C)cn2)CC1 1529118214 GMAVXTBKIMEHGR-UHFFFAOYSA-N 397.523 2.778 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)c1cn2cc(Cl)ccc2n1 1565527877 QGTGMWOYBUHJNA-CJNGLKHVSA-N 386.883 2.851 0 50 GFAA CC1CCN(Cc2ccc(C(=O)N[C@H]3COC[C@@H]3Cc3ccncc3)o2)CC1 1615965686 MNNGQQKRCINPSP-ICSRJNTNSA-N 383.492 2.894 0 50 GFAA Cc1nccnc1N1C[C@H]2CN(Cc3coc(C(C)C)n3)C[C@@]2(CCC(=O)O)C1 1772804216 JLDSHNRHZBDCBP-IERDGZPVSA-N 399.495 2.700 0 50 GFAA Cc1cncc(CC(=O)NC2(C3CCN(c4cc(C)nc(C)n4)CC3)CC2)c1 1775991629 LIWJRZVRCITJHE-UHFFFAOYSA-N 379.508 2.905 0 50 GFAA CCc1ccc(CCC(=O)NC[C@H]2COCCN2C(=O)/C=C(\C)C2CC2)cc1 1775992526 QWEUWAVBELAJAZ-UEBLJOKOSA-N 384.520 2.882 0 50 GFAA CN(C)S(=O)(=O)N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1cccc(Cl)c1Cl)C2 1857684335 JMPOCWASMXUTID-VIKVFOODSA-N 392.352 2.600 0 50 GFAA O=C(NCc1ccccc1Cl)[C@@]12CCCCN1C[C@@H](NC1CCOCC1)C2 1857689107 FEJAALUNKVOKNP-RXVVDRJESA-N 391.943 2.722 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccccc4)C[C@]34CC[C@H]2O4)n1 1857737281 FQYAPOOJYPGCBV-KLJZETAQSA-N 377.488 2.799 0 50 GFAA O=C1CC[C@@H](Nc2cc(N3CCCCCC3)nc(-c3ccccc3)n2)C(=O)N1 1857797741 IMZSGQUPLSBJLM-MRXNPFEDSA-N 379.464 2.741 0 50 GFAA CCCCN1CCC[C@]2(CCc3c2nc(C)[nH]c3=NCc2nncn2CCC)C1 1875243045 MZKCXHGXMKFWRT-QFIPXVFZSA-N 397.571 2.900 0 50 GFAA CO[C@@H](C(=O)N1CCC(n2c(O)nc3ccccc32)CC1)C1CC(F)(F)C1 1875280151 XCLWBDNJRRUZLV-MRXNPFEDSA-N 379.407 2.966 0 50 GFAA CN(C)C1(C(=O)N[C@H](CNc2ncnc3scnc23)C(C)(C)C)CCCC1 1875326674 RXPHTRYOTOULOY-CYBMUJFWSA-N 390.557 2.904 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](C)c3cnn(C(C)C)c3)C2)c1C 1875397439 AIBZHQQPTAMKAS-FUHWJXTLSA-N 399.543 2.502 0 50 GFAA COc1ccc2ccccc2c1CN[C@@H]1C[C@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875398533 URADIJQKXGRTJU-VHKYSDTDSA-N 395.459 2.672 0 50 GFAA O=C(c1ccncc1)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940198485 ZTFACQVTIBLXHG-UHFFFAOYSA-N 387.443 2.759 0 50 GFAA CC(C)(C)n1ccc(-c2nc(C3CCOCC3)nn2[C@@H]2CCS(=O)(=O)C2)c1 2100543097 LOJFGVNJWRTZRV-MRXNPFEDSA-N 392.525 2.755 0 50 GFAA O=C([C@@H]1OC[C@@H]2CCC[C@@H]21)N1Cc2ccc(CN=c3[nH]cncc3Cl)cc2C1 2325794121 RCAHXMQODQBYLO-VDZJLULYSA-N 398.894 2.821 0 50 GFAA CC(C)C(C)(C)C(=O)N[C@H]1CC12CCN(C(=O)[C@@H]1CN3CCC1CC3)CC2 2325794133 RMXAVGCUBLUECW-MSOLQXFVSA-N 375.557 2.508 0 50 GFAA Cn1c(CNC(=O)c2cc(Cl)cc(N3CCCC3=O)c2)nc2cccnc21 2325806386 OXYYMMFKIZGRPJ-UHFFFAOYSA-N 383.839 2.679 0 50 GFAA CCc1nc(-c2nc[nH]n2)sc1C(=O)N1CCCc2cc(CCN)ccc21 2325858979 IZOVERTXRIVHEU-UHFFFAOYSA-N 382.493 2.585 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)N2CCC3(CCCO3)CC2)[C@H]1c1ccccc1 2356167970 KLQBHEZQPFBNEN-UXHICEINSA-N 386.492 2.535 0 50 GFAA COC(=O)c1sc(NC(=O)c2ccc3c(c2)OCO3)c(C(=O)OC)c1C 668697 GKPWTCHRBVTLSU-UHFFFAOYSA-N 377.374 2.611 0 50 GFAA CCCNC(=O)CN(c1ccc(OCc2ccccc2)cc1)S(C)(=O)=O 2875309 ZZUSVKPNJBUXIE-UHFFFAOYSA-N 376.478 2.558 0 50 GFAA CC(C)(C)SCCNC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 2992994 LCWSCIKNQWFOPA-UHFFFAOYSA-N 378.947 2.754 0 50 GFAA Cc1ccc(CN(C)C(=O)[C@H]2OCC(=O)N[C@@H]2c2ccccc2Cl)s1 2356163538 IAVLJIBQGHINDA-SJORKVTESA-N 378.881 2.925 0 50 GFAA Cc1ncccc1C(=O)NCCOc1ccc(I)cc1 225756139 LROHGFXXMDQJAA-UHFFFAOYSA-N 382.201 2.803 0 50 GFAA CCN1[C@@H](c2ccc(Cl)cc2)[C@@H](CNCc2cnn(C)c2)C[C@@]1(C)CO 20910998 XJBHIZIWSSDBAP-HOJAQTOUSA-N 376.932 2.997 0 50 GFAA C[C@H](NC(=O)N1CCNC(=O)C[C@H]1c1ccccc1)[C@@H]1CCCN(C2CCC2)C1 248389660 AZRWXOCRMPWFDK-DSKINZAPSA-N 398.551 2.912 0 50 GFAA Cc1cnc(NC(=O)[C@H](C)SCc2nc3sc(C)c(C)c3c(=O)[nH]2)[nH]1 135705093 ZQJIQJXHOPHHMO-JTQLQIEISA-N 377.495 2.893 0 50 GFAA Cc1ccc(CN2C[C@H](n3cnnn3)C[C@H]2C(=O)NC2CCCCCC2)c(C)c1 64083867 QPDAPLMVKQTRJY-RTWAWAEBSA-N 396.539 2.945 0 50 GFAA CC1(C)CCN(c2ccc(C(=O)N3CCC(N4CCOCC4)CC3)cn2)CC1 67674665 PZNYPDYGPVNIBO-UHFFFAOYSA-N 386.540 2.645 0 50 GFAA Cn1cnc(-c2nc(O)cc(CNC(=O)c3cc4c(s3)CCCCC4)n2)c1 63857036 BVGRLFMCQJVPQG-UHFFFAOYSA-N 383.477 2.843 0 50 GFAA CN(Cc1cnc(N)nc1)C(=O)c1coc(COc2ccc(F)cc2Cl)n1 67650390 VQQAYBXCCUWSBV-UHFFFAOYSA-N 391.790 2.691 0 50 GFAA CCOC(=O)c1ccc(-n2ccc3nc(N4CCCCC4)ncc3c2=O)cc1 22608831 PXOBBXCEJBHLFQ-UHFFFAOYSA-N 378.432 2.948 0 50 GFAA CN(Cc1cccc(O)c1)C(=O)[C@H]1C[C@@H](C(=O)O)N(C)[C@H]1c1ccccc1F 67920408 HMLZJMWIEMSNTH-WDSOQIARSA-N 386.423 2.636 0 50 GFAA Cn1nc(C(=O)O)c2c1CCN(C(=O)CSC13CC4CC(CC(C4)C1)C3)C2 67726675 NUPWIPSAYJJLGO-UHFFFAOYSA-N 389.521 2.705 0 50 GFAA C[C@@H]1CN(C)[C@H](C)C[C@@H]1Nc1cnc(N2CCOCC2)c(Br)c1 253430842 MBEQOAGNOIHSSM-IOASZLSFSA-N 383.334 2.821 0 50 GFAA CCO[C@H]1C[C@@H](NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)C12CCC2 152497416 VWOMVCPSBZHZLN-MSOLQXFVSA-N 385.439 2.758 0 50 GFAA COc1cccc(CN2CC3(CCN(c4ncnc5c4CCC5)CC3)CC2=O)c1 77287102 HOWZJVJTKAJDCD-UHFFFAOYSA-N 392.503 2.993 0 50 GFAA CO[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc3ccccc3c2O)C1 363092951 RBGUDKRZGXJLJA-LPHOPBHVSA-N 382.460 2.787 0 50 GFAA CC(C)c1cnc(NC(=O)N2CCC[C@H]2c2nc(C(=O)NC3CC3)no2)s1 365191256 KHLRHLUDARTXIK-NSHDSACASA-N 390.469 2.911 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@@H](C(=O)N4CCCC4)C3)CC2)cc1 71753165 NHNARMSFWQBBGP-HXUWFJFHSA-N 383.536 2.934 0 50 GFAA C[C@H](C(=O)N1CCNC[C@@H]1c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1 262101077 VBKZKBNQHAPKHS-RDTXWAMCSA-N 396.882 2.728 0 50 GFAA CC[C@H](C)NC(=O)Cn1c(Cc2ccccc2)nn(-c2ccccc2OC)c1=O 77339874 XQDDPESNQWSCCU-INIZCTEOSA-N 394.475 2.548 0 50 GFAA Cc1cc(=O)oc2cc(OCCN3CCC[C@H](c4nnc5n4CCC5)C3)ccc12 158384277 LCUIZORMNUZGHR-INIZCTEOSA-N 394.475 2.898 0 50 GFAA CCCc1cc(N[C@@H]2CCN(CCCc3ccccc3)C2=O)n2ncnc2n1 225456507 LIYSOOWPFSEHCU-GOSISDBHSA-N 378.480 2.722 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Cn2cc(-c3ccccc3)nn2)CC1 178057101 HQVAZARHTLZDJZ-UHFFFAOYSA-N 391.475 2.739 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(C(=O)c3cccc(F)c3)CC2)n1C 96150396 RQBZLLXKFBJJPA-UHFFFAOYSA-N 382.443 2.527 0 50 GFAA COc1ccc2c(c1)cc(C(=O)N[C@@H]1c3ccccc3C[C@H]1NC(C)=O)n2C 91381832 XNBZNSXQCVEDEV-WIYYLYMNSA-N 377.444 2.719 0 50 GFAA NCCc1cccc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)c1 91427077 JJGUHVUPRSOHHO-UHFFFAOYSA-N 392.547 2.988 0 50 GFAA Cc1cc(C)n2ncc(C(=O)N3C[C@H]4CC[C@@H]3CN(Cc3cscn3)C4)c2n1 91780060 MYPVNMYDYBFBGR-DOTOQJQBSA-N 396.520 2.539 0 50 GFAA CNc1ncc(-c2nc(CCOC)nn2Cc2c(F)cccc2Cl)cn1 96138739 DXRVCKJNXHHJGB-UHFFFAOYSA-N 376.823 2.807 0 50 GFAA c1ccc(-c2nn(-c3ccccc3)cc2-c2cn(C[C@H]3CNCCO3)nn2)cc1 95363726 DRWAGVXBEBOZGE-LJQANCHMSA-N 386.459 2.786 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)cc1 91380751 GNNFYAVTVBCLNG-UHFFFAOYSA-N 396.491 2.506 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccc(-c3cccc4ccnn34)cc2)CC1 534574423 DFIRCAPHILNYAT-UHFFFAOYSA-N 378.432 2.916 0 50 GFAA NC(=O)[C@@H]1C(=O)N(CCC2=CCCCC2)[C@@]23CCOC[C@H]2[C@H]1c1ccccc1O3 826828486 IFOPXEFWHTXBMX-JEBQKTDQSA-N 396.487 2.730 0 50 GFAA biogenic O=C1NCCN1c1ccc(C(=O)N2CCC[C@H]2Cn2cnc3ccccc32)cc1 270182348 XFWFSKDYTRTRMU-SFHVURJKSA-N 389.459 2.871 0 50 GFAA COc1ccc(-n2cccn2)cc1S(=O)(=O)NCCCc1ccccc1F 670465040 FKTLEEHKSIYELC-UHFFFAOYSA-N 389.452 2.931 0 50 GFAA COc1ccc2c(=NC(=O)c3cc(Cl)ccc3OCCN(C)C)[nH][nH]c2c1 1875265379 ZUHOCUZUHVBTCN-UHFFFAOYSA-N 388.855 2.840 0 50 GFAA C[C@H]1CCNC(=O)[C@@H]1CN1CCC(=O)N(CCc2cc3ccccc3s2)C1=O 1875299044 WPYABGMXTGKGJQ-WMLDXEAASA-N 399.516 2.870 0 50 GFAA NC(=O)c1cc(F)ccc1N1CCN(C(=O)c2ccc3c(c2)[C@H]2CC[C@H]3O2)CC1 1875310316 MIBRWFQFZGTLEM-WOJBJXKFSA-N 395.434 2.793 0 50 GFAA CCN1CC[C@H](CN(C)S(=O)(=O)c2ccc(Cl)c(Cl)c2OC)C1 952976350 MXZYUVHQBRQQJP-LLVKDONJSA-N 381.325 2.964 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)c2cccs2)C1)c1ccccc1N1CCOCC1 952981249 LFCWZXPDTQGWKT-MRXNPFEDSA-N 399.516 2.619 0 50 GFAA CN(C[C@@H](O)COCc1ccc2c(c1)OCO2)C(=O)Nc1cccc(F)c1 888093120 XORDUFPNFWNDBO-MRXNPFEDSA-N 376.384 2.596 0 50 GFAA CO[C@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1 1775957231 JPVVHQITLDWRQZ-VHDGCEQUSA-N 377.828 2.571 0 50 GFAA O=C([C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)N1CCC[C@H](N2CCNCC2=O)C1 186599752 ANAYRIZGINRFFV-NUEKZKHPSA-N 396.318 2.520 0 50 GFAA Cc1cc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)ccc1-n1cncn1 192355787 KSNYNCOEZVTFJS-JOCHJYFZSA-N 391.519 2.956 0 50 GFAA Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)NCc3nc(N(C)C)no3)c12 193125018 HJRAEEWHHDORQG-UHFFFAOYSA-N 399.499 2.997 0 50 GFAA CCCc1noc2nc(C3CC3)cc(C(=O)NS(=O)(=O)N3CCCCC3)c12 194681861 RRZQMOCYKAPPQX-UHFFFAOYSA-N 392.481 2.513 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2c2cccc(OC)c2)cc1 1191601524 ANXRXCCHPJCMBM-IBGZPJMESA-N 388.489 2.971 0 50 GFAA C[C@@H](Cc1ccc2c(c1)OCO2)CN1CCC(=O)N(Cc2cscn2)CC1 1506405709 LDSWCMIHBOAFCS-HNNXBMFYSA-N 387.505 2.785 0 50 GFAA C[C@H](CN1CCc2nnc(CCNC(=O)c3ccco3)n2CC1)c1ccccc1 12279004 BCHNYFZXJUCBKA-QGZVFWFLSA-N 393.491 2.505 0 50 GFAA COCCC(=O)N(CCN1CCCCC1)C[C@@H]1CCCN(C2CCCC2)C1 12578635 AHTHSHBTIYABAR-HXUWFJFHSA-N 379.589 2.992 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)c2ccoc2C)CC1 12591990 SMWVETDTOJLTIH-SFHVURJKSA-N 375.513 2.821 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3nc4ccccc4s3)C2)nc1 12754897 DYFKJIMVHMBCPF-CQSZACIVSA-N 396.472 2.877 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)CCc2ccccn2)CCC1=O 15072758 YOUMUUBQHWBTQB-GOSISDBHSA-N 381.476 2.530 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@@H](C)C2)sc2c1CCCC2 19791874 SDXBQENMOLIGQT-STQMWFEESA-N 380.510 2.851 0 50 GFAA Cc1cc(-c2nccn2-c2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)ccc1O 1857681817 OMWLXKMDMDAEPW-INIZCTEOSA-N 386.477 2.726 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc(Cl)s1)CC2 1857689673 UXUUJLUWXHQBRE-AWEZNQCLSA-N 394.928 2.923 0 50 GFAA O=C(c1cc2c(s1)C1(CCNCC1)OCC2)N1CCC[C@@H](c2cc[nH]n2)C1 1857703462 QLEGTAJVUHAGNZ-OAHLLOKOSA-N 386.521 2.642 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)COc2ccc(Cl)c(Cl)c2)C[C@@H]1O 1857716608 BVNXVGMYJHEJKN-DOTOQJQBSA-N 376.280 2.744 0 50 GFAA O=C(Nc1ccccc1-c1ccccc1)N[C@H]1C[C@H]2CO[C@@H](CCO)CN2C1 1857729874 VDRFDKYVTZMCMU-FHWLQOOXSA-N 381.476 2.699 0 50 GFAA Cc1ncccc1CN1C[C@@H]2[C@H](CNC(=O)c3cccs3)[C@H]3CC[C@]2(C1)O3 1875248538 WRKHBGRGCVAKFA-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA COc1ccc(CN2CCO[C@@H](CO)[C@@H]2c2ccccc2Cl)cc1C(=O)O 1875249444 TVMXOAAIELNIIF-OALUTQOASA-N 391.851 2.981 0 50 GFAA Cc1cc2c(N3CCN(CC(=O)N4C[C@@H](C)C[C@H](C)C4)CC3)ncnc2s1 301868689 ISTXWTYFFUGHTP-GJZGRUSLSA-N 387.553 2.626 0 50 GFAA CC(C)Oc1ccccc1C(=O)N1CCc2nc(NS(C)(=O)=O)sc2C1 332645404 SACIKZDBWVJZQH-UHFFFAOYSA-N 395.506 2.500 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N(CCC(=O)O)C[C@H]3CCCO3)cc2F)n1 237679944 OIUDUGSVGMXEEE-MRXNPFEDSA-N 389.427 2.724 0 50 GFAA COc1ccc(CC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccc2)cc1 247906998 IMKJFEXUCHODKS-UXHICEINSA-N 378.472 2.887 0 50 GFAA CN1CCN(C(=O)NCC2(c3ccc(F)cc3)CC2)C[C@H]1c1nc(C2CC2)no1 375496598 RCPAPSYZAYSWPB-KRWDZBQOSA-N 399.470 2.816 0 50 GFAA COc1cc(S(=O)(=O)N2CCN(c3ccccc3F)CC2)ccc1Cl 1072241 JVSXICJXNNWWSM-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA O=C(NCc1cccnc1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 6492306 IBJBQDWFMWYIDM-UHFFFAOYSA-N 393.896 2.840 0 50 GFAA COC(=O)c1ccc(N2C(=O)C[C@@H](NCCc3ccc(Cl)cc3)C2=O)cc1 19830939 NPNPAVVCZIDHJC-QGZVFWFLSA-N 386.835 2.591 0 50 GFAA O=C(CCS(=O)(=O)C1CCCC1)N[C@@H]1CCc2c1cc(F)c(F)c2F 2325813080 JHWINQHYEFAUGM-CQSZACIVSA-N 375.412 2.955 0 50 GFAA Cc1nc(O)[nH]c1C(=O)N[C@@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 1450297499 XOPTXNJGFTUBAF-MAUKXSAKSA-N 397.406 2.744 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 839203 CVYPXYYXVKEBGK-LJQANCHMSA-N 393.443 2.929 0 50 GFAA COc1ccc(OC)c([C@@H]2C(C(=O)Nc3cccnc3)=C(C)Nc3ncnn32)c1 949751 IGYWUKXPORFHPS-GOSISDBHSA-N 392.419 2.618 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC(=O)N(C)C)c2ccc(F)cc2)cc1 1110682 CIZLKTYPDYCJIE-UHFFFAOYSA-N 380.441 2.508 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)NCc2cccc3ncsc23)CC1=O 2356145360 MPYJESTZTYOAIX-CQSZACIVSA-N 381.457 2.974 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2cnn(-c3ccccc3Cl)c2)CC[C@H]1O 2356145618 FSPSDRITQKLRDD-IEBWSBKVSA-N 377.872 2.963 0 50 GFAA COc1cc(C(=O)N2CCC[C@]3(CCc4c[nH]c(=N)nc43)C2)nc2ccccc12 2356153441 HHYRQWXTZGYXNB-QFIPXVFZSA-N 389.459 2.566 0 50 GFAA COc1ccc(N(CC(=O)N[C@@H](C)c2ccccc2)S(C)(=O)=O)cc1Cl 4995782 AZLWLCNRDXSHGL-ZDUSSCGKSA-N 396.896 2.992 0 50 GFAA COc1ccccc1N1CCN(C(=O)C2CCN(C(=O)C(C)(C)C)CC2)CC1 7282469 PRRMBDMVZXXEHQ-UHFFFAOYSA-N 387.524 2.629 0 50 GFAA CC1CCN(C(=O)C[C@H]2C(=O)NCCN2Cc2cccc(C(F)(F)F)c2)CC1 55182603 KXIHZGZPYSSTHZ-KRWDZBQOSA-N 397.441 2.654 0 50 GFAA COc1ccc(OC)c(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)c1 22932944 XBKMPEYOPWNMFO-NRFANRHFSA-N 384.520 2.815 0 50 GFAA CC[C@@H](OC)C(=O)N1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67965441 LELFBWWDJHQYBI-LJQANCHMSA-N 380.492 2.706 0 50 GFAA Nc1ccnc(N2CCC(n3nccc3NC(=O)CCc3ccccc3)CC2)n1 67714509 IXUHBTMXESHDBB-UHFFFAOYSA-N 391.479 2.668 0 50 GFAA OCC[C@H]1CN(Cc2cccc3c2OCO3)CCN1CCCc1ccccc1 20204153 LBBNTXIIGXIBSG-NRFANRHFSA-N 382.504 2.917 0 50 GFAA O=C(Cc1cc2ccccc2[nH]c1=O)NCc1ccnc(N2CCCCC2)c1 120225373 SEPJIXZQPYOHJY-UHFFFAOYSA-N 376.460 2.772 0 50 GFAA Cc1ccc2nc(NC(=O)CN3CCN(C(=O)c4ccco4)CC3)sc2c1 35804731 WRFKPTKFXBAWKI-UHFFFAOYSA-N 384.461 2.594 0 50 GFAA Cn1cc(S(=O)(=O)NCc2cn(-c3ccccc3)nc2-c2ccccc2)cn1 2804422 SBHZUPRAFFJBBC-UHFFFAOYSA-N 393.472 2.751 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccc(C(=N)O)cn3)CC2)cn1 328642178 QXUVALKSZIQMRX-HNNXBMFYSA-N 382.468 2.533 0 50 GFAA COc1ccc2c(c1)CN(C(=O)c1nc(O)nc(O)c1N)[C@H](C1CCCCC1)C2 368548759 KSJGYQNBLUUZTJ-INIZCTEOSA-N 398.463 2.626 0 50 GFAA COc1ccccc1O[C@@H]1CCCN(C(=O)c2ccc3[nH]c(=O)n(C)c3c2)C1 285922428 UUGVCTXZPGFYAS-OAHLLOKOSA-N 381.432 2.559 0 50 GFAA Cc1cc(C(=O)N2CCC(c3n[nH]c(=O)n3Cc3ccccc3)CC2)c(C)o1 72161792 RYSIMDGRDCVLGB-UHFFFAOYSA-N 380.448 2.849 0 50 GFAA Cc1ccc(NC(=O)[C@H]2C[C@H](C(=O)O)CN(C3Cc4ccccc4C3)C2)cn1 71763503 VSOILRDIFXIIHW-ROUUACIJSA-N 379.460 2.519 0 50 GFAA Cc1ccccc1NC(=O)[C@H]1CN(C(=O)c2coc3c2C(=O)CCC3)CCO1 72478230 MCCHILQKNUPSLD-GOSISDBHSA-N 382.416 2.587 0 50 GFAA CN(CC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)no1)Cc1ccccn1 82139098 PGZFDWFQRQRZRE-SFHVURJKSA-N 377.448 2.927 0 50 GFAA COc1ccc(Cl)cc1C(=O)N[C@@H]1COCC[C@H]1OCc1ccccn1 223034819 ZEKGYCBDYWPHNS-SJLPKXTDSA-N 376.840 2.848 0 50 GFAA O=C1CN(C(=O)CCCC(=O)Nc2ccc(Oc3ccccc3)cc2)CCN1 40266278 JCPDBARCBSLOSI-UHFFFAOYSA-N 381.432 2.546 0 50 GFAA O=C(COc1ccc2c3c(c(=O)oc2c1)CCC3)NC[C@H]1CC[C@H](C(=O)O)CC1 238899370 GAMHDIDFJYINEW-HDJSIYSDSA-N 399.443 2.668 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Nc1cccc(Cl)c1Cl 239425818 VHQHLRDEWOJBSN-DWERLKKQSA-N 391.254 2.985 0 50 GFAA O=C1NC[C@]2(CCCN(C(=O)NCc3csc(-c4ccccc4)n3)CC2)O1 426444913 KDVLNWVRKMTXIX-LJQANCHMSA-N 386.477 2.984 0 50 GFAA COCCN1CCC(CN(C)C(=O)Nc2cc(NC(C)=O)ccc2C)CC1 96139565 IBXRSMZNWILURR-UHFFFAOYSA-N 376.501 2.776 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(Cc1cc3c(cc1C)OCCO3)CC2 95511434 ZZXMCSWLUNVPBC-UHFFFAOYSA-N 382.508 2.859 0 50 GFAA CC(C)N(C)CC(=O)N1C[C@@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95384879 QKNSEDLAVRDMQA-CEWLAPEOSA-N 377.479 2.694 0 50 GFAA O=C(NC[C@]1(O)CCCNC1)Nc1ccc(SCCc2ccccn2)cc1 97805704 CLAPXWSGGJGTEE-FQEVSTJZSA-N 386.521 2.652 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(NC(=O)[C@@H]3C[C@@H]3C)c2)c1 298467534 YOXFJKBQUWGPIT-KPZWWZAWSA-N 376.420 2.818 0 50 GFAA CC1(C)CN(C(=O)NCc2cccc(N3CCOCC3)n2)[C@H]1c1ccncc1 298525329 XHNSIRRGLVOJJG-IBGZPJMESA-N 381.480 2.606 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCc1cccn1C 252536937 JUZQBRNADDWJAE-UHFFFAOYSA-N 381.411 2.623 0 50 GFAA CCCN1CC[C@H](CNC(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)C1 534651126 CNSFOVNVWGOHNB-MRXNPFEDSA-N 380.483 2.524 0 50 GFAA CN1CCC[C@@H](CCNC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)C1 459244665 AWXQILBHGDPUOL-KRWDZBQOSA-N 378.948 2.899 0 50 GFAA Cc1c[nH]c(CN2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)c(C)c1=O 1940196664 YLRBCDZJYKXLOR-NZQKXSOJSA-N 398.503 2.652 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cnc(C2CC2)[nH]1 1875403193 RJJBRHBIHFYIBK-POZUXBRTSA-N 391.475 2.720 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)C1=NO[C@H](c2ccccc2)C1 1875389512 QYLFLQCJIMFJAO-CTNGQTDRSA-N 389.455 2.760 0 50 GFAA Cc1nc(C(N)=O)nc(N2CC[C@@H](N[C@H](C)c3ccc4cccnc4c3)C2)c1C 1875397791 NXVMYIMEVPWKAF-CRAIPNDOSA-N 390.491 2.670 0 50 GFAA O=C(N[C@@H]1CC[C@@H](CCNc2ncnn3cccc23)C1)[C@@]12CC=CCN1CCC2 1875326670 RWLKZIMQLBCDNC-SVMVAKDDSA-N 394.523 2.611 0 50 GFAA Cn1nnc(-c2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCO3)cc2)n1 952980706 KRLFIUKWUMFWDF-INIZCTEOSA-N 379.420 2.687 0 50 GFAA CN(Cc1ccc([S@@](C)=O)cc1)C(=O)N[C@H]1COc2c(F)cc(F)cc2C1 1351563584 KONMKHPIFOBNHN-YVORESIASA-N 394.443 2.847 0 50 GFAA CN(C)c1nccc([C@H]2CN(C(=O)Nc3cccc(-c4ncco4)c3)CCO2)n1 275977954 NCWXOUYMVGRCSL-QGZVFWFLSA-N 394.435 2.803 0 50 GFAA CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)Nc1ccc(-c2noc(=O)[nH]2)cc1 277168782 HPSZYIMHFIYGAM-HOCLYGCPSA-N 383.408 2.524 0 50 GFAA C[C@H]1CO[C@@H](c2ccccc2Cl)CN1Cc1nnc(S(C)(=O)=O)s1 170607428 AKLLKBQHOLGPKM-GXFFZTMASA-N 387.914 2.557 0 50 GFAA CN(C(=O)Nc1ccccc1N1CCCC1=O)[C@@H]1CCCN(c2cccnn2)C1 172402084 NWUXQWWSDFEJBD-MRXNPFEDSA-N 394.479 2.736 0 50 GFAA COc1cccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)N(C)C)c1 192770793 HQDPAOAOCGHRMC-NHCUHLMSSA-N 395.503 2.719 0 50 GFAA O=C(NCCN1CCc2sccc2C1)[C@@H]1CCCN1C(=O)c1ccccc1 193439271 AUPUKUHWGFOOMX-SFHVURJKSA-N 383.517 2.527 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N[C@@H](C)c1nnc(N)s1 1506403652 YILOLEISIUIYIP-QMMMGPOBSA-N 376.891 2.520 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCO[C@H](CO)[C@H]2c2ccccc2)cc1)C1CCC1 1529147118 UNTBUSVPBOHEEN-NHCUHLMSSA-N 394.471 3.000 0 50 GFAA COc1ccc(C(=O)N[C@H](c2nnc3n2CCN(CC(C)C)CC3)C(C)C)cc1 11996437 APIXKHXOPAXALK-FQEVSTJZSA-N 399.539 2.928 0 50 GFAA CC[C@H](C)C(=O)NCc1nnc2n1CCN(Cc1ccc(OC(C)C)cc1)CC2 12000393 PDVPZDCOESZJQD-KRWDZBQOSA-N 399.539 2.786 0 50 GFAA Cc1c(C(=O)N(CCO)C(C)C)cnn1-c1ncc2c(n1)-c1ccccc1CC2 14986004 SAUDHMCAOHKLMM-UHFFFAOYSA-N 391.475 2.579 0 50 GFAA COC(=O)[C@@H]1C(=O)C[C@H](c2ccc3c(c2)OCO3)[C@@H]1c1ccc2c(c1)OCO2 19908998 LGIWOAOMGYWGOB-CAYVGHNUSA-N 382.368 2.773 0 50 GFAA Cc1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(F)cc4Cl)C3)nn2)n1 169777913 XVYUHJBIFPUUOU-NSHDSACASA-N 376.779 2.516 0 50 GFAA O=C(CC1CCCC1)N1CCC[C@@]2(CN(Cc3cscn3)CC[C@H]2O)C1 1857693666 GTQIPHPQGXPZMA-UYAOXDASSA-N 377.554 2.899 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1)c1nncn1C 1857714600 YEBLBFDNVLSLHD-LLVKDONJSA-N 388.859 2.704 0 50 GFAA Cc1ccccc1CCC(=O)NC[C@H]1[C@H]2CN(c3ncccn3)C[C@]23CC[C@H]1O3 1857726227 XQHURZDTLOTWPO-DZCCDHAISA-N 392.503 2.518 0 50 GFAA CN(CCCO)C1CCN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1 116872447 LKMKWXPNMFCAFP-UHFFFAOYSA-N 395.429 2.840 0 50 GFAA COc1ccccc1C(=O)N1CCC[C@@H](N(Cc2cncnc2)C(C)=O)CC1 328632931 LPEIGAIWCYTPMK-GOSISDBHSA-N 382.464 2.529 0 50 GFAA CC1CCC(NC(=O)CS(=O)(=O)Cc2nnc(-c3ccccc3)s2)CC1 122410915 VTTRUSPYAVPMFQ-UHFFFAOYSA-N 393.534 2.815 0 50 GFAA O=C(c1cnc([C@@H]2CCCO2)s1)N1CCc2c(nnn2-c2ccccc2)C1 329362889 JBIYHHLPMPXOQY-INIZCTEOSA-N 381.461 2.774 0 50 GFAA CCCN(CCCN(C)C)C(=O)NCc1cccc(NC(=O)[C@H]2CCCO2)c1 252551869 UILQDBUCBSIMBV-LJQANCHMSA-N 390.528 2.677 0 50 GFAA Cc1nn2c(N3CCN(CCO)CC3)cc(C(C)C)nc2c1-c1ccccc1 20503353 BQNMCASOYODBDK-UHFFFAOYSA-N 379.508 2.942 0 50 GFAA Cc1noc(C2CCN(C(=O)N[C@@H]3CCN(c4ncccc4Cl)C3)CC2)n1 159149598 JVJJWFLSBGBSHX-CQSZACIVSA-N 390.875 2.594 0 50 GFAA CN1C[C@H](C(=O)N[C@@H](Cc2ccc(O)cc2)c2nc3ccccc3[nH]2)CCC1=O 818725635 OZCXIJDWEJPGFY-BEFAXECRSA-N 392.459 2.537 0 50 GFAA O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(-c2cnc3cccc(F)c3c2)cc1 2100480356 FNMSREWVVFGKAC-INIZCTEOSA-N 384.432 2.958 0 50 GFAA O=C1CO[C@H](C(=O)NCc2cc3ccccc3o2)[C@@H](c2ccccc2Cl)N1 2100543386 RLRPYEKEQXPSQO-MOPGFXCFSA-N 384.819 2.959 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCCN(C(=O)c3ccsc3)CC2)cc1 2325889759 REUWNMSRGNJZBB-UHFFFAOYSA-N 397.500 2.885 0 50 GFAA COc1cccc(C2=NN(C(=O)COc3ccccc3)[C@@](O)(C(F)(F)F)C2)c1 910788 WQZGAGMTWLROJG-SFHVURJKSA-N 394.349 2.962 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2c[nH]nc2C2CCCCC2)C1=O 2356154500 XZAOMQYJQGIAIX-OAQYLSRUSA-N 388.512 2.701 0 50 GFAA COc1cc(OC)cc(-c2nnc(SCC(=O)Nc3nccs3)o2)c1 2720402 IPYKZLNKDDXYKU-UHFFFAOYSA-N 378.435 2.941 0 50 GFAA O=C(N=c1[nH]n(CC2CC2)c2ccccc12)c1ccccc1N1CCOCC1 2356168056 NPAZWMMLWHUWCZ-UHFFFAOYSA-N 376.460 2.957 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1 4810952 VEPVZEPUAQGDGI-KRWDZBQOSA-N 390.480 2.851 0 50 GFAA COc1ccc(C2=NO[C@@H](CNC(=O)c3cnn(-c4ccccc4)c3)C2)cc1 225768771 IZVBAMLXABFNPT-LJQANCHMSA-N 376.416 2.804 0 50 GFAA CN1CCN([C@@H]2CCN(Cc3ccc(C4CCCCC4)s3)C[C@H]2O)CC1 20321764 JRHVYEIGMGZTJJ-WOJBJXKFSA-N 377.598 2.978 0 50 GFAA O[C@H]1[C@H](N2CCCOCC2)c2ccccc2C12CCN(c1ccccn1)CC2 20782777 FDYBKGAGMIPZNY-YADHBBJMSA-N 379.504 2.758 0 50 GFAA Cc1ccc(N2C[C@@H](C(=O)NCCCN3CCCC[C@H]3C)CC2=O)cc1F 230139946 FHAVVXFAEOBHMZ-SJORKVTESA-N 375.488 2.868 0 50 GFAA CN(C(=O)CN1CCN(C(=O)c2cccc3cc[nH]c23)CC1)C1CCCCC1 173056829 OXFDNEOVZCRDJK-UHFFFAOYSA-N 382.508 2.717 0 50 GFAA COc1ccc(/C=C/C(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)cc1 253630011 VHKLHMYUHKVCDR-FLSMSTFGSA-N 393.443 2.683 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)Nc1ccc(CN2CCCC2=O)cc1 363153589 UIWTWGXHKWWDQG-UHFFFAOYSA-N 390.447 2.711 0 50 GFAA O=C(NO[C@H]1CC=C[C@H]1N1C(=O)c2ccccc2C1=O)OCc1ccccc1 39345918 RWGAQOXHOHROMA-MSOLQXFVSA-N 378.384 2.838 0 50 GFAA COc1cc(CN2CCN(c3ccc(Cl)cn3)C[C@@H]2CCO)cc(OC)c1 72473953 WWYCANNBWNTMFI-KRWDZBQOSA-N 391.899 2.825 0 50 GFAA Cc1nc(-c2ccccc2)oc1C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1 174552540 VZHHPLYLTLSQKI-QGZVFWFLSA-N 383.448 2.504 0 50 GFAA Cn1ncc(Cl)c1C(=O)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72121066 DQNQFKSOXYWTAE-OAHLLOKOSA-N 382.851 2.758 0 50 GFAA NC(=O)[C@H]1CC[C@@H](C(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)O1 285834209 ATYZCYKFOXBJKU-YUDUHTQSSA-N 393.281 2.855 0 50 GFAA O=C(c1cc(-n2cnnn2)ccc1O)N1CCC[C@H](CCc2ccc(F)cc2)C1 71497964 MWGHKBRMVSNHQS-MRXNPFEDSA-N 395.438 2.992 0 50 GFAA Cc1c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)nnn1C1CCNCC1 178657410 AWRSTVKEBVLEKY-UHFFFAOYSA-N 393.495 2.839 0 50 GFAA C[C@@H](C1CCN(C(=O)c2cc(COc3ccccc3)[nH]n2)CC1)N1CCOCC1 20999082 QTXCGKTYZPBOFQ-KRWDZBQOSA-N 398.507 2.562 0 50 GFAA Cn1cnnc1CC1CCN(Cc2sc(N3CCCC3)nc2Cl)CC1 82161718 KBWMQWGMJNOAPF-UHFFFAOYSA-N 380.949 2.980 0 50 GFAA CC(C)CS(=O)(=O)N1CCC(N[C@@H](C)c2ccc3c(c2)OCCCO3)CC1 180020071 VJUHSPCSCNIBKT-INIZCTEOSA-N 396.553 2.949 0 50 GFAA Fc1cccc([C@@H]2CN(c3ncnc4[nH]cnc34)[C@@H]3C4CCN(CC4)[C@H]23)c1F 95390203 RFFFUJUYXJSPLR-MORSLUCNSA-N 382.418 2.698 0 50 GFAA COCCN(Cc1cnn(C)c1)C(=O)Nc1c(-c2ccccc2)c(C)nn1C 96140996 KTMQGRMPDJDMNK-UHFFFAOYSA-N 382.468 2.810 0 50 GFAA O=C(O)c1cccc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)n1 95372447 UIBBDKSVMGEDFR-IWMITWMQSA-N 393.443 2.575 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccc(CO)cc3)CC2)CN1Cc1ccncc1 91441302 RZRPGYLGLRQOSP-UHFFFAOYSA-N 393.487 2.619 0 50 GFAA Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@@]2(CCC(=O)N(C3CC3)C2)C1 91381420 KIMVBDRIGFLSIA-LJQANCHMSA-N 380.485 2.690 0 50 GFAA COc1ccc(-c2noc(CCC(=O)N3[C@H](C(=O)O)C[C@H]4CCCC[C@@H]43)n2)cc1 268950929 TVNGXMRPJPMBQR-PVAVHDDUSA-N 399.447 2.922 0 50 GFAA CC(C)n1c([C@@H]2CCCN2C(=O)CCc2nnc(O)nc2O)nc2ccccc21 263588478 UOANWEXDZIZACO-INIZCTEOSA-N 396.451 2.510 0 50 GFAA O=C(CCn1cccn1)NC[C@@H]1CCCN(Cc2ccnc3ccccc23)C1 827822442 QYLMSUPWYLTPOX-SFHVURJKSA-N 377.492 2.850 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1ccc(-c2cn[nH]c2)cc1 1875401302 IEBYUVHNQBFPSU-DLBZAZTESA-N 378.436 2.524 0 50 GFAA O=C(NC[C@@H](c1cccnc1)N1CCCCC1)c1ccccc1N1CCOCC1 952965034 FHBHSQAAGRIHBR-QFIPXVFZSA-N 394.519 2.875 0 50 GFAA CS(=O)(=O)Nc1cccc(NC(=O)c2csc(N3CCCCC3)n2)c1 895625912 KONNVCABVLDAOI-UHFFFAOYSA-N 380.495 2.757 0 50 GFAA CCCc1occc1C(=O)N1C[C@@H](c2cncn2C)[C@H](CNC(=O)C2(C)CC2)C1 1775962862 PLAQPAZRJSZJLZ-NVXWUHKLSA-N 398.507 2.738 0 50 GFAA O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1ncc(Br)s1 170607905 XKJGMQJQIDFVHK-CYBMUJFWSA-N 396.310 2.709 0 50 GFAA C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 170612380 FQRRTYMNAIHMFX-KGLIPLIRSA-N 377.485 2.805 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)Cc3n[nH]c4ccccc34)CC2)oc1C 111154308 SJWTYKDGXMSRBX-UHFFFAOYSA-N 381.480 2.739 0 50 GFAA Nc1ncc(C(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)c(-c2ccccc2)n1 1506397049 OIOWJQSNSJHMEW-SFHVURJKSA-N 389.459 2.942 0 50 GFAA CN(C)Cc1nc(C(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)cs1 1506407042 IDMHUEOYKOQILT-UHFFFAOYSA-N 386.481 2.639 0 50 GFAA COc1ccc2cc([C@@H](C(=O)O)N3CCC(N4CCC(O)CC4)CC3)ccc2c1 1529138967 KTGPNDMGZPZIFP-QFIPXVFZSA-N 398.503 2.895 0 50 GFAA COc1ccc(F)c(CN2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c1F 1704312161 LZTCIDVXYRRITB-WIYYLYMNSA-N 391.414 2.854 0 50 GFAA O=C(CCc1ccsc1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 219520802 REXLUDCSGBELAQ-ZBFHGGJFSA-N 375.519 2.787 0 50 GFAA O=C(NCc1ccon1)[C@@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 11933312 ONGNCNHHWPBXRM-HXUWFJFHSA-N 396.535 2.710 0 50 GFAA COc1ccccc1-c1cc(C(=O)N(C)Cc2ccon2)cc(-n2cnnn2)c1 12325967 TZEKQLWJRYCZEB-UHFFFAOYSA-N 390.403 2.598 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N[C@@H](C)CCn3cccn3)no2)c1 12440620 LLFZJWNSHAESCT-AWEZNQCLSA-N 382.420 2.861 0 50 GFAA CC(C)CN1C[C@@H](OCc2cccc(F)c2)CN(C(=O)C2(C)CC2)CC1=O 14532006 DQYUBVROLCJKHD-GOSISDBHSA-N 376.472 2.838 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cc(F)ccc4F)nnc3c2)n1 169776165 HTPLCGZTDDQIGJ-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA CCOc1ccc(C(=O)N2CCC3(CC2)NC(=O)N(c2ccc(F)cc2)N3)cc1 169780595 GFUZHSXQYBBGGF-UHFFFAOYSA-N 398.438 2.891 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N(C)Cc4ncc(C)[nH]4)CC3=O)sc2c1 1857698644 BJSNKJKNHNKHMC-ZDUSSCGKSA-N 383.477 2.648 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857734429 JMLSWFXQEKIFMD-HLIPFELVSA-N 385.851 2.593 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3cc(C)ccc3F)C[C@]23CC[C@H]1O3 1875249051 ATQKUEFQZFJRLU-IXIUHKBRSA-N 378.513 2.593 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H]3C[C@H]4CO[C@@H](C5CC5)CN4C3)CCCC2)cc1 1875250431 XYALCDSFEPWFKQ-SVFBPWRDSA-N 384.520 2.875 0 50 GFAA COc1ccccc1N1CCN(S(=O)(=O)c2cc(C)c(C)cc2OC)CC1 1115114 VQFAMLPJUGAJEW-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA O=C([C@@H]1CC12CCNCC2)N1CCO[C@@H](c2ccccc2Br)C1 236589345 HHAQPJDXAHZPIT-GOEBONIOSA-N 379.298 2.739 0 50 GFAA O=C1[C@H]2CC=CC[C@H]2C(=O)N1c1ccc(N2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 249992330 MEXOGPOPICBMII-ODJDQKDNSA-N 390.439 2.678 0 50 GFAA Cc1nc(S(=O)(=O)N[C@@H]2CCCC23CCOCC3)sc1Br 374450594 GSDSKORJMHDGAS-SNVBAGLBSA-N 395.344 2.842 0 50 GFAA CC(=O)N1N=C(c2ccc(Br)cc2)O[C@]12C(=O)Nc1ccccc12 4753752 CCHYJISTWQGVBU-QGZVFWFLSA-N 386.205 2.795 0 50 GFAA CC(C)(C)Sc1cc(CNC(=O)Cn2ncc(=O)c3ccccc32)ccn1 2325727423 MEUOMYITZKOQHS-UHFFFAOYSA-N 382.489 2.999 0 50 GFAA Cn1cnnc1Sc1ccc(NC(=O)c2cccc(C3(F)CNC3)c2)cc1 2325859595 CPTZTWUCMRBKAK-UHFFFAOYSA-N 383.452 2.987 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)ccn1 2356148105 HMSLKRMQYVZYFE-HSZRJFAPSA-N 393.487 2.930 0 50 GFAA CCOC(=O)c1sc(NC(=O)CSc2nc(CC(C)C)n[nH]2)nc1C 2751140 RIGUSULNOOSQMO-UHFFFAOYSA-N 383.499 2.676 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356170203 ZUABZZVVFISWMB-JOCHJYFZSA-N 378.476 2.891 0 50 GFAA CC(C)c1nnc(NC(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)s1 4731757 AGLLLIIPTNVEFW-CYBMUJFWSA-N 376.457 2.830 0 50 GFAA CC(C)C[C@H](NC(=O)c1cccnc1)c1nnc2n1CCN(CC(C)C)CC2 20542903 XKTVQZNAVJIKQO-SFHVURJKSA-N 384.528 2.704 0 50 GFAA COc1ccc(C(=O)N2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)c(O)c1 67884090 VIEIYKSICCJOAK-UHFFFAOYSA-N 394.383 2.983 0 50 GFAA O=C(CC1(Cn2cnnn2)CCCCC1)Nc1nnc(C(F)(F)F)s1 409413330 HZYZIWWLJVEKDI-UHFFFAOYSA-N 375.380 2.523 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4ccc(F)cc4F)CC3)nn2)n1 67603431 PMECLEFZYAQHCZ-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA c1ccc(CN(C[C@@H]2CCCO2)c2ncnc3sc4c(c23)CCNC4)nc1 65372692 PIBVBWMDWRLLKQ-HNNXBMFYSA-N 381.505 2.918 0 50 GFAA COc1cc(OC)cc(C(=O)Nc2c3c(nc4c5c(nn24)CCC5)CCC3)c1 63856339 GOSDYFQWKCNEGF-UHFFFAOYSA-N 378.432 2.976 0 50 GFAA OCC1CCN(Cc2cccc(OC[C@H](O)CN3CCCCCC3)c2)CC1 12197671 DRVBCMDCZFMLSW-OAQYLSRUSA-N 376.541 2.507 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(Cc3ccco3)CC2)C1 71763671 RBYZYDRFIYAZRV-LJQANCHMSA-N 382.508 2.667 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C[C@H]21 284157190 QRGPMMVJCMCWCJ-SJORKVTESA-N 395.290 2.724 0 50 GFAA O=C(CCCc1ccccc1)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528231 DCCYHXXPLPGWKZ-UHFFFAOYSA-N 379.508 2.748 0 50 GFAA O=C(CCCn1cncn1)N1CCC[C@](CO)(Cc2cccc(Cl)c2)C1 12583291 ZSPZPEGAINKTRT-IBGZPJMESA-N 376.888 2.556 0 50 GFAA Cc1ccn(-c2cc(NCCNC(=O)c3ccccc3C(F)(F)F)ncn2)n1 72140600 NTSYQHNQQYCERT-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA Cc1cc(C)n(-c2ccc3nnc(CCC(=O)Nc4nc(C)c(C)s4)n3n2)n1 71283127 BBUNGOSAWBYMQS-UHFFFAOYSA-N 396.480 2.571 0 50 GFAA COc1cccc([C@@H](O)CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c1 378146500 WSFSQMIYQDUDOA-UXHICEINSA-N 382.460 2.540 0 50 GFAA C[C@@H]1C[C@H](NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)CCN1 262940070 UJWTYHHVRNCVIF-ATZDWAIDSA-N 389.499 2.867 0 50 GFAA Cc1cnc2c(C(=O)N3CCC[C@@H](Cc4ccc(C(=O)O)cc4)C3)cnn2c1 72156892 YXRRCFUUVBSYKB-INIZCTEOSA-N 378.432 2.831 0 50 GFAA O=C(C1CCS(=O)(=O)CC1)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 374950275 GZXRVRXBCGTWBL-INIZCTEOSA-N 393.402 2.927 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)N2CCN(CCc3ccncc3)CC2)c1 72433272 TXHHLPLCOGXLPV-UHFFFAOYSA-N 381.520 2.786 0 50 GFAA COc1ccc(-c2cn([C@@H]3c4ccccc4C4(CCNCC4)[C@H]3O)nn2)cc1 72156700 IUJHFKIDHGYASW-RTWAWAEBSA-N 376.460 2.539 0 50 GFAA CS(=O)(=O)c1ccc(N2CCOCC3(CCOCC3)C2)c(C(F)(F)F)c1 286740887 GESXVISNLFSCEK-UHFFFAOYSA-N 393.427 2.742 0 50 GFAA Cc1cn2cc(NC(=O)C3(S(=O)(=O)c4ccccc4)CCOCC3)ccc2n1 288261072 AIMJVENKMWKJNN-UHFFFAOYSA-N 399.472 2.604 0 50 GFAA Cc1cnc(C(C)(C)NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)s1 176875493 JRQXGTUCSVKBQW-UHFFFAOYSA-N 379.507 2.557 0 50 GFAA COc1cccc(CC(=O)N2CCn3nc([C@H](O)Cc4ccccc4)cc3C2)c1 221408045 VVGCKJIEAAQXDP-JOCHJYFZSA-N 391.471 2.753 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCOC4(CCC4)C3)cc2)c(C)c1CCC(=O)O 263552551 XEIDQRAIKYXHSX-UHFFFAOYSA-N 397.475 2.901 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)NC3CCN(Cc4ccncc4)CC3)cn2)n1 193984917 FDUOWLCDXNBAPO-UHFFFAOYSA-N 390.491 2.674 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@H](C)CN(C)C)csc2C1 426489656 PABKTEHQPOCSPZ-GFCCVEGCSA-N 376.526 2.591 0 50 GFAA O=C(c1cc(-c2ccccc2)on1)N1CCc2c(nc(CC3CC3)[nH]c2=O)C1 82136995 IUUKQJGNBMOISQ-UHFFFAOYSA-N 376.416 2.576 0 50 GFAA CN(C)c1nc(-c2ccc(C(=O)N3CCOCC3)cc2)cc(C(F)(F)F)n1 426479027 SFJPFTJMILUERO-UHFFFAOYSA-N 380.370 2.701 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 182456187 JNFDJWCUANHTLO-PKOBYXMFSA-N 383.839 2.505 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](c3nccn3Cc3ccncc3)C2)nc(C)n1 95527944 FSDQITZRKDQOFO-SFHVURJKSA-N 376.464 2.753 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)N1CCC[C@@H](COc2cccc(F)c2)C1 91877076 HNRNWRZTKQFIGZ-MRXNPFEDSA-N 395.434 2.853 0 50 GFAA O=C(Cc1ccc(C(F)(F)F)cc1)N1C[C@H](CO)[C@H](CN2CCCCC2)C1 91435060 GIBHAHDXSYPKFP-IAGOWNOFSA-N 384.442 2.801 0 50 GFAA Cc1ccc(-c2nnn(C)n2)cc1NC(=O)N1CCC(N2CCCCC2)CC1 96153652 ICQZTADTZIYMKR-UHFFFAOYSA-N 383.500 2.668 0 50 GFAA CNC[C@H]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2Br)C1 299739023 JPWKOLYKDUXVGA-GHMZBOCLSA-N 375.694 2.938 0 50 GFAA COCCN1Cc2cc(C(=O)N[C@H](C)CCc3ccccc3)ccc2OCC1=O 263617805 PSCJWKQFAWKERW-QGZVFWFLSA-N 396.487 2.805 0 50 GFAA COc1c(I)cc(I)nc1Cl 43827467 KDGNLHUMFQGFJM-UHFFFAOYSA-N 395.365 2.953 0 50 GFAA O=C(N[C@H]1C[C@@H]1C1CCN(C(=O)/C=C/c2cn[nH]c2)CC1)OCc1ccccc1 1875270928 LROLTMHQYKFZDF-HEVSSNLLSA-N 394.475 2.976 0 50 GFAA C=CC(=O)NC[C@H](NC(=O)[C@@H]1CCCN(C(C)=O)C1)c1ccc2ccccc2c1 1875386349 NXNASBDSDIGUFA-RTWAWAEBSA-N 393.487 2.558 0 50 GFAA CCNC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)cc1Cl 952988232 MWTAXMDRIYEZRQ-LBPRGKRZSA-N 377.872 2.819 0 50 GFAA CCc1ccc2nc(C)cc(C(=O)N3CCC4(CC3)C(=O)N(C)C(=O)N4C)c2c1 952970760 LQDOOINAFRWCQZ-UHFFFAOYSA-N 394.475 2.604 0 50 GFAA Cc1cc2n(n1)CCN(C(=O)Cn1nc(-c3ccccc3)c3ccccc3c1=O)C2 952868022 ACTGJVKTDDMCAX-UHFFFAOYSA-N 399.454 2.611 0 50 GFAA CCc1occc1C(=O)N[C@]12CCC[C@H]1N(c1c(C)c(C)nc3ncnn13)CC2 1775991844 NIUKKBVLSAFFRH-UTKZUKDTSA-N 394.479 2.828 0 50 GFAA Cc1ccc(CNC(=O)CCN2C[C@@H]3CC[C@H]2CN(C(=O)C2CCC2)C3)cc1 1565510425 KALLIRIHUSSUNR-FPOVZHCZSA-N 383.536 2.724 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1C[C@@H](CO)[C@H](c2ccsc2)C1 188880902 AJSIIEFHJDYLHN-AAEUAGOBSA-N 392.424 2.559 0 50 GFAA CCN(CC)CCN(CC)C(=O)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 11874012 UBSQWIMCUFLHKB-IBGZPJMESA-N 391.531 2.797 0 50 GFAA CCCO[C@@H]1CCCN(C(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)C1 12387632 XLBNPJCHWOWZEU-OAHLLOKOSA-N 387.436 2.816 0 50 GFAA O=C(NCCc1ccccc1C(F)(F)F)c1cc(CN2CCC[C@@H](O)C2)on1 12763308 YOUHIRDQJOLTMX-CQSZACIVSA-N 397.397 2.623 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(Cc1ccsc1)CC2 14530346 IRTOKRRXKTWPJC-UHFFFAOYSA-N 384.505 2.962 0 50 GFAA CCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](N(C)Cc1ccco1)C2 14753066 XXOPKBHXJLQAKS-OAHLLOKOSA-N 388.537 2.674 0 50 GFAA COCCn1c(=O)c(CNCc2ccc3c(c2)OCO3)cc2cc(C)ccc21 14989035 KHWLFZGGANUWEG-UHFFFAOYSA-N 380.444 2.975 0 50 GFAA CC(C)C(=O)N1CCC(N2CCC[C@H](C(=O)NCCc3ccccc3)C2)CC1 15077685 YNNHBCRZWQONJV-FQEVSTJZSA-N 385.552 2.704 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2csnn2)C1)NCc1ccccc1F 19642603 NJGQZNJMZABYIC-CYBMUJFWSA-N 376.457 2.626 0 50 GFAA COc1ccccc1C(=O)N1CCC(n2cc(-c3nc(C(C)C)no3)nn2)CC1 169777498 FQPUYUOWYGDPTJ-UHFFFAOYSA-N 396.451 2.937 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cc(=O)c4ccccc4o3)C[C@H]12 1857668077 HVRYXTYKBTWJNS-XASIKMQRSA-N 381.428 2.866 0 50 GFAA O=C(CSc1ccccn1)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 1857711922 IQEBDUFYJJQBAS-VQIMIIECSA-N 379.485 2.784 0 50 GFAA O=C(c1ccon1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857720531 YGYVDIPQPLRBHI-UHFFFAOYSA-N 376.416 2.957 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)N1CC(c2ccncc2)C1 1857725272 ZJRNULWCEJCMEQ-HNNXBMFYSA-N 377.448 2.850 0 50 GFAA O=C(c1cccc(F)c1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857731566 KEKUPYVTYWACHS-VXKWHMMOSA-N 398.478 2.865 0 50 GFAA CCc1nsc(N2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)n1 121159964 XFVDTLMNCUQYGY-SFHVURJKSA-N 388.537 2.981 0 50 GFAA Cc1nc([C@@H]2CCCCN2C(=O)c2n[nH]c(C3CC3)c2Br)n[nH]1 328666815 CUJHMGQJWDTEIT-JTQLQIEISA-N 379.262 2.844 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1cn([C@H]2CCOC2)nn1 330047356 HPJZSQOSIXMMCF-KRWDZBQOSA-N 383.452 2.508 0 50 GFAA COCCn1c([C@@H](C)NC(=O)c2cc(-c3cccnc3)[nH]n2)nc2ccccc21 334161978 LFCZXGFZHWPHOU-CQSZACIVSA-N 390.447 2.959 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1c(F)cccc1F)CCC2 152419606 PZWFJEAAOAXBIZ-UHFFFAOYSA-N 394.443 2.737 0 50 GFAA C[C@H]1CN(C(=O)NCc2cccc(NC(=O)NCc3ccncc3)c2)CCCO1 263870337 JZFYJTAWKZKWIK-INIZCTEOSA-N 397.479 2.724 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)CCc3ccc(O)cc3)C1)CC2 1704332140 PWRRIFQYDFXGLX-JOCHJYFZSA-N 380.492 2.687 0 50 GFAA O=C(CCCn1c(O)nnc1O)N1CCC(Cc2ccccc2Cl)CC1 913759478 PIDOPOSOSABSIE-UHFFFAOYSA-N 378.860 2.604 0 50 GFAA COc1ccc(CCNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)cc1 2858129 ZHGSYPGFJHJQCB-NRFANRHFSA-N 379.460 2.583 0 50 GFAA O=S(=O)(NCCOC12CC3CC(CC(C3)C1)C2)c1cccc2nsnc12 4537652 ZRXAPLLMGHKBJL-UHFFFAOYSA-N 393.534 2.955 0 50 GFAA Cc1nc(C)c(-c2nnc(NC(=O)CCc3nc(-c4ccncc4)no3)o2)s1 2100545508 SWGBQBGWOIWXNU-UHFFFAOYSA-N 397.420 2.826 0 50 GFAA CN(Cc1nc(-c2cccc(C(F)(F)F)c2)no1)Cc1cnn2c1CNCC2 2325759906 VHRNAZVKHFFUBS-UHFFFAOYSA-N 392.385 2.687 0 50 GFAA O=C(C[C@H]1CN(C(=O)c2ccccc2)C2(CCC2)CO1)N1CC[C@@]2(CCCO2)C1 2325785300 PAWUENTUBNVIPI-CVDCTZTESA-N 398.503 2.622 0 50 GFAA Cc1cc(S(=O)(=O)NCC(C)C)ccc1OCC(=O)NC1CCCCC1 2881869 UFIVLMRDHPHWQS-UHFFFAOYSA-N 382.526 2.757 0 50 GFAA Cc1ccc(S(=O)(=O)N(CCCC(=O)O)c2ccccc2C(=O)O)cc1 3051389 JIQUXDGNPHWHEP-UHFFFAOYSA-N 377.418 2.753 0 50 GFAA COc1ccc(C)cc1N1C[C@H](C(=O)Nc2ccc(NC(C)=O)cc2)CC1=O 7598414 UOAOZQFDLUDHAY-OAHLLOKOSA-N 381.432 2.954 0 50 GFAA Cc1nc2n(n1)C[C@H](Nc1cc(C(F)(F)F)nc(-c3cccnc3)n1)CC2 116870871 MSZHUYSKJHQJMK-GFCCVEGCSA-N 375.358 2.884 0 50 GFAA Cc1c(CO)cccc1NC(=O)c1ccc(CN2CC(n3cccn3)C2)cc1 65425354 QSPPSWWDMLMSPL-UHFFFAOYSA-N 376.460 2.993 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc(C)cc(F)c3)CC2)C1 67854897 DGEVNJXOGOVICY-LJQANCHMSA-N 391.531 2.573 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(N(C)C[C@H]4COCCO4)CC3)cc2)n1 23541235 YMZNFWHXOFAYOR-QFIPXVFZSA-N 384.524 2.805 0 50 GFAA Fc1ccccc1-c1cnnc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 12029171 POYFCHXRAUVTMY-UHFFFAOYSA-N 393.422 2.729 0 50 GFAA COc1cc2c(cc1OC)CN(CC(=O)Nc1cnc(CC(C)C)nc1)CC2 473659137 JPYQMRIKOPFFGS-UHFFFAOYSA-N 384.480 2.689 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(Cc4noc(C(C)C)n4)[nH]c3C2)c1 67515290 GGRXNCGBJHKMBU-ZDUSSCGKSA-N 381.436 2.585 0 50 GFAA CN(C)C(=O)CN1CCCN(C(=O)c2ccc(COc3ccccc3)cc2)CC1 122599801 ATKUIYIHVVRPRE-UHFFFAOYSA-N 395.503 2.502 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)CC[S@@]1=O 253424843 LEAIVVMXLVBJDW-PWECECGKSA-N 398.550 2.778 0 50 GFAA O=S(=O)(c1ccc(-c2ccno2)s1)N1CCN(c2ccccc2)CC1 32498084 XEPIYEFACXWUFR-UHFFFAOYSA-N 375.475 2.914 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCC2(CO)CCC2)Cc2ccccc2C1 72153073 SBNQATGFDJBKFY-UHFFFAOYSA-N 392.543 2.977 0 50 GFAA CC(C)(C(=O)N1CCC[C@@H](Cn2cnc3ccccc32)C1)S(=O)(=O)C1CC1 376155266 JUCXBRIZCVIBRV-OAHLLOKOSA-N 389.521 2.631 0 50 GFAA O=C(CCc1cc2n(n1)CCCNC2)N1CCc2[nH]c3ccc(F)cc3c2C1 72435462 XLVKFKNRUGHEHO-UHFFFAOYSA-N 381.455 2.514 0 50 GFAA Cc1ccc(OC2(C(=O)NCc3ccccc3-n3ccnc3)CCNCC2)cc1 77504616 OXHGAAJZTFGUFU-UHFFFAOYSA-N 390.487 2.998 0 50 GFAA COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cc(F)ccc3OC)CC2)nc1 454281883 QVAPRANGHAPXOL-AWEZNQCLSA-N 388.443 2.831 0 50 GFAA CNC[C@@H]1CCN(C(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)F)C1 178984013 DGDDRCUDMXAKQT-JTQLQIEISA-N 387.793 2.621 0 50 GFAA CCS[C@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91486883 CGTDEOZUJDVSSK-QGZVFWFLSA-N 389.565 2.997 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)c2ccccc2CS(=O)(=O)c2ccccc2)C1 237443859 KJUUJYQYCMBTSP-IRXDYDNUSA-N 386.517 2.860 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)CCC(=O)NC2CCCC2)C3)c1 96151039 CHVCYFDQFPGNBO-UHFFFAOYSA-N 396.491 2.809 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)Nc3ccc(-n4cccn4)cc3)CC2)n1 95510515 XLPDGSZHBYWVRD-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CCCN1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@H]1C(=O)NCC 96166034 OZVIRGJWDQRKRD-WFASDCNBSA-N 376.888 2.540 0 50 GFAA CCSc1ncc(CN2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)cn1 95361132 YJFMDBWRNIYDKC-CRAIPNDOSA-N 383.521 2.720 0 50 GFAA Cc1nc(CCNC(=O)Nc2cccc(N3CCOC3=O)c2)nc2c1CCC2 96151145 XGEHJVBVROCCNE-UHFFFAOYSA-N 381.436 2.595 0 50 GFAA COc1cccc2c1CCN(CC(=O)N1CCO[C@H](c3ccc(F)cc3)C1)C2 182666331 SFGVUVRJKSZMIH-NRFANRHFSA-N 384.451 2.793 0 50 GFAA O=C1c2ccc(C(=O)N3CCOc4ccccc43)cc2C(=O)N1C[C@@H]1CCCO1 298539046 ZANBGGKYTPOHFM-HNNXBMFYSA-N 392.411 2.501 0 50 GFAA CSC1(CNC(=O)c2ccc(-n3ncc(C(=O)O)c3C)cc2)CCOCC1 299750578 NZHKXNYKOWMYFI-UHFFFAOYSA-N 389.477 2.521 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@]3(CCCN(Cc4ccccn4)C3=O)[C@H]2C)n1 1940196403 IWWKZLNMTPJFNP-VGSWGCGISA-N 395.507 2.732 0 50 GFAA CNC(=O)c1ccc(Cl)c(NC(=O)N2CCC[C@@H](Cn3ccnc3)C2)c1 299785601 MNKYXBWITMCODL-ZDUSSCGKSA-N 375.860 2.840 0 50 GFAA Cc1ccc(CC(=O)N[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)o1 1875402556 HEJUXSROXACPEL-NSISKUIASA-N 379.460 2.950 0 50 GFAA CN(C)C[C@@H](O)Cn1cc(NC(=O)C(C)(C)c2cccc3ccccc23)cn1 1875266101 RIADWTJTWAUVMJ-GOSISDBHSA-N 380.492 2.875 0 50 GFAA Cc1nnc(CCC(=O)N2CCN([C@H](c3ccccc3)C(F)(F)F)CC2)n1C 1875280481 NENUPCLJRNULMG-GOSISDBHSA-N 395.429 2.504 0 50 GFAA CC1(C)CC(=O)c2cc(OC(=O)c3ccncc3N3CCOCC3)ccc2O1 1875272496 GTOJBHJSHQEYMS-UHFFFAOYSA-N 382.416 2.881 0 50 GFAA COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1cc(Cl)nc(Cl)c1C 1875369598 XOQKTAUYIPPZMR-JTQLQIEISA-N 383.235 2.945 0 50 GFAA COc1cccc(Oc2ccc(C(=O)NS(=O)(=O)c3cc(C)ccn3)nc2)c1 1875343742 SUJSULIFGJXGRH-UHFFFAOYSA-N 399.428 2.705 0 50 GFAA COc1ccccc1-c1ccnc(N2CC[C@H](C3CC3)[C@H]2c2nc(O)n[nH]2)n1 1875399569 CYWSQWOJTVDUEZ-DYVFJYSZSA-N 378.436 2.954 0 50 GFAA CC(C)c1cc(C(=O)Nc2ccc(OC3CCN(C)CC3)cc2)nc2ncnn12 952985625 CXQLPLUOGJJNDG-UHFFFAOYSA-N 394.479 2.973 0 50 GFAA CC[C@@H]1CCO[C@@H]1C(=O)Nc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 888102325 MTZAFHXSYCXUJV-ABAIWWIYSA-N 395.506 2.935 0 50 GFAA C[C@H]1CCOCCN1C(=O)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1 170603779 KYXBTVCPFBNTJZ-HNNXBMFYSA-N 382.464 2.716 0 50 GFAA CCc1nc(C2CCN(C(=O)[C@@H](C)Cc3ccc(OC)c(OC)c3)CC2)n[nH]1 191499265 VLHCHJWMGKJGHH-AWEZNQCLSA-N 386.496 2.969 0 50 GFAA CCOC1CC(CN[C@@H](C)c2nc3c(s2)CCCC3)(N2CCOCC2)C1 193396493 MLYUJXKNZJYLNR-SHPPYHEDSA-N 379.570 2.942 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCC([C@H](O)c3ccccn3)CC2)CC1 1506398070 JHUDOGYHISESMU-NRFANRHFSA-N 380.492 2.527 0 50 GFAA Cc1cnc(C(=O)N2CCCN(Cc3ccc([C@H]4CCCCO4)o3)CC2)cn1 1529168805 MIHJPRZMRWCVFN-LJQANCHMSA-N 384.480 2.968 0 50 GFAA CSCc1ccc(C(=O)N2CCC[C@H](CNC(=O)c3cc(C)on3)C2)o1 11771374 FBXYJCLEMIGSMQ-CYBMUJFWSA-N 377.466 2.721 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@H]1CCCN(CCc2ccccc2)C1 12455767 GGGHOPMTJQJVRR-QFIPXVFZSA-N 393.531 2.704 0 50 GFAA CCc1noc(C)c1C(=O)N[C@H]1CC(=O)N(CCc2cccc(Cl)c2)C1 12576751 MIETUSANTOEBPA-HNNXBMFYSA-N 375.856 2.772 0 50 GFAA CC(C)CCNC(=O)c1cn(CC(C)C)cc(C(=O)N2CCCCC2)c1=O 14981945 YEMGBMZGQOERAW-UHFFFAOYSA-N 375.513 2.906 0 50 GFAA O=C(NCc1cccnc1)c1ccccc1NS(=O)(=O)Cc1ccccc1 16578620 FJJZIPMOOZDKOX-UHFFFAOYSA-N 381.457 2.954 0 50 GFAA Cn1nc(C(F)F)cc1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857700122 NXOUZCVCQQKZBJ-UHFFFAOYSA-N 385.418 2.999 0 50 GFAA CCOC(=O)c1ccc(CNC(=O)c2sc(-c3ncccn3)nc2CC)o1 1857700699 JZOCSXVYYKBNCU-UHFFFAOYSA-N 386.433 2.862 0 50 GFAA Cc1ccncc1C(=O)NC[C@H]1[C@H]2CN(c3ncccc3C)C[C@]23CC[C@H]1O3 1875242446 TZEUZDWZDGGHAM-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA O=C(N[C@H](c1ccc(Cl)c(F)c1)c1nn[nH]n1)[C@H]1CCOC2(CCCC2)C1 907414441 WRAWYTVKCLQIIA-SWLSCSKDSA-N 393.850 2.937 0 50 GFAA NCc1cccc(CNC(=O)[C@H]2CCO[C@H]2c2cnn(-c3ccccc3F)c2)c1 2325787562 HNVVKLJGMUXRPN-RXVVDRJESA-N 394.450 2.864 0 50 GFAA Cc1ccccc1[C@H]1CN(C(=O)c2cnc3[nH]nc(O)c3c2C(C)C)CCN1 2325859760 JOGNHRJLPRCFMG-MRXNPFEDSA-N 379.464 2.882 0 50 GFAA CC(C)(C)n1ccc(C(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)c1 2356145768 VSPHTZRAXWTLGU-XMSQKQJNSA-N 384.476 2.764 0 50 GFAA O=C(O)C1(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1 118959635 RZYAEOYRYADFMP-GFCCVEGCSA-N 375.812 2.961 0 50 GFAA CC(=O)c1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)cs1 22932816 NCULOWVFXIKVLA-FQEVSTJZSA-N 393.597 2.692 0 50 GFAA COc1ccccc1C(=O)N1CCc2nnc(CCc3ccccc3)n2CC1 67804638 BVTIHFIDAKCDQW-UHFFFAOYSA-N 376.460 2.770 0 50 GFAA COc1cccc(-c2cn3c(C(=O)NCc4cccnc4N)csc3n2)c1 67691957 OCGJJLLGVRWVAU-UHFFFAOYSA-N 379.445 2.979 0 50 GFAA CNc1ccc(Cl)c(C(=O)N2CCC(C(=O)Nc3nncs3)CC2)c1 425148737 UONSVEXPLINFNV-UHFFFAOYSA-N 379.873 2.724 0 50 GFAA CN(Cc1cc[nH]n1)C(=O)c1ccc([C@@H]2CCCN2Cc2nccn2C)s1 20536415 HKCQFXOIWXXTEA-HNNXBMFYSA-N 384.509 2.814 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCCN(Cc2ccc3cn[nH]c3c2)CC1 121695241 JVRNYTUXKXVHSZ-UHFFFAOYSA-N 388.468 2.599 0 50 GFAA CC(=O)C(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 67850682 ZDYHYZFSOYQETN-UHFFFAOYSA-N 389.843 2.933 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2Nc2cc(COC)nc(C(C)(C)C)n2)cn1 328627985 NGRIWALBPBQHIP-QAPCUYQASA-N 386.500 3.409 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(CCc3c(F)cccc3Cl)C2=O)nn1 328615241 YCOJEAUFYLPVIV-OAHLLOKOSA-N 379.823 2.562 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1ccnc(NCc2ccc([S@@](C)=O)cc2)n1 328621675 AQIRTEWAHVOWSL-QZXAKIBKSA-N 388.537 3.442 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc(NC(=O)OCC(F)(F)F)cc2)C2(CCC2)N1 282618546 FIOJXMOLOVIODL-ZDUSSCGKSA-N 399.369 2.729 0 50 GFAA Cc1ccc(F)c(NC(=O)c2ccn(Cn3nnc(-c4ccccc4)n3)n2)c1 2795303 NJYWJXLGOVSBOK-UHFFFAOYSA-N 377.383 2.742 0 50 GFAA O=C(c1cccc(CNc2ccncn2)c1)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 329470415 YFBRAYZTDLFMKR-CTNGQTDRSA-N 391.519 3.178 0 50 GFAA Cc1nc2cc(C(=O)NC3CCS(=O)(=O)CC3)ccc2n1-c1ccccc1 71957815 OMZFMUSUVGRRLU-UHFFFAOYSA-N 383.473 2.641 0 50 GFAA CN(C)C(=O)CN(C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)c1ccccc1 174082651 WNJGVTNHIQHAME-IBGZPJMESA-N 393.487 2.660 0 50 GFAA CC(C)CN1CCC(NC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)CC1 173864593 ZYQHHUCWYSEGQP-UHFFFAOYSA-N 378.904 2.720 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C/C=C/c1ccccc1)CC2 72161539 HFUKTHCJPZHTOB-JXMROGBWSA-N 377.492 2.826 0 50 GFAA CC(=O)c1ccc(S(C)(=O)=O)c(NC2CCN(C(=O)c3ccoc3)CC2)c1 156754346 QNFWERBGOFHUOH-UHFFFAOYSA-N 390.461 2.602 0 50 GFAA CCOc1ccc(OCCNC(=O)Cn2ccnc2C(=O)c2ccccc2)cc1 241213389 KOKVHSBGRBBQGF-UHFFFAOYSA-N 393.443 2.708 0 50 GFAA CC(C)(C)CN1C[C@]23C=C[C@H](O2)[C@@H](C(=O)N2CCc4ccc(F)cc4C2)[C@H]3C1=O 77505893 PYEMTYMZCINUMD-YWNPBTLJSA-N 398.478 2.539 0 50 GFAA O=C(Cc1cccnc1)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 71419331 QVFSLLHVBXYXFH-ZWKOTPCHSA-N 385.851 2.552 0 50 GFAA CC(C)[C@@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)c1nc2ccccc2n1C 223214845 IPLIGCNSLJDOTI-HXUWFJFHSA-N 389.459 2.866 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)N1CC(Oc2ccccc2Cl)C1 95508483 WNZSOBNYKDKWAR-MRXNPFEDSA-N 384.863 2.946 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)s1 95502114 SPYQXDZBYSCTFS-UHFFFAOYSA-N 384.505 2.706 0 50 GFAA O=C(Nc1cccc(-n2cncn2)c1)N1CCC([C@@H](O)c2ccccn2)CC1 95508912 YMVSJTFUMYRDOA-LJQANCHMSA-N 378.436 2.640 0 50 GFAA Cc1ccc(CNC(=O)CCN2CC[C@@]3(CCCN(CC4CC4)C3=O)C2)cc1 91745736 UKGXUYSEZIHURK-QHCPKHFHSA-N 383.536 2.726 0 50 GFAA CN(Cc1ccc2nsnc2c1)C(=O)c1cnc(-c2cccnc2)nc1O 92037038 APAVWPNMNWMKNP-UHFFFAOYSA-N 378.417 2.521 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(Cc3ccc(-n4ccnc4)cc3)C2)CC1 95500561 WPRCCOJBRFHHCT-FQEVSTJZSA-N 395.551 2.639 0 50 GFAA CC(C)S(=O)(=O)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91794090 VOLUMORTDVVKEB-UHFFFAOYSA-N 378.538 2.672 0 50 GFAA Cc1cccc(C(=O)N2CCCN(C(=O)Cn3cnc4ccccc43)CC2)c1 299171835 UOFHTWJNRBWOFO-UHFFFAOYSA-N 376.460 2.719 0 50 GFAA COc1cccc(CN2CCC[C@@H](n3cc(C(=O)N4CCCCC4)nn3)C2)c1 299780640 BDGQWLPHICLSPC-GOSISDBHSA-N 383.496 2.750 0 50 GFAA COCc1cc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)ccc1OC 36379401 RDLHVRFBBSKBMX-HSZRJFAPSA-N 398.547 2.953 0 50 GFAA O=C(c1cnc(CN2CCCC2)s1)N1CC[C@@H](c2ccc(F)cc2)[C@H](O)C1 65406765 XEURONKYJKASLX-DLBZAZTESA-N 389.496 2.869 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)Nc2cccc(C(=O)NCC(C)C)c2)cc1 821319203 OLRVZVBPNNHQKR-UHFFFAOYSA-N 392.463 2.668 0 50 GFAA C[C@H](NC(=O)c1[nH]nc(N)c1-c1ccccc1)c1nc(-c2cccnc2)no1 822284906 PGNBJEGYNSNLOR-NSHDSACASA-N 375.392 2.595 0 50 GFAA CC(=O)NCCC1CCN(c2nc(CCN)nc3sc(C)c(C)c23)CC1 65385833 MMTJRSHFXUAIRS-UHFFFAOYSA-N 375.542 2.552 0 50 GFAA CC(C)(C)OC(=O)N1CC(Sc2ccc3nnc(C(F)(F)F)n3n2)C1 866082181 DZZNQKHSLUNHPF-UHFFFAOYSA-N 375.376 2.855 0 50 GFAA COc1cc(-c2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)cc(C)n1 952895675 VOSPXAZFCDACGT-ZDUSSCGKSA-N 396.451 2.664 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H]2CC[C@@H]([C@@H]3CCCO3)O2)cc1Br 1875296719 LEDSGVAUCZSXLK-KKUMJFAQSA-N 398.253 2.901 0 50 GFAA NC(=O)c1ccccc1Oc1cccc(NS(=O)(=O)c2cncc(F)c2)c1 1875262134 LLPLCRXLSPYSDG-UHFFFAOYSA-N 387.392 2.913 0 50 GFAA CN1C[C@H](c2ccnc(N(C)C)n2)C2(C1)CN(C(=O)C1CC3(CCCCC3)C1)C2 1875395597 GGVMHHWKPORBHY-GOSISDBHSA-N 397.567 2.761 0 50 GFAA CCn1nc2c(c1C(=O)N1CCn3nc(C(F)(F)F)cc3C1)C[C@H](C)O[C@@H]2C 1875314269 PMJUDXJVANUQDA-WDEREUQCSA-N 397.401 2.797 0 50 GFAA C[C@H]1CN(C(=O)c2cc3cnccc3[nH]2)C[C@H]1NC(=O)c1coc(C2CCC2)n1 1875333857 NYRAXUBPEKIVTI-YVEFUNNKSA-N 393.447 2.709 0 50 GFAA C[C@@H]1CC[C@H](C(=O)NCC2(O)CCN(C(=O)CCCC(F)(F)F)CC2)C1 1775992516 QSYCINMFDUAPDH-KGLIPLIRSA-N 378.435 2.625 0 50 GFAA COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3ccc4c(c3)C[C@H](C)O4)C2)c1 1439137805 BGBSBMMDRGJXBA-ZSEKCTLFSA-N 396.443 2.837 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(c4nccc(C(C)C)n4)CC3)nn2)n1 302199000 GIWIHVNAERDSGN-UHFFFAOYSA-N 378.484 2.519 0 50 GFAA O=C(O)Cc1ccc(S(=O)(=O)NCCc2ccc(C(F)(F)F)cc2)cc1 739883538 PPEBHXUCWLXSJS-UHFFFAOYSA-N 387.379 2.854 0 50 GFAA CN(C[C@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1ccc2c(c1)N(C)CC2 189303650 MYOWGSWRIJUYCY-HSZRJFAPSA-N 394.519 2.780 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N3CCC(c4nncn4C)CC3)cc2)n1 195386127 QTTAETUXMKVMAW-UHFFFAOYSA-N 378.480 2.697 0 50 GFAA c1coc(CN2CCC(NCc3noc(-c4ccc5c(c4)OCO5)n3)CC2)c1 1506405356 ZOGVOKNSNUYPCE-UHFFFAOYSA-N 382.420 2.813 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H](C(C)C)N(C)C)ccc1F 1704324694 DCXRWUVHMXDDSY-HNNXBMFYSA-N 392.475 2.871 0 50 GFAA CN1CCN(C(=O)c2ccc(N3CCCC3)c(Cl)c2)CC12CCOCC2 1775982001 ZRHSKMZHCIKDHI-UHFFFAOYSA-N 377.916 2.877 0 50 GFAA CC[C@@H](c1nc(COc2cccc(F)c2)nn1-c1cnn(C)c1)n1cccn1 1772806895 GQLYPCCUTPJXJX-KRWDZBQOSA-N 381.415 2.915 0 50 GFAA O=C(Cc1ccsc1)N1C[C@H]2CN(Cc3ccccc3Cl)C[C@@]2(CO)C1 1772816050 FNHXKWBOYIELPX-XLIONFOSSA-N 390.936 2.897 0 50 GFAA CN(CCCCN1CCOCC1)Cc1nc(Cc2ccccc2Cl)no1 11838903 YKIPVAABMURFTJ-UHFFFAOYSA-N 378.904 2.858 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCc1nnc(-c2ccc(C(C)=O)s2)o1 11873913 NVOZGORXYMVRBL-ZDUSSCGKSA-N 376.482 2.534 0 50 GFAA O=C(NC1CC1)C1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)CC1 13678377 DNYGBDMBDCLNNV-UHFFFAOYSA-N 391.320 2.814 0 50 GFAA CC[C@@H](C(=O)NCc1ccccn1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712273 ZFTLRCPCSUONIH-INIZCTEOSA-N 381.885 2.596 0 50 GFAA COC(=O)[C@@H]1CCCN1c1ccc(-c2nc(COc3ccccc3)no2)cn1 14961418 SAKTZMYFJUEJLD-INIZCTEOSA-N 380.404 2.852 0 50 GFAA CN(Cc1ccc2c(c1)OCO2)Cc1nnc(SCc2ccncc2)n1C 15068901 XJWKSLFVBVUUKT-UHFFFAOYSA-N 383.477 2.863 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)c3cc(COc4ccccc4)[nH]n3)CC2)C[C@@H](C)O1 15078483 QRHBAEGOOOAFHE-CALCHBBNSA-N 398.507 2.703 0 50 GFAA CCN(CC)CCNCc1ccc(OC[C@@H](O)CN(C)Cc2ccccc2)cc1 19732941 FSKJJCHEXCRPNO-QHCPKHFHSA-N 399.579 2.990 0 50 GFAA Cc1cn2nc(C(=O)NCc3ccccc3F)cc2c(N2CCSCC2)n1 169768821 RVRTZSGITOQCSW-UHFFFAOYSA-N 385.468 2.660 0 50 GFAA C[C@@H]1CN(c2ccc(C(=O)N3CCCCC3)cn2)CCN1c1ccc(F)cn1 1857690194 FHTLSXJYIUDKGY-MRXNPFEDSA-N 383.471 2.957 0 50 GFAA Cc1cccnc1CN1CC2(CCN(C(=O)[C@@H]3CC34CCC4)CC2)OCCC1=O 1857716566 DBMXIGCXYABKPB-SFHVURJKSA-N 397.519 2.690 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3cc(C4CC4)ncn3)C[C@]23CC[C@H]1O3)c1ccccc1 1857723625 NZSQYDPFRPDXIJ-XNSSQMBPSA-N 390.487 2.768 0 50 GFAA Cn1cccc(CN2CCC[C@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)c1=O 1857729853 HUQXDJNZUVTOAA-QFIPXVFZSA-N 382.508 2.658 0 50 GFAA CCn1nc(C)cc1C(=O)N1CC[C@@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1875248689 HGPXRBLUXHKKGP-DENIHFKCSA-N 399.491 2.512 0 50 GFAA C[C@@]1(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCCN1C(=O)c1ccccc1 116632261 PFEDXFJQLSYEPG-BEFAXECRSA-N 397.441 2.682 0 50 GFAA Cc1nccc(CNC(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1 363439578 JJTSTIBKXVBHLS-SFHVURJKSA-N 378.398 2.856 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)c2ccc(N3CCCC3)c(F)c2)C1=O 163795301 KJIYZENCICNZSB-KRWDZBQOSA-N 397.450 2.970 0 50 GFAA O=C(Nc1n[nH]c(-c2ccccc2Cl)n1)[C@H]1CC(=O)N(Cc2ccccn2)C1 363437079 OVRZAYNSTLYPNV-LBPRGKRZSA-N 396.838 2.507 0 50 GFAA NCCc1cn(S(=O)(=O)c2c(Cl)nc3sccn23)c2ccccc12 3816551 RYBOXBBYCVOYNO-UHFFFAOYSA-N 380.882 2.742 0 50 GFAA in-vitro CCCCCCn1cc(C(=O)NCCN2CCOCC2)c(=O)c2ccccc21 2325809453 NSJJUVVGQBYIHX-UHFFFAOYSA-N 385.508 2.644 0 50 GFAA O=C(N[C@@H]1CCCn2nccc21)[C@@H]1CO[C@H](CNCc2ccccc2Cl)C1 2332237548 AOLIBSREUUGHNC-XYJFISCASA-N 388.899 2.683 0 50 GFAA CN1C(=O)[C@@H](CC(=O)Nc2ccc(F)cc2)N(Cc2cccs2)C1=S 1077791 FXLDSWUHIFVNKM-CQSZACIVSA-N 377.466 2.844 0 50 GFAA Cc1nnc(N2C(=O)c3ccc(-c4nc5ccccc5c(=O)o4)cc3C2=O)s1 1208683 QFFSKTVTUDJSGW-UHFFFAOYSA-N 390.380 2.816 0 50 GFAA CCOc1ccc(C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1Br 4507035 AFSIXILHDZPZGC-UHFFFAOYSA-N 399.266 2.748 0 50 GFAA COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C 5018187 VSHDSIZCAIEPCM-IRXDYDNUSA-N 392.496 2.826 0 50 GFAA aggregator Oc1nnc(-c2ccc(F)cc2)c2c1Nc1nnnn1[C@H]2c1ccc(F)cc1 9202039 FDXVVEYAWHCLLV-INIZCTEOSA-N 379.330 2.809 0 50 GFAA CCOc1ccccc1CCCNS(=O)(=O)c1ccc(NC(C)=O)cc1 10111008 WNHGNBLODFQETD-UHFFFAOYSA-N 376.478 2.955 0 50 GFAA O=C(c1cn(CCC2CCCCC2)nn1)N1CCCN(C(=O)c2ccco2)CC1 11702286 VZWDSMOKWNTWBL-UHFFFAOYSA-N 399.495 2.830 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(N(C)CCn3ccnc3C)nc2)CCN1C(C)C 12305667 UITFAGKWTVGJLV-FQEVSTJZSA-N 398.555 2.668 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CCC4=NNC(=O)CC4)C3)C2)c1 12464561 FGBXFKFZYIWAQW-QHCPKHFHSA-N 396.535 2.856 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccccc2F)C1)C(=O)c1cc2ncccn2n1 12470283 ASNRZSHPWMSIIU-KRWDZBQOSA-N 395.482 2.895 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1 14949469 WEHMTWNZTFDGIO-NRFANRHFSA-N 376.472 2.984 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(C(=O)c3ocnc3C)C2)cc1OC 15069600 PEBRARUCYAXPHE-KRWDZBQOSA-N 387.480 2.779 0 50 GFAA Cc1ccc(CN2CCN(S(=O)(=O)c3ccc(Br)cc3)CC2)o1 17081655 GEHPDAOOKBODDO-UHFFFAOYSA-N 399.310 2.857 0 50 GFAA Cc1cccc(C(=O)N2CCCC[C@@H]2CCn2cc(C(=O)NC3CC3)nn2)c1 19144519 SBKRBEMSTQHJAK-GOSISDBHSA-N 381.480 2.564 0 50 GFAA CC(C)CN1CCNC(=O)[C@@H]1CC(=O)NCC1(c2ccccc2)CCCCC1 23128926 FXKGRXKDYUZEEW-FQEVSTJZSA-N 385.552 2.851 0 50 GFAA Cc1nnc2ccc(N3CCC[C@@H](C(=O)NCc4ccccc4Cl)C3)nn12 32105823 VOWWLQHBNHLWBP-OAHLLOKOSA-N 384.871 2.619 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)n1 65362073 OVQXLJVKDBTMEW-UHFFFAOYSA-N 393.413 2.832 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1Cl 65362392 CJGSBGKEFSHJAK-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA Cc1nc(N2CCCCC2)cc(N2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 65362792 MUBJWJWRBHJDMX-UHFFFAOYSA-N 397.498 2.806 0 50 GFAA C[C@@H](CN)C(=O)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67491222 ZBRHLWPOYQXDKC-LBPRGKRZSA-N 383.473 2.985 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCC(CO)CC3)nc2)cc1 67673933 BJTPJMOGQIZLIJ-UHFFFAOYSA-N 383.492 2.662 0 50 GFAA CCOC(=O)c1[nH]c2ccccc2c1CN1CCN(c2ncc(F)cn2)CC1 67771697 VHEUVVAESQIETM-UHFFFAOYSA-N 383.427 2.596 0 50 GFAA C[C@@H](C(=O)N1CCC(c2cc(Cc3ccccc3)n[nH]2)CC1)N1CCCC1=O 67880034 UBMZPDYHRPBPOE-INIZCTEOSA-N 380.492 2.717 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)N1CCc2c(c(C(=O)O)nn2CC2CC2)C1 67966168 ORVWZDJOKPBWHU-SFHVURJKSA-N 383.448 2.734 0 50 GFAA COc1cc2c(cc1-n1ccnc1-c1ccnc(C(C)C)n1)n(C)c(=O)n2C 77299164 DYNLBMIMERZRIT-UHFFFAOYSA-N 378.436 2.652 0 50 GFAA CCc1nc(CNC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)cs1 91782258 IHIATVDDUXTMKQ-UHFFFAOYSA-N 387.417 2.931 0 50 GFAA CN(C)CCCN1CC2(CCC1=O)CCN(C(=O)[C@H](F)c1ccccc1)CC2 91849209 ATUNNWHZOPHHHK-HXUWFJFHSA-N 389.515 2.880 0 50 GFAA CCN1C(=O)COc2cc(NC(=O)N3CCC[C@H](c4ccncn4)C3)ccc21 96165552 CLDUFNGYOKGCEZ-AWEZNQCLSA-N 381.436 2.633 0 50 GFAA C[C@H](Oc1cccc(F)c1)C(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1 120041276 LJAIMPUQDWLLJW-ZDUSSCGKSA-N 392.452 2.920 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779736 LKNQSBSBBXLRIQ-UHFFFAOYSA-N 384.386 2.859 0 50 GFAA CCCCN1C(=O)CC[C@@H](C(=O)NCC(F)(F)CO)[C@H]1c1ccccc1OC 170597368 IWOFWSFAIXMDDZ-CRAIPNDOSA-N 398.450 2.519 0 50 GFAA O=C(N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(Br)cn1 171199760 XYCPLPKLGHUYMU-QGZVFWFLSA-N 390.281 2.647 0 50 GFAA O=C(NCc1cccc(CN2CCCC2=O)c1)c1nn(-c2ccccc2)cc1O 175374111 JBCPQKVVDWDQFL-UHFFFAOYSA-N 390.443 2.630 0 50 GFAA CCCNC(=O)c1ccc(NC(=O)[C@@H]2COCCN2CC2CCC2)cc1Cl 188261434 KXTZJHUOGWKPOT-SFHVURJKSA-N 393.915 2.919 0 50 GFAA CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@@]4(C3)NC(=O)NC4=O)o2)c1 195017492 KHMPTTPPTIVJEQ-NRFANRHFSA-N 381.432 2.884 0 50 GFAA COc1ccc(CCC(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)c(OC)c1OC 221904973 GPWLENJHLDOFTK-JYJNAYRXSA-N 391.464 2.889 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CCC(=O)O)C1)c1c(F)cccc1F 236685916 ZTHXNQCHVPWCOL-BBRMVZONSA-N 382.407 2.636 0 50 GFAA O=C(O)CCN(C(=O)c1cc(-c2ccccc2Cl)[nH]n1)C1CCOCC1 238077120 FNDFLZDWEAJSLV-UHFFFAOYSA-N 377.828 2.826 0 50 GFAA CNC(=O)c1cccc(CCNC(=O)Nc2nn(C)cc2-c2ccccc2)c1 252495176 OMGMKABLUNNLQR-UHFFFAOYSA-N 377.448 2.811 0 50 GFAA CN(CCCO)C1CCN(Cc2nc3ccc(Br)cc3o2)CC1 253430100 WMJUBYLPVQCRHO-UHFFFAOYSA-N 382.302 2.869 0 50 GFAA COc1cc(CCC(=O)N2CCC[C@@H](C(=O)O)C2)ccc1OCC(F)(F)F 261818632 NGBABIDVQKOPSX-CYBMUJFWSA-N 389.370 2.892 0 50 GFAA COc1ccccc1[C@@H]1CNCCN1C(=O)c1sc(-c2cnn(C)c2)nc1C 261932605 JSBODZOCFUXTRD-INIZCTEOSA-N 397.504 2.647 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)N2CCC[C@@H](N(C)CC(=O)O)CC2)C12CCCCC2 263207552 IHSGQJYHVXSOHT-FGTMMUONSA-N 395.544 2.695 0 50 GFAA O=C(NC[C@H]1CCN(CC(F)(F)F)C1)[C@H]1COc2ccc(Cl)cc2C1 299035639 PSAQSPRDBPHUCD-DGCLKSJQSA-N 376.806 2.892 0 50 GFAA COc1ccc(CNC(=O)CNC(=O)CCCc2c[nH]c3ccccc23)cc1 299241137 OSXYWHPJKFSHBZ-UHFFFAOYSA-N 379.460 2.932 0 50 GFAA CCn1c([C@H]2OCC[C@H]2c2ccccc2)nn(Cc2ccc(CO)cc2)c1=O 328634639 MVCRPQCDPZICBV-PMACEKPBSA-N 379.460 2.851 0 50 GFAA CCn1ccnc1CN(C(=O)c1cc(Cl)cn1C)[C@@H]1CC12CCNCC2 328635340 NHHZQGJUDDDCJP-MRXNPFEDSA-N 375.904 2.679 0 50 GFAA O=C1N(Cc2nnc3n2CCCCC3)C(O)=N[C@@]12CCc1cc(Cl)ccc12 330346257 GHIXDSFEAFKUAJ-LJQANCHMSA-N 385.855 2.756 0 50 GFAA COc1ccccc1CNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1 363205194 OBFYLPHNGZYBJX-KRWDZBQOSA-N 392.459 2.740 0 50 GFAA COc1cc(/C=C/C(=O)N2CCC[C@]23CCOC3)cc(Br)c1O 367655147 YOGAJPHFEBLCCT-REMYHPOOSA-N 382.254 2.958 0 50 GFAA CC(=O)c1c(C)nn([C@@H](C)CC(=O)NCc2nc(O)c3ccccc3n2)c1C 426519186 FAZXJXMWFKRGEJ-NSHDSACASA-N 381.436 2.619 0 50 GFAA CCCO[C@@H]1CCCN(S(=O)(=O)c2cc(-c3ccno3)ccc2OC)C1 952966455 WEOJSNGHORMHOO-OAHLLOKOSA-N 380.466 2.930 0 50 GFAA Cc1cc(CC(=O)N2CCCN(C[C@@H](C)Cc3ccc4c(c3)OCO4)CC2)on1 1529181042 PGUMODIVRRFYHF-INIZCTEOSA-N 399.491 2.667 0 50 GFAA O=C(N[C@H]1COCC[C@@H]1Oc1ccccn1)c1c[nH]nc1-c1cccc(F)c1 1565531475 XZLGYISCEQUROD-IRXDYDNUSA-N 382.395 2.577 0 50 GFAA Cc1nc2ccc(Cc3nc(C4CCOCC4)nn3-c3ccnn3C)cc2[nH]1 1857680262 JNCCHECKLOXPAM-UHFFFAOYSA-N 377.452 2.670 0 50 GFAA Cn1cnc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3c[nH]nc3C3CCCCC3)C2)c1 1857694196 DQNHPNRALDLIHB-HZPDHXFCSA-N 398.511 2.662 0 50 GFAA Cn1nc(CN2CC[C@H]3[C@@H]2CC(=O)N3C2CCOCC2)c2c(Cl)cccc21 1857696185 QLPRMGKSTBKFET-WMZOPIPTSA-N 388.899 2.581 0 50 GFAA CSCC(=O)N1CCC2(CC1)CN(Cc1ccc(C)s1)C[C@@H]2C(=O)O 1857704413 QUYJLUAHGRLFPX-OAHLLOKOSA-N 382.551 2.545 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(Cc3nc4ccccc4[nH]3)C1)CC2 1857727139 LSWYHESWTVIRRN-OAQYLSRUSA-N 378.480 2.605 0 50 GFAA Cc1ccccc1C1(C(=O)NC[C@@H](CC2CCOCC2)C(=O)O)CCOCC1 1875268152 XBFABPLYHQZDLS-GOSISDBHSA-N 389.492 2.677 0 50 GFAA C[C@@H]1CN(C(=O)c2cc3cnccc3[nH]2)C[C@H]1NC(=O)c1coc(C2CCC2)n1 1875333856 NYRAXUBPEKIVTI-SJKOYZFVSA-N 393.447 2.709 0 50 GFAA CC(C)[C@H](NS(C)(=O)=O)C(=O)N[C@@H](CNc1ccccc1)c1ccccc1 1875344455 LEKSXEWRYBLFFQ-OALUTQOASA-N 389.521 2.530 0 50 GFAA Cc1ccc([C@@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(C)n1 1875397527 CXSMMSGMKZYRBK-QZTJIDSGSA-N 396.539 2.737 0 50 GFAA O=C(N[C@@H]1C[C@@H](NC(=O)c2ccc(C(F)F)o2)C12CCC2)C1=CCOCC1 2325794994 ZCKKRACGJJSEHY-HUUCEWRRSA-N 380.391 2.721 0 50 GFAA Cc1nc(-c2cccnc2)ncc1C(=O)Nc1nc(C)c(C(=O)N(C)C)s1 2356147405 UTKIHKWIHWVGBC-UHFFFAOYSA-N 382.449 2.566 0 50 GFAA CC1(C)CN(c2ncc(C(=O)Nc3cccc(C(F)(F)F)c3)c(N)n2)C(=O)N1 537853 FUSNOPLQVRUIIM-UHFFFAOYSA-N 394.357 2.638 0 50 GFAA in-man O=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1cc2ccccc2oc1=O 909556 HIGQHOWPCSBASF-UHFFFAOYSA-N 398.440 2.830 0 50 GFAA CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)[C@H]1c1ccc(OC)cc1 917656 AGMOVMVLXKYHBL-FQEVSTJZSA-N 388.489 2.945 0 50 GFAA COc1ccc([C@@H]2C(C(=O)NCc3ccccc3)=C(C)Nc3ncnn32)cc1 4695801 GUTCRUDPBHYHBM-LJQANCHMSA-N 375.432 2.892 0 50 GFAA COC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C 5714498 DWYSRIJWRASDRW-HNNXBMFYSA-N 380.441 2.759 0 50 GFAA Cc1nc2ncnn2c(O)c1NS(=O)(=O)c1ccc(C2CCCCC2)cc1 6269115 RAMCGWDCOJCJNS-UHFFFAOYSA-N 387.465 2.987 0 50 GFAA COc1cccc(CNC(=O)c2cccn2-c2nnc(N3CCCC3)s2)c1 8600453 KZDDIWALKFMIPL-UHFFFAOYSA-N 383.477 2.868 0 50 GFAA CSCCCNC(=O)c1cccc(OC2CCN(C(=O)C3CC3)CC2)c1 11754035 AIXQFXFOAAPAET-UHFFFAOYSA-N 376.522 2.949 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCC[C@H](CNC(=O)c3ccc(F)cc3)C2)cc1 11770672 JGUHSFJDWGIJMU-OAHLLOKOSA-N 398.434 2.895 0 50 GFAA CCN(CCO)C(=O)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 12027963 BFSTYXBAMMNRKW-UHFFFAOYSA-N 394.519 2.690 0 50 GFAA Cc1cc(C(=O)N2CC[C@]3(CCCN(Cc4ccccc4F)C3=O)C2)nc(C)n1 12300620 IHYGBUMCXPDONP-JOCHJYFZSA-N 396.466 2.887 0 50 GFAA O[C@H](COc1cccc(CNCCOc2cccnc2)c1)CN1CCCCCC1 12318426 XTBCYYZGHYEEHG-NRFANRHFSA-N 399.535 2.866 0 50 GFAA Cc1ccc(Cn2cnc3sc4c(c3c2=O)CC[C@H](N(C)CCO)C4)cc1 12470182 HGPHDTBBAFODGK-INIZCTEOSA-N 383.517 2.596 0 50 GFAA CN1CCC(N(C)C(=O)CC[C@H]2CCCN(C3CSCCSC3)C2)CC1 12704588 QYWPJKWSTAEUPD-QGZVFWFLSA-N 399.670 2.880 0 50 GFAA COc1ccccc1CN[C@@H]1CCc2c(c(C(=O)N(C)C)nn2CC(C)C)C1 14753087 IMLCOJHFKSEGTE-QGZVFWFLSA-N 384.524 2.897 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCCc1ccccn1)C2 14755542 ZZLOACGJSDSPKO-LJQANCHMSA-N 395.551 2.860 0 50 GFAA O=C(c1cnsn1)N1CC[C@H]2[C@H](CCC(=O)N2CCC2CCCCC2)C1 14978924 FXXUXHDFQISEJL-WBVHZDCISA-N 376.526 2.962 0 50 GFAA CCOc1nc2ccccc2nc1N1CCC[C@H](C(=O)N2CCSCC2)C1 44803586 BMVNVQMKAIXELO-HNNXBMFYSA-N 386.521 2.820 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc(-n2ccnc2)n1 67602036 ZIULMXXFZLIJML-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CCCN(c4ncccn4)CC3)cn2)c1 67673808 SXAPPCUYOFLCPJ-UHFFFAOYSA-N 389.459 2.900 0 50 GFAA CC(C)c1ncc(C(=O)N2CCO[C@H](Cc3ccccc3Cl)C2)c(=O)[nH]1 71745234 LBRNHACEEFDBKM-CQSZACIVSA-N 375.856 2.630 0 50 GFAA Cc1cc(C)n([C@H]2CCN(Cc3c(C(=O)N4CCCC4)nc4ccccn34)C2)n1 71763226 GDSDMUSCDGIOAI-SFHVURJKSA-N 392.507 2.831 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)C(=O)c3cccn3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 72172905 FQHZJPHLLHTBRM-HMXCVIKNSA-N 377.488 2.605 0 50 GFAA COc1cc(SC)c(OC)cc1CN1CCC(N2CCC[C@@H](O)C2)CC1 72431116 JRHRMQCCHVRKEJ-QGZVFWFLSA-N 380.554 2.847 0 50 GFAA O=C(CCN1CCC[C@@]2(CCC(=O)N(Cc3ccccc3)C2)C1)N1CCCC1 72458239 FJEKJRLESIZVDD-HSZRJFAPSA-N 383.536 2.904 0 50 GFAA O=C1CC[C@H](c2nc(C3CCOCC3)nn2Cc2c(F)cccc2Cl)N1 96149615 NIUXMICQQVVFPX-OAHLLOKOSA-N 378.835 2.964 0 50 GFAA CSCc1nc(CNC(=O)CCc2nc(-c3ccncc3)no2)cs1 97272553 LNXMUODREWLCCI-UHFFFAOYSA-N 375.479 2.700 0 50 GFAA COc1cccc2c1OCC(C(=O)NC1CCN(Cc3ccccn3)CC1)=C2 124761068 LDRIDFHNNONVFR-UHFFFAOYSA-N 379.460 2.647 0 50 GFAA CCOc1ccccc1NC(=O)[C@H](C)N1CCn2c(nnc2C(F)(F)F)C1 150908870 GOTDUNCUDOIHTK-NSHDSACASA-N 383.374 2.538 0 50 GFAA O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)N1CCN(c2ccc(F)cc2)CC1 154485512 FACWGLXWXYOFKR-JOCHJYFZSA-N 397.494 2.765 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1c(Cl)nc2ccccn12 157150620 PSLSXLXBMPVQDX-NSHDSACASA-N 394.888 2.516 0 50 GFAA Cc1ccc(Cn2c(C3CCN(C(=O)Cc4ccccc4)CC3)n[nH]c2=O)cc1 169770175 CMHVHUNFCYCHGJ-UHFFFAOYSA-N 390.487 2.877 0 50 GFAA C[C@]1(CO)CCN(C(=O)c2ccc(Cl)cc2I)C1 170596289 XZAJCRXZVCLDSM-ZDUSSCGKSA-N 379.625 2.789 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1 170614967 GOXYNQATWDTYDL-BBRMVZONSA-N 393.484 2.598 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCCC[C@@H]1CCO 180426689 USBBLQMSSUBPDH-QGZVFWFLSA-N 381.467 2.876 0 50 GFAA Cc1cc(C(=O)NC2CCN(C(=O)C[C@](C)(O)c3ccccc3)CC2)c(C)o1 182313097 YGOBUPLOGUARBZ-QFIPXVFZSA-N 384.476 2.915 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)N[C@H](CC(N)=O)C3CCCCC3)c2O1 192639815 ITTFWGHMXQVCRT-OAHLLOKOSA-N 380.510 2.503 0 50 GFAA CCN(C(=O)NCc1ccc(COC2CCOCC2)cc1)[C@@H](C)CN(C)C 252497267 QCSGVAVOJMNAFU-KRWDZBQOSA-N 377.529 2.864 0 50 GFAA CC(C)Oc1ccccc1CNC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O 334161788 ILXBHEZSDXKHDM-GOSISDBHSA-N 395.459 2.621 0 50 GFAA Cc1cc(F)c(Br)cc1NC(=O)C(=O)N1CC[C@H]([C@H]2CCOC2)C1 377001526 PXJAZVCUZMGHMR-RYUDHWBXSA-N 399.260 2.720 0 50 GFAA CN(C)[C@@H](C(=O)NCc1ccccc1-n1cccn1)c1ccc2c(c1)OCO2 426722435 MHVBHPLHWKWIHD-HXUWFJFHSA-N 378.432 2.520 0 50 GFAA COc1ccc(Cn2cc(C(=O)N3CCC[C@H](c4ncc[nH]4)C3)cn2)cc1OC 427132126 ZGWQAVUHFTXTOT-INIZCTEOSA-N 395.463 2.692 0 50 GFAA Cn1nccc1N1CCC[C@@H](NC(=O)c2cc(Cl)c3ccccc3n2)C1=O 451140437 GHWULPRUQOOCMI-OAHLLOKOSA-N 383.839 2.547 0 50 GFAA CCn1ncc(CNC(=O)N2CCN([C@H]3CCc4ccccc4C3)CC2)c1C 534651194 UBJLKIDPIMFQIO-NRFANRHFSA-N 381.524 2.596 0 50 GFAA O=C(NCCCSCc1ccccc1Cl)N1CCN2C(=O)OC[C@@H]2C1 584894818 RWPUVOOXVBRWKY-AWEZNQCLSA-N 383.901 2.809 0 50 GFAA CC(C)CCOc1ccccc1CCNC(=O)N1CCC2(CC1)CNC(=O)C2 584903135 PDRAOIBJVOXHOU-UHFFFAOYSA-N 387.524 2.966 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)[C@@H]1CCCCN1C(=O)c1ccccc1 670452204 ZCHRWOQGMYCTDH-FQEVSTJZSA-N 380.492 2.990 0 50 GFAA CN(C)S(=O)(=O)[C@H]1CCCN(c2nc(Cl)nc3c2CCCC3(C)C)C1 848703580 KOVACAXVADVIOP-LBPRGKRZSA-N 386.949 2.604 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)NC[C@@H]1CN(Cc2ccccc2)CCCO1 1506420640 JDJPEXYMFLPKBD-LJQANCHMSA-N 396.535 2.628 0 50 GFAA Cc1cc(C(=O)Nc2ccc3c(c2)N(C)C(=O)[C@@H](C)O3)ccc1N1CCOCC1 1506422415 PHCPOOYJNAMALG-OAHLLOKOSA-N 395.459 2.828 0 50 GFAA Cc1onc(-c2c(Cl)cccc2Cl)c1CN1C[C@@H]2CNC[C@@]2(CO)C1 1772704349 QRBYRLDRKHHQRD-SGTLLEGYSA-N 382.291 2.971 0 50 GFAA c1ccc(CC[C@]23CN(Cc4cnc[nH]4)C[C@H]2CN(c2nncs2)C3)cc1 1772808834 CFLLWDFVRSXYCB-FXAWDEMLSA-N 380.521 2.832 0 50 GFAA Cc1cnn(CCCN2C[C@H]3CN(Cc4ccccc4)C[C@@]3(CCC(=O)O)C2)c1 1772809444 WOQZTCQNVMQKFF-JTHBVZDNSA-N 396.535 2.880 0 50 GFAA COc1ccc(F)c(CN2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)c1 1857697758 LNDRRUVORARRAW-SFTDATJTSA-N 384.451 2.836 0 50 GFAA COc1cc(-c2nccn2C2(C3CC3)CC2)ccc1OCC(=O)N1CCOCC1 1857698543 XCXSMWJDIXXUAG-UHFFFAOYSA-N 397.475 2.695 0 50 GFAA O=C(NCC1(CO)CCC1)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857723949 DRQKXBWICGNWTH-ZDUSSCGKSA-N 377.872 2.976 0 50 GFAA OCCOc1cccc(CN2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1 1857740995 XCIIKCKJDFQZLF-HSZRJFAPSA-N 395.503 2.911 0 50 GFAA Cc1ccc(Cc2ccccc2C(=O)N2C[C@H]3COC[C@@H](C2)C(=O)N3C)cc1F 1875249339 VPLJPEVLIVEOLC-MOPGFXCFSA-N 396.462 2.654 0 50 GFAA N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1)Cc1ccccc1 1875263860 WIWMSPQIMJQPIK-YADHBBJMSA-N 393.531 2.687 0 50 GFAA C[C@@H]1C[C@@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)CC(=O)N1 1875270420 JPXAYQHEUGFARX-RKDXNWHRSA-N 382.233 2.714 0 50 GFAA COc1cc(CNC(=O)N2CC[C@@H](C)C2)ccc1CNC(=O)N1CC[C@@H](C)C1 1875272649 CDPHKWZEFONLGU-HZPDHXFCSA-N 388.512 2.798 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@H](CCCN3C(=O)c3ccc(F)c(C)c3)C2)ncn1 1875280552 WISNMIXDPXFGRO-XLIONFOSSA-N 396.466 2.999 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cc(F)cc(N3C[C@H](C)O[C@H](C)C3)c2)CC1 1875365909 KMBCKHMZENXKTM-GASCZTMLSA-N 389.471 2.802 0 50 GFAA Cc1sc(NC(=O)CCNS(C)(=O)=O)nc1C12CC3CC(CC(C3)C1)C2 1940197020 MMJJRZDFEBIPJF-UHFFFAOYSA-N 397.566 2.797 0 50 GFAA Cn1cnc(C(=O)N[C@H]2CC[C@H](CCNC(=O)c3ccc4ccccc4n3)C2)c1 2325879707 DTSFMVGOFGZRRU-WBVHZDCISA-N 391.475 2.687 0 50 GFAA CCCOc1ccccc1C(=O)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356145564 QEIOSDWDTAIGLB-NFBKMPQASA-N 397.471 2.996 0 50 GFAA O=C(CCCn1cccn1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356165491 BLHYAPYVBRMTSV-HSZRJFAPSA-N 394.519 2.890 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1 651251 AHOFTLALAVJAKS-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1I 670812 LXLJMUHVQLSRLR-UHFFFAOYSA-N 396.184 2.651 0 50 GFAA CCn1cc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c(C(=O)NC2CCCCC2)n1 1460410 BGZONIBVLOVGMX-HUUCEWRRSA-N 388.468 2.571 0 50 GFAA COc1ccc(CCc2nnc(CCC(=O)N(C)C[C@H]3CCCCO3)o2)cc1 11662633 JCLKXOCOIDHCBV-GOSISDBHSA-N 387.480 2.824 0 50 GFAA COCC(=O)N1CCC(Oc2ccc(C(=O)N(C)Cc3ccco3)cc2)CC1 11768039 ILMVMTZCALENJT-UHFFFAOYSA-N 386.448 2.568 0 50 GFAA O=C(Nc1ccnn1C1CCN(C(=O)CCOc2ccccc2)CC1)C1CC1 11878145 QTAWNLJHRXJPPW-UHFFFAOYSA-N 382.464 2.864 0 50 GFAA Cc1cccnc1CN(C)C[C@]1(O)CCCN(Cc2cccc(F)c2F)C1=O 12373723 YUXRVPMFVVDTAI-OAQYLSRUSA-N 389.446 2.654 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1C[C@H](NCC(F)(F)F)CC2 14532847 LDEBMCYBMUBDMG-CQSZACIVSA-N 380.414 2.642 0 50 GFAA CCn1c(CN2CCOCC2)nnc1SCC(=O)Nc1cccc(Cl)c1 15018904 VLFOCXABZCQJPZ-UHFFFAOYSA-N 395.916 2.514 0 50 GFAA O=C(N[C@@H]1CCCN(CCc2ccccc2)C1)C1(N2CCOCC2)CCCCC1 15062770 XYIWWQGLISFPCY-JOCHJYFZSA-N 399.579 2.845 0 50 GFAA O=C(NCc1ccccc1)[C@@H]1CCCN(C2CCN(C(=O)c3ccoc3)CC2)C1 15064350 PAJGSJYDUUGDKQ-LJQANCHMSA-N 395.503 2.913 0 50 GFAA COc1ccc(Cc2noc(-c3ccc(N[C@H]4CCCCNC4=O)nc3)n2)cc1 39516085 HQSKNWNAMXILIG-KRWDZBQOSA-N 393.447 2.812 0 50 GFAA CCOC(=O)c1ccc(NC(=O)C2CCN(C(=O)N(CC)CC)CC2)cc1 47978034 PMYWWEPGBHGWLI-UHFFFAOYSA-N 375.469 2.976 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3nc(C)c(C)s3)n2)c(F)c1 49550752 GVVKTKUKLDQUSX-UHFFFAOYSA-N 388.424 2.770 0 50 GFAA CCCC(=O)Nc1ccc(NC(=O)c2nnc3nc(C)cc(C)n23)cc1OC 55108670 DHUBQOFYGJGMCA-UHFFFAOYSA-N 382.424 2.741 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)c1ccc(N2CCCC2=O)cc1 55815712 JVZVDWCKPRHCKK-UHFFFAOYSA-N 379.460 2.898 0 50 GFAA Cc1nc(CC(=O)N2CCc3nnc(CCc4ccccc4)n3CC2)c(C)s1 67514108 VHUIMEDAHNVFPQ-UHFFFAOYSA-N 395.532 2.764 0 50 GFAA CC1(C)CC(NC(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)CC(C)(C)N1 67754872 AIJYGEKSOHQSSD-UHFFFAOYSA-N 380.496 2.847 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@@H](Cc2ccc(C(=O)O)cc2)C1 72174552 LABDIZDDTHITHM-INIZCTEOSA-N 378.432 2.831 0 50 GFAA COC[C@H](c1ccccn1)N(C)C(=O)c1cnc(-c2ccc(C)cc2)[nH]c1=O 91487126 ZUNPDXUSAIGHLG-GOSISDBHSA-N 378.432 2.600 0 50 GFAA CC[C@@H](C(=O)OC)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95366593 XZVKASUFGZYQLA-KRWDZBQOSA-N 380.435 2.731 0 50 GFAA CN(C(=O)Nc1ccc(OCC(N)=O)cc1)C1CCN(Cc2ccccc2)CC1 113540799 MYARHPSODOEPGS-UHFFFAOYSA-N 396.491 2.679 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1cnc(C(F)(F)F)nc1 126311288 DYPFGAOWQPOKJG-OAHLLOKOSA-N 378.398 2.790 0 50 GFAA Cc1cc(C(=O)N2c3ccccc3CC[C@@H]2C(C)C)nc2nc(O)[nH]c(=O)c12 127788653 XLPGUBNQRRZMDU-OAHLLOKOSA-N 378.432 2.950 0 50 GFAA CN(C)c1cc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc(Cl)n1 130036668 ASLZRKULEQKNLN-INIZCTEOSA-N 386.883 2.722 0 50 GFAA CC(=O)O[C@@H]1C2=C([C@H]3OC(=O)/C(=C/O[C@H]4C=C(C)C(=O)O4)[C@@H]13)C(C)(C)CCC2 138272666 DLRIUVHQJRZTMZ-CQMYTRALSA-N 388.416 2.710 0 50 GFAA biogenic Cn1ccnc1-c1cccc(NC(=O)N2CCC(Nc3cccnn3)CC2)c1 151453482 ILHUCASSUUDVEJ-UHFFFAOYSA-N 377.452 2.986 0 50 GFAA Cc1cc(C)c2c(OCC(=O)N[C@@H]3C[C@@H]3c3ccc(F)cc3F)nn(C)c2n1 170626417 WFIDQCXZSKRFEZ-GDBMZVCRSA-N 386.402 2.914 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCN(c2nc3ccccc3o2)CC1 172387320 QADBNVBFOCSYBG-UHFFFAOYSA-N 392.459 2.627 0 50 GFAA O=C(NCC1CC1)[C@H]1CCCN([C@H]2CCN(c3cccc(Cl)c3)C2=O)C1 177031307 ANVMYRSXBRZAMK-YJBOKZPZSA-N 375.900 2.684 0 50 GFAA Cc1cccn2c(=O)c(C(=O)NCc3ccc(CN4CCCC4)cc3)cnc12 179653091 JGLKKRIGNPCLFP-UHFFFAOYSA-N 376.460 2.529 0 50 GFAA COc1c(C(=O)N2CCN(CC3CC3)c3ccccc32)cnc2c1cnn2C 182964746 QWGDUDWZHDWURY-UHFFFAOYSA-N 377.448 2.854 0 50 GFAA Cc1cccc(C)c1-n1nnnc1CN1CCCN(C(=O)c2ccccc2)CC1 193747179 IIZPXXOZPAHVOU-UHFFFAOYSA-N 390.491 2.627 0 50 GFAA Cc1oc(-c2cnn(C)c2)nc1C(=O)N1CCNC[C@H]1c1cccc(Cl)c1 262172895 YQIQJHHGSGBLER-INIZCTEOSA-N 385.855 2.824 0 50 GFAA O=C(O)CC[C@H]1CCCN(C(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)C1 262850889 BOCLKGPDJMCAJL-OAHLLOKOSA-N 397.475 2.840 0 50 GFAA O=c1c2c(CO)c(-c3ccccc3)nn2ccn1CCOc1ccc(F)cc1 263615956 GFRFEMLMICHMNB-UHFFFAOYSA-N 379.391 2.873 0 50 GFAA Cc1ccc(CN[C@@H]2CCC(=O)N[C@H]2c2cnn(C)c2)c(Br)c1 275674530 VUJKSKJJTJJFBK-WBVHZDCISA-N 377.286 2.601 0 50 GFAA Cc1ccc2c(c1)nc(CNC(=O)N1CCO[C@H](c3nnc(C(C)C)o3)C1)n2C 283497860 YOAPUTXEGCEZEJ-INIZCTEOSA-N 398.467 2.671 0 50 GFAA CN(C)c1cc(C(=O)N2CCC([C@@H]3C[C@@H](N)CCO3)CC2)nc2ccccc12 333246140 FTVXSYBNFKFQBE-KKSFZXQISA-N 382.508 2.659 0 50 GFAA COc1ccc(C(F)(F)F)cc1-c1cccc(C(=O)N[C@H]2CCNC2=O)c1 584885718 NMCNZTHTBGCLAK-HNNXBMFYSA-N 378.350 2.999 0 50 GFAA O=S(=O)(CCOc1ccccc1)N[C@H]1CCCN(Cc2ccccc2F)C1 826626751 WHDWFCYKHSLQKT-SFHVURJKSA-N 392.496 2.789 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCCN(Cc3cccs3)C2)c1 828172505 ATBOCUZTPRRDBV-OAHLLOKOSA-N 378.519 2.546 0 50 GFAA COc1ccccc1[C@H]1CN(C(=O)c2ccc(-n3cncn3)c(C)c2)CCO1 870114489 AFTJZNGFHSXVFG-HXUWFJFHSA-N 378.432 2.798 0 50 GFAA COC(=O)c1cc(O)cc(C(=O)N2CCC3(CC2)OCCc2ccsc23)c1 1704344117 OBJGXVPKBNSAFI-UHFFFAOYSA-N 387.457 2.945 0 50 GFAA Cc1cccc(CC(=O)N2C[C@H]3CN(CCO)C[C@]3(CCc3ccccc3)C2)c1 1772710515 SETGIZVRVOMYII-ILBGXUMGSA-N 392.543 2.923 0 50 GFAA c1ccc(CC[C@]23CNC[C@H]2CN(c2ccc(CN4CCOCC4)cn2)C3)cc1 1772712299 NKGUVJVUKXZVPY-LADGPHEKSA-N 392.547 2.572 0 50 GFAA Cc1nc(-c2ccccn2)cc(=NCc2ccnc(N3CCO[C@@H](C)C3)c2)[nH]1 1875255346 FURVKPKWLPAHHG-HNNXBMFYSA-N 376.464 2.501 0 50 GFAA CN(Cc1ccc([S@@](C)=O)cc1)c1nnnn1Cc1cccc2c1CCC2 1875322832 JXOMYQZYBZIKHB-HHHXNRCGSA-N 381.505 2.584 0 50 GFAA CC[C@H](O)[C@H](C)C(=O)N[C@H](CNC(=O)[C@@H](C)c1ccco1)C1CCCCC1 1875344656 OIEDRSZWDYQWMF-ONIAQPFYSA-N 378.513 2.971 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N3CCO[C@@H](C(F)(F)F)[C@H]3C)ccc21 1875372058 VDEUGLZCLZHEII-SJKOYZFVSA-N 382.382 2.944 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ocnc1-c1ccccc1 2325785521 CBWSKQMYNOZEPL-DAXOMENPSA-N 386.839 2.761 0 50 GFAA Cc1ccn(C)c1C(=O)N1C[C@@H]2CN(C(=O)C[C@H]3CC[C@H](C4CC4)O3)C[C@]2(C)C1 2325794696 NPTMGSUIPFQUNO-RTXPOLOASA-N 399.535 2.602 0 50 GFAA COc1ccc(-c2onc(NCc3ccc(C(=O)N(C)C)o3)c2C(=O)O)cc1 2356157212 FRZDYYCGDUYWDA-UHFFFAOYSA-N 385.376 2.955 0 50 GFAA COCC[C@H]1COCCN1C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 462778992 WDPPYTYSUOFVER-ZDUSSCGKSA-N 385.342 2.633 0 50 GFAA COc1cccc(CNS(=O)(=O)c2ccc3c(c2)N(C(C)=O)CCS3)c1 6892665 JDFMIHRCZKAEMQ-UHFFFAOYSA-N 392.502 2.632 0 50 GFAA COC(=O)c1ccc(-c2noc(CN3CCN(c4ccccc4F)CC3)n2)cc1 55119497 GEOUXDKGFBZREV-UHFFFAOYSA-N 396.422 2.985 0 50 GFAA CN(C(=O)CCNC(=O)Cc1ccccc1)C1CCN(Cc2ccccc2)CC1 113093672 HJMVHONELUYLGY-UHFFFAOYSA-N 393.531 2.858 0 50 GFAA Cc1ccc2oc(=O)n(Cc3nc(C)nn3-c3ccc4c(c3)OCCO4)c2c1 63846043 YVPDXHFCNMXDOX-UHFFFAOYSA-N 378.388 2.612 0 50 GFAA O=C(NC[C@@H]1CCN(c2ccccc2)C1)NC[C@@H](O)c1ccc(F)c(F)c1 229739483 SFFVHCJGANFOOD-IFXJQAMLSA-N 375.419 2.824 0 50 GFAA Cc1cc(NC(=O)C2CCN(Cc3nc(-c4cnn(C)c4)cs3)CC2)no1 252482333 DDCAQIGAKPOROM-UHFFFAOYSA-N 386.481 2.691 0 50 GFAA COCCS(=O)(=O)c1ccc(NC(=O)c2oc(CC(C)C)nc2C)cc1 252491760 LSLWOOFQACRZIC-UHFFFAOYSA-N 380.466 2.854 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCN(C3CCCC3)[C@H](CCO)C2)cc1 43103306 PJXFCYWFAANCCZ-HXUWFJFHSA-N 384.524 2.897 0 50 GFAA O=C(c1ccco1)N1CCC(NCCC(=O)N2CCCc3ccccc32)CC1 65435330 HQUIRYUWHRLMSH-UHFFFAOYSA-N 381.476 2.843 0 50 GFAA CCN(CC)Cc1cc(CN2CCN(C(C)C)[C@H](CCO)C2)ccc1OC 39360202 HQKLKTLCLDBSDK-OAQYLSRUSA-N 377.573 2.814 0 50 GFAA O=C(NCCNc1cc(N2CCCC2)ncn1)c1ccc(C(F)(F)F)cc1 72140665 TUZYCCGLEGMWIL-UHFFFAOYSA-N 379.386 2.938 0 50 GFAA CC(C)n1ccnc1CN1CCCN([C@H](C)C(=O)N2CCCCCC2)CC1 370791369 VVKKOIDHCROMCJ-LJQANCHMSA-N 375.561 2.763 0 50 GFAA CC[C@H](C(=O)N1CCC2(CC1)CNC(=O)C2)n1cc(C(C)=O)c2ccccc21 77536632 KSONIAZLBRHGIL-GOSISDBHSA-N 381.476 2.924 0 50 GFAA Cc1[nH]nc2ncc(C(=O)N[C@@H](C)c3cc(F)ccc3N3CCC(O)CC3)cc12 128339651 QMRUGBDDMGNLRB-LBPRGKRZSA-N 397.454 2.858 0 50 GFAA CCOc1ccccc1CCC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O 157416420 WXFBSSJQBGVTEN-QGZVFWFLSA-N 382.460 2.948 0 50 GFAA CCCc1c(C(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)cnn1C1CCCC1 333977340 YYRRKHPHOPYEFK-FQEVSTJZSA-N 393.553 2.992 0 50 GFAA CO[C@@H](CNC(=O)c1ccc(-n2nc(C)c(CCC(=O)O)c2C)cc1)C(C)C 262428062 RLROMJOGMQEIDO-IBGZPJMESA-N 387.480 2.907 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@]2(CCCN(CCCc3ccccc3)C2=O)C1 14965116 QZTHXBWCEATEAF-HXUWFJFHSA-N 378.538 2.672 0 50 GFAA O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCC[C@H]1Cn1ccnc1 177761038 SJDABDRXUJFWPB-ZDUSSCGKSA-N 390.369 2.787 0 50 GFAA COc1cccc(-c2nsc(NS(=O)(=O)c3cn(CC(C)C)cn3)n2)c1 178873947 LACMQNOFMVFNLP-UHFFFAOYSA-N 393.494 2.867 0 50 GFAA CCc1[nH]nc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)c1C 95362559 ZGJUNCNRYMFMNQ-IOMROCGXSA-N 380.492 2.689 0 50 GFAA CCCOC(=O)[C@@H]1[C@H]2C=C[C@@]3(CN(c4ccccc4Br)C(=O)[C@H]13)O2 239433251 XKSAJNGWGQWNCX-BSXFFOKHSA-N 392.249 2.689 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2cncc(Cl)c2)CC1 95379266 UYUQKNDJNIHSHD-UHFFFAOYSA-N 375.904 2.903 0 50 GFAA CCc1ccc(C(=O)NCc2cc3n(n2)CCCN(C(=O)C2CCC2)C3)s1 91820266 YSJVJVFJGCOFIC-UHFFFAOYSA-N 386.521 2.969 0 50 GFAA CCCc1nnc(N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)s1 91440689 GFWCTAKTYAYMRN-UHFFFAOYSA-N 388.541 2.665 0 50 GFAA CC(C)c1nccn1[C@@H](C)C(=O)N1CCC2(CC1)Nc1ccccc1NC2=O 91304564 ZJJQKYBYAXVWBG-HNNXBMFYSA-N 381.480 2.993 0 50 GFAA CN(C)CCN1C[C@H](C(=O)NCc2cccc(Oc3ccccc3)c2)CC1=O 95362178 WLNMGWPMALRZDX-GOSISDBHSA-N 381.476 2.505 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(Cc1nc3ccc(C)c(C)c3[nH]1)CCN2C 95363507 ZVSWHFIDOMQDMD-QFIPXVFZSA-N 383.540 2.698 0 50 GFAA C[C@@H]1CCN2c3cc(Cl)ccc3CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]2C1 247817209 DTOPSWXMIXQGOS-IAQYHMDHSA-N 375.856 2.538 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N[C@H](c1cccs1)[C@H]1C[C@@H](O)C1 244795605 RJQLAEDTWLLFNP-IYOUNJFTSA-N 379.503 2.540 0 50 GFAA COc1cc(C(=O)Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)on1 183330342 HSLWSSBCWCCFIP-UHFFFAOYSA-N 382.401 2.814 0 50 GFAA NC(=O)N[C@H](CC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc(Oc2ccccc2)c1 299743358 NIHPNQRIIALQKP-CRAIPNDOSA-N 397.431 2.512 0 50 GFAA COc1ccc(CN2CCC3(CC[C@H](CNS(=O)(=O)C(C)C)O3)CC2)cc1 299757417 HDBDEWRMCWHVIR-LJQANCHMSA-N 396.553 2.537 0 50 GFAA NS(=O)(=O)c1ccc(Cl)c(NC(=O)N[C@H]2COC3(CCCCC3)C2)c1 299761258 TWPPMIVNLOYKNR-LLVKDONJSA-N 387.889 2.601 0 50 GFAA NCc1ccc(C2(C(=O)NCc3nnnn3-c3cccc4ccccc34)CC2)cc1 1875340755 QENHZJKQSBVTQZ-UHFFFAOYSA-N 398.470 2.622 0 50 GFAA Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@@]45CCCC[C@H]4C5)C3)CC2)s1 1875328149 BAAKAGVRUFIAHQ-HRAATJIYSA-N 387.549 2.605 0 50 GFAA C[C@@H](NC(=O)Nc1ccc(OCc2noc(C3CC3)n2)cc1)[C@@H](C)n1cncn1 1875264565 HPJJSHFGZGFWKC-CHWSQXEVSA-N 397.439 2.889 0 50 GFAA COc1ccc(NC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cc1C(=O)N(C)C 952983738 QWFQGSUAGYRQLR-AWEZNQCLSA-N 385.395 2.601 0 50 GFAA COc1ccc(-c2nc(NS(=O)(=O)c3cnc(C4CC4)s3)no2)cc1 888099613 SOWOQATXLMBQFD-UHFFFAOYSA-N 378.435 2.880 0 50 GFAA O=C(NCc1cccc(-c2ccccc2)c1)[C@@H]1CNC[C@@H](C(=O)N2CCCC2)C1 1565515288 KHFNJJWHOZMFSX-VXKWHMMOSA-N 391.515 2.818 0 50 GFAA CCN(CC)C(=O)CN1CCCN(C(=O)c2cc(C)oc2C(F)(F)F)CC1 274570748 HKIGWACZMIMMFO-UHFFFAOYSA-N 389.418 2.623 0 50 GFAA COC(=O)c1c[nH]c(S[C@@H](C)C(=O)N(C)CCOc2ccc(Cl)cc2)n1 170600445 OOOAEPDZHQRIEB-NSHDSACASA-N 397.884 2.868 0 50 GFAA CCS(=O)(=O)Nc1ccc(NC(=O)NC[Si](C)(C)c2ccccc2)cc1 170609734 RVWZZRCJYCXOON-UHFFFAOYSA-N 391.569 2.725 0 50 GFAA O=C(NC[C@H](O)c1ccccc1)NC1CCN(Cc2ccc(F)c(F)c2)CC1 193461078 VZXFEGQMNZDFRO-FQEVSTJZSA-N 389.446 2.962 0 50 GFAA CCCN(C(=O)c1ccccc1NC(=O)NCc1ccc(C(N)=O)nc1)C(C)C 771528630 URVBDIULBBLDAT-UHFFFAOYSA-N 397.479 2.763 0 50 GFAA O=C(NCc1cccc(F)c1)N1CCCN(C(=O)c2cnc(C3CC3)nc2)CC1 1775978782 CTXOSHLBCWUQNF-UHFFFAOYSA-N 397.454 2.551 0 50 GFAA CC(C)[C@@H](O)C1CCN(C(=O)c2cn(Cc3ccccc3Cl)nn2)CC1 11818209 GYBYYWBDYNVUNM-GOSISDBHSA-N 376.888 2.849 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@H](NC(=O)c2ccc(O)nn2)C1 11842704 XFJURLLPWVLZEJ-MRXNPFEDSA-N 381.411 2.951 0 50 GFAA CCOC(=O)[C@@]1(Cc2cccc(Cl)c2)CCCN(C(=O)CCNC(C)=O)C1 11999100 MPQAUJAIYMYEQS-HXUWFJFHSA-N 394.899 2.581 0 50 GFAA C[C@@]1(C2CCN(C(=O)C3CCC3)CC2)NC(=O)N(C2Cc3ccccc3C2)C1=O 12183869 VMFPVMZBMBNETQ-QHCPKHFHSA-N 395.503 2.503 0 50 GFAA C[C@H](NC(=O)c1ccco1)c1nnc2n1CCN(CCCc1ccccc1)CC2 12281082 MKXXLKLGXUNNIO-KRWDZBQOSA-N 393.491 2.853 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)N1CCC[C@@H](Nc2ccccc2)C1 12449258 IYJOWWOUZMKEMD-GOSISDBHSA-N 376.460 2.890 0 50 GFAA COc1ccc2cc(C(=O)[C@H]3CCCN(C(=O)CCn4cncn4)C3)ccc2c1 14981029 HAELNPJSSDYPGK-IBGZPJMESA-N 392.459 2.952 0 50 GFAA COc1ccc(O[C@H](C)C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19877552 KUMUSOMORAPHNR-MRXNPFEDSA-N 398.459 2.536 0 50 GFAA Clc1cccc(N2CCN(CCCN3CC[C@@H]4NCCC[C@@H]4C3)CC2)c1 1857679111 FZDPUFWPIKLXIR-NQIIRXRSSA-N 376.976 2.926 0 50 GFAA O=C(NC1(CO)CC=CC1)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857731539 UQXSDDPCLPCFMP-ZDUSSCGKSA-N 375.856 2.895 0 50 GFAA O=C(NCCN1CCCC1)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857732159 FFQDUYYWQFFXLD-CQSZACIVSA-N 376.888 2.910 0 50 GFAA CC(C)(C)n1cc(C(=O)N2CCO[C@@H](C(=O)O)C2)c(-c2ccccc2Cl)n1 236775663 YWNWQNFCASVDNP-OAHLLOKOSA-N 391.855 2.884 0 50 GFAA O=S1(=O)CCC(O)(CN2CCC(F)(Cc3ccc(Cl)cc3)CC2)CC1 451523873 AYDFQUJJBVTMTA-UHFFFAOYSA-N 389.920 2.626 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2)C1 136108168 IDNPLVYDEXPIEB-LLVKDONJSA-N 378.226 2.572 0 50 GFAA CCN(C)S(=O)(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704336773 OULFNPSIPFTKGF-FQEVSTJZSA-N 386.521 2.620 0 50 GFAA CCn1c(=O)c(Nc2ccc(OCCS(C)(=O)=O)cc2)nc2ccccc21 853760480 FEAOJAJLKNDONI-UHFFFAOYSA-N 387.461 2.583 0 50 GFAA Nc1c(S(=O)(=O)c2ccc(Br)cc2)nnn1-c1ccccc1F 4776773 GQHNVXSNUMQUCI-UHFFFAOYSA-N 397.229 2.584 0 50 GFAA Cc1oc(-c2ccccc2Cl)cc1C(=O)N1CCO[C@H](c2nnn(C)n2)C1 2100478106 RTYXOOVHAPZBSB-INIZCTEOSA-N 387.827 2.646 0 50 GFAA COc1ccc(Br)cc1S(=O)(=O)Nc1cccc(C(=O)O)c1 7053757 WEJHZRAAGHFVBB-UHFFFAOYSA-N 386.223 2.957 0 50 GFAA Cn1cnn(CCC(=O)NC2(Cc3ccc(Cl)cc3Cl)CCC2)c1=O 2325820364 QUWBPDIIJBJKEZ-UHFFFAOYSA-N 383.279 2.560 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)c2ccc(C)cc2)cc1 886717 POMBTJNLQJPHNW-UHFFFAOYSA-N 388.489 2.868 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 1127469 YRPIPAOXNHLXJG-LBPRGKRZSA-N 386.470 2.703 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)N[C@H](C)c1ccccc1)S(C)(=O)=O 2064943 GALLQRSMDKZAJX-CYBMUJFWSA-N 396.896 2.992 0 50 GFAA O=C(O)c1c(N2CCN(c3cnccn3)CC2)noc1-c1ccc(Cl)cc1 2356143436 HTBXPTSUORZLTN-UHFFFAOYSA-N 385.811 2.810 0 50 GFAA CCOc1ccc(CN2CCC[C@]23CCCN(CCOC)C3=O)cc1OC 2356150241 SNYDUVYPNJVXGD-NRFANRHFSA-N 376.497 2.697 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cccc4ncnn34)C2=O)cc1 2356153952 BPIWPUVGCFASRF-QFIPXVFZSA-N 389.459 2.840 0 50 GFAA Cc1cc(C)c(C)c(C(=O)COC(=O)CNS(=O)(=O)c2ccccc2)c1C 2983394 SCRKRDUZXVXJJA-UHFFFAOYSA-N 389.473 2.625 0 50 GFAA O=C(N[C@H]1COc2ccccc2C1)c1cc2c(s1)CCOC21CCNCC1 2356155398 FOUFOQNOJZAELK-OAHLLOKOSA-N 384.501 2.633 0 50 GFAA COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(Cl)c(Cl)c1 4918834 HYVZEEJMNZCBKS-CYBMUJFWSA-N 375.277 2.976 0 50 GFAA Cc1cccc(N2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c1C 6702589 ZIKPJAWMGDQDJH-UHFFFAOYSA-N 388.489 2.586 0 50 GFAA Cc1noc([C@@H](C)N2CCN(C(=O)NCc3nc4ccccc4s3)CC2)n1 111789859 BYPGNJRHVGCZSO-GFCCVEGCSA-N 386.481 2.576 0 50 GFAA COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN2CCC[C@@H](O)C2)cc1 227740805 AXQULSBJGPNGCV-KNQAVFIVSA-N 393.487 2.830 0 50 GFAA COc1cc(CN2CCN(CC=C(C)C)[C@@H](CCO)C2)cc(OC)c1OC 23358534 RVXBOXUSJNJHQC-SFHVURJKSA-N 378.513 2.547 0 50 GFAA CCOC(=O)C1(CCOC)CCN(C(=O)[C@@H](c2ccccc2C)N(C)C)CC1 55255590 JSTNZUQBKVOMBO-LJQANCHMSA-N 390.524 2.806 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)N2CCCOCC2)[C@H](c2ccccc2Cl)N1C 55090551 CBCRQAIPUOFEMN-KNBMTAEXSA-N 394.899 2.513 0 50 GFAA O=C(Nc1ccc(Cl)cc1I)N1CCC[C@@H]1CO 136468684 SJOSQDSFCYLMGW-SECBINFHSA-N 380.613 2.933 0 50 GFAA CCC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccc(F)cc3)CC2)cc1 22535093 MNTWOTUEQFPHDH-FQEVSTJZSA-N 386.467 2.980 0 50 GFAA Cc1ccc2nc(-c3cnc(N(C)C)nc3)cc(C(=O)N3CCOCC3)c2c1 23619265 MWUXGRFMIQQHNU-UHFFFAOYSA-N 377.448 2.539 0 50 GFAA CCOc1ncc(C(=O)N[C@H]2CCN(Cc3ccc(F)cc3)C2=O)cc1Cl 252492302 MHXPOPPLQVLEOA-INIZCTEOSA-N 391.830 2.804 0 50 GFAA COCCNC(=O)c1cnn2c(C(F)(F)F)cc(-c3ccc(OC)cc3)nc12 4855084 DEYHANSUPIEFBP-UHFFFAOYSA-N 394.353 2.800 0 50 GFAA Cc1ccc(NC(=S)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 7560870 NINFZWLOIVZQOK-UHFFFAOYSA-N 375.519 2.698 0 50 GFAA O=C(CSCc1ccc(Cl)cc1Cl)N1CCN2C(=O)N=C(O)[C@@H]2C1 329461400 SQVUSZJEJKTTPZ-LBPRGKRZSA-N 388.276 2.830 0 50 GFAA Cn1cc(C[C@H]2CCN(CC(=O)Nc3ccc(N4CCCCC4)cc3)C2)cn1 363306947 MWBNCBGAJIDQDM-GOSISDBHSA-N 381.524 2.914 0 50 GFAA O=C(N1CCCC1)N1CCC[C@@H](NS(=O)(=O)c2ccc(C3CC3)cc2)C1 333711544 PXNZMOSOWIRUAJ-QGZVFWFLSA-N 377.510 2.523 0 50 GFAA Cc1nc2scc(C3CC3)n2c1CN1CCC[C@]2(CCS(=O)(=O)C2)C1 333836688 MOPLIGLXERICIL-SFHVURJKSA-N 379.551 2.982 0 50 GFAA CN1C(=O)[C@](CC(=O)N2CCCOCC2)(Cc2ccccc2)c2ccccc21 71736103 CILPTSROXSOPOM-QHCPKHFHSA-N 378.472 2.783 0 50 GFAA CCOC(=O)C1=C(CN2CCn3cccc3[C@H]2C)NC(=O)N[C@H]1c1ccccc1 240886217 INVYJCIZTYQUDL-QRWLVFNGSA-N 394.475 2.736 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)CC[S@@]1=O 242178815 XBBHPADSAISGIQ-BZQUYTCOSA-N 381.567 2.610 0 50 GFAA Cc1nc(C[C@H]2CCCN(C(=O)Nc3ccc(F)c(C(=O)N(C)C)c3)C2)no1 176063049 KZPHKRFHXLNERW-CYBMUJFWSA-N 389.431 2.706 0 50 GFAA O=C(COc1ncnc2ccccc12)NCc1cccc(CN2CCCC2)c1 221397245 SKVVYSMIBCTOSM-UHFFFAOYSA-N 376.460 2.921 0 50 GFAA CC(C)c1c(C(=O)N2CC[C@H](CN)C2)cnn1-c1ccc(C(F)(F)F)cn1 178559818 VUPVKBGULFEIDL-GFCCVEGCSA-N 381.402 2.830 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)N(Cc1cocn1)Cc1cocn1 426627860 WBUWGGDQAKVKTD-UHFFFAOYSA-N 385.428 2.671 0 50 GFAA COCCN(Cc1sccc1C)C(=O)NCc1cn2nc(C)sc2n1 426628904 WYPTVEHECDPFHA-UHFFFAOYSA-N 379.511 2.827 0 50 GFAA CN(Cc1noc(-c2ccccc2)n1)C(=O)[C@H]1CC(=O)Nc2ccc(F)cc21 91289359 VTCGJMOJDUIRLR-HNNXBMFYSA-N 380.379 2.960 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)[C@H]2CCOC(C)(C)C2)CC1 95366298 XJNLJFWMWKHNCK-SFHVURJKSA-N 376.545 2.746 0 50 GFAA O=C(NCCc1cnc[nH]1)c1cccc(-c2ccc(C(=O)N3CCCC3)o2)c1 426537702 NOWXLPSRIPDRCH-UHFFFAOYSA-N 378.432 2.878 0 50 GFAA Cc1ccc2c(c1)c1c3n2CCN(C[C@@H](O)CNCCCN(C)C)[C@@H]3CCC1 231374326 MADDWMBZCFZGJC-PGRDOPGGSA-N 384.568 2.545 0 50 GFAA O=C(NCC1CC1)c1ccc(OC2CCN(C(=O)c3cccnc3)CC2)cc1 95522302 QOYSMIHHFYYZTJ-UHFFFAOYSA-N 379.460 2.905 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N[C@H]2CCc3ccccc32)c(Br)o1 238205132 DMPJAGZAQAKVNK-JTQLQIEISA-N 386.223 2.706 0 50 GFAA O=C(NCCc1cn2ccsc2n1)N1CCC[C@@H](OCc2cccnc2)C1 426613623 LAJVPCNCEXHPHB-QGZVFWFLSA-N 385.493 2.724 0 50 GFAA COc1cccc2c1OCCCN(C(=O)c1cnc(-c3cccnc3)nc1)C2 95359187 OVBOZXAIYSICQL-UHFFFAOYSA-N 376.416 2.972 0 50 GFAA CC[C@H]1CN(C(=O)NCC(F)(F)F)C[C@H]1c1cnc2cnc3[nH]ccc3n12 147178941 WYQFJHHDOKWSHR-WDEREUQCSA-N 380.374 2.908 0 50 GFAA CNc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)ccn1 92077421 QSZIAQBJGMRMLQ-OXJNMPFZSA-N 376.504 2.827 0 50 GFAA CN(CCC1(O)CCCC1)C(=O)[C@H]1CCC(=O)N(Cc2ccccc2F)C1 92028019 OYCQDBCZVRJSNB-KRWDZBQOSA-N 376.472 2.718 0 50 GFAA CS(=O)(=O)c1ccc(CN2C[C@@H](C(=O)O)[C@H](c3cccc(F)c3)C2)cc1 91547556 ABDKLPKDCIVXKB-ZWKOTPCHSA-N 377.437 2.529 0 50 GFAA Cc1ccc(-c2nnc(-c3ccc(C(=O)N4CCOC[C@@H]4C(=O)O)cc3)o2)cc1 299753878 ZPYDCBMBXQEVOP-QGZVFWFLSA-N 393.399 2.638 0 50 GFAA CC(C)Cc1nc(CN(C)C(=O)NCc2noc(-c3cccs3)n2)no1 534590188 XZPXQQWTEBBPAD-UHFFFAOYSA-N 376.442 2.721 0 50 GFAA CCC(CC)Cc1nc(-c2ccnc(-n3cncn3)c2)nn1CCCN(C)C 1875330752 BASHCELVQPUUTM-UHFFFAOYSA-N 382.516 2.851 0 50 GFAA N=[S@@]1(=O)CCC[C@@]2(CCCN2C(=O)NCc2ccc(N3CCCC3)nc2)C1 1875393094 GDPPYJINVSQJEV-UZTOHYMASA-N 391.541 2.567 0 50 GFAA CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NC[C@H]1COC(C)(C)CO1 1875345430 XPFUQADAJQUHLF-DLBZAZTESA-N 396.915 2.795 0 50 GFAA CCn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1cccc(-n2ccnc2)c1 1875401340 JKVGVWOLFJRZMQ-ROUUACIJSA-N 392.463 2.803 0 50 GFAA O=C(NCC1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1)c1ccnnc1 952986772 FOEQWWVPFIXZQH-UHFFFAOYSA-N 391.475 2.559 0 50 GFAA Cc1nn(C)c(Sc2ccccn2)c1NS(=O)(=O)C[C@H]1CCCCO1 888095849 COWLKPVRKLNTFP-CYBMUJFWSA-N 382.511 2.586 0 50 GFAA Cc1nc(Cn2cc(C(=O)N3CC4(CCCC4)c4cccc(F)c43)nn2)no1 278725732 HPCODKAAQIVPMI-UHFFFAOYSA-N 382.399 2.629 0 50 GFAA CC(=O)[C@@H]1CC(C(=O)NCc2ccc3c(c2)OCCCO3)=NN1c1ccccc1 170620603 OGIYGBNQHMNPMU-IBGZPJMESA-N 393.443 2.688 0 50 GFAA COc1ccnc(N2CCN([C@@H]3CCN(c4ccccc4Cl)C3=O)CC2)c1 111226401 IKWDYSIBFZGWAC-GOSISDBHSA-N 386.883 2.671 0 50 GFAA Cc1c(NC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)nnn1Cc1ccccc1F 192377189 CJUPCEIYYGZCRW-HNNXBMFYSA-N 397.385 2.978 0 50 GFAA COc1cccc2c1CCN(C(=O)N[C@H](C)c1nnnn1-c1ccccc1)CC2 194447466 VOMGKVPEULHUNN-OAHLLOKOSA-N 392.463 2.542 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N(C)[C@H](C)c2cc(-c3ccccc3)n[nH]2)cc1 1506421723 MBMRYARMQZGXHO-CQSZACIVSA-N 398.488 2.818 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N[C@@H]1CCCNC1 1704308964 UECQBAWXOTUNBE-CQSZACIVSA-N 378.860 2.535 0 50 GFAA CCc1cc(N[C@@H](c2ccccc2)c2nccn2C)nc(N2CCOCC2)n1 1704299285 HVPQLTFMIIOVHP-IBGZPJMESA-N 378.480 2.811 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N1CCCN(C(=O)[C@@H]2CC23CC3)CC1 1704306895 XJKAZSSIFXNDPT-KRWDZBQOSA-N 394.519 2.850 0 50 GFAA CCn1ccnc1CN1CCC[C@@H](CNC(=O)c2cc(OC)cc(OC)c2)C1 11664674 XMRAMPCYEDALGP-INIZCTEOSA-N 386.496 2.562 0 50 GFAA CCN1CCN(c2ccc(-c3nc(-c4cccc(OC)c4OC)no3)cn2)CC1 12076149 WBWGLQMOODLUAA-UHFFFAOYSA-N 395.463 2.958 0 50 GFAA COc1cc(C)ccc1OCc1nc(C(=O)NCc2n[nH]c3c2CCC3)co1 12317251 FCYMTDXJVXLJAS-UHFFFAOYSA-N 382.420 2.712 0 50 GFAA O=C1NCCN(C(=O)c2ccc3nc(C4CC4)oc3c2)[C@H]1Cc1ccccc1 12597208 IRZATKGWNQJZEP-SFHVURJKSA-N 375.428 2.889 0 50 GFAA CCN1C(=O)N(Cc2cccc3ccccc23)C(=O)C12CCN([C@@H](C)CO)CC2 14732365 IJLUWFBXYSUCER-KRWDZBQOSA-N 395.503 2.839 0 50 GFAA CSc1cccc(CN2CC[C@@H](N3CCN(c4ccccn4)CC3)[C@H](O)C2)c1 14948496 ACNZSTZGHWXROY-NHCUHLMSSA-N 398.576 2.561 0 50 GFAA CC(=O)Nc1cccc(NC(=O)[C@H]2CC(=O)N(c3n[nH]c4cccc(F)c34)C2)c1 169772909 GZQMKGUMQHAVOB-LBPRGKRZSA-N 395.394 2.652 0 50 GFAA Cc1cccc(CN2CCO[C@@H](CN3CCC(O)CC3)[C@@H]2c2ccccc2)n1 1857695183 YJUUJWYODMWPKQ-GOTSBHOMSA-N 381.520 2.789 0 50 GFAA O=C([C@H]1CC(=O)N(c2nccs2)C1)N1CCC(Oc2ccccc2F)CC1 1857695791 YESGLOUCRJZWRL-ZDUSSCGKSA-N 389.452 2.705 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3ccccc3OC)CC(=O)N2[C@H]1c1ccccc1 1857712098 RAJUXFRVLGFLFJ-IPJJNNNSSA-N 394.471 2.642 0 50 GFAA CCCCc1nc(CN2C[C@H](O)[C@]3(C2)[C@H](c2ccccc2)[C@H]3CO)c(Cl)[nH]1 1857715948 PESLBCNTFVIRFF-UKHYVGRKSA-N 389.927 2.975 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCc4nccs4)CC3=O)sc2c1 1857740241 JXELBRKFVYULKF-LBPRGKRZSA-N 386.502 2.773 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)NC[C@H](CO)CC1CCCC1 225622507 XBUZBVZKFHENKQ-VQIMIIECSA-N 378.488 2.885 0 50 GFAA Cc1nc2ccc(Br)cn2c1C(=O)N1CC[C@@H](c2nccn2C)C1 373573236 FESXNCUBEMXZQJ-GFCCVEGCSA-N 388.269 2.768 0 50 GFAA NC1CCC2(CC1)CC(C(=O)N[C@@H]1CNCC[C@@H]1c1ccc(F)c(F)c1)C2 2325768852 YACUGJRYAHFHFS-KSCCQPJMSA-N 377.479 2.824 0 50 GFAA Cc1cnn([C@@H]2CCCNC2)c1C(=O)N1CCC[C@H](c2cc(O)cc(F)c2)C1 2325779088 GGICEFZCHCAEGD-MAUKXSAKSA-N 386.471 2.981 0 50 GFAA O=C(CCc1cncc2ccccc12)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785879 RQNJLVSBISWUTB-VHKYSDTDSA-N 398.894 2.973 0 50 GFAA COc1cc(OC)c2c(c1)C(=O)N(Cc1cc(C(F)(F)F)co1)S2(=O)=O 871671065 JSMFCFFHFLGZBF-UHFFFAOYSA-N 391.323 2.660 0 50 GFAA CN1C(=O)C[C@H](c2nc(-c3nc[nH]n3)no2)[C@@H]1c1ccc(Cl)c(Cl)c1 350191236 NHKUEHYIOREKBM-UFBFGSQYSA-N 379.207 2.849 0 50 GFAA COc1ccc(N([C@H](C)C(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1 662121 LFLAWKQVSFSRQS-OAHLLOKOSA-N 376.478 2.508 0 50 GFAA O=C(c1cccc(-c2cnc3c(N4CC[C@@H](O)C4)nccn23)c1)N1CCCCC1 2356144669 IKWIJEFMHQGYQO-GOSISDBHSA-N 391.475 2.593 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356158390 ZYEOEGIUWUEVAD-HXUWFJFHSA-N 386.883 2.871 0 50 GFAA Cc1ccc(CN2CCN(Cc3nc4ccccc4n3C)C[C@H]2CCO)cc1 104533569 CKRCUWVJZAFVHC-HXUWFJFHSA-N 378.520 2.951 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1cccc(C(F)(F)F)c1)NC1CCCCC1 55099436 TUTHXHRVHXUVTB-QGZVFWFLSA-N 397.441 2.845 0 50 GFAA C[C@@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCC[C@@H](CN2CCCCCC2)C1 246988587 HQQBAJRRFDSIRT-OALUTQOASA-N 398.551 2.948 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)NCC(F)(F)F)[C@H](c2ccccc2Cl)N1C 55342284 JHDPIXFNWYSHPJ-RBOXIYTFSA-N 392.805 2.943 0 50 GFAA CCOc1ccc(CN2CCN(C3CCN(C(C)C)CC3)C[C@@H]2CCO)cc1 20351095 QTQJRLKUQTXECR-QFIPXVFZSA-N 389.584 2.827 0 50 GFAA COC(=O)[C@]1(C)C[C@H](C(=O)NCC(F)(F)F)[C@H](c2ccc(Cl)cc2)N1C 55245091 RJVDERXUBBRZTM-XEZPLFJOSA-N 392.805 2.943 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(N(C)C)nc(C)n3)CC2)c(C)c1 67621945 ICEZWKRPIZWNNC-UHFFFAOYSA-N 384.484 2.522 0 50 GFAA Cc1csc(SCC(=O)N2CCC3(CC2)Nc2ccccc2NC3=O)n1 1506421944 LUTVHHQACGABCD-UHFFFAOYSA-N 388.518 2.969 0 50 GFAA Cc1cc(CNC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)nc(N(C)C)n1 252490136 KJYYHJJSMNMXPI-UHFFFAOYSA-N 393.495 2.817 0 50 GFAA O=C(Cn1nc2c(cc1=O)CCCCC2)Nc1nc(-c2ccccn2)cs1 61720145 XSXTZALRMJFQQU-UHFFFAOYSA-N 381.461 2.669 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@]3(CCN(C(=O)c4cc(C)[nH]n4)C3)C2)c1 76915976 UQVNHJLHIONAGE-OAQYLSRUSA-N 386.471 2.994 0 50 GFAA COc1ccc(N2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CC2=O)cc1 77503499 NCCLPQRDQUCSQW-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA CC(=O)N[C@H](CC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccccc1 150753977 MVYAUTPCARLIJU-VQIMIIECSA-N 387.430 2.927 0 50 GFAA CCc1ccc(N2CCN(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)CC2)cc1 363300629 WXRQBFUOCIRPER-HXUWFJFHSA-N 383.496 2.979 0 50 GFAA CCO[C@H](C)c1nc(CN(C)C(=O)c2cc(N3CCOCC3)ccn2)cs1 131335865 YKVZRSSMJYLSLT-CQSZACIVSA-N 390.509 2.744 0 50 GFAA CC(C)(C)c1ccc(OCc2ncc(C(=O)NC[C@H]3CCCO3)c(O)n2)cc1 77426804 PAVWYQYDRAFNLK-MRXNPFEDSA-N 385.464 2.968 0 50 GFAA COC(=O)c1cccnc1N1CCC2(CC1)CC(=O)N(Cc1ccccc1)C2 72424311 NTESMWAUGBNINF-UHFFFAOYSA-N 379.460 2.887 0 50 GFAA CCOc1ccc(CN2CCN(c3nc(C)ncc3CC)C[C@H]2CCO)cc1 72478196 MCYSBXGCOJXLQZ-HXUWFJFHSA-N 384.524 2.819 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)[C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)C1 136108209 BREKILRDFPTFFU-XHDPSFHLSA-N 399.274 2.921 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N[C@H](C)c3cn(C)nc3C)c2n1 20602208 UGFYJTINKFRJJO-SNVBAGLBSA-N 394.401 2.986 0 50 GFAA CCn1nnc(-c2cccc(NC(=O)N3CCO[C@@H](c4ccccc4)C3)c2)n1 426719807 FVJJRWDABUFAMS-GOSISDBHSA-N 378.436 2.965 0 50 GFAA O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 225267884 BTKKATXWCSPENV-YTQUADARSA-N 376.522 2.533 0 50 GFAA CCn1ncnc1[C@H](C)NC(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl 97295324 QRJUJXBYIDWCJX-NSHDSACASA-N 378.864 2.972 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN(c2cc(C)ncn2)CC1 95505322 UJADCATYZOJYGS-UHFFFAOYSA-N 382.464 2.734 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@@H]1CCCN(c2ncc(Cl)cc2F)C1 91503937 FTEDHFNZJWGENX-GFCCVEGCSA-N 375.839 2.631 0 50 GFAA Cc1cc(N2CCC([C@H](O)c3nccn3C)CC2)nc(Nc2cccc(O)c2)n1 92107427 LNVPFGQVQMCODJ-IBGZPJMESA-N 394.479 2.918 0 50 GFAA CN(CC1(CO)CCC1)C(=O)[C@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 91691730 XSQYBNDFAXPAKE-KRWDZBQOSA-N 392.927 2.742 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)c2ccc(OC)c(F)c2)CC1 96137366 VDPSOGAHXYTOTN-UHFFFAOYSA-N 389.475 2.527 0 50 GFAA CCN1CCN(Cc2ccc(OC[C@@H](O)CN(C)Cc3ccccc3)cc2)CC1 95509167 JJRFDXPKJYWVSD-QHCPKHFHSA-N 397.563 2.696 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(c3ccncn3)CC2)C1 298507138 BBQMGAQTFCPILM-KRWDZBQOSA-N 395.507 2.901 0 50 GFAA CCOc1cc(S(=O)(=O)N[C@@H]2CCCN(C(=O)C(C)C)C2)ccc1Cl 823366083 CLHATOQVLCYFMA-CYBMUJFWSA-N 388.917 2.664 0 50 GFAA Cc1cc(C)n(CC(=O)NCC[C@H](c2ccc(F)cc2)c2ccco2)c(=O)n1 670453926 KMQKGPLMMLBARJ-GOSISDBHSA-N 383.423 2.931 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)c2nn3cccnc3c2Cl)C[C@H]1CC(C)(C)C 1875383039 DDLSUISCIIVGMA-CHWSQXEVSA-N 389.887 2.562 0 50 GFAA CN(C(=O)Cc1ccc(F)c(F)c1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)C1 1875316672 GCVNPRBRAJJNHK-BLONOQDTSA-N 388.458 2.859 0 50 GFAA CNC(=O)c1cccc(O[C@H]2CCN(C(=O)COc3ccccc3Cl)C2)c1 1875390478 OJUSCGMRLWFGNE-INIZCTEOSA-N 388.851 2.758 0 50 GFAA CC(=O)Cc1ccc(OC[C@H]2C[N@@]2Cc2cnn(C)c2)c(Br)c1 1875381690 DLHBVYGPIGPLAX-QVKFZJNVSA-N 378.270 2.577 0 50 GFAA O=C1N[C@@H](c2ccccc2)CCN1Cc1nc(-c2n[nH]c3c2CCCC3)no1 1875286194 NWSCEZBJGWJYQR-OAHLLOKOSA-N 378.436 2.995 0 50 GFAA CN(C)C(=O)Cn1ccc2ccc(NC(=O)c3nnc4ccccc4c3N)cc21 1875261454 JDAYOJPVEIAIOS-UHFFFAOYSA-N 388.431 2.507 0 50 GFAA Cc1nc2ccccn2c1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 1875300956 XNRBANPPOOZMHX-MRXNPFEDSA-N 381.411 2.818 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(CC(C)C)[C@H](CCO)C2)c(Cl)cc1F 952984062 NGOBQFBNYVCKPA-CQSZACIVSA-N 392.924 2.501 0 50 GFAA CCOCC(=O)N1CCC(C(=O)Nc2ccccc2CN2CCCCC2)CC1 952868511 AHLGTMWGIFMIHF-UHFFFAOYSA-N 387.524 2.886 0 50 GFAA CC(C)=CC(=O)N1CCOC2(CCN(c3ncnc4cccc(F)c34)CC2)C1 1775993075 XTUFALZXSQRUFW-UHFFFAOYSA-N 384.455 2.933 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2nccc(-c3cccs3)n2n1 1775988805 JLGAZQDZVSQLFI-HNNXBMFYSA-N 392.440 2.884 0 50 GFAA COc1cc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)ccc1OCc1ccccc1F 1529173166 NBFDVOJUADHOKR-FUHWJXTLSA-N 389.423 2.681 0 50 GFAA Cc1cnn(C[C@H]2CN(Cc3nnc(-c4ccc(Cl)cc4)n3C)CCO2)c1 186329598 HIERVBQYCIUGEK-QGZVFWFLSA-N 386.887 2.541 0 50 GFAA O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CC[C@@H](N2CCCC2)C1 171454872 GQUMEEPPDYFBRF-MRXNPFEDSA-N 385.489 2.778 0 50 GFAA Cc1ccc(-c2nnc(-c3ccc(C(=O)N4CCO[C@H](C(=O)O)C4)cc3)o2)cc1 408513437 FOLLHTUAYVJHHL-KRWDZBQOSA-N 393.399 2.638 0 50 GFAA O=C1CCc2cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)ccc2N1 192218380 JZWYWZLINOODNZ-HXUWFJFHSA-N 393.487 2.592 0 50 GFAA O=C1CO[C@H](C(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)[C@@H](c2ccccc2Cl)N1 1529102168 ZCPDJHJKXXWBIB-ODIOGJKDSA-N 388.895 2.933 0 50 GFAA CCn1c(C)ccc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCC(C)C)C2)c1=O 216976426 GDWJWOYLEGLQQS-MJGOQNOKSA-N 387.524 2.676 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)c1cccc(F)c1 11839432 LJXUWWZAORVGMK-SFHVURJKSA-N 397.450 2.805 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)Cn1ccnc1 11936682 FSKAZFJMDYPRMU-FQEVSTJZSA-N 384.524 2.695 0 50 GFAA CC(C)Cn1cc(C(=O)NC(C)C)c(=O)c(C(=O)N2CCc3ccccc3C2)c1 12154340 XIASDFBCZLNJLN-UHFFFAOYSA-N 395.503 2.841 0 50 GFAA COc1ccc(Cc2noc(CN(C)C[C@H](O)c3ccccc3)n2)cc1OC 13594736 VCYWGUOXJOFIOH-KRWDZBQOSA-N 383.448 2.843 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1ccc(OC)c(C)c1)CC2 14950540 IKLHWSUAMAFCJT-SFHVURJKSA-N 386.492 2.546 0 50 GFAA Cc1c(CN2CCC[C@@H](C(=O)Nc3ccc(-c4ccn[nH]4)cc3)C2)cnn1C 15074017 IUSYOHQYLXQLJB-QGZVFWFLSA-N 378.480 2.969 0 50 GFAA COc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 16606997 CQJKJYPFDVBYBU-UHFFFAOYSA-N 375.446 2.702 0 50 GFAA COc1ccc([C@@H](CNC(=O)COc2cc(C)cc(C)c2)N2CCOCC2)cc1 19897845 HUFWMUBTSALPBD-JOCHJYFZSA-N 398.503 2.881 0 50 GFAA CCc1nn2c(ncc3c(=O)n(-c4nnc(C)[nH]4)ccc32)c1-c1ccc(F)cc1 19962548 JYURGXBRROCFQI-UHFFFAOYSA-N 389.394 2.828 0 50 GFAA CN1c2cc(C(=O)Nc3ccc4c(c3)OCCO4)ccc2C(=O)N2CCC[C@H]21 169765942 OKHZYISOCSRJSD-IBGZPJMESA-N 379.416 2.722 0 50 GFAA Fc1cccc(OCc2nc([C@H]3CCn4ncnc4C3)n(CC(F)(F)F)n2)c1 1857670135 VOQNXFHXCAQEHJ-NSHDSACASA-N 396.348 2.880 0 50 GFAA COc1ccc(C(=O)N(C)C)cc1-n1ccnc1-c1cnn2c(C)cc(C)nc12 1857681398 CPWUCETZYLMEJJ-UHFFFAOYSA-N 390.447 2.909 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cn(-c3ccccc3)nn2)N1CC1=CCCCC1 1857693706 IUDBAVSNQGGSGA-PMACEKPBSA-N 391.475 2.583 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)Cc3cnc4c(C)cccn34)C[C@H]12 1857696806 DKSVTJVMNGAPGO-QQDKQVRDSA-N 381.476 2.645 0 50 GFAA O=C1OC[C@]2(Cc3ccccc3)CN(c3ccc(Cn4ccnc4)cn3)CCN12 1857698073 VPVNFXRVPMOMJX-QFIPXVFZSA-N 389.459 2.580 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)Cc3ccc(O)c(Cl)c3)C1)CC2 1857703022 FJESCGNEIAFORD-HXUWFJFHSA-N 387.867 2.899 0 50 GFAA O=C([C@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CC(c2ccncc2)C1 1857710268 OGZLTQZKYLWCLT-AWEZNQCLSA-N 378.457 2.670 0 50 GFAA O=C(Cc1ccsc1)NC[C@H]1[C@H]2CN(C3CCSCC3)C[C@]23CC[C@H]1O3 1857710841 SDIIMWRMQMGTBQ-JRBPQWBISA-N 392.590 2.782 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cc(C)on4)[C@H]4CC[C@]3(C2)O4)cc1 1857739612 XLJCGBGJIRYLDL-XHYAQGIWSA-N 381.476 2.701 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCc4cccc(CO)c4)CC3=O)sc2c1 1857741040 ZILGPNFMLSUSSS-MRXNPFEDSA-N 395.484 2.766 0 50 GFAA O=C(NC[C@@H]1CCCNC1)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1875247197 FHBWWJVLZCXPGQ-CYBMUJFWSA-N 376.888 2.813 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 209789014 MJMGITCWOKSMSD-QAPCUYQASA-N 393.443 2.601 0 50 GFAA CNC[C@H]1CCCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 237322590 SVQLGWAOYQQZBA-OAHLLOKOSA-N 398.956 2.885 0 50 GFAA CCCn1cc(CN2CCCN(S(=O)(=O)CC34CCC(CC3)C4)CC2)cn1 253428341 KHJARUYWJOGWEI-UHFFFAOYSA-N 394.585 2.711 0 50 GFAA C[C@@H](C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)Cc1cccc(F)c1F 912934641 ULNVGBQUIGXFBG-BLLLJJGKSA-N 395.427 2.908 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 784072 LAODADABVDUNSA-FQEVSTJZSA-N 395.484 2.704 0 50 GFAA COc1ccc2c(c1)CC[C@@H](C)N2S(=O)(=O)c1ccc2c(c1)NC(=O)CO2 4690108 HADARXXIPPPJED-GFCCVEGCSA-N 388.445 2.556 0 50 GFAA COc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2ccccc2)cc1 4144364 RUVFDGOFCYCCJZ-VKJFTORMSA-N 394.349 2.799 0 50 GFAA COc1ccc(C(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 1158112 OUKPRIVWXVJLFA-UHFFFAOYSA-N 396.443 2.957 0 50 GFAA C[C@@H](c1ccccc1)N1C(=O)c2ccc(C(=O)NC[C@@H]3CCCO3)cc2C1=O 4842585 ANZANGGBAZBILH-YOEHRIQHSA-N 378.428 2.953 0 50 GFAA Cc1cccc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c1 6626055 ZDUCSMLZCACWSU-UHFFFAOYSA-N 384.910 2.857 0 50 GFAA O=C(Cn1cc(NC(=O)c2ccsc2)cn1)NC[C@@H]1OCCc2ccccc21 11813400 CNIMJHJGYDQKJX-SFHVURJKSA-N 396.472 2.627 0 50 GFAA CC(C)=CCC[C@@H](C)CN1CCc2nnc(CCNC(=O)C3CCC3)n2CC1 14992396 FZEDGXWASLWUAP-GOSISDBHSA-N 387.572 2.978 0 50 GFAA CCCOc1ccc(N2C(=O)C[C@H](NCc3ccc4c(c3)OCO4)C2=O)cc1 18250297 ZNEZTAFSRUJVJQ-KRWDZBQOSA-N 382.416 2.626 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(C(=O)CCC(F)(F)F)CC2)CC1 19794419 OGSJBVQSODVJFL-UHFFFAOYSA-N 377.451 2.512 0 50 GFAA OCCCNc1ncnc2c1sc1nc(N3CCOCC3)c3c(c12)CCCC3 19808876 VKCUZKWKRJSYEC-UHFFFAOYSA-N 399.520 2.749 0 50 GFAA CCOC(=O)N1CCN(CCC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 20506589 ODNHDFANTPLWRW-UHFFFAOYSA-N 389.374 2.688 0 50 GFAA O=C(c1c[nH]c2ccccc12)N1CCC(Cn2cc(CN3CCCC3)nn2)CC1 23430540 FVKNFWXXLNNZQR-UHFFFAOYSA-N 392.507 2.908 0 50 GFAA CN(CCn1cccn1)Cc1ccc(-c2nc(-c3cccnc3)cc(=O)[nH]2)cc1 48139926 ZXKQYXUIRSHPRD-UHFFFAOYSA-N 386.459 2.827 0 50 GFAA C[C@H](C(=O)NCc1cc(-c2ccccc2)[nH]n1)N(c1ccccc1)S(C)(=O)=O 55341840 LHFYPHVXHBBLFP-OAHLLOKOSA-N 398.488 2.548 0 50 GFAA COc1nc2ccccc2nc1N1CCN(Cc2ccc3c(c2)OCO3)CC1 55392761 LCTJWLSARKRXIC-UHFFFAOYSA-N 378.432 2.689 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccccc2F)CN1Cc1cc(F)ccc1F 64031523 DWAUPCSIBRWCRR-KDOFPFPSSA-N 392.377 2.650 0 50 GFAA O=C1C[C@H](c2cc3ccccc3[nH]c2=O)c2sc(N3CCCC3)nc2CN1 67909699 NLVQLZCRHPPQQB-CYBMUJFWSA-N 380.473 2.737 0 50 GFAA CC(C)c1nnsc1C(=O)N1CCC(n2nccc2NC(=O)C2CC2)CC1 67921482 HHLRHEDSIJLJNC-UHFFFAOYSA-N 388.497 2.684 0 50 GFAA O=C(NCc1cccnc1-n1cnc2ccccc21)c1ccc2[nH]c(=O)[nH]c2c1 67956408 VDHOUYHGFMOFLP-UHFFFAOYSA-N 384.399 2.520 0 50 GFAA CCN(Cc1ccncc1)C(=O)[C@H]1C[C@@H](C(=O)O)N(C)[C@H]1c1ccccc1F 67966540 KCACRDCNRWPAEN-WDSOQIARSA-N 385.439 2.715 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-n2ccc(-c3ccco3)n2)c1 71776499 AGWBLEJSQXBAOJ-UHFFFAOYSA-N 375.406 2.517 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CN2CCCCC2=O)CCCN1Cc1ccc(F)cc1 72152920 AWXLUPJQXPFFMI-FQEVSTJZSA-N 389.515 2.897 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC[C@]2(CCC(=O)N(C3CC3)C2)C1 77390163 POVRHCIFZFYTHY-NRFANRHFSA-N 382.464 2.532 0 50 GFAA COc1cccc(N2C[C@H](C)N(C(=O)Cc3c[nH]c4ccccc34)CC2=O)c1 91713820 XNVNDOZORBISNK-HNNXBMFYSA-N 377.444 2.983 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(CCCc2ccccc2)C3)[nH]n1 91769200 NIVXNGAMNHPMEE-UHFFFAOYSA-N 380.492 2.806 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N1CCCC[C@@H]1CCn1cccn1 91769886 GPZPDJYOBXSWHK-MRXNPFEDSA-N 379.464 2.524 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@@H](C(=O)O)[C@H](c2ccccc2OC)C1 91943171 LTEWIGGVZZVFLG-UONOGXRCSA-N 377.872 2.945 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)NC1CCN(C2CCSCC2)CC1 95498848 VZEXPROEHPTIRE-UHFFFAOYSA-N 386.525 2.749 0 50 GFAA C[C@H]1Oc2cc(NC(=O)N(C)Cc3noc4c3CCCC4)ccc2N(C)C1=O 95523879 BMZULDOZHNIWNK-GFCCVEGCSA-N 384.436 2.961 0 50 GFAA CN(CC(=O)N1CCC[C@@H](c2nccn2Cc2cscn2)C1)C1CCCC1 95527534 ZPZRCGBRCMHGRB-MRXNPFEDSA-N 387.553 2.968 0 50 GFAA Cn1c(CN2CCCCCC2)nnc1C1CCN(C(=O)c2ccncc2)CC1 96149967 IORVQCSNDWOCRX-UHFFFAOYSA-N 382.512 2.606 0 50 GFAA CN1CCN2C[C@@H](NC(=O)Nc3cccnc3Oc3ccc(F)cc3)C[C@H]2C1 97528896 BTNNLNUCLSXIKU-HOTGVXAUSA-N 385.443 2.523 0 50 GFAA CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)O 100656456 BSRAGXJNZJMFMY-UAGQMJEPSA-N 378.469 2.943 0 50 GFAA CCOc1ccc(N([C@@H](C)C(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 101685516 UXVVONRGSKLJCN-YRBFXIGRSA-N 380.510 2.545 0 50 GFAA COC(=O)c1ccc(CN2CCN(Cc3ccccc3C)[C@H](CCO)C2)cc1 104465848 HGRKTTWNGMFETB-JOCHJYFZSA-N 382.504 2.850 0 50 GFAA Cc1cc(C(=O)N2c3ccccc3CC[C@H]2C(C)C)nc2nc(O)[nH]c(=O)c12 127788874 XLPGUBNQRRZMDU-HNNXBMFYSA-N 378.432 2.950 0 50 GFAA COc1cc(N2CC[C@H](c3ccc(F)cc3)[C@H](NC(=O)C(F)(F)F)C2)ncn1 129221108 MEHPVTAOIRMZBY-ZIAGYGMSSA-N 398.360 2.665 0 50 GFAA Cc1ccc(CNC(=O)c2cnn3ccc(C)nc23)c(OC[C@@H]2CCCO2)c1 151927830 RZEOTOVXTXABKB-KRWDZBQOSA-N 380.448 2.834 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](N2CCCC2)C1)c1cccs1 171450605 AUIVMRFYOLSMDF-MOPGFXCFSA-N 397.544 2.786 0 50 GFAA CN(Cc1cnn(-c2ccccc2)c1)C(=O)[C@@H]1CCCN1C(=O)c1ccccn1 173143423 DULQYKHQSACPGV-FQEVSTJZSA-N 389.459 2.531 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)NC[C@H]4CCCS4(=O)=O)CC3)oc12 189402831 UTRNRZWSOSWERX-OAHLLOKOSA-N 391.493 2.602 0 50 GFAA CCCn1ccc(CN2CCC(OC)(c3nc(-c4cnccn4)no3)CC2)c1 225839500 YDQGJFOGAWUJJV-UHFFFAOYSA-N 382.468 2.876 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@H]([C@H]2C(=O)N1c1cccc(I)c1)[C@@H]1C[C@@H]31 239347189 MHPWIUHQCRHJIL-WCBJTDJXSA-N 391.208 2.849 0 50 GFAA CN1C(=O)CCc2cc(Nc3ncnc4ccc(S(C)(=O)=O)cc34)ccc21 241942336 ULRILUMCFVXUJO-UHFFFAOYSA-N 382.445 2.686 0 50 GFAA O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NCCc1nc2c(s1)CCC2 252485517 GXMYKLIBFRGYNE-QGZVFWFLSA-N 385.533 2.582 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@H](NCc2cc(F)cc(F)c2)CNC3=O)cc1 263618619 UQQILDAZXRLXMD-IBGZPJMESA-N 384.386 2.869 0 50 GFAA CC1(C)C[C@H](NC(=O)Cn2c(O)nc(=O)c3ccccc32)c2ccccc2O1 268431290 FLKVSKMRORUJLC-HNNXBMFYSA-N 379.416 2.521 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCN(C(=O)c3ccco3)CC2)ncn1 275561074 FSXKPDLTMGLVNZ-OXJNMPFZSA-N 399.495 2.648 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1ccnc(NCc2ccc([S@@](C)=O)cc2)n1 328621674 AQIRTEWAHVOWSL-FJZVYHFZSA-N 388.537 3.442 0 50 GFAA COc1ccc([C@H]2OCC[C@@H]2NS(=O)(=O)c2cc(C)c(Cl)s2)cn1 328813668 NLQGSIZXEJWPKV-SMDDNHRTSA-N 388.898 2.922 0 50 GFAA O=C(NC[C@@H]1Cc2cc(F)cc(-c3ncccn3)c2O1)c1onc2c1CCCC2 426487833 CXAZJEFCGYQPOI-AWEZNQCLSA-N 394.406 2.883 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@@H]2CCCN(C(=O)c3ccco3)C2)c1C 670439900 PDPQCJFHQLXJCB-MRXNPFEDSA-N 383.448 2.646 0 50 GFAA O=C(NC[C@@H](c1ccccn1)N1CCOCC1)c1ccc(Cn2cccc2)cc1 670473066 MOKHJNKVIJZWRL-QFIPXVFZSA-N 390.487 2.735 0 50 GFAA CC[C@@H]1CN(C(=O)C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C[C@H]1O 774489943 HWDICYJTWIHTSD-AUUYWEPGSA-N 391.487 2.762 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)N1CCN(c2nc3ccccc3o2)CC1 823118463 MQWSMRXVRVFAEL-FQEVSTJZSA-N 390.487 2.923 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(OC[C@H]2CCCCO2)cc1 827861297 BDONLYAQNPVKIP-GOSISDBHSA-N 393.443 2.983 0 50 GFAA C[C@H](OC(=O)[C@@H]1CNC(=O)c2ccccc21)C(=O)N1CCSc2ccccc21 860417129 CXSITQJPUPEWMQ-XJKSGUPXSA-N 396.468 2.584 0 50 GFAA Nc1ncnc2c1ncn2C[C@@H]1CC[C@H](C(=O)N2CCCC3(CCCCC3)C2)O1 865724720 FBPQNXVNDMESCF-JKSUJKDBSA-N 398.511 2.529 0 50 GFAA c1coc(-c2ncc(CNC34C[C@@H]5C[C@H](C3)CC(n3ncnn3)(C5)C4)cn2)c1 952974935 JTNXQJLLKAYOKV-JNKARSBBSA-N 377.452 2.561 0 50 GFAA Cc1nccnc1N1CCC(CNC(=O)CCn2cnc3ccccc32)CC1 952988824 SNIONBCZAGPEAF-UHFFFAOYSA-N 378.480 2.558 0 50 GFAA Nc1ncc(C(=O)N2CCC[C@H](C(=O)c3ccccn3)C2)c(-c2ccccc2)n1 1506400197 JEQMDZCXKKJFNI-INIZCTEOSA-N 387.443 2.856 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)N1CC(N2CCCC[C@@H]2C)C1 1506419927 MFCDLNYPHAHGFS-LBPRGKRZSA-N 381.523 2.959 0 50 GFAA Cc1ccc(C)c([C@@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)c1 1506422210 OZEXOWZMOHNJTF-FQEVSTJZSA-N 381.476 2.853 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)Cc3csc(-c4ccccc4)n3)C[C@H]2O)on1 1529189557 RKWIVRVGPITTLC-CRAIPNDOSA-N 383.473 2.711 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1704338819 ZXUAWQHMNBSLKI-OPAMFIHVSA-N 386.455 2.716 0 50 GFAA CCOc1cc(S(=O)(=O)N[C@H]2COC[C@H]2Cc2ccncc2)ccc1Cl 1704340849 NRGUZDKITPPVGX-PBHICJAKSA-N 396.896 2.670 0 50 GFAA CN1CCC(CNc2ccc(C(=O)N3CCOCC3)cn2)(c2ccccc2)CC1 1704341353 ZOCDYPPETFESBF-UHFFFAOYSA-N 394.519 2.630 0 50 GFAA Cn1cc(-n2nc(C3CCOCC3)nc2-c2cccc(N3CCCC3=O)c2)cn1 1857676197 PRCPVNSVVZJIID-UHFFFAOYSA-N 392.463 2.689 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3ccc(OC)cc3)CC(=O)N2[C@H]1c1ccccc1 1875251211 YPDWLBLVXBLFKB-VCOUNFBDSA-N 394.471 2.642 0 50 GFAA CC(C)c1ccc(-c2nc(CC(=O)NCCN3CC[C@@H](CO)C3)cs2)cc1 1875307102 KOPJCHBDJUHMIA-MRXNPFEDSA-N 387.549 2.906 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CCc3nc(CCC(C)(C)C)ncc3C2)C1 1875371154 QXBZAUGTCJTYEX-MRXNPFEDSA-N 384.524 2.765 0 50 GFAA CNC(=O)c1ncoc1[C@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(F)c(C(F)F)c1)C2 1875394340 FZTOFMJVULFKLV-BIMULSAOSA-N 379.338 2.739 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1cnnc(-c2ccccc2)c1 1875401852 UNJMOHFCYBOKIA-SJLPKXTDSA-N 390.447 2.591 0 50 GFAA O=C(c1ccc(-c2nc(Cc3c[nH]c4ncccc34)no2)cc1)N1CCOCC1 2325776664 IWHGVRBLOCHNLE-UHFFFAOYSA-N 389.415 2.676 0 50 GFAA C[C@@H](CNC(=O)C[C@@H]1CN(CC2C3(CC3)C23CC3)C2(CCC2)CO1)c1cnc[nH]1 2325785288 OLLLIFDFSATKKZ-DLBZAZTESA-N 398.551 2.833 0 50 GFAA C[C@@H]1CN(C(=O)[C@@H](Cc2cc(F)cc(Br)c2)C(=O)O)C[C@@H]1F 2325869972 DSBRKSONGPADNT-WQHBLYJGSA-N 376.197 2.648 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N=c3[nH]nc(C(F)(F)F)s3)ccc21 2325889199 FBTHCSXIPYDMAT-UHFFFAOYSA-N 382.367 2.696 0 50 GFAA CCOc1cc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)ccc1Br 1051497 POMZXPCROGGSES-GHMZBOCLSA-N 378.288 2.646 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)COc2ccc3ccccc3c2)cc1 1157775 MGTZUNNJUMUQQD-UHFFFAOYSA-N 398.440 2.682 0 50 GFAA CCc1ccc(N2C[C@H](C(=O)N3CCN(c4ccccc4)CC3)CC2=O)cc1 7452267 WTRSGMARIIOLHK-LJQANCHMSA-N 377.488 2.951 0 50 GFAA Cc1cc(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)s3)CC2)c(C)o1 9155076 MULFYWMTCFVLAT-UHFFFAOYSA-N 388.898 2.758 0 50 GFAA CCNc1cc(C)nc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)n1 9620355 DZULYPFBVHXYSR-UHFFFAOYSA-N 389.887 2.841 0 50 GFAA Cc1c(CC(=O)NC(C)(C)CO)c2c(n1Cc1ccccc1F)CCCC2=O 11954905 HTQFPUCEWVLMNX-UHFFFAOYSA-N 386.467 2.933 0 50 GFAA COc1ccc(CC(=O)NC(=S)Nc2ccc(C(=O)N3CCCC3)cc2)cc1 12138749 FCSNWVAQOOBPKO-UHFFFAOYSA-N 397.500 2.987 0 50 GFAA O=C(c1ccc2c(c1)OCO2)[C@@H]1CCCN(Cc2ccc(OCCO)cc2)C1 12387404 QUXHVHVLTPLHKG-GOSISDBHSA-N 383.444 2.881 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2c[nH]nc2-c2ccccc2)C1)N1CCOCC1 12433429 ZMHFEWRDWBMADN-GOSISDBHSA-N 382.508 2.928 0 50 GFAA O=C(c1cc2ncccn2n1)N1CC[C@H]2[C@H](CCC(=O)N2CC2CCCCC2)C1 12453132 LRUBKXRNSISXDZ-MJGOQNOKSA-N 395.507 2.763 0 50 GFAA CN(C(=O)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1)C1CCCCC1 12835409 GSIVNAHWQJQXPA-GOSISDBHSA-N 375.557 2.891 0 50 GFAA COc1ccc(C(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c(C)c1 19144888 IRJJKHFMYWDPCZ-OAHLLOKOSA-N 391.493 2.627 0 50 GFAA Cc1n[nH]c(CCC(=O)N2CCC[C@H]2c2ccc(C(=O)NC3CCC3)s2)n1 19720771 NEDUQJBHUKQHGX-AWEZNQCLSA-N 387.509 2.753 0 50 GFAA COc1cc(Cl)c(CN2CCc3nnc([C@@H]4CCCO4)n3CC2)cc1OC 20601301 RXGMFMBWVMEYES-HNNXBMFYSA-N 392.887 2.859 0 50 GFAA COc1cc([C@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C)C(=S)N23)ccc1O 22204855 GVCLBNUGPADGCM-BEFAXECRSA-N 393.468 2.955 0 50 GFAA CCCCn1c(CN2CCC[C@H](OC)C2)cnc1S(=O)(=O)CC1CCC1 59311982 HLBBYXVQDLHJNY-SFHVURJKSA-N 383.558 2.868 0 50 GFAA Cc1nc2nnc3c(=O)n(-c4ccc(C(F)(F)F)c(Cl)c4)ccc3n2n1 67630684 XIOQOIWKICUPCN-UHFFFAOYSA-N 380.717 2.804 0 50 GFAA CC[C@@H]1CN(C(=O)c2c(C)cc(C)n(C)c2=O)CCC(=O)N1Cc1ccccc1 71661339 KKAWTTRECCSUNY-LJQANCHMSA-N 395.503 2.655 0 50 GFAA CN(Cc1ccc(Cl)cc1)c1ncc(S(C)(=O)=O)c([C@H]2CCCNC2)n1 71754767 MTZSXOYDHLWCSC-AWEZNQCLSA-N 394.928 2.637 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N[C@H]2CCCOC2)Cc2ccccc2C1 72138660 VTYJLNILFBVLFZ-QFIPXVFZSA-N 378.516 2.994 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)CCc1nc2cccnc2n1C 72429440 XWRUFBWGSDVJKS-UHFFFAOYSA-N 376.420 2.610 0 50 GFAA COCC1(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)CCC1 82099078 UQTSSBKLFNNRGO-OAQYLSRUSA-N 385.508 2.630 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CNC[C@H](C(=O)NCCc3cccc(C)c3)C2)cc1 91876783 WOHQEKSVELCBEU-UXHICEINSA-N 379.504 2.827 0 50 GFAA O=C(NCc1cnn(-c2ccc(F)cc2)c1)[C@H]1CCCN(C2CCOCC2)C1 95384365 WJPQCKZTGHGUPX-KRWDZBQOSA-N 386.471 2.519 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)N1CCC(O)(c3ccc(F)cc3)CC1)C2 95508578 SXCROQATPVAWGG-MRXNPFEDSA-N 385.435 2.896 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC1CCN(C(=O)c3cccnc3)CC1)C2 95516666 RQKRGOLQVUUMGU-MRXNPFEDSA-N 381.476 2.536 0 50 GFAA O=S(=O)(c1ccccc1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95519159 QYKNCWBJVZICPP-GOSISDBHSA-N 382.489 2.895 0 50 GFAA O=C(CC(F)(F)F)N1CCC(c2nnc(Cn3cccn3)n2C2CC2)CC1 96147963 RMQRUKOMNQXFBX-UHFFFAOYSA-N 382.390 2.516 0 50 GFAA CCc1ccc(-c2noc(C3=NN(c4ccc(F)cc4)[C@H](C(N)=O)C3)n2)cc1 113737084 XGQCDOQEWQVOJM-KRWDZBQOSA-N 379.395 2.906 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c2cnn(C)c2n1 131255627 KXMFLUSKVDCWHM-WMZOPIPTSA-N 377.492 2.917 0 50 GFAA CC(C)(C)c1ncc(NC(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)cn1 132670562 ZVWDLWBMRBSXEE-AWEZNQCLSA-N 389.406 2.979 0 50 GFAA COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1cnn(C2CCOCC2)c1 132972232 LSHXARMFAWPWQX-GOSISDBHSA-N 391.493 2.769 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)[C@@H]1CCCN1C1CCOCC1 134415216 BJQDXBQYWUPSBC-KUHUBIRLSA-N 395.906 2.817 0 50 GFAA Cc1c(NC(=O)[C@@H]2OCCc3ccccc32)cccc1C(=O)N1CCOCC1 137916046 IYTCETGBIZQHGR-HXUWFJFHSA-N 380.444 2.720 0 50 GFAA O=C(Cc1ccccc1)NCCC(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1 174846942 IUCSJHXEQGSJSE-SFTDATJTSA-N 380.488 2.850 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3cc(C4CC4)[nH]n3)C[C@@H]2NC(=O)C2CC2)cc1 219488628 OVMFMMMZQSKLHD-XLIONFOSSA-N 378.476 2.730 0 50 GFAA C[C@H]1CN(Cc2ccccn2)CCN1C(=O)c1cncc(Br)c1 225384362 OITNCMREJRQHEG-ZDUSSCGKSA-N 375.270 2.586 0 50 GFAA CCc1cccc(OC[C@@H](O)CN2C(=O)O[C@]3(CCc4ccccc43)C2=O)c1 225835665 LJJFQKVVYXDNOJ-JTSKRJEESA-N 381.428 2.809 0 50 GFAA O=C(O)[C@H]1CN(C(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)CCO1 238123274 RHCUKNSLFJQNEW-LLVKDONJSA-N 388.367 2.560 0 50 GFAA CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)N[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 248235214 DJZZFRQMSFYHDE-AUNWISOPSA-N 395.503 2.926 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)c1ccc(O)nc1)CC2 275529748 CSIZZOFBOCDJKL-QGZVFWFLSA-N 385.489 2.892 0 50 GFAA C[C@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1ncnn1C(C)(C)C 288255343 CGQXZJZNPOBZRU-ZDUSSCGKSA-N 386.504 2.569 0 50 GFAA COC(=O)c1cnc(NS(=O)(=O)c2cccc3cccnc23)c(Cl)c1 328594138 UPNOPALSVOBUIB-UHFFFAOYSA-N 377.809 2.871 0 50 GFAA Cc1cc(C(=O)N=c2cc(-c3ccccc3)[nH]n2[C@@H]2CCS(=O)(=O)C2)c(C)o1 334158515 SMOBYUIGXOTHEO-MRXNPFEDSA-N 399.472 2.794 0 50 GFAA Cn1ccc(N2CC[C@H](NC(=O)c3ccc(C(=O)Nc4ccccc4)cc3)C2)n1 367001315 PJRNMNQWHKMJRR-IBGZPJMESA-N 389.459 2.681 0 50 GFAA O=C(NCCn1ccnc1)c1ccc(-c2ccc(N3CCOCC3)cc2)cc1 534583455 YJEXGVPSJQEPED-UHFFFAOYSA-N 376.460 2.817 0 50 GFAA Cc1c(-c2nc(-c3ccc(C(F)(F)F)c(F)c3)no2)nnn1[C@@H]1CCNC1 854136601 HEMUNNFIWZUQDM-SNVBAGLBSA-N 382.321 2.996 0 50 GFAA Cc1ccc(S(=O)(=O)N=S2(=O)CCN(C(=O)CCCC3CC3)CC2)cc1 854486508 AQOYNJWOARSIRY-UHFFFAOYSA-N 398.550 2.574 0 50 GFAA CCc1nnc(N2CCC[C@H](CNC(=O)c3cc(=O)c4ccccc4o3)C2)s1 952873393 WIOJQFPNOKGBQH-CYBMUJFWSA-N 398.488 2.853 0 50 GFAA Cc1noc(-c2ccnc(N3CCC[C@H](CNC(=O)c4oc(C)nc4C)C3)c2)n1 952988793 KSFZLYXEUFCYEY-OAHLLOKOSA-N 396.451 2.691 0 50 GFAA CCOc1cc(CN2C[C@@H]3CCCN3C(=O)[C@@H]2C)ccc1OCCn1ccnc1 1772811655 WSHLNMRENWLSIX-HKUYNNGSSA-N 398.507 2.556 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CCC2)[C@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1 1775997217 CECACEIZBGCFTK-JBPLPALLSA-N 396.531 2.565 0 50 GFAA O=C(O)c1cc2c(s1)C1(CCN(C(=O)CCCn3cccn3)CC1)OCC2 1857687201 QWPPEYSXAUUGLW-UHFFFAOYSA-N 389.477 2.514 0 50 GFAA O=C(CC1=CCCC1)N1CCC[C@@]2(CN(Cc3cncs3)CC[C@H]2O)C1 1857691449 LLJMEMBNPOMMHE-UYAOXDASSA-N 375.538 2.819 0 50 GFAA O=C(Cc1ccccc1O)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857715613 ZTIKHPBQGWGTLA-WSTZPKSXSA-N 386.879 2.919 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N[C@@H](Cn1cccn1)c1ccccc1 1857719531 NXYNGLLYYYLGFG-KRWDZBQOSA-N 397.504 2.656 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(C)nc4C)[C@H]4CC[C@]3(C2)O4)ccn1 1857738524 LSVGCQSUTLKOFH-ZZLPTCMGSA-N 392.503 2.816 0 50 GFAA Cc1ccc(N2C[C@@H]3[C@H](CNC(=O)CSC(C)C)[C@H]4CC[C@]3(C2)O4)nc1 1875247875 RUGGJLJMFYTQGU-TVKQPGBESA-N 375.538 2.632 0 50 GFAA O=C(NCC1(c2ccccc2Cl)CCOCC1)[C@@H]1CNCC[C@@]12CCOC2 1875277093 GFCOMBKLQIEYBK-UWJYYQICSA-N 392.927 2.521 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1cc(Oc2ccccc2)ccn1 1875402665 JOUXRDWHUYPTJZ-QKYXUNIQSA-N 378.432 2.640 0 50 GFAA O=C(Nc1ccccc1)[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)NCC3)C1 2325843186 YFFDARZZBHODHT-MRXNPFEDSA-N 385.489 2.694 0 50 GFAA Cc1ccc(N=c2ccc(C(=O)N3CCNCC3)n[nH]2)cc1-c1ccsc1 2325859740 JCTAHFZDVFORES-UHFFFAOYSA-N 379.489 2.724 0 50 GFAA Cc1nnc(NC(=O)c2ccc(-n3ncc(Cl)c(Cl)c3=O)cc2)s1 938154 YJFMNNFQMPVNOD-UHFFFAOYSA-N 382.232 2.952 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N[C@@H]1COc2ccccc2C1 2356163154 QPHHBQLLJMZZML-SFHVURJKSA-N 390.439 2.698 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)CCCn3cccn3)CC1)OCC2 2356166745 LWUFFRILRRPPRB-UHFFFAOYSA-N 399.491 2.771 0 50 GFAA Cc1ccc(-c2cnn(CC(=O)Nc3ccnn3Cc3cccs3)c2)nn1 55245445 BCFLFAVVVNTSJZ-UHFFFAOYSA-N 379.449 2.594 0 50 GFAA CCC[C@H](NC)C(=O)N1CCOc2c(O)cc(-c3nc(C)cnc3C)cc2C1 67955118 MOLGTRWIYQODPH-KRWDZBQOSA-N 384.480 2.575 0 50 GFAA COCC(=O)N1CCC[C@@H]1c1ccc(C(=O)Nc2ccc3[nH]nnc3c2)s1 23399394 FJRHNEBKCKMCMV-CQSZACIVSA-N 385.449 2.582 0 50 GFAA CC(C)Cc1ncc(NC(=O)C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)cn1 472597705 KCIUYMACXHTUFY-INIZCTEOSA-N 399.470 2.538 0 50 GFAA Cc1nc([C@@H](C)N(C)C(=O)c2cc(CN3CCC(O)CC3)on2)c(C)s1 67742148 UQQWAAIZKYFGKK-LLVKDONJSA-N 378.498 2.538 0 50 GFAA CC[C@@H](Nc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)CN(C)CCN2C 67726700 GCLUXEZYPBIEFD-GOSISDBHSA-N 378.948 2.769 0 50 GFAA Cc1cnn([C@H]2CCCN(C(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)C2)c1 151707143 MLIRURIHOSNFGV-HNNXBMFYSA-N 397.447 2.594 0 50 GFAA C[C@]1(c2ccc(F)cc2)CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1 483011635 YZPTZOJRRYBACI-QFIPXVFZSA-N 382.483 2.533 0 50 GFAA COc1cc(CN2CCN(Cc3cccs3)[C@H](CCO)C2)cc2c1OCO2 39537058 JAXLFGOURWCIAV-MRXNPFEDSA-N 390.505 2.554 0 50 GFAA Cc1cccc(OC[C@H](O)CN2CCc3c(cccc3N3CCOC3=O)C2)c1 174057422 XMHZSCWUHLNECR-GOSISDBHSA-N 382.460 2.750 0 50 GFAA O=C(NCCc1cnc(C2CC2)nc1)[C@H]1CCCCN1C(=O)c1cccs1 378270493 ROJBLVJPLVIVCH-MRXNPFEDSA-N 384.505 2.769 0 50 GFAA Cc1ccc(-c2cccc(C(=O)N3CCOC[C@@](O)(CN4CCCC4)C3)c2)o1 77406761 GDSLFHYHMODTLQ-JOCHJYFZSA-N 384.476 2.554 0 50 GFAA O=C(N[C@H]1CCOC2(CCCCC2)C1)N1CCCC[C@H]1CN1CCOCC1 157846412 NJKDMCGYPBOGEB-OALUTQOASA-N 379.545 2.765 0 50 GFAA C[C@H](C(=O)Nc1ccccc1F)S(=O)(=O)Cc1cnn(C)c1C(F)(F)F 130358113 XQOVAIKOQIFCFB-SECBINFHSA-N 393.362 2.520 0 50 GFAA CCc1c(C(=O)N2CCC(n3cc(C(=O)O)cn3)CC2)cnn1-c1ccccc1 455924752 YEOXCUQDFUJPKL-UHFFFAOYSA-N 393.447 2.807 0 50 GFAA Cc1ccc(-c2nc(C)c(C(=O)N3CCN(C[C@H]4CCOC4)CC3)s2)o1 178090279 SUXZXUQWAVHMNL-OAHLLOKOSA-N 375.494 2.814 0 50 GFAA COc1ccccc1C1=NO[C@H](C(=O)Nc2ncn(Cc3ccc(F)cc3)n2)C1 20602005 YRIMVBLBPYQRQZ-SFHVURJKSA-N 395.394 2.606 0 50 GFAA Cc1cccn2cc(COc3ccccc3C(=O)N3CC[C@H](C(=O)O)C3)nc12 178274957 BCFYYNBFVUEQBM-HNNXBMFYSA-N 379.416 2.768 0 50 GFAA Cc1noc2nc(C3CC3)cc(C(=O)N[C@H]3CCCN(c4cnccn4)C3)c12 426525883 JKVTXNMSCYJGIJ-AWEZNQCLSA-N 378.436 2.597 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)c(C)c1 95510079 UMWJBSBVNLZYRF-UHFFFAOYSA-N 392.503 2.953 0 50 GFAA COc1cccc(-c2cc(C(=O)N3CCN(c4cccc(O)c4)CC3)[nH]n2)c1 92002398 RMKPZVXBEVLFDB-UHFFFAOYSA-N 378.432 2.753 0 50 GFAA CN1CCN(C(=O)Nc2ccccc2OCCCc2ccccc2)C[C@H]1CO 95503358 VUGIPBBVDWQGFA-IBGZPJMESA-N 383.492 2.838 0 50 GFAA O=C(NCCn1cccn1)c1cccc(-c2cc(C(=O)N3CCCC3)ccn2)c1 426589958 JUXLUTVSEGJXIJ-UHFFFAOYSA-N 389.459 2.611 0 50 GFAA C[C@@H](N)C(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 95507865 NMWWJTUCKJKHJZ-CYBMUJFWSA-N 385.430 2.688 0 50 GFAA Cc1c(CC(=O)N2CC[C@@H](N)C2)c2c(n1Cc1ccccc1F)CCCC2=O 95526415 WCIALKSWIQFSDS-MRXNPFEDSA-N 383.467 2.605 0 50 GFAA Cc1nnc(CN2CCC3(CC2)CC(=O)N(Cc2ccc(F)c(F)c2)C3)o1 91987705 UCTVSTONJHNWEI-UHFFFAOYSA-N 376.407 2.671 0 50 GFAA Cc1noc(C2CCN(C(=O)NCc3cn(-c4ccccc4)nc3C)CC2)n1 182978148 OSPZQOULADKUJI-UHFFFAOYSA-N 380.452 2.961 0 50 GFAA COc1ccc([C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)[C@H]2C[C@@H](O)C2)cn1 244778607 PTPMINJCBNGBIS-YRNRMSPPSA-N 378.432 2.722 0 50 GFAA Cc1[nH]ncc1CNC(=O)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263618010 QWBQTXZWXMHILK-UHFFFAOYSA-N 390.443 2.569 0 50 GFAA O=C(/C=C/c1nc2ccccc2s1)NC[C@@H](c1cccnc1)N1CCOCC1 828019334 QEAYVHLZUCZAGV-DVBCCOPCSA-N 394.500 2.894 0 50 GFAA CCc1oc(C(=O)Nc2cccc(-n3nnnc3C)c2)cc1CN1CCCC1 823570730 KCFSXPJGLNOLEN-UHFFFAOYSA-N 380.452 2.974 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)c2ccco2)C1)c1cc(O)nc2cc(F)ccc12 670449160 BWHCGPIAUQCUOW-CYBMUJFWSA-N 383.379 2.707 0 50 GFAA O=C(CC1CCN(Cc2ccccc2)CC1)NCCCN1CCCC[C@@H]1CO 670457199 ASUXIUYDECJQAZ-JOCHJYFZSA-N 387.568 2.642 0 50 GFAA N[C@@H](CCNC(=O)NC[C@H](c1cccc(O)c1)N1CCCC1)Cc1ccccc1 1875354575 JMBIBNZUPQDQOG-RBBKRZOGSA-N 396.535 2.788 0 50 GFAA CN(C(=O)Cc1ccc(F)c(F)c1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)C1 1875316775 GCVNPRBRAJJNHK-PDCGBLAGSA-N 388.458 2.859 0 50 GFAA COC(=O)N1CCN(C(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)C[C@@H]1C 1875296491 ZJMTWCHXFABTHU-JTQLQIEISA-N 397.353 2.872 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N(C)CCCOc2ccccc2Cl)C1 952973025 RADLAJLEYBJFQQ-OAHLLOKOSA-N 390.933 2.644 0 50 GFAA CC(C)Cn1ncc2cc(C(=O)N3C[C@@H](C)C(=O)Nc4ccncc43)cnc21 1775962051 PRCRBLAQLMRVMR-CYBMUJFWSA-N 378.436 2.717 0 50 GFAA O=C(c1ccc(O)c(Cl)c1)N1C[C@@H]2CN(C3CCCCC3)C[C@]2(C(=O)O)C1 1565516980 LLDSKEZCEQXPAA-XOBRGWDASA-N 392.883 2.837 0 50 GFAA COc1ccc(CN2CC[C@H](N(C)CCc3ccccn3)[C@@H](O)C2)c(C)c1C 1565510194 YJCRQXKIKLWMBP-VXKWHMMOSA-N 383.536 2.817 0 50 GFAA Cc1cc(C)c(CS(=O)(=O)CC(=O)Nc2ccc3c(c2)OCO3)c(C)c1 170620688 FLUOEHMCAJTGFD-UHFFFAOYSA-N 375.446 2.894 0 50 GFAA O=C([C@H](Cc1ccccc1)NCc1cnc(-c2ccco2)s1)N1CCOCC1 193212494 HGJBSQXNQCMFQP-SFHVURJKSA-N 397.500 2.963 0 50 GFAA O=C(O)c1cnn2cc(CN3CCC(c4nc5ccc(F)cc5[nH]4)CC3)cnc12 1506423901 GVWDWWVQAMWZBD-UHFFFAOYSA-N 394.410 2.823 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)NCc1noc(-c2c(F)cccc2F)n1 1506415665 ASIKJWRYCGMZEQ-UHFFFAOYSA-N 387.390 2.866 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2cccc(C)c2C)cc1OC 1529133187 GAOJDYMNEZHEIE-NHCUHLMSSA-N 385.460 2.895 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)CCc3csc(N)n3)CC1)OCC2 1704302290 HNTAJWIIZDPPRW-UHFFFAOYSA-N 387.505 2.757 0 50 GFAA Cc1noc(C)c1CC(=O)N1CCC(CCC(=O)NCc2cccnc2)CC1 11937793 QILPOCVEDXBPHJ-UHFFFAOYSA-N 384.480 2.564 0 50 GFAA O=C(NCCn1ccnc1)[C@@H]1CC12CCN(Cc1cc3ccccc3[nH]1)CC2 12148834 OSRNWDDFTQGDQJ-IBGZPJMESA-N 377.492 2.783 0 50 GFAA O=C(Cc1cccc(F)c1F)N1CCC(=O)N(Cc2cccc(F)c2)CC1 12327004 BVMGYBRYWRHCLP-UHFFFAOYSA-N 376.378 2.908 0 50 GFAA COc1ccccc1CC(=O)NC1CCN(c2cc(C(F)(F)F)ncn2)CC1 169772331 VTGVIVABRDLLKO-UHFFFAOYSA-N 394.397 2.832 0 50 GFAA COc1cc(C)c(CN2CC[C@H]3[C@@H]2CC(=O)N3CCCn2cccn2)cc1C 1857685016 NYPNDOKKTMSOHE-PMACEKPBSA-N 382.508 2.774 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cnc3ccccc3n2)N1CC1=CCCCC1 1857689534 RVHMFIAUNYYHCL-PMACEKPBSA-N 376.460 2.946 0 50 GFAA COc1cc(CN)ccc1Oc1ccc(C(=O)N2CCC[C@H](CN)C2)cc1OC 1857694615 GEKYORNQMIQLRD-MRXNPFEDSA-N 399.491 2.766 0 50 GFAA Fc1cccc(-c2nnc(CN3[C@H]4CC[C@@H]3[C@@H]3CN(C[C@@H]5CCOC5)C[C@@H]34)o2)c1 1857702040 XKXWWOWAZYMDKY-LXPIXPORSA-N 398.482 2.807 0 50 GFAA O=C(c1cncc(Cl)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857717542 XWOQTEIYTFAEAH-HLIPFELVSA-N 383.835 2.650 0 50 GFAA CCn1ccc2cc(CN3CCC(OC)(C(=O)N4CCC[C@@H]4CO)CC3)ccc21 1857721382 MDWKPEWSTCWQDU-HXUWFJFHSA-N 399.535 2.626 0 50 GFAA CCN(C)c1nc(C)nc2c1CC[C@@]21CCCN(C(=O)c2cc(OC)ccn2)C1 1875243961 GBKIRNFNPDKXMF-JOCHJYFZSA-N 395.507 2.765 0 50 GFAA CC(C)Oc1ccc([C@@H](C)NS(=O)(=O)c2ccc3c(c2)C(=O)NCC3)cc1 116330086 FQTBHSUAWFNIEE-CQSZACIVSA-N 388.489 2.799 0 50 GFAA C[C@@H](NC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 248379421 MUQIIKSIIFLPGA-CQSZACIVSA-N 379.932 2.971 0 50 GFAA CCCc1cc(N2CCN(CCO)CC2)n2nc(C)c(-c3ccccc3)c2n1 20518919 RBXYMFUUPKINDL-UHFFFAOYSA-N 379.508 2.772 0 50 GFAA CC(C)C(=O)NC[C@H]1CCCN(C(=O)[C@H]2CCCN2Cc2ccc(F)cc2)C1 266969682 LGIJGCNFWOUNKW-UYAOXDASSA-N 389.515 2.801 0 50 GFAA CC(=O)N1CCc2c(C(F)(F)F)nc3sc4c(O)cc(=O)[nH]c4c3c2C1 8555125 FQNJFRFDZVBOBT-UHFFFAOYSA-N 383.351 2.767 0 50 GFAA O=C(COc1ccc(F)cc1)N1CCc2nc(CCc3ccccc3)nn2CC1 2100556765 HAXMBORBEBJWQS-UHFFFAOYSA-N 394.450 2.666 0 50 GFAA Cn1ccnc1[C@H]1CNCCN1CCNC(=O)c1cccc2cc(Cl)ccc12 2325786493 QCXQMSBBSNDGDL-LJQANCHMSA-N 397.910 2.603 0 50 GFAA Cc1cnc(OC2CCN(c3cc(C)nc(-n4nc(C)cc4C)n3)CC2)nc1 2325792967 YTVJJDIYIGFLNP-UHFFFAOYSA-N 379.468 2.734 0 50 GFAA COc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2nccc(C)n2)cc1 2813802 QMFHXZLPSHSGLY-UHFFFAOYSA-N 398.444 2.847 0 50 GFAA O=C(COc1ccc(Br)cc1)N[C@H](Cc1ccccc1)C(=O)O 3109919 YTQLPFOFYAZLCD-OAHLLOKOSA-N 378.222 2.640 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3nccs3)n2C)cc1OC 4735935 QNRQVLZIEDBNFS-UHFFFAOYSA-N 391.478 2.687 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccccc2SC)cc1 4778221 PDUGEPQDLIAYLT-LBPRGKRZSA-N 380.491 2.723 0 50 GFAA C[C@@H]1Cc2cc(S(=O)(=O)NCCc3ccccc3)ccc2N1C(=O)C1CC1 6866590 SPWLTHVZGPRTNG-OAHLLOKOSA-N 384.501 2.895 0 50 GFAA COCCn1c(CN(C)CC(C)C)cnc1S(=O)(=O)CC1CCCCC1 11664466 ZYXQDUGFFCUIIL-UHFFFAOYSA-N 385.574 2.971 0 50 GFAA COc1ccccc1OCC(=O)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 11934240 RLAPADOTDQHEMU-QGZVFWFLSA-N 398.459 2.948 0 50 GFAA O[C@@H](COc1cccc(CNCCOc2cccnc2)c1)CN1CCCCCC1 12318425 XTBCYYZGHYEEHG-OAQYLSRUSA-N 399.535 2.866 0 50 GFAA Cc1ncoc1C(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12440016 VBLADCQZYRDRJM-FQEVSTJZSA-N 389.402 2.916 0 50 GFAA OC1CCN([C@@H]2CCN(Cc3cccc(Oc4ccccc4)c3)C[C@H]2O)CC1 12709956 IOGFKIOUSVDRQR-DHIUTWEWSA-N 382.504 2.871 0 50 GFAA Cc1cc(C(=O)N2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)c(C)o1 13331572 UQBZRZWNUBKEKU-UHFFFAOYSA-N 376.478 2.660 0 50 GFAA CCOC(=O)c1nn(CC(C)C)c2c1CN(C(=O)[C@H]1CCOC(C)(C)C1)CC2 14536332 HFEGDXHBNAHYNC-HNNXBMFYSA-N 391.512 2.806 0 50 GFAA Cc1nc(CN(C)[C@H]2CCc3c(c(C(=O)N(C)C)nn3CC(C)C)C2)cs1 14537102 KASNMLAKYBUXCC-INIZCTEOSA-N 389.569 2.995 0 50 GFAA CCNC(=O)c1nn(CC2CC2)c2c1CN(Cc1cccc3nccnc13)CC2 14748301 QGUJGFFZFCJECT-UHFFFAOYSA-N 390.491 2.544 0 50 GFAA Cc1ccc(OCC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 19214259 BTOQZGNVENJUGY-UHFFFAOYSA-N 382.460 2.755 0 50 GFAA CCSc1nnc(-c2ccccc2NC(=O)Cn2ccnc2CC)c(O)n1 55131588 UNVGCQDRZSFIKF-UHFFFAOYSA-N 384.465 2.754 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cccc([C@H](C)OC)c2)c1 71639312 NLGBOVINZLDKMQ-ZDUSSCGKSA-N 393.461 2.684 0 50 GFAA CC(=O)N1CCc2c(nc(C)nc2N[C@@H](C)CN2CCc3ccccc3C2)C1 71750420 HHWIWYXVKYTKHM-HNNXBMFYSA-N 379.508 2.548 0 50 GFAA O=C(O)[C@@H]1CC2(CCNCC2)CN1C(=O)C1(c2ccc(Cl)cc2)CCC1 72123831 WLSVOOBDQWHKSZ-INIZCTEOSA-N 376.884 2.817 0 50 GFAA O=C(c1ccccc1[C@H]1CCNC1)N1CCc2nnc(-c3ccccc3)n2CC1 72161327 WLCRTODGLCPVPN-SFHVURJKSA-N 387.487 2.721 0 50 GFAA CC(C)c1ncc(CN2CCC3(CCC(=O)N(CCCN(C)C)C3)CC2)cn1 91690229 ODXGWFKCGWHWHN-UHFFFAOYSA-N 387.572 2.756 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@@H](Cc2cccc(CO)c2)C1 91876837 BSZNZDFSKPAXDJ-KRWDZBQOSA-N 379.460 2.663 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C(=O)Nc1ccccc1C)CC2 95352695 YUBSNEUTXWVEMW-UHFFFAOYSA-N 394.479 2.653 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCC(C(=O)N2CCCC2)CC1 95382740 WVNNJFOIQYVURB-KRWDZBQOSA-N 380.872 2.809 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 95521072 UFOORGCGWPISSI-MRXNPFEDSA-N 387.447 2.618 0 50 GFAA CCn1nccc1C(=O)N1CCCN(C(=O)c2ccnn2CC)c2ccccc21 121201442 YOLSTMPFQLGOPK-UHFFFAOYSA-N 392.463 2.817 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)N[C@H](CN3CCCC3=O)c3ccccc3)C2)n1 130862910 BJPHINPXLXFOAI-QZTJIDSGSA-N 397.479 2.631 0 50 GFAA CCCCCCn1c(-c2ccc(OC)cc2)cn2c3c(=O)[nH]c(=O)n(C)c3nc12 170624328 YPKUQQAWWLIZOB-UHFFFAOYSA-N 395.463 2.932 0 50 GFAA COc1ccc2c(c1)N(C(=O)CCc1c(C)nc(SC)[nH]c1=O)C[C@H](C)O2 170640674 YTUHQGIYDMWMRW-NSHDSACASA-N 389.477 2.556 0 50 GFAA COC[C@@H](NC(=O)N1CCC(NC(=O)c2ccccc2C)CC1)c1ccco1 175753835 LNFHMPPFPJOTGN-GOSISDBHSA-N 385.464 2.880 0 50 GFAA C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cnc3c(cnn3C)c2O)cc1 181814655 PIUQWPHYNFOTKN-ZDUSSCGKSA-N 393.447 2.941 0 50 GFAA Cc1ccc(CN2CC[C@@H](NC(=O)COc3ccc4c(c3)CCC4)C2=O)cc1 191627149 IYAXXWYLLZXZQL-OAQYLSRUSA-N 378.472 2.780 0 50 GFAA CN(CC(=O)N1CCc2cc(C(C)(C)C)ccc21)S(=O)(=O)c1cccnc1 194780505 KGIVAJJYJIKHOY-UHFFFAOYSA-N 387.505 2.589 0 50 GFAA Cc1cc(C(=O)NC[C@@H](NC(=O)c2cc(C)no2)c2ccc(Cl)cc2)on1 225670074 HPZJEFXXDSGYEM-CQSZACIVSA-N 388.811 2.834 0 50 GFAA O=C(c1ccc(F)cc1)[C@@H]1[C@@H]2C(=O)N(c3ccc(F)cc3)C(=O)[C@H]2[C@H]2CCCN12 229885755 DMCLCFCWODYPFH-HCXYKTFWSA-N 396.393 2.800 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O)c1ccc(C)cc1 236690008 YLPJKYNZZUJIBR-VQTJNVASSA-N 380.444 2.600 0 50 GFAA COC(=O)[C@@H]1[C@H]2C=C[C@@]3(CN(C(c4ccccc4)c4ccccc4)C(=O)[C@H]13)O2 238997498 AJYDXIPSQULZLA-GBPOLFSSSA-N 375.424 2.731 0 50 GFAA CC(C)n1ncc2cc(C(=O)N[C@@H](C(=O)O)c3ccc4c(c3)CCO4)cnc21 263209352 ZKSGURGGGPTJGE-QGZVFWFLSA-N 380.404 2.503 0 50 GFAA CCn1ncc2cc(C(=O)N3CCC[C@@H](Oc4ncccc4F)C3)c(C)nc21 282685503 LKZUDNNDOJSHDA-OAHLLOKOSA-N 383.427 2.977 0 50 GFAA COc1ccc(S(=O)(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cc1C(=O)O 284113326 SRBNOXFEFFCHNR-OCCSQVGLSA-N 394.276 2.598 0 50 GFAA C[C@H]1CN(C(=O)C(C)(C)C)C[C@@H](C)N1C(=O)c1ccc(Br)cn1 293760847 UGRPHWWIZGHMHB-TXEJJXNPSA-N 382.302 2.952 0 50 GFAA C[C@@H]1CN(S(=O)(=O)C2CCC(C(F)(F)F)CC2)C[C@@]2(CCCOC2)O1 333458630 UANUYKYNPRMJCH-XSCHDIRWSA-N 385.448 2.707 0 50 GFAA C[C@@H](c1ccc(F)cc1)N1CC[C@H](N2CCC3(CCC3)S(=O)(=O)CC2)C1=O 334050564 ROIUMRRMSLCKSL-YJBOKZPZSA-N 394.512 2.531 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)Nc1cnn(C[C@H]2CCCO2)c1 363739780 POFXJKBPVILKRJ-OAHLLOKOSA-N 396.455 2.941 0 50 GFAA CN(CC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)c1ncnc2[nH]cnc12 376157703 MDQNEDKHBOVXOM-ZACQAIPSSA-N 376.464 2.584 0 50 GFAA O=C(NCCCOc1cccnc1)N1CCCN(Cc2ccccc2F)CC1 426359998 USMHDKGVVWHVTM-UHFFFAOYSA-N 386.471 2.907 0 50 GFAA Cc1cc(-c2cccc(C(=O)NCc3cnn(C)c3)c2)nc(N2CCCC2)n1 426627656 JCFCSNQKEPHLSH-UHFFFAOYSA-N 376.464 2.716 0 50 GFAA CCN1CCN(C(=O)c2ccc(-c3cc(CC(=O)OC)ccc3O)cc2)CC1 426641458 GMBHXHZVALVVMU-UHFFFAOYSA-N 382.460 2.552 0 50 GFAA O=C(NCCn1cccn1)c1ccc(-c2cc(N3CCCCC3)ncn2)cc1 426712022 JXVCSJHNPUUICR-UHFFFAOYSA-N 376.464 2.760 0 50 GFAA C[C@@H](c1cc(-c2ccccc2)n[nH]1)N(C)C(=O)NCC1(CN2CCOCC2)CC1 534636233 KHQNOQDUANXYJY-KRWDZBQOSA-N 397.523 2.892 0 50 GFAA CNC(=O)c1ccc(CNC(=O)N(CCOC)Cc2sccc2C)cc1 584897890 HANOVHJFVUISJG-UHFFFAOYSA-N 375.494 2.774 0 50 GFAA O=c1c2nnc(C3CCOCC3)n2cc(Br)n1CC1CCCC1 616581106 UDLAXUPVISWZSI-UHFFFAOYSA-N 381.274 2.738 0 50 GFAA Cc1cc(-c2ccc(S(=O)(=O)NCCCn3nc(C)cc3C)s2)on1 670455062 IBCIVYPLCLIILU-UHFFFAOYSA-N 380.495 2.893 0 50 GFAA O=C1N[C@H](C(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)Cc2ccccc21 827780159 YALNABPSVVQAEF-KRWDZBQOSA-N 382.851 2.620 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3ccc(Br)cn3)CCN2)c1 870149004 AJMUYNCUBJJEEC-INIZCTEOSA-N 376.254 2.639 0 50 GFAA O=C(O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@H]2CCCc3nn[nH]c32)CC1 910030924 ABCBGGYIGHLCBH-DLBZAZTESA-N 382.464 2.722 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)cc1 952980117 CMQSZERVKGGLIM-AWEZNQCLSA-N 386.473 2.787 0 50 GFAA CNS(=O)(=O)c1cccc([C@@H](C)Nc2nccc3c2C(=O)OC3(C)C)c1 1337836608 DFVQUOODZUHJML-LLVKDONJSA-N 375.450 2.568 0 50 GFAA Oc1nc(CN2C[C@@H]3CC[C@H]2CN(Cc2cscn2)C3)nc2ccsc12 1565527324 YLWGKGMSACEGQN-OCCSQVGLSA-N 387.534 2.950 0 50 GFAA CC[C@H](CNC(=O)c1c(N(C)C)noc1-c1ccc(F)c(OC)c1)N(C)C 1704304295 CMCYJSDSEABERK-CYBMUJFWSA-N 378.448 2.625 0 50 GFAA O=C(Cc1cccs1)N1C[C@H]2CN(Cc3cc4ccccc4o3)C[C@@]2(CO)C1 1772810316 FXUUJDZRYDNLRH-VGSWGCGISA-N 396.512 2.990 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(-n3cncn3)c(C)c2)c2cnccc2NC1=O 1775961884 GUQUVAZRGPWWNC-CQSZACIVSA-N 376.420 2.596 0 50 GFAA Cc1c(C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)cnc2ccnn12 1857707585 FBUWZLYCJFFXFU-UHFFFAOYSA-N 386.459 2.679 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cc4c(nc3O)CCCC4)CC2)O1 1857709595 HMDAWROIXGYPOH-VQIMIIECSA-N 388.508 2.837 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)[C@H](O)C1CCCCC1 1857719941 ZIPGMDNUMZJBDD-IYWMVGAKSA-N 392.927 2.912 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cc(C(F)F)nn2C)[C@H]1c1ccccc1 1857720112 FIVUMEBIEWTSDI-IRXDYDNUSA-N 378.423 2.502 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)COc3ccc4ccccc4c3)C[C@]23CC[C@H]1O3 1857723125 UVFXZHNBZLXHKH-ZZLPTCMGSA-N 380.488 2.786 0 50 GFAA COC(=O)CCNC(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857729214 AHOIEJSITPDDTQ-GFCCVEGCSA-N 379.844 2.767 0 50 GFAA Cc1nc(C)c(C(=O)N2CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]24)s1 1857733225 ALJRRJBXRSUWCH-YRNRMSPPSA-N 383.473 2.675 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2c3cnn(C)c3CC[C@H]2C(F)(F)F)cc1 1875382445 BIAWOAVKQDDZRY-INIZCTEOSA-N 392.381 2.746 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1n[nH]cc1C1CC1 1875402365 DSHCFBVTTOJHOF-GDIGMMSISA-N 391.475 2.720 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@]2(C1)C(=O)N(CC1CCC1)c1ccccc12 1940198238 XERAKQNJHAHFQM-HSZRJFAPSA-N 375.472 2.941 0 50 GFAA CN1CCN(C(=O)c2cc(=O)n(-c3ccc(Cl)cc3)[nH]2)[C@H](c2ccccc2)C1 2325736508 RNWSDKYRCWPRLY-IBGZPJMESA-N 396.878 2.948 0 50 GFAA CC(C)c1ccccc1CC(=O)N1CCOC[C@@H]1CN(C)C(=O)c1ccccn1 2325872133 JWXNDEUEZFQRDJ-IBGZPJMESA-N 395.503 2.747 0 50 GFAA O=C1C[C@H](NC(=O)c2cc3c(s2)CCOC32CCNCC2)c2ccccc2N1 2356143414 GTCXVNKWEFNRBX-INIZCTEOSA-N 397.500 2.713 0 50 GFAA Cc1cccc(S(=O)(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)c1 2356154302 PWUUTEUMGCOPQL-HXUWFJFHSA-N 386.521 2.520 0 50 GFAA CC(C)(N)c1cn(C[C@H]2CCCN(C(=O)NCc3ccc(Cl)cc3)C2)nn1 23620066 ZXBGOAIIRSFKPE-HNNXBMFYSA-N 390.919 2.747 0 50 GFAA Cc1csc2nc(=O)c(-c3ccccc3NC(=O)[C@@H]3CC(C(C)C)=NO3)nn12 55199992 MIXUOILMSWFVON-HNNXBMFYSA-N 397.460 2.866 0 50 GFAA CCCCc1nc(CN2CCN(C)C3(CCN(C(=O)C(C)(C)C)CC3)C2)c[nH]1 67489833 NAJCGRQODCMYIU-UHFFFAOYSA-N 389.588 2.907 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)c1 67612396 YNIWGJNXDIRESU-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA O=C(N1CCCC1)N1CCC[C@H](C(=O)N2CCOc3ccc(Cl)cc32)C1 172685952 TWSAWXIXNBRJBW-AWEZNQCLSA-N 377.872 2.993 0 50 GFAA O[C@@H]1CCN(c2ccnc(NCc3cccnc3N3CCCCCCC3)n2)C1 67966445 OHPVZELMFFTJBU-GOSISDBHSA-N 382.512 2.825 0 50 GFAA COc1ccc(C2(C(=O)N3CC[C@@H]4COC(=O)N[C@H]4C3)CC3(CCC3)C2)cc1 370581020 ZTCVJQRASLILIT-QAPCUYQASA-N 384.476 2.854 0 50 GFAA Cc1ccc(NC(=O)c2c(NC(=O)COCC(=O)O)sc3c2CCC3)cc1 17079293 GGVBKOBIJGDXJB-UHFFFAOYSA-N 388.445 2.837 0 50 GFAA O=C(CCN1CCCS1(=O)=O)N1CCCC[C@H]1CCCc1ccccc1 179064855 SCLSMLQKCZFIKL-IBGZPJMESA-N 378.538 2.816 0 50 GFAA CN1CCC(CNC(=O)N(CCOc2ccccc2)C[C@@H]2CCCO2)CC1 426739061 NOTMUAJBYFVLRN-FQEVSTJZSA-N 375.513 2.598 0 50 GFAA COc1cccc(N2C(=O)[C@H]3[C@@H](c4ccc(C)cc4)N4CCCN4[C@H]3C2=O)c1 138546952 XYGKUGZWLMVTJR-XUVXKRRUSA-N 377.444 2.539 0 50 GFAA CN1CC[C@@H](NC(=O)NCC(=O)Nc2ccccc2)[C@@H]1c1ccc(F)c(F)c1 179415116 KXOWILMVFMIXSZ-MJGOQNOKSA-N 388.418 2.648 0 50 GFAA Cc1nc(C(=O)NCc2cccc(OCCN(C)C3CCOCC3)c2)c(C)o1 292996407 JAWDZWKGRUXPIQ-UHFFFAOYSA-N 387.480 2.711 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1NC(=O)N(C)CCc1c(C)n[nH]c1C 96151349 YNLRQZSUTJLIFK-UHFFFAOYSA-N 385.468 2.634 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)c2cccc3c2ccn3C)C1 95382885 FFZYKPIVJKLGIY-QGZVFWFLSA-N 379.508 2.956 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3cnc(C)nc3C)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95380418 YMARKBFLYGIDTR-BHDDXSALSA-N 392.503 2.804 0 50 GFAA O=C(O)c1ccccc1-c1cn(Cc2ccc(C(=O)N3CCCC3)cc2)nn1 95369962 YYGZHXDCNIFUMY-UHFFFAOYSA-N 376.416 2.928 0 50 GFAA COc1ccc(-n2ncc([C@H](C)NC(=O)CSc3nnc(C)o3)c2C)cc1 91460952 OHONHADLMQGFJH-NSHDSACASA-N 387.465 2.850 0 50 GFAA O=C(Cc1ccccn1)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95381321 RVAVZXJPSZEUHP-MTNREXPMSA-N 383.442 2.991 0 50 GFAA CCN1CC2(CCN(C(=O)c3ccnn3C)CC2)C[C@H](c2ccccc2)C1=O 92028308 DNOJRMXVKHFFBY-GOSISDBHSA-N 380.492 2.679 0 50 GFAA O=C(O)[C@@H]1CCN1C(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1 95517960 FZMOMGQBJDEFGV-FQEVSTJZSA-N 378.472 2.906 0 50 GFAA CCc1cccc(NC(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)c1 91914751 SAMFVSNDACJIFT-MJGOQNOKSA-N 389.496 2.668 0 50 GFAA C[C@@H](C(N)=O)N1CCC(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)CC1 95499845 AJPIUJWPOXMYNW-AWEZNQCLSA-N 391.475 2.754 0 50 GFAA COCc1nc(NCc2c[nH]nc2-c2ccc(F)cc2)cc([C@H]2C[C@@H](N)C2)n1 244723847 MIPXHNAJQHBHND-AKAXFMLLSA-N 382.443 2.969 0 50 GFAA CCC(CC)C(=O)NCc1nc(C2CCN(C(=O)OC(C)(C)C)CC2)n[nH]1 864096583 JTWBMEDCAOGVEN-UHFFFAOYSA-N 379.505 2.972 0 50 GFAA CC(C)(C)c1cc(CNC(=O)c2cccc(-c3cncc(C(=O)O)n3)c2)[nH]n1 534590944 RHMJVHLAOJTPRB-UHFFFAOYSA-N 379.420 2.792 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)N[C@H](CC(C)(C)C)c2cccnc2)cs1 823836840 HCQPAXTTYXIXLC-CQSZACIVSA-N 381.523 2.959 0 50 GFAA Cc1nc(CC(=O)NCC2CCN(Cc3ccccc3C(=O)O)CC2)cs1 827855276 RYYWNSCFRIOLGH-UHFFFAOYSA-N 387.505 2.721 0 50 GFAA CS(=O)(=O)NC1CCN(C(=O)C[C@H](Cc2ccccc2)c2ccco2)CC1 827913343 IIMFDZUVRGKWPM-KRWDZBQOSA-N 390.505 2.536 0 50 GFAA Cn1cnnc1Sc1ccc(CN2CCC(c3nnc4ccccn34)CC2)o1 825647876 UEQFPQHFJSJIQN-UHFFFAOYSA-N 395.492 2.982 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CC[C@@H](C(=O)O)[C@H](C)C2)cc1 952884225 LMBMSIGWQUCLTL-RHSMWYFYSA-N 375.469 2.672 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCN(CCc4ccccc4)C(=O)C3)n[nH]2)cc1 952867250 KNMABFSJIHVMDZ-UHFFFAOYSA-N 388.471 2.912 0 50 GFAA COCCn1cnnc1CN(C)C(=O)Cc1coc2cc(C)c(Cl)cc12 952981973 JMHOGACCZQGYNJ-UHFFFAOYSA-N 376.844 2.834 0 50 GFAA COc1cccc([C@@H](C)N2CCN(C(=O)Cc3cccc(C(=O)O)c3)CC2)c1 887557229 DDKQNKULRPNWQZ-MRXNPFEDSA-N 382.460 2.841 0 50 GFAA OC1CCN([C@H]2CCN(Cc3ccc(OCc4ccccc4)cc3)C[C@@H]2O)CC1 1565509680 FWRMJBKTZHERCZ-ZEQRLZLVSA-N 396.531 2.658 0 50 GFAA O=C(NOC[C@@H]1CCOC1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 188320665 NDCYIBMOJJLPAN-ABAIWWIYSA-N 387.263 2.682 0 50 GFAA CC(C)(C)CCCN1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1 225449321 SFUKAFKAMGHDCG-UHFFFAOYSA-N 381.542 2.811 0 50 GFAA Cc1ccc([C@H](C(=O)O)N2CCC(C(=O)NCc3ccccn3)CC2)cc1F 1506416141 IJLZQGKKLIJPAG-LJQANCHMSA-N 385.439 2.683 0 50 GFAA CO[C@@H]1CCC[C@@]12CCCN(C(=O)CN(c1cccc(C)c1)S(C)(=O)=O)C2 1704297638 CIZAQFXFHGLZFD-QUCCMNQESA-N 394.537 2.569 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc4nc(C(F)(F)F)[nH]c4c3)C[C@H]2O)on1 1704298052 DLRSPZSDIGUTBG-IAQYHMDHSA-N 394.353 2.554 0 50 GFAA CNC(=O)CCC(C)(C)NC(=O)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 1772815183 YKFLQNGFUWDRNW-CQSZACIVSA-N 386.521 2.731 0 50 GFAA COc1ccc(OC[C@H](O)CN(C)C)c(CNCc2cc(F)ccc2F)c1 12057271 NURPWFSNAVKZOO-QGZVFWFLSA-N 380.435 2.565 0 50 GFAA Cc1c(C(=O)NCCOC(C)C)sc2ncnc(NC[C@H]3CCCO3)c12 12278402 KIAMMKBWNZUWDW-CYBMUJFWSA-N 378.498 2.745 0 50 GFAA Cc1cc(C(=O)N2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)c(C)o1 12387053 XTIAPPIJMQVZGI-HNNXBMFYSA-N 386.452 2.545 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN1CCC[C@H]1CO 12434270 ACYKFSLOWDAQLZ-KRWDZBQOSA-N 398.532 2.667 0 50 GFAA COc1ccc(-c2nc(CN3CCN(c4ncccn4)CC3)c(C)o2)c(OC)c1 14977060 UQONORDBPFBMJK-UHFFFAOYSA-N 395.463 2.779 0 50 GFAA COc1cc(-c2nc(CNC(=O)COC[C@H]3CCCCO3)c(C)o2)ccc1O 1857693408 WDONQOYKTANHNG-OAHLLOKOSA-N 390.436 2.566 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(F)cc4)[C@H]4CC[C@]3(C2)O4)ccn1 1857711892 HRYMUGKMVYJDGS-GPQLQYNLSA-N 381.451 2.943 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1cc(O)nc2ccccc12 1857715090 ARDCCZJQXYBJTL-LLGFUMIMSA-N 389.455 2.885 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)NC(C)(C)Cc3ccc(F)cc3)CC2=O)s1 1857731884 SESCFZQWLZWUSG-ZDUSSCGKSA-N 390.484 2.730 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2cn3cc(Cl)ccc3n2)CC1 1857737761 BNJWDGIVANOIJM-UHFFFAOYSA-N 397.866 2.912 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1 1875242693 XWWXLHPTCCVYRI-FXAWDEMLSA-N 391.826 3.000 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]2N(C)C)cc1 212488371 PRRBJADJLKHXFS-RTWAWAEBSA-N 375.476 2.746 0 50 GFAA O=C(c1ccc2nc[nH]c2n1)N1CCO[C@@H](c2cccc(Br)c2)C1 368826660 WTWCNIGZKICLPJ-OAHLLOKOSA-N 387.237 2.934 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@H](O)c3ccc(Cl)cc3F)CC2)cs1 813404571 ZEPVLQDZRGIDRQ-MRXNPFEDSA-N 383.876 2.622 0 50 GFAA CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OCCSCC)ccc1O 4113722 NTINEAMBSYUYRG-MRXNPFEDSA-N 380.466 2.715 0 50 GFAA Cn1cc(C2CCN(C(=O)C(=O)N3CC[C@@H]3c3ccc(Cl)cc3)CC2)cn1 2325751667 NTGVGNXQGIYXOB-GOSISDBHSA-N 386.883 2.753 0 50 GFAA Cc1c(-c2nc(-c3ccc(Br)s3)no2)nnn1[C@@H]1CCNC1 2325756073 SZKUATGWAWFDIH-MRVPVSSYSA-N 381.259 2.662 0 50 GFAA O=C(c1cccc2c1CNCC2)N1CCn2c(nnc2-c2ccc(Cl)cc2)C1 2325778733 MNHPKLNFJVWTTH-UHFFFAOYSA-N 393.878 2.900 0 50 GFAA O=C(N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1cnn([C@H]2CCS(=O)(=O)C2)c1 2325779850 KMUQLKNILRRIGL-JQFCIGGWSA-N 393.896 2.572 0 50 GFAA COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(OC)c1OC 862469 XHQDBRHJFNOJHW-GOSISDBHSA-N 397.431 2.979 0 50 GFAA Cc1ccc2nc(NC(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)sc2c1 1062649 ZJPWDNQVWODQBH-AAEUAGOBSA-N 377.466 2.914 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1C(=O)Nc1ccccc1)Nc1cccc(Cl)c1 1118940 OSTMZEXSXFOHTE-MRXNPFEDSA-N 386.839 2.701 0 50 GFAA Cc1cc(C)n(C[C@@H](O)CN(c2ccccc2)S(=O)(=O)c2ccccc2)n1 1177346 JIWKLZZNYQBJOH-LJQANCHMSA-N 385.489 2.756 0 50 GFAA CC(=O)N1C(=O)N(c2ccccc2)[C@@H]2[C@H]1N(c1ccccc1)C(=O)N2C(C)=O 1216565 GBFHVGKAHIMKKO-QZTJIDSGSA-N 378.388 2.616 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1cccc(I)c1)C(=O)O 2385584 MPTBEGFNTNOLNZ-NSHDSACASA-N 391.205 2.812 0 50 GFAA Cc1cc(C)cc(N(C(=O)c2ccc3c(c2)OCO3)[C@H]2C=CS(=O)(=O)C2)c1 4101361 HIRFKHTURFWMBS-INIZCTEOSA-N 385.441 2.990 0 50 GFAA COC(=O)c1ccc([C@H]2NC(=S)NC(C)=C2C(=O)NCc2ccccc2)cc1 4825763 ZBDUZVGNANVGHY-GOSISDBHSA-N 395.484 2.582 0 50 GFAA COc1ccccc1CCc1nnc(CCC(=O)N2CCCC[C@H]2CCO)o1 11873480 KOWYROUBWSDHNV-KRWDZBQOSA-N 387.480 2.560 0 50 GFAA COC(=O)CCCC(=O)N1CCC(CCC(=O)Nc2cccc(OC)c2)CC1 11997563 VDBJXDZLFKALIU-UHFFFAOYSA-N 390.480 2.996 0 50 GFAA O=C1CC[C@@H](CCNCc2ccc(Cl)cc2)N1CCCN1CCOCC1 12131061 PIPSRTVOECEWAX-IBGZPJMESA-N 379.932 2.533 0 50 GFAA Cc1cc(Cl)ccc1C(=O)[C@@H]1CCCN(C(=O)C2=NN(C)C(=O)CC2)C1 12194447 MEFHFFHWDBKTIA-CYBMUJFWSA-N 375.856 2.678 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H](CNC(=O)c3cccs3)C2)cc1 12315784 MNCHAXPWTZASAV-HNNXBMFYSA-N 378.519 2.887 0 50 GFAA Cc1cccc(N2CCN(C(=O)[C@H]3CCC(=O)N(CC4CCCCC4)C3)CC2)n1 12574662 BLHQMHIZXQUABI-FQEVSTJZSA-N 398.551 2.858 0 50 GFAA COC(=O)[C@H]1CCCCN1C(=O)c1cc(COc2cccc3cccnc23)on1 12707688 JSGOQQHZONDRGT-QGZVFWFLSA-N 395.415 2.970 0 50 GFAA Cc1ccn2c(=O)c(C(=O)N3CCCC[C@H]3CCn3ccnc3C)cnc2c1 19113955 BRRJAEIRSITFDU-KRWDZBQOSA-N 379.464 2.593 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNc2ncccc2C(F)(F)F)CC1 19147299 ISXCCNNSEGCOOB-UHFFFAOYSA-N 379.386 2.776 0 50 GFAA COc1ccccc1N1CCN(C[C@@H](O)COc2ccc3c(c2)CCC3)CC1 20109543 DXKJLDCDDBTGGS-HXUWFJFHSA-N 382.504 2.746 0 50 GFAA OCCOc1ccc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)cc1 20451597 XTTAEAKWDTWLLN-QHCPKHFHSA-N 398.547 2.559 0 50 GFAA O=C(N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)O)OCc1ccccc1 31720031 RSDRIMXAOFFQMC-IBGZPJMESA-N 379.416 2.854 0 50 GFAA in-vitro CCc1ccccc1NC(=O)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528336 UDMDSHCCMVEOSN-UHFFFAOYSA-N 380.496 2.993 0 50 GFAA O=C(NCc1n[nH]c2c1CCC2)c1coc(COc2cccc3cccnc23)n1 67694495 TUPFLTZAEGPMFM-UHFFFAOYSA-N 389.415 2.944 0 50 GFAA Cc1ccncc1C(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccc(F)cc2)C1 67947953 ZLJUWEDJUXZWNS-UHFFFAOYSA-N 394.406 2.671 0 50 GFAA Cc1cc(C)c2c(CC(=O)N3CC4(CCNCC4)C[C@H]3C(=O)O)coc2c1C 72133811 GNZBNDDHZZXEKK-KRWDZBQOSA-N 384.476 2.956 0 50 GFAA COCC(=O)N1CCCN(Cc2nc(-c3ccccc3Cl)oc2C)CC1 72412439 BEFLHKAZDUAJTC-UHFFFAOYSA-N 377.872 2.984 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCN(c2nc3ccccc3s2)CC1 72421939 WJJZGFIWKPOUSQ-UHFFFAOYSA-N 383.521 2.928 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cc3ccccc3[nH]c2=O)[C@@H](C)C1 72477365 WGYOPRRMFDEJBG-HNNXBMFYSA-N 377.444 2.888 0 50 GFAA O=C(Nc1nn(CC(F)(F)F)c2cccc(N3CCOCC3)c12)[C@H]1CCCO1 77288159 FBKPCMYHYXGGSE-CQSZACIVSA-N 398.385 2.553 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3CCCCC3)[C@@H]4C2=O)cc1C 77486272 BHSJYKBURHIKJS-VAWZGJIGSA-N 380.488 2.598 0 50 GFAA CCCS(=O)(=O)N1CCC2(CC1)CC(=O)N(Cc1ccc(Cl)cc1)C2 77525408 KXSBIRQFDPSDJL-UHFFFAOYSA-N 384.929 2.894 0 50 GFAA COc1ccc(CN2CCCn3nc(CNC(=O)C4CCC4)cc3C2)cc1F 91547823 HBISDDXZHWOLCF-UHFFFAOYSA-N 386.471 2.853 0 50 GFAA CN(C)C(=O)CCN1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2 91997225 IPLXTKMDBGGLHH-FQEVSTJZSA-N 383.536 2.725 0 50 GFAA CC(C)n1ccnc1[C@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 95498254 UKTGBAWPAKIRFM-KRWDZBQOSA-N 386.496 2.909 0 50 GFAA CCn1ncnc1[C@@H](NC(=O)Nc1cccc(-c2nncn2C)c1C)C1CC1 95508258 WMQXHINNDHFVOV-INIZCTEOSA-N 380.456 2.675 0 50 GFAA CCOc1ccc(NC(=O)NC[C@H]2CCS(=O)(=O)C2)cc1C(F)(F)F 95530769 PJQFWDXGKDHJHP-SNVBAGLBSA-N 380.388 2.660 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nnc(Cn4ccnc4C)n3C)CC2)c(C)o1 96152723 WDNMTVITVJVYGX-UHFFFAOYSA-N 382.468 2.598 0 50 GFAA Cc1cc(CN2CCC3(CC2)CCN(Cc2cscn2)C[C@H]3CO)on1 97288826 MOHVSMMLDXYSEY-INIZCTEOSA-N 376.526 2.536 0 50 GFAA COc1cc(CN2CCN(Cc3ccccc3F)C[C@H]2CCO)cc(OC)c1 104484770 GRRCVVLVZUOKFX-LJQANCHMSA-N 388.483 2.912 0 50 GFAA COCCN1CCN(C(=O)c2csc(-c3ccccc3OC)n2)C[C@H]1C 117295082 WICMSKALODEOJF-CQSZACIVSA-N 375.494 2.611 0 50 GFAA CCc1ccccc1NC(=O)CN1CCN(C(=O)Nc2ccc(F)cn2)CC1 122535294 IIIYZDJLEQDUOB-UHFFFAOYSA-N 385.443 2.571 0 50 GFAA CC(=O)N[C@H]1CCCN(CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)C1 125188122 AWSKBLABGGAHEE-KRWDZBQOSA-N 397.523 2.709 0 50 GFAA C[C@H](NC(=O)CCCc1nc(=O)c2ccccc2[nH]1)c1nc2ccccc2[nH]1 138831646 JOMUWJLVAUMBNL-ZDUSSCGKSA-N 375.432 3.000 0 50 GFAA Cn1cc(CC(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)cn1 156428611 SDZASXSESZZRBJ-UHFFFAOYSA-N 381.307 2.656 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CCO[C@H](c2cccs2)C1 161880722 ISNDXQMBPHQDNJ-MSOLQXFVSA-N 384.501 2.882 0 50 GFAA CN(CCc1ccncc1)C(=O)c1csc(CCNC(=O)OC(C)(C)C)n1 170610276 QENNVICMCBSENN-UHFFFAOYSA-N 390.509 2.920 0 50 GFAA Cc1cc2nc(C)c(CCC(=O)N[C@H](C[S@](C)=O)c3ccccc3)c(C)n2n1 174317200 WWCHRWAGILMWDA-GDJIYFAZSA-N 398.532 2.823 0 50 GFAA CC(C)(C)c1nc2ccc(NC(=O)[C@@H]3CCCN3S(C)(=O)=O)cc2s1 174569147 OGIDPLTVNKULFG-ZDUSSCGKSA-N 381.523 2.956 0 50 GFAA CCc1nsc(N2CCN(C(=O)N[C@H]3CCCOc4ccccc43)CC2)n1 176172586 BGZDXENSHMAUMK-HNNXBMFYSA-N 387.509 2.846 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)[C@H](O)c1cc(Cl)cc(Cl)c1 179761598 KTCAOPWHVMFVMR-MRXNPFEDSA-N 377.231 2.924 0 50 GFAA NC(=O)c1c[nH]c(C(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2)c1 191472126 FAKLEUVMIXCVIG-LBPRGKRZSA-N 381.263 2.819 0 50 GFAA O=C(CCn1c(=O)[nH]c2ccccc21)NC[C@@H]1CCN(c2ccc(F)cc2)C1 215902372 KRMKPSJRYHNKAT-HNNXBMFYSA-N 382.439 2.502 0 50 GFAA COc1cccc(-n2cc(CN(C)CCn3c(=O)oc4ccccc43)cn2)c1 216346509 KYDHVZPNWFIKLJ-UHFFFAOYSA-N 378.432 2.921 0 50 GFAA COc1ccc(C(=O)N[C@@H]2COCC[C@H]2Oc2ccc(C(=O)O)cc2)cc1C 223148311 QQDZDUGOMZRNLN-IEBWSBKVSA-N 385.416 2.668 0 50 GFAA CC[C@H](O)c1cc2n(n1)CCN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 223423558 NEHDXBHDEICUBH-IBGZPJMESA-N 377.448 2.748 0 50 GFAA O=C(Cc1ccsc1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 225331390 QOSBRWCJIKVVJX-UHFFFAOYSA-N 381.505 2.561 0 50 GFAA Cc1cc(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 252527949 DUMMDWSZDNAXRD-SJLPKXTDSA-N 377.492 2.917 0 50 GFAA COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@@]12C 253604836 RKZIYOHKBLFLTH-SBMOZAPWSA-N 394.552 2.757 0 50 GFAA CCCN1C(=O)[C@@H]2CC[C@H]1CN(C(=O)c1c(C)n(C)c3ccc(OC)cc13)C2 253612867 CFGUOXKKLNQYLF-CVEARBPZSA-N 383.492 2.968 0 50 GFAA CN(C(=O)CN1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1)C1CCCCC1 271250758 DZKUCMSHLUZPDJ-QHCPKHFHSA-N 398.595 2.670 0 50 GFAA CCN1CCN(C2CCN(C(=O)c3c(OC)cnc4ccccc34)CC2)C1=O 374777097 MKEPRBVAGGNBRH-UHFFFAOYSA-N 382.464 2.606 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)N[C@@](C)(CO)C(C)C)CC2)cs1 378123202 ONXDADWYMKEMNF-IBGZPJMESA-N 382.574 2.624 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1C(=O)O 396373269 OATGCISNYOXHGR-INIZCTEOSA-N 388.489 2.588 0 50 GFAA O=C(NCc1cccs1)c1ccc(-c2nccc(N3CC[C@H](O)C3)n2)cc1 426429129 ZHMBFUMQALCTAO-INIZCTEOSA-N 380.473 2.706 0 50 GFAA CCCNC(=O)c1cccnc1-c1cccc(C(=O)N2CCCC[C@@H]2CO)c1 426594811 JPXFNWOWYIZETR-GOSISDBHSA-N 381.476 2.875 0 50 GFAA COc1ccc(Cl)cc1C(F)(F)C(=O)N1CCO[C@@]2(CCCOC2)C1 935917360 ZIENHYLMDQZMTO-INIZCTEOSA-N 375.799 2.848 0 50 GFAA Cc1cc(N2CCN(Cc3cnn(C)c3C)CC2)nc(-c2ccccc2O)n1 952967385 HQEXDXNAXIJKRY-UHFFFAOYSA-N 378.480 2.522 0 50 GFAA CN1CCCC[C@@H]1C(=O)NCC1CCN(CCCOCc2ccccc2)CC1 952979063 MQHCZTMZQLLQKM-JOCHJYFZSA-N 387.568 2.906 0 50 GFAA O=C(Nc1ccccc1CN1CCCC1)c1cn(CC[C@@H]2CCCCN2)nn1 952991536 UEPREHKBVLSNFP-SFHVURJKSA-N 382.512 2.658 0 50 GFAA COc1cccc([C@@H]2CCN(C(=O)CSc3nnc(C)s3)C2)c1OC 1506407033 LQINYLNIBFCALD-GFCCVEGCSA-N 379.507 2.972 0 50 GFAA O=C(Nc1ccc(-c2cccc(F)c2F)cn1)c1cn(C[C@H]2CCCNC2)nn1 1529192169 PXYGNOZUZJWPLN-ZDUSSCGKSA-N 398.417 2.870 0 50 GFAA Cc1nc(CN2CC[C@H](NC(=O)c3cc(Cl)ccc3C)[C@@H](O)C2)cs1 1565530792 YVKHCAKVXZPQIG-IRXDYDNUSA-N 379.913 2.779 0 50 GFAA COc1cccc(C(=O)N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)c1OC 1615733732 PIAHTTDCSZJIQD-JXFKEZNVSA-N 392.455 2.928 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(CC(=O)N(C)C3CCCCC3)C1)CC2 1704337076 UDFFEXOMYYKIHV-JOCHJYFZSA-N 385.556 2.614 0 50 GFAA CN(C)Cc1nc(C(=O)N2CCC3(CC2)OCCc2sccc23)cs1 1704340631 KKGHZDDABKTFFP-UHFFFAOYSA-N 377.535 2.970 0 50 GFAA Cc1ccc(C(=O)N2CCCN(CCn3c(=O)oc4ccccc43)CC2)s1 1775980172 TYXVEROZTOQOCI-UHFFFAOYSA-N 385.489 2.813 0 50 GFAA O=C(Cc1ccc(F)cc1Cl)N[C@H]1CCC[C@@H](CNC(=O)c2ncc[nH]2)C1 1857678033 ADNGSHDXMFXKOE-DOMZBBRYSA-N 392.862 2.850 0 50 GFAA CC[C@@]12COC(=O)N1CCN(C(=O)c1oc3c(OC)c(OC)ccc3c1C)C2 1857680012 DWPRRHNWUABHBS-HXUWFJFHSA-N 388.420 2.815 0 50 GFAA NCc1ccnc(CNC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)c1 1857738032 ONTRVHFKXUOJJU-CQSZACIVSA-N 399.882 2.868 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)n1 1875245949 UMAQBAQPDQXMCW-DOTOQJQBSA-N 389.883 2.961 0 50 GFAA OC[C@H]1CCN(Cc2ccccc2OCCCCN2CCCCC2)C[C@H]1O 1875249841 FALBDLIMIKJXEU-NHCUHLMSSA-N 376.541 2.507 0 50 GFAA C[C@@H](O)c1cn(CC(=O)N[C@H](CCc2ccccc2)c2cccc(F)c2)nn1 1875312957 LCQGGFGBSVBXOX-DNVCBOLYSA-N 382.439 2.961 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@@H]2C[C@@]23CCOc2ccccc23)c(F)c1 1875371242 UWCYLLUSZOBBNN-FDDCHVKYSA-N 394.446 2.985 0 50 GFAA CCc1c(C(=O)N=[S@@]2(=O)CCC[C@]3(CCCN3)C2)cnn1-c1ccccc1 1875393342 KTDMZVAADZWJFF-NFQMXDRXSA-N 386.521 2.959 0 50 GFAA CC(C)n1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3cc(C4CC4)n(C)n3)CC1)O2 1875394434 IXBOYRVJSBAIMD-QGZVFWFLSA-N 399.495 2.566 0 50 GFAA Cc1[nH]nc2c1CC[C@@H](NC(=O)N[C@@H]1CN(Cc3ccccc3)C(C)(C)C1)C2 2325828444 HPZQGXBTEGBSDI-MSOLQXFVSA-N 381.524 2.928 0 50 GFAA CC[C@@H]1SC2=NC(C)=C(C(=O)OC)[C@@H](c3ccc(OC)c(OC)c3)N2C1=O 2251777 FOSGWPWSCKRQPY-GOEBONIOSA-N 390.461 2.916 0 50 GFAA Cc1ccccc1OCC(=O)N(Cc1cccs1)[C@H]1CCS(=O)(=O)C1 4313124 QBMMXPBKICXZMV-HNNXBMFYSA-N 379.503 2.651 0 50 GFAA FC(F)(F)c1cccc(N2CCN(Cc3nc(-c4cnccn4)no3)CC2)c1 55281867 ZBJFUKNVSFQZNC-UHFFFAOYSA-N 390.369 2.868 0 50 GFAA CS(=O)(=O)c1cc(C(=O)NC[C@@H]2Cc3ccccc3CO2)ccc1Cl 862424066 GYMBJIOIKGNOIH-HNNXBMFYSA-N 379.865 2.615 0 50 GFAA COc1ccc(NC(=O)Cc2nc(C)nn2-c2ccc3c(c2)OCCO3)cc1 63856536 QQEPPPQVJVQKBT-UHFFFAOYSA-N 380.404 2.537 0 50 GFAA CC(C)Cc1noc([C@H](C)Nc2nc(-c3cccnc3)nc3c2CCNC3)n1 67965658 CWMNPZLGNPWJKV-ZDUSSCGKSA-N 379.468 2.939 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)Cc1ccc(O)cc1 67541354 IGDTWNJOTYTQFV-UHFFFAOYSA-N 376.460 2.720 0 50 GFAA C[C@H](OC[C@H]1CCCO1)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 252458479 KUKNUCIRXHTCAJ-PNBKFKSVSA-N 380.460 2.962 0 50 GFAA O=C(C[C@@H]1OCCc2ccccc21)NS(=O)(=O)Cc1ccc(F)cc1F 121532981 ULHWINKQIITSFI-KRWDZBQOSA-N 381.400 2.615 0 50 GFAA COc1ccc(OC)c(NC(=O)CN2CCN(Cc3ccccc3C)CC2)c1 20418585 RGYNGWZCRQPZQX-UHFFFAOYSA-N 383.492 2.769 0 50 GFAA Cc1ncccc1O[C@@H]1CCN(S(=O)(=O)Cc2cccc3cccnc23)C1 328644919 ZNGRVDXCEBYDBN-GOSISDBHSA-N 383.473 2.921 0 50 GFAA Cc1nn(CC(=O)N2CCc3ccccc32)c(C)c1I 4726624 XETUJXCVHRYWAG-UHFFFAOYSA-N 381.217 2.694 0 50 GFAA Cc1nn(-c2cccc(C(=O)N3CCC[C@H](N)CC3)c2)c(=O)c2ccccc12 72168030 PVQRQNJSYOCMAL-KRWDZBQOSA-N 376.460 2.648 0 50 GFAA C[C@@H](NC(=O)CSc1nnc([C@H](O)c2ccccc2)n1C)c1ccccc1 30953054 IRVFNKDIZOHQER-RDTXWAMCSA-N 382.489 2.866 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@@]1(O)CNCc1ccccc1F 12707353 TVYCNJJDKBGVBK-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA CC[C@@H](NC(=O)N1CCC12CCOCC2)c1ccccc1OCC(=O)N(C)C 365591067 YGAHXQZJXUYTGI-QGZVFWFLSA-N 389.496 2.569 0 50 GFAA c1cc(CN2CCCCC2)cc(-c2noc(-c3ncn([C@@H]4CCCNC4)n3)n2)c1 261623950 BYACMYFIDZALNM-GOSISDBHSA-N 393.495 2.906 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cn(Cc3ccccc3)nc2-c2ccccc2)CCO1 238143518 URNDQTJFOGWBDZ-LJQANCHMSA-N 391.427 2.524 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N[C@H](C)c1ccc(OCC(=O)O)cc1 263189444 XQHFMUCXLYONJQ-LLVKDONJSA-N 387.436 2.743 0 50 GFAA C[C@@H](O)C(=O)N1CCC(n2nccc2NC(=O)Nc2ccccc2Cl)CC1 71681272 NEDUTMYFUPKYLA-GFCCVEGCSA-N 391.859 2.725 0 50 GFAA CCn1ccnc1CS(=O)(=O)[C@H](C)c1nc(-c2ccc(OC)cc2)no1 131169596 YLTHRNDHCFEEQO-GFCCVEGCSA-N 376.438 2.638 0 50 GFAA Cc1cc(NC(=O)N[C@H]2CCN(CC(F)(F)F)C2)cc(N2CCN(C)CC2)c1 241653355 PULFKLCKXJDOFI-HNNXBMFYSA-N 399.461 2.505 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCS(=O)CC1 242389367 ZWPGGXZDHLZHSR-INIZCTEOSA-N 394.537 2.870 0 50 GFAA Cc1ccc(Nc2ccc(NCCNS(=O)(=O)c3cccc(C)c3)nn2)nc1 72140553 CPENOWMYNJOREU-UHFFFAOYSA-N 398.492 2.622 0 50 GFAA O=C(C[C@H]1COCCN1)NC1CCN(Cc2ccc(-c3ccccc3)cc2)CC1 72132936 ARQOUFLTNDZLBO-QHCPKHFHSA-N 393.531 2.813 0 50 GFAA COC(=O)c1cc2cc(CN3CCN(C(=O)c4ccc(O)cc4)CC3)ccc2o1 176309438 RRGJOVPHYKIRPC-UHFFFAOYSA-N 394.427 2.883 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)CCNC(=O)[C@H]3C[C@H]3C)cc2)C1 229757579 YOKOGEWFEQKVJU-IIMDRIAPSA-N 385.552 2.943 0 50 GFAA O=C(O)[C@H]1[C@H](C(=O)Nc2cnn(Cc3cccc4ccccc34)c2)[C@H]2C=C[C@H]1O2 239164974 NGEGGVYNURDQQT-UAFMIMERSA-N 389.411 2.677 0 50 GFAA COc1ccc(NC(=O)CC[C@@H]2CCCN(S(=O)(=O)C3CC3)C2)c(C)c1 95510158 NTJHLWRJRJXMKQ-HNNXBMFYSA-N 380.510 2.927 0 50 GFAA Cn1nc(C(F)(F)F)c(Cl)c1C(=O)NCCCn1nnc2ccccc21 97179318 SFWFIINATBGERH-UHFFFAOYSA-N 386.765 2.657 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Nc3ccc(Cl)cc3)[C@@H]3OC(C)(C)O[C@H]3[C@@H]2O1 239433191 XINPLTKQOKCZLO-NJURLYQPSA-N 383.828 2.675 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@H]3CC[C@@H]1[C@H]32 248042629 OQPJCJPJPNWQBN-LDEXNAQYSA-N 379.504 2.873 0 50 GFAA O=C(c1ccc(O)cc1)N1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 248005753 SWWKKTIUJBRYTN-UAPYVXQJSA-N 386.492 2.541 0 50 GFAA O=C(CN1CCc2c(F)cccc21)Nc1ccccc1S(=O)(=O)C(F)F 184038814 GNQGXVQJRQSYPW-UHFFFAOYSA-N 384.379 2.823 0 50 GFAA COc1ccc([C@@H](O)Cn2ccn3nc(-c4cccs4)cc3c2=O)cc1OC 263615146 AURAWSSYNCTLPB-INIZCTEOSA-N 397.456 2.975 0 50 GFAA COC(=O)N1CCCc2cc(NC(=O)NCc3cn4c(n3)SCC4)ccc21 299795762 MRGLJYPDDIIKLL-UHFFFAOYSA-N 387.465 2.830 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(C(=O)c3ccc(Cl)cc3OCCCN)C2)n1 299768055 IGCVIQFXHPQFKD-MRXNPFEDSA-N 376.888 2.968 0 50 GFAA O=C(N[C@@]12CC[C@@H](CN(C(=O)c3cc4c([nH]3)CCC4)C1)C2)c1cc2c([nH]1)CCC2 1875405723 NBRQSEGDRKVMNZ-QKFKETGDSA-N 392.503 2.745 0 50 GFAA CN1CC[C@@H](NC(=O)CN2CC[C@H](c3ccccc3)NC2=O)c2ccccc21 1875267744 BRGPCFKDPKRCBH-RTBURBONSA-N 378.476 2.840 0 50 GFAA O=C(N=[S@]1(=O)CCC[C@]2(CCCN2)C1)c1cccc(CN2CCCC2)c1 1875393413 MYCSMQKRURUFAG-IBVKSMDESA-N 375.538 2.807 0 50 GFAA O=C(Nc1ccc2c(c1)COB2O)c1cc(Oc2ccccc2Cl)ccn1 1875368599 DBGFLQJIUBDDRC-UHFFFAOYSA-N 380.596 2.997 0 50 GFAA CC(C)(C)NC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(Oc2nn[nH]n2)cc1 952972240 OPPKBAKKMSEBQM-LSDHHAIUSA-N 386.456 2.652 0 50 GFAA O=C(CN1CCOc2ccccc2C1)NCc1cc(-c2cccc(F)c2)no1 952982816 YSQPUDODUUMGEB-UHFFFAOYSA-N 381.407 2.992 0 50 GFAA Cc1cc(C(=O)N2CC[S@@](=O)C[C@H]2c2cnn(C)c2)cc(C)c1OC(F)F 277416478 HZUXOLDATNFWHT-KUNJGFBQSA-N 397.447 2.584 0 50 GFAA O=C(NCc1ccc(CN2CCOCC2)o1)Nc1ccc(NC(=O)C2CC2)cc1 170616979 CJDGJFXZXHTKKE-UHFFFAOYSA-N 398.463 2.782 0 50 GFAA Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3C(=O)N1CCC2(CC1)CN(C)C(=O)CO2 1775978981 DGTGFLXSVOFKEH-QGZVFWFLSA-N 395.503 2.746 0 50 GFAA COc1ccc(-c2nccn2-c2cccc3c2nnn3C)c(C(=O)O)c1OC 1775980797 ATEQHXLEUVEZDS-UHFFFAOYSA-N 379.376 2.536 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCN1CCOC1=O 11838450 IAJQDNVSVMCQCC-KRWDZBQOSA-N 382.416 2.506 0 50 GFAA O=C1CCN(C(=O)c2cc3ccccc3oc2=O)CCN1Cc1ccccc1 11968804 JYCYNHBEKWUIAW-UHFFFAOYSA-N 376.412 2.668 0 50 GFAA CSC[C@H](C)N1CCC(N2CCC(C(=O)NCc3cccnc3)CC2)CC1 12308016 FXAOAPNMFYEQHZ-KRWDZBQOSA-N 390.597 2.626 0 50 GFAA CCn1nc(C(=O)N(C)Cc2ccoc2)c2c1CC[C@@H](NCCSC)C2 14754620 IRUFMPKDAGMYNN-OAHLLOKOSA-N 376.526 2.578 0 50 GFAA COc1ccc(-c2noc(CN3CCCC[C@@H]3CCCO)n2)c(OC)c1OC 15065182 VJQFWGOGRDPCFK-CQSZACIVSA-N 391.468 2.889 0 50 GFAA CCOC(=O)COc1c(/C=C/c2cc(C(F)(F)F)[nH]c(=O)n2)cccc1OC 15659722 NOBSDHAYMWCXBH-BQYQJAHWSA-N 398.337 2.910 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccnc(N)c4)C3)C2)c1 19223706 DWKKADNBKUCZDR-JOCHJYFZSA-N 380.492 2.801 0 50 GFAA CCN(CC)CCNCc1ccc(OC[C@H](O)CN(C)Cc2ccccc2)cc1 19732943 FSKJJCHEXCRPNO-HSZRJFAPSA-N 399.579 2.990 0 50 GFAA O=C(NCc1nnc2c(-c3nc(C4CC4)no3)cccn12)c1cccc(F)c1 169776086 RWIAVEUAURZSIZ-UHFFFAOYSA-N 378.367 2.726 0 50 GFAA O=C(CC[C@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O)Nc1nccs1 206253452 XMHDXVYVMFTMED-OAHLLOKOSA-N 397.460 2.506 0 50 GFAA CCCn1ncc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1C 1857712665 LATVZZQAOJVPNO-SJBKTWHCSA-N 380.492 2.876 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CC(=O)Nc2ccccc21 1857713770 NCKFCIZEWWSYPI-CQSZACIVSA-N 379.445 2.976 0 50 GFAA CC(C)=CCN1C[C@@H]2[C@H](CNC(=O)CCc3c(C)noc3C)[C@H]3CC[C@]2(C1)O3 1857733297 DFQOZCYNCYTYNH-GPQLQYNLSA-N 387.524 2.786 0 50 GFAA CC(=O)N1CCC[C@@]2(CCc3c(N(C)Cc4ncc[nH]4)nc(C(C)(C)C)nc32)C1 1875244679 YZYNTPVECPPPAA-JOCHJYFZSA-N 396.539 2.960 0 50 GFAA O=C(c1scc2c1OCCO2)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 1875245895 COMCNDMXIUESJC-ZFWWWQNUSA-N 395.864 2.747 0 50 GFAA CCCN=c1[nH]c(-c2cccnc2)nc2c1CC[C@@]21CCCN(C(=O)C2CC2)C1 1875250902 POSRWVCFTPUAOL-HSZRJFAPSA-N 391.519 2.999 0 50 GFAA COc1ccc(CN2C(=O)O[C@H]3CN(Cc4cccc(O)c4)C[C@H]32)cc1OC 206620990 YUZXGSBGLCIMTQ-XLIONFOSSA-N 384.432 2.615 0 50 GFAA O=C(c1ccnc2ccccc12)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1ccccn1 216347274 QTHYHFFZTPNACQ-AEFFLSMTSA-N 386.455 2.893 0 50 GFAA C[C@H](NC(=O)[C@@H](C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)[C@@H]1C[C@H]2CC[C@H]1C2 333480445 XUHUZIMQSSZNKP-JIWXIQHESA-N 383.536 2.597 0 50 GFAA CC(C)CNC(=O)N1CCC[C@@H](C(=O)N2CCc3c(F)cc(F)cc3C2)C1 134285130 PNRTUEYAJSXNNO-CQSZACIVSA-N 379.451 2.927 0 50 GFAA Cc1cccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC[C@H](C)C3)n2)c1 1857797714 CWCJUMWWFLNQMZ-RDJZCZTQSA-N 393.491 2.905 0 50 GFAA Fc1cc(-c2noc([C@@H]3OCCO[C@@H]3C(F)(F)F)n2)ccc1Cn1cnnc1 2325760130 FNKKJERFVJMPMY-OLZOCXBDSA-N 399.304 2.534 0 50 GFAA COc1ccc(N2C[C@H](NC(=O)N[C@H]3C[C@H]3Cc3ccccc3)CC2=O)cc1 2325872172 LDBWMPBPYCPWTA-HLIPFELVSA-N 379.460 2.731 0 50 GFAA COC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(OC)c(Br)c1 955846 CUIUGEOMXIZQLP-ZDUSSCGKSA-N 379.214 2.511 0 50 GFAA CCOC(=O)C1=C(C)N2C(=O)CSC2=N[C@@H]1c1cc(OC)ccc1OC 1198551 ONXHCBHTWMFZEY-MRXNPFEDSA-N 376.434 2.527 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)CC1)C1CCN(C(=O)c2ccccc2Cl)CC1 2356163178 RCEYBURYPNZETN-GASCZTMLSA-N 392.883 2.952 0 50 GFAA COc1ccccc1N(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccccc1 4977033 NGYOUKRCDVNXLA-UHFFFAOYSA-N 376.478 2.805 0 50 GFAA COc1ccc(N2C[C@H](C(=O)NCCc3cc4ccccc4[nH]3)CC2=O)cc1 119931254 AHWLVUMEPKHXKE-MRXNPFEDSA-N 377.444 2.888 0 50 GFAA COc1ccc(NC(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)cc1 64800367 QQZIYNBMIHHWAJ-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA c1cc(CN2CCC[C@@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)ccn1 22851586 CBWPKQRMQGJTMP-OAQYLSRUSA-N 394.519 2.593 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNS(=O)(=O)C(C)C)CC1 67724297 HNYWQXNTUBMPFL-UHFFFAOYSA-N 388.537 2.544 0 50 GFAA NS(=O)(=O)c1cc(C(=O)NC2CC(F)(c3cccc(Cl)c3)C2)cs1 435950229 VFAZMSNVQPROQG-UHFFFAOYSA-N 388.873 2.806 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCCC3CCCC3)C2=O)c1 67946476 GASWREOAAPDFMD-NRFANRHFSA-N 378.488 2.858 0 50 GFAA CCc1ccc([C@H](COC)NC(=O)NC2CCN(Cc3ccncc3)CC2)o1 173486224 DXZHHSNPPOCHQO-IBGZPJMESA-N 386.496 2.888 0 50 GFAA Cc1cccc(C(=O)N2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c1C 71738896 WRLLAVOJISBSBR-SFHVURJKSA-N 383.536 2.899 0 50 GFAA COc1cc2nccc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)c2cc1OC 334023589 FMWBVEDLOIAPMT-LJQANCHMSA-N 376.478 2.657 0 50 GFAA CCN(C(=O)c1cc2n(n1)CCO2)[C@H](c1cccnc1)c1ccc2c(c1)CCO2 365953761 RQHUJCHVBMOFBM-NRFANRHFSA-N 390.443 2.857 0 50 GFAA Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@](C)(C(=O)O)C1 237604375 IJQRBOCUSUCBSZ-SFHVURJKSA-N 379.819 2.969 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1[C@@H]1CCCCC1=O)c1ccccc1OC(F)F 155240701 TXJHSLAVDNPKGA-ZFWWWQNUSA-N 394.418 2.768 0 50 GFAA NCC[C@H]1CCCN(C(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 442620959 SVHCHAVKJSBRHB-TZMCWYRMSA-N 384.307 2.934 0 50 GFAA O=C(c1cnc(O)c(Br)c1)N1CCNC[C@H]1c1cccc(Cl)c1 261630614 CVYYUEWKFPVLKP-AWEZNQCLSA-N 396.672 2.990 0 50 GFAA CC(=O)[C@@H](C)OC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1 239653810 BLMHTKQHTDGODA-UKRRQHHQSA-N 387.457 2.961 0 50 GFAA COc1cc(C(=O)NC2CCN(C(=O)c3ccco3)CC2)c2ccccc2n1 216165816 HHYBXBBQPFUOIP-UHFFFAOYSA-N 379.416 2.871 0 50 GFAA Cc1ccc(=O)n(CC(=O)N2CCC[C@H](CCc3c(F)cccc3F)C2)n1 71639697 FGODZPKEARXCEF-OAHLLOKOSA-N 375.419 2.701 0 50 GFAA CCOc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2cccn2C)cc1OCC 175990016 DHVKSWMQLQHANF-GOSISDBHSA-N 399.491 2.916 0 50 GFAA C[C@H](NC(=O)CCn1cnc2ccccc2c1=O)c1nc2c(s1)CCCC2 223320786 IQXSKXCTZPESCA-ZDUSSCGKSA-N 382.489 2.999 0 50 GFAA COc1ccc([C@@H]2CCCCCN2C(=O)CCN2CCCS2(=O)=O)cc1 194531072 RARCLHFLPZRSLQ-SFHVURJKSA-N 380.510 2.565 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CC[C@@H](CO)C4)csc3C2)nc1 426360507 YWDWWXBPIBVURS-MRXNPFEDSA-N 385.533 2.718 0 50 GFAA CCc1c(C)nn(CCNC(=O)Nc2ccc(Cc3n[nH]c(C)n3)cc2)c1C 95523209 CFFSNRIDFHRSFX-UHFFFAOYSA-N 381.484 2.901 0 50 GFAA COc1ccc(Cc2noc(-c3ccc(N4CCC[C@@H](CO)C4)nc3)n2)cc1 96767056 XNFAPVXDLROTFP-MRXNPFEDSA-N 380.448 2.940 0 50 GFAA O=C(Cc1ccncc1)N1C[C@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95498678 FYMZXPDPFRQHFE-CEMLEFRQSA-N 383.442 2.991 0 50 GFAA CCN(Cc1nnc(-c2cccnc2)o1)CC1CCN(C2CCN(C)CC2)CC1 95507591 QVMZFYCMBWDBCO-UHFFFAOYSA-N 398.555 2.760 0 50 GFAA Cc1nc(-c2ncc(C(=O)NC[C@H]3CCc4ccccc4O3)c(O)n2)cs1 92076865 ZZPBTEMJYUTAIU-CYBMUJFWSA-N 382.445 2.738 0 50 GFAA O=C(Cc1ccc(F)cc1F)N1C[C@H]2CN(C3CCCCC3)C[C@@]2(C(=O)O)C1 534645941 LIYOVCUNUYSWPO-QVKFZJNVSA-N 392.446 2.685 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2cncc(O)c2)CC1 1940197879 ZBTSUACDIVXXEE-UHFFFAOYSA-N 382.464 2.701 0 50 GFAA Cc1cnccc1CNC(=O)N1CC(O)(c2cccc(Br)c2)C1 856885940 FIVTWONMDVMPFA-UHFFFAOYSA-N 376.254 2.566 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)NCc3noc(C4CC4)n3)c(C)s2)on1 825300292 JGBSQRQZIMPLHT-UHFFFAOYSA-N 380.451 2.759 0 50 GFAA N=c1nncc(-c2cccc(C(=O)N3CC4(CCC4)C[C@@H]3C(F)(F)F)c2)[nH]1 1875318006 ABAPVNYZPOAKOE-CQSZACIVSA-N 377.370 2.898 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)NCc1cc(COC)cs1 1875395655 HVTNGXBRCVRTPH-QKYXUNIQSA-N 389.521 2.722 0 50 GFAA Cc1ccc(F)cc1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397128 MQIHEDUHHDCQJN-GOSISDBHSA-N 385.487 2.611 0 50 GFAA O=C1CCCCCN1Cc1nnc(SC2CCOCC2)n1-c1cccnc1 1875261663 RBIHBDLLXWROJS-UHFFFAOYSA-N 387.509 2.836 0 50 GFAA C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cn(C)nc1C(F)(F)F 1875254046 VQGFFZYUCOWLBZ-SNVBAGLBSA-N 379.342 2.850 0 50 GFAA COc1ccccc1C1(CNC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)CCC1 185927502 UCZOEJICNSCVGR-IBGZPJMESA-N 393.487 2.933 0 50 GFAA CN(C)C(=O)N1C[C@H]2CC[C@@H](C1)N(C(=O)CCSCc1ccccc1)C2 1073336483 ZKHBNHWKGLBQIE-MSOLQXFVSA-N 375.538 2.914 0 50 GFAA C[C@@H](O)CN(C(=O)Nc1cc(Cl)ccc1Cl)C1CCS(=O)(=O)CC1 170091134 KRYKMMVSNCCNKA-SNVBAGLBSA-N 395.308 2.785 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)CCc2ccccc2Br)CC1 186636292 MRYQAALXTQPSED-UHFFFAOYSA-N 397.313 2.779 0 50 GFAA O=C(NCc1cc[nH]n1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 193408130 DWFSDJUTCRKXMD-UHFFFAOYSA-N 396.900 2.558 0 50 GFAA CSC1(CNC(=O)[C@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)CCC1 194483997 GAYJNOXTCCVBHR-KRWDZBQOSA-N 377.485 2.756 0 50 GFAA COCCN1CCC(NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)CC1 194746876 NGZLVEMPAJAYGX-UHFFFAOYSA-N 396.413 2.732 0 50 GFAA Cc1cc(COc2ccccc2)oc1C(=O)N1C[C@@H]2COCC[C@]2(C(=O)O)C1 1772712230 PVFVCBDFOBKYLV-VFNWGFHPSA-N 385.416 2.730 0 50 GFAA CC1CCN(S(=O)(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)CC1 5427633 KTJHORZZCJQGNY-UHFFFAOYSA-N 384.457 2.908 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@H](C)Cc3cccc(C)n3)CC2)CC1 11821303 UGQIEQNOOQGOSA-HXUWFJFHSA-N 386.584 2.977 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)C3CCN(C(=O)[C@H]4CCCO4)CC3)cc2)n1 12020509 PQWVWQUKMUIOJI-HXUWFJFHSA-N 396.491 2.845 0 50 GFAA CCC(=O)NCCc1nnc(SC[C@H]2CCCO2)n1-c1ccccc1F 12151877 SYGNORHMOKWFSL-CYBMUJFWSA-N 378.473 2.746 0 50 GFAA Cc1ncsc1CCNC(=O)[C@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12710504 MUOHCXUGDCAJMS-HNNXBMFYSA-N 375.469 2.688 0 50 GFAA Cc1c(CN2CC(=O)N(CC(C)C)C[C@H](OCc3ccccc3)C2)cnn1C 14745796 CVAZMCCSDBLAKJ-OAQYLSRUSA-N 384.524 2.614 0 50 GFAA O=C(NCc1ccccc1)c1cc2n(n1)C[C@@H](c1ccc3c(c1)OCO3)OC2 169759850 DXOBEQGKNPUQJD-FQEVSTJZSA-N 377.400 2.813 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccncc4)ccn3n2)c(C)c1 169775761 LJFXMTUGZKCDPU-UHFFFAOYSA-N 387.443 2.605 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1cc(-c2ccno2)ccc1C 1857674603 PRPCDTCAWQIHOX-IPELMVKDSA-N 376.478 2.964 0 50 GFAA CC(C)[C@H]1C[C@@H](O)CC2(CCN(c3nc(N(C)C)nc4c3CCCC4)CC2)O1 1857701216 HFXAXFHCLXBJNZ-VQIMIIECSA-N 388.556 2.956 0 50 GFAA Cc1ccc2oc(CN3CCOC[C@@H]3CCNC(=O)c3cnccn3)c(C)c2c1 1857707697 GXQOSRMTZKZXQG-KRWDZBQOSA-N 394.475 2.861 0 50 GFAA O=S(=O)(C1CC1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857712733 FMHBWPVBBBPRBN-UHFFFAOYSA-N 385.489 2.621 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2nn(C)c3cccc(Cl)c23)CC[C@@H]1N 1857738673 SHVKXOWVQPBHLO-JDFRZJQESA-N 378.904 2.766 0 50 GFAA CCc1nn(C)cc1C(=O)NCc1noc(-c2cccc(Br)c2)n1 225740210 LLBGRYJAJTYSNG-UHFFFAOYSA-N 390.241 2.725 0 50 GFAA CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)N1CCC(c2ccnn2C)CC1 124661299 GWYDXLCJVNPIPR-LJQANCHMSA-N 386.471 2.720 0 50 GFAA O=C(O)c1cccc(C(=O)N[C@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 908419942 FLWCHXXPMNPGQQ-SQNIBIBYSA-N 379.460 2.810 0 50 GFAA Cc1nc2ccc(C(=O)N[C@@H]3C[C@@H](Cn4cc(Cl)cn4)C[C@H]3O)cc2nc1C 2325785927 UUFDGYSNGLOGFZ-UPRAQXHNSA-N 399.882 2.666 0 50 GFAA NCc1cccc(-c2ccc(C(=O)N[C@@H]3C[C@@H](Cn4cccn4)C[C@H]3O)cc2)c1 2325793401 SORKYWTXZZEGQB-ZPMCFJSWSA-N 390.487 2.578 0 50 GFAA O=C1CSc2cc(C(=O)NCCCc3ccc4c(n3)NCCC4)ccc2N1 2325795363 BGJYOWKMTDTUMB-UHFFFAOYSA-N 382.489 2.847 0 50 GFAA O=C1c2sc3nnc(-c4cccs4)c(=O)n3c2C(=O)N1Cc1ccccc1 946908 DQMJLKTVRAPQCW-UHFFFAOYSA-N 394.437 2.676 0 50 GFAA Cn1ncc2c1ncn1nc(Cn3nc(C(F)F)c(Cl)c3C3CC3)nc21 2803018 CSRCINGRXUMKLC-UHFFFAOYSA-N 378.774 2.724 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(F)cc2)S(C)(=O)=O)cc1Cl 2978868 LTORLULOASXQNA-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA CCCc1nccn1S(=O)(=O)c1ccc(I)cc1 4649696 VNAOTXSGGQEDPG-UHFFFAOYSA-N 376.219 2.677 0 50 GFAA COc1cccc(N(CC(=O)NCC(C)C)S(=O)(=O)c2ccccc2)c1 4982902 AFLBRZFNRPUMBU-UHFFFAOYSA-N 376.478 2.663 0 50 GFAA CCN(CC1CCN(C2CCN(C)CC2)CC1)C(=O)[C@H]1CCCCN1CC 11944565 IARSYPJIOGVURM-OAQYLSRUSA-N 378.605 2.516 0 50 GFAA CSc1ccccc1N1C(=O)[C@@H]2C[C@H]1CN2Cc1cccn1-c1ncccn1 12125495 XWUZSBPBKJIMHB-WMZOPIPTSA-N 391.500 2.979 0 50 GFAA COCCN(C)Cc1ccc(OC)cc1OC[C@@H](O)CN1CCCCCCC1 14959634 KFVKCLCMPDLPGH-FQEVSTJZSA-N 394.556 2.779 0 50 GFAA CCn1c(CN2CCOCC2)nnc1SCC(=O)c1cn(C)c2ccccc12 19851978 MINFBIRJGFFCHZ-UHFFFAOYSA-N 399.520 2.597 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N(C)Cc3cn(C)nc3C)c2n1 20602455 MOFXUDOOJUPNEQ-UHFFFAOYSA-N 394.401 2.767 0 50 GFAA CCc1cc(-c2cccc(-c3ccn(C[C@@H](C)O)n3)c2)nc(N2CCOCC2)n1 23379757 DIIOPVYRIDJKIJ-MRXNPFEDSA-N 393.491 2.787 0 50 GFAA Clc1cccc(CN2CCN(c3nc4nonc4nc3NC3CC3)CC2)c1 55089252 PSGQMMYFKGYSJP-UHFFFAOYSA-N 385.859 2.563 0 50 GFAA O=C(CCNC(=O)c1ccccc1F)N[C@H](Cn1ccnc1)c1ccccc1 55198635 VZHXXLURNJQDDT-LJQANCHMSA-N 380.423 2.700 0 50 GFAA O=C(NCCc1ccco1)[C@@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71662844 AGYDRGNITTZJFO-HXUWFJFHSA-N 396.535 2.710 0 50 GFAA Fc1cccc(CN2CCN(Cc3cnc(NC[C@@H]4CCCO4)nc3)CC2)c1 72163800 AKPZYGZSTYPJSP-FQEVSTJZSA-N 385.487 2.524 0 50 GFAA CN(Cc1csc(-c2ccccc2)n1)C(=O)[C@H]1CSC(C)(C)C(=O)N1 72433163 FGTPJCJPVUNNQZ-CQSZACIVSA-N 375.519 2.779 0 50 GFAA Cc1[nH]c2c(C(=O)N3CCC4(CC3)[C@@H](OCCN(C)C)C[C@H]4O)cccc2c1C 92021263 LHAXLEDBOMPMEY-UXHICEINSA-N 399.535 2.719 0 50 GFAA Cc1cccnc1C[C@@H](C)NC(=O)Nc1ccc2c(c1)C(=O)N(C1CC1)C2=O 96138794 PUVJEILIDYJYPY-CYBMUJFWSA-N 378.432 2.901 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)Nc2cccn3nc(C)nc23)n1 97173366 PKJSQBIUSVWERZ-UHFFFAOYSA-N 379.346 2.519 0 50 GFAA O=C(CCc1nc2ccc(F)cc2[nH]1)N1CCC(N2CCSCC2)CC1 97551424 WGFVAIWPCUFLIU-UHFFFAOYSA-N 376.501 2.674 0 50 GFAA COc1ccccc1-n1cc(CN2CCN(CC=C(C)C)[C@H](CCO)C2)cn1 104398554 VSWIATXBQYNFLY-HXUWFJFHSA-N 384.524 2.716 0 50 GFAA O=C(N[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1cnc2sccn2c1=O 121728387 JNCZFWYULSETTL-CMPLNLGQSA-N 395.362 2.941 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCCCC[C@@H]1CO)n1c(S)nnc1-c1cccs1 153915314 SFXIRZAYMYSRFM-JHJVBQTASA-N 380.539 2.914 0 50 GFAA Cc1cccc2nc(CNC(=O)[C@@H]3CCN(c4ccc(F)c(F)c4)C3=O)n(C)c12 157812169 YHNUKWJLVXVWPR-AWEZNQCLSA-N 398.413 2.829 0 50 GFAA CC(C)Cn1nc(C(=O)NCCc2ccc3c(c2)CCO3)c2ccccc2c1=O 172147495 RAXZGWVGVFCQNS-UHFFFAOYSA-N 391.471 2.960 0 50 GFAA C[C@@H](CN1CCCCCC1)NC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 186017523 IQIYWQXOFADLTK-INIZCTEOSA-N 394.541 2.613 0 50 GFAA O=C1[C@H](NC2CCN(Cc3ccccn3)CC2)CCN1Cc1ccc(F)cc1 189047975 HBBRWDKOTDPCRV-OAQYLSRUSA-N 382.483 2.576 0 50 GFAA CN([C@@H]1CCCc2c1cnn2C)S(=O)(=O)c1cccc2c1OC(C)(C)C2 192643189 TZBPVJWDKVCEIR-MRXNPFEDSA-N 375.494 2.832 0 50 GFAA CC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@H](c1cccc(F)c1)c1cccc(Cl)c1 193520556 HKVHNNRZKDVOSD-QRVBRYPASA-N 390.842 2.666 0 50 GFAA O=C(O)COc1ccc(Cl)cc1CN1CCC(CN2CCCC2=O)CC1 214966070 CMWFIDUMMXILBZ-UHFFFAOYSA-N 380.872 2.638 0 50 GFAA C[C@]1(O)CCCC[C@@H]1[C@@H]1CCCN1c1cc(S(=O)(=O)N2CCCC2)ccn1 284512693 DXCDCXKMAIRJNU-HBFSDRIKSA-N 393.553 2.776 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N[C@@H]3CCCC[C@H]3S(C)(=O)=O)c2)no1 292586839 KDICIBSXSLHJCF-HUUCEWRRSA-N 378.454 2.522 0 50 GFAA COc1ccc(CNC(=O)[C@@H]2CCC(=O)N2Cc2ccc(C)cc2)cc1C(=O)O 299752804 VMOLANSPNMSJQR-SFHVURJKSA-N 396.443 2.509 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCc1cccc(OCC(=O)O)c1 299753085 WTOVBYGEIFIDKW-HXUWFJFHSA-N 394.427 2.730 0 50 GFAA CCN(C(=O)c1cccc(-c2ccc(C(F)(F)F)cn2)c1)[C@H]1COC[C@@H]1O 299768840 ZMSHBAYTNOBQRC-IRXDYDNUSA-N 380.366 2.989 0 50 GFAA NS(=O)(=O)c1cccnc1NCC1(c2ccc(Cl)cc2)CCOCC1 301278303 PGDOHYNPQYHLJR-UHFFFAOYSA-N 381.885 2.543 0 50 GFAA Cc1cc(CS(=O)(=O)N2CCCN(c3cccc(Cl)c3C)CC2)on1 328849885 UHGLQVJAIUVGKM-UHFFFAOYSA-N 383.901 2.987 0 50 GFAA CN1CCN(CC2(C)CCN(C(=O)c3ccccc3OCC3CC3)CC2)CC1 363810856 CHUQVLKVJPURPF-UHFFFAOYSA-N 385.552 2.965 0 50 GFAA CO[C@@H]1COC[C@H]1n1cc(C(=O)Nc2nc3c(ccc4ccccc43)s2)nn1 368555331 GYNGUFJRGPWVTJ-HUUCEWRRSA-N 395.444 2.880 0 50 GFAA CN1Cc2ccccc2[C@@H](NC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 378277621 OIRBASNJFUJJCH-RXVVDRJESA-N 395.478 2.981 0 50 GFAA Cn1c([C@H]2CCCN(C(=O)NCc3ccc(C(=O)O)o3)C2)nc2ccccc21 426547640 PINPVLBDSKEUER-ZDUSSCGKSA-N 382.420 2.954 0 50 GFAA CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCC[C@@H]1CCO 428792673 IOAROHGXJSVPCV-XFQXTVEOSA-N 385.508 2.519 0 50 GFAA O=C(NC[C@H](c1cccnc1)N1CCCCC1)N1CCC(c2cc[nH]n2)CC1 584889125 KNONFNRQFQOAEB-HXUWFJFHSA-N 382.512 2.921 0 50 GFAA COc1ccccc1N1CCN(C(=O)N[C@@H](CCSC)C(=O)O)CC1(C)C 670462227 JOOKYMPWIQFYAS-AWEZNQCLSA-N 395.525 2.512 0 50 GFAA Cc1cc(C)n2nc(C)c(C(=O)NC[C@@H](O)c3cc(F)c(F)c(F)c3)c2n1 856400344 VESHUKYWOORQPP-CQSZACIVSA-N 378.354 2.535 0 50 GFAA C[C@H]1CN(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)C[C@]1(C)CO 888101909 KEPBDPOZULKPLC-IFXJQAMLSA-N 382.526 2.882 0 50 GFAA CN1CCC(n2ccc(NC(=O)N3CC[C@@H](c4ccccc4)[C@@H](CO)C3)n2)CC1 952845719 JUKQSMOGCMQLDL-QUCCMNQESA-N 397.523 2.780 0 50 GFAA CCN1C[C@H](CN(C)S(=O)(=O)c2cccc3cccc(Cl)c23)CC1=O 952991246 VOGUHEBTCIBIBH-ZDUSSCGKSA-N 380.897 2.982 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2CC[C@H]1CN(Cc1[nH]cnc1C)C2 1073375091 LNXLXHGZJAAQCV-SJORKVTESA-N 384.528 2.795 0 50 GFAA CCc1nnc(N2CCC(CNC(=O)c3scc4c3OCCO4)CC2)s1 1506406314 JCCPDYIWKROJIY-UHFFFAOYSA-N 394.522 2.580 0 50 GFAA COc1ccccc1-c1ncc(CN2CC[C@@]3(C(=O)O)CCCN(C)[C@@H]3C2)cn1 1529093926 BJMIVJIQNJIQBK-KNQAVFIVSA-N 396.491 2.523 0 50 GFAA O=C(CCc1cc(Cl)no1)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1529093990 FGLGTKXGIOZJFI-NVXWUHKLSA-N 375.856 2.545 0 50 GFAA O=C1CN(C(=O)Cc2csc(-c3ccccc3)n2)C[C@H](Cc2ccccc2)N1 1772712921 VRCPUJLMASNNJE-SFHVURJKSA-N 391.496 2.922 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)c1nc(=O)c3ccccc3[nH]1)CC2 1857710504 AFDJNUAMJARYSC-UHFFFAOYSA-N 399.454 2.565 0 50 GFAA COC[C@@]1(O)CCOC[C@@H]1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 1875278517 GPDZFWKPFGMBCV-GMAHTHKFSA-N 394.471 2.586 0 50 GFAA Cc1nc2ccccc2c(=O)n1CCCC(=O)NC1(c2ccc(O)nc2)CCC1 1875321495 KULHIOSODDVBKP-UHFFFAOYSA-N 392.459 2.781 0 50 GFAA O=C(NC[C@H]1C[C@@H]2C[C@H]1[C@@H](O)[C@H]2O)[C@]1(Cc2ccccc2)CCc2ccccc21 1875405451 GPQXYIFVSGCPAW-BUEQVCRESA-N 391.511 2.607 0 50 GFAA CN1CC[C@@](C)(CNC(=O)C[C@@H](NC(=O)c2ccc(O)cc2)c2ccccc2)C1 2325810596 SZSQBJLBQHWFNV-OFNKIYASSA-N 395.503 2.711 0 50 GFAA O=C(N[C@@H]1CNCc2nccn2C1)c1ccc(Oc2ccc(Cl)cc2)cn1 2325856892 HHRVHYCAFSRYMG-CQSZACIVSA-N 383.839 2.626 0 50 GFAA CCCN1CCC[C@@]2(CCCN2C(=O)c2cc3ccccc3n(C)c2=O)C1=O 2356147521 AAIPBRYXQUDKFX-JOCHJYFZSA-N 381.476 2.546 0 50 GFAA COc1ccc(-c2onc(N3CCC(N4CCCC4=O)CC3)c2C(=O)O)cc1 2356158074 CAHIGADCLLYDTO-UHFFFAOYSA-N 385.420 2.640 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)c2ccccc2-n2cccn2)CC[C@@H]1O 2356166456 YNRFSUQGGUMWBF-GHTZIAJQSA-N 385.464 2.586 0 50 GFAA O=C(COc1ccccc1)N[C@H]1CCCC[C@@H]1NC(=O)COc1ccccc1 637776 YBRVMPVDCHTAQX-PMACEKPBSA-N 382.460 2.688 0 50 GFAA COc1ccc(C(=O)COC(=O)c2ccc(NC(=O)CCCC(=O)O)cc2)cc1 993363 XYYXILGFQAJHEK-UHFFFAOYSA-N 399.399 2.928 0 50 GFAA COc1ccc(S(=O)(=O)C[C@@](C)(O)C(=O)Nc2ccc(Cl)cc2)cc1 1388616 HDKOTSXOFOSMGX-QGZVFWFLSA-N 383.853 2.512 0 50 GFAA CCOc1ccccc1NC(=O)CSc1nnc(-c2cnccn2)n1CC 2522384 ORTNJDJWRLSLQW-UHFFFAOYSA-N 384.465 2.885 0 50 GFAA O=C(O)c1scc(I)c1I 5045721 DFODTRYHCRLKBY-UHFFFAOYSA-N 379.944 2.656 0 50 GFAA O=C(Cc1ccccc1)NC[C@H]1CCC2(CCN(Cc3cccnc3)CC2)O1 11971745 MMGIRZMYKAHPBE-OAQYLSRUSA-N 379.504 2.954 0 50 GFAA Cc1cccc(C(=O)NC(=S)Nc2cccc(C(=O)N3CCOCC3)c2)c1 12138717 OYNVJYOEVDLVCY-UHFFFAOYSA-N 383.473 2.594 0 50 GFAA CN(C)CCCN(C)Cc1cccc(OC[C@@H](O)CN2CCCCCC2)c1 12464532 BYDIYPUDTKONIG-NRFANRHFSA-N 377.573 2.686 0 50 GFAA CC[C@H](C(=O)NCc1cccnc1)N(c1cccc(Cl)c1)S(C)(=O)=O 13712276 JDVFQMHAQQAULW-MRXNPFEDSA-N 381.885 2.596 0 50 GFAA COc1ccccc1-n1cc(-c2ccnc(N3CC[C@@H](n4ccnc4)C3)n2)cn1 19113238 UBWUEPVHQZUFAY-QGZVFWFLSA-N 387.447 2.986 0 50 GFAA Cc1ccccc1N1CCN(c2ncccc2CNCc2nccn2C)CC1 19218051 UKYBMFZNMJOOOW-UHFFFAOYSA-N 376.508 2.740 0 50 GFAA O=C(c1ccc(NCCc2cccnc2)nc1)N1CCC(Cn2cccn2)CC1 20908543 KNKSUIDDRPXZPA-UHFFFAOYSA-N 390.491 2.880 0 50 GFAA O=C(Nc1cnns1)c1ccc(CN2CCC[C@H](Cn3ccnc3)C2)cc1 65452411 YXUFAOOWBPUQGS-INIZCTEOSA-N 382.493 2.899 0 50 GFAA COc1ccc(F)c(CN2CCC[C@@](O)(CNCC3(C(C)C)CC3)C2=O)c1 67740383 HNLWWNZHSVFRJE-OAQYLSRUSA-N 378.488 2.714 0 50 GFAA Cc1ccc(C)c(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCN(C)CC3)c2)c1 71721408 QQNDDWDWESKYGQ-UHFFFAOYSA-N 388.489 2.605 0 50 GFAA O=C(CCCOc1ccccc1)N[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O 72157529 STRMMFVBZZGCPA-YADHBBJMSA-N 380.488 2.699 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCN(c4cccc(C)n4)CC3)n[nH]2)cc1 91433988 JRCNGQUTZHXKDB-UHFFFAOYSA-N 377.448 2.751 0 50 GFAA COc1cccc(CCNC(=O)c2ccc(C)c(N3CCNC3=O)c2)c1OC 91745466 YYVCCSFPSAIZQW-UHFFFAOYSA-N 383.448 2.514 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 95501419 GWZGKDWMJVEVPA-SFHVURJKSA-N 386.459 2.994 0 50 GFAA Cc1ccc([C@H](CNC(=O)Nc2ccc(-n3nnnc3C)cc2)N(C)C)cc1 95528338 ZYOFIAQEBZAJIG-IBGZPJMESA-N 379.468 2.704 0 50 GFAA O=C1OCc2cc(NC(=O)N3CCC4(CC3)c3ccccc3C[C@H]4O)ccc21 96133725 BTQSTOJBMJQRKR-LJQANCHMSA-N 378.428 2.840 0 50 GFAA COc1ccc([C@@H]2[C@H]3C(=O)N(C(C)C)C(=O)[C@H]3ON2c2ccccc2)c(OC)c1 100626350 VVSVAJQQYLURHZ-AQNXPRMDSA-N 396.443 2.959 0 50 GFAA CC(=O)c1cc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)cs1 104473584 NCULOWVFXIKVLA-HXUWFJFHSA-N 393.597 2.692 0 50 GFAA Cc1c(C(=O)NCc2ccccc2CS(C)(=O)=O)cnn1C1CCCC1 123659014 MHYKYYKARLYSJM-UHFFFAOYSA-N 375.494 2.781 0 50 GFAA Cc1nc(=O)[nH]c(C)c1CCC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 153944257 ZMEYBAMPDWYDCM-UHFFFAOYSA-N 379.464 2.602 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1ccc(N3CCC(C)=N3)cc1)C[C@H]2O 169949747 STJKYGCDSDQPMU-GOSISDBHSA-N 395.459 2.979 0 50 GFAA CC(C)c1nnc(CCC(=O)NS(=O)(=O)C2=Cc3ccccc3CC2)o1 170649626 UMMOQHFCJAGUMQ-UHFFFAOYSA-N 375.450 2.559 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)NC2CCN(CCOC(C)C)CC2)o1 176611625 QURZODHMVUKROZ-IBGZPJMESA-N 393.528 2.814 0 50 GFAA Cc1cccc2c1N(C1CC1)CCN2C(=O)c1cccnc1N1CCOCC1 187324326 OKASNUJYWNJOBW-UHFFFAOYSA-N 378.476 2.856 0 50 GFAA CN(CCCO)C1CCN(C(=O)c2c[nH]nc2-c2cc3ccccc3o2)CC1 188929379 RULFTWWVSPYHRR-UHFFFAOYSA-N 382.464 2.742 0 50 GFAA CN(C)c1cccc(CCC(=O)N2CCn3c(nnc3-c3ccccc3)C2)c1 192226323 ONLDUXBPWKJFMP-UHFFFAOYSA-N 375.476 2.986 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1ccccc1I 229903350 ALWHPSLTCNMERY-DUBDDPSESA-N 379.197 2.993 0 50 GFAA CC(C)(C)c1ccc(OC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)cc1 239173611 OHACCAFHDGWNAZ-WDYSCTGBSA-N 379.456 2.943 0 50 GFAA O=C1[C@H]2[C@H]3C=C[C@H]([C@H]2C(=O)N1c1ccc(I)cc1)[C@@H]1C[C@@H]31 243915065 BMJVLFNSTCZFLG-WCBJTDJXSA-N 391.208 2.849 0 50 GFAA CN1CCC([C@@H]2CCN(C(=O)CNC(=O)c3ccc(C(F)(F)F)cc3)C2)CC1 270267398 SRTXDJGNTSXXOJ-MRXNPFEDSA-N 397.441 2.626 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)Nc1ccn(C)n1)CC2 275520155 DASWSGGCPSDSGS-MRXNPFEDSA-N 387.509 2.917 0 50 GFAA Cc1nn(C)c(C)c1OCC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 282813262 QZACGPANKKDCIF-HNNXBMFYSA-N 394.516 2.568 0 50 GFAA CS(=O)(=O)c1ccccc1CC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 284820320 XQSSMFMZZYIKHK-KRWDZBQOSA-N 393.892 2.886 0 50 GFAA Cc1cccc(N2CCN(C(=O)Nc3ccc(-n4nnnc4C)cc3)CC2)c1 299761978 STJNBYAMCIQFFR-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN([C@H](C(=N)O)c2ccccc2)CC1 328632913 LOYKXKXXMKEUQS-UXHICEINSA-N 381.480 2.956 0 50 GFAA O=C(NCCc1cnccn1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 369931038 RMAYFBNLSBJIBM-MRXNPFEDSA-N 380.370 2.821 0 50 GFAA CCc1c(C(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)nnn1Cc1ccccc1 421492399 UJNDKBUVZCKSMB-UHFFFAOYSA-N 389.459 2.769 0 50 GFAA Cc1ccc(C(=O)NCCc2nccc(-c3ccccc3)n2)cc1OCCN 426598854 KXSNEEKQLCHIAK-UHFFFAOYSA-N 376.460 2.762 0 50 GFAA C[C@H](Cc1ccccn1)NC(=O)N1CCC(C(=O)NCc2ccccc2)CC1 426634128 YLXSDAQOZVCCDH-QGZVFWFLSA-N 380.492 2.751 0 50 GFAA CC(C)c1ncc(CN(C)S(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)cn1 443078275 WLGRBMUVNUPLLY-UHFFFAOYSA-N 383.857 2.772 0 50 GFAA C[C@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)N1c2ccccc2C[C@@H]1C 456625613 JYFQUMWOOVDHSJ-GDZNZVCISA-N 395.434 2.734 0 50 GFAA Cc1ccc(CN2CCC(CNC(=O)N(Cc3cnn(C)c3)C3CC3)CC2)o1 584892664 OBUXQDNIHKASAS-UHFFFAOYSA-N 385.512 2.908 0 50 GFAA COc1ccc(CN(C)C(=O)NCCc2noc(C3CC3)n2)c2cccnc12 584902338 OSTYXPRHAHFVEO-UHFFFAOYSA-N 381.436 2.888 0 50 GFAA O=C(Cc1ccc(O)c(Cl)c1)NC[C@H]1CN(Cc2ccccc2)CCCO1 632760781 VQOFIOBOUKSCBO-SFHVURJKSA-N 388.895 2.995 0 50 GFAA CC(C)Cc1cc(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)nc(O)n1 1506408006 ATQSLQDWCNGUJE-UHFFFAOYSA-N 386.471 2.914 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)[C@@H](C)n3cnc4ccccc43)CC2)no1 1506410796 XKTILUDEPIIKPK-OAHLLOKOSA-N 396.495 2.571 0 50 GFAA CC(C)n1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)N=c1ccn(-c2ncccc2F)[nH]1 1857527963 MOFASGGQQFGHTI-DHUIEDIVSA-N 394.454 2.912 0 50 GFAA CC[C@]12COC(=O)N1CCN(C(=O)c1cccc(Cn3nc(C)cc3C)c1)C2 1857677064 WJFGRSWAZMIRMQ-NRFANRHFSA-N 382.464 2.605 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@]23CC[C@H]1O3)c1ccncc1 1857735863 VAZNTYPFIAPVES-GPQLQYNLSA-N 381.451 2.630 0 50 GFAA COc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4ccco4)C[C@]34CC[C@H]2O4)cc1 1857738475 JMXYRNGHOGWOFD-GPQLQYNLSA-N 382.460 2.698 0 50 GFAA O=C(Nc1ccccc1CCC(F)(F)F)N1CCc2c(O)nc(O)nc2C1 1875307431 YOEZROVCDDWODY-UHFFFAOYSA-N 382.342 2.973 0 50 GFAA C=CC(=O)N1CCC(C(=O)N=c2ccn(-c3cccc(C(F)(F)F)c3)[nH]2)CC1 1875365149 PODDEQPVQARDKF-UHFFFAOYSA-N 392.381 2.676 0 50 GFAA C=CC(=O)N(CC)CC(=O)N1CCC[C@@]2(CCCCN2C(=O)OC(C)(C)C)C1 1875369610 YSJPECNVLZEGFT-NRFANRHFSA-N 393.528 2.803 0 50 GFAA O=C(COc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O 2325785479 ARTXUIRKSNGXKP-MTNREXPMSA-N 391.471 2.885 0 50 GFAA Cc1cn2ccc(C(=O)N(C)CC(C)(C)CN=c3[nH]cncc3Cl)cc2n1 2325793358 QSIKZFSFXIMRLJ-UHFFFAOYSA-N 386.887 2.718 0 50 GFAA O=C(C[C@H]1CC1(Cl)Cl)NC[C@@H]1C[C@H](F)CN1C(=O)[C@H]1CC=CCC1 2325823039 CKATZHZMZYLFBI-XUXIUFHCSA-N 377.287 2.982 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2ccccc2I)C1 1182556 IJBXXZJRKLXBFF-NSHDSACASA-N 387.217 2.707 0 50 GFAA COC[C@@H](COCCCNC(=O)Nc1ccc(Br)cc1)OC 2052857 PBLKEPUESQCABM-AWEZNQCLSA-N 375.263 2.639 0 50 GFAA COCCCNC(=O)CN(c1ccccc1Cl)S(=O)(=O)c1ccccc1 2959249 JQFSAVRZVDDZIP-UHFFFAOYSA-N 396.896 2.688 0 50 GFAA CCOc1ccc(CCC(=O)Nc2ccc(S(=O)(=O)O)cc2)cc1OC 4582958 XRHPLKOMUASBRW-UHFFFAOYSA-N 379.434 2.912 0 50 GFAA COc1ccc(C2=NO[C@@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)C2)cc1 4904150 ZDPLHUXEHCFEAO-HXUWFJFHSA-N 383.423 2.676 0 50 GFAA C[C@H]1CN(C(=O)COc2ccccc2)[C@@H](C)CN1C(=O)COc1ccccc1 6183743 DAJHWAPCPADMDS-ROUUACIJSA-N 382.460 2.592 0 50 GFAA NC(=O)C1CCN(C(=O)C(=O)c2c(-c3ccccc3)cc3ccccn23)CC1 7604360 FJRJAGXIXOBYAW-UHFFFAOYSA-N 375.428 2.513 0 50 GFAA CNC(=O)c1cn(CCCc2ccccc2)cc(C(=O)NC2CCCC2)c1=O 12037677 AZXOOIPXOGLCLB-UHFFFAOYSA-N 381.476 2.513 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@H](CNC(=O)[C@H]2CCCN(C)C2)C3)n1 12040313 AKYRJSNWLNNYOH-ROUUACIJSA-N 380.492 2.522 0 50 GFAA COc1ccccc1CNC(=O)c1cn(CC(C)C)cc(C(=O)NC(C)C)c1=O 12570911 GJGJVHNLOQBWEC-UHFFFAOYSA-N 399.491 2.581 0 50 GFAA COc1ccc(CN2CC(=O)N(C3CCCCC3)C[C@@H](O)C2)c(Cl)c1OC 14530513 NHGHEHZRCQJFNB-INIZCTEOSA-N 396.915 2.695 0 50 GFAA CCCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@@H](NCc1ccon1)C2 14744660 IFSNWVIGEKRLJK-MRXNPFEDSA-N 385.512 2.944 0 50 GFAA CC[C@H](C)N1CCC2(CC1)C(=O)N(C1Cc3ccccc3C1)C(=O)N2CCOC 14754973 IZYGNLHDARCIAT-KRWDZBQOSA-N 399.535 2.698 0 50 GFAA COc1ccc(C(=O)NCc2ccncn2)cc1OC1CCN(C(C)C)CC1 14954614 MXQJHGHFRAQKMC-UHFFFAOYSA-N 384.480 2.667 0 50 GFAA O=C(Cn1c([C@@H]2CC(=O)N(C3CC3)C2)nc2ccccc21)N1CCCCCC1 32497895 BEXGILMRLBJJTR-MRXNPFEDSA-N 380.492 2.917 0 50 GFAA Cc1cc(C)n(CCCNC(=O)N2CCC[C@H](c3nnc4ccccn34)C2)n1 43099312 ZUAQXSOSCVTHJJ-KRWDZBQOSA-N 381.484 2.522 0 50 GFAA CC(C)c1nc(CNC(=O)c2ccc(N[C@H](C)Cc3ccncc3)nc2)no1 67769921 ZPFFTKIABLCGDV-CQSZACIVSA-N 380.452 2.956 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(CCn2nccc2C)CCO3)n1 67840574 QRPXCNILQGYGOS-UHFFFAOYSA-N 379.464 2.866 0 50 GFAA O=C(c1cnn2cc(CCO)cnc12)N1CCC[C@H](CCc2ccccc2)C1 71388547 UDSOARRFDUWXTP-GOSISDBHSA-N 378.476 2.749 0 50 GFAA COc1nc2c(cc1CNC(=O)c1cccc(C)n1)C(=O)N(C1CCCC1)C2 71681300 DXGVQIMHNYXVFE-UHFFFAOYSA-N 380.448 2.622 0 50 GFAA Cc1cc2c(cc1C(=O)N1CC[C@@H](Cc3cccc(C(N)=O)c3)C1)OCCO2 72158845 OFIAJHSFKDGMBY-INIZCTEOSA-N 380.444 2.570 0 50 GFAA CC(C)(O)CCc1cccc(C(=O)NCCc2nc(-c3ccccn3)no2)c1 72432988 ZRKYEBOYFMVZJP-UHFFFAOYSA-N 380.448 2.808 0 50 GFAA C[C@@H](CCn1cccn1)NC(=O)C1(Oc2ccc(Cl)cc2)CCNCC1 77538532 ZCDMDSFPGZQRHW-HNNXBMFYSA-N 376.888 2.633 0 50 GFAA Cc1c(CN2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)cnn1C 91620666 MJWIUYHAWCAWFR-UHFFFAOYSA-N 381.524 2.571 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1CCC(OCc2cccnc2)CC1 95354826 WIJZAISXZYZDFO-UHFFFAOYSA-N 375.432 2.755 0 50 GFAA CCn1nc(C)cc1C(=O)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95363199 QSNZDSYCOLJCCQ-HNNXBMFYSA-N 384.509 2.933 0 50 GFAA COc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3cc[nH]c3)C2)c(OC)c1 95498508 FWYOZHOCQXYKTF-INIZCTEOSA-N 399.491 2.981 0 50 GFAA CN1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 95502213 ROGIQFKMJXPLSA-QFIPXVFZSA-N 391.515 2.986 0 50 GFAA COc1ccc([C@@H]2CN(c3noc(-c4ccccc4)n3)C[C@H]2NC(C)=O)cc1 95523542 NUONREVPXLXCRF-RBUKOAKNSA-N 378.432 2.854 0 50 GFAA CCc1nc2n(n1)C[C@H](NC(=O)c1cnc(Cc3ccc(F)cc3)s1)CC2 114867937 MQENZNHSJCBCDI-CQSZACIVSA-N 385.468 2.772 0 50 GFAA COc1ccccc1N1CC[C@H](NC(=O)Nc2ccc(-n3ccnn3)cc2)C1 122132844 TYRZYXSUTSNNOS-INIZCTEOSA-N 378.436 2.676 0 50 GFAA CCN1CCc2nc(NC(=O)[C@@H]3CCCCN3C(=O)c3cccnc3)sc2C1 151955153 ZDKRCZMSLBXGOI-INIZCTEOSA-N 399.520 2.550 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(c3ncnc4ccsc34)CC2)c(F)c1 173298314 VGZKDIAIGIZOMF-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA Cc1nc(CS(=O)(=O)c2ncc(-c3ccccc3)n2CC(F)(F)F)no1 177529154 DNEMEOAADWMADZ-UHFFFAOYSA-N 386.355 2.778 0 50 GFAA CCc1c(C(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)cnn1-c1ccccc1 180549379 DKRWWLLKQUTPJX-UHFFFAOYSA-N 388.431 2.571 0 50 GFAA O=C([C@H](Cc1ccccc1)NCc1nc(-c2ccccc2)c[nH]1)N1CCOCC1 194419014 PYFSHUJCNGALRK-FQEVSTJZSA-N 390.487 2.636 0 50 GFAA CCn1nc(C)c(CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1C 237036180 JPQXQPPSYLEDRU-HXUWFJFHSA-N 383.540 2.507 0 50 GFAA COCCn1nc(C(=O)N2CCC(C)(c3ccc(Cl)cc3)CC2)ccc1=O 279985735 LPBOQJMLEPIOOU-UHFFFAOYSA-N 389.883 2.737 0 50 GFAA CCCS(=O)(=O)Nc1ccc(C(=O)N2CCC3(CCCN3C)CC2)cc1 368701236 ZBUSFZOVMNMLEO-UHFFFAOYSA-N 379.526 2.539 0 50 GFAA Cc1c(NC(=O)c2ccc3c(c2)N(C)CCO3)cccc1C(=O)N1CCOCC1 375427088 RVLAGRADLYSBOK-UHFFFAOYSA-N 395.459 2.548 0 50 GFAA CN(C)c1ncccc1CNC(=O)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 376581141 WNYAFTWGIZACMH-VAMGGRTRSA-N 380.492 2.862 0 50 GFAA COc1cccc([C@H](O)CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)c1 378146504 WSFSQMIYQDUDOA-VQTJNVASSA-N 382.460 2.540 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)c1ccc(-c2ccncc2)nc1O 426429797 LGHAGVVFZGZGNN-UHFFFAOYSA-N 388.427 2.906 0 50 GFAA O=C(O)c1ccc(CCNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)cc1 485471233 YKBVCHTYOZOLPE-UHFFFAOYSA-N 387.823 2.540 0 50 GFAA O=C(COC(=O)CCOC1CCOCC1)Nc1ccccc1C(F)(F)F 753529866 MISMPWZSYQVZCP-UHFFFAOYSA-N 375.343 2.773 0 50 GFAA Cn1ccnc1[C@@H]1CCCN(C(=O)Nc2cccc([C@]3(C)COC(=O)N3)c2)C1 881105826 KAWMKAOTLUFNLR-VLIAUNLRSA-N 383.452 2.787 0 50 GFAA CC[C@@H](NC(=O)c1cc(CC(C)C)nc(O)n1)c1ccc(S(C)(=O)=O)cc1 1506397548 WATIRSYLVVAHHY-MRXNPFEDSA-N 391.493 2.665 0 50 GFAA Cc1ccc2nc(C)c(C(=O)N3CC[C@@]4(C(=O)O)CCCN(C)[C@@H]4C3)cc2c1 1704298512 GWDDEORPRMXRDU-KNQAVFIVSA-N 381.476 2.863 0 50 GFAA O=C([C@H]1CCc2sc(N3CCOCC3)nc2C1)N1CCc2sccc2C1 1772818686 JRZLJAPQSYHLNU-ZDUSSCGKSA-N 389.546 2.731 0 50 GFAA Cc1cnc(CN2CCC3(CC2)CN(CCCc2ccccc2)C[C@H]3C(=O)O)[nH]1 1857691052 SXWZHBBSKRWGIT-FQEVSTJZSA-N 396.535 2.950 0 50 GFAA Cc1cc(N2CCO[C@@]3(C[C@@H]4CC[C@H](C3)N4[C@H](C)C(N)=O)C2)c2ccccc2n1 1857725412 VQACKNRCOURDOB-ZHSNQQFMSA-N 394.519 2.619 0 50 GFAA Cc1cc(CC(=O)NC[C@H]2[C@H]3CN(CCC(C)(C)C)C[C@]34CC[C@H]2O4)on1 1857728752 BTEASMDWXCWFSS-XKGFGPFHSA-N 375.513 2.557 0 50 GFAA CC[C@H](Oc1ccccc1)C(=O)NCCC(=O)N1CCOc2ccccc2C1 1875257959 IYXSQOIZRBZKTH-IBGZPJMESA-N 382.460 2.772 0 50 GFAA COCCn1ncc2c1[C@H](NC(=O)c1cc(Nc3ccccc3)ncn1)CCC2 1875258359 LVLIHYBHCYXOAE-QGZVFWFLSA-N 392.463 2.871 0 50 GFAA NC(=O)[C@H](CNC(=O)CC[C@H]1CCc2ccccc2C1=O)Cc1ccc(F)cc1 1875316131 WSPNROZVXJFASN-MSOLQXFVSA-N 396.462 2.811 0 50 GFAA O=C(Nc1cccc(CNC(=O)c2cc3c([nH]2)CCCNC3)c1)c1ccccn1 2325856009 YVJSOBIDSXPCBE-UHFFFAOYSA-N 389.459 2.628 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3sc4[nH]cnc(=O)c4c3C)C1)CC2 2356153900 ZDKSEOZJWDGYDO-FQEVSTJZSA-N 395.488 2.512 0 50 GFAA COc1cccc(N(CC(=O)NC(C)(C)C)S(=O)(=O)c2ccccc2)c1 2064841 MRRBCVKQKCZYDV-UHFFFAOYSA-N 376.478 2.805 0 50 GFAA O=C(Cc1cn2ccsc2n1)NC[C@H]1Cc2cccc(-c3cnccn3)c2O1 11784766 MRPUNSSHOSSQCW-OAHLLOKOSA-N 391.456 2.515 0 50 GFAA Cn1ccnc1CNC(=O)c1coc(COc2cccc(C(F)(F)F)c2)n1 12317194 XQYSDEGWBWMONQ-UHFFFAOYSA-N 380.326 2.936 0 50 GFAA CCCCn1c(CN2CCC[C@]3(CCCN(C)C3)C2)cnc1S(=O)(=O)CC 12434243 PYWHRKJVSNBCBO-FQEVSTJZSA-N 396.601 2.785 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 12443336 YSZQGTCOSLLRPG-OAQYLSRUSA-N 387.430 2.727 0 50 GFAA CCOC(=O)C1CCN(C2CCN(Cc3nc(-c4ccccc4)no3)CC2)CC1 12471970 PSYRLNZYJCEGGL-UHFFFAOYSA-N 398.507 2.976 0 50 GFAA O=C(CCN1CCCCCC1=O)N[C@@H]1CCCN(CCCc2ccccc2)C1 12718670 DSDUPVPSJOANMD-OAQYLSRUSA-N 385.552 2.993 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2nc(C)c(C)s2)cc1 13548655 XYWFZXYUTOTJCP-HNNXBMFYSA-N 379.507 2.860 0 50 GFAA CN(C)C(=O)c1cnn(-c2nccc(-c3ccc4c(c3)OCO4)n2)c1C1CC1 14959950 UDMKPRVOYCDAGX-UHFFFAOYSA-N 377.404 2.637 0 50 GFAA Cc1cccnc1CN1CCN(Cc2nc(CCc3ccccc3)no2)CC1 19338233 SJAKEBIJWQAUFD-UHFFFAOYSA-N 377.492 2.876 0 50 GFAA CN1CCN(CCC(=O)N2CCC[C@H](CCc3ccc(F)c(F)c3)C2)CC1 19839039 GJIPJHMBIAAZKX-GOSISDBHSA-N 379.495 2.774 0 50 GFAA CCCn1nc(C(=O)N2CCSCC2)c2c1CC[C@@H](NCc1ccncc1)C2 20385905 HGZCMANJWKGRKB-QGZVFWFLSA-N 399.564 2.524 0 50 GFAA COc1ccc(CNCCc2ccncc2)cc1OC[C@H](O)CN1CCCCC1 20540775 YNNXWRNMAOYCEH-OAQYLSRUSA-N 399.535 2.648 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC2CCN(C)CC2)CN1Cc1ccc2ccccc2c1 23362103 HBYMFSSUUVTHFT-PKTZIBPZSA-N 394.563 2.603 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@@H]2CCC(=O)N(Cc3cccc(F)c3)CC2)C1 43027820 RKPPZEBBFMRDRW-IEBWSBKVSA-N 376.472 2.982 0 50 GFAA Cn1cc(SCC(=O)NCc2cc(=O)[nH]c(C(C)(C)C)n2)c2ccccc21 63868250 YSUMQWBGCZYWNV-UHFFFAOYSA-N 384.505 2.968 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N2CCC3(CCNC(=O)CC3)CC2)c1 67867759 XGSMRBXDAOWKJH-UHFFFAOYSA-N 382.464 2.608 0 50 GFAA O=C(c1nc2ccc(Cl)cn2c1CN1CC(O)C1)N1CCCCCCC1 71419096 FXAULWKIYPXPIJ-UHFFFAOYSA-N 376.888 2.571 0 50 GFAA COc1ccc2cc([C@H]3CN(CC(=O)NCc4ccccn4)CCO3)ccc2c1 71753288 UDHYNVZLKIJVRM-JOCHJYFZSA-N 391.471 2.933 0 50 GFAA Cn1ncc2c(NCc3nc4ccccc4c(=O)[nH]3)nc(C3CCCC3)nc21 72422254 POAAEXOSEAJQOS-UHFFFAOYSA-N 375.436 2.870 0 50 GFAA COc1ccc(C(=O)N2CCC3(CC2)CN(CCC(C)C)C(=O)O3)cc1O 77489407 FUGJVHJWAMLQJN-UHFFFAOYSA-N 376.453 2.874 0 50 GFAA Cn1c2c(cc(C(=O)N3CCC[C@H](c4ccc(C(=O)O)cc4)C3)c1=O)CCCC2 95367564 QWQMWHBRNJMXKI-SFHVURJKSA-N 394.471 2.982 0 50 GFAA CCc1ccccc1OCCN(C)C(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 95367923 QMDHOKNOOFQRFW-SFHVURJKSA-N 381.476 2.530 0 50 GFAA CCN(C)C(=O)c1cccc(S(=O)(=O)NCCCc2ccccc2F)c1 95370036 OZSLGQZFQIJEGB-UHFFFAOYSA-N 378.469 2.829 0 50 GFAA CNc1nc(C(=O)N2CCC[C@H](c3nccn3Cc3ccncc3)C2)cs1 95502524 DFRZMFLNMDKXEL-HNNXBMFYSA-N 382.493 2.844 0 50 GFAA O=C(Nc1ccc(-c2ccn[nH]2)cc1)[C@@H]1CCCN(C(=O)Cc2ccncc2)C1 95509277 YSJOFDTUOUFKIE-GOSISDBHSA-N 389.459 2.892 0 50 GFAA O=C(CCC1CCN(C(=O)c2ccon2)CC1)Nc1ccc2c(c1)OCCO2 95521083 OSVSSBKETPUMCS-UHFFFAOYSA-N 385.420 2.717 0 50 GFAA O=C(c1ccc(Cl)cc1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95527784 QIQKJXIXNMGFJL-UHFFFAOYSA-N 398.894 2.989 0 50 GFAA CCCOCc1nc(C2(c3ccccc3)CC2)nn1[C@@H]1CCS(=O)(=O)C1 96149619 RXYMAGUKQWLMMQ-MRXNPFEDSA-N 375.494 2.644 0 50 GFAA Cc1nnc(SCCCNC(=O)c2ccc(N3CCCC3=O)cc2)s1 96164574 LXXKTTFVDYKGKX-UHFFFAOYSA-N 376.507 2.886 0 50 GFAA CC(C)c1cccc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)n1 131319383 DHOMIVNCFAKTRD-UHFFFAOYSA-N 393.475 2.993 0 50 GFAA COc1ccc(C)cc1-n1ccc(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)n1 147964575 RIIOQKCNSIOQCB-INIZCTEOSA-N 381.436 2.817 0 50 GFAA Cc1cccc(S(=O)(=O)CCCN2C(=O)N[C@](C)(c3cccs3)C2=O)c1 164858183 YOAKNTFRRMGOSV-GOSISDBHSA-N 392.502 2.688 0 50 GFAA COc1ccc(NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCCC4)cc1 169778343 KVPMBOLTJUYESJ-UHFFFAOYSA-N 380.448 2.880 0 50 GFAA COc1ccc(-c2nn3c(nc2=O)-c2ccc(F)cc2N2C(=O)CC[C@@]23C)cc1 170620136 VFBVYHOTMNQBNW-NRFANRHFSA-N 392.390 2.933 0 50 GFAA Cc1occc1C(=O)NC1CCN(CC(=O)N2c3ccccc3C[C@H]2C)CC1 170777856 VKBIWBNLCBFXHE-OAHLLOKOSA-N 381.476 2.760 0 50 GFAA CCn1cnc2c(c1=O)CCN(C(=O)Cc1nc(-c3ccc(F)cc3)cs1)C2 194326760 FMVAQJCVVWDSNC-UHFFFAOYSA-N 398.463 2.653 0 50 GFAA O=C(NCCN1C(=O)S/C(=C/c2ccc(F)cc2)C1=O)c1ccnc(F)c1 225523576 WWYYEKVBHIGRNO-NTEUORMPSA-N 389.383 2.826 0 50 GFAA O=S(=O)(NC1CCCC1)c1c(Cl)nc2ccc(Br)cn12 225703444 NFRMKILUUFNVGP-UHFFFAOYSA-N 378.679 2.971 0 50 GFAA C[C@H](N)[C@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 237454141 WIPWSYJONCRBLI-LPHOPBHVSA-N 386.517 2.860 0 50 GFAA O=C(NCCc1c[nH]c2ccc(Cl)cc12)[C@H]1CC[C@H](Cn2cnnn2)CC1 238924122 RCZUTYRJCUURID-HDJSIYSDSA-N 386.887 2.973 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNc1ncc(C(F)(F)F)cc1Cl 247778732 ZHIKENOIXWFNSP-RBJBARPLSA-N 385.773 2.973 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@@H]2CC[C@H]1CN(Cc1ccc(C(=O)O)cc1)C2 252021001 YODYBRCIRGZKOS-MSOLQXFVSA-N 383.448 2.613 0 50 GFAA Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)[C@H]2CCCN2Cc2ccccc2)cn1 269403682 DKUAXRBKBIIHFI-VQTJNVASSA-N 380.492 2.649 0 50 GFAA COc1ccc(CN(CC2CCC2)C(=O)[C@@H]2CCc3[nH]nnc3C2)c(OC)c1 286841337 UOXWGCSAGSDKBH-OAHLLOKOSA-N 384.480 2.756 0 50 GFAA C[C@H]1OCCN(C(=O)Nc2ccc3c(c2)N(C)CCO3)[C@@H]1c1nc(C2CC2)no1 297787683 WPQRLCHKUIYBPK-PXAZEXFGSA-N 399.451 2.770 0 50 GFAA Cc1cccc(C)c1OC[C@H](C)NC(=O)N1CCC[C@@H](CS(C)(=O)=O)C1 299153820 QXJHATPUAVURBD-DLBZAZTESA-N 382.526 2.537 0 50 GFAA CCc1oc(C(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1CN1CCCC1 299790143 AQRHZYLRJZZPLN-KRWDZBQOSA-N 381.476 2.973 0 50 GFAA Cc1ccc(N2CCC(C(=O)N3CCOC[C@@H]3c3nnc(C(C)C)o3)CC2)nc1 370439953 VUQOZNKRRIKZGM-QGZVFWFLSA-N 399.495 2.713 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)c1ccc2nccnc2c1 409414436 QSOPFYWXWAZOMQ-GHTZIAJQSA-N 382.508 2.983 0 50 GFAA biogenic Cc1nnc(CN(C)C(=O)c2cccc(-c3ccc(C(=O)NC4CC4)o3)c2)o1 426531539 FQYYPSZUPDBANO-UHFFFAOYSA-N 380.404 2.802 0 50 GFAA Cc1cccc(CN2CCN(C(=O)NC[C@H](C)c3nc(C)cs3)CC2=O)c1 584885245 KUTMPMCUOLOMFD-HNNXBMFYSA-N 386.521 2.917 0 50 GFAA Cn1ccnc1CN1CCN(C(=O)NCCCSC2CCCCC2)CC1 584891190 ZZBLAZALWZLOHU-UHFFFAOYSA-N 379.574 2.703 0 50 GFAA CCc1nc(C)sc1CNC(=O)N1CCc2nc[nH]c2[C@H]1c1ccccn1 584895205 SGRAGASRCYHYLL-GOSISDBHSA-N 382.493 2.989 0 50 GFAA CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 771641582 NDODEXJAYZQLFX-GOSISDBHSA-N 390.499 2.759 0 50 GFAA O=C(N[C@H](CO)C(=O)N1CCC=C(c2ccccc2)C1)OCc1ccccc1 908083426 KEVKDQUZMHQHKO-HXUWFJFHSA-N 380.444 2.590 0 50 GFAA O=C(N[C@H]1CC[C@H](O)CC1)c1ccccc1NC(=O)[C@H](C1CC1)N1CCCC1 911471570 QDHAFPJOQIVJEX-ZWOKBUDYSA-N 385.508 2.533 0 50 GFAA NC(=O)c1ccc(CN(C2CC2)S(=O)(=O)CCc2cccc(F)c2)c(F)c1 915815828 GYIRPVYXKRMKLX-UHFFFAOYSA-N 394.443 2.601 0 50 GFAA COc1ccc(CN2CC[C@H](O)[C@@H](C(=O)O)C2)cc1OCc1ccc(F)cc1 1529161771 PIUQFSWUULZLMH-ROUUACIJSA-N 389.423 2.681 0 50 GFAA Cc1ncc(CN(CCO)C(=O)[C@H](C)n2c(CC(C)C)nc3ccccc32)[nH]1 1704309744 RYCCWNMKHJXPON-HNNXBMFYSA-N 383.496 2.848 0 50 GFAA CC(C)N1CC[C@H](C(=O)N2CCCN(C(=O)c3c(F)cccc3Cl)CC2)C1 1772703179 HARIFBSQEMLMJM-HNNXBMFYSA-N 395.906 2.884 0 50 GFAA C[C@H]1CC[C@H](C(=O)NCC2(O)CCN(C(=O)CCCC(F)(F)F)CC2)C1 1775992514 QSYCINMFDUAPDH-KBPBESRZSA-N 378.435 2.625 0 50 GFAA CC(C)(C)[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3ccccc3-n3cnnc3)CC2)O1 1857670587 WJCUGEWFQCAHKP-VQIMIIECSA-N 398.507 2.828 0 50 GFAA Cc1nc(C)c(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)o1 1857691868 ZJRQNVFGJCEROB-YESZJQIVSA-N 375.856 2.889 0 50 GFAA Cn1nc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cc1C1CC1 1857716643 ODULZTNZHNQSGF-VXKWHMMOSA-N 394.519 2.976 0 50 GFAA Cc1nc(N2C[C@@H]3[C@H](CNC(=O)c4cscn4)[C@H]4CC[C@]3(C2)O4)sc1C 1857721376 LXHMNRZARRZNCN-YRWGSWDYSA-N 390.534 2.630 0 50 GFAA CCn1cc(CNC(=O)C[C@@H]2CCCN(c3nc4ncccc4o3)C2)c(C)n1 1857733090 UXAYLHJFAUEPST-HNNXBMFYSA-N 382.468 2.671 0 50 GFAA COc1ccc(O)cc1CN1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857738432 HOKQWQKKOLRPLB-DWLFOUALSA-N 380.444 2.675 0 50 GFAA COC12CCC(C(=O)N[C@@H]3CCc4ncc(Br)n4C3)(CC1)CC2 1875272355 FFLAWOHDZJNHAV-AXOLYNHLSA-N 382.302 2.816 0 50 GFAA Cc1cnc2n1CC[C@@H](NC(=O)N(C)[C@@H](c1ccc(F)cc1)c1ncccn1)C2 1875329465 XBGMHFHOIBLUDK-MJGOQNOKSA-N 394.454 2.866 0 50 GFAA Cc1nc2c(C(=O)N3CCC[C@H]3c3nc(-c4ccncc4)no3)ccnc2n1C 2100473713 WAVBMCVDTHTTFL-HNNXBMFYSA-N 389.419 2.699 0 50 GFAA CCc1ccc(N2C(=O)NC(=O)[C@@H](Cc3ccc(OC)cc3OC)C2=O)cc1 1088838 NFQNHGBLQCRMRK-QGZVFWFLSA-N 382.416 2.708 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSc1ccccc1)c1ccc(F)cc1 2991426 CFLWRRRKGCQLFJ-UHFFFAOYSA-N 382.482 2.500 0 50 GFAA Cn1c(CN2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)nc2ccccc21 2356152421 ILNOQWULXBESRG-PMAPCBKXSA-N 396.535 2.834 0 50 GFAA Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1CCOC2(CCOCC2)C1 135639681 QNNDLTOEVCYDDI-IBGZPJMESA-N 377.525 2.914 0 50 GFAA CCn1nc(C)c(NC(=O)CN2CCC[C@H]2c2nc(-c3ccncc3)no2)c1C 65395567 OQLKFWGAKNDEBO-INIZCTEOSA-N 395.467 2.740 0 50 GFAA O=C(NCCO)c1ccc([C@@H]2CCCN2Cc2ccc3nsnc3c2)s1 20860127 LIDVVYMOBCBVFB-HNNXBMFYSA-N 388.518 2.812 0 50 GFAA C/C(=C\c1ccco1)CN1CCN(c2ccc(CN3CCOCC3)cn2)CC1 65490184 PMIOQCILFKQTKB-XDJHFCHBSA-N 382.508 2.732 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCCO2)ccc1N(C)S(=O)(=O)c1ccccc1 65363373 PHKGHCDTSOAVCI-QGZVFWFLSA-N 388.489 2.729 0 50 GFAA CN(Cc1cccc(C(=O)Nc2cnn(C)n2)c1)Cc1n[nH]c2c1CCCCC2 67675030 AGHXUOBOAPIBHD-UHFFFAOYSA-N 393.495 2.691 0 50 GFAA CC(C)Nc1ccnc(N2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)n1 72419727 WTWFKEWOEJQAKM-MRXNPFEDSA-N 391.466 2.648 0 50 GFAA C[C@H]1CN[C@H](C)CN1Cc1cccc(C(=O)Nc2ccc3c(c2)CC(=O)N3)c1 65395178 WJBRAQDQDUCUMA-CABCVRRESA-N 378.476 2.616 0 50 GFAA CCn1ncnc1-c1c(-c2ccccc2)ncn1CCCc1nnc(N)s1 65376462 REXHPTFOGZXCKF-UHFFFAOYSA-N 380.481 2.895 0 50 GFAA Cc1cc(C(=O)NCCNC(=S)Nc2cc(Cl)ccc2Cl)nn1C 2740896 QHRGAYCTDZEFLB-UHFFFAOYSA-N 386.308 2.752 0 50 GFAA CCCc1cc2c(=O)n(NC(=O)c3nn(C)c(C)c3Cl)c(C)nc2s1 2779572 YMSHGORASXEGHE-UHFFFAOYSA-N 379.873 2.798 0 50 GFAA CCOC(=O)CN1CCc2c(C)nc3c(-c4ccc(OC)c(OC)c4)cnn3c21 4050950 QUHZHPMUQYOJNG-UHFFFAOYSA-N 396.447 2.648 0 50 GFAA O=C(c1cc2c(cc1O)OCO2)N1CCc2c(ncn2-c2ccc(F)cc2)C1 436663149 LERIKBVESGBFHP-UHFFFAOYSA-N 381.363 2.644 0 50 GFAA Cc1cc(C)cc(-c2nnc(NC(=O)N3CC[C@H]4OCCN(C)[C@@H]4C3)s2)c1 285168694 MBBLOIASXWALJZ-HZPDHXFCSA-N 387.509 2.759 0 50 GFAA CN(C)S(=O)(=O)c1cccc(NC(=O)N[C@H]2CCOc3c(F)cccc32)c1 373655871 ZCKWQXRKRZMAHV-INIZCTEOSA-N 393.440 2.721 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3ccc4c(c3)OCO4)CC2)C1)N1CCCC1 71757153 GIWHUPLZGNOIGA-LJQANCHMSA-N 399.535 2.714 0 50 GFAA O=C(c1ncn(-c2ccccc2)n1)N1CCCC[C@H]1c1nnc2n1CCCC2 158785662 PZSYKXJQDSXVFZ-INIZCTEOSA-N 377.452 2.563 0 50 GFAA COc1nc2c(cc1CNC(=O)[C@]1(C)CCCCO1)C(=O)N(C1CCCC1)C2 71498969 ONFUWUQVLFYOII-NRFANRHFSA-N 387.480 2.564 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)[C@H]3[C@@H](N)[C@H]4CC[C@@H]3C4)CC2)OC1=O 77284684 KXNRPJIKNAAMJE-XDNAFOTISA-N 377.529 2.754 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](C)C[C@@H](C(=O)O)C2)c1NC(=O)c1ccncc1 263398180 ZQKNDBZILDACMC-XJKSGUPXSA-N 381.432 2.825 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)NCc2cccc(Cl)c2Cl)CCC(=O)N1 223823318 PGSLWFIQBHYTQS-QGZVFWFLSA-N 387.263 2.903 0 50 GFAA O=S(=O)(N[C@H]1CCCCN(CC2CC2)C1)c1ccc(-c2ccon2)s1 82134306 DIXPDFTVGSWEAM-AWEZNQCLSA-N 381.523 2.946 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1c1nc(-c2ccc(=O)n(C)c2)no1 289008529 HRMBGMBVGCNBEI-MRXNPFEDSA-N 394.431 2.811 0 50 GFAA CCN(C)C1(CNC(=O)c2cccc(-c3ncc(F)c(NC)n3)c2)CCCC1 426604679 XNIYXRAMXGZAEM-UHFFFAOYSA-N 385.487 3.319 0 50 GFAA Cc1cnn([C@H]2CCN(C(=O)NC3CCN(CCc4ccccc4)CC3)C2)c1 290619330 GFFOCOYAMHBRFW-NRFANRHFSA-N 381.524 2.855 0 50 GFAA CC(C)(C)COC(=O)N1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 82116078 YOVHFVVYNUPFIJ-FQEVSTJZSA-N 376.501 2.840 0 50 GFAA CC[C@@H](CNC(=O)c1csc2c1CCN(Cc1c(C)noc1C)C2)N(C)C 426505968 XRMKGMDQJVXTTP-HNNXBMFYSA-N 390.553 2.981 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1ccc3ncccc3c1)CC2 91829369 ABRPKAZZZGDAEY-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC(=O)c2csc(C)c2)CN1CC1CCCCC1 92096566 CXXWAPMBIWGFLH-MSOLQXFVSA-N 377.554 2.946 0 50 GFAA CN(Cc1nccs1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2)c1 97394110 XDQOBFADWDKFBN-UHFFFAOYSA-N 388.474 2.611 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)CCc1nc2ccccc2[nH]c1=O 91974226 FMDRJWYKAZPHOT-UHFFFAOYSA-N 379.464 2.506 0 50 GFAA Cc1ccccc1SC1CCN(C(=O)c2cnn3cc(CCO)cnc23)CC1 97578680 UVVAFMPQLIPCSD-UHFFFAOYSA-N 396.516 2.969 0 50 GFAA Cc1ccccc1CC(=O)N1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1 92066611 DHSHGBFVEIECQE-HXUWFJFHSA-N 384.520 2.948 0 50 GFAA O[C@H](COc1ccc(F)cc1)CN1CCC[C@@H](c2nnc3n2CCCCC3)C1 298206208 IZJAJWGPJZEVHC-AEFFLSMTSA-N 388.487 2.763 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(c3ccncn3)CC2)C1 298507142 BBQMGAQTFCPILM-QGZVFWFLSA-N 395.507 2.901 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cc(C3CC3)nc3onc(-c4ccccc4)c23)CCO1 299751874 SBQXOCZJRKBQQJ-INIZCTEOSA-N 393.399 2.693 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 299774335 CDZJBKCCCKNHAJ-UHFFFAOYSA-N 384.440 2.582 0 50 GFAA O=C(NCC1CCN(C(=O)Cc2ccncc2)CC1)c1ccc2ncsc2c1 827910701 WEORAVCFCZSEHD-UHFFFAOYSA-N 394.500 2.902 0 50 GFAA O=C(CCc1cccnc1)NCC1CCN(Cc2ccccc2C(=O)O)CC1 827822476 ULZIFKVQADMQSD-UHFFFAOYSA-N 381.476 2.741 0 50 GFAA Cc1cc(C)nc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)n1 827696045 IVFQXFYWVOFMQF-GOSISDBHSA-N 380.492 2.929 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)C[C@H]3NC(=O)c4ccccc43)cc2)CC1 823765058 QZKZEWGHJZRSLZ-HXUWFJFHSA-N 379.460 2.973 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O)c1cccc(CO)c1 1875402355 DLANBVIIKSFDFF-IOMROCGXSA-N 391.471 2.612 0 50 GFAA Cn1c(C(=O)N2CC(C)(C)[C@@H]2c2nccn2-c2cccc(F)c2)cccc1=O 952891022 SHEJZBSUUCYLFK-SFHVURJKSA-N 380.423 2.933 0 50 GFAA Cc1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccncc3)C2)cc2sc(N)nc12 952991430 RMVNHJSLVLNHTP-ZDUSSCGKSA-N 381.461 2.569 0 50 GFAA Cc1c(NC(=O)[C@H]2CN(C)C(=O)c3ccccc32)c(=O)n(C2CCCCC2)n1C 880517702 OQUVRJNOBYKBIY-SFHVURJKSA-N 396.491 2.808 0 50 GFAA O=C(Nc1ccc2c(c1)COB2O)c1cc2ccccc2n1Cc1ccncc1 1776003208 YCFFYMQPABKZFR-UHFFFAOYSA-N 383.216 2.555 0 50 GFAA CSc1ncccc1C(=O)N[C@H]1CCOC[C@@H]1OCc1c(C)noc1C 1565508449 BTDGBMVMOXNIPC-HOTGVXAUSA-N 377.466 2.512 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC(Cn3ccnn3)CC2)ncn1 275709865 NZCPMOLXIXNEHX-XLIONFOSSA-N 385.516 2.600 0 50 GFAA Cc1noc(NC(=O)COC(=O)c2oc3ccc(Br)cc3c2C)n1 170616627 RFUUJABPFPYFRP-UHFFFAOYSA-N 394.181 2.991 0 50 GFAA CNC(=O)c1ccc(CN(C)C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)cc1 172191460 NGLQWYBBWZPWAG-IBGZPJMESA-N 398.482 2.996 0 50 GFAA Cn1cc(CNS(=O)(=O)CCc2ccc3c(c2)CCO3)c(-c2ccccc2)n1 189812883 NUQWHMNHSPIMTO-UHFFFAOYSA-N 397.500 2.684 0 50 GFAA OC[C@@H]1CCCCN1c1cc(N2CCC(CCCN3CCCC3)CC2)ncn1 192345468 MJBKOMQNCIXZKK-FQEVSTJZSA-N 387.572 2.920 0 50 GFAA Cc1cccc(Cn2ncc(C)c2NC(=O)CCC(=O)Nc2nncs2)c1 1506418773 IYXMENQOKLZUPZ-UHFFFAOYSA-N 384.465 2.757 0 50 GFAA O=C(NC[C@H]1CCCN(c2ncnc3[nH]ccc23)C1)c1ccc2c(c1)CCCO2 1506418889 UMYGYAZMOHQXNU-OAHLLOKOSA-N 391.475 2.929 0 50 GFAA CS(=O)(=O)N1CCN(C(=O)[C@H](Sc2ccccc2)c2ccccc2)CC1 1054311 CDFRHBUZRFYXTO-GOSISDBHSA-N 390.530 2.624 0 50 GFAA O=S1(=O)N=C(Nc2ccccc2I)c2ccccc21 1127762 UDTAMSCECHSRLO-UHFFFAOYSA-N 384.198 2.852 0 50 GFAA CCOC(=O)C1=C(c2ccc(OC)cc2)NC(=O)N[C@@H]1c1ccc2c(c1)OCO2 831855 UIOXYAFIQOEHQU-LJQANCHMSA-N 396.399 2.752 0 50 GFAA O=C(c1ccc(Cn2ccnc2)o1)N1C[C@H]2CNC[C@@]2(CCc2ccccc2)C1 1772703154 GXNFPHPAVGWDRO-XXBNENTESA-N 390.487 2.819 0 50 GFAA C[C@@H](c1ccncn1)N(C)c1nc2nonc2nc1N(C)Cc1ccccc1 11812824 PKOOHGKRIWGUPT-ZDUSSCGKSA-N 376.424 2.637 0 50 GFAA COc1ccccc1OCC(=O)N[C@H]1CC(=O)N(Cc2ccccc2Cl)C1 11842756 JCBCJSSBXRGPGW-HNNXBMFYSA-N 388.851 2.645 0 50 GFAA O=C(CCN1CCCO1)N(CC1CCN(C2CCCC2)CC1)C[C@H]1CCCO1 11874447 OKDMFHQWVDLTFN-OAQYLSRUSA-N 393.572 2.676 0 50 GFAA Cc1cc(C)c(C(=O)N[C@@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)o1 11879980 OWAYLHYKOPHGRQ-MRXNPFEDSA-N 384.480 2.967 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@@H](CNC(=O)c2snnc2C)C3)n1 12131177 RHBBHMYXMBHHRA-CQSZACIVSA-N 381.461 2.654 0 50 GFAA CS(=O)(=O)c1ncc(CN2CCCC[C@H]2CCCO)n1CC1CCCCC1 12445343 NNKSIZYVUNZZPE-SFHVURJKSA-N 397.585 2.994 0 50 GFAA O=C(C1=CCCC1)N1CCC(Oc2cccc(C(=O)N3CCOCC3)c2)CC1 14960863 ZBZBYRGXGNSKIC-UHFFFAOYSA-N 384.476 2.639 0 50 GFAA Cc1c(C(=O)NCC(C)C)sc2ncnc(NCCCN3CCCC3=O)c12 14989138 XFWGJLVPKSTQOA-UHFFFAOYSA-N 389.525 2.810 0 50 GFAA CN(C)C(=O)N1CCN(S(=O)(=O)c2ccc3oc4ccccc4c3c2)CC1 4649518 PQVHLIFAUKMJML-UHFFFAOYSA-N 387.461 2.574 0 50 GFAA COC(C)(C)C(=O)N1CCC2(CC1)CN(Cc1ccc(C)s1)C[C@@H]2C(=O)O 1857699637 XHZFHNFISFMUSO-MRXNPFEDSA-N 394.537 2.607 0 50 GFAA O=C(c1ccon1)N1CCC(C2CCN(Cc3nccn3C3CC3)CC2)CC1 1857722800 OMOLONODKBPQIS-UHFFFAOYSA-N 383.496 2.970 0 50 GFAA Cc1ccc(F)c(CN2C[C@@H]3[C@H](CNC(=O)c4cnc(C)[nH]4)[C@H]4CC[C@]3(C2)O4)c1 1857726094 WJBTWUVTQJVJJE-VTAPXXACSA-N 398.482 2.575 0 50 GFAA CC1=C[C@@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@@H]4[C@]2(O)[C@@H]1O)[C@@H]1[C@H](C[C@@H]3C)C1(C)C 504185777 ONMDPPVVEFWDOD-ZSQITRIKSA-N 388.504 2.614 0 50 GFAA biogenic O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(N2CCCC2=O)c1 134830672 SJUIMEALRAXQKA-OAHLLOKOSA-N 384.867 2.871 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(S(=O)(=O)Cc3ccc(F)cc3)C1)CC2 1704315897 QIHAJBOFMAFIGD-LJQANCHMSA-N 375.469 2.734 0 50 GFAA Cc1ccc(CNc2nc3c(c(=O)[nH]c(=O)n3C)n2Cc2ccc(F)cc2)cc1 637627 XOEQGNJTMXMKDX-UHFFFAOYSA-N 393.422 2.531 0 50 GFAA CCCc1c(C(=O)OCc2nc3cncnc3[nH]2)nnn1-c1cccc(Cl)c1 2325735842 KVFRGMRVUBFACO-UHFFFAOYSA-N 397.826 2.897 0 50 GFAA CN(c1cc(C(=O)NCCN2C(=O)COc3ccccc32)ccn1)C1CCCC1 2325748585 OJKRQLKWNRVEAO-UHFFFAOYSA-N 394.475 2.616 0 50 GFAA COc1ccc2c(c1)CC[C@]2(O)CNC(=O)c1cnn(C)c1Cc1ccccc1 2325791076 QUMNODCMCGQXBY-QHCPKHFHSA-N 391.471 2.583 0 50 GFAA CC1=N[C@@H](CCS(=O)(=O)C(C)C)C(=O)Nc2ccc(Br)cc21 2325796295 HFNVQNZTBWCLEW-AWEZNQCLSA-N 387.299 2.792 0 50 GFAA CCc1ccc(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 101128960 LEDKUPVYELOHHM-HXUWFJFHSA-N 379.460 2.830 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(F)cc2)cc1Cl 1057427 DGHJAYZXFPRJJG-SNVBAGLBSA-N 386.832 2.793 0 50 GFAA CCOc1ccc([C@H](C)NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1 2851077 FWWQSISCVPFVDH-LBPRGKRZSA-N 379.507 2.780 0 50 GFAA COc1ccccc1NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 2872419 WWUXVAFVEWLPMN-UHFFFAOYSA-N 382.869 2.749 0 50 GFAA CN1CCCC[C@H]1CNC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12574720 OSBTUCQJOAEHGJ-HNNXBMFYSA-N 381.402 2.559 0 50 GFAA CN(C)[C@H]1CCN(C(=O)c2cn(C(c3ccccc3)c3ccccc3)nn2)C1 12584070 QELJKFHMRYFTER-IBGZPJMESA-N 375.476 2.692 0 50 GFAA CC[C@H]1CN(c2ccc(C(=O)NCCCn3ccnc3C(C)C)cn2)CCN1C 15077406 JTPNDLLOAGEEGG-IBGZPJMESA-N 398.555 2.752 0 50 GFAA CCC(=O)N1CCN(c2ccccc2NC(=O)COc2ccc(OC)cc2)CC1 16527232 ZHIOFJFQEIRWNB-UHFFFAOYSA-N 397.475 2.771 0 50 GFAA COc1ccc2[nH]cc(CCN[C@@H]3CC(=O)N(c4ccc(F)cc4)C3=O)c2c1 18240782 WIZBQZWWHWFZPW-LJQANCHMSA-N 381.407 2.780 0 50 GFAA Cn1cc(CNc2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)cn1 19740055 DGTGFIMSRKBFRH-UHFFFAOYSA-N 393.495 2.566 0 50 GFAA CCc1ccc([C@@H]2CC(=O)Nc3c2c(C)nn3-c2ccc3nnc(C)n3n2)cc1 21726249 YWAJWIPYZMPFOD-INIZCTEOSA-N 387.447 2.963 0 50 GFAA COC[C@H](C)NC(=O)C1CCN(Cc2cnc(-c3cccc(C)c3)nc2)CC1 55309109 CXGXOAACLGPFKM-KRWDZBQOSA-N 382.508 2.815 0 50 GFAA Cc1cc2c(cc1NC(=O)CN(C)C)NC(=O)C[C@H]2c1ccc2nonc2c1 65387406 HHYMDOMLKHRMSW-ZDUSSCGKSA-N 379.420 2.505 0 50 GFAA CCN1C(=O)COc2cc3c(cc21)[C@H](c1cccc(OC)c1OC)CC(=O)N3 65502873 ZHIHVFSDMJMXGD-ZDUSSCGKSA-N 382.416 2.923 0 50 GFAA CCn1ccnc1CNC[C@@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67457813 XXECLWZFSCSPKD-QFIPXVFZSA-N 384.524 2.670 0 50 GFAA CCN(CCO)C(=O)[C@@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 67909701 JXPWVAUUPAPZLW-GOSISDBHSA-N 394.519 2.690 0 50 GFAA Nc1nc(CNC(=O)c2coc(COc3cccc4cnccc34)n2)cs1 67966851 LHGPGZBMLFDDKU-UHFFFAOYSA-N 381.417 2.771 0 50 GFAA COC(C)(C)CNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 71422315 SPZLSLYGMRCIES-HXUWFJFHSA-N 387.568 2.904 0 50 GFAA CC[C@H]1CN(C(=O)c2c(C)[nH]c(C)cc2=O)CCC(=O)N1Cc1ccccc1 71759693 KXDVIKGLPJMMHR-SFHVURJKSA-N 381.476 2.645 0 50 GFAA O=C(Cn1cnc2ccccc21)N1CCC(c2nnc3n2CCCCC3)CC1 82087488 IOMHKTVOUXPSKQ-UHFFFAOYSA-N 378.480 2.760 0 50 GFAA CN1CCc2nc[nH]c2C12CCN(Cc1c[nH]nc1-c1ccc(F)cc1)CC2 91425820 NXJXUOQBSMEPQN-UHFFFAOYSA-N 380.471 2.918 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)C(=O)c1cccn1C 95497220 JNXCSNICJTYPFM-UHFFFAOYSA-N 385.483 2.760 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 101293629 MBDWPUWOQANSFQ-BNBDDXAPSA-N 376.840 2.708 0 50 GFAA CCS(=O)(=O)Nc1ccccc1C(=O)NCC1([C@@H](O)c2ccccc2)CC1 155866696 FPXRBLGAPXXHKE-SFHVURJKSA-N 388.489 2.692 0 50 GFAA CN(Cc1c(-c2ccccc2)nc2ccccn12)C1CCN(S(C)(=O)=O)CC1 156934765 NCXCMTABWRCZKK-UHFFFAOYSA-N 398.532 2.857 0 50 GFAA CC[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2ccccc2O1 173611506 YRBFHIQRIWIVNW-IBGZPJMESA-N 393.487 2.873 0 50 GFAA C[C@H]1CN(Cc2cccc(CNC(=O)c3cc(N4CCCC4)ccn3)c2)CCO1 188757875 SIDUXNQPCDLABL-SFHVURJKSA-N 394.519 2.833 0 50 GFAA Cc1cccc2c1OCC[C@@H]2NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 190662347 BTQOZXVNLVSVRT-SFHVURJKSA-N 386.473 2.689 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)Nc2cnn(C3CCCC3)c2C)c1 193411716 PPYAUZFLQIZWNB-UHFFFAOYSA-N 377.470 2.859 0 50 GFAA COc1ccccc1CN(C)C(=O)C(=O)Nc1ncc(Br)cc1C 225688390 KUYJVKALBQMVHR-UHFFFAOYSA-N 392.253 2.758 0 50 GFAA C[C@@H](NC(=O)C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc2c(c1)OCO2 225742520 SMRREDUFGGKAKX-SSDOTTSWSA-N 387.339 2.707 0 50 GFAA CN1[C@H]2CC[C@H]1CN(C(=O)Nc1ccc(S(C)(=O)=O)c(C(F)F)c1)CC2 240626676 HIMNVYPDZKSOIO-STQMWFEESA-N 387.452 2.728 0 50 GFAA CC[C@H](C(=O)Nc1nccs1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 244899364 ZIPSVZMZPZUNCE-OAHLLOKOSA-N 385.493 2.840 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCc4cccc(F)c4)c3CO2)cc1 263617400 NPFQLNCIUODEEK-GOSISDBHSA-N 382.395 2.627 0 50 GFAA O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cnn2cccnc12 265134449 OCMMWLJNRXVYNH-GFCCVEGCSA-N 391.353 2.637 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1 269195856 PTINJAPPWQFZOV-QGZVFWFLSA-N 387.457 2.516 0 50 GFAA Cc1cc(N2CCC[C@@H](NC(=O)Nc3ncn(C4CCCCC4)n3)C2)n(C)n1 278172060 ZAWSESUIXOFZMX-OAHLLOKOSA-N 386.504 2.616 0 50 GFAA CC(F)(F)c1cccc(NC(=O)N2CCC[C@@H](N3CCCS3(=O)=O)C2)c1 278868210 ROYKBCJIUYJOLL-OAHLLOKOSA-N 387.452 2.830 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)CC1 328630568 JNOQRTILIJZEIL-NHCUHLMSSA-N 386.471 2.552 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccn4cncc4c3)CC2)cn1 328647535 UAIRVEMTMNVFMQ-KRWDZBQOSA-N 378.480 2.902 0 50 GFAA Cc1nc([C@H]2CCCCN2C(=O)c2n[nH]c(C3CC3)c2Br)n[nH]1 328666816 CUJHMGQJWDTEIT-SNVBAGLBSA-N 379.262 2.844 0 50 GFAA O=C(NCc1cc(C2CC2)n[nH]1)N1CCN([C@H]2CCc3ccccc3C2)CC1 426423093 QPKLGZVQULNRQV-FQEVSTJZSA-N 379.508 2.672 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3CC[C@@](O)(c4ccccc4)C3)c2n1 426511722 QLQYXSPXJNZVDP-SFHVURJKSA-N 390.365 2.790 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)N[C@H](C)c3nc4ccccc4[nH]3)CC2)n1 426615008 CFKNAXQPQIYPEO-CQSZACIVSA-N 379.468 2.563 0 50 GFAA COc1cnccc1N1CCN(C(=O)c2ccccc2OC(F)(F)F)CC1 478483314 DQIRFNBZMRVMPW-UHFFFAOYSA-N 381.354 2.951 0 50 GFAA Cc1cc(CC(=O)NCC2CCN(C(=O)CSc3ccccc3)CC2)on1 827861819 ROHRVGVMVJXVQM-UHFFFAOYSA-N 387.505 2.673 0 50 GFAA COCCc1noc([C@@H]2CCCCN2C(=O)c2cc(C)nc3onc(C)c23)n1 952870257 VAALPPLHTRSAPY-AWEZNQCLSA-N 385.424 2.779 0 50 GFAA CC(C)(C)C[C@@H](O)CC(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894983 VVJFVHROYQGQQV-KRWDZBQOSA-N 383.496 2.827 0 50 GFAA Cc1cc(N2CCN(C(=O)c3oc(C)nc3C)CC2)nc(-c2ccccc2O)n1 952985635 ISZBYUMHMJAFCH-UHFFFAOYSA-N 393.447 2.725 0 50 GFAA Cc1ncnc(N2CCN(C(=O)CCc3nc4ccccc4s3)CC2)c1C 952988855 SXXMPNQUGGXRMZ-UHFFFAOYSA-N 381.505 2.985 0 50 GFAA CNc1nc(C(N)=O)c(NC(=O)[C@@H](c2ccc(F)cc2)N2CCCCC2)s1 1529173120 MNVGZBVLUSUIFO-CQSZACIVSA-N 391.472 2.589 0 50 GFAA O=C(c1nn(Cc2ccccc2)c2ncccc12)N1CCC[C@H](C2(O)CC2)C1 1772813150 XLEUOUVGUQIBLW-KRWDZBQOSA-N 376.460 2.857 0 50 GFAA COCC1(CNC(=O)C[C@@H](C)CC(C)(C)C)CCN(C(=O)[C@H](C)OC)CC1 1775989085 CHEFZXVZPIUOCW-SJORKVTESA-N 384.561 2.855 0 50 GFAA CC(C)NC(=O)N1CCC2(CC1)OCCc1cc(C(=O)N3CCCC3)sc12 1857693281 PSGSGKBDRYIZNB-UHFFFAOYSA-N 391.537 2.966 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCc4cc(C)[nH]n4)C3)nc2c1 1857699857 BAGTVPVXLRIZQV-CQSZACIVSA-N 383.452 2.791 0 50 GFAA O=C1CCOC2(CCN(C(=O)[C@@H]3CC34CCC4)CC2)CN1Cc1ccccc1 1857711738 FCORQQNHGPNGMN-IBGZPJMESA-N 382.504 2.987 0 50 GFAA N=c1[nH]c2cc(C(=O)N3CCc4nc[nH]c4[C@H]3c3ccncc3)ccc2s1 1857715927 OGKYUBAAOMNHEA-QGZVFWFLSA-N 376.445 2.615 0 50 GFAA O=C(NCC1(CO)CCC1)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857723948 DRQKXBWICGNWTH-CYBMUJFWSA-N 377.872 2.976 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCc3nc4ccccc4[nH]3)C1)CC2 1857727957 GYMQQYIEXHDIOI-JOCHJYFZSA-N 391.475 2.806 0 50 GFAA COC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCN(c2ccccc2F)C[C@@H]1C 1875262040 CGGJLQTWPBGFRT-LPHOPBHVSA-N 399.466 2.830 0 50 GFAA C[C@@H](C(=O)N1C[C@@H](Cc2ccccc2)[C@H](C(=O)O)C1)n1cnc2ccccc21 1875349785 MSZLUKNPVXPEAD-CGTJXYLNSA-N 377.444 2.999 0 50 GFAA CC[C@H](C(N)=O)N1CC[C@]2(CCN(C(=O)c3coc4cc(C)c(C)cc34)C2)C1 2325793776 HMLYZMRKYPXKGA-GCJKJVERSA-N 383.492 2.852 0 50 GFAA CC(C)(C)OC(=O)NC[C@H]1C[C@@H]([S@@](C)(=O)=NC(=O)CCc2ccncc2)C1 2325813131 ORMLRSBGVKKIQP-DZLKFECGSA-N 395.525 2.942 0 50 GFAA Cc1nc([C@H](NC(=O)c2cnc3ccnn3c2C)c2ccc(Cl)cc2)no1 2325819856 SHWCISWSIZAHAW-MRXNPFEDSA-N 382.811 2.902 0 50 GFAA COc1nc2ccccc2nc1CCC(=O)Nc1ccnn1Cc1ccncc1 2356138784 IEINYTSPPMZLKS-UHFFFAOYSA-N 388.431 2.850 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356163899 WOHCGSNLNOIXFK-JOCHJYFZSA-N 396.491 2.803 0 50 GFAA CCc1ccc(Nc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccccc2)cc1 637476 IYARARSFXNXURE-UHFFFAOYSA-N 389.459 2.788 0 50 GFAA COC(=O)Cc1c(C)c2ccc(OCC(=O)OC(C)(C)C)c(C)c2oc1=O 2094247 JVDYQMVLIBIKMD-UHFFFAOYSA-N 376.405 2.846 0 50 GFAA biogenic CS(=O)(=O)N(Cc1nnc(-c2ccccc2)o1)c1cccc(-n2cccn2)c1 2356141652 KHQWDZHVNNNZTO-UHFFFAOYSA-N 395.444 2.889 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)Nc2ccc(C)c(Cl)c2)nc1N 2879086 GQLYYFRGOMQNSY-UHFFFAOYSA-N 380.857 2.928 0 50 GFAA COc1ccc(C)cc1N(CC(=O)N[C@@H](C)c1ccccc1)S(C)(=O)=O 4982889 MVNVJZGJKWNIJR-HNNXBMFYSA-N 376.478 2.647 0 50 GFAA Cc1ccccc1N1CCN([C@@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)CC1 55386591 LTYXNFCUCAXSSG-HXUWFJFHSA-N 396.535 2.956 0 50 GFAA Cc1cccc(CN2CCN(c3noc(-c4ccccc4)n3)C[C@H]2CCO)n1 106942997 SANYIYZWIWFENK-LJQANCHMSA-N 379.464 2.513 0 50 GFAA CCn1nccc1NC(=O)Cn1cc(-c2ccc(Cn3ccnc3)cc2)cn1 23250883 JMAVMLCRFQRTKB-UHFFFAOYSA-N 375.436 2.650 0 50 GFAA COc1cc2nc(N(C)CCOc3ccccc3OC)nc(N)c2cc1OC 25763539 LUFRFTFQBQEJMY-UHFFFAOYSA-N 384.436 2.753 0 50 GFAA O=C1OCCN1CCNc1ccc(-c2nc(Cc3ccc(F)cc3)no2)cn1 20450471 RYNPEPNEJCAOAU-UHFFFAOYSA-N 383.383 2.726 0 50 GFAA CC(C)n1nnc(-c2ccc(C(=O)NC[C@@H]3CCCN4CCCC[C@@H]34)cc2)n1 170613725 STNZFIIMNWEGQU-OALUTQOASA-N 382.512 2.915 0 50 GFAA Cc1n[nH]c(C)c1CCNCc1ccccc1OC[C@@H](O)CN1CCCCC1 20452996 OOMQAIFMYUIRTQ-FQEVSTJZSA-N 386.540 2.584 0 50 GFAA OCC[C@H]1CN(Cc2ccc(-n3cccn3)cc2)CCN1Cc1ccccc1 22932707 YSKAMAVCVYBNCF-QHCPKHFHSA-N 376.504 2.941 0 50 GFAA Cc1cc(N2CCN(C(=O)COc3ccccc3)CC2)nc(N2CCCCC2)n1 65362686 WREHAGBOAIYRPO-UHFFFAOYSA-N 395.507 2.503 0 50 GFAA C1CC([C@H]2COCCN(CC3(CN4CCOC[C@H](C5CCC5)C4)COC3)C2)C1 366499938 ZKGKPNNAAPOANQ-FGZHOGPDSA-N 392.584 2.500 0 50 GFAA Cc1cccc(CN2CCN(c3ccnc(C(=O)NC4CC4)c3)[C@H](C)C2=O)c1 71764700 MUPPOGQRUZNSOJ-MRXNPFEDSA-N 378.476 2.520 0 50 GFAA CN(CC(F)(F)F)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 242147536 WSNVDHSTXCDOIZ-UHFFFAOYSA-N 379.404 2.934 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)Nc3nnc(-c4ccsc4)s3)CC2)CCO1 131511216 VOPAIRWPCXVMRI-LBPRGKRZSA-N 393.538 2.984 0 50 GFAA O=C(NC[C@H]1CCN(c2ccccc2)C1)Nc1ccc2c(c1)S(=O)(=O)CC2 178355533 VMNIIMUKWXRGFX-OAHLLOKOSA-N 385.489 2.664 0 50 GFAA O=C(c1ccccc1)[C@@H]1[C@@H]2C(=O)N(c3ccccc3F)C(=O)[C@@H]2[C@@H]2CCCN21 226879292 WRRUROFEEKQBIT-MANSERQUSA-N 378.403 2.661 0 50 GFAA CN1C[C@]2(CCN(C(=O)CC(c3ccccc3)c3ccccc3)C2)OCC1=O 426549862 CTVOABLLSAKHFE-QHCPKHFHSA-N 378.472 2.668 0 50 GFAA CC(C)c1noc(CN(C)C(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)n1 91725818 CZUKVPJZTLCXAP-INIZCTEOSA-N 376.501 2.970 0 50 GFAA CCCN(Cc1ccsc1)C(=O)Cn1nnnc1CN1CCCCCC1 95530418 VLQDTOKMVJUICH-UHFFFAOYSA-N 376.530 2.549 0 50 GFAA COc1ccc(CCC(=O)N2CCC[C@@H](c3nccn3CCN(C)C)C2)cc1 95371062 NYNWZNVCSZKVHR-LJQANCHMSA-N 384.524 2.792 0 50 GFAA Cc1ccncc1C(=O)N1CCC2(CC1)CC(=O)N(Cc1c(C)noc1C)C2 91586487 YORRTRNJYUZRAU-UHFFFAOYSA-N 382.464 2.650 0 50 GFAA Cn1nc(C(=O)N2C[C@H]3CC[C@@H]2CN(C2CCOCC2)C3)cc1-c1ccccc1 91943800 CEDYKNZSTWJCOY-FXAWDEMLSA-N 394.519 2.803 0 50 GFAA Cc1c(CC(=O)N2CC[C@@H](CN)C2)c2c(n1Cc1ccccc1)CCCC2=O 95500290 YXOQSBXOSLRTSR-SFHVURJKSA-N 379.504 2.714 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)s1 253378391 CMIXUTARBJITRU-RVKKMQEKSA-N 379.503 2.782 0 50 GFAA COc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccc(S(C)(=O)=O)nc1 299326949 NXWVSGQXTDHAEJ-INIZCTEOSA-N 389.477 2.733 0 50 GFAA COc1ccc([C@@H]2[C@@H](C(=O)NCc3ccccc3F)OCC(=O)N2C2CC2)cc1 1940193546 RTYSXQHYWVALJT-RTWAWAEBSA-N 398.434 2.582 0 50 GFAA COc1cccc2ccc(-c3cccc(C(=O)NC[C@H]4CNCCO4)c3)nc12 299780433 NKLGOSNZSZFAGO-GOSISDBHSA-N 377.444 2.629 0 50 GFAA COc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1C(=O)N(C)C 824586800 HEXJSEMGBQCQET-UHFFFAOYSA-N 388.420 2.675 0 50 GFAA COC(=O)c1nc(-c2ccc(C)cc2)oc1S(=O)(=O)N1CCC[C@H](C)C1 824216781 UQRALIOFVQKYFJ-ZDUSSCGKSA-N 378.450 2.857 0 50 GFAA COC(=O)[C@H](C)NC(=O)Cc1c(-c2ccc(OC)cc2)oc2c(=O)cc(C)oc12 824159247 NOTLOOUMAWIXOH-LBPRGKRZSA-N 399.399 2.590 0 50 GFAA biogenic CC(C)c1nnsc1CNC(=O)N1CCC(OCc2cccnc2)CC1 584898034 OEUOOEAYHGHDDX-UHFFFAOYSA-N 375.498 2.947 0 50 GFAA CC(C)Cc1c[nH]c(C(=O)N[C@H]2CCCN(C(=O)c3cc4n(n3)CCCC4)C2)c1 1875310362 NLGMCHFZRPKIOJ-KRWDZBQOSA-N 397.523 2.781 0 50 GFAA C[C@H]1CCc2sc(C(=O)N3CC[C@H](N(C)Cc4nccc(N)n4)C3)cc2C1 276518186 QKNSJZQHIRQANP-ZFWWWQNUSA-N 385.537 2.592 0 50 GFAA COc1cc2nc(C)c(N3CCN(Cc4nc(C)c(C)o4)CC3)nc2cc1OC 170602000 VMLNOEAIHKPCQR-UHFFFAOYSA-N 397.479 2.882 0 50 GFAA CCC[C@@]1(C)C(=O)NCCN1CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C 187331424 VRPZZXRSUKRUGH-QFIPXVFZSA-N 397.523 2.727 0 50 GFAA CCn1cccc(NS(=O)(=O)c2cc(C(=O)O)sc2C(C)(C)C)c1=O 414397089 QLVDVWPNVVIEAA-UHFFFAOYSA-N 384.479 2.726 0 50 GFAA COCCn1ccc(C(=O)N(C[C@@H]2CCCO2)c2nc3ccccc3s2)n1 190393613 XDSWBKODHHJTMV-AWEZNQCLSA-N 386.477 2.965 0 50 GFAA CC(=O)CCc1ccc(O[C@H](C)C(=O)NCc2ccnc(-n3ccnc3)c2)cc1 194473574 GTKNQIORJCWRCL-QGZVFWFLSA-N 392.459 2.873 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)Nc3ccn(CC(F)(F)F)n3)c2O1 195504995 XHZZCCWMHHBRID-UHFFFAOYSA-N 375.372 2.960 0 50 GFAA CC[C@@H](C(=O)Nc1cc(-n2cnnc2)ccc1OC)N1Cc2ccccc2C1=O 1506397373 MDEBMZXZWZUWHB-SFHVURJKSA-N 391.431 2.649 0 50 GFAA COC[C@H](C)N(CC(=O)N1C[C@H](C)O[C@H](C)C1)Cc1ccc(SC)cc1 1506402286 VVRVBZSVWHDEDZ-YESZJQIVSA-N 380.554 2.881 0 50 GFAA O=C(CCC1CCN(C(=O)[C@H]2CCCO2)CC1)N1CCN(c2ccccc2)CC1 11753915 NNHQUYLYSKCCNQ-OAQYLSRUSA-N 399.535 2.533 0 50 GFAA CCN(C[C@@H]1CCCO1)C(=O)CCc1nnc(-c2ccc(C(C)=O)s2)o1 11771924 SYPKDJYTAYPBOK-ZDUSSCGKSA-N 377.466 2.961 0 50 GFAA O=C([C@H]1CCCO1)N(Cc1cc2ccc(F)cc2nc1N1CCOCC1)C1CC1 11910821 FNDQTMPPJKLSGR-HXUWFJFHSA-N 399.466 2.881 0 50 GFAA Cc1cc2c(c(-c3cnccn3)c1)O[C@H](CNC(=O)Cn1cnc3ccccc31)C2 11995247 UQMVMPWDQUZXCY-KRWDZBQOSA-N 399.454 2.922 0 50 GFAA CN(Cc1ccccc1)C(=O)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12003409 ASPSZSVUMIBROS-UHFFFAOYSA-N 392.864 2.679 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)CCOc2ccccc2)CCC1=O 12112094 PVNTXSFUBCKBQI-IBGZPJMESA-N 396.487 2.971 0 50 GFAA O=C1CCN(C(=O)c2cccc(Cn3cccn3)c2)CCN1Cc1ccccc1 12278941 JJNXISAMKXHWPT-UHFFFAOYSA-N 388.471 2.806 0 50 GFAA CCc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1 16578611 AQYAZPQBRKOJMZ-UHFFFAOYSA-N 378.469 2.908 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H](c3cccnc3)N3CCCC3)n1)CCNC2 200508166 JCVQNLONYFOIRN-IBGZPJMESA-N 376.464 2.666 0 50 GFAA COc1cccc(-c2ccc(=O)n(CC(=O)Nc3ccc(C(C)=O)cc3)n2)c1 5400137 AHHAWWGZEFMZEZ-UHFFFAOYSA-N 377.400 2.760 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCn4nc(C)cc4C)CC3=O)sc2c1 1857697307 OJSNIQGLVXLFAH-OAHLLOKOSA-N 397.504 2.587 0 50 GFAA O=S(=O)(CC1CCCC1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857700328 SZLZOQZZFPRNQJ-HXUWFJFHSA-N 391.537 2.859 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1n[nH]cc1Cl 1857721291 IKPKIXXVYNKEDK-KCQAQPDRSA-N 381.263 2.661 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)c1cnc(O)c2ccccc12 1857722353 JFCVYKKVMQTIES-XGHQBKJUSA-N 389.455 2.885 0 50 GFAA CC(C)CCN1C[C@@H]2[C@H](CNC(=O)CN3CCCCCC3)[C@H]3CC[C@]2(C1)O3 1857732187 GQPOQCQSSHJJJJ-GPQLQYNLSA-N 377.573 2.504 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)N(Cc1ccccn1)C[C@@H]1CCC(=O)N1 1857735494 PVKHUNYHBMZPSX-SFHVURJKSA-N 389.459 2.701 0 50 GFAA CCOc1cc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)ccc1OC 114293158 JALHAPQNKIQWJH-INIZCTEOSA-N 386.448 2.998 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)[C@H]1CCCN(CC(F)(F)F)C1 246552097 MQSQVDCJPFAJJB-STQMWFEESA-N 390.837 2.704 0 50 GFAA CCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(OCC(=O)O)c(Cl)c1 262157787 MPEUWDADDWLWIQ-CQSZACIVSA-N 382.844 2.923 0 50 GFAA CC(C)[C@H](CNC(=O)C1(CN(C)C)CCCCC1)NC(=O)Cc1ccoc1 2325793970 MRSBVMAGLJFUCN-SFHVURJKSA-N 377.529 2.591 0 50 GFAA CCOC(=O)c1cc(CC)sc1NC(=O)Cn1cnc2ccccc2c1=O 801757 BGZVSFZEXSRJSF-UHFFFAOYSA-N 385.445 2.836 0 50 GFAA CCOC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@H]1c1ccc2c(c1)OCO2 803071 YENNMAHIHWJEKX-IBGZPJMESA-N 390.399 2.996 0 50 GFAA COc1ccc2nc(NC(=O)CCN3C(=O)c4ccccc4C3=O)sc2c1 951194 XPDANRBHXLQMEQ-UHFFFAOYSA-N 381.413 2.930 0 50 GFAA CCOC(=O)C1=NN(C(=O)c2cccc(Br)c2)[C@@](O)(C(C)(C)C)C1 1195172 LGTWTGYCOMSWCB-KRWDZBQOSA-N 397.269 2.949 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSc1ccccc1)c1ccccc1F 2983903 QOCAEYAKZYPNIE-UHFFFAOYSA-N 382.482 2.500 0 50 GFAA COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NC[C@@H]2CCCO2)cc1 3055558 DILBYBNSGKXCFZ-QIYXJHPLSA-N 380.444 2.761 0 50 GFAA COc1ccc(OC)c([C@@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)c1 4042662 XOTRRQJMTJIJPY-GOSISDBHSA-N 392.419 2.618 0 50 GFAA CCOC(=O)c1ccc(N2CC3=C(C2=O)[C@@H](c2ccccc2)NC(=O)N3C)cc1 4727960 YFHGODJIYPDRPI-LJQANCHMSA-N 391.427 2.860 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cn2ccccc2n1 11664766 USPBGIJQLXUZRY-UHFFFAOYSA-N 386.459 2.733 0 50 GFAA O=C(Nc1cccc(F)c1)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1 12003659 LWKPAHOFLRFXAR-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1ccnn1C 12058114 LHWJMQXKWQUGSQ-UHFFFAOYSA-N 388.487 2.560 0 50 GFAA COCCCNc1ncnc2sc(C(=O)NCCc3cccnc3)c(C)c12 12152298 RNWMHCBRBICIPX-UHFFFAOYSA-N 385.493 2.816 0 50 GFAA COc1ccccc1CCCNC(=O)[C@H]1CCC(=O)N(CCc2ccccn2)C1 12306896 HDJPUNIOXPXBCD-IBGZPJMESA-N 395.503 2.620 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)c2cn(CCC3CCCCC3)nn2)CC1 19217910 IICZLNCCHLZLQW-UHFFFAOYSA-N 396.539 2.910 0 50 GFAA COCc1cc(CN2CCN(Cc3ccc(C)o3)[C@@H](CCO)C2)ccc1OC 19733265 CBNVDDSBBMWOCP-FQEVSTJZSA-N 388.508 2.812 0 50 GFAA CC[C@@H](C)CC(=O)N1CCOc2ccc(CN3CCN(C(C)=O)CC3)cc2C1 19744299 KUGOGATYSWNLIJ-QGZVFWFLSA-N 387.524 2.508 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 19909320 DOFPJNUSZRYBEV-UHFFFAOYSA-N 388.489 2.539 0 50 GFAA O=c1c2c3c(sc2ncn1CCc1ccccc1)C[C@@H](N1CCOCC1)CC3 20541286 IHAKGUHNACZNDK-KRWDZBQOSA-N 395.528 2.890 0 50 GFAA COc1ccc(CN2CC[C@@H](N(C)CCc3ccccn3)[C@H](O)C2)c(C)c1C 20906583 YJCRQXKIKLWMBP-FGZHOGPDSA-N 383.536 2.817 0 50 GFAA O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1cc(=O)c2ccccc2o1 28289761 VXTQVGKNKUPQDO-SFHVURJKSA-N 378.428 2.596 0 50 GFAA O=C(Cc1ccc(Cl)cc1)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528217 SMXXMHNNISKAEA-UHFFFAOYSA-N 385.899 2.622 0 50 GFAA COc1ccc([C@H]2[C@@H](C(=O)Nc3cnn(C)c3)c3ccccc3C(=O)N2C)cc1 61720678 PEOSYHQRGDORMT-PMACEKPBSA-N 390.443 2.978 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N(CC)[C@H]3CCOC(C)(C)C3)cnn2c1 67742870 WSYZKYYRROVXPZ-KRWDZBQOSA-N 387.528 2.991 0 50 GFAA CSc1cccc(CN2CCN(C)C3(CCN(C(=O)N(C)C)CC3)C2)c1 67973682 RJCBXPKYXXMBDV-UHFFFAOYSA-N 376.570 2.672 0 50 GFAA Cc1ncc(CC(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)c(=O)[nH]1 71681297 OADJOYXCTHCGRX-OAHLLOKOSA-N 382.247 2.528 0 50 GFAA CN(Cc1ccccc1)C1(C(=O)NCC[C@H]2CCCN2)Cc2ccccc2C1 72154385 JZEFDLXWAKFIMO-JOCHJYFZSA-N 377.532 2.914 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC[C@@H](c2nccn2Cc2ccccn2)C1 91951902 XYTWLIGXGULBAT-GOSISDBHSA-N 376.460 2.981 0 50 GFAA CN(C)c1ccc(CC(=O)N2CCC[C@]3(CCC(=O)N(CC4CC4)C3)C2)cc1 92099675 JQUHRAKRZJNQEK-QHCPKHFHSA-N 383.536 2.936 0 50 GFAA O=C(NC1CCCCC1)c1cccc(S(=O)(=O)NCc2nccs2)c1 95358832 VWMZYCFBWOBXBR-UHFFFAOYSA-N 379.507 2.684 0 50 GFAA CC(=O)N1CCCN([C@H](C(=O)O)c2ccc(OCc3ccccc3)cc2)CC1 95371769 ZBPXBUFAWQJWAJ-NRFANRHFSA-N 382.460 2.946 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(Cc1cnc(-c3ccccc3OC)nc1)C2 95383580 TZGGLTVLFGERTH-PKOBYXMFSA-N 382.508 2.695 0 50 GFAA Cc1cc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)nc(C)n1 95390306 ZITYAJZNNOKDCM-CEWLAPEOSA-N 380.467 2.935 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(CC(C)(C)N2CCOCC2)C3)cc1 95391697 UPRAILBTOXZKLU-LEWJYISDSA-N 387.568 2.702 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)NCCc4nncn4C)cc3o2)c1 95498183 IYMXTHSEVUPPAI-UHFFFAOYSA-N 377.404 2.604 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(C(=O)c3ccn(C(C)(C)C)c3)C2)CC1 95504738 OTXCWIMZYDPMFT-GOSISDBHSA-N 388.556 2.650 0 50 GFAA O=S(=O)(c1c[nH]c2ncccc12)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 114735487 WCQAEHSLYVLGNJ-OAHLLOKOSA-N 385.445 2.860 0 50 GFAA CCO[C@H](C)c1noc(CN2CCC(NC(=O)c3cc(C)oc3C)CC2)n1 120657475 MJDKUEJSVFACJH-CQSZACIVSA-N 376.457 2.771 0 50 GFAA O=C(NCCNS(=O)(=O)c1cccs1)c1cc2ccc(Cl)cc2[nH]1 126238445 OMJNAUIFHSLPSF-UHFFFAOYSA-N 383.882 2.591 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(-c2ncon2)cc1 129952313 PJVPTFSLZPVOMH-GOSISDBHSA-N 376.416 2.658 0 50 GFAA CC1CCN(Cc2ccc(NC(=O)C(=O)Nn3cnc4ccccc43)cc2)CC1 134709184 IDGORDRQXYZLMU-UHFFFAOYSA-N 391.475 2.977 0 50 GFAA O=C(Cc1csc(NC(=O)c2cccs2)n1)N[C@H]1c2ccccc2C[C@@H]1O 175317842 FHVATDKXBKYHFH-YOEHRIQHSA-N 399.497 2.774 0 50 GFAA Cn1cc(N2CCN(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)CC2)cn1 175774013 SZODHQSTSWLVSV-SFHVURJKSA-N 399.495 2.722 0 50 GFAA Cc1cc2c(N3CCN(C(=O)c4nc(C)c(C)nc4C)CC3)ncnc2s1 189315832 OBNLNKLBMMQKCC-UHFFFAOYSA-N 382.493 2.677 0 50 GFAA Cc1sc2nc([C@H](C)N3CCN(C(=O)c4ccccn4)CC3)nc(N)c2c1C 192822830 YPZMYKAOSCLUEY-ZDUSSCGKSA-N 396.520 2.804 0 50 GFAA O=C(NC[C@@H]1CCCC[C@@H]1O)c1cc2n(n1)CCCN(Cc1ccccc1)C2 210422116 AQHRNNJTJBMTOF-RXVVDRJESA-N 382.508 2.570 0 50 GFAA C[C@H](C(=O)NC1CCN(Cc2ccccc2)CC1)N(C)C[C@H]1CCCC[C@@H]1O 241588047 OZERHNRGFYBTHG-UZKOGDIHSA-N 387.568 2.639 0 50 GFAA Cc1ccc(C(=O)N[C@H]2C[C@H](c3nnc(Cn4cccn4)n3C)C2)cc1Cl 244734715 NKOFUDATWZVIBO-SHTZXODSSA-N 384.871 2.698 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@H]1C=Cc3cc(Cl)ccc3N1[C@H]2C(=O)c1cccs1 245256592 RRKMLLGXBGFJBG-SLBVQIDZSA-N 384.844 2.757 0 50 GFAA C[C@@H](CCn1cncn1)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 253432806 OKNBGUBRJWMBCG-JTQLQIEISA-N 380.330 2.556 0 50 GFAA COc1ccc2c(c1)C1(CC1)CN([C@@H](C)C(=O)Nc1ccc3[nH]c(=O)[nH]c3c1)C2 289629543 RVUGASOJGXZLNR-ZDUSSCGKSA-N 392.459 2.739 0 50 GFAA Cc1cc(Br)cc(C)c1N1CCC[C@H](N2C(=O)[C@@H](C)N=C2O)C1=O 328594802 BZADYDRBHYCKEB-YPMHNXCESA-N 394.269 2.706 0 50 GFAA Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N1CC[S@](=O)C(C)(C)CC1 333955507 GECKBVDXYZDNBI-DEOSSOPVSA-N 385.839 2.623 0 50 GFAA CCN(Cc1cccs1)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C 366348640 NIVOEDRZBLDIAH-APWZRJJASA-N 386.521 2.972 0 50 GFAA CCc1nc(CNC(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)cs1 378088816 KBSYDRIBNOESCB-CABZTGNLSA-N 385.536 2.873 0 50 GFAA CN(C(=O)c1cccc(S(=O)(=O)N(C)Cc2cc[nH]n2)c1)c1ccccc1 408525265 SPJYUKQEAPMDIV-UHFFFAOYSA-N 384.461 2.507 0 50 GFAA C[C@@H]1Cc2cc(CNC(=O)N3CCC(N4CCSCC4)CC3)ccc2O1 534632592 HMXWEOKECHXEHX-OAHLLOKOSA-N 375.538 2.733 0 50 GFAA C[C@H]1CN(Cc2ccc(CN(C)C(=O)c3c(Cl)cnn3C)cc2)C[C@@H](C)O1 898286275 DFXIHDKLBWZQJB-GASCZTMLSA-N 390.915 2.955 0 50 GFAA O=C(c1ccccn1)N1CCC(C(=O)N2CCO[C@@H](c3ccccc3)C2)CC1 952983160 OFZLJLQXJSFPIG-HXUWFJFHSA-N 379.460 2.534 0 50 GFAA CN(CC[C@@H]1CCCCO1)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506398096 LAMIHXDWPWTWNF-JTQLQIEISA-N 379.837 2.757 0 50 GFAA COCCc1noc([C@H]2CCCN(C(=O)c3nc4c(s3)CCCC4)C2)n1 1506408723 ZQWNXKSAIPZPRP-LBPRGKRZSA-N 376.482 2.614 0 50 GFAA Cc1[nH]nc(-c2ccc(S(=O)(=O)N3CCC[C@@]4(CCC[C@H]4O)C3)o2)c1C 1704301390 XKRYHGVHEZIUFG-QAPCUYQASA-N 379.482 2.602 0 50 GFAA Cc1ccc(-c2ccnc(N3CCCN(C(=O)c4ccccn4)CC3)n2)c(C)n1 1772812679 OFCNXWDVYZMJLE-UHFFFAOYSA-N 388.475 2.903 0 50 GFAA CCOC(=O)CCNC(=O)[C@@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857701512 MEWUWEPEUJZMMC-GFCCVEGCSA-N 379.844 2.767 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NCCc1cnn[nH]1 1857729207 NCGSXJBGLUFRRZ-GFCCVEGCSA-N 388.859 2.565 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC[C@H]4c4nc(C)no4)CC3)nc2n1 1857731426 IAZSUPJVJXIBGO-HNNXBMFYSA-N 396.451 2.803 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1ncc(F)cc1F 1857737069 VTFNJLWOZKQPAD-YQQAZPJKSA-N 393.821 2.957 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3nc(-c4ccc(Cl)cc4)oc3c2)C(=O)N1 1857797870 BUYACJZIOFXWCF-AWEZNQCLSA-N 383.791 2.683 0 50 GFAA C=CC(=O)N[C@H](CNC(=O)c1cnn2cc(C)cnc12)c1ccc(C(C)C)cc1 1875386387 OYAGDKPSFWXTME-LJQANCHMSA-N 391.475 2.934 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)N(C)Cc3n[nH]c4c3CCCCC4)cn12 1940195807 OAXQFMBKVQSSEU-LJQANCHMSA-N 396.495 2.683 0 50 GFAA COc1cccc([C@H]2C[C@H](NC(=O)NC3CCC4(CC3)CS(=O)(=O)C4)C2)c1 2325768481 JCMXLYBHLKDHHC-JCNLHEQBSA-N 392.521 2.598 0 50 GFAA CCCc1[nH]nc2ccc(C(=O)NCCN3C(=O)c4ccccc4C3=O)cc12 2325854110 OKBVPHAFAYWFHQ-UHFFFAOYSA-N 376.416 2.541 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N[C@H]2COc3cc(F)c(Br)cc32)C1 2325888285 CNGQREYGBVSDPP-YGRLFVJLSA-N 397.244 2.563 0 50 GFAA COc1ccc2c(c1)OC[C@H](CNC(=O)c1ccc(-c3cncc(N)n3)cc1)C2 2356156799 RRJDHQFWMMKFKC-AWEZNQCLSA-N 390.443 2.716 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC(C)(C)C)cc1 643442 VLGIULJGFQCSOS-UHFFFAOYSA-N 389.477 2.974 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 789912 GCQMRNZCGSMULP-UHFFFAOYSA-N 376.434 2.744 0 50 GFAA COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(Br)cc1 792950 MSNNECLBCSCZBO-UHFFFAOYSA-N 386.223 2.957 0 50 GFAA CC1=C(C(=O)OCc2ccc3c(c2)OCO3)[C@H](c2ccc(F)cc2)NC(=O)N1 812919 QCGHTRAZOATGMB-SFHVURJKSA-N 384.363 2.926 0 50 GFAA CC(=O)N(C)c1ccc(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)cc1 839202 CVYPXYYXVKEBGK-IBGZPJMESA-N 393.443 2.929 0 50 GFAA CC(=O)N1CCC(C(=O)Nc2cccc(C(=O)NCc3ccccc3)c2)CC1 6726753 VUAMDQKYERUGRY-UHFFFAOYSA-N 379.460 2.814 0 50 GFAA Cc1c(CC(=O)N2CCOCC2)c2c(n1Cc1ccccc1F)CCCC2=O 11719952 KHHSUCBDPBMDKK-UHFFFAOYSA-N 384.451 2.904 0 50 GFAA O=C(NCCN1Cc2ccccc2O[C@@H](c2ccccc2)C1)c1cnsn1 11996267 KREHKFRGUMKOOQ-LJQANCHMSA-N 380.473 2.904 0 50 GFAA COc1ccc(OC2CCN(C(C)=O)CC2)c(C(=O)NCCCSC)c1 12021649 OAWRWDOBCQLRPL-UHFFFAOYSA-N 380.510 2.568 0 50 GFAA O=C(CCc1nnc(CCc2ccccc2)o1)NC[C@@H]1COc2ccccc2O1 12228437 WBSCMPFBHUFIKN-QGZVFWFLSA-N 393.443 2.744 0 50 GFAA O=C(c1cccc(OC2CCN(Cc3ccncc3)CC2)c1)N1CCC[C@@H](O)C1 12308414 FCPCXVVLDWALBE-HXUWFJFHSA-N 395.503 2.722 0 50 GFAA COc1ccc(CCN2C[C@@H](NC(=O)c3ccc(SC)cc3)CC2=O)cc1 12373666 ZIYCVHUAFBFCEV-KRWDZBQOSA-N 384.501 2.991 0 50 GFAA Cc1cc(C)c(C(=O)N2CCC[C@@H](CNS(=O)(=O)c3cccs3)C2)o1 12593774 OKDOFVRNMXOBEX-AWEZNQCLSA-N 382.507 2.789 0 50 GFAA O=S(=O)(c1cccnc1)N1CCC[C@@](CO)(Cc2cccc(Cl)c2)C1 15068085 LSXGPTLUVFTDGW-GOSISDBHSA-N 380.897 2.741 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(C(=O)c3cscn3)C2)cc1OC 15078790 KIWUNXOYBGDYJA-MRXNPFEDSA-N 389.521 2.939 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)NCCSc2ccc(Cl)cc2)CC1 18205740 XQSHCIUFSHZMFI-UHFFFAOYSA-N 390.958 2.610 0 50 GFAA CN1CCN(C(=O)c2cnn3c(C(F)(F)F)cc(-c4cccs4)nc23)CC1 19774214 JRHUSIMAWZEKIL-UHFFFAOYSA-N 395.410 2.864 0 50 GFAA O=C(CN1CCN(Cc2ccco2)CC1)Nc1ccc(Br)cc1 20479650 NPNWKGGBQCEQSM-UHFFFAOYSA-N 378.270 2.798 0 50 GFAA C[C@@](O)(CCCO)CNC(=O)c1csc2nc(-c3ccccc3Cl)cn12 67689007 QIVHCKMHXGAKNP-GOSISDBHSA-N 393.896 2.970 0 50 GFAA Cc1nc(C)n(C[C@H](C)C(=O)N2CCc3[nH]nc(-c4ccccc4F)c3C2)n1 67965412 QEIIFFZWQLKQCX-LBPRGKRZSA-N 382.443 2.645 0 50 GFAA COc1ccc2cc([C@H]3CN(c4cncc(C(=O)N(C)C)n4)CCO3)ccc2c1 71497763 IVYOHLFWCUESPC-HXUWFJFHSA-N 392.459 2.918 0 50 GFAA CC(C)N(Cc1ccc(F)cc1)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccoc1 72125619 BSYFXBUCVVIAPD-LJQANCHMSA-N 387.455 2.546 0 50 GFAA O=S(=O)(c1cccnc1)N1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1 72154696 CQGCFMHKMMAGLG-HXUWFJFHSA-N 389.496 2.898 0 50 GFAA CCN1CCC[C@H]1CN1Cc2ccc(C(=O)NCc3ccc(C)o3)cc2C1=O 72423256 WZUOEGSTAXWYMW-SFHVURJKSA-N 381.476 2.958 0 50 GFAA CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cccc(CCC(C)(C)O)c1 72431244 FZZHDBCWRBQMSW-UHFFFAOYSA-N 379.460 2.899 0 50 GFAA CCN1CC2(CCC1=O)CCN(C(=O)[C@@H](c1ccccc1F)N(C)C)CC2 91951416 DSAMBHRSACXPDD-LJQANCHMSA-N 375.488 2.680 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CC[C@@]2(CCCN(CCO)C2=O)C1 91997571 CTEZVDFERUHCNR-QHCPKHFHSA-N 378.472 2.801 0 50 GFAA CC(C)c1cc(C(=O)N[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)[nH]n1 92038350 IWPHLCNTWIZDLJ-KRWDZBQOSA-N 398.511 2.603 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)cc1 95373948 KGCRAHRPMHPOLN-HSZRJFAPSA-N 381.520 2.879 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)c2csc(Br)n2)CC1 95495794 XTJLRYIKLFKCKL-UHFFFAOYSA-N 376.276 2.599 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ncoc1C 95517445 OTDZSOOLYDKABF-SFHVURJKSA-N 397.519 2.951 0 50 GFAA CCc1cc(N2CCN(C(=O)Nc3cccc(-n4cccn4)c3)CC2)ncn1 97546513 LVLIMYKNNWILOI-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2cnn(-c3ccc(F)cc3)n2)c1 151137211 LNGKOUOQFFHLES-UHFFFAOYSA-N 394.815 2.716 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4ccc(F)c(F)c4)CC3)nn2)n1 169777458 OPUJQHCEWJDTFF-UHFFFAOYSA-N 388.378 2.646 0 50 GFAA Cn1nc(C(=O)NCc2nnc3ccc(-c4ccccc4)nn23)c2ccccc21 169778298 UEVJRJGUERHQBD-UHFFFAOYSA-N 383.415 2.608 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@@H](c3ccccc3OC)C2)c1 170615170 BXWHLPCEAZGZMI-GOSISDBHSA-N 390.461 2.823 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2coc(-c3cccs3)n2)c1 170636392 MWTNAPZGQIUBDL-UHFFFAOYSA-N 393.490 2.644 0 50 GFAA CC(C)[C@@H](CNC(=O)N1CCC(N(C)c2ccccc2)CC1)N1CCOCC1 175693027 ZBGBGZXMFRYGQO-OAQYLSRUSA-N 388.556 2.654 0 50 GFAA COc1cc(C(=O)NC2(Cc3ccccc3)CCCC2)sc1S(N)(=O)=O 185292938 GAQPHAYOWJSIAJ-UHFFFAOYSA-N 394.518 2.689 0 50 GFAA O=C(c1ccc(Oc2ccccc2)cc1)N1CCC[C@@H](N2CCNCC2=O)C1 186683038 UTBXFSOBMVNBNI-GOSISDBHSA-N 379.460 2.515 0 50 GFAA CN1C(=O)C[C@H](C(=O)N2CCN(C3CC3)c3ccc(F)cc32)[C@H]1c1cccnc1 187368081 KAPRVDZFGKGFNN-LAUBAEHRSA-N 394.450 2.756 0 50 GFAA Cc1ccnc(-c2ccc(NC(=O)N3CCC(Cn4cncn4)CC3)cc2)n1 188950228 FMOVJSFYXYRCNP-UHFFFAOYSA-N 377.452 2.988 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2C(=O)N2CCN3CCC[C@H]3C2)cc1 195327033 YDQIFAXRIQSHDC-KRWDZBQOSA-N 379.460 2.868 0 50 GFAA COCCN[C@H]1CCc2c(sc3ncn(CCc4ccccc4)c(=O)c23)C1 200562219 QOQRNKJXBWCCQR-INIZCTEOSA-N 383.517 2.794 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC(C(=O)N2CCc3ccccc3C2)CC1 216324137 HEFZHYNTGOMJHX-UHFFFAOYSA-N 386.883 2.511 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N[C@@H](CC(=O)O)c1ccc(F)cc1 236584135 BOGARULPOPTJRJ-PMACEKPBSA-N 398.434 2.994 0 50 GFAA CN(C(=O)c1ccc(C(=O)O)s1)[C@H]1CCN(c2ccccc2Cl)C1=O 237033344 HRYFPMRHNKMMQK-LBPRGKRZSA-N 378.837 2.977 0 50 GFAA O=C(O)CCN(Cc1cccc(F)c1F)C(=O)[C@H]1CC(=O)Nc2ccccc21 238148551 JGOUZFDTVSTMBP-AWEZNQCLSA-N 388.370 2.894 0 50 GFAA CN(CCc1ccccn1)C(=O)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244858628 VOVAOQLABOEGNA-IYARVYRRSA-N 394.475 2.515 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H](C)c3nnc4ccccn34)CCOCC2)cc1 252486004 HGZQFDWXGLGSFD-HNNXBMFYSA-N 380.448 2.664 0 50 GFAA COC(=O)N1CC[C@@H](NC(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)C1 253428683 DSAVKRLZFBROAH-GOEBONIOSA-N 397.516 2.617 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(/C=C/c2nc(C3(N)CCCC3)no2)cc1 261889493 XGEUVCNGXAYLJE-JXMROGBWSA-N 376.482 2.655 0 50 GFAA Cc1cccc2c(CCC(=O)N3CC[C@@H](N(C)Cc4nccc(N)n4)C3)c[nH]c12 276345895 HMBRUSKYPVXPBB-QGZVFWFLSA-N 392.507 2.514 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2cc(O)c3cc(Br)ccc3n2)C1 299741148 DBYDPCSAQFOMFK-SECBINFHSA-N 379.210 2.640 0 50 GFAA COC(=O)c1c(NC(=O)C2CCC2)c2cc(N)cnc2n1CCc1ccccn1 299761264 TZGJCUNDUFTPHN-UHFFFAOYSA-N 393.447 2.781 0 50 GFAA C[C@H]1CCCCN1C(=O)CN1CCN(c2ncc(C(F)(F)F)s2)CC1 302792430 ZLJPXCAPOUGGKH-LBPRGKRZSA-N 376.448 2.685 0 50 GFAA Cc1nc2cc(NC(=O)N3CCO[C@H](c4ccnc(N(C)C)n4)C3)ccc2o1 372465703 NOZGPVSEPCWOSH-KRWDZBQOSA-N 382.424 2.598 0 50 GFAA O=C(C[C@@H]1CCS(=O)(=O)C1)N1CCCc2c(F)cc(Br)cc21 408126553 QASHZABCRSGVON-JTQLQIEISA-N 390.274 2.692 0 50 GFAA O=C(N[C@@H]1CCCN(c2cnccn2)C1)c1cc(-c2ccc(Cl)cc2)[nH]n1 426489815 WVQRBHGTDUPLTQ-OAHLLOKOSA-N 382.855 2.919 0 50 GFAA Cc1cc(C)c2ccc(C(=O)N3CCN(c4ccc5nccn5n4)CC3)cc2n1 426722438 MTHXBQPIXIZEGK-UHFFFAOYSA-N 386.459 2.857 0 50 GFAA CCNC(=O)N1CCC(NC(=O)c2cccc(-c3ccc(NC)nc3)c2)CC1 534592843 QIKYFKZZHGCHBF-UHFFFAOYSA-N 381.480 2.714 0 50 GFAA CSCCN1CCC(NC(=O)N(C)Cc2nc3ccccc3n2C)CC1 670473806 SMJITBSOEKGTSH-UHFFFAOYSA-N 375.542 2.542 0 50 GFAA Cc1ccccc1CN1CCC(N2C(=O)N[C@H]3CN(C(=O)C(C)C)CC[C@@H]32)CC1 888103303 CEPNZIFLNXJHTA-SFTDATJTSA-N 398.551 2.610 0 50 GFAA O=C(NC[C@@H]1CN(c2ccnc3ccsc23)CCCO1)c1ccc(F)cn1 888103446 HMCKECRJWNWDNJ-CQSZACIVSA-N 386.452 2.856 0 50 GFAA CC(C)CN1CCN(S(=O)(=O)c2cccc3ccccc23)C[C@@H]1CCO 952873703 NCEVKCVKEJPYAV-SFHVURJKSA-N 376.522 2.553 0 50 GFAA CC[C@@H](C)c1ccccc1OCC(=O)N1CCC(c2nnc(CO)n2C)CC1 952981688 UHFSVHZZHDUKNV-OAHLLOKOSA-N 386.496 2.606 0 50 GFAA Cn1c(CO)nc2cc(C(=O)N3CCC[C@@H]3Cn3cnc4ccccc43)ccc21 1336418300 UJYKIWDRZFIRER-MRXNPFEDSA-N 389.459 2.720 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N(Cc2ccc3[nH]ccc3c2)C2CC2)C1 1506422250 NFGNYSGMNLLZES-INIZCTEOSA-N 377.510 2.736 0 50 GFAA COc1ccc2ccc(OC)c(CN3C[C@@H](O)[C@H](Cc4cnccn4)C3)c2c1 1529099404 WTWBMUFRYROUAP-IIBYNOLFSA-N 379.460 2.682 0 50 GFAA O=C([C@@H]1CCc2sc(-c3ccncc3)nc2C1)N1C[C@H]2[C@H]3CC[C@H](N3)[C@H]2C1 1772811880 AALVVUFNNLSRIN-UUAJXVIYSA-N 380.517 2.519 0 50 GFAA CC[C@H]1[C@@H]2OC(=O)[C@H](C)[C@@H]2[C@H]2C[C@H]([C@@H]3C[C@H](C)C(=O)O3)N3[C@@H]4CCC[C@H]1[C@]23O4 1772820091 RRHMLMRBONYJOT-AQJXFAGBSA-N 389.492 2.699 0 50 GFAA Cc1nnc([C@H]2C[C@@H](O)CN2C(=O)COc2ccccc2Cc2ccccc2)o1 1775957404 SMGLYUSRVRKMBE-RTBURBONSA-N 393.443 2.682 0 50 GFAA CNC(=O)Cc1nc([C@@]2(c3ccccc3F)CC2(C)C)n(CC(F)(F)F)n1 1857680194 DUPSNEJVWDFUGN-KRWDZBQOSA-N 384.377 2.984 0 50 GFAA O=C(NCCO)c1cc2c(s1)CCOC21CCN(C2CCCCC2)CC1 1857684699 ZBCABLDWBVSUKQ-UHFFFAOYSA-N 378.538 2.667 0 50 GFAA COc1cc(-c2nc(CNC(=O)COC[C@@H]3CCCCO3)c(C)o2)ccc1O 1857693407 WDONQOYKTANHNG-HNNXBMFYSA-N 390.436 2.566 0 50 GFAA O=C(NCCO)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2CCc1ccccc1 1857697309 ORFZEFAUNNTVQA-WMTXJRDZSA-N 378.516 2.803 0 50 GFAA O=C(CCCn1cccn1)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857720075 CTCVUVWZKYHJSO-CEXWTWQISA-N 388.899 2.647 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(C(=O)c3cccc(Cl)c3)C[C@]23CC[C@H]1O3 1857738295 ATQMNQQFKXPDOQ-TVKQPGBESA-N 376.884 2.876 0 50 GFAA Cc1ccc(C(=O)N2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)cn1 1875247640 ZKMPLWNWEIIFHS-DENIHFKCSA-N 382.460 2.691 0 50 GFAA N[C@@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)[C@H]2COC[C@@H]12 1875292860 VEGLWVOYGPDNQH-ZNMIVQPWSA-N 397.422 2.556 0 50 GFAA CCn1ccc(C(=O)N2C[C@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]2C)n1 1875309966 WQMIQOSWHUTXGF-KBPBESRZSA-N 397.454 2.804 0 50 GFAA CC(C)[C@@H](C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)CC1CCN(C)CC1)c1ccccc1 1875336837 NUYQOUHRZXGXFH-QNWVGRARSA-N 397.563 2.970 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2C[C@@H](C)N(C(=O)c3cc4cnccc4[nH]3)C2)cc1 2325806546 RQUIWISIESPYST-RHSMWYFYSA-N 392.459 2.533 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCc3nc(C)nc(O)c3CC2)cc1 2356141133 WIMFPDWGXOLKIT-UHFFFAOYSA-N 390.443 2.802 0 50 GFAA Cc1ccc2c(c1)c(=O)c(C(=O)N1CC[C@H](c3ccccc3)[C@H](O)C1)cn2C 2356150215 RHGDFVUZGMNXJK-DYESRHJHSA-N 376.456 2.838 0 50 GFAA COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)[C@@H]4CCCN4)C3)[C@@H]3CCCCN23)c1 2356154036 FYCVMTAEERKAGO-RNTGTLJKSA-N 397.563 2.691 0 50 GFAA CN(C)S(=O)(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1132231 BUWHOKBMWLEEEW-UHFFFAOYSA-N 383.267 2.952 0 50 GFAA COC(=O)C1=C(C)N=C2S[C@@H](C)C(=O)N2[C@@H]1c1ccc(OC)c(OC)c1 2254234 MMELZDSVMIBFNE-ZUZCIYMTSA-N 376.434 2.525 0 50 GFAA CCn1nc(CO)c2c1CCN(C(=O)c1ccc(-c3ccncc3OC)cc1)C2 2356136942 CIRPXWOUNHGOKU-UHFFFAOYSA-N 392.459 2.664 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)NCc2ccc(Cl)cc2)S(C)(=O)=O)cc1 2980113 UEHFWGKRBAMTGJ-ZDUSSCGKSA-N 396.896 2.820 0 50 GFAA CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)O 4700926 AYQHQTALHLLYTN-OALUTQOASA-N 382.460 2.643 0 50 GFAA CC(C)(C)CN1CCC[C@@H]1c1ccc(C(=O)NCCCc2nnn[nH]2)s1 23430473 FQOIQXDWFHGKGQ-CYBMUJFWSA-N 376.530 2.807 0 50 GFAA CCSc1nc(CC(=O)NCCc2nc(-c3ccccn3)no2)cs1 55226673 BIZOKWDQWCYFQX-UHFFFAOYSA-N 375.479 2.602 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)CC1 55071457 NILNHPQCGJFXDF-GOSISDBHSA-N 384.480 2.547 0 50 GFAA CCN1C(=O)C[C@@H](N2CCN(C(c3ccccc3)c3ccccc3)CC2)C1=O 100633156 XYFQLQZHLUZOJJ-HXUWFJFHSA-N 377.488 2.541 0 50 GFAA COc1cc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)cc(OC)c1 23375369 DBQQJKHDWOLBSO-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA CCN(C(=O)c1cccc(F)c1F)[C@@H]1CCN(C(=O)c2cccs2)C[C@H]1O 12758741 IZNDPINYLMPWIR-HUUCEWRRSA-N 394.443 2.764 0 50 GFAA CCN1CCCN(C[C@]2(O)CCCN(Cc3ccc(C(C)C)cc3)C2=O)CC1 67742957 JWEWMFXRAPHCLR-HSZRJFAPSA-N 387.568 2.691 0 50 GFAA CC[C@@H](CNC(=O)N1CCn2cnnc2C1)Cc1cccc(Br)c1 153822099 CQSNNKQHGIEPPZ-CYBMUJFWSA-N 392.301 2.835 0 50 GFAA CC[C@H]1C[C@H](C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)CCO1 328616395 BPBDHUYLOZFACW-LCLWPZTBSA-N 376.545 2.857 0 50 GFAA COc1cccc(CN2CCN(Cc3cccc(C(C)=O)c3)C[C@H]2CCO)c1 39461459 URBCBWWOALFQSB-JOCHJYFZSA-N 382.504 2.967 0 50 GFAA CN(C[C@H](O)COc1cccc(CN2CCC(O)CC2)c1)C1CCCCC1 12578839 YHXCQZJDCUBFJR-NRFANRHFSA-N 376.541 2.648 0 50 GFAA O=C(Cn1c(Cc2ccccc2)nn(-c2ccc(Cl)cc2)c1=O)NC1CCC1 77505795 AAVSBIBLTCFASG-UHFFFAOYSA-N 396.878 2.947 0 50 GFAA CC[C@H](CO)N1CCN([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 174132468 RWXHQIPMJGODST-RTWAWAEBSA-N 385.483 2.894 0 50 GFAA CN1CCN(c2ccc(NC(=O)C(C)(C)c3ccc4c(c3)OCCO4)cn2)CC1 122255074 INYSTXHJJLWOTF-UHFFFAOYSA-N 396.491 2.521 0 50 GFAA CC1(C)CN(C(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 333113364 SPUUJVJIAZRCHJ-WIRVCHQWSA-N 378.513 2.704 0 50 GFAA Cc1ccc([C@H]2OCCC[C@H]2NC(=O)NC2CCN(c3cccnn3)CC2)cc1 373787339 NRDPHQPHZIGLJI-TZIWHRDSSA-N 395.507 2.973 0 50 GFAA COc1ccc(CCC(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)c(OC)c1OC 240540875 GPWLENJHLDOFTK-XHSDSOJGSA-N 391.464 2.889 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CC[C@H](CO)C4)csc3C2)nc1 426360503 YWDWWXBPIBVURS-INIZCTEOSA-N 385.533 2.718 0 50 GFAA CCc1nnc(CNC(=O)c2ccc(-c3ccc(C(=O)N(C)C)o3)cc2)s1 426493325 WSZVGQDEDYZXLC-UHFFFAOYSA-N 384.461 2.992 0 50 GFAA CCOC(=O)C1=C(C)N[B-](c2ccccc2)(c2ccccc2)N=C1C(F)(F)F 198088070 HLRTTYURRMOSHB-UHFFFAOYSA-N 387.190 2.687 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)COc1ccccc1)CC2)[C@@H]1CCCO1 95508546 HVWNFMJHPIBWPA-FQEVSTJZSA-N 380.444 2.768 0 50 GFAA Cc1cc(C)n2nc(CC(=O)NCc3csc(Cc4ccccc4)n3)nc2n1 426477800 XPRCZLHFGNBSBS-UHFFFAOYSA-N 392.488 2.647 0 50 GFAA COc1ccc(OC)c([C@H]2CCN(C(=O)CSc3nnc(C)s3)C2)c1 1506429498 STXQDIYIFDVAFF-LBPRGKRZSA-N 379.507 2.972 0 50 GFAA Cc1ccc(CNC(=O)CCN2CC[C@]3(CCCN(CC4CC4)C3=O)C2)cc1 91745735 UKGXUYSEZIHURK-HSZRJFAPSA-N 383.536 2.726 0 50 GFAA Cc1[nH]nc(-c2ccc(F)cc2)c1CC(=O)N[C@H](Cc1ccccc1)C(=O)O 334160798 MMYGAJTXMHZSQP-GOSISDBHSA-N 381.407 2.879 0 50 GFAA C[C@@H](Cc1cnccn1)NC(=O)Nc1cc(N2CCOCC2)ccc1Cl 96141762 WTVYLCVKZRVZJJ-ZDUSSCGKSA-N 375.860 2.719 0 50 GFAA C[C@H](C(=O)Oc1cccc2cccnc12)N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O 239046694 FXERADPWPCNZNP-UPLOXUSXSA-N 388.423 2.582 0 50 GFAA O=C(NCc1noc(Cc2cccs2)n1)c1cnc(-c2ccncc2)nc1 95365277 MJKJOJJQLFKYII-UHFFFAOYSA-N 378.417 2.504 0 50 GFAA CC(C)(C)c1cc(CNC(=O)[C@H]2CCC(=O)N(CCc3ccccc3)C2)[nH]n1 91562765 QLLATGFOMSGYIO-KRWDZBQOSA-N 382.508 2.805 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)c1ccn(C(C)(C)C)c1)CC2 91644357 QLIYUBGGRLZJEY-UHFFFAOYSA-N 375.513 2.734 0 50 GFAA CN(C)c1cccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)c1 95378342 DYDDXWMXSVOVLZ-OXJNMPFZSA-N 378.476 2.524 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N[C@H](c1ccccn1)[C@H]1C[C@@H](O)C1 244716145 LJFQIZQCJLEGND-PPHDSNJXSA-N 382.869 2.534 0 50 GFAA C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1 245225352 SUFUKTFASVRDSI-DYXWJJEUSA-N 385.552 2.704 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1c(O)c2cccc3c2n(c1=O)[C@@H](C)C3 299738234 LPXNXUGLAJTIJT-NSHDSACASA-N 378.384 2.863 0 50 GFAA O=S(=O)(c1ccccc1)n1ccc2cc(I)cnc21 66054170 WXBJXZNURXJKAE-UHFFFAOYSA-N 384.198 2.878 0 50 GFAA in-vitro Oc1nc(N2CCC[C@@H](n3nccn3)C2)nc2ccc(Br)cc12 1875273536 HMUNYBIRFMCLHL-LLVKDONJSA-N 375.230 2.531 0 50 GFAA CC(C)c1ccc(C(=O)N2CCN(C(=O)NCc3cccnc3O)CC2)cc1 1875269854 GOUPJTPDCRXOAE-UHFFFAOYSA-N 382.464 2.578 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)Cc1cc(-c2ccccc2)on1 1875400909 CFCLRBXAYOPQCP-LPHOPBHVSA-N 393.447 2.718 0 50 GFAA COc1ccc(NC(=O)Cn2c(C)cc(=O)c3ccccc32)cc1C(=O)N(C)C 952982611 ZMQAEYMFQKANAV-UHFFFAOYSA-N 393.443 2.659 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)N1CCO[C@@H](c2ccccc2)C1 952990353 YFXKBMPSOYWKDV-LJQANCHMSA-N 383.473 2.943 0 50 GFAA CCc1cc(S(=O)(=O)N(C)C[C@@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC 952986546 IAKUHXMISHXKIH-AWEZNQCLSA-N 382.526 2.525 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1nc(-c2cccnc2Cl)ns1)C(C)C 888094361 LNJQMCVWRBEBSI-JTQLQIEISA-N 376.891 2.666 0 50 GFAA Cc1cccc(N2CC[C@@H](N(C)S(=O)(=O)c3cccc4cnccc34)C2=O)c1 1775997687 PEFNNWDPKDDINR-LJQANCHMSA-N 395.484 2.969 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(CC[C@H]1CCOC1=O)CC2 276402494 KMDPWPAEVCCAHG-ZWKOTPCHSA-N 376.522 2.904 0 50 GFAA O=C(NC1CC(OCc2ccccc2)C1)C1CCN(C(=O)N2CCCC2)CC1 170596681 MZHJDASYXWQXHU-UHFFFAOYSA-N 385.508 2.778 0 50 GFAA CC(=O)N1CCN(Cc2ccccc2NCc2cnc3nc(C)cc(C)n23)CC1 189444327 QJVUOSGHSXFAGO-UHFFFAOYSA-N 392.507 2.622 0 50 GFAA O=C1C[C@@H](Cc2ccccc2)C(=O)N1C[C@H](O)COc1cccc2[nH]ccc12 191403116 MFKYYGNFNMMXCC-SJORKVTESA-N 378.428 2.525 0 50 GFAA Cc1ccccc1NC(=O)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12004013 ASCBGYLAVIXIRZ-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA CCN(CC)CC(=O)NCc1cccnc1N1CCN(c2ccccc2C)CC1 12309026 TXJFZCCXOYPTTE-UHFFFAOYSA-N 395.551 2.675 0 50 GFAA CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-c2ccc(F)cc2)c1 12717720 WANJZLONUVUPCJ-LJQANCHMSA-N 383.423 2.558 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@@H](C(=O)c2ccccc2SC)C1 13595543 XLQYAEQWOWJONN-CQSZACIVSA-N 378.494 2.966 0 50 GFAA C[C@]1(C2CCN(C(=O)c3ccc(-c4ccccc4)cc3)CC2)NC(=O)NC1=O 15068622 VYOOFPGOROAERL-JOCHJYFZSA-N 377.444 2.804 0 50 GFAA O=C(NCc1ccccn1)c1cnc2scc(-c3ccc(F)cc3)n2c1=O 16647972 CLXOYLBAOHPCDC-UHFFFAOYSA-N 380.404 2.887 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccccc3F)CC2)C(=O)N1c1ccc(Cl)cc1 19757322 KYDCIKXOWRYGMX-GOSISDBHSA-N 387.842 2.933 0 50 GFAA CCc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4OC)CC3)C2=O)cc1 19973670 MZUDWGHGMSUUKE-FQEVSTJZSA-N 393.487 2.712 0 50 GFAA O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NC[C@H]1CCCO1 969090 WQGRPEKHFFBEDR-OAHLLOKOSA-N 384.461 2.915 0 50 GFAA Fc1ccc(OCc2nc(-c3cnc4cccnn34)n([C@@H]3CCOC3)n2)cc1 1857670497 QHMVGIAMZQAFOU-CQSZACIVSA-N 380.383 2.667 0 50 GFAA Cc1nnc(CN2CCC3(CC2)CC(=O)N(Cc2ccccc2)CCO3)s1 1857702815 DFODZFGGWCMLCI-UHFFFAOYSA-N 386.521 2.630 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4cccc(C)n4)[C@H]4CC[C@]3(C2)O4)ccn1 1857718136 AIOVRWROOXEEMR-XHYAQGIWSA-N 378.476 2.507 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(c3ccnc4ccccc34)C[C@]23CC[C@H]1O3 1857719095 CUANGADOBIIQCM-VXIWKAIFSA-N 383.517 2.698 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3cccc(Cl)c3)C[C@]23CC[C@H]1O3 1875243274 ZCFMEOUCCYTZOC-DODZYUBVSA-N 380.941 2.799 0 50 GFAA CCCS(=O)(=O)N1CCC(NC(=O)N2CC3(CC=CC3)[C@@H]2C(C)C)CC1 825686767 QXEUDMXNVMKNJY-KRWDZBQOSA-N 383.558 2.577 0 50 GFAA CC(C)c1ocnc1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 855081807 MQWMVPTVILIPJN-SUMWQHHRSA-N 387.484 2.650 0 50 GFAA COc1ccc([C@H]2NC(=O)CO[C@@H]2c2nc(C)nn2-c2ccccc2)cc1OC 2100542801 FTYUZHMSGLMCOH-UXHICEINSA-N 394.431 2.522 0 50 GFAA O=C(c1ccc(CO)cc1)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2100556185 HLQGFWMEWDEFSI-QHCPKHFHSA-N 378.472 2.976 0 50 GFAA CN(C)Cc1ccc2c(c1)CCN(C(=O)c1ccc(Cn3cncn3)cc1)C2 2325802922 FQBIZFUURSYFHM-UHFFFAOYSA-N 375.476 2.587 0 50 GFAA COC(=O)c1c(NC(=O)c2ccccc2OC)sc2c1[C@@H](C(=O)OC)CC2 622576 ZWFPAOMWXMMADE-NSHDSACASA-N 389.429 2.998 0 50 GFAA O=C(c1cccc(-c2cncc3nc[nH]c23)c1)N1CCCN(c2ncccn2)CC1 2356135609 LZFJXWBSYUZQMV-UHFFFAOYSA-N 399.458 2.767 0 50 GFAA O=C(CC(c1ccccc1)c1ccccc1)N1CCC2(CC1)OCC[C@H](O)[C@@H]2O 2356147313 QRKUSVLXQWGSML-GMAHTHKFSA-N 395.499 2.712 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)cnc1C 2356154912 PJXYATVAVJHDMQ-FHJLPGHOSA-N 390.487 2.647 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(OC)ccc1OC 4065367 JNTSNWAKCKBOOY-MRXNPFEDSA-N 380.466 2.628 0 50 GFAA O=C(NCc1ccc(N2CCCC2=O)cc1)c1cn(CCc2ccccc2)nn1 4399772 BOKRSQDNHNHPRM-UHFFFAOYSA-N 389.459 2.578 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)CN2CC3(CCCCC3)CC2=O)C1 23192228 OWHARRUOTHTZLQ-QGZVFWFLSA-N 383.492 2.686 0 50 GFAA Cc1ccc([C@@H](NC(=O)c2cc3n(n2)CCN(C)C3)c2cccnc2)cc1C 65408996 UVZWXZXZYPRGKB-OAQYLSRUSA-N 375.476 2.860 0 50 GFAA COc1cc(CN2CCN(Cc3cccs3)[C@@H](CCO)C2)cc2c1OCO2 20542557 JAXLFGOURWCIAV-INIZCTEOSA-N 390.505 2.554 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@@H]3CCN(c4ccccc4)C3)c2c1 252484592 FZWMWQULKZSLSS-HNNXBMFYSA-N 382.489 2.972 0 50 GFAA CN(CCC(C)(C)O)c1ccc(C(=O)N2CCCC[C@@H]2CCn2cccn2)cn1 67843411 SCQINZHUBKFFDG-LJQANCHMSA-N 399.539 2.960 0 50 GFAA CCOc1ccccc1CN1CCN(C2CCN(C(C)C)CC2)[C@@H](CCO)C1 22919084 AKWJMNOUFSXYOQ-QFIPXVFZSA-N 389.584 2.827 0 50 GFAA CCCCn1c(CN(C)Cc2nc3ccccc3[nH]2)cnc1S(=O)(=O)CC 12445618 WDHAZIWUDGVGFM-UHFFFAOYSA-N 389.525 2.985 0 50 GFAA Cc1cccc([C@@H](NC(=O)C2CCN(S(C)(=O)=O)CC2)c2ccccc2)c1 65362000 VIFSBNNRGTVKEN-FQEVSTJZSA-N 386.517 2.872 0 50 GFAA Cc1ccc(O[C@H]2CCN(S(=O)(=O)c3ccc(C(F)(F)F)nc3)C2)cn1 328628928 OERKLBKTMIPLAB-ZDUSSCGKSA-N 387.383 2.646 0 50 GFAA COc1cccc(/C=C/C(=O)NN2C(=O)N[C@@](C)(CCc3ccccc3)C2=O)c1 253423180 XZQFOXCQGTWSIQ-LEQVUBRHSA-N 393.443 2.683 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3csc(C(C)(C)C)n3)CC(=O)N2C)cnn1C 328614289 AFPVVTRJBYNRQC-SUMWQHHRSA-N 375.542 2.792 0 50 GFAA C[C@H](CS(C)(=O)=O)N[C@@H](Cc1ccc(F)cc1)[C@@H]1COc2ccccc2O1 368142544 PPXYERHEALFZPF-LIVBEALHSA-N 393.480 2.600 0 50 GFAA Cc1cc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)n(C)n1 71754265 BKQPLCVPASJXSJ-LJQANCHMSA-N 386.471 2.767 0 50 GFAA O=C1CCCN1CC[C@H]1CCCCN1C(=O)c1ccc(SCCO)cc1 77393503 ACZCKBMUGZTIII-QGZVFWFLSA-N 376.522 2.778 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(c1cncc3nncn13)CC2 377151989 QQIKQKUJJIRVDC-MRXNPFEDSA-N 382.493 2.593 0 50 GFAA Cc1ccc(N2CCN(C(=O)c3sc4nc[nH]c(=O)c4c3C)[C@@H](C)C2)cc1 77428112 YLDCHSBOJWRIRU-ZDUSSCGKSA-N 382.489 2.952 0 50 GFAA Cc1cc(C)cc(NC(=O)C[C@@H]2COCCN2C(=O)Cc2c(C)noc2C)c1 72479132 BFGZWJYBLUJHOG-GOSISDBHSA-N 385.464 2.707 0 50 GFAA C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1)C2=O 242191306 XENLBVNYQMIUMU-FJZAXULXSA-N 389.418 2.724 0 50 GFAA CNC(=O)[C@@H]1CN(C(=O)NCC2(c3cccc(Cl)c3)CCCCC2)CCO1 455376774 DAIHAXJMEYMWFM-KRWDZBQOSA-N 393.915 2.698 0 50 GFAA Cc1nccn1C[C@H]1CCCN1C(=O)Nc1cc(F)cc(N2CCOCC2)c1 176941244 QFMUAEYYRMBFCP-GOSISDBHSA-N 387.459 2.864 0 50 GFAA CCN(CC(=O)N1CCc2cc(OC)c(OC)cc2C1)[C@@H]1CCOC(C)(C)C1 289711010 HYXSPZXGLABYOK-GOSISDBHSA-N 390.524 2.868 0 50 GFAA COc1ccccc1C1=NO[C@@H](C(=O)Nc2ccc(Br)cn2)C1 20601975 XWIIWGFWRHFSME-CQSZACIVSA-N 376.210 2.984 0 50 GFAA CC(C)(Oc1ccccc1)C(=O)N[C@@H]1CCOC[C@H]1OCc1cscn1 223013181 CXCUJFDUOBZAQL-IAGOWNOFSA-N 376.478 2.791 0 50 GFAA CN1CC[C@]2(CCC1=O)CN(Cc1cnc(C3CCCCC3)nc1)CCN2C 95374134 HZRJOVJOOCOTMM-JOCHJYFZSA-N 385.556 2.653 0 50 GFAA Cc1cc(O)nc(CCNC(=O)N2CCC[C@@H](COc3ccccc3C)C2)n1 426405787 UOZPINCWABWMGK-QGZVFWFLSA-N 384.480 2.842 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)CCn3ccc(C)n3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95511146 OAOZQDVZLSNROK-MDNUFGMLSA-N 394.519 2.679 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccc2)C3)c(O)c1 95372534 FUOKCMZMWZXNOL-DOTOQJQBSA-N 380.444 2.778 0 50 GFAA CN1CCN(C[C@@H]2CN(Cc3ccc(C4CCCC4)s3)C[C@@H]2CO)CC1 95383394 PBPCHTGJKKLODE-RTBURBONSA-N 377.598 2.693 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)c3ccc(CSC)o3)C2)CCC1=O 91951877 NNLRUPYFICXLPG-LJQANCHMSA-N 380.510 2.634 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)c1ccc(=O)n(C)c1 95517512 GGWDBRUBVJTPKN-UHFFFAOYSA-N 385.483 2.551 0 50 GFAA CCCc1cncnc1N1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 244840259 UJYPKOYZZGJUBE-WGSAOQKQSA-N 386.540 2.942 0 50 GFAA CN1C(=O)[C@](CC(=O)N[C@H]2CC[C@H](O)CC2)(Cc2ccccc2)c2ccccc21 248000396 AFTKFBYACWFVDN-JXQFQVJHSA-N 392.499 2.953 0 50 GFAA Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N1CCCC[C@H]1CN 299738639 DLGOIUIPCGGRMP-HNNXBMFYSA-N 395.429 2.785 0 50 GFAA CCN(C(=O)c1ccc(-c2cccc3c(=N)cc[nH]c23)cc1)[C@H]1COC[C@@H]1O 534664650 PNGKOGMMYMSMIY-PMACEKPBSA-N 377.444 2.536 0 50 GFAA COc1ccc(Cn2ccn3nc(-c4cccc(F)c4)c(CO)c3c2=O)cc1 263617987 QTZYCWNRDVNBKC-UHFFFAOYSA-N 379.391 2.851 0 50 GFAA O=C(CN1CCOc2ccccc2C1)N[C@H](Cn1ccnc1)c1ccccc1 827995239 WRNDXMILIUXASH-HXUWFJFHSA-N 376.460 2.635 0 50 GFAA O=C(/C=C/c1cc(CO)cs1)N1CCN([C@@H]2CCc3ccccc3C2)CC1 828835557 DOHNOPCYQUTPGV-AQKVLALTSA-N 382.529 2.955 0 50 GFAA CC(C)n1cnnc1CNC(=O)N1CCC[C@H](COc2ccc(F)cc2)C1 584897831 XFSCNNSTKNFPGW-HNNXBMFYSA-N 375.448 2.999 0 50 GFAA CCc1ccccc1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397692 KHUZKKVWRKWWMK-LJQANCHMSA-N 381.524 2.726 0 50 GFAA Cc1noc([C@@]2(C(F)(F)F)CCN(Cc3ncc(CN(C)C)s3)C2)n1 952893817 WQXQBIZMUMYXOV-CQSZACIVSA-N 375.420 2.602 0 50 GFAA O=C(N1CCN([C@@H]2CCNC2)CC1)C1(Cc2ccc(Cl)cc2)CCCC1 952845911 KJBQIJJQKPJBIB-LJQANCHMSA-N 375.944 2.949 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N1CCC(NC2CCC2)CC1)c1ccco1 1875271862 XXLZGFONDPFDCA-HXUWFJFHSA-N 395.503 2.754 0 50 GFAA O=C(NC[C@H]1CCCN(CCS(=O)(=O)c2ccccc2)C1)c1cccs1 952969174 REFYTUNRKBOOJL-MRXNPFEDSA-N 392.546 2.664 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2nnc(-c3ccon3)s2)CC1 225492057 QPHIDQGLFXIMPH-UHFFFAOYSA-N 399.432 2.777 0 50 GFAA Cc1nn(C)c(N2CCOCC2)c1CNCC1(O)CCC(C(C)(C)C)CC1 111388666 IPHLEQZKPAVAJI-UHFFFAOYSA-N 378.561 2.622 0 50 GFAA CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)CNC(=O)c2ccccc2)C(C)(C)C1 225769917 QQGIQKBTGSRJJR-MRXNPFEDSA-N 389.496 2.568 0 50 GFAA N[C@@H](CNS(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C1CC1 193315324 RXPSLRNJCAQYAH-JTQLQIEISA-N 388.114 2.772 0 50 GFAA O=C(NC[C@@H](O)c1ccccc1)NC1CCN(Cc2ccc(F)c(F)c2)CC1 193461065 VZXFEGQMNZDFRO-HXUWFJFHSA-N 389.446 2.962 0 50 GFAA O=C(c1cccnc1)N1CCC(NC[C@H](c2cccnc2)N2CCCCC2)CC1 1506410228 SLMAHWQMDIJAEH-JOCHJYFZSA-N 393.535 2.898 0 50 GFAA Cc1nc(-c2cccnc2)ncc1C(=O)Nc1ccc2c(c1)N(C)C(=O)[C@@H](C)O2 1506398479 DOJDBNMDNFAKNT-CYBMUJFWSA-N 389.415 2.843 0 50 GFAA O=C1CC[C@@H](C(=O)N2CCCN(Cc3ccccc3-c3ccccc3)CC2)CN1 1529180659 HHDYGZASTOVLQT-HXUWFJFHSA-N 391.515 2.914 0 50 GFAA CN1CC[C@]2(C(=O)N3CCCC3)CCCN(C(=O)C3(c4ccccc4)CC3)[C@H]2C1 1775977509 HHSLOYQAUYEWHM-GBXCKJPGSA-N 395.547 2.654 0 50 GFAA O=C(c1cn([C@@H]2CCCN(Cc3c(F)cccc3F)C2)nn1)N1CCCC1 12454844 GSDKIZOZYYLCLO-CQSZACIVSA-N 375.423 2.629 0 50 GFAA CCN(CC)C(=O)c1cn([C@@H]2CCCN(Cc3c(F)cccc3F)C2)nn1 12509006 WTJAGMBXNQJJLZ-CQSZACIVSA-N 377.439 2.875 0 50 GFAA COc1cc(NC(=O)CCN2CCN(Cc3ccccc3)CC2)cc(OC)c1 19851831 DYKNMTQQRZKZBS-UHFFFAOYSA-N 383.492 2.850 0 50 GFAA COCCNC(=O)CN(c1ccc(Cl)cc1C)S(=O)(=O)c1ccccc1 4534951 WUYORKMVSIZHPM-UHFFFAOYSA-N 396.896 2.606 0 50 GFAA CN(C)c1cccc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1 1857682314 VETDRYHTDFTIQS-JOCHJYFZSA-N 379.460 2.642 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC2(CC1)OCCc1cc(C(=O)O)sc12 1857685631 MYHDFVMXRFHMAE-UHFFFAOYSA-N 376.434 2.755 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)C2(c3ccc(Cl)cc3)CCC2)CC[C@H]1O 1857716333 HLFWQODIPHCMJT-QUCCMNQESA-N 395.927 2.760 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC3(CCc4c(O)nc(C5CC5)nc43)CC2)n1 1857736462 PZQKCLQKAHXQHJ-UHFFFAOYSA-N 387.871 2.567 0 50 GFAA CC1(C)CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC[S@@]1=O 459348214 WRGOKDBAXQYYTH-VWLOTQADSA-N 379.404 2.788 0 50 GFAA NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@H](Cc2ccccc2)C2CC2)c1 153589525 IHDJFPQZTFSYSZ-MRXNPFEDSA-N 396.871 2.878 0 50 GFAA Cc1ccnc(N2CCN(C(=O)c3cc(N4CCCC4=O)ccc3F)CC2)c1 158875915 DEFONIKWGAOPDI-UHFFFAOYSA-N 382.439 2.618 0 50 GFAA COc1cc(/C=c2\sc3nc4ccccc4n3c2=O)cc2sc(=O)oc12 8657244 MNCLPWLQJBACST-ZSOIEALJSA-N 382.422 2.633 0 50 GFAA CN(Cc1nccn1Cc1ccccc1)C1=NC[C@@H](c2ccc(CO)cc2)N1 2325863799 XBXHNNCYFTZSSW-FQEVSTJZSA-N 375.476 2.556 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)c1cccc(-c3cncc(N)n3)c1)CC2 2356135393 BXEHZVHPYCNIDX-UHFFFAOYSA-N 390.443 2.942 0 50 GFAA C[C@@H](C1CCN(c2noc(-c3ccccc3)c2C(=O)O)CC1)N1CCOCC1 2356148726 OYNOYABNEOSZIT-HNNXBMFYSA-N 385.464 2.977 0 50 GFAA Cc1nn(C)cc1CC(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 2356153922 AGPHUOZRNRNLQA-UHFFFAOYSA-N 378.476 2.843 0 50 GFAA CN(C)Cc1ccc(-c2ccc(C(=O)NCCc3cnc[nH]3)cc2)c(CO)c1 2356165762 MXRATEWFAFDCLM-UHFFFAOYSA-N 378.476 2.603 0 50 GFAA NCc1cccc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)c1 2356170119 VPPJDGHOIMPVFY-HSZRJFAPSA-N 377.488 2.943 0 50 GFAA CCn1cc(CN[C@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)c(C)n1 55107971 YNXQMFOMGUMPJM-IBGZPJMESA-N 398.555 2.766 0 50 GFAA O=C(NC1CC1)[C@@H]1C[C@@H](Sc2nc3ccccc3[nH]2)CN1Cc1ccccn1 52606464 NAWJCPAEVKPHAI-APWZRJJASA-N 393.516 2.972 0 50 GFAA CC(C)c1nc(C(=O)N2CC[C@@H](c3cnn(C)c3)C2)nn1-c1cccc(F)c1 117675040 BSLAPEJJEWPRLT-CQSZACIVSA-N 382.443 2.893 0 50 GFAA CC(C)(N)c1cn(C[C@@H]2CCCN(C(=O)NCc3ccc(Cl)cc3)C2)nn1 23620063 ZXBGOAIIRSFKPE-OAHLLOKOSA-N 390.919 2.747 0 50 GFAA C[C@H]1[C@H](C)CCC[C@H]1NC(=O)NC(=O)CN1CCC(=O)Nc2cc(F)ccc21 252670465 KQRKLCCHPGYTMZ-VNHYZAJKSA-N 390.459 2.625 0 50 GFAA O=S(=O)(c1ccccc1F)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 119886881 LVROCFYAIURFHO-CQSZACIVSA-N 378.473 2.712 0 50 GFAA Cc1ccc(Cl)c(OCn2ccc(-c3nc4c5cnn(C)c5ncn4n3)n2)c1 2803002 FLRPSSFJHUZPJC-UHFFFAOYSA-N 394.826 2.873 0 50 GFAA O=C(Nc1cccc(-c2nc[nH]n2)c1)[C@H]1CCCN1C(=O)Cc1ccccc1 363539572 MIFQJUBDIRXZFR-GOSISDBHSA-N 375.432 2.644 0 50 GFAA O=C(Cn1cn[nH]c1=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 122445961 YZXSZGWVIHPHAR-OAHLLOKOSA-N 395.850 2.654 0 50 GFAA NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cnn(-c2cccc(Cl)c2)c1 122556499 VWXXAMKYPHWVHD-SFHVURJKSA-N 380.835 2.578 0 50 GFAA CCc1ccc([C@H]2CNCCN2C(=O)c2cc3c(nc2O)CCCC3=O)cc1 261709009 KIAUNWZHOHASRJ-LJQANCHMSA-N 379.460 2.655 0 50 GFAA O=C(N[C@H]1CCOC2(CCCCC2)C1)[C@@H]1CCS(=O)(=O)c2ccccc21 332752576 GKYINYWZWLYEFG-DOTOQJQBSA-N 377.506 2.946 0 50 GFAA CN(CC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)c1ncnc2[nH]cnc12 376157701 MDQNEDKHBOVXOM-GVDBMIGSSA-N 376.464 2.584 0 50 GFAA Cn1cc([C@@H](NC(=O)N2CCOc3cc(O)ccc3C2)c2ccc(F)cc2)cn1 376933286 TUYSXBGUSOYFSC-FQEVSTJZSA-N 396.422 2.958 0 50 GFAA O=C(c1ccc(OCc2ccccc2)nc1)N1CCN(C2CCOCC2)CC1 175833284 INLMZEFDUMDAPN-UHFFFAOYSA-N 381.476 2.597 0 50 GFAA CCn1cc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)cn1 71775618 KVVMOBZGVVIWRP-IBGZPJMESA-N 386.471 2.941 0 50 GFAA C[C@H](OC(=O)C1=NN(c2ccccc2)C(=O)CC1)C(=O)N[C@@H]1CCCC[C@H]1C 245284854 UKPQPLKFCIELAZ-HLLBOEOZSA-N 385.464 2.796 0 50 GFAA CNC(=O)CCc1cccc(NC(=O)N2CC(Oc3ccccc3OC)C2)c1 426369945 NIZSGZAUNOSHMG-UHFFFAOYSA-N 383.448 2.669 0 50 GFAA COc1ccccc1CCC(=O)N1CCn2nc([C@H](O)c3ccccc3)cc2C1 221325716 FIBSHYNMCSEALS-HSZRJFAPSA-N 391.471 2.948 0 50 GFAA CN1C(=O)N(C)C(=O)C2(Cc3ccccc3N3C[C@H](c4ccccc4)C[C@H]32)C1=O 229905628 QLTDJNLCFQACAO-MJGOQNOKSA-N 389.455 2.642 0 50 GFAA CC(C)n1cnnc1[C@@H](C)NC(=O)N1CCN(C/C=C/c2ccccc2)CC1 426431092 QNJDOQMJMQLFED-RUJXFNLJSA-N 382.512 2.961 0 50 GFAA CC(C)c1noc([C@@H]2CCCN(C(=O)Nc3ccc4c(c3)OCC(=O)N4)C2)n1 96149736 SYCMATLFQNPVGU-GFCCVEGCSA-N 385.424 2.935 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)Cn3ccccc3=O)CC2)C1 96162098 YEQPJWBULZFEMP-NRFANRHFSA-N 393.531 2.967 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCCCSc1nnc(C)s1)C2 95382767 NEFWTJHVVXGPEX-CYBMUJFWSA-N 379.507 2.705 0 50 GFAA COc1ccc(OC)c([C@H](C)NC(=O)c2cnc(-c3ccccn3)nc2O)c1 92078233 YDFHPTZKFIMDBS-LBPRGKRZSA-N 380.404 2.752 0 50 GFAA COc1ccc(C(=O)N2CCC(c3nnc(CN4CCCC4)n3C)CC2)c(C)c1 96139238 KQKVMCUWVOIVKS-UHFFFAOYSA-N 397.523 2.748 0 50 GFAA COc1ccc(NC(=O)N2CCC[C@@H](CN3CCCC3=O)C2)cc1NC(C)=O 96164783 VPSJQHBXCQVGED-HNNXBMFYSA-N 388.468 2.520 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)Nc1ccc(F)c(F)c1)CCN2C 95359715 QKDKYWYVOUONGH-IBGZPJMESA-N 380.439 2.515 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Cn3ccc4ccccc43)C2)CCC1=O 91351028 YNFDJAUSMXOOBL-QFIPXVFZSA-N 383.492 2.519 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)N2CCCN2[C@H]3c2ccc(Cl)cc2)cc1 239302836 FQAIRYRCTPLSPA-GBESFXJTSA-N 397.862 2.884 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)c(O)c1 91476045 HOYZXTBPVPADBF-QGZVFWFLSA-N 386.492 2.724 0 50 GFAA CCN(c1cc(C)nc(Nc2c(F)cccc2F)n1)[C@H]1CCS(=O)(=O)C1 243463155 NIHOWQVNZVWNAO-LBPRGKRZSA-N 382.436 2.820 0 50 GFAA O=C(NC1Cc2ccccc2C1)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244708088 KNFJTJCWEOHFMW-WGSAOQKQSA-N 391.471 2.703 0 50 GFAA O=C(Nc1ccc2c(c1)OCCO2)c1nnn2c1CO[C@H](c1ccc(F)cc1)C2 263618362 SOTSAQVJMONQLS-SFHVURJKSA-N 396.378 2.712 0 50 GFAA CCNc1ccc(-c2cccc(C(=O)NCc3nc(CSC)no3)c2)nn1 534648663 LIRQUGMFQYLHQL-UHFFFAOYSA-N 384.465 2.751 0 50 GFAA CSCCN1CCC(NC(=O)N(Cc2c(C)nn(C)c2C)C2CC2)CC1 584893427 STFGUFHMHFNIEQ-UHFFFAOYSA-N 379.574 2.538 0 50 GFAA FC(F)COCCN1CC[C@](c2nc(-c3ccncc3)no2)(C(F)(F)F)C1 952892940 QDIKGUXWYLXYRE-HNNXBMFYSA-N 392.328 2.919 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)CC1CCCCC1)c1cc(=O)n2[nH]cnc2n1 1875260024 YWIJADPFEYRVEB-KRWDZBQOSA-N 379.464 2.729 0 50 GFAA O=C(CS(=O)(=O)CCC(F)(F)F)Nc1ccc(Oc2ccncn2)cc1 1875295765 PVRPYCWWEDFPCY-UHFFFAOYSA-N 389.355 2.575 0 50 GFAA COc1cc(Cc2c[nH]c(=N)[nH]c2=N)ccc1OCc1cnc(Cl)c(F)c1 1875374868 HWCMOVGZUVZJCG-UHFFFAOYSA-N 389.818 2.668 0 50 GFAA Cc1nc(C(C)C)[nH]c(=N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)c1Br 1875398820 FVDNOGWAHKALJP-MGPQQGTHSA-N 394.317 2.541 0 50 GFAA O=C(NCCN1CC=CC1)Nc1cccc(COc2ccc3c(c2)OCO3)c1 1318961000 WQGYIBQBFXPULR-UHFFFAOYSA-N 381.432 2.988 0 50 GFAA CCOc1cnc(C(=O)N2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 187598187 GDUANYGWGMYOHE-HNNXBMFYSA-N 378.436 2.680 0 50 GFAA O=C(O)CC[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21 191547082 QIHSPMIBZJDZDP-NVXWUHKLSA-N 384.407 2.844 0 50 GFAA O=C(Nc1ccc2c(c1)CCO2)N1CCN(c2ncnc3sccc23)CC1 193028375 ZOOHNRMQIDAFPV-UHFFFAOYSA-N 381.461 2.980 0 50 GFAA CN(C)Cc1ccc([C@H]2CCCN2C(=O)CCC(=O)Nc2nncs2)cc1 1506419496 CZBWKMGLZWLBPF-MRXNPFEDSA-N 387.509 2.682 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NC[C@@H]2CCCCN2C)ccc1F 1704335934 IKEVGPSGMDRYFQ-AWEZNQCLSA-N 390.459 2.769 0 50 GFAA Cn1cc(CCC(=O)N2CC[C@@]3(CCCN(CC4CCCCC4)C3=O)C2)cn1 11753464 YHOLROKGIJVGPZ-QFIPXVFZSA-N 386.540 2.774 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)N3c4ccccc4C[C@H]3C)c2)C1=O 12003291 RTLYDQFQCNZRIU-UONOGXRCSA-N 384.457 2.591 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CCCn4cncn4)C3)C2)c1 12297462 QJCRNMSBCFQTGL-QFIPXVFZSA-N 381.524 2.881 0 50 GFAA CCN(CCN(C)C)C(=O)c1sc2ncnc(NC[C@H]3CCCO3)c2c1C 14972399 OXBVIBXMALJBPI-CQSZACIVSA-N 391.541 2.614 0 50 GFAA COc1ccc(C2=NO[C@@H](C(=O)N3CCN(Cc4ccccc4)CC3)C2)cc1 19894422 UVHMIXHJBBABEH-OAQYLSRUSA-N 379.460 2.533 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)Nc2nc3ccccc3s2)nc1N 4757586 FGYIIOYNCPOJHJ-UHFFFAOYSA-N 389.462 2.576 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2-c2ccccc2Cn2cccn2)cn1 1857698640 BHEUCBSHALDAIX-UHFFFAOYSA-N 389.463 2.507 0 50 GFAA O=C(c1ccsc1)N1CCC[C@]2(C1)CN(c1ncccc1F)CC[C@H]2O 1857698924 AYPWCNLOTWNMRJ-VQIMIIECSA-N 375.469 2.776 0 50 GFAA O=C(C1CCCCC1)N1CCO[C@@H](CN2CCC(O)CC2)[C@@H]1c1ccccc1 1857727688 XZPFFJQHLJKGFU-VXKWHMMOSA-N 386.536 2.992 0 50 GFAA CCC(=O)N1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NCc2cc(C)no2)C1 1875246371 OKHDULRHPGRWFI-QFIPXVFZSA-N 395.507 2.901 0 50 GFAA COCc1ccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1 252487073 HRVVLDMFGHGWIB-QGZVFWFLSA-N 388.489 2.872 0 50 GFAA COc1ccc(N2C(=O)C[C@H](NC34CC5CC(CC(C5)C3)C4)C2=O)c(OC)c1 19881075 QDMQGUGANXXLCL-LEJIWSMMSA-N 384.476 2.894 0 50 GFAA CCc1nc(CN2CCOC[C@H]2c2c(C)nn(-c3cccc(OC)c3)c2C)n[nH]1 364280836 SBEZQKVMAOKLOR-SFHVURJKSA-N 396.495 2.752 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CSCCS1)C2 826753046 KQUYPTCTPUDGOG-XGUBFFRZSA-N 386.583 2.987 0 50 GFAA O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(I)cc1 100293257 RVGHVGYEUBBIMP-NGERZBJRSA-N 383.185 2.753 0 50 GFAA O=C(CNS(=O)(=O)c1ccccc1)NCc1ccc(-c2ccccc2)cc1 2325735157 LRRPFAHIMQCTLV-UHFFFAOYSA-N 380.469 2.948 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccccc2Cl)S(C)(=O)=O)c(OC)c1 827679 RHIWCEARWNZARG-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA COc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc(OC)c1OC 910897 JGULMNWEIQNBRV-UHFFFAOYSA-N 376.434 2.614 0 50 GFAA CCSCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc(OC)ccc1OC 2784128 ZNMOFZUBBULFLY-KRWDZBQOSA-N 394.493 2.970 0 50 GFAA Cc1cccc([C@@H]2c3[nH]c4ccccc4c3CCN2C(=O)CN2CCOC2=O)n1 13596195 HHCUADUIXZSAPP-OAQYLSRUSA-N 390.443 2.798 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NC1Cc3ccccc3C1)C2 14531820 MGZPVTDQIAEMKT-SFHVURJKSA-N 378.520 2.753 0 50 GFAA COC(=O)c1cc(Br)cc2[nH]nc(I)c12 14983957 AYZUZQGRXQHAMA-UHFFFAOYSA-N 380.967 2.717 0 50 GFAA COc1ccc(CN2CCC[C@H](n3cc(C(=O)N4CCCCC4)nn3)C2)cc1 15002475 XMQWFVRGXRIJOS-SFHVURJKSA-N 383.496 2.750 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)c2ccsc2)CC1 15068536 QSPGBWUCQXVOTL-SFHVURJKSA-N 377.554 2.981 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2cccc(Cl)c2)CN1C1Cc2ccccc2C1 32511766 NZONJNBMTQIWRM-CTNGQTDRSA-N 383.923 2.786 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2cccc(F)c2)CN1Cc1ccc(C)s1 39355023 MZOLWRNMNJCORL-RDJZCZTQSA-N 376.453 2.742 0 50 GFAA O=c1cc(CN2CCC[C@H](CCc3ccccc3C(F)(F)F)C2)[nH]c(=O)[nH]1 72151595 ZWMNIZWPXWLNCT-CYBMUJFWSA-N 381.398 2.927 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c1 72446832 ROQXDRYPKCHJPS-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)N(C)CCc1nc3ccc(F)cc3[nH]1)CC(=O)N2 91526102 JDIIIXRZUTURCQ-OAHLLOKOSA-N 396.422 2.838 0 50 GFAA Cc1nn(CC(=O)N2CCC3(CC2)CC(=O)N(CC(C)C)C3)c(C)c1Cl 95368010 RVAZPAIREXRHTM-UHFFFAOYSA-N 380.920 2.650 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)CSc1ccccc1)C2 95376478 APORGKMQLYBCHG-DLBZAZTESA-N 381.501 2.937 0 50 GFAA COc1cccc(OCC(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccn2)C3)c1 95377981 PGTKOTVLBHFANV-PKOBYXMFSA-N 381.476 2.592 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)Cc3cn(C)c4ccccc34)C2)CCC1=O 95521651 LNNLTKOWNRHFLS-HSZRJFAPSA-N 397.519 2.598 0 50 GFAA Nc1ncccc1CN1CCC(c2nnc(CN3CCCC3)n2C2CC2)CC1 96179969 GVCDYRGDVRKMHE-UHFFFAOYSA-N 381.528 2.566 0 50 GFAA CCc1ncc2c(n1)CN(C(=O)[C@H](c1ccccc1)N1CCCCC1=O)CC2 119089601 BLNQKGJIGVMOQX-NRFANRHFSA-N 378.476 2.678 0 50 GFAA O=C(N[C@H]1CC(=O)N(CC(F)(F)F)C1)c1cccc(-c2noc(C3CC3)n2)c1 173677351 NGELKCDGWMXNEB-ZDUSSCGKSA-N 394.353 2.507 0 50 GFAA O=S(=O)(c1cnn(CC(F)F)c1)N(Cc1ccccc1)C[C@@H]1CCCO1 186624686 ZUIDJLSHABXWFK-HNNXBMFYSA-N 385.436 2.518 0 50 GFAA COc1ccnc(NC2CCN(C(=O)NCC3(c4cccc(F)c4)CC3)CC2)n1 190177497 MCYAGKOJVNFIPM-UHFFFAOYSA-N 399.470 2.942 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 236823279 OHVSZIBBSYUBAX-LEWJYISDSA-N 390.439 2.989 0 50 GFAA CCn1cc(C(=O)N[C@@H](C)c2nc(C)no2)c(=O)c2cc(F)c(F)c(F)c21 244811643 SIGRVBOYMHTMCP-ZETCQYMHSA-N 380.326 2.621 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)CSc1ccccc1 247792017 APORGKMQLYBCHG-SJORKVTESA-N 381.501 2.937 0 50 GFAA CCn1cc([C@H]2CN(C(=O)Nc3ccc(N4CCCC4=O)cc3)CCO2)cn1 252498898 RPJHZXVETKNXFD-GOSISDBHSA-N 383.452 2.635 0 50 GFAA Nc1cc(OC(=O)c2ccc(F)cc2Cl)nn1S(=O)(=O)c1ccccc1 253433606 ZIVIVRKSZDPKGC-UHFFFAOYSA-N 395.799 2.714 0 50 GFAA CCc1c(C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)cnn1C(C)(C)C 263957084 CNWZDZSIIVWFQB-UHFFFAOYSA-N 383.456 2.746 0 50 GFAA NC(=O)c1cc([C@H]2CCCN(C(=O)c3ccnc(OC4CCCCC4)c3)C2)n[nH]1 271847490 VLGNSWUOIPGGHO-HNNXBMFYSA-N 397.479 2.635 0 50 GFAA C[C@H]1Oc2ccccc2[C@H]1NC(=O)Nc1ccccc1N(C)S(C)(=O)=O 288820089 NXDCTSCGTPGQSI-PXAZEXFGSA-N 375.450 2.726 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)CCO1 299750373 NHARZAFNLXILSV-AWEZNQCLSA-N 384.413 2.996 0 50 GFAA O=C(NCC1(CO)CCOCC1)Nc1cccnc1Oc1ccccc1F 299758770 NAPDRUVKVZCOPD-UHFFFAOYSA-N 375.400 2.924 0 50 GFAA CN(Cc1nc2c(s1)CCCC2)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 299786002 QTBOAUNXVWGEKJ-UHFFFAOYSA-N 385.493 2.876 0 50 GFAA Cn1c([C@@H]2CCCN2CC(=O)N2CCO[C@@H]3CCCC[C@@H]32)nc2c1CCCC2 328621662 APUSNIQJYFUNBK-SLFFLAALSA-N 386.540 2.606 0 50 GFAA CN(C)C(=O)[C@H](NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1ccccc1 328625377 DCBJTEQDFIEMQW-CXAGYDPISA-N 380.414 2.883 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2cnn(C)c2C(F)(F)F)n1C 328644580 RWMNRKCRBZNJNN-AWEZNQCLSA-N 383.418 2.864 0 50 GFAA O=C(NCc1nccn1CC(F)(F)F)[C@H]1CCCN(Cc2ccccc2)C1 363625650 GFPJYQMMSIZFEE-INIZCTEOSA-N 380.414 2.974 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CCCC[C@@H]1CN1CCCC1=O 365506333 HFAZJJVVXXCSGT-GOSISDBHSA-N 398.507 2.896 0 50 GFAA O=C(c1ccccc1)N1CC[C@H](Cn2cnc3c(cnn3-c3ccccc3)c2=O)C1 374545033 VGYSFQQVSQCRAP-KRWDZBQOSA-N 399.454 2.745 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1 375688875 LLBDJWFYYXNLLO-XUVXKRRUSA-N 399.516 2.541 0 50 GFAA CC(C)Oc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)nn1 376572392 GGKKGHZEFHCWJJ-KZNAEPCWSA-N 382.464 3.300 0 50 GFAA CO[C@@]12CC[C@@H](OCC3CC3)C[C@@H]1N(C(=O)CCn1nc(C)cc1C)CC2 426551035 HCBHRCCEESXISN-SVFBPWRDSA-N 375.513 2.855 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCC3(C)COC3)csc2C1 426563040 FQGAIPHIXGEEID-UHFFFAOYSA-N 375.494 2.678 0 50 GFAA COCCCOC1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C1 478556226 AXAPVDGQEXLJKE-UHFFFAOYSA-N 394.269 2.717 0 50 GFAA CN1CCCC[C@H]1CCC(=O)Nc1ccc(-n2ncc3c(O)ncnc32)cc1 480887530 YPBNGMBBYFZDCZ-HNNXBMFYSA-N 380.452 2.724 0 50 GFAA CCCN1C[C@H](NC(=O)c2ccccc2N(C)C(=O)c2cccs2)CC1=O 822919218 SXHYSOLRJUVNHI-CQSZACIVSA-N 385.489 2.765 0 50 GFAA COc1ccc(CN(C(=O)c2ccc3c(c2)CC[C@@H](N)C(=O)N3)C2CC2)cc1 912103331 SBONTZZZEXORRP-LJQANCHMSA-N 379.460 2.712 0 50 GFAA Cc1ccc(C(=O)NCC(C)C)cc1NC(=O)[C@H]1CCCN(C(=O)N(C)C)C1 952980043 FBKNAIQIRYCHTM-KRWDZBQOSA-N 388.512 2.713 0 50 GFAA CN1CCC(n2nccc2NC(=O)CCCc2nc(-c3ccncc3)no2)CC1 1506419589 SRXSJTNTIBCZMK-UHFFFAOYSA-N 395.467 2.556 0 50 GFAA CC[C@@H]1C=CCN1C(=O)Cn1nnnc1C1(NCc2ccccc2)CCCCC1 1506419915 ZRROJPLHZSZOGP-LJQANCHMSA-N 394.523 2.799 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(Oc3ccccc3)o2)C[C@@H]1NS(C)(=O)=O 1565506790 WYMAIVASEPLMQV-CVEARBPZSA-N 392.477 2.718 0 50 GFAA O=C(c1csc2ccccc12)N1C[C@H]2CN(Cc3ccns3)C[C@@]2(CO)C1 1772813131 WWAXWHVJFFRERU-VLIAUNLRSA-N 399.541 2.924 0 50 GFAA O=C(c1cc[nH]n1)N1CC[C@H]2[C@@H](CCCN2C(=O)CC2(C(F)(F)F)CC2)C1 1775993199 XGLPBSFBTQGBAV-JSGCOSHPSA-N 384.402 2.595 0 50 GFAA COc1ccccc1-c1cccc(C(=O)N2C[C@@H]3CCOC[C@]3(C(=O)O)C2)c1 1857668907 MDLJOIGLAQTMBU-HTAPYJJXSA-N 381.428 2.926 0 50 GFAA Cc1ccn2ncc(-n3ccnc3-c3cnc(NC[C@H]4CCCO4)nc3)c2c1 1857681692 CCQQWMRINKYNOO-MRXNPFEDSA-N 375.436 2.876 0 50 GFAA O=C(Cn1ccc2ccccc21)N1CC[C@@]2(C1)Cn1c(nnc1C1CCC1)CO2 1857694164 CUAOQYRQYBXCJQ-JOCHJYFZSA-N 391.475 2.702 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCc4cc(C)[nH]n4)C3)nc2c1 1857699856 BAGTVPVXLRIZQV-AWEZNQCLSA-N 383.452 2.791 0 50 GFAA CCOCCN1CC[C@@H](O)[C@]2(CCCN(C(=O)[C@H]3CC[C@H](CC)CC3)C2)C1 1857702949 JQSRDISTFSFBEZ-NXLVEIQXSA-N 380.573 2.915 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)N[C@@H]1CCCc2c1c(C)nn2C 1857708488 WTZCXAZIJQPRGN-MRXNPFEDSA-N 385.493 2.579 0 50 GFAA CCc1nc(CNC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)no1 1857709335 RQWAKXCFHYDMKR-LLVKDONJSA-N 389.843 2.959 0 50 GFAA COc1cc(F)c(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c(F)c1 1857719157 FPUGATBPALEJBI-ZRGWGRIASA-N 388.414 2.918 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1cncc(F)c1 1857720544 YYSNRUBMLDVJMD-FGTMMUONSA-N 375.831 2.818 0 50 GFAA C/C=C/CCCC(=O)NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3 1857732606 YARLKYCKXRIHER-DBDYVFGQSA-N 375.538 2.985 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2[C@H](CNC(=O)c3ccsc3)[C@H]3CC[C@]2(C1)O3 1857732622 YORFEXZZUPNUGA-ZCDKGFTFSA-N 387.505 2.762 0 50 GFAA COC(=O)N(C)CCCN(C)C(=O)c1nc(C)n(-c2ccccc2C(C)C)n1 1875312134 ICKDPXWPHFKUEY-UHFFFAOYSA-N 387.484 2.859 0 50 GFAA C[C@H]1CN(C(=O)c2cccc3c[nH]nc23)C[C@H]1NC(=O)c1coc(C2CCC2)n1 1875333904 PIMBGNUBQWUJQV-BLLLJJGKSA-N 393.447 2.709 0 50 GFAA O[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1NCc1ccccc1OCc1ccncc1 1875400297 WDHZXPNNPDXUTG-CEWLAPEOSA-N 378.476 2.786 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)N=c1[nH]n(C)c3cccc(Cl)c13)CC(=O)N2 1940196618 VYMZATOSANHOCE-LBPRGKRZSA-N 384.823 2.722 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC2CCC2)CC[C@H]1NC(=O)c1ccncc1F 1940198131 PTXCTYYNAMCZPR-MORSLUCNSA-N 377.460 2.583 0 50 GFAA CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCCn1ncc2ccccc2c1=O 2325732305 NYFBVSTYWYVOIN-POAQFYNOSA-N 385.508 2.990 0 50 GFAA CN(C)Cc1cncc(NC(=O)N2CCN(c3ncnc4ccsc34)CC2)c1 2325798744 VYHBCRQFPMKIMC-UHFFFAOYSA-N 397.508 2.502 0 50 GFAA Cc1[nH]nc(C(=O)N[C@@H]2CCC[C@@H]2NC(=O)Cc2csc3ccccc23)c1O 2325876961 FYHYVKKRBTVJTL-LSDHHAIUSA-N 398.488 2.648 0 50 GFAA CCC(CC)NC(=O)[C@@H]1CO[C@H](CNC(=O)c2ccc(SC)cc2OC)C1 2332237718 IXWYMKREIBWYTK-ZFWWWQNUSA-N 394.537 2.857 0 50 GFAA CCCN1CCC[C@@]2(CCCN2S(=O)(=O)c2cc(C)c(OC)c(C)c2)C1=O 2356168000 LOQGIKMRSSUEMW-HXUWFJFHSA-N 394.537 2.868 0 50 GFAA O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1[C@H]1CCS(=O)(=O)C1 1822989 YXJUYPXPAGMOFH-UGZWPXFQSA-N 391.898 2.867 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3cc(C(C)C)[nH]c(=N)n3)CC1)OCC2 2356139301 VMNMMHGASODGCX-UHFFFAOYSA-N 396.491 2.725 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cc2ccccc2oc1=O 4750165 FNNMYBOGKUJNGV-UHFFFAOYSA-N 378.384 2.518 0 50 GFAA O=C(NC1CCCCC1)[C@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 100637001 NQFNXZYBAQVKDT-JZTRKIHISA-N 392.499 2.854 0 50 GFAA Cc1cc(-n2nc(-c3ccccc3)nc2Cn2nc(Cl)ccc2=O)ccn1 63856323 VSINTFLRWFUAFY-UHFFFAOYSA-N 378.823 2.896 0 50 GFAA O=C(Cc1cc2ccccc2[nH]c1=O)N[C@@H]1CCN(c2ncccc2Cl)C1 137403814 WWNIVDLZRSNLKS-OAHLLOKOSA-N 382.851 2.514 0 50 GFAA C[C@@H](CNC(=O)N[C@H]1c2ccccc2C[C@H]1O)c1nc(-c2ccccc2)no1 119802021 DEJNTPSVVNYGMA-VHSSKADRSA-N 378.432 2.798 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 11821778 VQOMAVMXIZAISM-QFIPXVFZSA-N 381.451 2.805 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N(CCCn1ccnc1)Cc1ccncc1 65384009 JONJBWSJZVFWDR-UHFFFAOYSA-N 378.432 2.668 0 50 GFAA Cn1ccc(C(=O)NC(=S)Nc2ccccc2C(=O)Nc2ccc(F)cc2)n1 2806647 YFGPHQKPUWWMGK-UHFFFAOYSA-N 397.435 2.938 0 50 GFAA COc1ccccc1C/C(C)=C/C(=O)N1CCC([C@@H](O)c2nccn2C)CC1 125044202 GVCJRGDWBQQVLO-UFBKIKKCSA-N 383.492 2.890 0 50 GFAA C[C@H](NC(=O)N1CCc2nn(C)c(=O)cc2C1)c1ccc(Cl)cc1Cl 173359241 ZPXSTOUNHVCGTB-JTQLQIEISA-N 381.263 2.916 0 50 GFAA CCOc1ccc(C(=O)N2CCC(NC(=O)CC3(O)CCCCC3)CC2)cc1 173749150 KAIMRVCKFLFMJP-UHFFFAOYSA-N 388.508 2.891 0 50 GFAA Cc1ccc(N2CCC(C(=O)NCc3ccc(-n4ccnc4)nc3)CC2)nc1 363290703 FZEVIXSXYPWOFJ-UHFFFAOYSA-N 376.464 2.504 0 50 GFAA O=C(NCc1nc(C2CC2)cs1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 363759672 POJGQJSNSMNSHD-OAHLLOKOSA-N 399.472 2.670 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)N3CC(N4CCCC[C@@H]4C)C3)cc2n1 216385080 QJQZAXOGHWJKNU-LBPRGKRZSA-N 381.402 2.755 0 50 GFAA CN(C)c1noc(CNC(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)n1 365792963 GRXGQXSMHBRQCE-UHFFFAOYSA-N 386.431 2.845 0 50 GFAA CC[C@H]1CN(C(=O)c2cc(Cl)c[nH]c2=O)CCC(=O)N1Cc1ccccc1 71661583 QXKUQAZWPWQZLK-INIZCTEOSA-N 387.867 2.682 0 50 GFAA O=C(COc1ccc2nncn2n1)N1CCC[C@H](CCc2ccc(F)cc2)C1 71551766 WHKNGPUEPLFXFD-MRXNPFEDSA-N 383.427 2.514 0 50 GFAA Nc1ccnc(-c2ccc(C(=O)N3CCC[C@H](C(=O)N4CCCC4)C3)cc2)c1 426537840 ZGWREBIXGVNANR-SFHVURJKSA-N 378.476 2.805 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)N1CC[C@@H](n2cc(C)cn2)C1 290927716 KIYYIMCVSYYIBT-IEBWSBKVSA-N 396.491 2.668 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2CCN(c3ccccc3C)C(=O)C2)cc1 82121529 ZIXLSEYRKOIHKL-UHFFFAOYSA-N 380.444 2.842 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCn3cccn3)csc2C1 426526325 XXYLJUFXSRKRBY-UHFFFAOYSA-N 385.493 2.538 0 50 GFAA Cc1cccn2c(=O)c(C(=O)N(C)C3CCN(Cc4ccccc4)CC3)cnc12 180163753 OLKBQFQUOWCBJP-UHFFFAOYSA-N 390.487 2.740 0 50 GFAA CNC(=O)[C@@H](NC(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccccc1 426402014 SGWPHHUYVHJGRW-NRFANRHFSA-N 394.519 2.685 0 50 GFAA O=C(NC1CCN(C(=O)CCc2n[nH]c3c2CCCC3)CC1)c1ccccc1 97436844 JSDBCNMJISLVNF-UHFFFAOYSA-N 380.492 2.642 0 50 GFAA Cc1ccc(NC(=O)N2CCN(C)[C@]3(CCC(=O)N(C)CC3)C2)cc1Cl 91782114 BMGWSWOZCVZANM-IBGZPJMESA-N 378.904 2.809 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N2CCC(Cc3nc(C)no3)CC2)c1 96179738 NNMPKXMWYWOJNQ-UHFFFAOYSA-N 375.404 2.962 0 50 GFAA O[C@@H]1CN(c2cc(N3CCOCC3)ncn2)CC[C@H]1c1ccc2ccccc2c1 67540994 KKNZWLCRNDSPLF-LEWJYISDSA-N 390.487 2.821 0 50 GFAA Cc1cccc(CN(C[C@@H]2CCCO2)S(=O)(=O)c2cc(C(N)=O)cs2)c1 825216267 YAHMIPZSTARKMH-INIZCTEOSA-N 394.518 2.525 0 50 GFAA CCCOc1ccc(CCNC(=O)N2CCC[C@]3(CCNC3)C2)cc1OC 822983412 HLQISHVBXCEAGK-OAQYLSRUSA-N 375.513 2.812 0 50 GFAA O=C(CF)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc2ccccc12 669678975 VMVOHHPQIAPYHG-NRFANRHFSA-N 392.430 2.836 0 50 GFAA Cc1[nH]nc(-c2ccc(S(=O)(=O)NCc3n[nH]c4c3CCCCC4)o2)c1C 670434017 JFZQYYJAKDQXAC-UHFFFAOYSA-N 389.481 2.757 0 50 GFAA COC(=O)C[C@H]1CCN(C(=O)c2cc(=O)c3c(OC)cccc3o2)C2(CC2)C1 1875308402 DLUZTLGMZXDLQM-CYBMUJFWSA-N 385.416 2.750 0 50 GFAA COc1ccccc1CC1(O)CCN(C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875395221 RSVUGVPDLOJDDS-LSDHHAIUSA-N 399.491 2.650 0 50 GFAA C[C@H](CNC(=O)C(=O)N(C)Cc1ccccn1)c1cccc(C(F)(F)F)c1 1875258431 KRIYOTVWQDTUNS-CYBMUJFWSA-N 379.382 2.979 0 50 GFAA c1csc(CN2CCC(NCc3cnc(NC[C@@H]4CCCO4)nc3)CC2)c1 952960382 PAECIHNHPRKIJT-SFHVURJKSA-N 387.553 2.883 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2C[C@H]3[C@@H](c4ccccc4)N(C)C[C@H]3C2)cc1 1775996521 AOGJJDLBSYGZPT-QTGUNEKASA-N 392.503 2.818 0 50 GFAA CN1CCN(C(=O)c2cccc3[nH]c(-c4cccs4)nc23)C[C@]12CCOC2 1775960948 BUKSMXVJDNUYHC-FQEVSTJZSA-N 382.489 2.838 0 50 GFAA Nc1nc(CN2CCC(C(=O)C(F)(F)F)CC2)nc(Nc2ccc(F)cc2)n1 186001556 APVHLRBLCPVXHC-UHFFFAOYSA-N 398.364 2.680 0 50 GFAA CCc1ccccc1NC(=O)C[C@H](C)Nc1ccc(OC)c(OCC(N)=O)c1 170592223 FUIMZHRDNULEEW-AWEZNQCLSA-N 385.464 2.951 0 50 GFAA O=C(COc1ccc2c(c1)CCC2)N[C@H]1CCN(Cc2ccc(F)cc2)C1=O 191569936 XKQXOHRVOXKQJB-FQEVSTJZSA-N 382.435 2.611 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C3CCN(C(=O)c4cccs4)CC3)CC2)C1 1704304473 FFEMGDTWNFVSIH-LJQANCHMSA-N 378.538 2.749 0 50 GFAA Cc1cc(N2C[C@H]3COC[C@@H](C2)C(=O)N3C)c2ccc(C(F)(F)F)cc2n1 1704311114 YOIPVGTXZQGRNL-OCCSQVGLSA-N 379.382 2.855 0 50 GFAA COc1ccc([C@@]2(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)CC2(C)C)cc1 1704311830 DMKAMACYLLVVMA-JOCHJYFZSA-N 384.524 2.985 0 50 GFAA O=C(CCN1CCCCCC1)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1704349669 TZGCOPOPWKSIPV-DENIHFKCSA-N 381.520 2.863 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 1073315 VIMKZVIFVRPDFX-KRWDZBQOSA-N 390.480 2.585 0 50 GFAA O=C(O)[C@@H]1COCCN(Cc2ccc(OCCCCN3CCCCC3)cc2)C1 1772805244 IPUDUKMRJUUUBB-FQEVSTJZSA-N 390.524 2.865 0 50 GFAA COc1cccc(CN2CCC[C@H](n3cc(C(=O)NC4CCCC4)nn3)C2)c1 12125928 LIPLITSNMUDIED-SFHVURJKSA-N 383.496 2.796 0 50 GFAA COc1cc2c(cc1CNCc1cccnc1N1CCN(C(C)=O)CC1)CCC2 12432301 BEKOOJVBMVCOPC-UHFFFAOYSA-N 394.519 2.537 0 50 GFAA COc1ccc(OC)c(CC(=O)NC[C@H]2CC(Cc3ccc(F)cc3)=NO2)c1 12454926 QPVUGONXYLVDGN-LJQANCHMSA-N 386.423 2.889 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@H](C(=O)c2cccc(C(F)(F)F)c2)C1 12707232 GBLWQDCSAKEBKL-ZDUSSCGKSA-N 386.370 2.873 0 50 GFAA CCOC(=O)N1CCN(CCC(=O)Nc2ccc(Br)cc2)CC1 19841363 BCALQUIAKYQNTC-UHFFFAOYSA-N 384.274 2.552 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N2CCN(c3ccccc3Cl)CC2)c1 2835170 VMXDGGIYMAAZMO-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA COc1cc(CNC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC 2356651 VTTWIQSJOCSVTP-UHFFFAOYSA-N 391.420 2.668 0 50 GFAA CCCN1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)N1CCN(C(C)=O)CC1)C2 1857701356 PKZHGUZTGVMWHL-QZNHQXDQSA-N 383.536 2.553 0 50 GFAA Cc1cncc(C(=O)NC[C@H]2[C@H]3CN(c4cccc(C)n4)C[C@]34CC[C@H]2O4)c1 1875241527 XETJKJHFVNNIQN-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA COc1ccc(-n2ccc(C(=O)N3CCc4ccccc4[C@@H]3C(=O)O)n2)cc1 486024830 DHSIHTBMJUGFQY-LJQANCHMSA-N 377.400 2.705 0 50 GFAA Nc1cc(=O)nc(SCC(=O)NC2CCCCC2)n1CCc1ccccc1 4745556 ZCAXUOANSLFYKT-UHFFFAOYSA-N 386.521 2.609 0 50 GFAA O=C(O)[C@@H]1c2ccc(F)c(F)c2CCN1C(=O)c1cc(-n2ccnc2)ccc1O 2325875713 ACVJIHZGUJPIRR-SFHVURJKSA-N 399.353 2.680 0 50 GFAA CN(Cc1c(Cl)cnn1C)S(=O)(=O)c1ccc(Br)s1 20602097 KFUCOPHEGBNUMW-UHFFFAOYSA-N 384.708 2.718 0 50 GFAA CS(=O)(=O)N1CCN(c2ccccc2NC(=O)c2ccccc2Cl)CC1 624248 HMMYASIPXKQAID-UHFFFAOYSA-N 393.896 2.674 0 50 GFAA Cc1cccc(OCC(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)c1 800969 SPWIBJRSSWYSHT-UHFFFAOYSA-N 398.444 2.603 0 50 GFAA COc1ccc(NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)cc1OC 824403 FFUDKGCUHCJUDC-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CN1C(=O)[C@@H](CC(=O)Nc2ccc(F)cc2)N(CCc2ccccc2)C1=S 1185304 CCJHSYWXZLGPFH-QGZVFWFLSA-N 385.464 2.825 0 50 GFAA COc1nc2ccccc2cc1-c1cnc2cncc(N3CCC(O)CC3)n12 2356135601 LTXQKCMMBBOBLT-UHFFFAOYSA-N 375.432 2.914 0 50 GFAA COc1c(F)ccc(C(=O)N2CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C2)c1F 2356143683 SAQXQEJYAHOEIE-AUUYWEPGSA-N 385.407 2.687 0 50 GFAA CC(C)NC(=O)CN(c1ccc(OCc2ccccc2)cc1)S(C)(=O)=O 2870505 HGGLLHFJOXYTNV-UHFFFAOYSA-N 376.478 2.556 0 50 GFAA C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N(c1ccc(Cl)cc1)S(C)(=O)=O 2880137 HXKKQXMGTFFIOF-NSHDSACASA-N 396.852 2.862 0 50 GFAA O=C(NCCC1=CSC2=NCCCN12)[C@H]1CCCN1C(=O)C1CCCCC1 102354717 WLLPOFSDWPDHFM-QGZVFWFLSA-N 390.553 2.714 0 50 GFAA CCc1nc(C[C@@H]2CN(c3cc(C)nc(-c4ccccc4O)n3)CCO2)no1 102792434 NWRMLJFPYDJJBT-CQSZACIVSA-N 381.436 2.551 0 50 GFAA COc1cccc(N2CCN(Cc3nc(N)nc(Nc4ccccc4)n3)CC2)c1 9111309 FIJDSCCNFLYZSZ-UHFFFAOYSA-N 391.479 2.528 0 50 GFAA COCc1nc2n(n1)C[C@H](NC(=O)COc1ccccc1-c1ccccc1)CC2 135119839 HHPHVBWIYQYHKH-QGZVFWFLSA-N 392.459 2.602 0 50 GFAA O=c1c2cnc3nc(-c4ccc(Cl)cc4)nn3c2ccn1CCc1c[nH]cn1 20102171 KUOCZQVEENDHRE-UHFFFAOYSA-N 391.822 2.725 0 50 GFAA CCCNC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cccnc3)n2)C1 23337947 PVLZLXYGRKKLDN-UHFFFAOYSA-N 378.436 2.980 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2ccc3nonc3c2)C[C@H]1CCO 104456776 IAPFIJRCZJPIPO-LJQANCHMSA-N 396.491 2.690 0 50 GFAA CN1[C@H](CO)C[C@H](CNCc2nc3ccc(F)cc3[nH]2)[C@@H]1c1ccccc1F 20535369 KAGIQIWZTXEMMZ-VWVPQACVSA-N 386.446 2.985 0 50 GFAA Cc1nc(CCNC(=O)c2cccc(Cn3cccn3)c2)nc2c1CCCC2 65380356 OPVCYDPELMWJRU-UHFFFAOYSA-N 375.476 2.881 0 50 GFAA NC(=O)CCNc1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cn1 67675136 IMNHJQGDDFMQBP-UHFFFAOYSA-N 380.492 2.854 0 50 GFAA CC1(C)CC(NC[C@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)CC(C)(C)N1 67770879 YSFDBUMIUZDRGA-JOCHJYFZSA-N 391.531 2.578 0 50 GFAA O=S(=O)(/C=C/c1ccc(Br)cc1)NC[C@@H]1CCn2ccnc2C1 328639225 WTLHTYNCMHHUNX-OAUONFCTSA-N 396.310 2.798 0 50 GFAA Cc1noc(C2CCN(c3nccc(N[C@H]4CCCO[C@H]4C(C)C)n3)CC2)n1 328652967 WREQVOQFRDZSQC-WMZOPIPTSA-N 386.500 3.168 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CSc3ncccn3)CC2)OC1=O 77428641 QUGIXVVUUUCWLC-CQSZACIVSA-N 378.498 2.571 0 50 GFAA COc1cc2nc(N3CCO[C@@]4(CCc5ccccc54)C3)nc(N)c2cc1OC 157871839 GMUVQBBAMPTLQZ-QFIPXVFZSA-N 392.459 2.908 0 50 GFAA CCN1C[C@@H](CCN2CCOCC2)[C@@](c2ccccc2)(c2cccnc2)C1=O 71769363 DHPMSMRUUUKJSL-FYYLOGMGSA-N 379.504 2.568 0 50 GFAA CCCn1c(CO)nnc1S[C@@H]1CCN([C@H]2CCCc3ccccc32)C1=O 375114845 RTNIWMFOMUUCQP-DLBZAZTESA-N 386.521 2.951 0 50 GFAA c1ccc(CNc2ncc(CN3CCC[C@@H](CN4CCOCC4)C3)cn2)cc1 215192721 VZYJRWGWWPJZBD-FQEVSTJZSA-N 381.524 2.633 0 50 GFAA O=C(Nc1ccccc1)C(=O)N1CCC[C@]2(CCC(=O)N(C3CCCC3)C2)C1 77337528 RNQYCWQBRSZIKO-QFIPXVFZSA-N 383.492 2.799 0 50 GFAA Cc1cccc2[nH]c(CN(C)C(=O)[C@@H]3CCCN(C4CCN(C)CC4)C3)nc12 71753013 FJMGNPBNYJHIGU-QGZVFWFLSA-N 383.540 2.636 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 176103204 KVNFSXHLVLXGCQ-SFHVURJKSA-N 377.492 2.871 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1 82125426 JJIXRFAXRCSPHU-UHFFFAOYSA-N 388.487 2.715 0 50 GFAA CCc1c(C)cc(C(=O)N2CCCN(Cc3cccc(F)c3)CC2)c(=O)n1C 82155702 XUBLPGLIFNBYGY-UHFFFAOYSA-N 385.483 2.743 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)NCc2cc3cc(Cl)ccc3[nH]2)CCC(=O)N1 222890883 MSUGZYBIMPRKJY-LJQANCHMSA-N 391.855 2.731 0 50 GFAA CN(C)Cc1nnc(C2CCN(C3CSCCSC3)CC2)n1C1CC1 82087201 PAZLRSSKBJCSKF-UHFFFAOYSA-N 381.615 2.703 0 50 GFAA O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 239433484 XTMMVXNSTFFHAS-SLFVNDPXSA-N 392.455 2.902 0 50 GFAA O=C(N[C@H]1CCSC1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91998001 JTLDHRMPUYTXCL-VIFPVBQESA-N 384.288 2.903 0 50 GFAA CCN1CC2(CCN(C(=O)Cn3ccnc3)CC2)C[C@@H](c2ccccc2)C1=O 91848881 NTTNWWMIPQUWCO-IBGZPJMESA-N 380.492 2.528 0 50 GFAA CN1C[C@@]2(CCN(C(=O)Nc3ccc(CCc4ccccn4)cc3)C2)OC1=O 426470511 CPDNYZHPCVXCBQ-OAQYLSRUSA-N 380.448 2.925 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C)C3)nc(C)n1 95362096 MGIJNBUHEHOVRQ-IBGZPJMESA-N 392.503 2.962 0 50 GFAA O=C(c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1)N1CC(O)C1 95510414 VASUDRKRGUWHHD-UHFFFAOYSA-N 380.488 2.589 0 50 GFAA CNC(=O)CN1CCN(C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)CC1 97527404 IAQHMOLESYVZRD-UHFFFAOYSA-N 386.883 2.903 0 50 GFAA CCOc1ccc(C(C)=O)cc1NC(=O)N1CCN([C@H]2CCCC[C@@H]2O)CC1 96179906 SJNJWQFWKKAQQS-OALUTQOASA-N 389.496 2.741 0 50 GFAA CCN1CCN(CC(=O)N2CC[C@]3(CCCN(CC4CCCCC4)C3)C2)CC1 23358064 YAQAYENCQOFNEI-QHCPKHFHSA-N 390.616 2.519 0 50 GFAA O[C@H](COc1ccccc1CN1CCC(F)(F)CC1)CN1CCSCC1 95524470 MUWGKYOPHUWJNL-KRWDZBQOSA-N 386.508 2.706 0 50 GFAA COCc1cccc(C(=O)N2CCc3[nH]c(-c4cccc(OC)c4)nc3C2)n1 96163449 PWDXRBBCRCCPOI-UHFFFAOYSA-N 378.432 2.825 0 50 GFAA CCCCNC(=O)NC(=O)CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1 184015559 WDZHVBMNOIWSTK-OAHLLOKOSA-N 387.402 2.705 0 50 GFAA Cc1c(C(=O)O)cnn1-c1ccc(C(=O)NCc2ccc3c(c2)OCCO3)cc1 299745949 UFRFHSUMRLKQPZ-UHFFFAOYSA-N 393.399 2.580 0 50 GFAA CCn1cc(CN(C)C(=O)N[C@H](C)c2nc(-c3ccc(OC)cc3)no2)cn1 534632451 BUKURJVHRAFOJG-CYBMUJFWSA-N 384.440 2.864 0 50 GFAA O=C([C@@H](O)c1ccccc1)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1940196422 KWPIHCZISDQGNJ-KRWDZBQOSA-N 379.460 2.600 0 50 GFAA COc1ccccc1N1CCN([C@H]2CCCN(C(=O)c3ccccn3)C2)CC1 61969212 BVTJSFRMMZQBEC-SFHVURJKSA-N 380.492 2.517 0 50 GFAA O=C1NCC2(CCN(C(=O)c3cccc(-c4cccc5ccnn45)c3)CC2)O1 584902543 QULVVDCKFDRIFM-UHFFFAOYSA-N 376.416 2.716 0 50 GFAA CCN(CC1CCOCC1)C(=O)N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 584889263 IECAXLVQPCCRLU-INIZCTEOSA-N 379.888 2.903 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H](C)c2nncn2C(C)C)c2c1CCCC2 670447708 SVOFGWCSMYMCEN-CYBMUJFWSA-N 378.498 2.786 0 50 GFAA CCOCc1nc(-c2ccc3nc(C)n(C)c(=O)c3c2)n(C[C@@H]2CCCCO2)n1 1875348209 JGPSJQRHISSZDS-INIZCTEOSA-N 397.479 2.606 0 50 GFAA Cc1nc(CC(=O)N2Cc3cnn(-c4ccccc4F)c3CC(C)(C)C2)n[nH]1 952894932 VDDPBSDTYGHNCP-UHFFFAOYSA-N 382.443 2.592 0 50 GFAA CC1(C)CN(Cc2nnc3n2CCOC3)[C@@H]1c1nccn1-c1cccc(F)c1 952891872 JRRWEHLQDRKYBA-GOSISDBHSA-N 382.443 2.716 0 50 GFAA O=C(NOC1CCC1)N1CC[C@@](c2nc(-c3cccnc3)no2)(C(F)(F)F)C1 952893412 LXOLQGCQWDWWIH-MRXNPFEDSA-N 397.357 2.831 0 50 GFAA CCc1ccc(OC[C@H](O)CN(C)C(=O)NCc2cccc(CN(C)C)c2)cc1 1875261009 DYEKZEBIBDNRTK-OAQYLSRUSA-N 399.535 2.892 0 50 GFAA CC(=O)c1cc(CC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)cs1 952972520 FWGSLZLOOKLOPB-IBGZPJMESA-N 386.517 2.901 0 50 GFAA CC/C(C)=C/C(=O)N1CCOC2(CCN(c3nccc(SC)n3)CC2)C1 1775990080 COPLKNADBIHALT-FYWRMAATSA-N 376.526 2.753 0 50 GFAA CCc1occc1C(=O)N[C@]12CCC[C@@H]1N(c1c(C)c(C)nc3ncnn13)CC2 1775991847 NIUKKBVLSAFFRH-UWJYYQICSA-N 394.479 2.828 0 50 GFAA O=Cc1ccc(OCC(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)cc1 727370769 TZJXEAMSZYTYEZ-UHFFFAOYSA-N 389.411 2.842 0 50 GFAA O=S(=O)(NC[C@@H]1CN(C2CC2)CCO1)c1cc(Cl)cc(C(F)(F)F)c1 187097441 SRBSGDOYWXABRI-CYBMUJFWSA-N 398.834 2.500 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCC[C@@H]4C(=O)NC[C@@H]43)cc12 170609923 YIXOMQOITNMJMP-RDJZCZTQSA-N 394.500 2.805 0 50 GFAA CS(=O)(=O)N1CCCN(C(=O)NCC2(c3cccs3)CCCCC2)CC1 170635625 CEEWWJNYEBMNDF-UHFFFAOYSA-N 399.582 2.627 0 50 GFAA O=C(Nc1ccc(N2CCCC2)nc1)[C@H](c1ccccc1)N1CCC(O)CC1 170900662 PQLKHMFKJALMBK-NRFANRHFSA-N 380.492 2.818 0 50 GFAA CCc1noc2ncc(S(=O)(=O)NC[C@@H](N)c3ccc(C(C)C)cc3)cc12 225425694 KDEPJORLDJSXPX-QGZVFWFLSA-N 388.493 2.887 0 50 GFAA O=C1C[C@H](Cc2ccccc2)C(=O)N1C[C@@H](O)COc1cccc2[nH]ccc12 191403161 MFKYYGNFNMMXCC-DLBZAZTESA-N 378.428 2.525 0 50 GFAA Cn1ccnc1CN1CCC(C(=O)N2CC=C(c3ccc(O)cc3)CC2)CC1 193818180 DYIQBUGJJGGBFY-UHFFFAOYSA-N 380.492 2.654 0 50 GFAA CCOc1ccc(N2C[C@@H](C(=O)Nc3cnc4c(c3)COCC4)CC2=O)cc1 777035246 BMPLDNALJIQUIF-AWEZNQCLSA-N 381.432 2.545 0 50 GFAA COCC1(C(=O)N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)CCC1 1704300999 FNBRIHRVTOSRRY-UHFFFAOYSA-N 389.492 2.911 0 50 GFAA Cc1c(CN2CCC3(CC2)C[C@](O)(CO)CCO3)[nH]c2ccc(Cl)cc12 1704342466 DAWKUSPLAVUABG-IBGZPJMESA-N 378.900 2.998 0 50 GFAA Cc1noc(C)c1CNC(=O)CC1(N2Cc3ccccc3C2=O)CCOCC1 1772500399 BGOMHGBZSLBDMX-UHFFFAOYSA-N 383.448 2.503 0 50 GFAA COc1ccc(C(=O)NCCCOC(C)C)cc1OC1CCN(C(C)=O)CC1 11661964 YZOGTUGHWXFGHH-UHFFFAOYSA-N 392.496 2.630 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N(C)C[C@@H]2COc3ccccc3O2)n[nH]1 11663075 YQMWGWRXRBDKBL-MRXNPFEDSA-N 395.463 2.690 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)C(=O)c2ccco2)C1 11773624 FYNRYLDWKNXUDE-QGZVFWFLSA-N 384.476 2.884 0 50 GFAA COc1ccc(C(=O)Nc2ccnn2C2CCN(C(=O)CSC)CC2)cc1 12710458 RZYKKBYOGHAYPU-UHFFFAOYSA-N 388.493 2.671 0 50 GFAA COc1cc2c(cc1CN1CCN3C(=O)OC[C@@]3(Cc3ccccc3)C1)OCO2 1857679092 WSHNXKJXWKVJST-JOCHJYFZSA-N 396.443 2.673 0 50 GFAA CN(C)c1cccc(C(=O)N2CCN3C(=O)OC[C@]3(Cc3ccccc3)C2)c1 1857682316 VETDRYHTDFTIQS-QFIPXVFZSA-N 379.460 2.642 0 50 GFAA COCCCNC(=O)c1cc2c(s1)CCOC21CCN(CC2CC2)CC1 1857704459 SLJDORMKFIZSBL-UHFFFAOYSA-N 378.538 2.788 0 50 GFAA CC(C)[C@H]1CN(c2cncc(C(=O)N3CCOCC3)n2)C[C@@H](c2ccccc2)O1 1875245163 MXBFDFMMRFQGHI-UXHICEINSA-N 396.491 2.552 0 50 GFAA O=C1NC(=O)[C@@](Cc2ccccc2)(C2CCN(C(=O)CC3=CCCCC3)CC2)N1 12124014 HLYUSAKIWGBLMW-HSZRJFAPSA-N 395.503 2.936 0 50 GFAA COc1ccc(-c2cnnc(N3CCCC[C@@H]3CCN3CCOCC3)n2)cc1 19300987 NTQZKYMCRCMOMA-GOSISDBHSA-N 383.496 2.628 0 50 GFAA C[C@H](C(=O)Nc1ccnc(N2CCN(C)CC2)c1)n1ccnc1-c1ccccc1 2325797797 USBWCXASHUIBJG-QGZVFWFLSA-N 390.491 2.897 0 50 GFAA Cc1ccc2c(c1)[C@H](CCC(=O)O)CN2S(=O)(=O)c1cn2c(n1)CCCC2 2325806966 QOLKWWLOROUVHR-CQSZACIVSA-N 389.477 2.685 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3cc(C)cc(C)c3)CC2)cc1OC 796227 UABDRNKGJBRUSL-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2nc(-c3ccc(F)cc3)[nH]c2C)CC[C@H]1O 2356156267 ZKOYEMSQKKCKQA-FOIQADDNSA-N 389.427 2.602 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)CCCn3cncn3)C2=O)cc1 2356166399 WCMMURIUJNLCNM-OAQYLSRUSA-N 381.480 2.555 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CCC(c2cc[nH]n2)CC1 2356167249 KYPDEECRTSJKMF-UHFFFAOYSA-N 392.459 2.707 0 50 GFAA CCOc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC)c(Br)cc1OC 4755218 PEQKWZHPMWRRDM-AWEZNQCLSA-N 399.241 2.657 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)NC3CCCCC3)CC2)c1 6741052 RYIGRBXGJYCZBY-UHFFFAOYSA-N 379.526 2.652 0 50 GFAA CN1CCC[C@]2(CCCN(C(=O)c3ccc(CSc4nnc[nH]4)o3)C2)C1 55325497 XYBLHSPLTQFALX-SFHVURJKSA-N 375.498 2.638 0 50 GFAA Nc1nc(CN2CCN(c3ccccc3)CC2)nc(Nc2ccc(F)cc2)n1 54147189 BGLUBWMTQBCZHG-UHFFFAOYSA-N 379.443 2.659 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cn(CC)nc2C)C[C@@H]1CCO 20537992 MSRKDXAWDHBVRA-NRFANRHFSA-N 386.540 2.679 0 50 GFAA CCS(=O)(=O)c1ncc(CN2CC[C@H](C3CCCCC3)C2)n1CCOC 23251098 FAKXYCZVBXYWAX-KRWDZBQOSA-N 383.558 2.725 0 50 GFAA O=C(c1ccc(CN2C(=O)CNC2=O)cc1)N1CC[C@@H](Cc2ccc(F)cc2)C1 119529495 SVDXXNNFAGXTDX-KRWDZBQOSA-N 395.434 2.582 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@@H]3CCN(C(=O)C4CCCCC4)C3)[nH]n2)cc1 126934340 GIMLLFDCRKELTK-QGZVFWFLSA-N 396.491 2.996 0 50 GFAA Cc1nc(NCCNC(=O)c2ccc(Br)o2)cc(N2CCCC2)n1 67623091 KTCOVPFJFATCNI-UHFFFAOYSA-N 394.273 2.583 0 50 GFAA c1ccc(N2CCN(Cc3nnc4sc(-c5ccccn5)nn34)CC2)cc1 65364375 KVFVBSCRKYHBPA-UHFFFAOYSA-N 377.477 2.570 0 50 GFAA CCOC(=O)c1cccnc1N1CCN(Cc2cccc3nsnc23)CC1 65385344 FPMCACSANHRYPZ-UHFFFAOYSA-N 383.477 2.585 0 50 GFAA Cc1cc(CC(=O)N[C@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)n[nH]1 127372504 CCQKZTBBCJQSGD-KRWDZBQOSA-N 390.443 2.975 0 50 GFAA COc1ccccc1N1CCN(C(=S)Nc2ccc3c(c2)OCCO3)CC1 6398746 YQTIOEMGOCUARJ-UHFFFAOYSA-N 385.489 2.985 0 50 GFAA COc1cccc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)c1F 71746916 SPARLBVLOUDFER-KRWDZBQOSA-N 389.515 2.789 0 50 GFAA c1ccc(CNc2ncc(CN3CCC(Oc4ncccn4)CC3)cn2)cc1 215174669 ABIFCMFLVJAQNV-UHFFFAOYSA-N 376.464 2.922 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@@H]4CCCS(=O)(=O)C4)CC3)oc12 333287790 QVNMQSYEARVUCZ-OAHLLOKOSA-N 391.493 2.602 0 50 GFAA COCCN(C)S(=O)(=O)c1cccc(C(=O)N[C@H](C)C2=CCCCC2)c1 215187297 ODMKQYCYKKKOMR-OAHLLOKOSA-N 380.510 2.572 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)NC[C@H](Cc1ccccc1)C(=O)O 237735699 VHRWTJPZKVLFJM-AWEZNQCLSA-N 384.461 2.525 0 50 GFAA COc1ccc(OC)c(N2C[C@H](C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@@H]34)CC2=O)c1 245225404 UNOBQMYAIVCNDI-UKSCXKOUSA-N 398.503 2.998 0 50 GFAA COc1ccc([C@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)cc1 130669876 FLHAVYAXFZGUTQ-LJQANCHMSA-N 391.493 2.769 0 50 GFAA CCn1cc([C@H]2CN(C(=O)Nc3cccc(N4CCCC4=O)c3)CCO2)cn1 241173109 KGCPICZPDCIAIT-GOSISDBHSA-N 383.452 2.635 0 50 GFAA CC(C)[C@@H]1CN(C(=O)Cn2ccccc2=O)CCCN1Cc1ccc(F)cc1 71715142 IRYKDPCRXXRFAX-FQEVSTJZSA-N 385.483 2.747 0 50 GFAA NC(=O)c1cccnc1N1CCN(Cc2nc(-c3ccccc3)cs2)CC1 133168031 PHOLJEFTOMRAIO-UHFFFAOYSA-N 379.489 2.626 0 50 GFAA CCN1CCC[C@@H](CN2CCC(Oc3ccccc3OC)(C(=O)O)CC2)C1 82108847 FHJJLUKHUOPFEI-QGZVFWFLSA-N 376.497 2.725 0 50 GFAA CCCC[C@@H]1CN(c2cccc(-c3ccccc3)c2)C(=O)CN1C(=O)C(N)=O 82157377 QIIWSFYOSSMQEA-LJQANCHMSA-N 379.460 2.573 0 50 GFAA Cc1cc(C)c(CC(=O)N(Cc2cccnc2)[C@H]2CCS(=O)(=O)C2)c(C)c1 180203490 MWWFDFMDNDNKMS-IBGZPJMESA-N 386.517 2.765 0 50 GFAA Cc1ccc(NS(C)(=O)=O)cc1NC(=O)N[C@@H]1COC2(CCCCC2)C1 96180270 UFORAJKQNCAMGF-HNNXBMFYSA-N 381.498 2.980 0 50 GFAA Cc1cc(C)c(CNC(=O)N(Cc2cccnc2)C[C@@H]2CCC(=O)N2)c(C)c1 426360062 DQUMRWUUMBSVHQ-IBGZPJMESA-N 380.492 2.997 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3cc4nc(C)cc(C)n4n3)C[C@H]2N(C)C)cc1 95524409 KOXSLXJBKXHGNA-AZUAARDMSA-N 377.492 2.824 0 50 GFAA CC(C)Cc1ccc(CN2C[C@H]3CC[C@@H]2CN(S(=O)(=O)N(C)C)C3)s1 95503985 GGHWRHYQBDMDMY-HZPDHXFCSA-N 385.599 2.649 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)NCCCN1CCc2ccccc21 97099132 GOBHCDHTWZFHBB-QGZVFWFLSA-N 379.460 2.690 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)C(=O)c3ccco3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95355140 BEHMDSNTWOZAHU-DFQSSKMNSA-N 380.444 2.560 0 50 GFAA COc1cc2c(cc1CNC(=O)c1ccc([C@H]3CCCNC3)cc1)OCCO2 95358824 XXBSIDSWNPLWTC-KRWDZBQOSA-N 382.460 2.863 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)[C@H]2C[C@@H](O)C2)c1 244719099 LWVWKSJSFMIMEF-NBQZKYEYSA-N 378.432 2.722 0 50 GFAA CN(CCC1CCN(c2ccncc2)CC1)C(=O)Cc1ccc2c(c1)NC(=O)C2 183301146 PPTOKPLASOMSKW-UHFFFAOYSA-N 392.503 2.884 0 50 GFAA Cc1csc([C@@](O)(CC(=O)N2CCC(c3ncc[nH]3)CC2)C(F)(F)F)n1 299574748 CFZHIPMOIRPHFW-HNNXBMFYSA-N 388.415 2.721 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cc(Cl)ccc1F 266409031 ZJAYKYCURQAUHK-GFCCVEGCSA-N 385.848 2.904 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCN(C)C(=O)[C@H]3C)c2)c2ccsc2n1 534585865 QYFFGABZBHVSJR-GFCCVEGCSA-N 380.473 2.969 0 50 GFAA O=C(c1nnn2c1CO[C@@H](c1ccc(F)cc1)C2)N1CCc2ccccc2C1 263618500 UCNXXCYVBDKJIJ-LJQANCHMSA-N 378.407 2.887 0 50 GFAA COCCn1ccc2c(OCC(=O)NCCn3cnc4ccccc43)cccc21 263587101 CBIIEOKVVQHNMX-UHFFFAOYSA-N 392.459 2.833 0 50 GFAA COc1cccc2ccc(-c3cccc(C(=O)NC[C@@H]4CNCCO4)c3)nc12 299780448 NKLGOSNZSZFAGO-SFHVURJKSA-N 377.444 2.629 0 50 GFAA Cc1nnc(Cc2ccc(NC(=O)N3CCC[C@@H](c4ccncn4)C3)cc2)[nH]1 299769124 NBTWQWNAYROIKF-MRXNPFEDSA-N 377.452 2.905 0 50 GFAA Cc1cc(C)n(CCNC(=O)c2ccccc2OC(F)(F)C(F)F)c(=O)n1 825131991 HFSKAAUOGLAKAX-UHFFFAOYSA-N 387.333 2.527 0 50 GFAA Cc1cc(C)c(CNC(=O)NC[C@@H](O)COc2ccc(Cl)c(C)c2)cn1 584898611 RLOSLXWUIQZMLQ-MRXNPFEDSA-N 377.872 2.899 0 50 GFAA O=C(NC[C@]1(O)CCc2ccccc21)N[C@H]1Cc2n[nH]cc2[C@H](C(F)(F)F)C1 1875278175 GEKMZXZQANEZAC-CDHAZOANSA-N 394.397 2.504 0 50 GFAA COc1cc(Cl)ccc1-c1cccc2c1CN([C@H]1CCC(=O)NC1=O)C2=O 1875350674 WTMUXJPTETUMAG-INIZCTEOSA-N 384.819 2.777 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cnc(-c2ccccc2)o1 1875402730 LPFKIZBFCSBVTA-APHBMKBZSA-N 386.839 2.761 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1ccc(-c2cn[nH]c2)cc1 1875401303 IEBYUVHNQBFPSU-IAGOWNOFSA-N 378.436 2.524 0 50 GFAA CC(=O)N(C)CCCC(=O)N1CCOC[C@H]1c1c(C)nn(-c2ccccc2)c1C 952886765 AKDMMCLFLNRWGR-FQEVSTJZSA-N 398.507 2.648 0 50 GFAA O=C(Cc1cccs1)NC[C@H]1CCCN(C(=O)CSc2ccccn2)C1 952990092 FYGNVGKPVBQHRW-OAHLLOKOSA-N 389.546 2.833 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)cc1C 952971144 XBGHGMCABOWWLA-MRXNPFEDSA-N 382.464 2.830 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCC[C@H]2c2nc(-c3cccnc3)no2)n[nH]1 952990891 XZIAYLXQWKDPBB-KRWDZBQOSA-N 389.419 2.838 0 50 GFAA COc1cc2c(cc1OC)[C@@H](NC(=O)[C@H](C)n1cnc3ccccc3c1=O)CC2 888105478 BUFFYWYYCSRTHZ-UGSOOPFHSA-N 393.443 2.778 0 50 GFAA CO[C@@H](C)C(=O)N(Cc1scnc1C)C[C@H]1CCN(C(=O)CCC2CC2)C1 1775989604 QNWKNQARCJIZRA-RDJZCZTQSA-N 393.553 2.854 0 50 GFAA O=C(Cn1c(=O)cnc2ccccc21)N1CCO[C@H](c2cccc(Cl)c2)C1 186209913 WEMROIALLNBAKX-SFHVURJKSA-N 383.835 2.650 0 50 GFAA O=C(CSc1cc(Cl)ccc1Cl)Nc1ccc(-n2nn[nH]c2=O)cc1 194301856 NDEONDHPWISDBY-UHFFFAOYSA-N 396.259 2.993 0 50 GFAA O=C(NC1CCN(C(=O)c2ccccc2)CC1)[C@H]1CCCN(CC(F)(F)F)C1 194320009 HORYURRDJJKPFG-INIZCTEOSA-N 397.441 2.682 0 50 GFAA Cc1cc(NC(=O)CNC(=O)C2CCC(C(=O)O)CC2)ccc1Br 194407054 RCUXIBMPRVQKBQ-UHFFFAOYSA-N 397.269 2.703 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N3CCC[C@H](Cn4ccnc4)C3)o2)c1C 1506395904 JMTXOZFKPHDAML-OAHLLOKOSA-N 390.465 2.849 0 50 GFAA CN1CCC(C(=O)N2CCCN(C(=O)c3ccco3)CC2)(c2ccccc2)CC1 1506407445 VYWNIRVWAOJXFD-UHFFFAOYSA-N 395.503 2.618 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)NC[C@H]1CCOC1 1704311911 WPEYPBHBMTWEQQ-GFCCVEGCSA-N 379.844 2.820 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cn(Cc2ccc(Cl)cc2)nn1)c1ccccc1 11839309 HOXKRNFKSFOZSZ-KRWDZBQOSA-N 384.823 2.624 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CN1CCCC1=O 12196584 YSNSCYHVBNYFEM-GOSISDBHSA-N 391.943 2.675 0 50 GFAA Cc1c(CC(=O)N2CCC(O)CC2)c2c(n1Cc1ccccc1)CCCC2=O 12209143 LBEODCSESNMASV-UHFFFAOYSA-N 380.488 2.890 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1cccc(C)n1 12421779 ATVOTSBBVNNURT-UHFFFAOYSA-N 389.477 2.826 0 50 GFAA CN(C)CCCN(C)C(=O)c1cnn(-c2nccc(-c3ccco3)n2)c1C1CC1 15070203 NROWDCLQVWQTAR-UHFFFAOYSA-N 394.479 2.823 0 50 GFAA CCN1CCC(C(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)CC1 15079080 CTAHNXVKTXBJNE-JOCHJYFZSA-N 398.595 2.840 0 50 GFAA COc1cc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c(C)cc1Br 16578917 YMPIWVGNRHIZOR-GHMZBOCLSA-N 378.288 2.564 0 50 GFAA COc1ccc(CCCN2C(=O)O[C@@H]3CN(C(=O)NC(C)(C)C)C[C@@H]32)cc1 19300014 VWQHYHDIGROZCW-DLBZAZTESA-N 375.469 2.641 0 50 GFAA O=C(O)c1n[nH]c2c1CN(C(=O)c1ccccc1OC(F)(F)C(F)F)CC2 1857677805 NETZOKGZWAGSBS-UHFFFAOYSA-N 387.289 2.543 0 50 GFAA O=C(c1ccc(-c2cccc(F)c2)cc1)N1CC[C@H](O)[C@@]2(CCCNC2=O)C1 1857684001 VBADUOKGFBMFAA-SIKLNZKXSA-N 382.435 2.596 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)NCCCn3cccn3)sc12 1857691860 ZCZVVYNTRTWKNV-UHFFFAOYSA-N 388.537 2.648 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1)[C@@H]1CCCN2CCCC[C@H]12 1857728389 ZJTZLRMTDRELAO-PVIWCNJMSA-N 383.536 2.582 0 50 GFAA Nc1nccc(N2CCC[C@H](OC(=O)c3cc(Br)ccc3F)C2)n1 225743099 IMCKGUWPQCMMIL-NSHDSACASA-N 395.232 2.786 0 50 GFAA COc1ccc([C@H]2[C@H](CO)OCCN2Cc2ccncc2Cl)cc1OC 1875247586 XPLCFEJJKWOOIC-OALUTQOASA-N 378.856 2.687 0 50 GFAA O=C(NCc1cccc(NC(=O)C2CCC2)c1)N[C@H]1c2ccccc2C[C@H]1O 123561021 GNTDEOMXSAEEIX-UXHICEINSA-N 379.460 2.883 0 50 GFAA CCCc1cc(N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2c(C)noc2C)nc(C)n1 248203803 YHHFDHSSAWKPDW-AEFFLSMTSA-N 383.496 2.970 0 50 GFAA O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)N1CC[C@@H](O)C(F)(F)CC1 2325770108 DJPNWWKZRXYKHV-GFCCVEGCSA-N 378.206 2.802 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1nccs1 2325784593 XTPQMLGTBHMVNI-JQWIXIFHSA-N 397.250 2.541 0 50 GFAA CN1CCN(Cc2nc3ccc(NCc4ccc5c(c4)ncn5C)cc3[nH]2)CC1 2325809824 RESVKQYHMRBSLG-UHFFFAOYSA-N 389.507 2.809 0 50 GFAA CC(C)(C)OC(=O)N1CCOC[C@@H]1CC(=O)Oc1ccc2c(c1)C(=O)CCN2 2325872083 HGKUZOWFDVOVGC-ZDUSSCGKSA-N 390.436 2.616 0 50 GFAA Cc1oc(C=O)cc1C(=O)Nc1cc(S(=O)(=O)C(F)(F)F)ccc1O 2325899695 RLHQPMPPNMGMKG-UHFFFAOYSA-N 377.296 2.652 0 50 GFAA Cc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1 1148435 HOZYIJBKNLLPKE-UHFFFAOYSA-N 383.267 2.675 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@@H]2CC(=O)N(c3nccs3)C2)CC1 2356134254 GLTMROMPDPAOSW-OAHLLOKOSA-N 385.489 2.660 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)OCc1ccccc1 4763017 NFJJNKNWOMGSKP-LJQANCHMSA-N 396.443 2.647 0 50 GFAA CCc1ccccc1NC(=O)c1ccccc1NC(=O)c1cc(=O)[nH]c(O)n1 55154173 AXGWSMPCJPBWLR-UHFFFAOYSA-N 378.388 2.543 0 50 GFAA CCc1cc2c(CN[C@@H](C)c3nnnn3-c3ccccc3)cc(=O)oc2cc1O 115603905 GRERPZCYOHASKM-ZDUSSCGKSA-N 391.431 2.888 0 50 GFAA O=C(NCCO)c1ccc([C@H]2CCCN2C(=O)Cc2ccc(F)cc2)s1 20999889 SBUPMOGOSVXKCE-OAHLLOKOSA-N 376.453 2.516 0 50 GFAA C[C@@H](C(=O)NCc1cccnc1Oc1cccc(C(F)(F)F)c1)n1cnnn1 67675087 AWSZIFJHFNEUFL-NSHDSACASA-N 392.341 2.757 0 50 GFAA Cc1cccc2c(C(=O)N(C)C)cc(-c3cnn(-c4ccc5nncn5n4)c3)nc12 63846040 KMCPHKURZGXGAH-UHFFFAOYSA-N 398.430 2.535 0 50 GFAA Cc1nccn1-c1cc(N2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)ncn1 65362225 DGSAYFKCWIKCGW-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA CC[C@H]1CN(CCNC(=O)c2cccnc2OC)Cc2cc(OC)ccc2O1 11971646 VMQWCFWDCRLYNY-INIZCTEOSA-N 385.464 2.502 0 50 GFAA CCn1cc(S(=O)(=O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)cn1 152454306 SDAMFRCLVRJUKS-ZDUSSCGKSA-N 380.539 2.807 0 50 GFAA O=S(=O)(NC[C@H]1CCn2ccnc2C1)c1ccc(F)c(C(F)(F)F)c1 328631683 RHMAPXXLSZSAIS-JTQLQIEISA-N 377.363 2.582 0 50 GFAA COc1ccc(CN2CC[C@H](CO)[C@@H](O)C2)cc1OCc1ccc(F)cc1 215643942 QPYYUMHNEKMRJT-MJGOQNOKSA-N 375.440 2.588 0 50 GFAA Cn1ccnc1[C@@H]1c2[nH]cnc2CCN1Cc1cn[nH]c1-c1cccc(F)c1 71416293 CAINTZVIQJCIFO-IBGZPJMESA-N 377.427 2.820 0 50 GFAA C[C@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)Cc2ccc(Cl)cc2)CC1=O 120206287 YIIDEKKXECQWBS-PBHICJAKSA-N 399.878 2.640 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)n[nH]1 72419965 QARVQWUWVGVXPO-QFIPXVFZSA-N 381.524 2.951 0 50 GFAA CN(C(=O)Nc1ccccc1N1CCCCC1)C1CCN(S(C)(=O)=O)CC1 127311358 PVPGGLXPUWAOKD-UHFFFAOYSA-N 394.541 2.565 0 50 GFAA CN(C)c1noc([C@@H]2CCCN2CC(=O)N(C)c2nc3ccccc3s2)n1 374533132 AJNQEXZDQTYPBP-ZDUSSCGKSA-N 386.481 2.545 0 50 GFAA CN(C)c1cc(C(=O)N2CCC([C@H]3C[C@@H](N)CCO3)CC2)nc2ccccc12 333246134 FTVXSYBNFKFQBE-HRAATJIYSA-N 382.508 2.659 0 50 GFAA Cc1ccc(NC(=O)NC[C@@H]2CCCN(c3ccc4nc(C)nn4n3)C2)cc1 333394327 DBXTWMVNUIUZEJ-INIZCTEOSA-N 379.468 2.779 0 50 GFAA COc1cc(NC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)ccc1NC(N)=O 378151356 QXSYCFLDCQFTRO-GOSISDBHSA-N 396.447 2.660 0 50 GFAA COc1nc2c(cc1CN1CCO[C@@H](Cc3ccccc3)C1)C(=O)N(C(C)C)C2 71771063 GCPPHWBUOITRKC-IBGZPJMESA-N 395.503 2.898 0 50 GFAA Cc1nc(C)c(S(=O)(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)s1 177088982 KZNYSBPOELHDNM-UHFFFAOYSA-N 383.886 2.854 0 50 GFAA COc1ccccc1-c1nc(CSc2nc3c(=O)[nH]cnc3n2C)c(C)o1 20343034 IZSFEJUCYMTUHL-UHFFFAOYSA-N 383.433 2.921 0 50 GFAA CCN1C[C@H](CNC(=O)c2ccc(-c3cccc(C(=O)OC)c3)cc2)CC1=O 426657076 XHPFHJHWTHPWOB-HNNXBMFYSA-N 380.444 2.738 0 50 GFAA Cn1cnc(CNC(=O)N2C[C@@H](c3cccc(C(F)(F)F)c3)OC(C)(C)C2)n1 293279692 XYARTMZZQNOSHS-AWEZNQCLSA-N 397.401 2.896 0 50 GFAA CCn1nccc1C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(-n2cccn2)cc1 95505413 IWLJQJUJSKSDDG-GOSISDBHSA-N 392.463 2.722 0 50 GFAA O=C(CN1CCC[C@@H](c2ccccc2)C1)NCCc1nc(-c2cccnc2)no1 95387130 RSTNTGQUDGQREM-LJQANCHMSA-N 391.475 2.670 0 50 GFAA CCCSCC(=O)N1CCC[C@]2(CCC(=O)N(Cc3cnc(C)cn3)C2)C1 91933233 DGDKVHCQNIQRER-FQEVSTJZSA-N 390.553 2.659 0 50 GFAA O=C(OCCCCOC(=O)[C@@H]1CCCC[C@H]1C(=O)O)[C@H]1CCCC[C@H]1C(=O)O 239284777 CAOCATZETDLGIH-FPCVCCKLSA-N 398.452 2.635 0 50 GFAA CC(C)N(C)C(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 95512389 JJCYHQVEUFBBDO-UHFFFAOYSA-N 388.917 2.623 0 50 GFAA CS(=O)(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1cccc(-c3ccccc3)c1)C2 95384910 IDTGODFGPZOJFU-OXJNMPFZSA-N 384.501 2.850 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@H]1C=Cc3ccccc3N1[C@H]2C(=O)c1ccc(Cl)cc1 247798922 DVIXXRORQNKBTF-XMTFNYHQSA-N 378.815 2.696 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCCC[C@@H]2CCN2CCOCC2)c1 824628582 BWMKYXIRLMLQOU-HXUWFJFHSA-N 384.524 2.958 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N[C@H]2CCCN(Cc3cccs3)C2)c1 828172504 ATBOCUZTPRRDBV-HNNXBMFYSA-N 378.519 2.546 0 50 GFAA COC(=O)Cc1ccc(NC(=O)C[C@@H](NC(C)=O)c2ccc(C)cc2)c(OC)c1 1875320587 GJOYWIRHDQFDNE-LJQANCHMSA-N 398.459 2.925 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3cc(OC)c(OC)cc3C2(C)C)CC1 1875367160 UCHIJPQPIAPXLP-UHFFFAOYSA-N 386.492 2.748 0 50 GFAA CO[C@@H]1COC[C@H]1n1cc(-c2nc(CC(C)C)nn2Cc2ccccc2C)nn1 1875330815 DAMCALQYKCNRCS-RTBURBONSA-N 396.495 2.678 0 50 GFAA O=C(CC[C@H]1C(=O)Nc2ccccc21)NC1CCN(C(=O)c2ccccc2)CC1 952963631 CNUJYLNLVIVFDV-LJQANCHMSA-N 391.471 2.924 0 50 GFAA O=C1COc2c(cc(C(F)(F)F)cc2NC(=O)[C@@H]2CCC(=O)c3cccn32)N1 886091118 OIGZTXBFXUBZIW-ZDUSSCGKSA-N 393.321 2.994 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@@H](c3nncn3C)C2)ncn1 275653650 KTCAQAKIXNWXDM-GJYPPUQNSA-N 385.516 2.605 0 50 GFAA Cn1c(S)nc2cc(C(=O)N(CC(F)F)C[C@@H]3CCC=CO3)ccc2c1=O 170600578 GXUGOEPFKWIZLX-LBPRGKRZSA-N 395.431 2.622 0 50 GFAA O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 170638301 SNQODTZDJFBIFN-CHWSQXEVSA-N 386.351 2.589 0 50 GFAA Cc1ccc(N2CCC(C(=O)N3CC[C@H](OCc4ccncc4)C3)CC2)nc1 172250798 KRTYVNVGLWMKFR-FQEVSTJZSA-N 380.492 2.819 0 50 GFAA CC(=O)[C@H](NC(=O)CN1C[C@H](C)Oc2ccc(Br)cc21)C(C)C 225536172 PJXSJBRMTQLPBJ-APPDUMDISA-N 383.286 2.766 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)NCc1cccc(CN2CCCC2=O)c1 193211277 BEIUCVANRBMELF-UHFFFAOYSA-N 388.471 2.854 0 50 GFAA CC(C)Cc1cc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)nc(O)n1 1506398812 FYNCVFSFCOEBOQ-UHFFFAOYSA-N 396.491 2.937 0 50 GFAA CSCCCN1C(=O)CC[C@@H]2CN(C(=O)CCc3n[nH]c(C)c3C)CC[C@@H]21 216317424 ZJRAJBUAQXUDFY-AEFFLSMTSA-N 392.569 2.552 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(c2ccc(C(F)(F)F)cn2)C[C@@H]1O 1704307934 NMQNWWQHCTYYLR-MAUKXSAKSA-N 380.366 2.985 0 50 GFAA Cc1c(C(=O)NCc2ccccn2)sc2ncnc(NC[C@H]3CCCO3)c12 11995367 GCQGOUBJILKAQI-CQSZACIVSA-N 383.477 2.916 0 50 GFAA COC(=O)c1cc(CNC(=O)c2cccnc2)cc(NC(=O)c2ccoc2)c1 11996074 PWEKCNGFVNZKKO-UHFFFAOYSA-N 379.372 2.644 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)c2cnc(C)cn2)C1 12053523 DORRUHNVXNMKLW-GOSISDBHSA-N 382.508 2.820 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1ccc(F)c(F)c1 12111955 WXCAWYLQLFMXGR-SFHVURJKSA-N 384.390 2.544 0 50 GFAA O=C(NCc1nc2cc(F)ccc2[nH]1)c1cn(Cc2ccccc2Cl)nn1 12429749 ITLQLSOZQLHLQZ-UHFFFAOYSA-N 384.802 2.925 0 50 GFAA COc1cc(C(=O)N[C@H](C)c2ccccc2)c(N(C)S(C)(=O)=O)cc1OC 13582535 ALIGQSCKMGRWIJ-CYBMUJFWSA-N 392.477 2.591 0 50 GFAA O=C(NCCC(=O)N1CCN(Cc2ccccc2)CC1)c1cc2ccccc2[nH]1 13688314 BRAGPUSTOYAMEH-UHFFFAOYSA-N 390.487 2.632 0 50 GFAA O=C(C1CCN(C2CCN(CCCc3ccccc3)CC2)CC1)N1CCCO1 14964379 FJVZVPRETIQGET-UHFFFAOYSA-N 385.552 2.960 0 50 GFAA CCn1c(CN2CCOCC2)nnc1SCC(=O)Nc1ccccc1Cl 19799658 BKAFZCGQDIRDOH-UHFFFAOYSA-N 395.916 2.514 0 50 GFAA CCOc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)[C@@H]3NC(=O)[C@H]1CCOC1)CCC2 1857670145 WCVBQPPMCRUUFC-FAKFISEUSA-N 398.547 2.937 0 50 GFAA CC(C)[C@H]1CN2C[C@@H](NS(=O)(=O)c3c(Cl)cccc3Cl)C[C@H]2CO1 1857727506 USGVDQYTOQLYRU-SLEUVZQESA-N 393.336 2.769 0 50 GFAA CSc1ncccc1C(=O)NC[C@H]1[C@H]2CN(CC(C)C)C[C@]23CC[C@H]1O3 1857724822 FLWAPXAUDAJRGH-TVKQPGBESA-N 375.538 2.669 0 50 GFAA COC(=O)c1cccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c1 1857735458 OOJOQKXSJWOWIH-PMACEKPBSA-N 382.460 2.617 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3ccc(-n4nc(C)cc4C)cc3)CCN12 1857738841 AXOZCMRAKOQFDA-LEWJYISDSA-N 382.508 2.814 0 50 GFAA Cn1cc(-c2nc(C(=O)N3CCC[C@@H](CNC(=O)C(C)(C)C)C3)cs2)cn1 112676310 ZPGBBYMKNYNZAD-ZDUSSCGKSA-N 389.525 2.558 0 50 GFAA COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1cccc2[nH]c(=O)oc12 120024619 FRYJTRPMEIHGDB-HNNXBMFYSA-N 382.416 2.951 0 50 GFAA Cc1ccc([C@@](O)(Cc2noc(-c3nnc4ccccc4n3)n2)C(F)(F)F)o1 810304855 WNCLDSFJHVNXPS-INIZCTEOSA-N 391.309 2.969 0 50 GFAA c1ccc(-n2nnnc2SCCSc2nnnn2-c2ccccc2)cc1 2031044 VCQBHLKBLAFHEQ-UHFFFAOYSA-N 382.478 2.522 0 50 GFAA Cc1cc(C)n2ncc(CN3CCC4(CCc5c(O)nc(C)nc54)CC3)c2n1 2100477079 CNOMZISPPCFQPP-UHFFFAOYSA-N 378.480 2.630 0 50 GFAA Cc1cc(C)nc(-n2nc(C)c(CC(=O)N3CC[C@@H](N)c4ccccc43)c2C)n1 2325769080 GDIGXOPXXAZOBJ-LJQANCHMSA-N 390.491 2.875 0 50 GFAA COc1ccc([C@H]2NC(=O)[C@H](C3CC4(CCC4)C3)NC2=O)cc1Br 2325776904 MWYNDMUWVDPDEN-CABCVRRESA-N 393.281 2.694 0 50 GFAA CC(=O)N[C@@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 939609 QBJRNRDKTIWXDN-JTQLQIEISA-N 384.672 2.504 0 50 GFAA O=C(O)c1cc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc(C(=O)O)c1 953503 WSIXESJELOWBSM-UHFFFAOYSA-N 389.307 2.903 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)N(c2ccc(C)cc2)S(C)(=O)=O)c(OC)c1 1076295 JICWNLNJUGLPFW-CQSZACIVSA-N 392.477 2.805 0 50 GFAA O=C1C[C@@H](c2ccccc2)NCCCN(C(=O)c2ccncc2)CCCCN1 2356162898 SNDANTNRWFOCKA-FQEVSTJZSA-N 380.492 2.545 0 50 GFAA COC(=O)c1cc(NC(=O)COc2cccc(C)c2)ccc1N1CCOCC1 4711509 WUWXQUCDURQIEA-UHFFFAOYSA-N 384.432 2.636 0 50 GFAA CN1CCN(C(=O)c2c(-c3ccccc3)c(-c3ccccc3)nn(C)c2=O)CC1 54278106 UFPFXUFUTSGHDX-UHFFFAOYSA-N 388.471 2.502 0 50 GFAA Cc1c(C)n(CCN2CCOCC2)c2ncn3nc(-c4ccccc4)nc3c12 20573642 ABQCFUHUMMPHHK-UHFFFAOYSA-N 376.464 2.695 0 50 GFAA CC(=O)N1CCc2cc(C(=O)NC[C@@H](O)c3ccc(OC(C)C)cc3)ccc21 116463093 GUEOECVAPFXBPQ-OAQYLSRUSA-N 382.460 2.846 0 50 GFAA OCC[C@H]1CN(Cc2cccc(-n3cccn3)c2)CCN1CCc1ccccc1 22852363 PXWSWXBLUDILNX-DEOSSOPVSA-N 390.531 2.984 0 50 GFAA Cc1nnnn1CC(=O)NCc1cccnc1Oc1cccc(C(F)(F)F)c1 67675484 LTGNLJWOSCOFCP-UHFFFAOYSA-N 392.341 2.504 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)[C@@H]2CCCN2Cc2ccccc2)cn1 122077939 CHGPMRUXZUJKBZ-FQEVSTJZSA-N 375.476 2.857 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(Cc2cnn3ccccc23)CC1 328628205 GZIDRPFEQRQOJB-FQEVSTJZSA-N 378.480 2.528 0 50 GFAA CCN1CCC[C@@H](CN(C)C(=O)CC[C@@H]2CC[C@@H](C)O2)[C@@H]1c1cnn(C)c1 328632137 RQCIMJXSOIDBNZ-QRKMNUTDSA-N 376.545 2.999 0 50 GFAA CCc1ccc(NC(=S)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 6941245 MMSIQLSRLFZTQF-UHFFFAOYSA-N 389.546 2.952 0 50 GFAA O=C(NC1(c2nccs2)CCCC1)[C@@H]1CCS(=O)(=O)c2ccccc21 284059565 SZLIBHZQVSWLAE-CQSZACIVSA-N 376.503 2.990 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@H](Oc4cccnc4)C3)cn2)n1 127875518 YKUAKRPQRPLFSU-SFHVURJKSA-N 378.436 2.964 0 50 GFAA CCn1nc(C)c(CC(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)c1C 368322082 RXMGZAKWFCOEEN-UHFFFAOYSA-N 384.524 2.830 0 50 GFAA CC(=O)c1cccc(NC(=O)CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)c1 174602894 HWYDNELTIVFGAK-GOSISDBHSA-N 394.475 2.882 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCc3sccc3C2)cc(F)c1Cl 156489550 DCJKSSHUWDWCES-UHFFFAOYSA-N 375.830 2.986 0 50 GFAA CCCOc1ccccc1C(=O)N1CCc2c(nc(-c3cccnc3)[nH]c2=O)C1 72156676 SEFZLPGXHVLOSJ-UHFFFAOYSA-N 390.443 2.819 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCC3(CO)CCC3)csc2C1 426506844 RBVYTUJXSPUAQB-UHFFFAOYSA-N 389.521 2.804 0 50 GFAA CCc1csc(CCNC(=O)N2CCN(Cc3ccc(F)cc3)CC2)n1 426627624 DXDBHEVPLWSFKE-UHFFFAOYSA-N 376.501 2.915 0 50 GFAA CC[C@@H]1C(=O)N(C)CCN1Cc1ccccc1-c1nc2c(c(=O)[nH]1)CCCCC2 63884480 SKGIMRCBOTUOGZ-HXUWFJFHSA-N 394.519 2.758 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CCn3nc(C)cc3C)[nH]c2C1 95368551 XOIBIVQFTKMBRD-OAHLLOKOSA-N 379.464 2.544 0 50 GFAA C[C@H](NC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1nccs1 95376412 XLKYEOUPNJBKKD-LBPRGKRZSA-N 379.507 2.855 0 50 GFAA Cn1c(=O)oc2ccc(NC(=O)N(Cc3ccccn3)C[C@H]3CCCO3)cc21 96180311 ILTYNXDAAWKNRK-MRXNPFEDSA-N 382.420 2.740 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)Cn1ccc3ccccc31)CC2 91943781 FOOSXIGLPGBMIM-UHFFFAOYSA-N 377.492 2.760 0 50 GFAA COc1ccc(OC)c([C@@H](C)NC(=O)c2cnc(-c3ccccn3)nc2O)c1 92078235 YDFHPTZKFIMDBS-GFCCVEGCSA-N 380.404 2.752 0 50 GFAA O=C(NCc1nc2ccccc2c(=O)[nH]1)[C@@H]1CCC(=O)N(C2CCCCCC2)C1 91737107 FRMKHJSTQAXLNA-OAHLLOKOSA-N 396.491 2.501 0 50 GFAA Nc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4ccccc4)C3)C2)cn1 95522328 WKYBUUSYAISLAQ-QHCPKHFHSA-N 392.503 2.751 0 50 GFAA COCCN(C)C[C@@H]1CN(c2cc(C)c3ccc(Cl)cc3n2)C[C@@H]1CO 91965411 NBMIPRAGBIQUIV-HZPDHXFCSA-N 377.916 2.820 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@H](O)c3ccccc3Cl)CC2)CC1=O 95356477 OIRCBBKMXTYCCS-GOSISDBHSA-N 378.900 2.871 0 50 GFAA CN1CCN(C[C@H]2CCOC2)CC12CCN(C(=O)CCC1CCCC1)CC2 244884403 YLSXIWQJVAZXHX-HXUWFJFHSA-N 377.573 2.602 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@@H](CNC(=O)c2cc3ccccc3s2)C1 827928146 BQBJUZAJMYKOCQ-AWEZNQCLSA-N 398.488 2.804 0 50 GFAA CC(C)c1csc(CCNC(=O)N2CCCN(C(=O)C(F)(F)F)CC2)n1 670469755 FUDJPEMBBDONBR-UHFFFAOYSA-N 392.447 2.615 0 50 GFAA CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 271596644 TVNLRDCOZNVTLO-RKVPGOIHSA-N 375.448 2.615 0 50 GFAA O=C(C[C@@H]1COc2ccccc2O1)NS(=O)(=O)Cc1cccc(Cl)c1 1875289285 FDCVLQMXEFUZJW-CQSZACIVSA-N 381.837 2.516 0 50 GFAA CCC[C@H](C(=O)N[C@H](Cc1cccc(OC)c1)c1ccccc1)S(N)(=O)=O 1875267838 YJNAXABCOQCLOZ-RTBURBONSA-N 390.505 2.552 0 50 GFAA O=C(c1cc[nH]n1)N1CC[C@@H]2[C@@H](CCCN2C(=O)CC2(C(F)(F)F)CC2)C1 1775993198 XGLPBSFBTQGBAV-GXTWGEPZSA-N 384.402 2.595 0 50 GFAA O=C1N[C@H]2c3ccccc3O[C@@]3(CCCS(=O)(=O)[C@H]23)N1Cc1cccs1 1776006675 YXAPTTDYGNOZDA-LZLYRXPVSA-N 390.486 2.681 0 50 GFAA NC(=O)[C@@H](NC(=O)CCc1cc2ccccc2nc1O)c1ccc(Cl)cc1 1348085494 HHTFUEWBVQPOEV-SFHVURJKSA-N 383.835 2.869 0 50 GFAA Cc1ccc(-n2nc(C)cc2NC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)cc1 1317841935 SLHWTIJHVQJDLZ-ZDUSSCGKSA-N 380.370 2.838 0 50 GFAA Cc1ccc(NC(=O)[C@@H](C)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)c(C)c1 170599757 UGKOHVPSRFHPLJ-IAGOWNOFSA-N 391.512 2.856 0 50 GFAA CCCc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](C)S(=O)(=O)CC3)c12 192303982 VAYSDLVUYSBTPW-GFCCVEGCSA-N 391.493 2.702 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)[C@H]1COCCN1C1CCCC1 195096621 CVTRSPMSAUGQNT-JOCHJYFZSA-N 396.535 2.808 0 50 GFAA CCc1ccc(CN2C[C@@H](C(=O)Nc3c4c(nn3C)CSC4)CC2=O)cc1 1529155304 QPHPOZIKXGQHMA-HNNXBMFYSA-N 384.505 2.717 0 50 GFAA CCC1=NO[C@@H](C(=O)N2CCC3(CC2)OCCc2cc(OC)c(OC)cc23)C1 1704358373 ISGSLEACJMMFLP-LJQANCHMSA-N 388.464 2.649 0 50 GFAA O=C(c1cc2ncccn2n1)N1CCCN(Cc2nc3ccccc3s2)CC1 1772708893 CYUXRJWALOKIBQ-UHFFFAOYSA-N 392.488 2.687 0 50 GFAA CN1CCC[C@H](C(=O)N2CCCN(C(=O)Nc3ccc(Cl)cc3)CC2)C1 1775981523 AFCXBHWMCTZQHR-HNNXBMFYSA-N 378.904 2.748 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)c2coc(COc3ccc4c(c3)OCO4)n2)n1 11879207 BHPOYRBSXUVIIR-CYBMUJFWSA-N 398.419 2.614 0 50 GFAA O=C(CCc1ccccc1)N[C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 11950844 OSDYZLPZYMFIDZ-FQEVSTJZSA-N 394.519 2.812 0 50 GFAA CC(C)CC(=O)N1CCC2(CC[C@@H](CNC(=O)/C=C/c3ccccn3)O2)CC1 11966768 WIJRREBCXVGDTJ-GHOSXJJBSA-N 385.508 2.797 0 50 GFAA O=C(Nc1ccccc1F)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl 12004080 CFPSZOWTXNGSTA-UHFFFAOYSA-N 382.800 2.798 0 50 GFAA COc1cc(C(=O)NCc2ncccc2C)ccc1OC1CCN(C(C)=O)CC1 15066399 WEAFNNHVOBLEDO-UHFFFAOYSA-N 397.475 2.718 0 50 GFAA CCn1ccc(C(=O)N[C@@H]2CCCN(c3cc(-c4ccc(F)cc4)n[nH]3)C2)n1 169753545 RYWDHHXIJZPICN-MRXNPFEDSA-N 382.443 2.831 0 50 GFAA O=C(c1cscn1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857695620 RIFYEPPVWCANMM-FQEVSTJZSA-N 393.472 2.821 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4ccccc4OC(F)(F)F)[C@@H]2CC(=O)N13 1857706098 JZLFRAJQDGMHQA-JOQOYGCGSA-N 398.381 2.783 0 50 GFAA Cc1ccc2ncnc(NC34C[C@@H]5C[C@H](C3)CC(n3nnc(C)n3)(C5)C4)c2n1 1857708962 WEWNZUMJCLQMKY-JNKARSBBSA-N 376.468 2.788 0 50 GFAA COc1ccc(CC(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)cc1F 1857720275 MSUDQCVGYNSCSH-UNMCSNQZSA-N 386.467 2.907 0 50 GFAA Nc1nccnc1C(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Cl)c1 114678512 FAGKIHZXZZLRLW-LBPRGKRZSA-N 380.235 2.609 0 50 GFAA COc1ccccc1-c1cc(C(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)[nH]n1 136469999 PJWJGADDUXTFJY-HNNXBMFYSA-N 382.464 2.606 0 50 GFAA CCOc1cn(-c2ccccc2)nc1C(=O)N1CCN(c2nc(C)cs2)CC1 484721674 SEPWUOXGZZKDBT-UHFFFAOYSA-N 397.504 2.998 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CN(Cc2cc(-c3ccncc3)no2)CC[C@@H]1O 1704297423 RDNQGGKZYNAISH-UNMCSNQZSA-N 393.443 2.617 0 50 GFAA Cn1c(C(=O)N[C@H](CCO)c2cccc(OC(F)(F)F)c2)cnc1Cl 824020941 DJASQUMJEKJLPD-LLVKDONJSA-N 377.750 2.826 0 50 GFAA CCN1CCN(C(=O)c2ccc(NC(=O)c3ccnc4ccccc34)nc2)CC1 2325746098 KDFSHRUYJGZKJW-UHFFFAOYSA-N 389.459 2.660 0 50 GFAA O=C(Cc1ccc(-c2nn[nH]n2)cc1F)N1CCC[C@@H]1c1ccc2c(c1)OCO2 2325807960 NSJUYWWMDONPDU-MRXNPFEDSA-N 395.394 2.641 0 50 GFAA CCOc1ccc(/C=c2\s/c(=C\C(=O)c3ccco3)nc2O)c(Cl)c1 2325854794 VKBGIGXERKMBAU-KPJFGDCZSA-N 375.833 2.986 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)N(CCc3ccccc3)C3CC3)ccc2N1 880984141 CZCMXHVKWCTQCG-UHFFFAOYSA-N 399.472 2.651 0 50 GFAA CCC(=O)N(CCc1ccc(OC)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O 842658 UJDUXIFJRKTEOJ-IBGZPJMESA-N 398.434 2.948 0 50 GFAA COc1ccc(N2C(=S)N(c3ccc(F)cc3)[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 1018778 AKHWBOCJQGZDQH-SJORKVTESA-N 392.477 2.611 0 50 GFAA CCCCCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 2067557 CYDIQNAZDBPHPF-UHFFFAOYSA-N 386.477 2.589 0 50 GFAA COc1ccccc1CCC(=O)N1CC[C@@H](O)[C@](Cc2ccccc2)(C(=O)O)C1 2356145929 XXUBUYJHUXBIJF-NFBKMPQASA-N 397.471 2.535 0 50 GFAA CN(C)c1cccc(C(=O)N2CCc3nc(Cc4ccccc4)nn3CC2)c1 2356148517 CFPDBMNDRQHGNU-UHFFFAOYSA-N 375.476 2.633 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nnc(-c3cccnc3)n2C)cc1 2842793 IULALXWEVZWNNM-UHFFFAOYSA-N 397.460 2.785 0 50 GFAA CCOC(=O)c1sc2ncnc(N3CCN(c4ccccn4)CC3)c2c1C 2921760 PWSWEPRFQQSJTB-UHFFFAOYSA-N 383.477 2.898 0 50 GFAA CCNC(=O)c1c(NC(=O)[C@H](C)Cn2nc(C)nc2C)sc2c1CCCC2 55414233 GCCMMPSSYVIHIF-LLVKDONJSA-N 389.525 2.860 0 50 GFAA COc1ccc(NC(=O)C2CCC(N3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)CC2)cc1 100619297 YSUCNGMRMPFCKW-MBYDAUANSA-N 394.471 3.000 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)NCC[C@@H]1COc2ccccc2O1 55228545 LGQMEISDCMQRIV-CQSZACIVSA-N 383.404 2.999 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCc3nnc4n3CCCCC4)cc2)n1 61373842 RKPNTULHAIEPKT-UHFFFAOYSA-N 378.480 2.796 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)Cc3ccccc3Cl)C2)CC1 23339040 JKFNCVHNZWFDSR-KRWDZBQOSA-N 393.915 2.648 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N(Cc3cnn(C)c3)C3CC3)o2)c1C 1506414697 SROYXSGABOEWBP-UHFFFAOYSA-N 376.438 2.638 0 50 GFAA CN1CCN(C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)CC1 67431925 AXEOZPAZKHOLBY-UHFFFAOYSA-N 394.454 2.735 0 50 GFAA CN(C)[C@@H]1CCN(C(=O)C2(N(C)Cc3ccccc3)Cc3ccccc3C2)C1 39364744 NNYVJNTWJMNAFK-JOCHJYFZSA-N 377.532 2.819 0 50 GFAA Nc1nc(CN2CCOC3(CCOCC3)CC2)nc2sc3c(c12)CCCC3 364268272 YTJHQPRHQSCGKA-UHFFFAOYSA-N 388.537 2.924 0 50 GFAA Cc1c(C(=O)N2C[C@@H](C(=O)O)C[C@H](C(=O)NC3CC3)C2)sc2ccccc12 72150300 NAMZZYJPFGWYTL-STQMWFEESA-N 386.473 2.651 0 50 GFAA Cc1ccc(N2CCCC2=O)cc1-n1ccnc1-c1cc2n(n1)CCCNC2 72430224 GBYFOUVXGFPADR-UHFFFAOYSA-N 376.464 2.664 0 50 GFAA O=C(CCCc1cn[nH]c1)N[C@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72168554 BOEWEZLAQGTRQV-IBGZPJMESA-N 376.460 2.803 0 50 GFAA O=C(Nn1c(=S)[nH]c2sc3c(c2c1=O)CCC3)c1ccc2c(c1)OCO2 17079087 LKQZTSJXPOMTNG-UHFFFAOYSA-N 387.442 2.722 0 50 GFAA CN(C[C@@H]1CCCN(C(=O)CSc2ccc(Cl)cc2)C1)S(C)(=O)=O 289133017 VLGJKUNIKVLGPV-ZDUSSCGKSA-N 390.958 2.562 0 50 GFAA CN(C)S(=O)(=O)c1cccc(CN2CCC(F)(c3ccccn3)CC2)c1 289310544 JDIULQIXIWANQG-UHFFFAOYSA-N 377.485 2.793 0 50 GFAA Cc1cc(C)c(C(=O)N[C@@H]2CCOC[C@H]2Oc2ccc(C(N)=O)cc2)cc1C 223830352 QVJLKYMTLLLOSY-WOJBJXKFSA-N 382.460 2.677 0 50 GFAA COc1cc(C(=O)O)cc(C(=O)NC[C@@H](c2cccnc2)N2CCCCC2)c1 426612639 UHQGHZKMXWQSJP-IBGZPJMESA-N 383.448 2.745 0 50 GFAA CCN(C)C(=O)c1ccc([C@@H]2CCCN2C(=O)c2cn3cccnc3n2)s1 20858364 LGNSEOGSWPUOEF-AWEZNQCLSA-N 383.477 2.860 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)N(S(=O)(=O)c1cccs1)C2 95390617 NGGBCMKQOMTUQX-LSDHHAIUSA-N 381.523 2.638 0 50 GFAA CCCc1nc(C(=O)N2CCC[C@@H](c3nccn3CCN(C)C)C2)cs1 95506711 PRLCLLLBRGGYBS-OAHLLOKOSA-N 375.542 2.874 0 50 GFAA CCN(C[C@H](O)c1cccc(O)c1)C(=O)c1cnc(CN2CCCC2)s1 97475460 FZOKJDNYEALDIA-INIZCTEOSA-N 375.494 2.640 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NC(=O)C(=O)NC(C)C)cc1 91713056 IOAYCMAOYPVNLX-QGZVFWFLSA-N 384.480 2.535 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N[C@@H]2CCc3ccccc32)c(Br)o1 238204490 DMPJAGZAQAKVNK-SNVBAGLBSA-N 386.223 2.706 0 50 GFAA COc1ccc(NC(=O)N2CCCN(C(C)=O)CC2)cc1OCC(F)(F)F 298460849 ACPGBRXUCSMZTN-UHFFFAOYSA-N 389.374 2.722 0 50 GFAA COc1cc(NC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)cc(OC)c1 263615200 BCCLCKUXTFXGLH-SFHVURJKSA-N 398.394 2.958 0 50 GFAA CN(C[C@H]1CCCN2CCCC[C@@H]12)C(=O)CCn1cnc2ccccc2c1=O 299754393 HGHIKYSUAQJXSW-XLIONFOSSA-N 382.508 2.510 0 50 GFAA biogenic Cc1cccc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(F)cc2)n1 826593236 RGNUGNAAOHFCFJ-MRXNPFEDSA-N 377.441 2.711 0 50 GFAA COC(=O)c1nc(-c2ccc(C)cc2)oc1S(=O)(=O)N1CCC[C@@H](C)C1 824216780 UQRALIOFVQKYFJ-CYBMUJFWSA-N 378.450 2.857 0 50 GFAA NC(=O)[C@H](NC(=O)c1ccc(N2CCCCC2=O)cc1)c1ccc(Cl)cc1 1875260122 BIZGSPWYMIXDEV-GOSISDBHSA-N 385.851 2.813 0 50 GFAA Cn1cc(C[N@@]2C[C@H]2COc2cccc3c2N(C(=O)OC(C)(C)C)CC3)cn1 1875385481 UGGXBPBSRCZDFE-XDHUDOTRSA-N 384.480 2.981 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)c2c3c(nn2C)[C@H](C)O[C@H](C)C3)CC1 1875314593 HUJHYOODVBFZMB-SJORKVTESA-N 382.508 2.709 0 50 GFAA CC(=O)N[C@@H](C(=O)N1CCC([C@H](CN)c2ccccc2)CC1)c1ccccc1 1875302004 WLXMOKHLTSWJGP-FGZHOGPDSA-N 379.504 2.845 0 50 GFAA CC(C)C[C@@H]1C[C@@H](C(=O)N=c2[nH][nH]c3ccc(Br)cc23)CC(=O)N1 1875359048 RZRAKTXFYBWJKA-ZYHUDNBSSA-N 393.285 2.627 0 50 GFAA CC(=O)N1CC[C@H](OC(=O)Cc2nnc(O)c3ccccc23)c2ccccc21 1462109284 ONWDNBFQIRTYOC-IBGZPJMESA-N 377.400 2.919 0 50 GFAA C[C@H]1CO[C@H](c2ccccc2Cl)CN1Cc1nnc(S(C)(=O)=O)s1 170607426 AKLLKBQHOLGPKM-GWCFXTLKSA-N 387.914 2.557 0 50 GFAA CN(Cc1ccccc1OCCCn1ccnc1)[C@H]1C[C@H]2CNC(=O)C[C@H]2C1 1704345281 VZJNOFJVEWXLBY-HSALFYBXSA-N 382.508 2.699 0 50 GFAA CC[C@@H](C)C(=O)NCc1nnc2n1CCN(Cc1ccc(OC(C)C)cc1)CC2 12000389 PDVPZDCOESZJQD-QGZVFWFLSA-N 399.539 2.786 0 50 GFAA CC[C@@H](C)C(=O)NCc1nnc2n1CCN(Cc1ccc(Cl)cc1)CC2 12154446 IIIKBEMZTNEDNF-CQSZACIVSA-N 375.904 2.652 0 50 GFAA O=C(NCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)c3ccco3)CC2)C1 12583593 RUFMQHPTSNUSOZ-IBGZPJMESA-N 395.503 2.913 0 50 GFAA COc1cccc(C(=O)N2CCN(c3nc(C)cc(N4CCCCC4)n3)CC2)c1 17012498 MNEDJZFVMHEIGQ-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA Cc1ccccc1C[C@]1(CO)CCCN(C(=O)CN(C)Cc2cccnc2)C1 19594884 DXAWWOSEVGFSAG-HSZRJFAPSA-N 381.520 2.666 0 50 GFAA O=C(C[C@H]1CC1(F)F)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)CCO2 1857689436 DHIXDZNIKUTJNV-KRWDZBQOSA-N 392.446 2.842 0 50 GFAA CCn1nccc1C(=O)N[C@H]1CCC[C@@H](CNC(=O)c2cccc(N(C)C)c2)C1 1857707241 JYYLHUYKEDILNX-AEFFLSMTSA-N 397.523 2.688 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCc4ccncc4)CC3=O)sc2c1 1857714553 DTCVALBKMCXNSE-OAHLLOKOSA-N 380.473 2.712 0 50 GFAA O=C(c1cccn1C(F)F)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857725166 LFJCIXMOCUUFFW-QINHECLXSA-N 387.386 2.798 0 50 GFAA COC(=O)CN(C)C(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857730207 LZGFZGOJBWDXIK-GFCCVEGCSA-N 379.844 2.719 0 50 GFAA Cc1cc(S(=O)(=O)N2CC[C@H](C)C[C@H]2[C@H](C)O)sc1Br 408425362 FTOXCVKUROQKHU-LSJOCFKGSA-N 382.345 2.989 0 50 GFAA O=C(C[C@@H]1COc2ccccc2O1)N1C[C@@H]2Oc3c(F)ccc(F)c3O[C@@H]2C1 333607383 RIWIRFSEPMRRHL-LQAWEQHXSA-N 389.354 2.546 0 50 GFAA NC[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1C(F)(F)F 237980769 YERDJMDMHJOSMH-VIFPVBQESA-N 387.221 2.580 0 50 GFAA O=C(N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21)C1(n2cc(Br)cn2)CC1 826574770 DXHOWKAIZXEULM-QLFBSQMISA-N 376.229 2.728 0 50 GFAA O=C(O)c1cccnc1S[C@@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1=O 19881503 WVWJWOYKWNYLPT-GFCCVEGCSA-N 380.784 2.997 0 50 GFAA Cc1ccn(C)c1C(=O)N1C[C@@H]2CN(C(=O)C[C@@H]3CC[C@@H](C4CC4)O3)C[C@]2(C)C1 2325794693 NPTMGSUIPFQUNO-KEXUJGGDSA-N 399.535 2.602 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3cc(F)cc(Br)c3C2)CC1 2325884800 JOQPYPPCAVJOOW-UHFFFAOYSA-N 395.272 2.898 0 50 GFAA CC(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1 1003772 KSGMBSRGTNZVNS-UHFFFAOYSA-N 377.491 2.937 0 50 GFAA CC(C)Oc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)N[C@@H](C)C(=O)O)cc1 2106091 ISVVUANIJIHQHR-CCNLRRDASA-N 396.443 2.834 0 50 GFAA biogenic CCOc1cc([C@H]2NC(=O)c3nn(CC)cc3N2)c(Br)cc1O 2779259 PJBRZRXZRVIROP-CQSZACIVSA-N 381.230 2.624 0 50 GFAA CCOC(=O)N1CCC(N2C(=O)CC[C@H]2CCNCc2ccccc2F)CC1 11784095 DCQFTVNEDAXZBC-KRWDZBQOSA-N 391.487 2.917 0 50 GFAA COC(=O)c1ccccc1-c1cc(C)cc2c1O[C@@H](CNC(=O)[C@H]1CCOC1)C2 12027325 DEWFFSOFJYPKAO-DOTOQJQBSA-N 395.455 2.905 0 50 GFAA Cc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3snnc3C)C2)o1 12204079 IEVVWUQKADAQLG-AWEZNQCLSA-N 376.482 2.697 0 50 GFAA CN1CCC(N2CCC[C@@H](NC(=O)CC3CC(C)(C)NC(C)(C)C3)C2)CC1 12432377 WYFWVDHCNSSSHE-GOSISDBHSA-N 378.605 2.608 0 50 GFAA O=C(Cn1ncc(N2CCc3ccccc3C2)cc1=O)OCc1ccccc1 19608376 OXLAVWZPJLJFES-UHFFFAOYSA-N 375.428 2.549 0 50 GFAA COc1cc(/C=C/CN2CCN(Cc3cccc(C)n3)[C@@H](CCO)C2)ccc1O 19956974 BRQHIQWRUYTWLY-LWQICCLCSA-N 397.519 2.686 0 50 GFAA CC[C@@H](C)c1n[nH]c2c1CN(C(=O)c1cn3c4c(cccc4c1=O)CC3)CC2 20201124 DVUCUHAMOFCZEK-CYBMUJFWSA-N 376.460 2.993 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@@H]3CCC(=O)N(C4CCCC4)C3)CC2)c1 20782604 VKIVTSMWYOIUHM-LJQANCHMSA-N 399.535 2.521 0 50 GFAA CCN1CCN(C2(C(=O)N3CCc4ccccc4C3)Cc3ccccc3C2)CC1 22851251 HAVMYSGXDSWCHH-UHFFFAOYSA-N 389.543 2.746 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4cccs4)CC3)nc(C)n2)n1 67621578 NJSHPWOHQSKSAP-UHFFFAOYSA-N 382.493 2.611 0 50 GFAA CS(=O)(=O)N1CCC(NC[C@@H](c2ccccc2)N2CCCCCC2)CC1 67785638 OJDCVOUJGCTAED-FQEVSTJZSA-N 379.570 2.617 0 50 GFAA CC(C)[C@H]1CN(CCN2CCCC2=O)CCC(=O)N1Cc1ccc(F)cc1 71747833 OCHNOHYFCNYGCT-LJQANCHMSA-N 375.488 2.507 0 50 GFAA CCOC(=O)[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(Cc1ccco1)C2 72133732 RBIJCIXVEFGAKL-DBXWQHBBSA-N 376.497 2.536 0 50 GFAA NC(=O)c1ccnc(N2CCC[C@@]3(CCC(=O)N(Cc4ccccc4)C3)C2)c1 72408606 XTMAURASCCITHH-JOCHJYFZSA-N 378.476 2.590 0 50 GFAA CN(Cc1cnn(-c2ccc(F)cc2)c1)C(=O)C[C@@H]1NC(=O)c2ccccc21 77486285 JBOOVRLMVJBTHN-IBGZPJMESA-N 378.407 2.845 0 50 GFAA CCC[C@]1(C(=O)O)CCCN(C(=O)c2ccc(NS(=O)(=O)CC)cc2)C1 91451998 GOXWLYMKDXWOTB-SFHVURJKSA-N 382.482 2.555 0 50 GFAA CCc1nnsc1C(=O)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95353903 VNKWLGFDJRWNMB-OAHLLOKOSA-N 382.493 2.760 0 50 GFAA C[C@@H](N[C@H](C)C1CCOCC1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 125412617 WEQLQLDUVNTJJT-OTQYAVNOSA-N 377.529 2.574 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 130557435 FWBMPMPTVQDYCC-KRWDZBQOSA-N 383.492 2.961 0 50 GFAA CC1(C)Cc2cccc(OCC(=O)Nc3ccc(Cc4nnn[nH]4)cc3)c2O1 136988475 HXLAQGMXPZDDOM-UHFFFAOYSA-N 379.420 2.522 0 50 GFAA COc1ccc(N(C)C(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)cn1 151146892 GAJYBKLHFMVKEV-UHFFFAOYSA-N 377.326 2.966 0 50 GFAA CS(=O)(=O)c1ccc(OCCNc2cnc3cc(F)c(F)cc3n2)cc1 170633280 LZXCRWRDVCROGA-UHFFFAOYSA-N 379.388 2.802 0 50 GFAA O=C(c1ccc(=O)n(Cc2ccccc2Cl)c1)N1CC[C@@H](N2CCCC2)C1 171445205 PSTGROBEHLXJLD-GOSISDBHSA-N 385.895 2.860 0 50 GFAA CC(C)NC(=O)c1ccc(NC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1 195140701 GXKGNNIFWQDPDO-IBGZPJMESA-N 394.475 2.920 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCCn1nc(C)cc1C 225536083 HDIBLFSBJJBMFP-SFHVURJKSA-N 385.464 2.747 0 50 GFAA C[C@@H]1Cc2ccccc2N1CC(=O)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 239415266 UCAOFAKCXGFBFM-XLIONFOSSA-N 398.528 2.654 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCCC3)cc2)c(F)c1 252498637 RGNCOVJWVTYUJO-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccccc1 253413026 SUGLCWZRPYGOGR-ITTUMRLJSA-N 383.536 2.929 0 50 GFAA biogenic O=C([C@H]1C[C@H]2CC[C@H]1N2C(=O)C1CCC(F)(F)CC1)N1CC[C@@]2(CCOC2)C1 253418935 FTLLIGJJQXZSGM-AXVVYFOYSA-N 396.478 2.830 0 50 GFAA COC[C@]1(C(=O)O)CCN(C(=O)c2cc(C)c(Br)c(Cl)c2)C1 263057151 QIAMRRYCBGYDPD-HNNXBMFYSA-N 390.661 2.974 0 50 GFAA NC(=O)c1ccc(N2CCN(C(=O)C[C@@H]3CCc4ccccc4C3)CC2)cc1 265501554 XUVILHTWBWACLG-QGZVFWFLSA-N 377.488 2.629 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)[C@H]1Cc3ccccc3O1)CC2 277783927 XUTZYLHUQNBLED-OXQOHEQNSA-N 397.427 2.608 0 50 GFAA CC(C)c1nnc2n1C[C@H](NC(=O)N1Cc3cnn(-c4ccccc4)c3C1)CC2 297250584 JIBNANYMQWUWSI-MRXNPFEDSA-N 391.479 2.627 0 50 GFAA Cc1cccc(C)c1OC1CCN(C(=O)c2cn(C3CCNCC3)nn2)CC1 299739375 NSWKVBFWSUGGJU-UHFFFAOYSA-N 383.496 2.503 0 50 GFAA O=C([C@H]1CC12CCCC2)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 329393412 USOOAKSFEYCKRH-ZWKOTPCHSA-N 388.533 2.950 0 50 GFAA COc1ccccc1N1CCC(NC(=O)Nc2cnn(C[C@H]3CCCO3)c2)CC1 363211870 ZRUQPAGRYQJCJZ-GOSISDBHSA-N 399.495 2.861 0 50 GFAA CC1(C)[C@@H](c2ccccc2)CCN1S(=O)(=O)c1ccc2nc(O)nc(O)c2c1 420743904 BBCGQBYDFJTLBL-MRXNPFEDSA-N 399.472 2.998 0 50 GFAA Cc1nc(CCNC(=O)N2CCN(Cc3cccnc3)CC2)sc1Cl 534672596 DCTWTSPXVWQWGZ-UHFFFAOYSA-N 379.917 2.570 0 50 GFAA COCCN1CC[C@@H](CNC(=O)c2cc(OC)c(OC(C)C)cc2Cl)C1 670461234 LHTXTSVHFWQZHY-AWEZNQCLSA-N 384.904 2.834 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)N1CCOc2cc(O)ccc2C1 804572938 FZWNFUJDVPAUHJ-GOSISDBHSA-N 392.455 2.655 0 50 GFAA Cc1c(CN2CCC[C@H](CNC(=O)CCCn3cncn3)C2)[nH]c2ccccc12 828022167 CYAZODNXCKNLTQ-GOSISDBHSA-N 394.523 2.876 0 50 GFAA COCC(=O)Nc1ccc(OC)cc1NC(=O)[C@@H](c1ccc(F)cc1)N(C)C 952965645 BAHVYKYHDMGJJY-LJQANCHMSA-N 389.427 2.661 0 50 GFAA C[C@@H]1CCC(=O)N1c1cccc(NC(=O)Cn2ncc3ccccc3c2=O)c1 952969744 APUADAJMBRVQSP-CQSZACIVSA-N 376.416 2.551 0 50 GFAA COc1ccc(CN2CCC[C@H](C(=O)c3ccccn3)C2)cc1Cn1cncn1 952983079 UNUIFJNXNTZYBW-SFHVURJKSA-N 391.475 2.825 0 50 GFAA COc1ccc(-c2cc(C(=O)NCc3n[nH]c(C)n3)nn2-c2ccccc2)cc1 1472250086 AHPRVLRODDBJQD-UHFFFAOYSA-N 388.431 2.904 0 50 GFAA Cc1cccc(Cc2nnc(NC(=O)c3ccc4c(=O)n(C)cnc4c3)s2)c1 1506411697 UHPTVCGPVCGCJJ-UHFFFAOYSA-N 391.456 2.937 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2cccc(F)c2C)cc1OC 1529173671 OCANSNVNUWNMSY-WOJBJXKFSA-N 389.423 2.726 0 50 GFAA COc1cc(CN2CC[C@H](O)[C@H](C(=O)O)C2)ccc1OCc1cccc(F)c1 1615963439 KMRVJOYHITWVTG-MSOLQXFVSA-N 389.423 2.681 0 50 GFAA Cc1ccc(C)c(-c2n[nH]cc2CN2CCC3(CC2)OCC[C@@](C)(O)[C@@H]3O)c1 1704304128 ARZXQLVDZSPJKV-LEWJYISDSA-N 385.508 2.560 0 50 GFAA COc1ccc(Cc2nc([C@H]3CCCN(C(=O)c4cn(C)cn4)CC3)n[nH]2)cc1 1772804176 IJHITDXOPGRUFI-INIZCTEOSA-N 394.479 2.548 0 50 GFAA CCNC(=O)c1ccc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc1 1857697819 NOISJPTULQYLOH-QFIPXVFZSA-N 393.491 2.689 0 50 GFAA Cc1cccn2c(CC(=O)N3CCC4(CC3)C[C@H](O)C[C@H](C(C)C)O4)cnc12 1857697926 BIWOZBXIWAXLOG-RTBURBONSA-N 385.508 2.742 0 50 GFAA NC(=O)c1cc(N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)nc2ccccc12 1857721677 ATYXFGYOPNKLPM-ZHRRBRCNSA-N 398.466 2.922 0 50 GFAA Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)[C@]3(C(=O)O)CCNC3)cc2)cc1 1875267004 PJHGDMSRTFHOBH-HXOBKFHXSA-N 396.487 2.686 0 50 GFAA COc1ccc([C@@H]2CCN(C(=O)c3cn4cc(CN)ccc4n3)[C@@H]2C)cc1F 1875292361 FTBRUDLKGMKITL-CZUORRHYSA-N 382.439 2.959 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](CN)CC23CCC3)c2ccccc12 1875305375 BULJGWPETHJLCA-HNNXBMFYSA-N 387.505 2.690 0 50 GFAA CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCc1ccc(Br)cc1 1875330694 YEROYIZYPKLVRA-KRWDZBQOSA-N 391.265 2.518 0 50 GFAA CNC(=O)CN(C[C@H]1CSc2ccccc21)C(=O)CN1CCc2ccccc21 1875379571 WSHWIYHMXZRDOQ-KRWDZBQOSA-N 395.528 2.513 0 50 GFAA C=CC(=O)NC[C@H](NC(=O)Cc1c(C)nn(C)c1C)c1ccc2ccccc2c1 1875386831 ZWNIOSFJMJIMSS-NRFANRHFSA-N 390.487 2.892 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N1CC[C@@H](C2CC2)[C@H]1c1nnc(O)n1C 1875401944 WZQNAHCWTHVJPD-SJCJKPOMSA-N 381.436 2.624 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@@H]3CC(=O)N(c4nccs4)C3)cc2)c1C 2325737309 DNHKAOWIVLUOFC-CQSZACIVSA-N 381.461 2.937 0 50 GFAA CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CC[C@H]3SCCS[C@H]23)c(Cl)c1 2325779869 MDDHWOAZHYAGHY-MGPQQGTHSA-N 391.967 2.853 0 50 GFAA Cc1nccn1Cc1ccc(NC(=O)C2CCN(c3cc(O)ncn3)CC2)cc1 2325789824 PVEZJKCSFMRPSA-UHFFFAOYSA-N 392.463 2.591 0 50 GFAA Cc1cc(Br)cn2c(CN[C@@H](Cc3ccoc3)C(=O)O)cnc12 2325791869 FLXNTGOHMILUOE-AWEZNQCLSA-N 378.226 2.784 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@@H]2CC(=O)N(c3cccc(O)c3)C2)CC1 2356155771 MGAHOUKKESVEBP-QGZVFWFLSA-N 394.471 2.909 0 50 GFAA COc1cc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc(OC)c1OC 803529 QAHZSXRBOQXPSB-UHFFFAOYSA-N 385.464 2.717 0 50 GFAA CCOC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C)cc1 1908376 YCNXJLYOYVQVPB-LJQANCHMSA-N 386.473 2.929 0 50 GFAA biogenic,in-vitro Cc1cc(C(=O)N2CCC[C@@H](c3[nH]ncc3Cc3ccccc3)C2)nc(N)n1 67771047 JRMYMDIJBWDRHY-MRXNPFEDSA-N 376.464 2.701 0 50 GFAA O=S(=O)(N(c1cccc(Cl)c1)S(=O)(=O)C(F)(F)F)C(F)(F)F 67800033 VPTHJRFJWASZSA-UHFFFAOYSA-N 391.698 2.846 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c1 65361916 YDYNGXBGPZCQEA-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@@H](NCc2cc(C)nc(N(C)C)n2)C1 252478671 ARVPFJDTDHEAKF-OAHLLOKOSA-N 375.904 2.882 0 50 GFAA COC1(c2nc(CC(F)(F)F)no2)CCN(C(=O)Cc2cccc(O)c2)CC1 284542792 SKRPRYNVMLSIMR-UHFFFAOYSA-N 399.369 2.587 0 50 GFAA CN1C(=O)[C@](CC(=O)Nc2ccc[nH]c2=O)(Cc2ccccc2)c2ccccc21 71771660 PYJGSMRZBSBWJW-QHCPKHFHSA-N 387.439 2.861 0 50 GFAA C[C@@H](C(=O)NC1(c2cccc(F)c2)CCOCC1)n1nnc(-c2ccccc2)n1 173847074 PPIGUFAXWCPTDG-HNNXBMFYSA-N 395.438 2.862 0 50 GFAA O=C(c1cnc(O)c(Br)c1)N1CCNC[C@H]1c1ccccc1Cl 262061426 VXHPQMPOKJLRGK-AWEZNQCLSA-N 396.672 2.990 0 50 GFAA COC(=O)c1ccsc1NC(=O)CSc1nnc(-c2ccco2)n1C 17077365 SYIYUQZTCGOEOR-UHFFFAOYSA-N 378.435 2.654 0 50 GFAA COc1ccc(CCN[C@H]2CCCc3ccc(S(N)(=O)=O)cc32)cc1F 289912605 UTAHMMCGXFCENQ-SFHVURJKSA-N 378.469 2.691 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)N2CCC[C@H](c3ncc[nH]3)C2)n1 426465448 LJUGPZAJCXOXPV-LBPRGKRZSA-N 382.390 2.659 0 50 GFAA Cc1cccc2nc(CCNC(=O)N3CCN(C4CCSCC4)CC3)[nH]c12 426470660 ODLKUNHRZWWOMM-UHFFFAOYSA-N 387.553 2.637 0 50 GFAA COc1cc(CN2CCC(F)(F)CC2)ccc1OC[C@H](O)CN1CCCC1 95506808 CPKBLKMDLRPVIZ-QGZVFWFLSA-N 384.467 2.762 0 50 GFAA O=C(O)c1ccc([C@@H]2CCCN(C(=O)c3cc(=O)n(-c4ccccc4)[nH]3)C2)cc1 95381116 NZRGZVZUEJQTOY-QGZVFWFLSA-N 391.427 2.884 0 50 GFAA COc1cc2c(cc1CN1CCC3(CCC(=O)N(CCN(C)C)C3)CC1)CCC2 95527005 AWTFKHGKLFHVPQ-UHFFFAOYSA-N 399.579 2.950 0 50 GFAA CN1CCCCC[C@H]1C(=O)N1CCN(CCCOc2ccc(F)cc2)CC1 95370833 STAOWWQBWYRCIQ-FQEVSTJZSA-N 377.504 2.613 0 50 GFAA CC(C)=CCN1CCc2nc[nH]c2C12CCN(C(=O)[C@H](C)n1cccn1)CC2 97636724 YHSZVAICABWFDR-KRWDZBQOSA-N 382.512 2.509 0 50 GFAA CC(=O)N[C@@H]1CCN(C(=O)Nc2cc(C)nn2Cc2cccc(Cl)c2)C1 97522267 AIERXSIJFGCLGZ-MRXNPFEDSA-N 375.860 2.636 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCCc1nc(O)c2ccccc2n1 268953182 USAGAUPNLUZWAI-XYPHTWIQSA-N 383.448 2.902 0 50 GFAA O=C(c1cccs1)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@@H]2C=Cc3cc(Cl)ccc3N21 245256590 RRKMLLGXBGFJBG-HNKHHVNMSA-N 384.844 2.757 0 50 GFAA CCc1cc(N2CCN(CC(=O)Nc3nc(C(C)(C)C)cs3)CC2)ncn1 244873459 WQSNHKIBKXKXFQ-UHFFFAOYSA-N 388.541 2.554 0 50 GFAA CCOc1ccccc1[C@H](CC)NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 299650365 NKMLJJBOWYGFIJ-INIZCTEOSA-N 387.480 2.907 0 50 GFAA C[C@H](NC(=O)NCC(=O)NCc1ccccn1)c1cccc(C(F)(F)F)c1 1875258339 NZQHSKXXIVMLQS-LBPRGKRZSA-N 380.370 2.777 0 50 GFAA NC(=O)CO[C@H]1CCN(C(=O)c2ccc(-c3cccc(C(F)(F)F)c3)o2)C1 1875263913 OKLNJXYERNAZLA-ZDUSSCGKSA-N 382.338 2.682 0 50 GFAA COc1ccc([C@H](O)CNC(=O)C2(N3CCCC3)CCCCC2)cc1OC 952872747 SQLQZPSGYGVUDY-QGZVFWFLSA-N 376.497 2.652 0 50 GFAA CC(=O)c1cc(CC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)cs1 952972527 FWGSLZLOOKLOPB-LJQANCHMSA-N 386.517 2.901 0 50 GFAA Cc1cccc(C)c1OC1CN(S(=O)(=O)c2cccc3nsnc23)C1 952973320 NOBPWUCTHDFXLS-UHFFFAOYSA-N 375.475 2.760 0 50 GFAA O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)N1CCc2cc(O)ccc2C1 1347639803 GXPGMOMFRPLBEE-UHFFFAOYSA-N 385.485 2.630 0 50 GFAA CSc1ccc(Cl)c(C(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)c1 275620230 JDHXFTOOGGPTPF-GFCCVEGCSA-N 391.928 2.781 0 50 GFAA CCn1cc([C@H]2C[S@@](=O)CCN2c2ncnc3c2oc2ccccc23)cn1 225410381 WLFHPWTUNGNLSJ-RXAIFQJESA-N 381.461 2.902 0 50 GFAA C[C@](O)(CNC(=O)C(=O)Nc1ccc(Oc2ccncc2)cc1)c1cccs1 740522462 JZZROCFIPACSBH-FQEVSTJZSA-N 397.456 2.898 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NC[C@H](O)c1ccccc1 192770842 ZEJNRRSWNVLZRV-OALUTQOASA-N 382.460 2.540 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)CC(=O)Nc3cc(Cl)ccc3C)C2)n[nH]1 1506420860 CAHVVXTTXXCZDC-CYBMUJFWSA-N 375.860 2.810 0 50 GFAA CSc1ncc(C(=O)O)c(N2CCC(N3CCc4ccccc4C3)CC2)n1 1529109529 CQJOJCGKDBEGHR-UHFFFAOYSA-N 384.505 2.924 0 50 GFAA COC(=O)c1cc(S(=O)(=O)N2CCCC23CCC3)c(Br)o1 368431033 BHGFZJJCQXKJOF-UHFFFAOYSA-N 378.244 2.536 0 50 GFAA CCN(CC)C(=O)[C@H]1CCCN(C(=O)[C@@H]2CC(CCc3ccccc3)=NO2)C1 12097204 QEEDTWHYYWJGSN-ICSRJNTNSA-N 385.508 2.871 0 50 GFAA O=C(NCc1cccc(F)c1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12707503 LQGLFKFNKYGLGU-SFHVURJKSA-N 387.499 2.555 0 50 GFAA Cn1nc2c(c1C(=O)N1CCc3nn(C)c(-c4ccccc4)c3CC1)CCCC2 1857675850 KGBHJMXDVAITEA-UHFFFAOYSA-N 389.503 2.940 0 50 GFAA NC(=O)[C@H]1CCCN(CCCn2ccnc2-c2coc(-c3ccccc3)n2)C1 1857694578 SIKVITNUVGAFMP-KRWDZBQOSA-N 379.464 2.793 0 50 GFAA CC(=O)Nc1cccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c1 1857734372 QPSKHAWIZSZWFV-PCCBWWKXSA-N 379.460 2.589 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)C2(c3ccccc3)CCCCC2)CC[C@H]1O 1857739593 WXYRMHCYMZMSHU-IRLDBZIGSA-N 389.536 2.887 0 50 GFAA Cc1nc(C(C)C)ncc1C(=O)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210017233 UOSIQAHQGZDCMC-WBVHZDCISA-N 383.448 2.628 0 50 GFAA CCCN1CC[C@@]2(CO)CCCN(S(=O)(=O)c3ccc(C)c(C)c3)[C@@H]2C1 1704325295 HMBMIBRMDZDGHH-WOJBJXKFSA-N 380.554 2.551 0 50 GFAA O=C(OCc1ccccc1)N1CC[C@@H](c2nc(-c3ccnc4ccnn34)no2)C1 813348951 PLIMVOYCLMFANE-OAHLLOKOSA-N 390.403 2.905 0 50 GFAA O=C(O)[C@@H]1CCCN(S(=O)(=O)c2c(Cl)cccc2Br)C1 261691841 HRUOVIDDMSOTCC-MRVPVSSYSA-N 382.663 2.588 0 50 GFAA COCCn1nc(-c2ccccc2)nc1[C@H]1OCC(=O)N[C@@H]1c1ccccc1 2100478157 WBGVEGGAEDITQX-MOPGFXCFSA-N 378.432 2.520 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)cc(O)n1 2100557456 SZWLTQMQCFFRST-JOCHJYFZSA-N 379.460 2.893 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)[C@H](Cc3ccccc3)C3CC3)ccc2N1 2325766590 WQROQPVZELLFRN-MRXNPFEDSA-N 384.457 2.620 0 50 GFAA C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 878590705 WIPDQZAKWVKRSM-VBKZILBWSA-N 391.475 2.542 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)CC2)cc1 822751 DPOPSINLHHFBEO-UHFFFAOYSA-N 376.478 2.605 0 50 GFAA CN(CC(=O)NC1CCCCC1)S(=O)(=O)c1ccc(Br)cc1 1163165 NSZWYWGELMNYHW-UHFFFAOYSA-N 389.315 2.519 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Nc2cc(C)ccc2OC)C1=O 2356163376 ZMARLJCHNRZMMX-FQEVSTJZSA-N 375.469 2.639 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CCC(CO)CC3)nc2)C1 67966249 OMBLZJXUQSAVGJ-IBGZPJMESA-N 387.524 2.758 0 50 GFAA Cc1ccccc1[C@H](NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 67603468 GVLNCDRTQIJYPW-AZUAARDMSA-N 386.517 2.872 0 50 GFAA CCCCn1c(-c2ccccc2)c(CC)n2c3c(=O)n(C)c(=O)n(C)c3nc12 12411006 MXHFTGAKAIELKJ-UHFFFAOYSA-N 379.464 2.716 0 50 GFAA CCOc1ccc(NC(=O)Cn2cnc3c(cnn3-c3ccccc3)c2=O)cc1 4165693 PLMMJJFGRFJNKR-UHFFFAOYSA-N 389.415 2.620 0 50 GFAA C[C@@H]1CN(S(=O)(=O)C2CCC(C(F)(F)F)CC2)C[C@]2(CCCOC2)O1 333458628 UANUYKYNPRMJCH-URGYJCLVSA-N 385.448 2.707 0 50 GFAA O=C1CC2(CCN(c3nnnn3-c3ccccc3)CC2)CN1Cc1ccccc1 72469884 VVJFYTUDZITXTH-UHFFFAOYSA-N 388.475 2.681 0 50 GFAA O=C(O)CN(C(=O)CCc1ncc(-c2ccc(F)cc2F)o1)C1CCOCC1 238098402 ZSWWJCSJLDFMHF-UHFFFAOYSA-N 394.374 2.645 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H]1OC[C@H](n2cc(F)c(N)nc2=O)S1 212702493 JJJRXXAKALDRAS-IVHFILHXSA-N 399.488 2.557 0 50 GFAA O=C(Cn1nc(C(F)(F)F)c2c1CCC2)N1CCN(Cc2cccs2)CC1 20607509 DFQQJDULSGPSMI-UHFFFAOYSA-N 398.454 2.797 0 50 GFAA CC(=O)c1ccccc1-c1ccc(C(=O)N2C[C@H]3C[C@H](O)[C@H](O)C[C@H]3C2)cc1 426582713 BAEKWNVPOKOBOY-MTIDIVMFSA-N 379.456 2.760 0 50 GFAA O=C1CC[C@]2(CCCN(c3ncnc4[nH]ccc34)C2)CN1CCc1ccccn1 91468894 CUOGUNKJQCDDOW-JOCHJYFZSA-N 390.491 2.805 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@H]4CC[C@@H]3CN(C(=O)C3CCC3)C4)CC2)cc1 95370164 IDYQKZXBJCREPE-QFBILLFUSA-N 382.504 2.976 0 50 GFAA CCCCn1c(C)c(CC(=O)NCc2nnc3n2CCC3)c2c1CCCC2=O 95502917 GFASUXDMJVNFHD-UHFFFAOYSA-N 383.496 2.512 0 50 GFAA COc1cc(CN2CC=C(C)CC2)ccc1OC[C@H](O)CN1CCSCC1 95513059 BEDSHMNMBWIZNR-LJQANCHMSA-N 392.565 2.636 0 50 GFAA COc1ncccc1C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 91691082 CSKLBNWQXMEFLH-UHFFFAOYSA-N 377.448 2.750 0 50 GFAA COc1ccc2c(C(=O)N(C)Cc3nnc(C)o3)cc(-c3cn[nH]c3)nc2c1 23192998 JVLSIZBNQVKFIZ-UHFFFAOYSA-N 378.392 2.597 0 50 GFAA C[C@H](Nc1nc(N2CCN(CCO)CC2)nc2ccccc12)c1ccccc1 96439035 IRFLIWQODBUWBU-KRWDZBQOSA-N 377.492 2.917 0 50 GFAA COCCn1c([C@@H](C)NC(=O)c2cc(-c3ccncc3)[nH]n2)nc2ccccc21 252570631 XAFOBLJSHHISOU-CQSZACIVSA-N 390.447 2.959 0 50 GFAA COC(=O)c1cn([C@@H](c2ccc(OC)c(OC)c2)C(C)C)cc2c(=O)[nH]nc1-2 263588617 WGQLJFAEIKDHKK-GOSISDBHSA-N 385.420 2.725 0 50 GFAA O=C(NCc1noc(-c2ccco2)n1)N(Cc1ccccn1)C[C@@H]1CCCO1 534646674 DAMWYQUQOCEBEZ-HNNXBMFYSA-N 383.408 2.615 0 50 GFAA COC[C@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccnn1C 299767385 GYZBFVICGWSLAV-KRWDZBQOSA-N 385.468 2.555 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N1CCc2nc[nH]c2[C@H]1c1ccncc1 827972466 IOJBETMXOZMWMF-LJQANCHMSA-N 390.403 2.555 0 50 GFAA Cn1nc2c(c1CN[C@@H]1C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]1O)CCC2 1875398653 AEDUSJLKVZZBEH-BSLALVQMSA-N 391.519 2.702 0 50 GFAA O=C1O[C@@H](C(=O)NC2CCN(c3ccccn3)CC2)Cc2cc(Cl)ccc21 1875310471 QSACMSJWHOUBOF-QGZVFWFLSA-N 385.851 2.602 0 50 GFAA CN1C(=O)C[C@H](Nc2nc(Cl)nc3c2ncn3C)[C@H]1c1ccc(F)c(F)c1 1875404858 YFSHNQWLEMEHQV-SMDDNHRTSA-N 392.797 2.679 0 50 GFAA C[C@H]1C[C@@H](C(=O)NCc2cc3ccccc3n(C)c2=O)N1C(=O)OC(C)(C)C 1875284509 XLPHSPWXKFAQIS-GUYCJALGSA-N 385.464 2.553 0 50 GFAA Cc1cnn(CCC(=O)NC[C@@H]2CCCN(C(=O)/C=C/c3ccccc3)C2)c1 952974074 SWOCUPRILSUPEK-XTXLJPNXSA-N 380.492 2.650 0 50 GFAA COCC(=O)Nc1ccc(OC)cc1NC(=O)CCn1cnc2ccccc21 952979200 VCWRAOIIUXJXQG-UHFFFAOYSA-N 382.420 2.659 0 50 GFAA COc1ccc(CC(=O)N2CCc3nc[nH]c3[C@H]2c2cccnc2)cc1OC 888088913 XEGIGKCXXAUGBJ-OAQYLSRUSA-N 378.432 2.539 0 50 GFAA O=C(NCc1cccc(CN2CCOCC2)c1)c1cc2ccccc2c(=O)o1 170614588 DBYOJYFCONRFOH-UHFFFAOYSA-N 378.428 2.555 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2C(=O)Cc2ccc(C(F)(F)F)cc2)O1 225761866 GPFKJJXEHUOTTM-FWYOQMDTSA-N 385.382 2.958 0 50 GFAA O=C(Cn1nnc2ccccc21)NC1CCC(Oc2ncccc2Cl)CC1 189640912 BBAZYQRUWWFZSG-UHFFFAOYSA-N 385.855 2.986 0 50 GFAA CC1(C)CCN(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)CCS1(=O)=O 194174300 LGHRKLQEUINUTL-HNNXBMFYSA-N 399.944 2.527 0 50 GFAA COc1cc(C(=O)N(CC(=O)O)C2CCOCC2)ccc1OCc1ccccc1 767040086 SVQVMLYOHREPQD-UHFFFAOYSA-N 399.443 2.980 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3O)[nH]n2)C1 1506404516 VAZGSZYASURRNA-CQSZACIVSA-N 376.416 2.912 0 50 GFAA CCN1CCC[C@H](NC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704313617 JVOMWIQRKAJWOV-AWEZNQCLSA-N 390.459 2.769 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704328525 KHIRDBYWTFNIJE-MRXNPFEDSA-N 385.464 2.677 0 50 GFAA CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCCN(C(=O)CN2CCCC2=O)C1 11818584 RJCSOIYHDHUQRL-VMMLISQSSA-N 398.503 2.884 0 50 GFAA O=C1NCCN(Cc2ccccc2)[C@@H]1CC(=O)N(Cc1ccccc1)CC1CC1 11934848 QPVWXXGMVKEXMC-JOCHJYFZSA-N 391.515 2.816 0 50 GFAA CCN(CC)C(=O)Cn1cc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)nn1 12314422 MTPHUMVTKKFUMF-GOSISDBHSA-N 383.496 2.556 0 50 GFAA CCn1cnc2cc(NC(=O)c3cc(OC)c(OC)c(OC)c3)ccc2c1=O 12413865 IGROTETVFPRVPT-UHFFFAOYSA-N 383.404 2.695 0 50 GFAA biogenic,in-vitro CCn1nc(C(=O)N2CCCC2)c2c1CCN(C(=O)c1c[nH]c3ccccc13)C2 14748963 JYKATOVSWYJJJX-UHFFFAOYSA-N 391.475 2.819 0 50 GFAA Cc1cc(C)n(C(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CCCC[C@H]3C2=O)n1 18107160 ZUPWIBSQWPGFOD-OTWHNJEPSA-N 379.460 2.927 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)N2CCC[C@@H](CN3CCCCC3)C2)cc1 19224344 PMXFCPLTHBSZCI-KRWDZBQOSA-N 393.553 2.786 0 50 GFAA CCC[C@@H](C)c1n[nH]c2c1CN(C(=O)CCn1c(=O)[nH]c3ccccc31)CC2 19757149 UQAHSAVXXJRIIN-CQSZACIVSA-N 381.480 2.931 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@@H]1O)c1ncncc1Cl 1857531345 LPPJCLHAGLOMAD-JQFCIGGWSA-N 397.866 2.563 0 50 GFAA Cc1nc2ccc(Cc3nc(C4CCOCC4)nn3-c3cnn(C)c3)cc2[nH]1 1857679909 ABIFMNWTFWMZHO-UHFFFAOYSA-N 377.452 2.670 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857722937 QITQNVMKNWWODN-JOCHJYFZSA-N 394.475 2.843 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3cnc(C)c(C)c3)C[C@@H]2C(=O)O)c1OC 219504556 XJHJGKRHMQREMI-SJORKVTESA-N 384.432 2.656 0 50 GFAA C[C@@]1(C(=O)O)CCN(C(=O)C2(c3ccc(Br)cc3)CCOCC2)C1 237642023 IUQQJEQKZLGVMC-QGZVFWFLSA-N 396.281 2.821 0 50 GFAA Cc1ccc(-n2nc(C)c(CC(=O)N3CC[C@@H](C(=O)O)C3)c2C)cc1Cl 237838656 YKLFPWWFZQYCRH-CQSZACIVSA-N 375.856 2.927 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)Cc2csc(COc3ccc(Cl)cc3)n2)C1 238087698 QAOSUEOZFRFMND-NSHDSACASA-N 380.853 2.851 0 50 GFAA CS(=O)(=O)N1CCC(C(=O)Nc2ccc3[nH]c(-c4ccccc4)nc3c2)CC1 252508802 XUODADBTTYRIIS-UHFFFAOYSA-N 398.488 2.840 0 50 GFAA Cc1nccn1CCCN(C)C(=O)c1cnc2c(Br)cccn12 2325790046 JALGNDYUUOWKOF-UHFFFAOYSA-N 376.258 2.764 0 50 GFAA Cn1ccnc1CN1CCC[C@H]([C@H]2CCCN(C(=O)CCCn3ccnc3)C2)C1 2325840118 QADLOVVJCGARHJ-PMACEKPBSA-N 398.555 2.548 0 50 GFAA CO[C@@H]1COCC[C@H]1Cn1nnnc1N1CCC[C@H](CCCc2ccccc2)C1 2325842334 VDJMIJUIBMMUDF-PCCBWWKXSA-N 399.539 2.964 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(N)=O)Cc2c(Cl)cccc2Cl)cc1 1015631 LUQBVJNWEVINBM-UHFFFAOYSA-N 387.288 2.978 0 50 GFAA COc1ccc(-c2nnc(SCC(=O)Nc3ccc(F)c(F)c3)n2N)cc1 1049682 ZTSPIWSRXKKCLY-UHFFFAOYSA-N 391.403 2.677 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)[C@H](C)Cn1cc(Br)cn1)OCO2 2793113 PWFFEJXKAWOHMW-SECBINFHSA-N 394.225 2.852 0 50 GFAA Cc1ccc(C(=O)O)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)cs1 6680598 XSLDHSOYQYUIIW-UHFFFAOYSA-N 394.474 2.792 0 50 GFAA Cc1ccc(CNC(=O)c2cn(CC(C)C)cc(C(=O)NC(C)C)c2=O)cc1 12055737 YGRJUNFRWWOLGK-UHFFFAOYSA-N 383.492 2.881 0 50 GFAA COc1cccc(OC[C@H](O)CNC(=O)c2cc(CCc3ccccc3)no2)c1 12572373 ZDKSPTOKTHQCPA-GOSISDBHSA-N 396.443 2.638 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 12712003 AJPLRPQOXRCQBJ-FQEVSTJZSA-N 390.434 2.713 0 50 GFAA O=C1NCCN(Cc2ccccc2C(F)(F)F)[C@@H]1CC(=O)N1CCCCCC1 15063627 GAFZPQVOZCIZKA-QGZVFWFLSA-N 397.441 2.799 0 50 GFAA CCN1CC[C@@H](CN(C)C(=O)c2cc(Cn3c(C)nc4ccccc43)[nH]n2)C1 15065360 PZYTXWQACPLFBU-INIZCTEOSA-N 380.496 2.530 0 50 GFAA Cc1cc(-c2nnc(SCC(=O)Nc3ccccc3C(N)=O)n2C)cs1 17079131 XXADJJCSTGHCFA-UHFFFAOYSA-N 387.490 2.682 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2[C@H](C)CCC[C@H]2C)c1C(=O)OC(C)C 17080894 GAENXTZOLUPPIX-VXGBXAGGSA-N 395.525 2.922 0 50 GFAA CCOc1ccc(CN2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 19842723 HXUZOWRRZXWBKC-UHFFFAOYSA-N 378.469 2.731 0 50 GFAA COc1ccc(OC[C@@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 20109775 SEQFSUFNUVIUSY-SFHVURJKSA-N 376.884 2.911 0 50 GFAA Cc1nonc1OCCNC(=O)c1ccc([C@@H]2CCCN2C(=O)C(C)C)s1 20232702 OCSWNPZTMKJQLX-ZDUSSCGKSA-N 392.481 2.568 0 50 GFAA COC(=O)c1ccc(CN2CCN(CCCc3ccccc3)[C@H](CCO)C2)cc1 36385676 GZNTUQIPBYHOHS-HSZRJFAPSA-N 396.531 2.975 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)Nc4ccccc4C)CC3)nn2)n1 65363827 BRBBUGAZRXUUCE-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA COc1ccc(-c2ccc(C(=O)N3CCCN(c4ncccn4)CC3)cn2)cc1 67447286 MWGOMBUSMXDIRF-UHFFFAOYSA-N 389.459 2.900 0 50 GFAA Cn1nc(C(=O)O)c2c1CCN(C(=O)C[C@@H](c1ccccc1)c1ccco1)C2 67675669 UEEFQECIYWJYIT-HNNXBMFYSA-N 379.416 2.818 0 50 GFAA CCc1c(C)cc(C(=O)N2CCc3[nH]nc(-c4ccccc4)c3C2)c(=O)n1C 67676098 IEPMQCNRGUQZKQ-UHFFFAOYSA-N 376.460 2.845 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@@H](N(C)Cc1c[nH]nc1-c1ccccc1)C2 67880983 UAADCOHBWUQPSF-MRXNPFEDSA-N 379.464 2.981 0 50 GFAA CCCCNC(=O)Cn1c(-c2ccccc2)nn(-c2ccc(OC)cc2)c1=O 77342513 MGUBFEPAHZOARK-UHFFFAOYSA-N 380.448 2.626 0 50 GFAA Cc1c(C(=O)N2CC[C@H](N3CCOCC3)[C@H](CCC(=O)O)C2)[nH]c2ccccc12 91645627 XVERAAVDABQFHH-APWZRJJASA-N 399.491 2.504 0 50 GFAA O=C1CCC2(CCN(C(=O)NC3CCCCC3)CC2)CN1CCc1c[nH]cn1 91656763 FZWRUDVXSRMMGK-UHFFFAOYSA-N 387.528 2.699 0 50 GFAA O=C(NCCNc1cccnc1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)C1 91943339 AEHVVCXYFJZITJ-INIZCTEOSA-N 386.883 2.702 0 50 GFAA CC(=O)c1ccc(C(=O)N2CCC3(CC2)CC(=O)N(C[C@H]2CCCO2)C3)s1 95362049 YSJPRDNFAIRELA-OAHLLOKOSA-N 390.505 2.584 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H](NC(=O)c2ccccc2Cc2ccc(C)cc2)CN1C 95390637 ZMFTVZMCLQRJIU-CTNGQTDRSA-N 379.504 2.524 0 50 GFAA Cc1cc(C)nc(N2CCN(C(=O)Nc3cccc(-c4cnc[nH]4)c3)CC2)n1 96141742 HBKOXTKRSUPLNJ-UHFFFAOYSA-N 377.452 2.838 0 50 GFAA COc1ccccc1[C@H]([C@@H](O)C(=O)c1c[nH]c2ccccc12)N1CCOCC1 101016392 RBTFANDLWWTNGH-IFMALSPDSA-N 380.444 2.794 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnc(C)s2)C[C@H]1CCO 104428444 RQFVGCWGFWSSGS-GOSISDBHSA-N 375.538 2.919 0 50 GFAA CCCOc1cccc(CCNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)c1 129500167 KWPGLNNSSKFKFO-SFHVURJKSA-N 381.476 2.578 0 50 GFAA O=C(Nc1cccc(-n2ccnn2)c1)N[C@H]1CCN(c2c(F)cccc2F)C1 130410689 KPWKJNDEBTYPHC-AWEZNQCLSA-N 384.390 2.946 0 50 GFAA Cc1noc(C2CCN(C(=O)NC[C@H](c3cccc(F)c3)N(C)C)CC2)n1 130744011 XFQJOOWIUVVTMK-QGZVFWFLSA-N 375.448 2.709 0 50 GFAA Cc1nn(C)c(N2CCOCC2)c1CN1CC[C@H](COCc2ccccc2)C1 131190974 JMZDDZRYNPDAIB-FQEVSTJZSA-N 384.524 2.604 0 50 GFAA O=C(NCC[C@@H]1C(=O)Nc2ccccc21)Nc1cccc(OCC(F)F)n1 133965859 KVSMLLJOPFAACY-LBPRGKRZSA-N 376.363 2.973 0 50 GFAA O=C1CCCN1Cc1ccccc1CNC(=O)N1CCC(c2ccn[nH]2)CC1 156202901 CDEBYHHVFSKLEW-UHFFFAOYSA-N 381.480 2.621 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cc4ccccc4[nH]c3=O)CC2)oc1C 171889180 LLFGFOHLGZIXAA-UHFFFAOYSA-N 394.475 2.775 0 50 GFAA COc1cccc(-c2cc(C(=O)NC3CCN(Cc4cccnc4)CC3)[nH]n2)c1 177907905 SKCNPQNRGMJQJM-UHFFFAOYSA-N 391.475 2.875 0 50 GFAA O=C(NCCOc1ccccc1-c1ccccc1)N1CCO[C@]2(CCOC2)C1 187232734 ZYWGHQKNMXOVCZ-JOCHJYFZSA-N 382.460 2.933 0 50 GFAA O=C(NCc1cccc(Cl)c1)[C@@H]1[C@@H]2C(=O)N(Cc3ccco3)C[C@@]23C=C[C@H]1O3 226933104 SWPILLKACOCUKW-IIMDRIAPSA-N 398.846 2.531 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3cnn(C(F)F)c3C)C[C@H]2C)cc1 229907426 BEZLPKDWRVDPQD-CYBMUJFWSA-N 384.452 2.794 0 50 GFAA Cc1c(C(=O)N[C@H](CN)C2CCCCC2)nnn1-c1ccc2ncccc2c1 237843117 JSCRADBDPBUPEE-LJQANCHMSA-N 378.480 2.761 0 50 GFAA O=C(c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)c1)N1CCCCC1 239322005 JAYJDNGAUOGCSR-GFLQDLJJSA-N 376.456 2.870 0 50 GFAA OCCOc1cccc(CN2CCN(CCCc3ccccc3)[C@H](CCO)C2)c1 257372258 DGDVNHVNRKINMU-HSZRJFAPSA-N 398.547 2.559 0 50 GFAA CCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(OCC(=O)O)c(Cl)c1 262157784 MPEUWDADDWLWIQ-AWEZNQCLSA-N 382.844 2.923 0 50 GFAA CC(C)Oc1ccc(S(=O)(=O)N2CC[C@@](C(=O)O)(C(F)(F)F)C2)cc1 275258691 IMLDVKXCJCHCKU-CQSZACIVSA-N 381.372 2.502 0 50 GFAA C[C@H](c1ccc(F)cc1)N1CC[C@H](N2CCn3c(nnc3C(F)(F)F)C2)C1=O 293048324 KIPSDLLURLFZOI-RISCZKNCSA-N 397.376 2.614 0 50 GFAA CC(C)(C)[C@@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C[C@@H]1O 298844698 IFDHTCWZFQDKJK-SJORKVTESA-N 381.480 2.750 0 50 GFAA COc1ccccc1[C@@H]1CCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)C1 363418236 FITLSTYEKRRPKA-MOPGFXCFSA-N 393.487 2.959 0 50 GFAA O=C(c1csc(-c2cccs2)n1)N1CCCN(C(=O)[C@@H]2CCCO2)CC1 368908940 FUVMRXHTFCEUDV-AWEZNQCLSA-N 391.518 2.725 0 50 GFAA Cc1nnc([C@H]2CN(C(=O)c3nc(C)n(-c4ccccc4C(C)C)n3)CCO2)o1 372380510 NOBFHABNSSGPKS-QGZVFWFLSA-N 396.451 2.604 0 50 GFAA Cc1cc(=O)n(CC(=O)N(C)C[C@H]2Cc3ccccc3CN2C)c2ccccc12 426490036 HUTUKMLULVCAIC-HXUWFJFHSA-N 389.499 2.825 0 50 GFAA Cc1ccc2nc(CCNC(=O)N3CCC(N4CCSCC4)CC3)[nH]c2c1 534590751 BEFSMWUSCGOBLE-UHFFFAOYSA-N 387.553 2.637 0 50 GFAA CCNc1ccc(-c2ccc(C(=O)NCc3cnc(SC)n3C)cc2)nn1 534651787 JWJCEPURURLRMH-UHFFFAOYSA-N 382.493 2.961 0 50 GFAA O=C(NC[C@@H]1CN(c2ccnc3ccncc23)CCCO1)c1ccc(F)cc1 888103523 KXFIOJOOVFMOQU-QGZVFWFLSA-N 380.423 2.794 0 50 GFAA O=C(COCc1nc2ccc(F)cc2[nH]1)N1CCC[C@@H](OCc2ccccn2)C1 1506424197 HMTKODSHXFXNBX-QGZVFWFLSA-N 398.438 2.821 0 50 GFAA CN(Cc1cc(=O)n2cc(Cl)ccc2n1)C[C@H]1Cc2ccccc2CN1C 1529103933 IJERCIAPWTYKKD-LJQANCHMSA-N 382.895 2.836 0 50 GFAA O=C(CCC(=O)N1CCCN(C(=O)C2CCC2)CC1)Nc1ccc2c(c1)CCC2 1772705091 KOSSZXHQIQIGJS-UHFFFAOYSA-N 397.519 2.755 0 50 GFAA CN1CCC(N2C[C@@H]3CN(Cc4cc[nH]n4)C[C@@]3(CCc3ccccc3)C2)CC1 1772817611 GLHMFZCYLCIZCH-URXFXBBRSA-N 393.579 2.871 0 50 GFAA CC(=O)NCC(=O)N1C[C@@H]2CN(C3CCCCC3)C[C@@]2(CCc2ccccc2)C1 1772819889 WQVSWQVUCJJHDD-URXFXBBRSA-N 397.563 2.848 0 50 GFAA COc1cc(CN2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cc2c1OCO2 1857673006 LOHYLVUXWAUXSL-JOCHJYFZSA-N 396.443 2.673 0 50 GFAA C/C=C/CCCC(=O)N1CCC2(CC1)CN(Cc1ccccn1)C[C@@H]2C(=O)O 1857681501 LNLKGOZPAAKCDW-LSTKMXGYSA-N 385.508 2.953 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)[C@H]1Cc3ccccc3CN1)CC2 1857696113 NEEFQAKJXCWRAR-OAQYLSRUSA-N 386.499 2.729 0 50 GFAA Cc1c(F)cccc1C(=O)NC[C@H]1[C@H]2CN(Cc3cccnc3)C[C@]23CC[C@H]1O3 1857724127 MZPQHYVIRGIOLY-KLJZETAQSA-N 395.478 2.939 0 50 GFAA Cc1nc(N2C[C@@H]3[C@H](CNC(=O)c4cccnc4)[C@H]4CC[C@]3(C2)O4)sc1C 1857733879 CVISKNQOJSENMI-TVKQPGBESA-N 384.505 2.569 0 50 GFAA O=C1CC[C@@H](NC(=O)c2ccc3nc(-c4ccc(Cl)cc4)oc3c2)C(=O)N1 1857797871 BUYACJZIOFXWCF-CQSZACIVSA-N 383.791 2.683 0 50 GFAA Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N1C[C@@H]3CCC[C@@H]3[C@@H]1C(=O)O)CC2 1875291659 HRNTXIANIKQRTE-JUFZMCDQSA-N 397.397 2.620 0 50 GFAA C[C@H](OC(=O)[C@@H]1NC(=O)[C@H]2CC[C@H]21)c1nc(-c2cccc(C(F)(F)F)c2)no1 1875295303 FLMNIQLHGICQJK-OQCKYNKVSA-N 395.337 2.884 0 50 GFAA C[C@H]1CCC[C@H](C)N(C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)C1 1875350722 YIVPWAHLMJNPKY-STQMWFEESA-N 381.436 2.739 0 50 GFAA Cc1cc([C@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(C)o1 1875398058 ZEUAMQSSPGVXTP-DOTOQJQBSA-N 385.512 2.935 0 50 GFAA Cc1cncc(CC(=O)N[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)c1 1875402759 KENHPSMZKGPIBL-HMXCVIKNSA-N 390.487 2.752 0 50 GFAA O=C(O)c1csc(/C=c2\s/c(=C\C(=O)c3ccc(Cl)cc3)nc2O)c1 2325749748 AGQRPIIJIBDXHP-LRSUZXNRSA-N 391.857 2.754 0 50 GFAA O=C(NCCC1CCS(=O)(=O)CC1)NC[C@H]1CCCc2ccccc2C1 2325784427 DITOFFHGOPVORW-KRWDZBQOSA-N 378.538 2.696 0 50 GFAA N[C@H]1CC[C@H](c2nc(-c3cccnc3O)nn2-c2ccc3c(c2)OCO3)CC1 2356156160 UICFZDNVIQJXPZ-JOCQHMNTSA-N 379.420 2.749 0 50 GFAA Cc1ccc(Cl)cc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O 2072335 WTSZQEFOGDRHAI-UHFFFAOYSA-N 380.897 2.773 0 50 GFAA CCN(CC)C(=O)CSc1nc(N)c(C(=O)Nc2ccc(OC)cc2)s1 2308468 WQHKLGZOPQGCCG-UHFFFAOYSA-N 394.522 2.947 0 50 GFAA COC(=O)c1sc(NC(=S)NCc2cccnc2)c(C(=O)OC)c1C 2857961 MDDCYVAWJWFJAP-UHFFFAOYSA-N 379.463 2.511 0 50 GFAA CCOc1cccc(N2C(=O)C[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2=O)c1 4718549 IGWSTOBADNAJJM-HXUWFJFHSA-N 397.450 2.679 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccc(C)c2)cc1Cl 4867682 KBNLSECTXNYFMR-UHFFFAOYSA-N 382.869 2.916 0 50 GFAA CCc1oc(C(=O)NCc2nc3ccccc3c(=O)[nH]2)cc1CN(CC)CC 55270219 CEVLZUDPRXZIJO-UHFFFAOYSA-N 382.464 2.850 0 50 GFAA CS(=O)(=O)c1ccc(N2CCC[C@@H]2Cc2ccccc2)c(S(C)(=O)=O)c1 117463467 NGSFPCMYAGETPE-MRXNPFEDSA-N 393.530 2.705 0 50 GFAA C[C@@H]1CN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2OC(F)F)[C@H](C)CO1 249315774 NVNIICVYLSKPBP-UMVBOHGHSA-N 382.407 2.528 0 50 GFAA CN(CC(=O)Nc1nnc([C@@H]2CCCO2)s1)Cc1c[nH]nc1-c1ccccc1 1506420632 JBMMFYVTYIKQIA-HNNXBMFYSA-N 398.492 2.850 0 50 GFAA Cc1cc(CNC(=O)Cc2cccc(OCc3cccnc3)c2)nc(N(C)C)n1 252484441 FWFNIDXTDLGMRB-UHFFFAOYSA-N 391.475 2.684 0 50 GFAA O=C1CCCCN1CCC(=O)N1CC[C@@H](c2ccnc(-c3ccncc3)c2)C1 67713766 QMWQVBOSPSULBH-LJQANCHMSA-N 378.476 2.862 0 50 GFAA Cc1ccc(-c2nnc(SCC(=O)NC[C@@H](O)Cc3ccccc3)[nH]2)cc1 152056957 FVGRBYRGJVWTPS-KRWDZBQOSA-N 382.489 2.592 0 50 GFAA Cc1nn(C)cc1-c1cc(C(F)(F)F)n2nc(C(=O)N3CCCC3)cc2n1 2782522 HOTWTRUHCSWTSA-UHFFFAOYSA-N 378.358 2.693 0 50 GFAA C[C@@H]1CCCN(c2ccccc2OS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)C1 153471686 CFRCXETZPYERCI-HZPDHXFCSA-N 391.493 2.849 0 50 GFAA COc1ccsc1C(=O)N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1 363388493 VSSHQAIRAZHNBO-UHFFFAOYSA-N 388.445 2.976 0 50 GFAA Cc1nc(-c2cccc(NC(=O)c3cc(C(N)=O)n(-c4ccccc4)n3)c2)no1 363407387 XFVDVEVYFDCTEA-UHFFFAOYSA-N 388.387 2.582 0 50 GFAA Cc1cc2c(cc1C)O[C@@H](C(=O)N1CCC(C(=O)NCc3cccnc3)CC1)C2 173462524 HBQFGDRXVFXIMB-OAQYLSRUSA-N 393.487 2.557 0 50 GFAA CS(=O)(=O)N1CC[C@@H](CN[C@H]2CCCOc3cc4c(cc32)CCCC4)C1 373138934 JOTBUBRZXVMTIT-KXBFYZLASA-N 378.538 2.650 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](c3ccncn3)C2)nnn1-c1cccc2ncccc12 377223298 JLHSGTMKFMDQGV-MRXNPFEDSA-N 399.458 2.934 0 50 GFAA Cn1nc2c(cc1=O)CN(C(=O)N[C@H](c1ccc(F)cc1)C1CCCC1)CC2 174081807 XXTVTZWMVQEVEW-FQEVSTJZSA-N 384.455 2.919 0 50 GFAA CSc1cccc(NC(=O)NCCNc2cc(-n3ccnc3C)ncn2)c1 72434141 QJLOMHLEMVHERA-UHFFFAOYSA-N 383.481 2.926 0 50 GFAA COc1ccc(CN2CCC([C@H](C)N3CCCC3)CC2)cc1OCC(=O)O 72447166 SUZIISGYFQFACP-INIZCTEOSA-N 376.497 2.855 0 50 GFAA CCOc1cc2c(cc1OCC)CN(C(=O)c1cnc(C3CC3)nc1N)CC2 287215123 RGGOKLNIOOCBFY-UHFFFAOYSA-N 382.464 2.932 0 50 GFAA O=C1N[C@H](CC(=O)N2CCc3[nH]nc(-c4ccc(F)cc4)c3C2)c2ccccc21 48212339 NVDHEUYILACENX-LJQANCHMSA-N 390.418 2.975 0 50 GFAA CCc1ocnc1C(=O)N1CCC[C@]2(CCC(=O)N(Cc3cccnc3)C2)C1 82098878 LJFFOVVFMIMMIA-NRFANRHFSA-N 382.464 2.677 0 50 GFAA CCc1nc2c(c3c1CCCC3)C(=N)/C(=C(\O)N[C@H]1CCS(=O)(=O)C1)S2 334158928 BKOZBLITUOKODU-YRJAVLFESA-N 393.534 2.500 0 50 GFAA CCCN1CCCn2nc(CNC(=O)c3c(F)ccc(OC)c3F)cc2C1 82106256 AJJQPBCELBPXKJ-UHFFFAOYSA-N 378.423 2.716 0 50 GFAA C[C@H](C(=O)Oc1cccc2cccnc12)N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O 239046689 FXERADPWPCNZNP-HNWGTBJJSA-N 388.423 2.582 0 50 GFAA O=C(CCc1ccc(-c2ccc(Cl)cc2)[nH]1)NC1CCS(=O)(=O)CC1 426387704 NRZHZJQIIGXZOD-UHFFFAOYSA-N 380.897 2.961 0 50 GFAA Cc1cccc(CCNC(=O)N2CCC(C(=O)NCc3ccccn3)CC2)c1 426552339 MPLXZSGGMHVOJQ-UHFFFAOYSA-N 380.492 2.671 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)[nH]n1 91270471 OYGORSLCMUYSTH-WEVVVXLNSA-N 375.476 2.886 0 50 GFAA Cc1oc2c(c1C(=O)NCc1cc3n(n1)CCN(CC(C)C)C3)C(=O)CCC2 91737011 LFKFZGREXDALQS-UHFFFAOYSA-N 384.480 2.705 0 50 GFAA CSCCc1nc(-c2n[nH]cc2Cl)n(-c2ccc3c(c2)OCCO3)n1 96179527 UFXSRPQPDGYIRN-UHFFFAOYSA-N 377.857 2.988 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@@H](C(=O)Nc2cccc(-n3cccn3)c2)C1 95509554 FVVFUQVCLDGGAV-MRXNPFEDSA-N 377.448 2.702 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cnc(-c3ccco3)nc2)C1)c1cccnc1 95501867 IPGCNWHWOMYAIQ-INIZCTEOSA-N 377.448 2.774 0 50 GFAA C[C@@H](N)[C@@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 269297212 WIPWSYJONCRBLI-VQIMIIECSA-N 386.517 2.860 0 50 GFAA Cc1nc(NC(=O)CC[C@H]2N=C(O)N(CCc3ccccc3)C2=O)sc1C 252571827 YOHQYQPTCJTHCA-OAHLLOKOSA-N 386.477 2.846 0 50 GFAA CN1CCc2nc(O)c(CNC(=O)N3CC4(CCC4)[C@@H]3c3ccncc3)cc2C1 1875295451 YMNGYZYRQPMTEI-IBGZPJMESA-N 393.491 2.607 0 50 GFAA C[C@H](C(=O)Nc1ccccc1)N1CCC(CNC(=O)COc2ccccc2)CC1 952982983 NIMKISCSVYRJKG-GOSISDBHSA-N 395.503 2.921 0 50 GFAA Cn1ncc(C(=O)N[C@H]2CC(C)(C)CCc3ccccc32)c1S(C)(=O)=O 885679325 MXQJBCCVBKJUFE-INIZCTEOSA-N 375.494 2.657 0 50 GFAA CCOC(=O)[C@]12CC[C@H](N3CCOCC3)C[C@@H]1CCN(c1ccnc(C)c1)C2 1565513993 HCEUSWDCOGOSHR-IPJJNNNSSA-N 387.524 2.651 0 50 GFAA Cc1ccsc1CCNC(=O)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 1565527504 XCVMKXSJARZJAL-CVEARBPZSA-N 388.489 2.888 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)N1CCN(Cc2cccnc2)CC1 189082294 JTFODRHTWGZELW-UHFFFAOYSA-N 397.429 2.812 0 50 GFAA Cc1noc(CCCC(=O)N2CC[C@@H]3CCN(C(=O)OC(C)(C)C)[C@H]3C2)n1 225445857 NZXVXANQTJDFDQ-CABCVRRESA-N 378.473 2.559 0 50 GFAA CCCCOC[C@@H](O)CN(C)C[C@H](O)COc1ccccc1C(F)(F)F 225718419 RDTMYQSWXRHQEB-GJZGRUSLSA-N 379.419 2.555 0 50 GFAA CCN1CCC[C@@H](NC(=O)c2c(N(C)C)noc2-c2ccc(F)c(OC)c2)C1 1704313618 JVOMWIQRKAJWOV-CQSZACIVSA-N 390.459 2.769 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)Cc3c(C)[nH]c4c(C)ccc(C)c34)C[C@@H]2O)n[nH]1 1704279436 FSCPMDQTCPKQGD-APWZRJJASA-N 380.492 2.729 0 50 GFAA CCCC[C@H]1CN(C(=O)Cc2nn(C)c(=O)c3ccccc23)C[C@@H](C2CC2)O1 1615734648 HZGMZFXGUIEEQQ-JXFKEZNVSA-N 383.492 2.672 0 50 GFAA O=C(c1ccsc1)N1CCCN(c2ncccc2C(=O)N2CCCC2)CC1 1772805648 NUZJCADEDRKEEM-UHFFFAOYSA-N 384.505 2.732 0 50 GFAA COCCNC(=O)[C@@H](NC(=O)c1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2 5043527 NXERNWOMUZMEJX-FRXJQHJJSA-N 388.483 2.903 0 50 GFAA O=C(CCn1cncn1)N1CCc2[nH]nc(-c3ccc(C(F)(F)F)cc3)c2C1 11817278 NASJZPLWMIAFBN-UHFFFAOYSA-N 390.369 2.662 0 50 GFAA CSCC[C@@H](CO)NC(=O)c1cc(COc2cccc3cnccc23)on1 12715399 HRDGVSPWUBPZID-AWEZNQCLSA-N 387.461 2.646 0 50 GFAA CCN1CCN(C(=O)CCC2CCN(Cc3ccc(F)c(OC)c3)CC2)CC1 14956580 CNZMGQSEGQHDID-UHFFFAOYSA-N 391.531 2.991 0 50 GFAA CCOC(=O)N1CCC(N2C(=O)CC[C@@H]2CCNCc2ccc(F)cc2)CC1 14986524 SMZNZZUZBFLYMW-GOSISDBHSA-N 391.487 2.917 0 50 GFAA Cc1cccc(CCNCc2ccc(OC[C@H](O)CN3CCCCC3)cc2)n1 15063411 ZGCXSCPNPNMXED-JOCHJYFZSA-N 383.536 2.948 0 50 GFAA Cn1c(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)nc2ccccc21 19792550 NETGRIBIMBJIIZ-IBGZPJMESA-N 382.483 2.781 0 50 GFAA CN=[S@]1(=O)CCC[C@]2(CCCN2C(=O)c2cc(OC)c(C)c(OC)c2)C1 1857527973 NTBOQPCTXDZHAK-BCHFMIIMSA-N 380.510 2.879 0 50 GFAA O=c1cc(CN2CCc3[nH]nc(-c4ccccc4)c3CC2)nc2sccn12 1857672355 SVEBUUABLQNEDA-UHFFFAOYSA-N 377.473 2.747 0 50 GFAA Cc1cc(C)c2nc(O)c(-c3nccn3CCN3CCC[C@H](C(N)=O)C3)cc2c1 1857682323 VLLHEZOFQDOHBL-INIZCTEOSA-N 393.491 2.618 0 50 GFAA Cc1ocnc1C(=O)N[C@@H]1[C@H]2CC[C@@H]1CN(C(=O)CCCOc1ccccc1)C2 1857683522 IEYZCZYNRWIDCP-LFUKPOHLSA-N 397.475 2.809 0 50 GFAA CC(C)Cc1noc(CNC(=O)C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857701618 RNQPCVGUSRQRHY-AWEZNQCLSA-N 398.467 2.727 0 50 GFAA COC(=O)c1ccc(C(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)cc1 1857735392 BSWHFKOULFCIKX-PMACEKPBSA-N 382.460 2.617 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(Cc4cccnc4)C[C@]34CC[C@H]2O4)s1 1857736086 KAVUPEGVVUZEPZ-XKGFGPFHSA-N 383.517 2.861 0 50 GFAA CN1CC[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)[C@H]1c1ccccc1 248038270 LNTGZZQIHWMBNG-PCCBWWKXSA-N 377.488 2.853 0 50 GFAA CS(=O)(=O)CCCN[C@@H](Cc1ccc(F)cc1)[C@H]1COc2ccccc2O1 368351496 HMOBHFVGWZMVSC-FXAWDEMLSA-N 393.480 2.601 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CCO[C@@H](C2CCN(C(=O)C[C@@H]3CCCO3)CC2)C1 839830155 IWZJIQSYXBDOAU-FGTMMUONSA-N 396.528 2.866 0 50 GFAA COC[C@@]12COC[C@@H]1CN(C(=O)c1ccccc1OC(F)(F)C(F)F)C2 2100555034 KLZDWIOHCSLYKQ-ZBEGNZNMSA-N 377.334 2.658 0 50 GFAA CCc1ccc(N2C(=O)NC(=O)[C@H](Cc3ccc(OC)cc3OC)C2=O)cc1 1088837 NFQNHGBLQCRMRK-KRWDZBQOSA-N 382.416 2.708 0 50 GFAA COC1(CN(C)C)CCN(C(=O)Cc2c(C)nn(-c3ccccc3)c2C)CC1 2356133909 LQVCSJAOQSFKIU-UHFFFAOYSA-N 384.524 2.601 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)COCc3nc4ccccc4[nH]3)C1)CC2 2356153488 JDRUUVAIEVDROP-JOCHJYFZSA-N 391.475 2.685 0 50 GFAA c1cc(-n2nc(C3CCOCC3)nc2[C@H]2CCCN(C3CCOCC3)C2)ccn1 2356154498 XXPRADYJAKZOCB-SFHVURJKSA-N 397.523 2.915 0 50 GFAA COC(=O)c1ccc(NC(=O)CSC2=N[C@@H](c3ccccc3)CC(=O)N2)cc1 2869441 WSAXXZXIDFAORK-MRXNPFEDSA-N 397.456 2.762 0 50 GFAA CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2cccc(Br)c2)NC(=O)N1 4201975 AWIYWWFBNRXJEF-ZFWWWQNUSA-N 395.253 2.799 0 50 GFAA CC(=O)Nc1cccc(NC(=O)c2cc3c(=O)n4cccc(C)c4nc3n2C)c1 6586676 AOKMBJSVZQRWBA-UHFFFAOYSA-N 389.415 2.705 0 50 GFAA CN(c1ccc(C(=O)N[C@H]2CCCC[C@H]2O)cc1)S(=O)(=O)c1ccccc1 104836176 BSXBHHRLIYNZHV-RBUKOAKNSA-N 388.489 2.545 0 50 GFAA NC(=O)c1cccc(Oc2ccc(NC(=O)[C@H]3CCCc4[nH]ncc43)cn2)c1 135247773 QZVXJPKYAZFWMQ-HNNXBMFYSA-N 377.404 2.755 0 50 GFAA Nc1nc(CN2CCN(c3ccccc3F)CC2)nc(Nc2ccc(F)cc2)n1 54147063 KARSUWOOZAFXFW-UHFFFAOYSA-N 397.433 2.798 0 50 GFAA COc1ccc(CN2CCN(Cc3cccc4nonc34)C[C@H]2CCO)cc1C 104462783 NJZVXFRVJAIBON-LJQANCHMSA-N 396.491 2.609 0 50 GFAA O=C(c1ccco1)N1CCN(c2nc(N3CCCC3)c3ccccc3n2)CC1 27105447 OPUINEZXNVLKPH-UHFFFAOYSA-N 377.448 2.785 0 50 GFAA COc1ncc(C(=O)N[C@H](CO)Cc2ccc(C)c(C)c2)cc1Br 424886393 DRZXOZKSUKVQFO-HNNXBMFYSA-N 393.281 2.803 0 50 GFAA CC1=C(C(=O)N(C)Cc2cnc3ccccn23)[C@@H](c2cccs2)NC(=O)N1 65505688 AYWPAVKPTBUBHO-QGZVFWFLSA-N 381.461 2.682 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(Cc2cccc3c2OCO3)CC1 328655643 YPFWJYQDUFXQQY-LJQANCHMSA-N 382.464 2.609 0 50 GFAA COc1ccc(C2(C(=O)N3CCC4(CC3)CN(C)CCN4C)CCCC2)cc1 67650474 DKWWZFLXSXUAPR-UHFFFAOYSA-N 385.552 2.745 0 50 GFAA COC(=O)c1scc(I)c1I 4088416 ANNFGBRGQCTWLH-UHFFFAOYSA-N 393.971 2.744 0 50 GFAA Cn1ncc(NC(=O)N2CCC([C@H]3OCCC[C@@H]3N)CC2)c1-c1ccccc1 333270258 FZYXULWEQFNJBP-FXAWDEMLSA-N 383.496 2.837 0 50 GFAA CN1CC2(CCN(Cc3ccc(OCCCn4ccnc4)cc3)CC2)CC1=O 72477895 LWJVMNMUCOJRJB-UHFFFAOYSA-N 382.508 2.797 0 50 GFAA COc1ccc(CCNc2nc(-c3ccncc3)nc3c2cnn3C)cc1O 72144372 FLBRZVSEEQNYLK-UHFFFAOYSA-N 376.420 2.794 0 50 GFAA O=C(N[C@H]1C[C@H]1C1CCCCC1)N1CCC(S(=O)(=O)N2CCCC2)CC1 369108007 YPGPDAYTFYOIGU-ROUUACIJSA-N 383.558 2.555 0 50 GFAA O=S(=O)(c1ccc(-c2ccn[nH]2)o1)N1CCCC[C@@H]1CCN1CCCC1 77504758 JLAVNUXXAGSLLA-OAHLLOKOSA-N 378.498 2.699 0 50 GFAA CO[C@H]1C[C@H](c2nc(C3CC3)no2)N(C(=O)c2cc(F)c(F)c(O)c2F)C1 372397035 RDAWMUYYWCNIET-GZMMTYOYSA-N 383.326 2.672 0 50 GFAA COc1ccc(C(C)(C)CNC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)cc1 174434662 UUIYORPTHGXNGM-QGZVFWFLSA-N 385.512 2.675 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)O)NC(=O)c1nc(N2CCCC2)ncc1Cl 237620426 YDWKPRCRIFPMBU-OAHLLOKOSA-N 388.855 2.984 0 50 GFAA CC(C)(C)OC(=O)NCc1ccc(C(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)o1 245878986 KCUDGYPPUJGTNY-NUEKZKHPSA-N 376.453 2.992 0 50 GFAA Cc1ccccc1C(=O)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71750673 VVQBRGXFDOIRTH-LJQANCHMSA-N 383.536 2.934 0 50 GFAA CC[C@@H]1Oc2cc([C@@H](C)NC(=O)N3CCOCC(F)(F)C3)ccc2NC1=O 378109856 FQIUJWHVUXBCBU-RISCZKNCSA-N 383.395 2.534 0 50 GFAA CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)[C@H]2C[C@@H]2c2cccnc2)c1 133959912 MRRBWDZMAUFKGK-KGLIPLIRSA-N 378.837 2.546 0 50 GFAA COc1ccc(N2CCN(C(=O)c3cccn3Cc3cccs3)CC2)nc1 456977952 GKTNBINHBGVIKV-UHFFFAOYSA-N 382.489 2.964 0 50 GFAA CCn1c(C)ccc(-c2noc(CCC(=O)N(C)Cc3ccccc3)n2)c1=O 46020399 LCIWRVOUXKZCOB-UHFFFAOYSA-N 380.448 2.818 0 50 GFAA CCOc1cccc(CN2CCC(NS(=O)(=O)CC)CC2)c1OC(F)F 289492944 RYMVMISWBWRFAD-UHFFFAOYSA-N 392.468 2.590 0 50 GFAA COCCCn1c(=S)[nH]c(=O)c2c(C(F)(F)F)cc(-c3cnn(C)c3)nc21 20605216 RJGHSGMXIYGPDR-UHFFFAOYSA-N 399.398 2.910 0 50 GFAA COc1ccc(C2(C(=O)N3CCN(c4ccc(C(=O)O)cc4)CC3)CC2)cc1 223665510 RRCXMOLMJUDKEM-UHFFFAOYSA-N 380.444 2.774 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(C(=O)NCCn2ccc3ccccc32)C1 426370532 QZVQTZAYYGZEAO-QGZVFWFLSA-N 379.464 2.679 0 50 GFAA CNC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc2cnn(C(C)C)c2nc1C 291441519 BHVINWLIXZIFAH-GOSISDBHSA-N 377.448 2.638 0 50 GFAA Cc1c(C(=O)N[C@H]2CCOC3(CCCC3)C2)cnn1CCO[C@H]1CCCCO1 179327174 MPTTZTSYNGCCBM-HKUYNNGSSA-N 391.512 2.956 0 50 GFAA O=C(Nc1nnc2n1CCCC2)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 162561788 YECCSSPZNIVVKM-LBPRGKRZSA-N 394.401 2.883 0 50 GFAA Cc1ccc(C)c(CC(=O)N2CCC3(CCC(=O)N(CCN(C)C)C3)CC2)c1 91468501 CPEHQVGSWSEGHN-UHFFFAOYSA-N 385.552 2.639 0 50 GFAA CCc1nnsc1C(=O)N1CC[C@]2(CCCN(C3CCCCC3)C2=O)C1 91416905 FVKYDIKPBQHYQB-LJQANCHMSA-N 376.526 2.888 0 50 GFAA CN(C)c1ccc(C(=O)N2CC[C@]3(CCCN(C4CCCCC4)C3=O)C2)cn1 91893980 RRLCLLFMFIRSIW-JOCHJYFZSA-N 384.524 2.935 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@H]2CN(C2=NC=N[C@@H]3c4cc(Cl)ccc4N[C@@H]23)C1 148638638 TYFADLFYBVKNDX-ISZNXKAUSA-N 393.878 2.897 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1cc[nH]c1 95524349 WLWSSORVXUKZMD-GOSISDBHSA-N 381.520 2.983 0 50 GFAA CNC(=O)CNC(=O)c1cc(Cl)ccc1OC1CCN(C2CCCC2)CC1 95501176 PQRPMQIEEDOEPO-UHFFFAOYSA-N 393.915 2.602 0 50 GFAA Clc1cc(CCN2CCN(Cc3ccon3)CC2)cc2c1OCCCO2 182799599 OLVOGOVKDOUUTF-UHFFFAOYSA-N 377.872 2.850 0 50 GFAA COc1ccccc1CN(CC(=O)N1CCN(C)CC1)Cc1ccccc1C 244741875 NYGRTRVREIQCPJ-UHFFFAOYSA-N 381.520 2.780 0 50 GFAA Cc1ccc2nc(CCNC(=O)N3CCN(c4ccccn4)CC3)[nH]c2c1C 534674595 JHQPCLDQRCQSNG-UHFFFAOYSA-N 378.480 2.649 0 50 GFAA CCn1nc(-c2cccc(C(=O)N[C@H](C)c3c(C)n[nH]c3C)c2)nc1N(C)C 534645464 WQOVIBJGAQPPFC-GFCCVEGCSA-N 381.484 2.862 0 50 GFAA COC(=O)c1c(NC(=O)c2ccccc2)c2cc(N)cnc2n1C[C@@H]1CCCO1 299763131 ZNSAFWUOMGTKLR-HNNXBMFYSA-N 394.431 2.836 0 50 GFAA O=C(NCc1nncn1C1CCCCC1)c1cccc(NC(=O)[C@H]2CCCO2)c1 827753144 XBCCTLNYIBRDAM-GOSISDBHSA-N 397.479 2.831 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cccc(-c4ncnn4C(C)C)c3)CC2)n[nH]1 584889199 MFTCEAQQPSCEGN-UHFFFAOYSA-N 379.468 2.972 0 50 GFAA O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@H](c2noc(C3CC3)n2)C1 270089796 TVAZNFWBZMCSRI-HOTGVXAUSA-N 382.468 2.510 0 50 GFAA O=C(NCCN(C(=O)c1cccc2nccn12)C1CC1)[C@H]1CCCC(F)(F)C1 1875331666 RYWAJXHONORBNB-AWEZNQCLSA-N 390.434 2.881 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N[C@@H]2Cc3n[nH]cc3[C@@H](C(F)(F)F)C2)c1 1875367540 MMDUWGSGEUMHOA-JSGCOSHPSA-N 378.354 2.925 0 50 GFAA Cn1cncc1CC(=O)N1Cc2cnn(-c3ccccc3F)c2CC(C)(C)C1 952891774 HXPHWQXBCZZACH-UHFFFAOYSA-N 381.455 2.899 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Cc2c(C)nc(O)nc2O)N2CCC(C)CC2)cc1 952967522 LWDGUAFSVRUXPW-LJQANCHMSA-N 398.507 2.637 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3cc(C)nc(-c4ccccc4O)n3)CC2)cn1 952975421 ISIOKPSNGUQGCY-UHFFFAOYSA-N 389.459 2.823 0 50 GFAA Cc1ccc(C(=O)NCC(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)s1 1323967749 HDLSJBJHBAFECR-JOCHJYFZSA-N 397.544 2.911 0 50 GFAA CC(C)c1c(NC(=O)CN2CCCS2(=O)=O)cnn1-c1ccc(Cl)cc1 192161298 BCPOHBVDRLPVDU-UHFFFAOYSA-N 396.900 2.623 0 50 GFAA CCOC(=O)N1CC[C@H](N2CCCN(C(=O)c3ccc(Cl)cc3F)CC2)C1 1772805374 MLOXZXARZAJYAU-HNNXBMFYSA-N 397.878 2.858 0 50 GFAA CC(C)c1ccc(OCC(=O)N(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)cc1 5215651 SPYYEQQRXBSNBL-QGZVFWFLSA-N 391.489 2.998 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CN1CCOC1=O 12385411 TYDSSTBTRXTWCO-QGZVFWFLSA-N 393.915 2.505 0 50 GFAA COCCN1CCC(CN(C[C@H]2CCCO2)C(=O)Cc2cccs2)CC1 12585131 RSPJQIWVFMFXKT-GOSISDBHSA-N 380.554 2.657 0 50 GFAA COCCN1C(=O)N(C(C)C)C(=O)C12CCN(Cc1cc3ccccc3[nH]1)CC2 14753039 PGPZWYBXIQMIBC-UHFFFAOYSA-N 398.507 2.822 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccccc1F)NC1CCCCCCC1 15068827 WWAGFZLSWZIIRC-IBGZPJMESA-N 375.488 2.745 0 50 GFAA O=C(CCc1ccccc1)NCc1nnc2c(-c3nc(C4CC4)no3)cccn12 169776065 KQZUQCWCTOVSEY-UHFFFAOYSA-N 388.431 2.906 0 50 GFAA COc1c(C(=O)O)cc(-c2cc(C(=O)N3CCCC3)ccn2)c(OC)c1OC 1875246789 MUMUZHZINYKUKL-UHFFFAOYSA-N 386.404 2.709 0 50 GFAA O=C1CCCCN1CCC(=O)N1CC[C@H](c2ccc3ccccc3c2)[C@@H](O)C1 210399794 AHONZVBTIAYPOO-RTWAWAEBSA-N 380.488 2.919 0 50 GFAA Cc1cc(C(=O)N2CCc3c(Cl)cccc3C2)cc(S(N)(=O)=O)c1C 156781496 UWVSBOUKPJBNJU-UHFFFAOYSA-N 378.881 2.803 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@H]3CCN(C)C[C@@H]3c3cnn(C)c3)cc2)c1C 849596505 ORDZZMWGMQCYTP-LEWJYISDSA-N 392.507 2.897 0 50 GFAA COc1ccc(OCCCn2cc(Br)n3cncc3c2=O)cc1 2325801543 MSVSIGNOCLVDQO-UHFFFAOYSA-N 378.226 2.736 0 50 GFAA CS(C)(=O)=Nc1cnc(N2CCN(c3nsc4ccccc34)CC2)nc1 2325802384 DQJOWUXKBPFTFN-UHFFFAOYSA-N 388.522 2.772 0 50 GFAA Cn1cc(-c2nc(C(=O)N[C@@H]3CN(Cc4ccccc4)C(C)(C)C3)co2)cn1 2325857791 PCAOHYBKJPZWJL-KRWDZBQOSA-N 379.464 2.858 0 50 GFAA CCCN(CCC)C(=O)Cn1cnc2sc(C(=O)OCC)c(C)c2c1=O 936990 OBPDIPISCRABQU-UHFFFAOYSA-N 379.482 2.592 0 50 GFAA COc1ccc(N2C(=O)C[C@@H](SCC(=O)Nc3ccccc3F)C2=O)cc1 1051831 IUKJRHZKYZEIGG-MRXNPFEDSA-N 388.420 2.838 0 50 GFAA CC(=O)Oc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 1137862 ITZYIYNVRCNHMH-UHFFFAOYSA-N 390.461 2.941 0 50 GFAA COc1ccnc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)c1 2356139689 HOIHTIHIOJLOAI-HSZRJFAPSA-N 393.487 2.930 0 50 GFAA O=C(NC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1ccc2nn[nH]c2n1 416218233 DYQGISHSSHCMBL-UHFFFAOYSA-N 391.353 2.807 0 50 GFAA COc1ccc(CN2CCN(Cc3cnc(C)s3)C[C@@H]2CCO)cc1C 20541370 BNTWVIJGTVSQLZ-SFHVURJKSA-N 375.538 2.837 0 50 GFAA COc1cc(CN2CCN(CC(C)(C)C)[C@@H](CCO)C2)cc(OC)c1OC 20996649 DGCWCTPRUOZQJM-KRWDZBQOSA-N 380.529 2.627 0 50 GFAA C[C@H]1CCCN(c2ccccc2OS(=O)(=O)c2cnn([C@@H]3CCOC3)c2)C1 153471767 CFRCXETZPYERCI-JKSUJKDBSA-N 391.493 2.849 0 50 GFAA O=C(O)[C@H]1CC2(CCN(CCCOc3ccccc3)CC2)CN1C(=O)C1CC1 72171627 LICYMXPKBWPFEN-LJQANCHMSA-N 386.492 2.633 0 50 GFAA COc1ccc(S(=O)(=O)NCCCN2CCc3ccccc3C2)cc1F 30336485 WWLVIQKQUOVKKC-UHFFFAOYSA-N 378.469 2.561 0 50 GFAA Cc1ccc(CN(C)C(=O)[C@@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)o1 71748076 VUVVFMYEFPHXDI-GOSISDBHSA-N 387.524 2.659 0 50 GFAA C[C@@H](O)c1ncc(C(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)s1 241862553 SRARNODOLXSHSZ-CHWSQXEVSA-N 392.500 2.578 0 50 GFAA CCN(CC)C(=O)c1sc2ncn(C[C@H]3CCCC[C@H]3O)c(=O)c2c1C 43102934 DPEAAUDVHAZFQE-ZIAGYGMSSA-N 377.510 2.800 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1CN(Cc1cccnc1)CC2 14539117 UHBLYUVSBGZRTA-UHFFFAOYSA-N 375.476 2.587 0 50 GFAA CCc1c(C)sc(NC(=O)COCC(=O)O)c1C(=O)NC1CCCCC1 17078097 DHWNDVGJKZWVLV-UHFFFAOYSA-N 382.482 2.721 0 50 GFAA CCNC(=O)c1ccnc(-c2ccc(C(=O)NCCC3(O)CCCC3)cc2)c1 426597358 FFOHQMOBMYVIBI-UHFFFAOYSA-N 381.476 2.923 0 50 GFAA CN1CCN(C(C)(C)CNC(=O)c2cccc(-c3ccc(O)c(F)c3)c2)CC1 426548839 QUBAXILFFCEQLP-UHFFFAOYSA-N 385.483 2.954 0 50 GFAA O=C(C[C@H](c1ccccc1)c1ccc(F)cc1)NCc1cc2n(n1)CCNC2 96166648 YTEYQDJRWAPBGN-OAQYLSRUSA-N 378.451 2.964 0 50 GFAA Cn1cc(-c2cccc(C(=O)NC3CCN(Cc4ccncc4)CC3)c2)cn1 426359520 AZRZDEMTLOOVBR-UHFFFAOYSA-N 375.476 2.877 0 50 GFAA CCN1C[C@H](c2ccccc2)CC2(CCN(C(=O)c3cnc[nH]c3=O)CC2)C1 91351064 IHFANAJBLSPIAA-GOSISDBHSA-N 380.492 2.502 0 50 GFAA COCc1cccc(C(=O)N2CCC(c3nccn3Cc3ccccn3)CC2)n1 95520977 BJHNHJWDLFZDHV-UHFFFAOYSA-N 391.475 2.888 0 50 GFAA O=C([C@@H](O)c1ccc(Cl)cc1)N1CCC2(CCC(=O)N(C3CC3)C2)CC1 91625113 JFFMNIDAQGGZPF-SFHVURJKSA-N 376.884 2.767 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3CCC[C@@H](Nc4ccccc4)C3)CC2)n1 164055029 GKDKNRYIVNROPB-LJQANCHMSA-N 395.507 2.805 0 50 GFAA Ic1ccc(I)c2nsnc12 90560728 LXEFYJDGPPWGGL-UHFFFAOYSA-N 387.971 2.901 0 50 GFAA O=C(N[C@H]1CC[C@H](O)CC1)[C@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1 244608514 FEAPOPOMMSMMKG-FUDKSRODSA-N 399.579 2.783 0 50 GFAA COc1cccc([C@@H]2CCN(C3CCN(C(=O)c4ccncc4)CC3)C[C@H]2O)c1 65535369 QKZWPTUYBBDVHO-FCHUYYIVSA-N 395.503 2.545 0 50 GFAA COCC(=O)N1CCCc2ccc([C@@H]3CCN(C(=O)OC(C)(C)C)C3)nc21 864096699 BKKSZSGAESICLC-OAHLLOKOSA-N 375.469 2.732 0 50 GFAA CC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2C1)c1cn2cccnc2n1 822662134 FULFLEKKLXCRDX-INIZCTEOSA-N 395.463 2.966 0 50 GFAA CN(Cc1ccccc1CN1CCCC1)C(=O)Cn1c(=O)oc2ccccc21 827883911 ISKJFVSDXOCATP-UHFFFAOYSA-N 379.460 2.849 0 50 GFAA O=C(CSc1nc(-c2ccco2)n[nH]1)NCCN1CC[C@H](c2ccccc2)C1 670436321 GCQSLEPPRFBFCO-INIZCTEOSA-N 397.504 2.763 0 50 GFAA CC1(O)CCC(CC(=O)NCc2cccc(C(=O)N=c3cc[nH]cc3)c2)CC1 1875271601 JHHBEIWVBBFYEG-UHFFFAOYSA-N 381.476 2.703 0 50 GFAA COc1ccc(S(=O)(=O)Nc2cccc3[nH]nc(C(=O)O)c23)c2cccnc12 1875300091 KXGMHVPVQQONAE-UHFFFAOYSA-N 398.400 2.619 0 50 GFAA CNC(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)c1c(C)oc3ccc(OC)cc13)C2 1875394541 MHHOJSTUWXCETK-FABXCBLPSA-N 395.415 2.726 0 50 GFAA FC1(F)CC(Cc2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)C1 952893802 KHQLAFMLNYAAHG-LBPRGKRZSA-N 379.411 2.873 0 50 GFAA CCc1ccc(S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2NC2CCCCCC2)cc1 54092241 DJSLMQVHDYKZII-OALUTQOASA-N 399.578 2.501 0 50 GFAA Cc1c(CNC(=O)N2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)cnn1C 1565506148 IFFHOXOTPBLJJN-RTWAWAEBSA-N 378.476 2.942 0 50 GFAA Cc1cc(C)c(N2CC[C@@H](NS(=O)(=O)c3ccccc3F)C2=O)c(C)c1 188624991 BJBTUHJFDUQJCN-MRXNPFEDSA-N 376.453 2.835 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2C(=O)N2CCN3CCC[C@@H]3C2)cc1 195327024 YDQIFAXRIQSHDC-QGZVFWFLSA-N 379.460 2.868 0 50 GFAA COc1cc(CN2C[C@H]3CNC[C@]3(CO)C2)ccc1OCc1cccc(C)c1 1772711355 BMXPNSUHIDDAOK-NFBKMPQASA-N 382.504 2.596 0 50 GFAA O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC(Cc2ccc(O)nc2)CC1 1772712961 WWAGEPLPJLRBJJ-IBGZPJMESA-N 380.492 2.880 0 50 GFAA O=C(N[C@H](Cn1cccn1)c1ccccc1)c1cn(CCc2ccccc2)nn1 11765853 CACBXGDKBNQOEA-HXUWFJFHSA-N 386.459 2.889 0 50 GFAA O=C(Cn1ccc2cc(Br)ccc21)N1CCC2(CC1)OCCO2 11866174 OGMBCDAULKBGSC-UHFFFAOYSA-N 379.254 2.769 0 50 GFAA Cc1ccc(CN2CCC(N3CCC(C(=O)NCc4cccnc4)CC3)CC2)o1 11874276 ZVHYBPGHWDLREB-UHFFFAOYSA-N 396.535 2.976 0 50 GFAA CCc1nc(C)c(CN2CCC[C@H](CCC(=O)N(C)C3CCN(C)CC3)C2)[nH]1 11933602 FSBKWQBSAQYLKV-GOSISDBHSA-N 389.588 2.825 0 50 GFAA CC(C)N(CCO)Cc1cnc(S(=O)(=O)CC2CC2)n1CC1CCCCC1 12316705 UFPKMEBHTUIAPP-UHFFFAOYSA-N 397.585 2.850 0 50 GFAA O=C(CC[C@H]1CCCN(C(=O)c2n[nH]c3c2CCC3)C1)NCc1ccccc1F 12446169 IOPAFDUVZADBMV-OAHLLOKOSA-N 398.482 2.986 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)c1coc(COc2ccccc2F)n1 12717909 UPAWKTDPEUVXIR-UHFFFAOYSA-N 393.378 2.903 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)[C@@H](C)c4ccccc4)nnc23)n1 169781029 HWQAVRYSNPURLU-ZDUSSCGKSA-N 376.420 2.762 0 50 GFAA CCc1nc(O)ccc1C(=O)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1857721482 QSWULSQUAHBLLI-QRWLVFNGSA-N 377.444 2.573 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4ncc[nH]4)C3)nc2c1 1857725676 IDZHTIDCDPNQIU-CQSZACIVSA-N 383.452 2.525 0 50 GFAA O=C(c1cccc2c1NCCC2)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210394317 KTCFAOQZNQXIHD-AEFFLSMTSA-N 380.444 2.764 0 50 GFAA C[C@@H]1C[C@H](N)CCN1C(=O)CCC[S@@](=O)c1ccc(Br)cc1 237383555 PSWDBAMFNDVVNK-MZOGBMEOSA-N 387.343 2.675 0 50 GFAA O=C(Cn1cc(C2CC2)nn1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 152153350 CWGXAJIQBISMOO-INIZCTEOSA-N 380.370 2.774 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CCO[C@@H](c2cccs2)C1 161881059 ISNDXQMBPHQDNJ-ZWKOTPCHSA-N 384.501 2.882 0 50 GFAA CCCNC(=O)c1ccc(N2CCN(c3ncnc4sccc34)CC2)nc1 264898521 QZXFPPSRVXERKP-UHFFFAOYSA-N 382.493 2.553 0 50 GFAA CC(=O)c1ccc(N2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)nc1 2100539774 XYEQLYIWKUXMSU-SIKLNZKXSA-N 382.460 2.949 0 50 GFAA Cc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C 797282 RBVJNQHYTRJGLT-UHFFFAOYSA-N 375.446 2.544 0 50 GFAA Cn1ncc(Cl)c1C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 6731981 QNVBUVYYKKJHJU-UHFFFAOYSA-N 382.873 2.500 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)CSC)C3)C2=O)c1 11955396 CVYXYTRKDFACGT-LJQANCHMSA-N 380.485 2.538 0 50 GFAA COC(=O)C1CCN(C(=O)C2CCN(c3nc(C)c4ccccc4n3)CC2)CC1 12154614 WKHJTVWYRGUENL-UHFFFAOYSA-N 396.491 2.566 0 50 GFAA COc1ccc(CN(C)Cc2cccnc2)cc1OC[C@H](O)CN1CCCCC1 12297205 IVXXNUPGKYEOCB-OAQYLSRUSA-N 399.535 2.948 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(CCCn4cccn4)C3)C2=O)c1 12455781 LMMMPHYZPKRJTB-JOCHJYFZSA-N 382.508 2.797 0 50 GFAA CC(=O)N[C@H](CC(C)C)c1nnc2n1CCN(Cc1c(F)cccc1F)CC2 14882223 UTWGPXHZMLOGMG-GOSISDBHSA-N 391.466 2.838 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1CCC(CCC(=O)N2CCOCC2)CC1 14965670 VFPRYOMIEYBCOB-UHFFFAOYSA-N 390.528 2.518 0 50 GFAA Cc1ccc(CC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C 16650921 JDSGDEIVALSGEJ-UHFFFAOYSA-N 388.489 2.506 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnc(C)s2)C[C@@H]1CCO 19225463 RQFVGCWGFWSSGS-SFHVURJKSA-N 375.538 2.919 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(C(=O)c2ccccc2F)CC1 19594980 VFZYACJCFWREBC-UHFFFAOYSA-N 388.439 2.810 0 50 GFAA COc1cccc(NC(=O)[C@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)c1 19814837 ZTIOYFSUSSAYQB-CQSZACIVSA-N 395.444 2.600 0 50 GFAA Cc1c(C(=O)NCC(C)C)sc2ncnc(NCCCN3CCOCC3)c12 20599182 YAPLEXHJIYBZSG-UHFFFAOYSA-N 391.541 2.520 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(N[C@H](C)Cn4cncn4)CC3)cc2)n1 23153587 NTCTVPGBPYZAII-QGZVFWFLSA-N 379.512 2.728 0 50 GFAA CC[C@@H](C(=O)NCc1cccnc1)N(c1cc(C)ccc1C)S(C)(=O)=O 65362398 FEQLJKOMHQHDDR-KRWDZBQOSA-N 375.494 2.559 0 50 GFAA O=C(CN1CCC[C@H]1c1nc(-c2ccncc2)no1)NCc1ccccc1F 65373938 IRXBJRNKKRGQKE-KRWDZBQOSA-N 381.411 2.724 0 50 GFAA CC(C)[C@H](CO)NC(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1 72125426 JMRZEBDLWSXBMU-QFIPXVFZSA-N 380.532 2.832 0 50 GFAA O=C(C[C@@H]1COCCN1)NC1CCN(Cc2ccc(-c3ccccc3)cc2)CC1 72132935 ARQOUFLTNDZLBO-HSZRJFAPSA-N 393.531 2.813 0 50 GFAA Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC(N2CCC(O)CC2)CC1 72152741 UTEDRFTZWBUSMH-UHFFFAOYSA-N 380.492 2.513 0 50 GFAA COc1ccc(-n2ccnc2CN2CCCn3nc(CN(C)C)cc3C2)cc1 72436735 JEMFGQFZLADHBL-UHFFFAOYSA-N 380.496 2.545 0 50 GFAA O=C(c1cccc(S(=O)(=O)NCC[C@@H]2CCCCO2)c1)N1CCCCC1 95374896 CJYGWNMMKHLXMQ-KRWDZBQOSA-N 380.510 2.550 0 50 GFAA CCc1n[nH]c(-c2cccc(NC(=O)N3CCN(c4ccncc4)CC3)c2)n1 95521046 POHOQONKXASLEY-UHFFFAOYSA-N 377.452 2.783 0 50 GFAA O=C(c1ccc2[nH]nnc2c1)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95522029 GZCGMYLQCBCENQ-KRWDZBQOSA-N 387.447 2.618 0 50 GFAA CN(C[C@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1)C(=O)c1nc[nH]n1 95524021 CZMDFEWSGJNQDL-OAHLLOKOSA-N 395.429 2.850 0 50 GFAA O=C1[C@@H]2[C@H](C(=O)N1c1ccccc1I)[C@H]1C=C[C@H]2C12CC2 101362610 KXTANTNNZLNZLA-MHWZDGSBSA-N 391.208 2.993 0 50 GFAA CN(C)C[C@@H]1CN(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCO1 118805221 WJBAAVYUAFZJRL-LJQANCHMSA-N 382.464 2.733 0 50 GFAA Cc1ccc(C(N)=O)cc1OC(=O)Cc1ccccc1I 123854964 ZBKKLENJBZLYBX-UHFFFAOYSA-N 395.196 2.847 0 50 GFAA CCC1(CO)CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)CC1 130138434 ACXKVLKQBAHHEG-CYBMUJFWSA-N 382.863 2.843 0 50 GFAA O=C(c1cc(N2CCOCC2)ccn1)N1CCC(COc2ccccc2)CC1 130735794 ILBQNMUWNRZOIG-UHFFFAOYSA-N 381.476 2.849 0 50 GFAA Cc1ccccc1N1CCN(C(=O)CCc2c(C)nc3cc(O)nn3c2C)CC1 132104551 MYLGJNCAYFHMKD-UHFFFAOYSA-N 393.491 2.642 0 50 GFAA CCO[C@@H](C)c1nc(C(=O)NS(=O)(=O)c2cc(C)c(F)cc2F)cs1 151798990 YGSNPXSKGBPPKN-VIFPVBQESA-N 390.433 2.946 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)c1ccn(-c2cccc(F)c2)n1 155706234 LSXKQMMJEPJMHD-UHFFFAOYSA-N 381.411 2.804 0 50 GFAA CCc1oc(C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1C 157258764 RLZYXQRFQHTCHM-UHFFFAOYSA-N 377.466 2.972 0 50 GFAA CC[C@@H]1CN(C(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)CCO1 171893979 CRIRSLWPJXGLRT-LJQANCHMSA-N 386.496 2.616 0 50 GFAA COCC(=O)N1CCc2c(NC(=O)c3cccnc3N3CCCCC3)cccc21 182034279 RZFNPSRJXFLJCB-UHFFFAOYSA-N 394.475 2.860 0 50 GFAA CC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)C1 185196698 GYTRPOOMYPBYPN-HUUCEWRRSA-N 383.414 2.659 0 50 GFAA CN(C(=O)COc1ccc2c(c1)CCC2)[C@@H]1CCN(Cc2ccccc2)C1=O 189780257 QPQVAKILNVGQRO-OAQYLSRUSA-N 378.472 2.814 0 50 GFAA O=C1CN(C(=O)[C@@H]2CCCc3c(O)cccc32)CCN1Cc1cccc(F)c1 190496355 QXBPKPKLZCOMMH-LJQANCHMSA-N 382.435 2.822 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)Nc3cn(Cc4ccccc4)nn3)c2O1 192625511 GCBICGYVHQQKNZ-UHFFFAOYSA-N 384.461 2.841 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)Cn2c(COc3ccccc3)nc3ccccc32)C1 238136334 LMNRQMBFKVEXBH-HNNXBMFYSA-N 379.416 2.548 0 50 GFAA CN1CC[C@@H](NC(=O)NCC(=O)Nc2ccccc2)[C@H]1c1ccc(F)c(F)c1 245674625 KXOWILMVFMIXSZ-IEBWSBKVSA-N 388.418 2.648 0 50 GFAA C[C@H]1CO[C@H](C)CN1C(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 249315771 NVNIICVYLSKPBP-GZBFAFLISA-N 382.407 2.528 0 50 GFAA Cc1ccccc1C[C@H](CO)CNc1ncnc2ccc(S(C)(=O)=O)cc12 252501481 UFRCXNXLZJPIJG-HNNXBMFYSA-N 385.489 2.605 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N[C@H]1c2ccccc2C[C@H]1O 267466411 NNKVBJMSUCZBSX-MJGOQNOKSA-N 383.448 2.567 0 50 GFAA O=C1NCc2ccc(NC(=O)[C@H]3CCN(C(=O)OCc4ccccc4)C3)cc21 277744751 PMHHHFIWZWBWSR-INIZCTEOSA-N 379.416 2.527 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)[C@H]1CCCN1Cc1ccccc1 299425246 JERFAJYLXYYDNB-OAQYLSRUSA-N 393.487 2.762 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(n2cnnc2)CC1 426597352 DJTOJNMVVYTWHJ-LJQANCHMSA-N 382.512 2.537 0 50 GFAA O=C(c1cccc(-c2ccc(OC(F)F)cc2)c1)N1C[C@@H](CO)[C@H](CO)C1 426705684 KTUCCIICQUNGSA-IRXDYDNUSA-N 377.387 2.628 0 50 GFAA CS(=O)(=O)N(CCOc1ccc(Cl)cc1)Cc1cn2c(n1)CCCC2 433598477 GAHVPLZROGVFTB-UHFFFAOYSA-N 383.901 2.713 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1)c1cccc2c1OCO2 486334217 LIIKVSIVJMMQCW-UHFFFAOYSA-N 396.399 2.604 0 50 GFAA CSCc1noc(CNC(=O)N2CCCC[C@@H]2CCn2ccnc2C)n1 534645901 PFUMEQFVGRGOQG-CQSZACIVSA-N 378.502 2.592 0 50 GFAA Cc1ccc([C@@H](CNC(=O)N2CCOc3ccccc3C2)N2CCOCC2)o1 534665470 QTOBWKCYHGBZPW-GOSISDBHSA-N 385.464 2.566 0 50 GFAA Cc1cc(C(=O)NCCc2nc(Cc3ccccc3)no2)c2c(C)noc2n1 584900682 WTGOEMKSIHTPLS-UHFFFAOYSA-N 377.404 2.786 0 50 GFAA C[C@@H]1c2cc(F)ccc2CCN1C(=O)NCc1csc(N2CCOCC2)n1 584903505 PQXIQIJEUBVTPJ-CYBMUJFWSA-N 390.484 2.948 0 50 GFAA CCOC(=O)[C@@]1(c2ccc(OC)cc2)N(C(=O)OC(C)(C)C)CC[C@@]1(C)O 601200738 HMFPOLZISFWINO-WOJBJXKFSA-N 379.453 2.845 0 50 GFAA O=C(c1ccco1)N1CCC2(CC1)CN(C(=O)c1c[nH]c3ccccc13)CCO2 828138425 UPRRDDDEOAFQQN-UHFFFAOYSA-N 393.443 2.908 0 50 GFAA CCc1nc(C[C@H]2CCCN(c3nc4ncccc4o3)C2)n(CC(C)(C)O)n1 1857668686 CJMBFIVGXDGGPH-CQSZACIVSA-N 384.484 2.607 0 50 GFAA CCOc1cccc(C(=O)N2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)c1 1857673957 USGVKGBVGNEZHA-JOCHJYFZSA-N 380.444 2.975 0 50 GFAA COc1ccc(CN2CC[C@@]34OCCN3C(=O)C[C@@H]24)cc1OCc1ccccc1 1857722629 KMYKVHRFXAJBNC-GGAORHGYSA-N 394.471 2.807 0 50 GFAA CN1CC[C@@H](NC(=O)CN2CC[C@@H](c3ccccc3)NC2=O)c2ccccc21 1875267743 BRGPCFKDPKRCBH-RBUKOAKNSA-N 378.476 2.840 0 50 GFAA O=C(c1ccc2c(c1)CCCNC2)N1CC[C@@H](n2cnc3ccccc3c2=O)C1 1875310729 AAFQHXUBUZWSCL-LJQANCHMSA-N 388.471 2.520 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1ccc(-c2ccncc2)c(F)c1 1875403149 RFOVBRNXCSGOCR-VHKYSDTDSA-N 380.423 2.654 0 50 GFAA CN(C(=O)c1ccc2nnc(C(F)F)n2c1)C1CCN(c2ccncc2)CC1 2325739130 FJGUJDYGWYRBMP-UHFFFAOYSA-N 386.406 2.803 0 50 GFAA Cc1cc(-c2nn[nH]n2)cnc1C(=O)N1CCC[C@@H](c2cc(F)ccc2F)C1 2325808033 WHXCPMBCXRWECH-GFCCVEGCSA-N 384.390 2.868 0 50 GFAA C/C(=C\C(=O)NCCCCn1cc(C(=O)O)nn1)c1ccccc1C(F)(F)F 2325870689 KQQSAYIMGFEPSR-ZRDIBKRKSA-N 396.369 2.995 0 50 GFAA O=C(c1cccc2c1COC2)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356154120 IRVWVMJCESTJBA-PMAPCBKXSA-N 398.503 2.618 0 50 GFAA COc1ccc2c(C)c(C(=O)N3CCC[C@]34CCCN(C)C4=O)oc2c1OC 2356166126 VSBUUJRDYPNJIK-NRFANRHFSA-N 386.448 2.985 0 50 GFAA COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@H](NC(C)=O)CC2 607790 IAKHMKGGTNLKSZ-MRXNPFEDSA-N 399.443 2.872 0 50 GFAA biogenic,fda CC(C)NS(=O)(=O)c1ccc(OCC(=O)NC2CCCCC2)c(Cl)c1 1057435 MCWJGHNZGAUBJB-UHFFFAOYSA-N 388.917 2.854 0 50 GFAA Cc1ccc2nc(NC(=O)[C@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)sc2c1 1062644 ZJPWDNQVWODQBH-DGCLKSJQSA-N 377.466 2.914 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 2190799 YDZVRUBRPFBUFK-UHFFFAOYSA-N 376.478 2.955 0 50 GFAA O=C(CCSc1ccccc1)N1CCN(S(=O)(=O)c2ccccc2)CC1 7871847 HGSWLUKDUAGWIL-UHFFFAOYSA-N 390.530 2.702 0 50 GFAA CCOC(=O)c1cccc(NC(=O)c2ccccc2N(C)S(C)(=O)=O)c1 10441237 STXXCDZAQXJCLB-UHFFFAOYSA-N 376.434 2.511 0 50 GFAA COc1ccc(-c2cn3c(C(=O)N4CCC[C@H]4CO)csc3n2)cc1F 11819166 PEVHLYVQTMEIAH-LBPRGKRZSA-N 375.425 2.807 0 50 GFAA CCOC(=O)c1cnn(-c2ccccc2Cl)c1CN1CCC[C@H](CO)C1 12098951 YQPMQJZWKMFJPR-AWEZNQCLSA-N 377.872 2.907 0 50 GFAA COC(=O)c1c(NC(C)=O)c2cc(N[C@@H](C)CO)cnc2n1CCC(C)C 14533357 OWCPASVNHJHRJA-LBPRGKRZSA-N 376.457 2.620 0 50 GFAA COc1ccc(CN2CCC3(CC2)C(=O)N(C)C(=O)N3CC(C)C)c(OC)c1 14533904 ZGHFWQQSMAKJCD-UHFFFAOYSA-N 389.496 2.588 0 50 GFAA CC(C)CNC(=O)c1cn(C(C)C)cc(C(=O)NCc2cccs2)c1=O 14954483 TWJUVZIKDHEWJD-UHFFFAOYSA-N 375.494 2.807 0 50 GFAA CN(C)c1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@@H](CCO)C2)s1 20906235 YMNWZSAGLHJSIE-HNNXBMFYSA-N 396.507 2.556 0 50 GFAA CCN(CC)CCNC[C@H](O)CN1CCn2c3c(c4cc(C)ccc42)CCC[C@@H]31 22146331 WIWRJIZZYKIADD-CVDCTZTESA-N 398.595 2.935 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1ccc(Cl)cc1Cl 55060434 OTRJHYZTSYZOCO-UHFFFAOYSA-N 382.247 2.983 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)CCc2nc(-c3ccccc3F)no2)C1 55413654 ZWAAJKVUNSSNQN-CYBMUJFWSA-N 375.400 2.610 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)c2ccccc2N2CCCC2)N1 65406651 RRDQUFTZARHNFQ-SFHVURJKSA-N 378.476 2.603 0 50 GFAA O=C(NCc1cccnc1)c1cccc(OC2CCN(Cc3cc[nH]n3)CC2)c1 67649976 LKGHRENZGLDCCE-UHFFFAOYSA-N 391.475 2.778 0 50 GFAA O=C(c1ccccc1O)N1C[C@H]2[C@@H](C1)OC(=O)N2CCc1cccc(Cl)c1 67757239 ASRLWHKQWHHUSQ-FUHWJXTLSA-N 386.835 2.934 0 50 GFAA CC[C@@H](Oc1ccccc1)C(=O)N1CCc2c(c(C(=O)O)nn2CC2CC2)C1 67966172 ORVWZDJOKPBWHU-GOSISDBHSA-N 383.448 2.734 0 50 GFAA COc1ccc(CCC(=O)N2CCN(c3ncnc4ccccc34)CC2)cc1 68999536 JCKIDZROKMYZLO-UHFFFAOYSA-N 376.460 2.920 0 50 GFAA CC(C)(C)c1ccc(OCc2ncc(C(=O)NC[C@@H]3CCCO3)c(O)n2)cc1 77426800 PAVWYQYDRAFNLK-INIZCTEOSA-N 385.464 2.968 0 50 GFAA O=C(NCC1(c2cccc(F)c2)CCOCC1)c1cccc(-n2cnnc2)c1 91707951 FPNRNUMQNAYDDZ-UHFFFAOYSA-N 380.423 2.885 0 50 GFAA CN(CC(=O)N1CCC[C@H](Cc2nc3ccccc3[nH]2)C1)Cc1ccccn1 91932381 DIJLZEXFSDSRNE-QGZVFWFLSA-N 377.492 2.871 0 50 GFAA C[C@@H](CO)NC(=O)c1ccc(OC2CCN(CCc3ccccc3)CC2)cc1 95499231 ZLEUNTKEUZKCSP-SFHVURJKSA-N 382.504 2.883 0 50 GFAA Cc1cc(C(=O)N2CCC(c3nccn3Cc3cccnc3)CC2)c(=O)[nH]c1C 95504622 HUOYJZGEPYMUQD-UHFFFAOYSA-N 391.475 2.651 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(c2ncc(C(=O)O)cc2Cl)C1 95525171 PFOUSISZANIZGL-CYBMUJFWSA-N 377.876 2.575 0 50 GFAA O=C(CCCn1ccnc1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 95529890 JMIGPRIYTPBZEP-LJQANCHMSA-N 378.480 2.709 0 50 GFAA O=C(c1c(F)ccc(F)c1F)N1C[C@@H]2CN(C3CCCC3)C[C@]2(C(=O)O)C1 96160124 KSDUKIACWHOWDQ-WLRWDXFRSA-N 382.382 2.505 0 50 GFAA COc1cccc(-c2nc3c([nH]2)CCN(C(=O)[C@@H](O)c2ccccc2F)C3)c1 96166521 PIBJXEKZQGUFOE-IBGZPJMESA-N 381.407 2.843 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](N3CCc4ccccc4C3)C2=O)cc1 96299661 JGALKUZYIZHNOB-LJQANCHMSA-N 378.428 2.554 0 50 GFAA Cc1ccc2cccc(NC(=O)C(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)c2n1 126321974 GTWDMAYAUWCZQB-GOSISDBHSA-N 394.475 2.532 0 50 GFAA Cc1nc(C(=O)NC[C@@H]2CN3CCCC[C@@H]3CO2)nn1-c1ccccc1C(C)C 129030269 IYLYWIFMMZCDBN-QZTJIDSGSA-N 397.523 2.682 0 50 GFAA CC(=O)N[C@@H](CC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1)c1ccccc1 150753989 MVYAUTPCARLIJU-LPHOPBHVSA-N 387.430 2.927 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCC2(CC1)NC(=O)N(c1ccc(F)cc1)N2 169764126 PTCHVVCRARTUMJ-UHFFFAOYSA-N 386.402 2.560 0 50 GFAA CNC(=O)c1cccc(NC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c1 171509167 DDMPTTBMRDRZBB-SFHVURJKSA-N 380.492 2.732 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1)C2 171799603 FYYNSRHSGICUAD-WOJBJXKFSA-N 397.519 2.959 0 50 GFAA CN(C(=O)Nc1ccccc1N1CCCC1=O)[C@H]1CCCN(c2cccnn2)C1 172402088 NWUXQWWSDFEJBD-INIZCTEOSA-N 394.479 2.736 0 50 GFAA Cc1ccc(-c2ccsc2C(=O)N2CCN(c3cnn(C)c3)C(=O)C2)cc1 177842873 OWKNGFZTUKJSAS-UHFFFAOYSA-N 380.473 2.946 0 50 GFAA NC(=O)[C@H]1CCCN(C(=O)CN2CCCCC[C@H]2/C=C/c2cccs2)C1 181955160 SDXPDFGJQKJKQL-RJCHQFKYSA-N 375.538 2.730 0 50 GFAA CN(C)c1ccncc1CNCc1ccccc1S(=O)(=O)NC(C)(C)C 185166178 XOCFSHUADXBRDW-UHFFFAOYSA-N 376.526 2.514 0 50 GFAA Cn1ccc2ccc(C(=O)Nc3ccc4c(c3)C(=O)N3CCC[C@@H]3C(=O)N4)cc21 206254721 ZVKVIVYBFHNMLT-GOSISDBHSA-N 388.427 2.987 0 50 GFAA C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)N1CCC[C@@H](c2ccnn2C)C1 229495270 XNLHAZHXYUFTLF-LSDHHAIUSA-N 378.484 2.872 0 50 GFAA CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCC[C@H]1Cc1ccc(F)cc1 239367334 AIINKCQZJISZLU-OALUTQOASA-N 376.472 2.777 0 50 GFAA CN(Cc1ccccc1)C[C@H]1CCCN(C(=O)CNC(=O)OC(C)(C)C)C1 242324452 ZBLHEPLDAMITDE-GOSISDBHSA-N 375.513 2.882 0 50 GFAA CN(CCc1nc2cc(F)ccc2[nH]1)C(=O)CCS(=O)(=O)c1ccccc1 252481991 CWKXTVLEMKPPJK-UHFFFAOYSA-N 389.452 2.567 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)N[C@@H]3CCCn4nc(CC)nc43)c2C)cc1 252508700 XRBLCZDAUHEVEM-QGZVFWFLSA-N 393.495 2.616 0 50 GFAA COCCN1Cc2cc(C(=O)N[C@@H](C)c3ccc(OC)cc3)ccc2OCC1=O 263618496 UBSUVYZEQJNNOA-HNNXBMFYSA-N 398.459 2.554 0 50 GFAA COc1cnc2ccccc2c1C(=O)N1CCO[C@@H](c2nnc(C(C)C)o2)C1 283217504 SBIVMMYRDVWHMN-MRXNPFEDSA-N 382.420 2.964 0 50 GFAA Cc1c(-c2cc(CN3CC[C@](CO)(Cc4ccc(F)cc4)C3)on2)cnn1C 288788479 KWKBKGZPWQJHEX-NRFANRHFSA-N 384.455 2.950 0 50 GFAA O=C(O)C[C@@H]1CCCN(S(=O)(=O)CCc2ccccc2Br)C1 290901883 FDCYERAVXNWQID-LBPRGKRZSA-N 390.299 2.508 0 50 GFAA COCCn1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)n1 299671745 NGGMFSVZROSEGZ-QGZVFWFLSA-N 384.480 2.637 0 50 GFAA Cc1nonc1CN1CCN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC1 299766251 MJKFDRYEGSRGIQ-UHFFFAOYSA-N 376.460 2.932 0 50 GFAA COCCNC(=O)c1cnn(-c2ncc(C)c(-c3cccs3)n2)c1C1CC1 299775756 IZJHCSNLJWIUPI-UHFFFAOYSA-N 383.477 2.953 0 50 GFAA O=C(c1ccc2cc[nH]c2c1)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328643399 YWHZRFUSTHGZBT-IBGZPJMESA-N 377.448 2.772 0 50 GFAA CCn1ccnc(N2CCC(NC(=O)N[C@@H]3CCCc4ccccc43)CC2)c1=O 364675920 VIAVHHHSXRQISU-LJQANCHMSA-N 395.507 2.609 0 50 GFAA C[C@@H](CO)N1CCCN(Cc2coc(-c3ccc(Br)cc3)n2)CC1 364900000 XXLAWTGHFQZKFI-AWEZNQCLSA-N 394.313 2.993 0 50 GFAA CO[C@@]12CC[C@H](Oc3ccccn3)C[C@@H]1N(CC(C)(C)N1CCOCC1)CC2 426409013 QQDPNPVYQHMYTE-CNNODRBYSA-N 389.540 2.583 0 50 GFAA Cc1ccc(-c2ccnn2C)cc1NC(=O)N1CCCC[C@@H]1CS(C)(=O)=O 455361162 DIQOQHGLRJHWTA-MRXNPFEDSA-N 390.509 2.827 0 50 GFAA O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccc2cc[nH]c2n1 498531066 YZJOCFBYKOKSTI-CYBMUJFWSA-N 379.338 2.751 0 50 GFAA Cc1cc(N2CCN(Cc3ccc([C@H]4CCCO4)s3)CC2)n2ncnc2n1 825138882 ASUWWKDEOGZFHA-MRXNPFEDSA-N 384.509 2.668 0 50 GFAA Cc1csc2nc(Cl)c(CN3CCC(CNC(=O)[C@H]4CCOC4)CC3)n12 827778586 NRXPNSQCJSICNN-AWEZNQCLSA-N 396.944 2.722 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)cs1 952971631 FNJAHEKCAGYVQR-UHFFFAOYSA-N 381.454 2.549 0 50 GFAA O[C@@H](c1cccs1)C1CCN(Cc2cnc(N3CCOCC3)s2)CC1 952984089 NPXMXDHTOMOKOI-QGZVFWFLSA-N 379.551 2.987 0 50 GFAA Cc1ccc2nc(SCC(=O)N3CCN(CC(C)C)[C@H](CCO)C3)[nH]c2c1 952991808 SSBKAXIKTUNJGB-MRXNPFEDSA-N 390.553 2.515 0 50 GFAA CC[C@@H](C)n1nc(C)cc1NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O 1506424090 AMERIKAPUYWNJS-CYBMUJFWSA-N 382.461 2.706 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)c3cccc4nccnc34)C1)CC2 1704300984 DPDPFSQNBLTMKV-QFIPXVFZSA-N 388.475 2.606 0 50 GFAA CO[C@H]1CN(C(=O)c2cc(-c3ccccc3)nn2C)C[C@H]1Cc1cc(C)no1 1704352324 CLCCEENMIUQPKR-UZLBHIALSA-N 380.448 2.713 0 50 GFAA O=C(NCCCOC1CCCC1)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772819157 GENLOMCVHPUQIJ-OAHLLOKOSA-N 393.553 2.550 0 50 GFAA Cc1cc(N2CCN(C(=O)c3n[nH]c4c3C[C@@H](C)O[C@H]4C)CC2)nc(C(C)C)n1 1857529158 MPBQFIFXUJIHGU-CABCVRRESA-N 398.511 2.616 0 50 GFAA NC(=O)C1(NC(=O)C2CCN(c3nc4ccc(Cl)cc4o3)CC2)CCCC1 1857716978 KJRUQLWLVRISKK-UHFFFAOYSA-N 390.871 2.612 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCc4cnn(C)c4)C3)nc2c1 1857718837 VNDNSAHGMPPBSH-OAHLLOKOSA-N 397.479 2.535 0 50 GFAA Cc1nc(-c2ccccn2)cc(=NCc2ccnc(N3CCO[C@H](C)C3)c2)[nH]1 1875255347 FURVKPKWLPAHHG-OAHLLOKOSA-N 376.464 2.501 0 50 GFAA COC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1 1875266962 IXAPQWBPEILXII-ZVDOUQERSA-N 393.487 2.549 0 50 GFAA O=C(N=c1ccn([C@H]2CCNC2=O)[nH]1)Nc1ccccc1SCC(F)(F)F 1875289704 JXDDECJKZACHJX-NSHDSACASA-N 399.398 2.664 0 50 GFAA CC(C)n1ncnc1CNC(=O)c1ccn(-c2ccc(C(F)(F)F)cc2)n1 1875310232 JOQDVCGWDKLZHA-UHFFFAOYSA-N 378.358 2.994 0 50 GFAA Cc1c(C(=O)N2CC[C@@H]3CN(c4ncccn4)C[C@@H]3C2)cnn1C1CCCC1 1875315301 ORCUKKIGEGELPJ-SJORKVTESA-N 380.496 2.695 0 50 GFAA Cc1ccc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)cc1Oc1ccncc1 1875402135 CFVMNVORDXEARR-PWIZWCRZSA-N 392.459 2.948 0 50 GFAA Cc1csc(CN2CCC[C@@]3(CCCN(C(=O)c4ccno4)[C@@H]3C)C2=O)n1 1940195424 BUPBOSHBDUPZKT-KUHUBIRLSA-N 388.493 2.873 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)c2cc3cccnc3[nH]2)CCCCN1 2100533431 OTVPJVNPKWEFIW-SFHVURJKSA-N 397.523 2.550 0 50 GFAA COC(=O)c1cnc(C(=O)Nc2cc(C)nn2Cc2cccc(Cl)c2)cn1 2100555370 SNYAWZFCZWUNMA-UHFFFAOYSA-N 385.811 2.722 0 50 GFAA CN1CCN(C(=O)c2cc(=O)n(-c3ccc(Cl)cc3)[nH]2)[C@@H](c2ccccc2)C1 2325736509 RNWSDKYRCWPRLY-LJQANCHMSA-N 396.878 2.948 0 50 GFAA COc1cnn2c1CN(C(=O)NCc1c(C)nn(-c3ccccc3C)c1C)CC2 2325796068 QWEVCPAPMUYYTM-UHFFFAOYSA-N 394.479 2.728 0 50 GFAA Cn1cnc(C(=O)N[C@H]2CC[C@@H](CCNC(=O)c3ccc4ccccc4n3)C2)c1 2325879706 DTSFMVGOFGZRRU-RDJZCZTQSA-N 391.475 2.687 0 50 GFAA O=C(O)c1c(N2CCN(c3ncccn3)CC2)noc1-c1ccc(Cl)cc1 2356160385 PWCGPVFOZMZICL-UHFFFAOYSA-N 385.811 2.810 0 50 GFAA CCOC(=O)c1ccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 1141529 IDYCWEVKNBSUJD-UHFFFAOYSA-N 376.434 2.511 0 50 GFAA CCc1ccccc1N(CC(=O)Nc1ccc(NC(C)=O)cc1)S(C)(=O)=O 1145180 RTQHBWBWGPSQMV-UHFFFAOYSA-N 389.477 2.612 0 50 GFAA O=C(NCCCNc1cccnc1)c1cc2c(s1)C1(CCNCC1)OCC2 2356140184 XWNADOONVROBCR-UHFFFAOYSA-N 386.521 2.527 0 50 GFAA COc1ccc2c(c1)C=C(CN1CCC[C@]3(CCc4c[nH]c(=N)nc43)C1)CO2 2356144625 GLHZECJWKNJRCE-QFIPXVFZSA-N 378.476 2.654 0 50 GFAA COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 4196713 JAUDXUKDOCZJHX-UHFFFAOYSA-N 383.809 2.699 0 50 GFAA COC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)c(Cl)c1 4842924 UFFBMTWSQKLGEP-UHFFFAOYSA-N 383.853 2.713 0 50 GFAA CC(C)N1CC[C@@H](NC(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)C1=O 114835663 HOKUKWAUNXHNKR-CVEARBPZSA-N 383.851 2.571 0 50 GFAA Cc1cccc(N2CCC(NS(=O)(=O)c3cccc4cnccc34)CC2)n1 116904723 ZBRLLQOYLBUPKW-UHFFFAOYSA-N 382.489 2.886 0 50 GFAA O=C(Nc1ccccc1)C1=C(NC[C@@H]2CCCO2)c2ccccc2S1(=O)=O 20725334 OYIJXJZZMFOZAN-HNNXBMFYSA-N 384.457 2.550 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc4occc4c3)CC2)C1 67695003 QGRBKPQYCNRLTM-FQEVSTJZSA-N 399.535 2.872 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCN2C(=O)CSc2nnc(C)s2)s1 23251545 OUXROXDKLDULPX-JTQLQIEISA-N 382.536 2.723 0 50 GFAA c1ccc2c(OCc3nn4c(CN5CCOCC5)nnc4s3)cccc2c1 36353617 XDGNJUIQINQHER-UHFFFAOYSA-N 381.461 2.750 0 50 GFAA C[C@H](NC(=O)N1CCC(c2nncn2C)CC1)c1ccc(-n2cccn2)cc1 174338132 OIDAUGIEDKKJSY-HNNXBMFYSA-N 379.468 2.651 0 50 GFAA CCn1cncc1S(=O)(=O)NCc1ccc(-n2cnc3ccccc32)cc1 433820278 SJKUFECFLYOCFY-UHFFFAOYSA-N 381.461 2.720 0 50 GFAA O=C(CN1CCCCC1=O)NCc1cccnc1Oc1ccc(F)c(F)c1 11664964 NMDSGDDIVFCJSH-UHFFFAOYSA-N 375.375 2.781 0 50 GFAA Cc1cnn(C[C@H]2CN(C(=O)Nc3cnn(-c4ccccc4F)c3C)CCO2)c1 157238911 FESOSWNALUMWOZ-MRXNPFEDSA-N 398.442 2.758 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N(C)[C@H]1CCCN(CCc2ccccc2)C1 72423187 UNGATPQDGMSZFF-FQEVSTJZSA-N 381.520 2.781 0 50 GFAA O=C(c1ncccc1O)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 71763459 RBFSMFFBUSATNB-JSNMRZPZSA-N 385.414 2.768 0 50 GFAA CC[C@H]1CN(C(=O)CCn2cc(Cl)cn2)CCC(=O)N1Cc1ccccc1 71751167 YJMYJZFKFOSGHJ-SFHVURJKSA-N 388.899 2.966 0 50 GFAA O=C(CCSc1nnc(-c2ccncc2)o1)N1CCC[C@H](c2ccn[nH]2)C1 77300204 ZJXSYVNCZZMBAF-AWEZNQCLSA-N 384.465 2.743 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1noc([C@@H]2CCCO2)n1 72420223 XSFTZWLJXLUZKU-KRWDZBQOSA-N 381.436 2.583 0 50 GFAA CN1C(=O)[C@@](CC(=O)NC2CCOCC2)(Cc2ccccc2)c2ccccc21 71552007 WRZXFZIQQGYAMT-HSZRJFAPSA-N 378.472 2.829 0 50 GFAA CC[S@](=O)[C@H]1CCCC[C@H]1NC(=O)c1ccc(-c2nnc(S)o2)cc1 241588501 PDSACGQHCXUTRE-JXQWACKNSA-N 379.507 2.835 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(C(=O)Cn3ccnc3)CC2=O)cc1 82121697 CISIOYBDKCLDRL-OAQYLSRUSA-N 388.471 2.678 0 50 GFAA Cc1ccn(-c2ccc(NCCNC(=O)c3ccccc3C(F)(F)F)nn2)n1 82230448 QCCNRVSUZDKMQI-UHFFFAOYSA-N 390.369 2.831 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@@H]3CCCC[C@H]3O)csc2C1 426697576 SEVBCNZFVKGXLG-QZTJIDSGSA-N 389.521 2.945 0 50 GFAA CC(C)Cc1cc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)[nH]n1 95522411 HFEHUXJOUIXPQS-UHFFFAOYSA-N 396.539 2.617 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)N2CCC[C@@H]2c2c(C)noc2C)c1 97674235 ICLKKMKQFGQIMW-OAHLLOKOSA-N 378.454 2.569 0 50 GFAA CCn1c(C)cc2cc(NC(=O)NC3CCN(S(C)(=O)=O)CC3)ccc21 96138040 PPDHSCMGZXHRJI-UHFFFAOYSA-N 378.498 2.515 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)cn1 91892820 OPXHUZYPQBYBLQ-UHFFFAOYSA-N 392.503 2.873 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2C[C@@H](NC(=O)N(C)C)[C@H](C(C)C)C2)cc1 95525554 LTLZRLITGWOANC-RBUKOAKNSA-N 385.512 2.813 0 50 GFAA COc1ccc(CN2CC(c3ccccn3)C2)cc1OC[C@H](O)CN(C)C(C)C 95511846 QWCGRGSPGSAATQ-HXUWFJFHSA-N 399.535 2.770 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)NCc1nc(C)c2c(n1)CCCC2 97495096 HDLWNDSGJSVTOI-UHFFFAOYSA-N 381.480 2.664 0 50 GFAA CNC(=O)c1ccc(CS(=O)(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1 297021128 KOIJUNOZGAPRQQ-SFHVURJKSA-N 399.516 2.755 0 50 GFAA CC[C@H](NC(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1)c1cccnc1 534656626 DDDHSKUGDBJLTP-SFHVURJKSA-N 382.464 2.789 0 50 GFAA Nc1nc2c(c(C(=O)NCCCc3nc4cc(Cl)ccc4[nH]3)n1)CCCC2 299773686 GXJUDIUTRFPSFC-UHFFFAOYSA-N 384.871 2.830 0 50 GFAA O[C@H](CCN1CCOC2(CCN(Cc3ccccn3)CC2)C1)c1ccccc1 828859709 UTWQSRVLEBMAKM-JOCHJYFZSA-N 381.520 2.872 0 50 GFAA C[C@H]1Oc2ccccc2N(CC(=O)N[C@H](CCC(=O)O)c2ccccc2)C1=O 268899935 SGOIQINCQRITGG-GDBMZVCRSA-N 382.416 2.523 0 50 GFAA Cc1nc2ccc(CNC(=O)N3CCCN(C(=O)c4ccco4)CC3)cc2[nH]1 584899558 SNQSVGZOXLIVOV-UHFFFAOYSA-N 381.436 2.522 0 50 GFAA COc1ccncc1C(=O)Nc1ccc(N2CCN(C)CC2)c2ccncc12 1875276237 NDAAMLDPMRVRHI-UHFFFAOYSA-N 377.448 2.643 0 50 GFAA C[C@@H]1CCS[C@@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H]1CCSC1 1875357793 XCIWUBQZFUAAGW-MZJJYOIFSA-N 390.574 2.780 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1ccccn1)c1cc(-c2ccccc2)[nH]n1 1565514750 CJPJBPQMHYLUJI-PXNSSMCTSA-N 378.432 2.576 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)c2cccc(NC(=O)c3cccnc3)c2)[C@]12CCCO2 273716676 QRXGMQGOBJYQAM-NNMXDRDESA-N 395.459 2.790 0 50 GFAA C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NCc2ccc(CN3CCOCC3)o2)c1 170595047 FJTNXWLLSIWFJC-FOIQADDNSA-N 397.475 2.636 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 170620887 FSXSADROSLCJJA-FKZOYECMSA-N 384.464 2.722 0 50 GFAA Cc1ccc(OCc2ccc(C(=O)N3CCc4nc[nH]c(=O)c4C3)o2)c(C)c1 170685892 YNQWXESFWLPVHF-UHFFFAOYSA-N 379.416 2.757 0 50 GFAA C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CSC[C@@H]1C(=O)N(C)C 170620621 NNIVWWNTMOBJFI-TVQRCGJNSA-N 377.293 2.750 0 50 GFAA CN1CC[C@@H](CNC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 109848977 WHZMSAWQLLHOTB-LRDDRELGSA-N 384.307 2.666 0 50 GFAA O=C1C[C@@]2(CCN(C(=O)NCCc3ccc4c[nH]nc4c3)C2)Oc2ccccc21 413533049 OFLLKIRHCUTJKO-JOCHJYFZSA-N 390.443 2.925 0 50 GFAA CNC(=O)CC[C@@H]1CCCN(S(=O)(=O)c2cc(C)c(F)cc2Cl)C1 1506420925 DOQLQMQIMDWELK-LBPRGKRZSA-N 376.881 2.714 0 50 GFAA CCn1ncc(S(=O)(=O)N2CCC[C@H](C(=O)CCc3ccccc3)C2)c1C 1506418667 UTDQYGKEGNJYIV-SFHVURJKSA-N 389.521 2.814 0 50 GFAA Cc1cccnc1CN(C)C(=O)[C@H]1OCC(=O)N(C(C)C)[C@@H]1c1ccccc1 1529189679 ULPCXIYQRWCTTN-RTWAWAEBSA-N 381.476 2.726 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(c3nc(C)ccc3C(N)=O)CC1)OCC2 1704304857 IWCCHZDZXRIYSG-UHFFFAOYSA-N 397.475 2.575 0 50 GFAA CC(=O)N1C[C@H]2CN(CCn3cc(Cl)cn3)C[C@@]2(CCc2ccccc2)C1 1772705368 HHYSOZAVDCTKGX-CTNGQTDRSA-N 386.927 2.950 0 50 GFAA CN1CCC(N2C[C@H]3CN(Cc4cc[nH]n4)C[C@]3(CCc3ccccc3)C2)CC1 1772817613 GLHMFZCYLCIZCH-ZJSXRUAMSA-N 393.579 2.871 0 50 GFAA Cc1nn(C)cc1CN1CCCN(C(=O)Cc2ccc(F)cc2Cl)CC1 1772712116 ICXGCKFWUWKWRB-UHFFFAOYSA-N 378.879 2.798 0 50 GFAA O=C(NCc1cccs1)c1cn(CCNCc2c(F)cccc2Cl)nn1 11909952 SEOKAQCDKPSBGD-UHFFFAOYSA-N 393.875 2.852 0 50 GFAA COc1ccc2cc(C(=O)[C@@H]3CCCN(C(=O)Cn4cncn4)C3)ccc2c1 12052866 VGEKXENGWHMKBX-GOSISDBHSA-N 378.432 2.561 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)CCc1n[nH]c2ccccc12 1857527467 PCHDNCBIOYZYRU-AUUYWEPGSA-N 394.479 2.812 0 50 GFAA COc1cc(CC2CN(C(=O)c3n[nH]c4c3C[C@@H](C)O[C@H]4C)C2)cc(OC)c1 1857528554 ACBCPIGLUWEBSI-OLZOCXBDSA-N 385.464 2.764 0 50 GFAA Cc1ncsc1CCN(C)C[C@@]1(O)CCCN(C(=O)CCC(F)(F)F)C1 1857729419 ZZUYAQCEWYAHMR-INIZCTEOSA-N 393.475 2.622 0 50 GFAA CC1CCN(C[C@H]2CCCN(C(=O)CNC(=O)c3ccc(F)c(F)c3)C2)CC1 263770244 SOAARLWWUISINT-MRXNPFEDSA-N 393.478 2.665 0 50 GFAA COc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4CCCC4)nn3)CC2)cc1 263804639 VKEZYSJBCUHNPN-UHFFFAOYSA-N 394.475 2.821 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1cc2c(s1)CCC2 266347592 NGPKWUYMDCPMKZ-CYBMUJFWSA-N 379.507 2.662 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2ccc(Br)cc2)NC(=O)N1 706381 QKMKMANBZFNUGU-HIFRSBDPSA-N 395.253 2.799 0 50 GFAA biogenic CCCCNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1 1803449 IBLOHOLPRDSVNW-MRXNPFEDSA-N 378.519 2.780 0 50 GFAA Cc1cc(C)n(CC(=O)N2CC[C@]3(C2)C(=O)N(CC(C)C)c2ccccc23)n1 2100555356 SDMLFWWGVOZFTD-JOCHJYFZSA-N 380.492 2.673 0 50 GFAA C[C@H](NC(=O)c1ccc(N2CCN(C)CC2)cc1)c1nc(-c2cccs2)n[nH]1 2325820743 XZWVIHLBWPUSAL-AWEZNQCLSA-N 396.520 2.776 0 50 GFAA O=S(=O)(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1c[nH]nc1Cl 2325873509 JQTWVXJPCUHFGT-UHFFFAOYSA-N 393.734 2.933 0 50 GFAA N=c1ncc([C@@H]2CCCCN2C(=O)c2cccc(NC(=O)NC3CC3)c2)c[nH]1 2325879259 OLWJLVPLGLFCKO-KRWDZBQOSA-N 380.452 2.540 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NCc1cccnc1 885085 AKYFDBVUHDXAPJ-UHFFFAOYSA-N 395.484 2.589 0 50 GFAA O=C(NC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(C1CCCC1)C[C@H]2O)C1CCOCC1 2356148710 OHGZHXITYFDOHW-GBEXAXCTSA-N 398.547 2.548 0 50 GFAA CN1CC[C@@H](C(=O)N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1=O 113832673 RQXVBQGMCWYKKL-CYBMUJFWSA-N 395.862 2.525 0 50 GFAA Cc1ccc(N2C(=O)C[C@H](NC3CCN(C(=O)C4CCCCC4)CC3)C2=O)cc1 100436565 YBSOAUNHQSBYCV-FQEVSTJZSA-N 397.519 2.788 0 50 GFAA CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccc2c1OCCO2 115588108 DYHGILXPLYMKRY-KRWDZBQOSA-N 388.489 2.747 0 50 GFAA O=C(c1cc(=O)[nH]c2ccc(F)cc12)N(Cc1ccccn1)C[C@@H]1CCCO1 55393287 PNZMYWMJAYZPNY-INIZCTEOSA-N 381.407 2.884 0 50 GFAA CCN1CCN(C2(C(=O)N(C)Cc3nc(C)cs3)Cc3ccccc3C2)CC1 20389383 AYVKYVFMXDPIQB-UHFFFAOYSA-N 398.576 2.585 0 50 GFAA C[C@H]1CCCN(CCNC(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1 252474958 PJJKHFJPTSLZAU-JKSUJKDBSA-N 380.483 2.822 0 50 GFAA C[C@H](N[C@H](C)C1CCOCC1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 125412297 WEQLQLDUVNTJJT-QZWKJPRYSA-N 377.529 2.574 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCc3cccc(F)c3)C2)n(C)n1 12156980 FNGORJGJOKQFTI-MJGOQNOKSA-N 398.482 2.563 0 50 GFAA O=C(NS(=O)(=O)CCC(F)(F)F)c1ccc(-c2noc(C(F)F)n2)cc1 253424656 JCMGKAFQGLKQPK-UHFFFAOYSA-N 399.297 2.686 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CC[C@H](N(C)C)C4)nc3)n2)c1OC 39379324 WNNDUDPRENCZDZ-HNNXBMFYSA-N 395.463 2.956 0 50 GFAA Cn1cc(NC(=O)CN2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)cn1 71615099 MYEXDBSMIYDYFL-CQSZACIVSA-N 394.397 2.972 0 50 GFAA Cc1ccc(CN2CCN(C(=O)[C@H](C)n3cnc4ccccc43)CC2=O)cc1 77503705 WHIYIBDFUFLCPC-KRWDZBQOSA-N 376.460 2.777 0 50 GFAA CCc1ccc(C(=O)N(C)CCc2ccccc2OC)cc1S(C)(=O)=O 152544051 CHQLQTHIRLSXEC-UHFFFAOYSA-N 375.490 2.976 0 50 GFAA S=C(NCCCn1cc(Br)cn1)Nc1ccc2c(c1)OCO2 6971536 PGMPSNFGQYAEPP-UHFFFAOYSA-N 383.271 2.751 0 50 GFAA CC(C)CNC(=O)N1CCC[C@H](CC(=O)N2CCC[C@@H](N3CCCC3)CC2)C1 127385576 RBGVSGVIZLAKOT-WOJBJXKFSA-N 392.588 2.931 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@H](C)[C@@H](C)N)ccc2C)cc1 262549603 XHOCKAHBWNRAMZ-ZIAGYGMSSA-N 391.493 2.726 0 50 GFAA O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cn(C2CCNCC2)nn1 262630979 MMVZXDPOFZOBMI-UHFFFAOYSA-N 378.436 2.987 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2nn(C)c(=O)c3ccccc23)CCCN1CC1CC1 71498206 ZGXYZJGDCPYBFU-LJQANCHMSA-N 382.508 2.516 0 50 GFAA CC(=O)c1[nH]c(C)c(C(=O)N2CCC3(CC2)C(=O)N(C)c2ccccc23)c1C 72123909 MBTCSAJWKWCXFR-UHFFFAOYSA-N 379.460 2.985 0 50 GFAA O=C(NCc1coc(-c2ccccc2)n1)N[C@H]1CCN(c2ncccc2F)C1 176211878 FLFLQADZKAWKOL-HNNXBMFYSA-N 381.411 2.954 0 50 GFAA CN1CCN(CC2CCN(C(=O)Cc3ccccc3C(F)(F)F)CC2)CC1 221403877 YYPYFIUWKPYSBA-UHFFFAOYSA-N 383.458 2.734 0 50 GFAA O=C(NCCCc1ccccn1)c1cccc(OCC(=O)N2CCCCC2)c1 223523054 YZKJYCCMJGVLKM-UHFFFAOYSA-N 381.476 2.836 0 50 GFAA CC1(C)O[C@@H]2O[C@H](C(=O)Nc3cccc(Cl)c3)[C@@H]3OC(C)(C)O[C@@H]3[C@H]2O1 239310472 ILXDDQNPLLGHNZ-SRTKAIALSA-N 383.828 2.675 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@@H](NC(=O)C2CCCC2)CN1Cc1ccc(C)o1 96131201 SHTCFQSCWDSXBT-MJGOQNOKSA-N 375.513 2.706 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4cccc(C)n4)C3)CCC2=O)cn1 91435083 HIXKLCZWODPYIV-JOCHJYFZSA-N 393.491 2.533 0 50 GFAA N[C@H]1C[C@H](c2cc(NCCc3nc(O)c4ccccc4n3)nc(C3CC3)n2)C1 253534848 LFDZZZGLIJHWGQ-HDJSIYSDSA-N 376.464 2.862 0 50 GFAA CC(C)CN1C[C@@H](C(=O)N2CCC3(CC2)OCCc2ccsc23)CC1=O 540915998 GUEOKHSLCBAXJC-INIZCTEOSA-N 376.522 2.643 0 50 GFAA CC(C)=CCN1CCC2(CC[C@@H](CNC(=O)N(C)Cc3cc[nH]n3)O2)CC1 584886519 HPNWZDSVJAIBLB-SFHVURJKSA-N 375.517 2.531 0 50 GFAA Cc1ccccc1[C@@]1(O)CCN(C(=O)NCCc2noc(C3CCCC3)n2)C1 584901861 AJXABIGFYQYKDL-OAQYLSRUSA-N 384.480 2.881 0 50 GFAA CC[C@H](O)Cn1nc(-c2ccc(N(C)CC)cc2)nc1CCn1cc(C)cn1 1875324988 PWUYUWSHJHLZKW-IBGZPJMESA-N 382.512 2.920 0 50 GFAA Cn1ccc(-c2noc([C@@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)cc1=O 952895943 YGRAMULFQRIRTR-QGZVFWFLSA-N 391.353 2.541 0 50 GFAA O=C(c1csc(-c2ncccn2)n1)N1CCC[C@H](OCc2ccccn2)C1 952971746 VMPSEXGFXRXQSL-HNNXBMFYSA-N 381.461 2.817 0 50 GFAA O=C(CC1(n2cccc2)CCSCC1)NC1CCN(C(=O)C2CC2)CC1 888105059 VSJJXYSTIRRQNE-UHFFFAOYSA-N 375.538 2.618 0 50 GFAA COc1cc(OC)c(C(=O)Nc2ccc3c(c2)N(C)C(=O)[C@H](C)O3)cc1OC 952986551 IAZKIJRAUVNOIY-NSHDSACASA-N 386.404 2.708 0 50 GFAA COc1ccccc1[C@H]1CN(C(=O)c2cc3c(nc2O)CCCC3)C[C@@H]1C(=O)O 1565514815 LAINFHROBXDRED-SJORKVTESA-N 396.443 2.615 0 50 GFAA CC(C)COc1cn(-c2ccccc2)nc1C(=O)N1CCO[C@]2(CCOC2)C1 186035689 QSMPZRUEFKVEPC-OAQYLSRUSA-N 385.464 2.539 0 50 GFAA Fc1ccc2oc(N3CCC[C@@H](c4[nH]ncc4CN4CCOCC4)C3)nc2c1 275745092 VUFRROSIZYNTHZ-CQSZACIVSA-N 385.443 2.906 0 50 GFAA CC(C)(C)c1noc(CCCC(=O)N2CCNC(=O)[C@H]2c2ccccc2F)n1 170594191 QPZBQYJSYXPYAU-QGZVFWFLSA-N 388.443 2.529 0 50 GFAA C[C@H](O)[C@](C)(CNC(=O)CCN1C(=O)COc2ccccc21)Cc1ccccc1 170611684 IXROESUSKBHBAA-SBUREZEXSA-N 396.487 2.548 0 50 GFAA COc1ccc(CNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)cc1C(=O)O 408526014 UWLJGPFKNHQJNM-SNVBAGLBSA-N 386.429 2.756 0 50 GFAA O=C(NCC1CCN(Cc2ccccc2)CC1)[C@@H]1COCCN1C1CCCC1 192906013 OWGHQNSVWMJJIH-QFIPXVFZSA-N 385.552 2.658 0 50 GFAA COc1ccc(C(=O)NS(=O)(=O)c2cccc(C)c2Cl)nc1Cl 766888529 JMRPSGHKRSLJKW-UHFFFAOYSA-N 375.233 2.824 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cccs1 788418509 ZZHRNNIQDDDZHB-SNVBAGLBSA-N 389.882 2.934 0 50 GFAA Cc1cnc(C)c(N2CCN(C[C@@H]3CN(Cc4ccccc4)CCCO3)CC2)n1 1506401966 PDQRTBMFNCGEGY-JOCHJYFZSA-N 395.551 2.507 0 50 GFAA CC(C)CN1CCNC(=O)[C@@H]1CC(=O)NC1c2ccccc2-c2ccccc21 11818463 ZZYYVDWNEIINFI-FQEVSTJZSA-N 377.488 2.719 0 50 GFAA CC(C)c1cc(CN2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)n[nH]1 11820252 RBANNNMMICDJQE-HNNXBMFYSA-N 386.500 2.542 0 50 GFAA Cc1cc(-c2nnc(CCC(=O)N(C)[C@@H](C)c3ccc4c(c3)OCCO4)o2)no1 11838719 JYUGKMNBMUGWFX-ZDUSSCGKSA-N 398.419 2.956 0 50 GFAA O=C(NCCc1cccs1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12200794 MUEVSCTUDWYWKL-KRWDZBQOSA-N 389.565 2.520 0 50 GFAA Cc1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)c3n[nH]c4c3CCC4)C2)o1 12316618 LRFUXTFEJATFJO-OAHLLOKOSA-N 384.480 2.749 0 50 GFAA O=C(Nc1ccc(-c2cscn2)cc1)[C@@H]1CCCN(C(=O)Cn2cccn2)C1 12387506 PNFRKTQPTKTFED-MRXNPFEDSA-N 395.488 2.884 0 50 GFAA CCOCCCN[C@@H]1CCc2c(c(C(=O)NC)nn2CC2CCCCC2)C1 14754687 FMKPOIIFSWGJEC-QGZVFWFLSA-N 376.545 2.697 0 50 GFAA Cc1nc(N2CCC[C@H]2C(=O)NCC2(O)CCCCC2)nc2ccc(F)cc12 14879207 LFEOTSCWGVTPDD-SFHVURJKSA-N 386.471 2.858 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 15064380 ZZTOAXPNJOKSMW-LJQANCHMSA-N 399.535 2.681 0 50 GFAA COC(=O)CC[C@H]1CN(Cc2cc(C)ccc2C)CC[C@H]1N1CCN(C)CC1 19853319 FGOOJZOLHIURRR-RBBKRZOGSA-N 387.568 2.695 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCCn4nccc4C)C3)nc2c1 1857739133 DJTQKNJGFNZDTR-MRXNPFEDSA-N 397.479 2.764 0 50 GFAA C[C@H](CCNS(=O)(=O)c1ccccc1)NC(=O)c1cccc2c1ccn2C 241316902 LVXAXWLCYZSSFR-OAHLLOKOSA-N 385.489 2.665 0 50 GFAA O=C(N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1)C1(CO)CC1 2100483929 SCMLNWPQGAEVFA-NRFANRHFSA-N 380.488 2.723 0 50 GFAA NC(=O)C1CCC2(CC1)CC(NC(=O)NC[C@]1(c3ccccc3)CCCO1)C2 2325780655 FRCFEJZEYFHVKS-SISMUFEVSA-N 385.508 2.816 0 50 GFAA Cn1cc(-c2cccc(CN[C@@H]3C[C@H](Cn4cc(Cl)cn4)C[C@H]3O)c2)cn1 2325785529 CPCDCTIRBHCPMY-CWFSZBLJSA-N 385.899 2.866 0 50 GFAA O=C(NCC1CCN(c2ncnc3[nH]ccc23)CC1)c1ccc(OCCF)cc1 2325806463 XAQKOAUSGPOCCR-UHFFFAOYSA-N 397.454 2.953 0 50 GFAA O=C(N[C@@H](CNC(=O)[C@@H](O)C1CCCC1)c1ccccc1)[C@@H]1CCCCS1 2325860458 IXKKADMKSPHYAH-FHWLQOOXSA-N 390.549 2.797 0 50 GFAA Cc1nc2sccc2c(=O)n1NC(=O)c1cccc(Oc2cnccn2)c1 134379821 LJYFTAHEFSVFPC-UHFFFAOYSA-N 379.401 2.733 0 50 GFAA COc1cc2c(cc1O)NC(=O)C[C@H]2c1ccc(OC)c(Cn2cncn2)c1 65373013 PMDUNDSINMGXSG-AWEZNQCLSA-N 380.404 2.523 0 50 GFAA O=C(c1cccc2ccccc12)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 67601903 IIQJYLDAAGJUKV-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccn2)cc1 11932794 XQJIXQPLUZXFTR-LJQANCHMSA-N 375.432 2.819 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3cc(C4CC4)n[nH]3)C[C@H]2NC(=O)C2CC2)cc1 77298329 OVMFMMMZQSKLHD-FXAWDEMLSA-N 378.476 2.730 0 50 GFAA COc1ccc(CNC(=O)CNC(=O)CCc2ccc3ccccc3n2)cc1 485940566 LTJYYHTZUNQNAN-UHFFFAOYSA-N 377.444 2.609 0 50 GFAA CCn1c(=O)c(O)nc2cc(C(=O)N3CCC[C@@H](c4ccncc4)C3)ccc21 328592074 VSDLVSKEKJCWGE-MRXNPFEDSA-N 378.432 2.537 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)c3c[nH]c(C)cc3=O)CC2)OC1=O 77506158 JJHPROCKGIIMGT-UHFFFAOYSA-N 375.469 2.547 0 50 GFAA COc1cccc(OC)c1-c1cnnc(NCc2ccccc2-n2cncn2)n1 11662781 RLIVCRHGZHJCHL-UHFFFAOYSA-N 389.419 2.749 0 50 GFAA O=C(c1cnc2ccccn2c1=O)N1CCC[C@H](COc2ccc(F)cc2)C1 77377390 HOIQQOULDUBDHW-HNNXBMFYSA-N 381.407 2.765 0 50 GFAA Cc1ccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cc1 71753164 NHNARMSFWQBBGP-FQEVSTJZSA-N 383.536 2.934 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1ccc(CC(=O)O)cc1 217614395 VPZFHNULFOWYNS-HNNXBMFYSA-N 385.372 2.571 0 50 GFAA biogenic O=C1CN(Cc2ccccc2Cn2cccn2)CCN1Cc1cccc(F)c1 72154979 BQBFFPYXNVHJOP-UHFFFAOYSA-N 378.451 2.915 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 452946876 VKBCDWAZHKSCAH-BTYIYWSLSA-N 387.455 2.728 0 50 GFAA O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)c1ccc(N2CCCC2)nc1 130753768 RHNVVMYLKDUXEV-KRWDZBQOSA-N 382.439 2.746 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC(n2cc(-c3ccccn3)nn2)CC1 48090859 SUWGTMDGCDHVOP-UHFFFAOYSA-N 377.404 2.546 0 50 GFAA C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCCc1cn2ccccc2n1 287129552 ONSXHMHPXTYJDS-OAHLLOKOSA-N 393.495 2.912 0 50 GFAA C[C@@H]1CN(c2ccc(NC(=O)[C@H]3COCCO3)cc2C(F)(F)F)C[C@@H](C)O1 242302391 YSEZLZFSBGFKMJ-XHBSWPGZSA-N 388.386 2.673 0 50 GFAA CCc1cc(N2CCC(NC(=O)CCc3ccc(OC)c(OC)c3)CC2)ncn1 177163436 XBRXIVBUZSFGFJ-UHFFFAOYSA-N 398.507 2.774 0 50 GFAA COC(C)(C)CS(=O)(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 289631130 YPUNJIJBMKNWFP-CQSZACIVSA-N 397.472 2.810 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3C[C@@H](C)Oc4cc(C)ccc43)CC2)n1 178226201 KVYVGCYRIDEZET-OAHLLOKOSA-N 382.464 2.824 0 50 GFAA Cc1c(S(=O)(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)cnn1C 292368069 QSHJBGVIJYXQGL-UHFFFAOYSA-N 376.457 2.917 0 50 GFAA Cc1[nH]c2c(F)cc(F)cc2c1CCNC(=O)N1C[C@@H]2CCC[C@H](C1)C(=O)N2 426361225 QTTDSJTZSTZQCK-OCCSQVGLSA-N 390.434 2.607 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)c1 91620846 ZLMKEPKKRKIHMA-QGZVFWFLSA-N 386.492 2.724 0 50 GFAA Cc1c(C(=O)N[C@H](Cn2ccnc2)c2ccccc2)sc2[nH]cnc(=O)c12 426550379 HGCNFSBFNZWQSW-CQSZACIVSA-N 379.445 2.661 0 50 GFAA O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1cn(C2CCNCC2)nn1 238080790 GUXYWKYONCNWRV-UHFFFAOYSA-N 396.476 2.769 0 50 GFAA NC(=O)c1ccc(-c2cccc(C(=O)NCCc3nc4c(s3)CCC4)c2)o1 426434170 WZWHUQGVZUREOK-UHFFFAOYSA-N 381.457 2.963 0 50 GFAA C[C@@H](c1ccccn1)N(C)C(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C 95383248 PFJARKDPRXQYSB-HNNXBMFYSA-N 379.464 2.638 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@H](c2nccn2Cc2ccncc2)C1 91462195 VBGWKDVOQSTVEL-SFHVURJKSA-N 386.459 2.994 0 50 GFAA O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)Nc1cccc(Cl)c1Cl 239309222 HIJAFHPBJXZJSR-YEQVQXDCSA-N 384.215 2.673 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NS(=O)(=O)C2CC2)cc1 91663861 KNRLNOXOPIVQGW-QGZVFWFLSA-N 375.494 2.976 0 50 GFAA Nc1nc(NCC2CCN(CCc3ccccc3)CC2)cc([C@H]2C[C@@H](O)C2)n1 252536138 HQNQBBLHBYCYIR-KDURUIRLSA-N 381.524 2.664 0 50 GFAA c1ccc(-c2cnn3cc(CN4CCN(C[C@H]5CCCO5)CC4)cnc23)cc1 67954478 PYYSKKYUFKVVRK-HXUWFJFHSA-N 377.492 2.693 0 50 GFAA O=C(NCc1nc(Cc2ccccc2)no1)[C@H]1CCCN(Cc2ccco2)C1 827733153 GQQYBCSQXYUAHF-KRWDZBQOSA-N 380.448 2.782 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3ccccc3[C@H]2C(=O)OC)cc1 1875371972 SKLNIANTXBWDED-FQEVSTJZSA-N 378.428 2.748 0 50 GFAA O=C(Cc1cc(-c2ccccc2Cl)on1)Nc1cc(N2CCNCC2)ccn1 1875305667 XCPPNJAUXUQTQE-UHFFFAOYSA-N 397.866 2.981 0 50 GFAA O=C(N[C@H]1[C@@H]2CN(C(=O)[C@@H]3CCN(c4ccccc4)C3)C[C@@H]21)c1ccc(F)cc1 1875325557 OZVABSSPTZMMET-DBOLQNLKSA-N 393.462 2.539 0 50 GFAA C[C@@H](NC(=O)Nc1ccc(F)c(N2CCOCC2)c1)[C@@H]1C[C@H](C(=O)O)C1(C)C 952853114 KWVWYRKVCRWNMI-VHDGCEQUSA-N 393.459 2.919 0 50 GFAA C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)c1cnc(C2CCC2)nc1O 1875278648 RGRYLHZOAIDNFT-IBGZPJMESA-N 375.856 2.827 0 50 GFAA C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1c[nH]nc1C(=O)NC1CC1 1875298729 LQNREMYRRGKRAV-SECBINFHSA-N 382.342 2.727 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(CNC(=O)c3ccoc3)CC2)C2(CCCCC2)O1 952968367 MSGYIOJIAOAEQQ-KRWDZBQOSA-N 388.464 2.514 0 50 GFAA c1cnc(Oc2ccc(Cc3noc([C@@H]4CCc5nn[nH]c5C4)n3)cc2)nc1 1775960475 NRTMBCFTWWQRNA-CYBMUJFWSA-N 375.392 2.633 0 50 GFAA Cc1cc(C)cc([C@@H](C)Nc2ccc(C(=O)N3CCS(=O)(=O)CC3)cn2)c1 276214383 KIKQLOJRXYRUFU-MRXNPFEDSA-N 387.505 2.742 0 50 GFAA COCc1cc(CNS(=O)(=O)CCc2ccc3c(c2)CCO3)ccc1F 189636821 RLVFFILHKOFQLY-UHFFFAOYSA-N 379.453 2.569 0 50 GFAA O=C(NCCN1CCc2sccc2C1)[C@H]1CCCN1C(=O)c1ccccc1 193439260 AUPUKUHWGFOOMX-GOSISDBHSA-N 383.517 2.527 0 50 GFAA CCCCN(Cc1cccc(Cl)c1)S(=O)(=O)N1CCC(C(=O)O)CC1 1506396203 BCTPZNBCLXEPQE-UHFFFAOYSA-N 388.917 2.984 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3c(C)ncnc3C)CC1)OCC2 1704349829 KMUBYWYSWOTGBY-UHFFFAOYSA-N 397.475 2.815 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)[C@H](C)Oc1ccc(F)cc1Cl 1704315879 PZRSOJMZGGZSGQ-ZDUSSCGKSA-N 382.867 2.868 0 50 GFAA CCOC(=O)C1(CCOC)CCN(Cc2cc(OC)c(OC)cc2OC)CC1 12297739 XWMWAMCAWYELKT-UHFFFAOYSA-N 395.496 2.894 0 50 GFAA COc1ccc(CCN2CCC[C@@H](CN(C)C(=O)Cn3ccc(C)n3)C2)cc1 12597814 IDHPHGXAHXORBX-FQEVSTJZSA-N 384.524 2.613 0 50 GFAA CCc1nc2cc(N)cc(C(=O)N(C)Cc3nccs3)c2n1CCCOC 14989250 CXZYZTUHMIWSJK-UHFFFAOYSA-N 387.509 2.946 0 50 GFAA CO[C@@H](C(=O)N1CCOc2ccc(CN3CCOCC3)cc2C1)c1ccccc1 14993669 WGCLDNRWNSOFTO-JOCHJYFZSA-N 396.487 2.628 0 50 GFAA Cc1ncn(C)c1C(=O)N1CCC[C@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857674253 ZXXCNOOOIPSSKO-NRFANRHFSA-N 383.496 2.642 0 50 GFAA COc1ccc2cc([C@H]3CN(c4ccc(C(=O)N(C)C)nn4)CCO3)ccc2c1 1857679607 NZYHBWQGNSLNBG-HXUWFJFHSA-N 392.459 2.918 0 50 GFAA O=C([C@H]1CC[C@@H](O)[C@H](Nc2cc(C3CC3)ncn2)C1)N1CCc2ccccc2C1 1857683955 SPQFYZGDJJKILF-IOMROCGXSA-N 392.503 2.880 0 50 GFAA CCOC(=O)c1coc(N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857706105 KPNNXWNJVAMNGC-FQEVSTJZSA-N 384.436 2.709 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCC4(CO)CCCC4)CC3=O)sc2c1 1857718716 PWVYNLGHJHBDBI-CQSZACIVSA-N 387.505 2.627 0 50 GFAA CN1CCc2ccc(NC(=O)c3nc(N4CCCC4)ncc3Cl)cc2C1=O 151128882 OMDXAYBQMYWEMI-UHFFFAOYSA-N 385.855 2.611 0 50 GFAA CN(C)[C@H]1C[C@H]2C[C@@H](N(C)S(=O)(=O)c3ccc(-c4ccno4)o3)C[C@H]2C1 2100547391 IRLWYYDBKYHVMS-NMWPEEMBSA-N 379.482 2.674 0 50 GFAA O=C(/C=C/c1cn(Cc2ccccc2)nn1)N1CCN[C@H](c2cccc(F)c2)C1 2325700881 JEKROGYEDNMKAC-GLCJEOIMSA-N 391.450 2.652 0 50 GFAA COc1ccc(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)c2c1CNCC2 2325768554 XPEUZJFDFMTEMK-UHFFFAOYSA-N 377.448 2.903 0 50 GFAA Cc1ccc2[nH]c(C(=O)NC[C@](C)(N)Cn3cccn3)cc2c1Br 2325774909 FIJMPMAQMYLUAO-KRWDZBQOSA-N 390.285 2.583 0 50 GFAA CO[C@@H]1COCC[C@@H]1Cn1nnnc1N1CCC[C@@H](CCCc2ccccc2)C1 2325842333 VDJMIJUIBMMUDF-NJDAHSKKSA-N 399.539 2.964 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2C[C@H](O)CCC2(C)C)cc1Br 2325874533 PYDRCFZFDCZYHA-GFCCVEGCSA-N 376.316 2.990 0 50 GFAA COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc(OC)cc2OC)c1 980416 GKTHRGJLXXMYFX-UHFFFAOYSA-N 376.434 2.848 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)NCc2ccccc2)c(Cl)c1 1057355 RPBCOBPOBLSBEH-UHFFFAOYSA-N 396.896 2.722 0 50 GFAA CCOC(=O)CN1C(=O)[C@@](O)(CC(=O)c2ccc(Cl)s2)c2ccccc21 1109334 NMCDCCOQHZNNII-GOSISDBHSA-N 393.848 2.772 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cnc4cccnn34)C2=O)cc1 2356147393 UISCEFYZXCWAHF-JOCHJYFZSA-N 389.459 2.840 0 50 GFAA Cc1ccc(NC(=O)CN(c2ccc3c(c2)OCO3)S(C)(=O)=O)cc1Cl 4434714 ZGECZOPZNPYWGY-UHFFFAOYSA-N 396.852 2.782 0 50 GFAA CCOc1ccc(CN2CCc3nnc([C@@H](CC(C)C)NC(C)=O)n3CC2)cc1 20601470 AKNRIDMNFBHHDR-HXUWFJFHSA-N 399.539 2.958 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc4occc4c3)CC2)C1 67695001 QGRBKPQYCNRLTM-HXUWFJFHSA-N 399.535 2.872 0 50 GFAA COc1ccc(C2(C(=O)NCc3ccc4c(c3)OCCO4)CCOCC2)cc1 140131478 MQHKDWFQYKFODW-UHFFFAOYSA-N 383.444 2.831 0 50 GFAA CCOc1c(CNCCCN2CCOCC2)cc(Br)cc1OC 20477824 LPZBARRNRQWXPH-UHFFFAOYSA-N 387.318 2.668 0 50 GFAA OCCOc1cccc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)c1 20540576 DGDVNHVNRKINMU-QHCPKHFHSA-N 398.547 2.559 0 50 GFAA CC(C)C(=O)N1CCCC[C@@H]1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 474832988 QWLXSONCNNDBTI-LJQANCHMSA-N 390.499 2.759 0 50 GFAA N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC(c2cc(-c3ccccc3Cl)[nH]n2)CC1 67689138 LPBAENZSPLSMCX-KRWDZBQOSA-N 398.898 2.729 0 50 GFAA O=C(CN1CCCCC1=O)N[C@H]1CCCc2c1cnn2-c1ccc(F)cc1F 12111750 DAXGNLYPYAMMOQ-INIZCTEOSA-N 388.418 2.657 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N1CC[C@H]2[C@@H](CCCN2C)C1 152584026 UJCDIQWYDBVBOD-WMZOPIPTSA-N 388.512 2.735 0 50 GFAA CN(C(=O)Cn1cnc(-c2ccccc2)n1)[C@@H]1CCCN(c2ccccc2)C1=O 152673853 MMXVCXCZEGKMBC-LJQANCHMSA-N 389.459 2.599 0 50 GFAA O=C(c1cccc(CNc2ccncn2)c1)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 329470418 YFBRAYZTDLFMKR-TZIWHRDSSA-N 391.519 3.178 0 50 GFAA CC(C)Oc1ncccc1C(=O)N1CCOC[C@H]1c1ncnn1-c1ccccc1 284551960 PZADKOXYHCEONA-SFHVURJKSA-N 393.447 2.663 0 50 GFAA O[C@H]1[C@H](n2cc(-c3cc(F)cc(F)c3)nn2)c2ccccc2C12CCNCC2 72159443 YBSNEJQQRGLRHC-UXHICEINSA-N 382.414 2.808 0 50 GFAA C[C@@]1(c2ccc(F)cc2)CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1 483011633 YZPTZOJRRYBACI-JOCHJYFZSA-N 382.483 2.533 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2ccc(-n3ccc(C)n3)nn2)CC1 72115793 MVFQIEUZFMVECS-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA Cn1cc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CCC2)c(O)nc1=O 375327873 RNRHEJJOJACESP-CQSZACIVSA-N 381.354 2.776 0 50 GFAA CN1CSC[C@H]1C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 72479385 OYTDBXVRXBRACL-FQEVSTJZSA-N 381.545 2.925 0 50 GFAA O=C(c1ccsc1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71681609 MPEVUVCHEUPPOI-INIZCTEOSA-N 375.538 2.687 0 50 GFAA COc1ccccc1C(=O)N1CCN(Cc2cnc(-c3ccco3)nc2)CC1 72152043 YLYIOSNVKORVRC-UHFFFAOYSA-N 378.432 2.703 0 50 GFAA CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(C(=O)NCC2(c4ccc(F)cc4)CCOCC2)[C@H]31 287235932 QVTATTUQASVVQN-TYIJSKFUSA-N 388.483 2.939 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)Nc2ccc(CN)cc2)cc1 131728776 DZQJKCVYDDDYJI-IBGZPJMESA-N 389.521 2.785 0 50 GFAA COc1ccccc1C1=NO[C@@H](C(=O)Nc2ncn(Cc3ccc(F)cc3)n2)C1 20602004 YRIMVBLBPYQRQZ-GOSISDBHSA-N 395.394 2.606 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)Nc3cccc(-c4nncn4C)c3C)C2)n[nH]1 426423836 XVYZERMPPSVOIQ-AWEZNQCLSA-N 380.456 2.629 0 50 GFAA CNC(=O)CN1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95509702 BCJXSLPFVOAETD-UHFFFAOYSA-N 385.552 2.706 0 50 GFAA Cc1ccc(N2CCN(C(=O)Nc3cccc(NS(C)(=O)=O)c3)CC2)cc1 95504232 IPAFTNUJQZYQDF-UHFFFAOYSA-N 388.493 2.721 0 50 GFAA Cc1cc(-c2ccc(C(=O)N3CC[C@@H]4CC[C@H](C3)N4C)cc2)nc(N(C)C)n1 426526853 KOFYUGHJCFMSQI-RBUKOAKNSA-N 379.508 2.827 0 50 GFAA COc1cccc([C@@H]2CN(C(=O)c3n[nH]c4c3CCC4)[C@@H]3C4CCN(CC4)[C@H]23)c1 95360133 MYGOBWDFCOSPRU-VLCRHTCISA-N 392.503 2.609 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)CCc2ccc(O)cc2)C1 95530019 XFLXKKINQLRGDJ-IBGZPJMESA-N 384.524 2.879 0 50 GFAA Cn1cc(-c2cc(CN(c3ccc(Cl)cc3F)S(C)(=O)=O)on2)cn1 184421069 HUSNFQIXOLSOCG-UHFFFAOYSA-N 384.820 2.834 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCCc4ccccc4)c3CO2)cc1 263619543 ZDRVKGZZJBXJSQ-LJQANCHMSA-N 378.432 2.531 0 50 GFAA O=C1c2c(-c3nc(-c4ccccc4)no3)nnn2CCN1Cc1ccc(F)cc1 263616136 HHQAHPNANJJIIX-UHFFFAOYSA-N 390.378 2.790 0 50 GFAA COc1ccccc1-n1cc(CNC(=O)C2(N3CCOCC3)CCCCC2)cn1 670468383 ONNPJNLGWSZHMZ-UHFFFAOYSA-N 398.507 2.532 0 50 GFAA COc1cccc(NC(=O)CN(C)C(=O)c2cc(Cc3ccccc3)[nH]n2)c1 1875253526 YKCVUWBOSZYCGM-UHFFFAOYSA-N 378.432 2.720 0 50 GFAA O=C(C[C@@H]1COc2ccccc2O1)NS(=O)(=O)Cc1c(F)cccc1Cl 1875289328 IYIYKWNERCDVGR-LLVKDONJSA-N 399.827 2.655 0 50 GFAA CC(=O)NCc1nc(CNC(=O)NCc2cccc(C(F)(F)F)c2)cs1 1875273337 QJHITOUKPZOFAJ-UHFFFAOYSA-N 386.399 2.797 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)c3cccc4c3OCC4(C)C)Cc3c[nH]nc32)n[nH]1 1875393997 XFEDISCFIFYJNU-CQSZACIVSA-N 392.463 2.548 0 50 GFAA Fc1cnc(N2CC[C@](c3nc(-c4ccccn4)no3)(C(F)(F)F)C2)cn1 952892529 DPGQCYYTXPVMIW-HNNXBMFYSA-N 380.305 2.771 0 50 GFAA CO[C@H](CNCc1ccc2c(c1)N(C(=O)OCc1ccccc1)CC2)C(=O)O 1777148803 NNPNAHYIKWTQQV-LJQANCHMSA-N 384.432 2.575 0 50 GFAA O=C(c1cccc(Cl)c1F)N1C[C@@H]2CN(CC3CCC3)C[C@]2(C(=O)O)C1 1565525829 ZYHZVXUIKBYXRD-DJJJIMSYSA-N 380.847 2.738 0 50 GFAA CC(C)Oc1ncc(C(=O)OCCCn2nc3ccccn3c2=O)cc1Cl 170635908 WOEKRQUXIVRLJR-UHFFFAOYSA-N 390.827 2.579 0 50 GFAA Nc1nnc(CCNc2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)o1 170603346 VTVMDPRJDHFBDI-UHFFFAOYSA-N 391.222 2.718 0 50 GFAA O[C@@H](CC1CCCC1)CN1CCN(Cc2nc(-c3cccs3)no2)CC1 190370940 GUMJZHGNMMQCPY-INIZCTEOSA-N 376.526 2.857 0 50 GFAA C[C@H](C(=O)NCc1cccc(CN2CCOCC2)c1)N1CCc2ccccc21 195082588 SDNCYOBLHJPXSV-GOSISDBHSA-N 379.504 2.586 0 50 GFAA Cc1cnc([C@H](NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)C2CC2)s1 195305808 FJUUFFBQJLQMJZ-OAHLLOKOSA-N 379.507 2.583 0 50 GFAA O=C(CN1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1)NC1CCCCCC1 1704344958 YGEYDCOQYTVAQI-XMSQKQJNSA-N 381.520 2.909 0 50 GFAA CC1(C)C[C@@H](O)CCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704312174 MNOVZMHMIVTSGV-KRWDZBQOSA-N 399.491 2.801 0 50 GFAA O=C(O)/C=C/C(=O)Nc1ccc(-c2ccc(NC(=O)/C=C/C(=O)O)cc2)cc1 833024 FTLRWRKPUWMOMS-WGDLNXRISA-N 380.356 2.512 0 50 GFAA CCCC[C@H]1CN(c2cc(C(=O)N3CCOCC3)ccn2)C[C@@H](C(C)C)O1 1615737382 VMRFPMKUUBJRTG-OALUTQOASA-N 375.513 2.974 0 50 GFAA Cn1c(CCNC(=O)/C=C/c2cccs2)nnc1SCc1ccccn1 11909931 QZRQSNXKRKXAHI-BQYQJAHWSA-N 385.518 2.936 0 50 GFAA COc1ccccc1CNc1ncnc2sc(C(=O)N[C@@H](C)CO)c(C)c12 12122635 FHLWRGJGQZTQCS-NSHDSACASA-N 386.477 2.731 0 50 GFAA O=C(Nc1ccc(-c2cscn2)cc1)[C@H]1CCCN(C(=O)Cn2cccn2)C1 12387507 PNFRKTQPTKTFED-INIZCTEOSA-N 395.488 2.884 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N(C)CCc3cnn(C)c3)no2)c1 12576612 IIBOGUKYWFWBAC-UHFFFAOYSA-N 382.420 2.504 0 50 GFAA CC(C)CCN1C(=O)N(CC(C)C)C(=O)C12CCN(Cc1cnn(C)c1)CC2 14533937 GSNZIFICMBUPOI-UHFFFAOYSA-N 389.544 2.721 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(Cc1cccc(O)c1)CC2 14744296 DOXSYZUZKIWTDN-UHFFFAOYSA-N 394.475 2.606 0 50 GFAA COc1cc(CN2CCC[C@@H](CCC(=O)N3CCN(C)CC3)C2)ccc1F 15074783 XQHIILYAFGYIGV-KRWDZBQOSA-N 377.504 2.601 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NCc1ccccc1 16607534 BLHSYVNKANJNGA-UHFFFAOYSA-N 388.489 2.800 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(C(C)C)C(=O)[C@H]3ON2c2ccccc2)c(OC)c1 18191026 VVSVAJQQYLURHZ-ZCNNSNEGSA-N 396.443 2.959 0 50 GFAA C=Cc1ccc(Cn2c(=O)c(-c3noc(CC)n3)c3n(c2=O)CCCC3)cc1 169763852 XQTWPMWHUCNFBL-UHFFFAOYSA-N 378.432 2.650 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857672749 HCKRSJWNAAEEJD-ZEYPLWLESA-N 379.456 2.943 0 50 GFAA COc1cc2c(cc1-c1nccn1-c1ccc(S(C)(=O)=O)cc1)OCCO2 1857690201 WGKGXHBARWPSDO-UHFFFAOYSA-N 386.429 2.723 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)cc1O 1857706305 PTDDBCAQZKQPEE-JOCHJYFZSA-N 395.459 2.894 0 50 GFAA C[S@@](=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 4899536 CEHRSUBRZOGRSW-MYUZEXMDSA-N 387.457 2.747 0 50 GFAA biogenic,in-vitro COc1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)c(OC)c1 19881441 DPKRIZLCZDJBBB-MRXNPFEDSA-N 387.413 2.826 0 50 GFAA Cn1cnc2cc(C(=O)N3CCCC[C@H]3CNC(=O)c3ccccc3)ccc21 153215341 XWUMZBHCIJQKOL-SFHVURJKSA-N 376.460 2.998 0 50 GFAA CCS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOC[C@@H]2CC(F)F)c1 804723245 UXNPGBGUZBLLKQ-JTQLQIEISA-N 381.828 2.630 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)N2CCCCC2)CC[C@@H]1NC(=O)c1c(C)n[nH]c1C 2100482217 IFECZTLXVVXBTR-BZSNNMDCSA-N 390.528 2.733 0 50 GFAA O=C(O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@@H]2CCCn3cnnc32)CC1 2325778010 XEJOTMHESXCMBJ-QZTJIDSGSA-N 382.464 2.653 0 50 GFAA Cc1coc(C)c1C(=O)N1CCN(C2CN(C(=O)C[C@H](C)CC(C)C)C2)CC1 2325794029 OOTXWXHXXCOZMA-MRXNPFEDSA-N 389.540 2.937 0 50 GFAA CCC(=O)N[C@@](Nc1ccc(OC(F)(F)F)cc1)(C(=O)OC)C(F)(F)F 2190752 UCIHCGBFAWQQHO-LBPRGKRZSA-N 388.264 2.955 0 50 GFAA CC(C)(C)c1nnc(NC(=O)CSc2nnnn2-c2ccccc2)s1 4903928 IDGYOWIJUJVAGK-UHFFFAOYSA-N 375.483 2.542 0 50 GFAA CN(c1ccc(C(=O)N[C@@H]2CCCC[C@@H]2O)cc1)S(=O)(=O)c1ccccc1 5509936 BSXBHHRLIYNZHV-MOPGFXCFSA-N 388.489 2.545 0 50 GFAA CCc1c(C)sc(NC(=O)c2ccn(CC)n2)c1C(=O)N1CCOCC1 6726390 KSXLXVJRRNLMBK-UHFFFAOYSA-N 376.482 2.560 0 50 GFAA CC(=O)c1cccc(OCc2cc(C(=O)N(C)Cc3c(C)n[nH]c3C)n[nH]2)c1 12300689 MKXXECTWGNOHLF-UHFFFAOYSA-N 381.436 2.803 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)CCCn1cncn1 12438239 DLWSMQDTIVNNMF-UHFFFAOYSA-N 387.503 2.611 0 50 GFAA CCN1C[C@H](CN(C)Cc2nc(-c3ccc(OC)cc3OC)oc2C)CC1=O 12472992 LKLGCUJCDPUYIL-HNNXBMFYSA-N 387.480 2.967 0 50 GFAA CCN(C[C@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1csnn1 12759449 YWJMCZXEGRNPRX-KRWDZBQOSA-N 388.537 2.964 0 50 GFAA CN1CCN(C(=O)c2cnn3c2N[C@@H](c2ccccc2)C[C@H]3C(F)(F)F)CC1 13124603 YHYMFGJYGJMYJJ-CVEARBPZSA-N 393.413 2.931 0 50 GFAA COc1cc(OC)c(OC)cc1/C=C1/NC(=O)N(Cc2ccccc2F)C1=O 14009905 PMOMNYZQQZWLLZ-OVCLIPMQSA-N 386.379 2.944 0 50 GFAA COc1ccc2[nH]cc(CCN[C@@H]3CC(=O)N(c4cccc(F)c4)C3=O)c2c1 18088221 GHTLPNWVPFZSPB-LJQANCHMSA-N 381.407 2.780 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)cc2)c(=O)[nH]n1 35229544 QCRJOPWCUWMEKM-ZUEVXXBESA-N 389.521 2.772 0 50 GFAA O=C(c1ccc2c(c1)CCO2)N1CCC(n2cc(-c3cccnc3)nn2)CC1 48159158 FNBVVOIJYAAXLM-UHFFFAOYSA-N 375.432 2.752 0 50 GFAA CCN(Cc1cnc(S(C)(=O)=O)n1CC1CCCCC1)C[C@H]1CCCO1 55042408 LZNHSPHWHRCRHG-GOSISDBHSA-N 383.558 2.868 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(Cc4cnc5ccccn45)[nH]c3C2)c1 65436324 HEYSYFWWFBUAOJ-OAHLLOKOSA-N 387.443 2.727 0 50 GFAA CO[C@@H]1CCCN(c2ccc(C(=O)NCCCn3ccnc3C(C)C)cn2)C1 67921177 KAFIXSLIHWTRKH-GOSISDBHSA-N 385.512 2.837 0 50 GFAA CN(CC1(N2CCCCC2)CCCCC1)C(=O)[C@H]1Cc2ccccc2C(=O)N1 72425264 WXLSMJBVRLUPHB-HXUWFJFHSA-N 383.536 2.988 0 50 GFAA Cc1cccc(N2C[C@H](C)N(C(=O)c3ccc(SCCO)cc3)CC2=O)c1 82092417 VNAVGQPJYGMQJP-INIZCTEOSA-N 384.501 2.957 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccc4[nH]cnc4c3)CC2)CN1C[C@@H]1CCCO1 91326291 GKUCOEAAGBGRRC-KRWDZBQOSA-N 396.491 2.587 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1CCC[C@H](c2ccc(C(=O)O)cc2)C1 95355003 DBTDBCCVOSVSHE-SFHVURJKSA-N 385.464 2.946 0 50 GFAA COc1cc(F)ccc1[C@@H](C(=O)O)N1CCC(CCN2CCCC2=O)CC1 95390612 NGWNKHFVIUSDMY-IBGZPJMESA-N 378.444 2.685 0 50 GFAA Cc1ccc(SCCN(C)C(=O)[C@H]2CC(=O)N(Cc3ccncc3)C2)cc1 97475025 MLYMNEAEPWDILU-SFHVURJKSA-N 383.517 2.989 0 50 GFAA CCc1nnc(-c2ccc(OC)c(NC(=O)N[C@@H](C)c3ncnn3CC)c2)o1 97729999 DQFQGLWPQRFBTR-NSHDSACASA-N 385.428 2.802 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNC(=O)c2cnc(N3CCCC3)nc2)C1 97730022 FUDGIBFOXGSGRV-SFHVURJKSA-N 379.508 2.605 0 50 GFAA CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)C(=O)O 100656460 BSRAGXJNZJMFMY-USXIJHARSA-N 378.469 2.943 0 50 GFAA O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)N1CCOC2(CCCCCC2)C1 120234132 SDUJBDBITOHVPU-IRXDYDNUSA-N 376.497 2.504 0 50 GFAA Cc1cc(O)cc(=O)n1CC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 128804620 ACBJKTTWZTXMHC-UHFFFAOYSA-N 384.461 2.678 0 50 GFAA Cc1cccc(OCC(=O)N2CC[C@H](n3cc(-c4nc(C(C)C)no4)nn3)C2)c1 169781410 HWBHVTGZXOITCA-HNNXBMFYSA-N 396.451 2.612 0 50 GFAA CNC[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2Br)C1 178973615 PBSDARBIMWBLNP-LLVKDONJSA-N 375.694 2.939 0 50 GFAA COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N(C)[C@@H]1CCNC1 179055844 BHMGQQVFJZAJBG-QGZVFWFLSA-N 376.460 2.982 0 50 GFAA O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccnc(OCC(F)F)c1 180954350 FRMGSBDMCVUJSC-CQSZACIVSA-N 375.375 2.540 0 50 GFAA CC(C)COc1cn(-c2ccccc2)nc1C(=O)N1CCO[C@@]2(CCOC2)C1 186035705 QSMPZRUEFKVEPC-NRFANRHFSA-N 385.464 2.539 0 50 GFAA CC[C@H](C)c1ccccc1OCC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 186647209 YBYIHXVYPNEJGI-DLBZAZTESA-N 376.497 2.976 0 50 GFAA Cc1c(C(=O)NCc2ccc3c(c2)CNC3)nnn1-c1ccc(Cl)cc1F 188708636 MBNQAEHNFBJQQI-UHFFFAOYSA-N 385.830 2.901 0 50 GFAA CN(C)[C@@H](CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 193069716 FQTIIZPUZMYAJP-NRFANRHFSA-N 394.519 2.893 0 50 GFAA COC(=O)C[C@H](c1ccc2ncccc2c1)c1c(O)n2ccccc2nc1=O 205961634 SOFZZLPLJSUYGA-OAHLLOKOSA-N 375.384 2.643 0 50 GFAA COc1nc2c(cc1C(=O)N[C@@H]1COCC[C@@H]1OCc1ccccc1)CCC2 222554844 BUWRMOJZJFIUTR-UXHICEINSA-N 382.460 2.683 0 50 GFAA CN1CCN(CC[C@@H]2CCCCN2C(=O)CCc2ccc(F)cc2F)CC1 223144040 LEQLHCVLJHHNHH-IBGZPJMESA-N 379.495 2.916 0 50 GFAA OCC1(COc2c(I)cccc2C(F)(F)F)COC1 225824426 IUYIKCGNSGAGCH-UHFFFAOYSA-N 388.123 2.698 0 50 GFAA COCC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](C(=O)O)C1 237116781 ZTOFSTFDTSNCPP-ZIAGYGMSSA-N 384.270 2.577 0 50 GFAA O=C(CCc1ccccn1)N1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 244719202 LYRGGZVKBWYRCN-MXVIHJGJSA-N 399.535 2.549 0 50 GFAA C[C@@H]1NCCN(C(=O)c2cccc(NC(=O)c3ccc4[nH]cnc4c3)c2)[C@@H]1C 262773529 KJXUKAXYQYOHQV-UONOGXRCSA-N 377.448 2.638 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2)C1 268933767 BCEJNAFKXYDECP-INIZCTEOSA-N 378.226 2.572 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3cc([C@H]4CCCOC4)nn3C)cn2)C[C@@H](C)O1 279356982 PBUORTUJIYWBMB-UXLLHSPISA-N 399.495 2.575 0 50 GFAA CCc1cccc2c(C(C)=O)cn(CC(=O)NCc3cnc4cnccn34)c12 426387023 DUHGHYGWQSIWHV-UHFFFAOYSA-N 375.432 2.765 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC(O)CC3)csc2C1 426414610 LDVDCMVARPNAQA-UHFFFAOYSA-N 375.494 2.508 0 50 GFAA O=C(NCc1cnn(-c2ccc(F)cc2)c1)N1CCC(Cn2ccnc2)CC1 426578882 WJOBHLOOQVUAJB-UHFFFAOYSA-N 382.443 2.830 0 50 GFAA CCc1c(C(=O)NC[C@H](c2ccccn2)N2CCOCC2)[nH]c2ccccc12 426669156 RXEUZEYNSLZJLW-HXUWFJFHSA-N 378.476 2.929 0 50 GFAA C[C@@H](NC(=O)C1CCN(C2CCOCC2)CC1)c1ccccc1-n1cccn1 670444944 XQWUXNDDYULYJV-QGZVFWFLSA-N 382.508 2.941 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)NCCn3cnc(C)c3C)c(C)s2)n[nH]1 825262095 HVDWKUITVMOXRD-UHFFFAOYSA-N 379.511 2.547 0 50 GFAA Cc1ccccc1[C@H](CC(=O)O)NC(=O)c1ccc(CN2CCOCC2)cc1 952832851 XOQSORRQLZYXRT-FQEVSTJZSA-N 382.460 2.773 0 50 GFAA O=C(CCC(=O)Nc1nncs1)Nc1cccc(NC(=O)c2cccnc2)c1 952860391 OPRUWRNFSUHMBX-UHFFFAOYSA-N 396.432 2.543 0 50 GFAA CCCn1ncc(CN2C[C@@H]3COC[C@H](C2)N(Cc2c(C)noc2C)C3)c1C 1772701838 PJHCMAZRTOGKIX-ICSRJNTNSA-N 387.528 2.539 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCCN(C(=O)[C@H](C)Oc3ccccc3)CC2)n1 1772809689 CLVJXDZUHMXRBG-INIZCTEOSA-N 383.448 2.594 0 50 GFAA COc1ccc(N2CCN(C3CCN(C(=O)c4ccccc4)CC3)CC2)cn1 1857670075 OIXPJYWPWRJKQS-UHFFFAOYSA-N 380.492 2.517 0 50 GFAA O=C(O[C@H]1CCN([C@@H]2CCCc3ccccc32)C1=O)c1nc[nH]c2nccc1-2 1875267227 VZOXWKRAHHUJOZ-SJORKVTESA-N 376.416 2.745 0 50 GFAA O=C(c1ccc(N2CCCC2=O)cc1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 1875274529 GCOOTJAZLUHNND-LJQANCHMSA-N 398.484 2.502 0 50 GFAA O=C1N[C@@H](Cc2c[nH]c3cccc(F)c23)C(=O)N[C@H]1Cc1cc2ccccc2o1 1875320245 MLAUQOJSGGLQLU-ROUUACIJSA-N 391.402 2.822 0 50 GFAA Cc1cc(F)ccc1[C@H]1C(=O)NCCN1S(=O)(=O)c1sccc1C1CC1 1875354878 RXHUUOQCUPNLLI-INIZCTEOSA-N 394.493 2.935 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1N=c1[nH]nc(-c2ccccc2Cl)s1 2325785877 RPCCMLIZVOWEGO-NILFDRSVSA-N 375.885 2.729 0 50 GFAA O=C(O)C[C@H]1CN(c2ncnc3[nH]c4cc(Br)ccc4c23)CCO1 2325844211 AQTOJEIGEGYIJF-JTQLQIEISA-N 391.225 2.554 0 50 GFAA CN(c1cncc(-c2ccc(Cn3ccc(C(F)(F)F)n3)cc2)n1)C1CNC1 2325857862 RSCNPCYWNMKDGR-UHFFFAOYSA-N 388.397 2.815 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2cc[nH]n2)C[C@H]1Nc1nc(C)ncc1C 2356154071 HFNFPKOPMLCWHM-CGTJXYLNSA-N 386.500 2.509 0 50 GFAA CC(C)CN1C(=O)c2ccc(C(=O)NCc3ccc4c(c3)OCO4)cc2C1=O 1121566 SQNJRDBKUTTWNK-UHFFFAOYSA-N 380.400 2.597 0 50 GFAA O=C(COC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1)c1ccccc1 1470022 PHMZYEHIPQDOBB-UHFFFAOYSA-N 399.424 2.798 0 50 GFAA CCOc1cc(Br)c(/C=C2/C(=O)N(C)C(=S)N2C)cc1OC 2818789 OHSGSNXINNYARU-WDZFZDKYSA-N 385.283 2.886 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)c2ccc(F)cc2)cc1 2875866 VOBYCZQJFAPDRL-UHFFFAOYSA-N 392.452 2.698 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1S(=O)(=O)N1CCOCC1 6401730 BWGUEUMPNRBJBB-INIZCTEOSA-N 388.489 2.507 0 50 GFAA Cc1nn2cc(CCNc3nc(CCN)nc4sc(C)c(C)c34)nc2s1 65506259 UZKOMXDXUMCMEP-UHFFFAOYSA-N 387.538 2.877 0 50 GFAA O=C(NCCCN1CCOCC1)c1cccc(-c2nnc(-c3ccccc3)o2)c1 20654045 XBOGISHDQNFDEA-UHFFFAOYSA-N 392.459 2.856 0 50 GFAA COc1ccc(OC)c(CN(CC(=O)N2CCO[C@H]3CCCC[C@H]32)C2CC2)c1 230133545 JBBVKFAQDVDLCO-CTNGQTDRSA-N 388.508 2.838 0 50 GFAA CCc1n[nH]c([C@@H]2CN(C(=O)Nc3ccccc3N3CCCCC3)CCO2)n1 152213815 QRJNSJRQQPBZFK-KRWDZBQOSA-N 384.484 2.963 0 50 GFAA CNC[C@@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 237263064 SCYXNYFMULZXRV-ZDUSSCGKSA-N 377.286 2.706 0 50 GFAA O=C1CCCN1CCC1CCN(C(=O)[C@H]2Cc3cc(Cl)ccc3N2)CC1 77299834 RMPXQMLPBDXTQP-GOSISDBHSA-N 375.900 2.928 0 50 GFAA Fc1ccc(N2CCN(c3ccc(-c4noc([C@H]5CCNC5)n4)cn3)CC2)cc1 261716591 JHELZIPMYHYUGF-INIZCTEOSA-N 394.454 2.674 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)c3ccn(CC)c(=O)c3)CC2)OC1=O 77377716 JCKGXSHNOLNWGL-UHFFFAOYSA-N 389.496 2.731 0 50 GFAA CN(Cc1csc(Br)c1)C(=O)[C@@H]1CC12CCS(=O)(=O)CC2 373570111 UQMRKVWEVHNTSK-NSHDSACASA-N 392.340 2.684 0 50 GFAA COC(=O)c1ccsc1NC(=O)CN1CCN(c2cccc(C)c2C)CC1 35884044 LYNLVKHYBWHOPR-UHFFFAOYSA-N 387.505 2.912 0 50 GFAA CC(=O)NC[C@H]1CCC2(CCN(c3nccc(-c4ccc(C)nc4C)n3)CC2)O1 71759235 DVEKPWWBHOXLKU-GOSISDBHSA-N 395.507 2.810 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc3sc(N)nc3c2)CCC(=O)N1CC1CC1 71639293 LXUWPMCZWNEPTQ-INIZCTEOSA-N 386.521 2.988 0 50 GFAA CC[C@@H]1Oc2cc([C@H](C)NC(=O)N3CCOCC(F)(F)C3)ccc2NC1=O 378109854 FQIUJWHVUXBCBU-FZMZJTMJSA-N 383.395 2.534 0 50 GFAA O=C(NCc1ccccc1N1CCOCC1)N1CCOC[C@@H]1c1ccc(F)cc1 458100022 UTQINDVJPBCOCY-OAQYLSRUSA-N 399.466 2.945 0 50 GFAA c1cnc(N2CCC3(CCCN3Cc3cnc(N4CCCC4)nc3)CC2)nc1 72426331 HZKJPHVNKCTWDZ-UHFFFAOYSA-N 379.512 2.502 0 50 GFAA CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@H]1OC 460119137 XUZPLEIBQNYDIX-FVQBIDKESA-N 394.269 2.761 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)sc2c1CCC2 17076989 WKSIYLJMSIUWGQ-NEPJUHHUSA-N 376.478 2.959 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91782169 RPESHZLMOUAOMT-UHFFFAOYSA-N 393.487 2.761 0 50 GFAA Cc1cc(C)n(CC(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)n1 95387001 AUPLGEAHQBAPQF-KSEOMHKRSA-N 382.483 2.728 0 50 GFAA O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCCC[C@H]1CCn1cccn1 95511928 QUKYFVBTLDKYHM-AWEZNQCLSA-N 382.386 2.535 0 50 GFAA CC(C)(C)OC(=O)N1C[C@]2(C[C@H]1C(=O)O)CC2(Br)Br 97436607 HYIIWDPUZNALMC-CPCISQLKSA-N 399.079 2.957 0 50 GFAA CN1Cc2ccccc2C[C@H]1CNC(=O)Nc1ccc(N2CCCC2=O)cc1 96180226 YRGHEKDLHMCJEN-FQEVSTJZSA-N 378.476 2.992 0 50 GFAA O=C(CCc1cnccn1)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)O)C1 426730658 ZVXSGPSDWRSIJT-SPEDKVCISA-N 379.460 2.906 0 50 GFAA COc1ncccc1C(=O)N1CCC(c2nccn2Cc2cccnc2)CC1 95511747 ZGUQFYPOLFFGGC-UHFFFAOYSA-N 377.448 2.750 0 50 GFAA CC(C)Cc1cc(C(=O)N[C@@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)nc(O)n1 253535396 OCSJDJFTAHQJAH-VPWXQRGCSA-N 397.475 2.558 0 50 GFAA COC(=O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 299035220 TUVCFAYOSZKLJN-ABAIWWIYSA-N 399.274 2.620 0 50 GFAA Cc1ccc(-c2cc3n(n2)[C@H](NCc2ccc4c(c2)OCO4)CNC3=O)cc1 263617290 NBOPKQLLHCEQRO-FQEVSTJZSA-N 376.416 2.619 0 50 GFAA O=C(NCc1cccnc1)C1CCN(c2cncc(OCC3CCCC3)n2)CC1 185349199 RKYTUGQLWKANEC-UHFFFAOYSA-N 395.507 2.973 0 50 GFAA O=C([C@H]1CC[C@H]2OCCN(C(=O)c3cnc4ccccc4c3)[C@@H]2C1)N1CCCC1 1940198426 RRMUMZPIRHLZPU-IOMROCGXSA-N 393.487 2.867 0 50 GFAA COc1ccc(CN2CCc3n[nH]c(C4CCC4)c3C2)cc1Cn1cncn1 43082545 PUVNWZXBQOOOQH-UHFFFAOYSA-N 378.480 2.884 0 50 GFAA CCn1nc(C)c(-c2cccc(C(=O)N[C@H]3COC[C@@H]3N3CCCC3)c2)c1C 299796454 OATRMDNBZXDMOU-PMACEKPBSA-N 382.508 2.780 0 50 GFAA Cc1cccc(Br)c1C(=O)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 1875402265 DFTDAEASZHXYHG-BPLDGKMQSA-N 378.270 2.524 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1occc1COc1ccccc1 1875403087 PSPIDIODXNRRDF-ATZDWAIDSA-N 381.432 2.625 0 50 GFAA O=C1CCN(CC2SCCS2)C(=O)N1Cc1ccc2c(c1)COCC2 1875293089 BXXITVCXQJJCJC-UHFFFAOYSA-N 378.519 2.720 0 50 GFAA COc1ccc(OC)c([C@H](O)[C@@H](C)NC(=O)C23CCC(OC)(CC2)CC3)c1 1875271770 LMECSZZUKWSQPO-BHJDLMHMSA-N 377.481 2.981 0 50 GFAA O=C1C[C@H](c2noc(C3CCN(c4cnccn4)CC3)n2)CN1c1ccccc1 1875291036 LZQIEIONFSMYMU-INIZCTEOSA-N 390.447 2.764 0 50 GFAA O=C(O)c1cccc(C(=O)NCc2ccccc2-n2cc(-c3ccncc3)nn2)c1 1875326178 DCFWWTMNMVMBNO-UHFFFAOYSA-N 399.410 2.958 0 50 GFAA COC(=O)[C@H]1CC[C@H](CNC(=O)c2cc(-c3ccc4c(c3)CCO4)[nH]n2)CC1 952963997 OEKMVIUYDDRYQY-HDJSIYSDSA-N 383.448 2.721 0 50 GFAA Cc1cc(-c2ccc(S(=O)(=O)N(C)C[C@H]3CC(=O)N(C(C)(C)C)C3)o2)on1 952982567 BAOOLCVHTODPDR-CYBMUJFWSA-N 395.481 2.511 0 50 GFAA CCO[C@@H](CC)C(=O)NC1(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)CCCCC1 1775986917 ULBYKASDYJKFID-OTWHNJEPSA-N 387.524 2.936 0 50 GFAA CC[C@H](C(=O)N[C@H](C)C1CCN(C(=O)CC2=CCOCC2)CC1)N(CC)CC 1775993292 YORCQMBCLOMORV-YLJYHZDGSA-N 393.572 2.587 0 50 GFAA C/C=C/C[C@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)C(=O)OCC 170596386 YOVGRRHCAJOPPN-LQPUYASZSA-N 381.372 2.761 0 50 GFAA CC1(C)COCCN1CCNC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1 188030149 YCLXLGHDXGUITM-KRWDZBQOSA-N 399.894 2.673 0 50 GFAA COc1ccc2c(c1)CCN2C(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 195135681 QMOSJFNGCMGTGA-HNNXBMFYSA-N 382.464 2.588 0 50 GFAA O=C(c1cn(CC[C@@H]2CCCCN2)nn1)N(Cc1ccccn1)Cc1ccco1 1506412923 FYSYVGZDXDSUKV-KRWDZBQOSA-N 394.479 2.641 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)N1CCCN(Cc2cccs2)CC1 1506397585 PEAADXCYYHIBMC-LJQANCHMSA-N 397.544 2.799 0 50 GFAA CN(Cc1ccccc1OCCCN1CCOCC1)[C@H]1C[C@H]2C[C@@H](O)C[C@H]2C1 1704350984 KUKSIWSPGJZCFI-COPRSSIGSA-N 388.552 2.769 0 50 GFAA CC[C@@H](O)CNC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 12712222 GWCLPCFKZCMXCL-JOCHJYFZSA-N 387.568 2.559 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CCCN1Cc1ccc(Cl)cc1 12718901 BICFRFGJITZGNJ-SFHVURJKSA-N 382.855 2.919 0 50 GFAA O=S(=O)(c1ccccc1)n1c(I)cc2cnccc21 16678146 CTECUBPRUJQMIJ-UHFFFAOYSA-N 384.198 2.878 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC2(CC1)NC(c1ccc(Cl)cc1)=NO2 169755068 MJWAVCFHWVHIDO-UHFFFAOYSA-N 399.834 2.983 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)N3CCO[C@@H](CO)[C@@H]3c3ccccc3)c2c1 1857720141 GJAYDIRZTGMTEB-FPOVZHCZSA-N 378.428 2.823 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2[C@H](CNC(=O)CCC(C)C)[C@H]3CC[C@]2(C1)O3 1857726779 CAMJRMDAMJYCKD-HKJQZYRSSA-N 375.513 2.823 0 50 GFAA CN1CCCC[C@H]1CCNC(=O)c1ccc(NCc2cnc3ccccn23)nc1 23250501 BDLNJYKODYDNAZ-SFHVURJKSA-N 392.507 2.946 0 50 GFAA CC(C)c1ccc(-c2nc(CN3CCN[C@@H]4CS(=O)(=O)C[C@@H]43)cs2)cc1 923521586 AQKZRXKCPURGLV-MSOLQXFVSA-N 391.562 2.504 0 50 GFAA CCCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Cl)c(O)c(OC)c1 4009217 KJEDDZJAUHIKPP-OAHLLOKOSA-N 398.843 2.652 0 50 GFAA O=C(CNC(=O)NCC1CCCC1)Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 2325703303 ZWVHUAUYEHYAOV-UHFFFAOYSA-N 382.468 2.777 0 50 GFAA C[C@]1(CO)COCCN(C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)C1 2325800909 MJUFTLSUIVXVCP-NRFANRHFSA-N 389.398 2.667 0 50 GFAA O=C(c1ccc(=O)n(-c2cccc(Cl)c2)c1)N1CCNC[C@@H]1c1ccncc1 2325858458 OEZDNSXVJBUBOO-LJQANCHMSA-N 394.862 2.673 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CC[C@@](O)(c3ccc(C(F)(F)F)cc3)C2)CC1 2325887863 GIKNRZBSWQLFJX-IBGZPJMESA-N 396.409 2.550 0 50 GFAA O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NCc1ccco1 885058 VAENKLONNUPSDH-UHFFFAOYSA-N 384.457 2.787 0 50 GFAA O=C(O)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O 915591 NEDXBAMFCBNKIB-UHFFFAOYSA-N 380.308 2.527 0 50 GFAA biogenic COc1ccccc1C(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 1115845 YJHHGPRTGZLIRP-UHFFFAOYSA-N 397.475 2.621 0 50 GFAA CCCC(=O)Nc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccccc1 2866900 IIFSGAYMWJVWAZ-UHFFFAOYSA-N 389.477 2.684 0 50 GFAA Cc1ccc2c(c1)N(CCCC(=O)NCc1ccc3c(c1)OCO3)C(=O)CO2 3046941 UTVAQNSKNITMFG-UHFFFAOYSA-N 382.416 2.546 0 50 GFAA COc1cc(C(=O)NC(=S)Nc2ccccc2C(=O)O)cc(OC)c1OC 4844755 AJVKYHUBIRUWIA-UHFFFAOYSA-N 390.417 2.537 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1nc(-c2ccccc2)cs1 6731200 DZYNBQIWIRZFFX-UHFFFAOYSA-N 379.489 2.966 0 50 GFAA O=C(c1cn(C/C=C/c2ccccc2)nn1)N1CCC(O)(c2ccccn2)CC1 11937686 UEVLYVLERNYEBF-RMKNXTFCSA-N 389.459 2.510 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCC3(CCN(Cc4cccs4)CC3)O2)n(C)n1 12023363 KIWZTKAXXDZQJZ-INIZCTEOSA-N 388.537 2.734 0 50 GFAA CCS(=O)(=O)c1ncc(CN2C[C@]3(C)C[C@H]2CC(C)(C)C3)n1CCOC 12303173 UZOKKXZRRSDULU-DNVCBOLYSA-N 383.558 2.724 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(Cc2ccccn2)CC1 12319350 PBZUPJZNMRRHRG-UHFFFAOYSA-N 399.491 2.510 0 50 GFAA CC(C)(C)C(=O)N1CCC(C(=O)N2CCN(c3ccccc3F)CC2)CC1 12381233 QQZMVQQVTDRUNJ-UHFFFAOYSA-N 375.488 2.759 0 50 GFAA CC(C)CCN(C)Cc1cnc(S(=O)(=O)CC2CC2)n1C[C@H]1CCCO1 12434341 AOGFVAOIDKXWSJ-GOSISDBHSA-N 383.558 2.724 0 50 GFAA O[C@H](COc1ccc(CNCCCOc2cccnc2)cc1)CN1CCCCC1 12448859 CKEMZUYTFHROKZ-NRFANRHFSA-N 399.535 2.866 0 50 GFAA COc1cc(CN(C)CC2CCOCC2)ccc1OC[C@H](O)CN(C)C(C)C 12454725 RZAYZCIOEUGNQY-HXUWFJFHSA-N 394.556 2.634 0 50 GFAA Cc1cc(C)cc(-n2ncc3c2CCC[C@@H]3NC(=O)CN2CCCCC2=O)c1 12459046 FTBRYFFFKKKWIO-IBGZPJMESA-N 380.492 2.995 0 50 GFAA CC1=C(C(=O)N2CC[C@]3(CCCN(Cc4cccc(C)c4)C3=O)C2)OCCO1 12465342 JRGQNFOMHLWEPW-JOCHJYFZSA-N 384.476 2.614 0 50 GFAA O=C(C1CCN(C2CCN(C/C=C/c3ccccc3)CC2)CC1)N1CCOCC1 12570622 QCRCKRKBQSEJMS-QPJJXVBHSA-N 397.563 2.735 0 50 GFAA CN(Cc1ccco1)[C@H]1CCc2c(c(C(=O)NCCc3ccccc3)nn2C)C1 14733297 DQUNUUFZNAEGAM-SFHVURJKSA-N 392.503 2.975 0 50 GFAA Fc1cc(CNc2nc3nonc3nc2N2CCOCC2)cc(C(F)(F)F)c1 14967492 KYKVVUOFHBWNIB-UHFFFAOYSA-N 398.320 2.619 0 50 GFAA CCN1CCC(N2CCC[C@H](N3CCN(c4ccccc4OC)CC3)C2)CC1 22913169 ZNMJCYUGJJLKHP-NRFANRHFSA-N 386.584 2.766 0 50 GFAA Cc1cc(C)n(-c2cc(NCCNC(=O)c3ccc(F)cc3Cl)ncn2)n1 23144429 ZSHPPMHICFWVPN-UHFFFAOYSA-N 388.834 2.914 0 50 GFAA CC(C)(N)c1cn(C2CCN(Cc3cncn3Cc3ccccc3)CC2)nn1 23214093 SLMQUMQRSXGILC-UHFFFAOYSA-N 379.512 2.554 0 50 GFAA Cc1nccn1CCN(C)Cc1ccc(-c2nc3c(c(=O)[nH]2)CCCC3)cc1 23231285 XOKIKVMJQGSXNG-UHFFFAOYSA-N 377.492 2.953 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)cc1F 32498066 HISFUNCVTNUHGP-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA Cn1c(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)nc2ccccc21 39400543 ZBTIFJCTHDCBLM-HXUWFJFHSA-N 378.520 2.685 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)c3ccc4c(c3)OCCCO4)n2)cc1 40287411 IPSVCWAAOPYWNP-UHFFFAOYSA-N 392.411 2.963 0 50 GFAA COc1ccccc1CNC(=O)Cn1nc(-c2ccc(SC)cc2)ccc1=O 49549525 BJSIOVFXUITWKM-UHFFFAOYSA-N 395.484 2.957 0 50 GFAA O=C(c1ccnc2ccccc12)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 65461784 FSPQVDPOPYBTEI-HNAYVOBHSA-N 376.412 2.954 0 50 GFAA CN1CCC(N2CCN(Cc3ccc(-c4ccco4)cc3)C[C@@H]2CCO)CC1 67513593 NXYQNOKTCVWXML-QFIPXVFZSA-N 383.536 2.909 0 50 GFAA NC(=O)NCCC(=O)N1CCc2onc(-c3ccc(-c4ccccc4)cc3)c2C1 67672944 LOPHCNJSCBEFLW-UHFFFAOYSA-N 390.443 2.952 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cc4ccccc4[nH]3)C[C@@H]2CCO)n1 72421792 DMKTVJGYQBVWQI-IBGZPJMESA-N 378.476 2.580 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@]2(CCC(=O)N(Cc3ccncc3)C2)C1 82106732 HWFAGCKKGUQCDK-QHCPKHFHSA-N 392.503 2.841 0 50 GFAA Cc1ccccc1OC1CCN(C(=O)Cn2ncc3ccccc3c2=O)CC1 82139131 PUQKWWAKIKPYIW-UHFFFAOYSA-N 377.444 2.775 0 50 GFAA Cc1nc(N2CCCCC2)cc(N2CCN(C(=O)Cc3ccccc3)CC2)n1 82230612 FOXFJHRSJWAJDQ-UHFFFAOYSA-N 379.508 2.667 0 50 GFAA CN(C)C[C@H]1C[C@H](CO)CN(C(=O)c2ccccc2OCc2ccccc2)C1 91858883 PUQKGLCCFHTLQV-UXHICEINSA-N 382.504 2.898 0 50 GFAA O=C1COc2cc(NC(=O)N[C@@H]3CCCN(Cc4cccs4)C3)ccc2N1 97173358 POMVSZLQVJXTAX-CQSZACIVSA-N 386.477 2.865 0 50 GFAA CCCc1noc(CCCC(=O)N2CCN(c3ccncc3Cl)CC2)n1 123587783 SDYJPVFGDCPFPZ-UHFFFAOYSA-N 377.876 2.742 0 50 GFAA CCCc1cc(C(=O)OCC)c(NC(=O)[C@H]2[C@H](C(=O)O)[C@H]3CC[C@H]2O3)s1 138680762 WZHXSPWZDFLGBW-AAVRWANBSA-N 381.450 2.694 0 50 GFAA O=S(=O)(C[C@@H]1CCCCO1)Nc1ccc(-c2nnc3n2CCCC3)cc1 150859304 IKFZPKSXNZCXMA-INIZCTEOSA-N 376.482 2.592 0 50 GFAA COc1cc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)ccc1C 153750015 UDQHVJRYUWQFET-UHFFFAOYSA-N 386.399 2.836 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 167601468 XSDFCVNMRQEYHV-OAHLLOKOSA-N 376.416 2.814 0 50 GFAA O=C(c1ccc(=O)n(Cc2ccccc2Cl)c1)N1CC[C@H](N2CCCC2)C1 171445201 PSTGROBEHLXJLD-SFHVURJKSA-N 385.895 2.860 0 50 GFAA CC(C)Oc1cccc([C@@H](O)CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1 172083934 WBGKYIJJBXDWMQ-RTWAWAEBSA-N 396.487 2.928 0 50 GFAA CC(=O)N1CCN(C(=O)c2cnc(-c3ccc4c(c3)CCO4)s2)C(C)(C)C1 180924571 UBRHBAYGHTYAPI-UHFFFAOYSA-N 385.489 2.828 0 50 GFAA COc1ccc2nc(CS(=O)(=O)Cc3nnc(C4CCC4)n3C)sc2c1 185206345 ZMTXORXHIZBKET-UHFFFAOYSA-N 392.506 2.816 0 50 GFAA COc1ccccc1CN1C(=O)N[C@H](CC(=O)Nc2ccc3cc[nH]c3c2)C1=O 206241849 ASDZSGMQGKEULM-QGZVFWFLSA-N 392.415 2.626 0 50 GFAA O=C(Nc1c(Cl)cc(NC(=O)C2CCNCC2)cc1Cl)c1cnccn1 237704199 NAOWWUQIXRYUAM-UHFFFAOYSA-N 394.262 2.974 0 50 GFAA COc1ccc(C(=O)NC[C@@H](O)CN2CCCCC2)c(OCCC(C)C)c1 239637102 BIUVEWSKGKGMAK-QGZVFWFLSA-N 378.513 2.697 0 50 GFAA CCc1nnc(N2CCC3(CCC(=O)N([C@H]4CC[C@H](O)CC4)C3)CC2)s1 244601779 DRPSSJMZUXRNPM-SHTZXODSSA-N 378.542 2.613 0 50 GFAA O=C(N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1)c1cc2c(nc1O)CCCC2 253535580 GRWBXKDBRDJKRZ-FVJLSDCUSA-N 394.471 2.843 0 50 GFAA COc1ccc(OC)c(NC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)c1 263615456 CMQIRZRAWDQYFV-SFHVURJKSA-N 398.394 2.958 0 50 GFAA O=S(=O)(c1cnc2ccc(F)cc2c1)N1CC[C@H](c2nc(C3CC3)no2)C1 329256215 DOYYNTJGFRJHQB-LBPRGKRZSA-N 388.424 2.813 0 50 GFAA c1ccc(-c2csc(CN3CCN(CCN4CCCOCC4)CC3)n2)cc1 375339255 XULPJKYYRYQWBB-UHFFFAOYSA-N 386.565 2.650 0 50 GFAA Cn1c(CN2CC[C@@](C(N)=O)(c3ccccc3)C2)nnc1-c1ccc(Cl)cc1 411967700 NDWOSNWFCCNMMD-NRFANRHFSA-N 395.894 2.765 0 50 GFAA COCC[C@@]1(NC(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CCOC1 446391199 QGGYEXFVMWXFIY-QGZVFWFLSA-N 394.269 2.765 0 50 GFAA CCOc1ccnc(N2CCN(C(=O)c3cnc4ccccc4c3C)CC2)n1 482534544 QXKDWJCMZVLWRI-UHFFFAOYSA-N 377.448 2.694 0 50 GFAA CCCc1nc(C(=O)NC[C@H]2CCCN(C(=O)c3oc(C)nc3C)C2)cs1 823023324 JSRZLZDLZOACQE-CQSZACIVSA-N 390.509 2.983 0 50 GFAA COc1ccccc1CN1CCN(C(=O)[C@@H](c2cccc(C)c2)N(C)C)CC1 824820285 QJUSZGZPNVSDGA-JOCHJYFZSA-N 381.520 2.951 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3ccc(Br)cn3)CCN2)cc1 870140630 IVKUZLMKJWUIMT-MRXNPFEDSA-N 376.254 2.639 0 50 GFAA O=C(c1ccc(C(F)(F)F)c(O)n1)N1C[C@@H]2C[C@H]1CN2Cc1ccccc1 913686598 OBJBIWITJXJKTB-KBPBESRZSA-N 377.366 2.905 0 50 GFAA CCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(-c3n[nH]c(C)n3)cc2)cc1 952979336 NNNFYCMFPQWVDA-UHFFFAOYSA-N 399.476 2.721 0 50 GFAA C[C@H](NCc1ccc(Sc2nncn2C)o1)c1nc(-c2ccncc2)no1 952985829 ASCWTBDPBCPPFZ-NSHDSACASA-N 383.437 2.855 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@H](O)CC(C)C)CC1)OCC2 1704299292 IBCLNSDFKZGRQJ-QGZVFWFLSA-N 377.481 2.501 0 50 GFAA COc1ccc2c(c1)[C@H](NC(=O)c1cc(N3CCOCC3)no1)CC(C)(C)O2 1772812293 KNIBXOBKVPAJIA-OAHLLOKOSA-N 387.436 2.552 0 50 GFAA C[C@H]1CC2(CCN(C(=O)[C@@H]3CCN(C)[C@@H]3C)CC2)CN1C(=O)/C=C/c1ccco1 1775996697 FAPMITWKNNAWNR-YGYLJGJZSA-N 399.535 2.863 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cc4ccccc4o3)C2)c1C 1857532808 BIIVHBZCZMKHFG-QGZVFWFLSA-N 393.491 2.910 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1cc(C)ccc1OC 1857677910 DUUWOPWJQSTDRT-POZUXBRTSA-N 381.494 2.889 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC2(CC1)OCCc1cc(C(=O)O)sc12 1857691837 FEBORSXZRPKMAK-UHFFFAOYSA-N 395.868 2.537 0 50 GFAA CCOc1cccnc1S(=O)(=O)NCc1ccc(Br)c(F)c1 1875327677 FVFGYYRMROWLQJ-UHFFFAOYSA-N 389.246 2.860 0 50 GFAA COCCCn1nc(-c2nc[nH]n2)nc1-c1cc2c(nc1O)CC[C@@H](C(C)C)C2 1875335994 OPNHUWBIUGXDEM-CYBMUJFWSA-N 397.483 2.628 0 50 GFAA O=S(=O)(c1ccc(-c2cnn3ccc(Cl)cc23)c(CO)c1)N1CCCC1 2325773280 GHYBNJAWFWVTFQ-UHFFFAOYSA-N 391.880 2.932 0 50 GFAA CC[C@@H](SC)C(=O)NC[C@]1(C)CCN(C(=O)c2ocnc2C(F)(F)F)C1 2325794342 ZAAZDOJDQGXSQK-BMIGLBTASA-N 393.431 2.803 0 50 GFAA COc1cccc(C(=O)N2CCC(C(=O)N=c3[nH][nH]c4c(F)cccc34)CC2)c1 2356162826 LQBBEXRQWQHLKP-UHFFFAOYSA-N 396.422 2.623 0 50 GFAA O=C(NCCCNc1cccnc1)c1cc2c(s1)CCOC21CCNCC1 2356166584 DXLJMFLLGDOWEF-UHFFFAOYSA-N 386.521 2.527 0 50 GFAA O=C(O)[C@@]1(Cc2ccccc2)CCN(c2cc(C(F)(F)F)ccn2)C[C@H]1O 2356166844 BTUKDHKYOWKXQI-CRAIPNDOSA-N 380.366 2.985 0 50 GFAA Cc1cccc(NC(=O)N[C@H]2CCN(c3ccccc3F)C2)c1S(C)(=O)=O 417312106 RFNLTEKAKCMGOT-AWEZNQCLSA-N 391.468 2.938 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2)n1 55090652 HRRREPWKNZKEER-HXUWFJFHSA-N 382.483 2.956 0 50 GFAA CN(C)C[C@@H](c1ccccc1)N(C)Cc1ccc(-c2nc(CN)cc(=O)[nH]2)cc1 23398548 YGZKTKSUSUPIFE-NRFANRHFSA-N 391.519 2.630 0 50 GFAA O=c1cc([C@H]2CCCO2)nc(-c2ccc(CN3CC(n4cccn4)C3)cc2)[nH]1 23380366 DOQGZQUAYVUIKV-LJQANCHMSA-N 377.448 2.542 0 50 GFAA CCN1CCC[C@H]1CN(Cc1cnn(CC)c1)CC1CCN(CCOC)CC1 20784621 FDENXPXCOQMATK-QFIPXVFZSA-N 391.604 2.548 0 50 GFAA O=C(N[C@H]1CCn2ccnc2C1)c1cc(-c2ccc(Br)cc2)[nH]n1 427994321 GZYYYAARIGCJPU-ZDUSSCGKSA-N 386.253 2.781 0 50 GFAA Cc1nc([C@@H](C)NC(=O)c2cc(COc3ccc(F)cc3Cl)on2)n[nH]1 67821620 YEALWUYKMSBAIK-MRVPVSSYSA-N 379.779 2.964 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCc2c(cccc2N2CCOC2=O)C1 172984635 NHWADEFNCRRJSN-UHFFFAOYSA-N 382.464 2.511 0 50 GFAA CC1CCN(C(=O)C2CCN(C(=O)c3ccc(-n4cncn4)c(F)c3)CC2)CC1 173149802 UMQMPRREKKDQNF-UHFFFAOYSA-N 399.470 2.517 0 50 GFAA Cn1cc(CNC(=O)CCn2nc(C(F)(F)F)c(Cl)c2C2CC2)cn1 2779063 DFLIRZZTIHQQDO-UHFFFAOYSA-N 375.782 2.873 0 50 GFAA CCCc1cc(CNC(=O)c2ccc(N3CC[C@@]4(CCN(CC)C4)C3)nc2)on1 12205381 PNWQOTGNXADDPW-JOCHJYFZSA-N 397.523 2.874 0 50 GFAA Cc1cccc(CNC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)c1 31058005 IJBJCNKEOUCYEP-UHFFFAOYSA-N 378.519 2.774 0 50 GFAA O=S1(=O)CCCN1C1CCC(N[C@@H](c2ccc(F)cc2)c2ncc[nH]2)CC1 370476827 KMKDBXPSEZSUPV-ABHNRTSZSA-N 392.500 2.575 0 50 GFAA O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1 129526780 SSXOGDHWVATEDQ-INIZCTEOSA-N 396.426 2.709 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)CC1 375937139 DSJNMHDFIGFBCJ-QGZVFWFLSA-N 387.528 2.788 0 50 GFAA Cc1cc(N2CCN(C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C3(C)C)CC2)nc(C(C)C)n1 240412899 FOQRJCHCJQVLIA-CGTJXYLNSA-N 387.528 2.554 0 50 GFAA O=C(c1cnc[nH]c1=O)N1CCO[C@@H](CC(c2ccccc2)c2ccccc2)C1 71415771 CJPNXFRMMNZUCI-IBGZPJMESA-N 389.455 2.833 0 50 GFAA O=C(NCC(F)F)c1cn2cc(-c3cccs3)n(CC3CC3)c(=O)c2n1 72463581 JRXQYKGEUOFEKF-UHFFFAOYSA-N 378.404 2.629 0 50 GFAA CO[C@@]12CC[C@@H](Oc3ccccn3)C[C@@H]1N(C(=O)c1cc(C)nc(C)n1)CC2 426740307 AOWOTBZRSHXVMJ-PLMTUMEDSA-N 382.464 2.720 0 50 GFAA Cc1ccc(C2(NC(=O)c3ccc(-c4cc(NCCO)ncn4)cc3)CC2)cc1 426397359 ICJPBMKTJANBTM-UHFFFAOYSA-N 388.471 3.275 0 50 GFAA NC(=O)C1(N2CCCCC2)CCN(CCCC(=O)c2ccc(F)cc2)CC1 21297287 AXKPFOAXAHJUAG-UHFFFAOYSA-N 375.488 2.594 0 50 GFAA biogenic,world C[C@@H]1Oc2ccccc2N(CC(=O)N[C@@H](CCC(=O)O)c2ccccc2)C1=O 268899941 SGOIQINCQRITGG-HOCLYGCPSA-N 382.416 2.523 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)c1 91575390 DTFKHXLUAPADGT-QFIPXVFZSA-N 382.508 2.866 0 50 GFAA O=C1CC[C@]2(CCCN(c3ncnc4c3CCC4)C2)CN1Cc1ccccn1 91906319 YCHCYPIXXVIUJG-QFIPXVFZSA-N 377.492 2.770 0 50 GFAA O=C(O)[C@H]1[C@H](C(=O)NCCC(c2ccccc2)c2ccccc2)[C@H]2C=C[C@H]1O2 239306203 GNMWHBAJTKJJEB-XRXFAXGQSA-N 377.440 2.979 0 50 GFAA O=C(COc1ccc(F)cc1)N1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2 91626094 AHOWBELCFKOYQD-WMLDXEAASA-N 375.469 2.784 0 50 GFAA COc1cncc([C@H](NC(=O)c2ccc(-c3cc[nH]n3)cc2)[C@H]2C[C@@H](O)C2)c1 244884447 YMTRTBNDCZYUPG-OXFYSEKESA-N 378.432 2.722 0 50 GFAA CC(C)[C@@H](O)C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940197213 ZNDZJTHNJXDXFN-QGZVFWFLSA-N 381.476 2.673 0 50 GFAA Cn1cc(CNC(=O)CN2Cc3ccccc3O[C@@H](c3ccsc3)C2)cn1 39353566 GYPXDHLICIKEQY-LJQANCHMSA-N 382.489 2.734 0 50 GFAA Cc1noc(C)c1NC(=O)c1cccc(CN2CCC3(CC2)CNC(=O)O3)c1 67727078 ZOJJWZKCBOHNKU-UHFFFAOYSA-N 384.436 2.618 0 50 GFAA COCCN1C[C@H](CN2CCN(c3cccc(Cl)c3Cl)CC2)CC1=O 299787540 OWFBVARWGNUPMJ-AWEZNQCLSA-N 386.323 2.610 0 50 GFAA COc1cccc2c1OC[C@@H](NC(=O)c1c3c(nc4onc(C)c14)CCC3)C2 824804774 LWJJWYRMQVNMQA-ZDUSSCGKSA-N 379.416 2.762 0 50 GFAA COCCCn1c(C)cc(O)c([C@H](CC(=O)OC)c2ccc(OC)cc2)c1=O 824396205 AVHXQUYBGNYLIE-QGZVFWFLSA-N 389.448 2.602 0 50 GFAA CN(Cc1noc2c1CCCC2)C(=O)NCc1nc(Cc2cccs2)no1 584898187 MKMXKNMUKMGVPG-UHFFFAOYSA-N 387.465 2.930 0 50 GFAA Cn1cc(C[N@]2C[C@H]2COc2cccc(-c3noc([C@H]4CCCO4)n3)c2)cn1 1875385133 NFRDQIMCHPMDOA-LAVPKYONSA-N 381.436 2.585 0 50 GFAA CC(C)C[C@H](NC(=O)N1CC(=O)Nc2ccccc21)C(=O)Nc1cccnc1 888088456 AUCYWEOMJISCKU-INIZCTEOSA-N 381.436 2.603 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2CC3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1 889235385 UNYQUOKTZZCVNY-UHFFFAOYSA-N 399.491 2.572 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(Cc1nc(-c3ccccc3Cl)no1)C2 1565515437 NJWWAUHJRAKURV-CABCVRRESA-N 376.888 2.933 0 50 GFAA CN(c1ccccc1)c1ccc(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2=O)cn1 171816723 FTVVSOWCVPSFOL-OAHLLOKOSA-N 392.381 2.743 0 50 GFAA CC(C)CNS(=O)(=O)c1ccc(C(=O)NC[C@H]2CCO[C@@H]2C(C)(C)C)cc1 189054568 HMKNQKMUVFRWQW-AEFFLSMTSA-N 396.553 2.802 0 50 GFAA Cn1cc([C@H]2OCC[C@@H]2NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cn1 190020459 FIKZOGLZFZFTNA-VQTJNVASSA-N 390.443 2.932 0 50 GFAA O=C(CCNc1ncc(C(F)(F)F)cc1Cl)N1CCOC[C@@]12CCOC2 195187877 UNGKQILRJWIIKD-HNNXBMFYSA-N 393.793 2.574 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1ccnc(C)c1 793281403 RVMWVOVKPLVDSC-LBPRGKRZSA-N 398.868 2.576 0 50 GFAA CCCN1Cc2cccc(NS(=O)(=O)c3cc(Cl)cc(C(N)=O)c3)c2C1 799122223 WNEFMZJWCMBQDY-UHFFFAOYSA-N 393.896 2.965 0 50 GFAA Cc1ccc(-c2ccc(O)nn2)cc1NC(=O)[C@H]1CN(C)c2ccccc2O1 1506396081 MSIRWNQFKUHGNK-LJQANCHMSA-N 376.416 2.994 0 50 GFAA CCCn1cc(C(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)c(C)n1 1529168988 POVQHWHLOVDOJT-DYESRHJHSA-N 378.476 2.825 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1 5394386 OETOMRYQKCPIOH-UHFFFAOYSA-N 393.896 2.869 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)NC[C@@H]1Cc2cccc(-c3cnccn3)c2O1 11871908 YUNPGXANGDEONX-INIZCTEOSA-N 389.411 2.535 0 50 GFAA COCCC(=O)N1CCCC[C@H]1C(=O)Nc1cccc(-c2nnc(C)s2)c1 12193255 YRDOFCNGLXSTEG-INIZCTEOSA-N 388.493 2.870 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3nnc(C)o3)no2)c(Cl)c1 12204199 YRZRUJGKLSAALK-UHFFFAOYSA-N 392.799 2.879 0 50 GFAA COc1ccccc1NC(=O)CNC(=O)N1CCc2c([nH]c3ccccc23)C1 12296783 JNAALZKOFBMPRH-UHFFFAOYSA-N 378.432 2.883 0 50 GFAA biogenic CCN(CCN(C)C)C(=O)c1sc2ncnc(NC[C@@H]3CCCO3)c2c1C 14972395 OXBVIBXMALJBPI-AWEZNQCLSA-N 391.541 2.614 0 50 GFAA CCOC(=O)[C@]1(CCOc2ccccc2)CCCN(C(=O)Cn2cccn2)C1 15074426 HGGZLSVKQUVFJX-NRFANRHFSA-N 385.464 2.524 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(CCCn3cccn3)C2)cc1OC 19741072 YHGVFJXRBUYGJU-FQEVSTJZSA-N 386.540 2.929 0 50 GFAA Cc1nc(CC(=O)N2CCC3(CC2)OCCc2sc(C(=O)O)cc23)cs1 1857687846 HZUGONDIADDBJJ-UHFFFAOYSA-N 392.502 2.844 0 50 GFAA O=C(O)[C@@H]1CN(CCc2ccccc2)CC12CCN(Cc1ccncc1)CC2 1857692593 LTMVDOUZKFYPRG-NRFANRHFSA-N 379.504 2.923 0 50 GFAA CCc1nc(O)ccc1C(=O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857722938 QITQNVMKNWWODN-QFIPXVFZSA-N 394.475 2.843 0 50 GFAA Cc1ncccc1C(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3)C[C@]23CC[C@H]1O3 1857732931 NOGCYQLMBUPHKJ-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA O=c1cc(CN2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)nc2c(O)cccn12 1857737871 HLONYYDWFJOSPC-VQTJNVASSA-N 377.444 2.752 0 50 GFAA NC(=O)c1ccc(CN2C[C@@H]3CC[C@H]2CN(C2Cc4ccccc4C2)C3)cc1 216705213 MTZMJCCJTBEKKA-AVRDEDQJSA-N 375.516 2.849 0 50 GFAA CC1(C)CN(S(=O)(=O)c2cnc[nH]2)C[C@@H](c2cccc(C(F)(F)F)c2)O1 432280868 AOOXYRIABYVDHS-ZDUSSCGKSA-N 389.399 2.969 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H]2CC[C@H](C1)CN2C(=O)Cc1c[nH]c2ccccc12 248002864 CTXRDBPSGMJGGU-AEFFLSMTSA-N 377.492 2.865 0 50 GFAA Cc1c(C(=O)N2CCCc3cc(OC(F)F)ccc32)nnn1C1CCNCC1 152648734 BJHKGGRIGQQWPG-UHFFFAOYSA-N 391.422 2.705 0 50 GFAA C[C@H](C(=O)NC1CCCC1)N1CCN(Cc2nnc(-c3ccccc3)s2)CC1 155183079 RYLBFOVFOKMRTL-MRXNPFEDSA-N 399.564 2.770 0 50 GFAA NC(=O)c1ccccc1Oc1ncccc1C(=O)Nc1nccn1CC1CC1 2325748739 AGRKAHZUPCIHIO-UHFFFAOYSA-N 377.404 2.832 0 50 GFAA O=C(NC[C@H]1CCC[C@@H]1N1CCCS1(=O)=O)c1ccc(-c2ccccc2)nc1 2325768134 QHIUVXJTEIGMBI-XLIONFOSSA-N 399.516 2.683 0 50 GFAA CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1ccc3c(C)cc(O)nc3c1)C2 895223040 YJHIRVLUKQOQDD-ZDUSSCGKSA-N 394.431 2.667 0 50 GFAA CCCc1c(C(=O)O[C@@H](C)C(=O)N2CCC(C)CC2)[nH]c(C)c1C(=O)OC 919526390 XEMPEBDRNWTMHF-AWEZNQCLSA-N 378.469 2.866 0 50 GFAA Cc1ccc(N([C@H](C)C(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)cc1 2890575 LDPFYHRTAQMWLU-CYBMUJFWSA-N 376.434 2.517 0 50 GFAA COC[C@H](NC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CCCO1 469090859 QOOUXLNHRVRJFC-JKSUJKDBSA-N 394.269 2.763 0 50 GFAA CN(Cc1sc2ccccc2c1Cl)C(=O)Cc1cnc(O)n(C)c1=O 1506400072 LXPLQDYBGCSTIR-UHFFFAOYSA-N 377.853 2.555 0 50 GFAA O=C(NC1CCCCCC1)[C@H]1c2ccccc2C(=O)N1CCCN1CCOCC1 20152489 VUZRVVPXLOVJBN-OAQYLSRUSA-N 399.535 2.745 0 50 GFAA O=C([C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccn1)N1CCC(n2ccnc2)CC1 252512734 VECUVATUDUFWTH-QRQLOZEOSA-N 380.496 2.674 0 50 GFAA CCOC(=O)C[C@@H](NS(=O)(=O)c1ccc(OC)cc1)c1ccc(C)cc1 3620799 DDYZLDOIBUKMPS-GOSISDBHSA-N 377.462 2.976 0 50 GFAA Cc1nn(C)c2nc(-c3ccccn3)nc(N(C)Cc3noc(C(C)C)n3)c12 72412316 FWBZLMMQJAGKOT-UHFFFAOYSA-N 378.440 2.877 0 50 GFAA O=C(Nc1cccnc1N1CCCC1)N[C@@H](CO)c1nc(-c2ccccc2)no1 363383127 JWUHFPUXQVSFCT-INIZCTEOSA-N 394.435 2.587 0 50 GFAA Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)c2cncc(-n3nc(C)cc3C)n2)on1 368179682 WZCBEKMTUHBKPD-IRXDYDNUSA-N 399.474 2.624 0 50 GFAA Cc1ccn2c(CN3CCC(CO)CC3)c(C(=O)N3CCCCCC3)nc2c1 71751264 OJKQIUSWAGURQW-UHFFFAOYSA-N 384.524 2.863 0 50 GFAA Cc1nsc(N2CCCN(Cc3ccc(C(=O)N4CCCC4)cc3)CC2)n1 174171150 OYKYFOKWBVYMRU-UHFFFAOYSA-N 385.537 2.795 0 50 GFAA Cc1nc(N2CCOCC2)ccc1NC(=O)c1cccc(OCC(F)F)n1 128073354 DBAZDJUPDFUWFN-UHFFFAOYSA-N 378.379 2.518 0 50 GFAA O=C([C@H]1CC2(CCNCC2)CN1)N(CCc1ccccc1)Cc1ccccc1 72120873 HWEQSUADQYPJSY-JOCHJYFZSA-N 377.532 2.990 0 50 GFAA Cc1noc(C)c1CC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1 262703503 CSBGHKPIRPFOOI-QGZVFWFLSA-N 385.420 2.552 0 50 GFAA O=C(NCCNC(=O)c1nc2ccc(Cl)cn2c1F)c1ccccc1Cl 215168341 NNWGAZSWLORXHG-UHFFFAOYSA-N 395.221 2.940 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](C(=O)O)N(C(=O)C2CC2)C3)c(C)c1 72419120 WVXXYTHWGGFWJO-GOSISDBHSA-N 384.476 2.621 0 50 GFAA Cc1ccccc1C(=O)Nc1ccnn1C1CCN(C(=O)c2cnccn2)CC1 71315724 AZZDBUJLPDVWTK-UHFFFAOYSA-N 390.447 2.711 0 50 GFAA OC[C@@]1(O)CCCN(Cc2cccc(OCCCN3CCCCC3)c2)CC1 72165280 ZWCAAVLARGUCDU-JOCHJYFZSA-N 376.541 2.651 0 50 GFAA CC(C)CN1CCCn2nc(CNC(=O)[C@@H](C)N3CCCCCC3)cc2C1 82087875 RDMFABRGCPQCMM-GOSISDBHSA-N 375.561 2.626 0 50 GFAA Cc1cc(CN2CCC[C@H]2c2ccc(C(=O)NCCc3cnc[nH]3)s2)n[nH]1 20542307 QBCLUTQZWNMNTJ-INIZCTEOSA-N 384.509 2.812 0 50 GFAA O=C(NCC(c1ccccc1)c1ccccc1)N1C[C@H](O)[C@@H](N2CCCC2)C1 426635743 YLNDTXQVEVRZIH-VXKWHMMOSA-N 379.504 2.669 0 50 GFAA COCc1nn2c(ncc3c(=O)n(CCCN(C)C)ccc32)c1-c1ccccc1 40396384 ZUMSDGMYNUADLG-UHFFFAOYSA-N 391.475 2.809 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@@H]4CCN(C)C4)csc3C2)nc1 426604235 FSKAGZQSZONABH-KRWDZBQOSA-N 398.576 2.945 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)NC(C)(C)c2nnc(N)s2)n1 426535888 OCDWMZJSMQTIIW-UHFFFAOYSA-N 386.481 2.853 0 50 GFAA O=C(NCc1ccco1)c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)c1 239165253 NTXAEMXTNHARBB-GFLQDLJJSA-N 388.423 2.767 0 50 GFAA CCn1c(=O)oc2cc(NC(=O)NC[C@H](CO)Cc3cccs3)ccc21 96166118 HXJLQFJDCAGZQZ-GFCCVEGCSA-N 375.450 2.649 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)c2cc(C(F)(F)F)n[nH]2)C1)OCc1ccccc1 97815391 RFJOCPGZQJHBOQ-GFCCVEGCSA-N 382.342 2.569 0 50 GFAA c1nc(N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)c2cc[nH]c2n1 95356364 GHOAGHKTAARPOF-PWIZWCRZSA-N 389.459 2.753 0 50 GFAA Cc1nnc([C@@H](C)NC(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)o1 95527306 GSEODFLWNYEIEM-CYBMUJFWSA-N 398.463 2.649 0 50 GFAA CN(C)C(=O)CN1C[C@@H]2CC[C@H](C1)N(Cc1ccc(F)c(C(F)(F)F)c1)C2 95365494 QLOXLKHGRNRENA-LSDHHAIUSA-N 387.421 2.829 0 50 GFAA COc1cc(OC)cc(C(=O)NC[C@H]2CCCN(C(=O)c3cc[nH]c3C)C2)c1 95505683 CNBDKWRAROIBKB-OAHLLOKOSA-N 385.464 2.623 0 50 GFAA C[C@@H](NC(=O)C1(c2ccccc2)CCN(Cc2ccccc2)CC1)c1nnn[nH]1 95374505 KYBYDKLVPIOUQU-QGZVFWFLSA-N 390.491 2.611 0 50 GFAA Cn1nc(C(F)(F)F)c(C[S@](=O)C2=NOC(C)(C)C2)c1OC(F)F 141826340 GXLGHGJWHZVKAD-XMMPIXPASA-N 375.319 2.801 0 50 GFAA Cc1cc(C(=O)N[C@H]2C[C@@H](c3cc(O)nc(N)n3)C2)c2cc(Cl)ccc2n1 253535287 OSXLEMAZSJLBSV-KLPPZKSPSA-N 383.839 2.950 0 50 GFAA O=C(Nc1n[nH]c(C2CCC2)n1)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 184600784 NBRLHCUPRMSJCS-JTQLQIEISA-N 377.807 2.856 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N3CCC(N4CCCCC4)CC3)cn12 1940193451 NGZASYXDJGGKIR-IBGZPJMESA-N 385.512 2.509 0 50 GFAA CCn1cc(C(=O)NCCC(=O)Nc2cccc(C)c2)c(=O)c2ccc(C)nc21 823584062 ONNHUFSWGRMUOL-UHFFFAOYSA-N 392.459 2.792 0 50 GFAA CNC(=O)[C@H]1CCCN(C(=O)c2ccc(-c3cc(C)c4nccn4c3)cc2)C1 584893510 NQMURGAWMDNKFR-SFHVURJKSA-N 376.460 2.908 0 50 GFAA Cc1sc2nc(CCNC(=O)C[C@H]3NC(=O)c4ccccc43)nc(O)c2c1C 827811407 KGFPMDJPEOIHMV-CQSZACIVSA-N 396.472 2.547 0 50 GFAA C[C@@H](Cc1ccc2c(c1)OCO2)CN1CCC(CNC(=O)c2ccnnc2)CC1 821459952 QBQZGLMDPONPRL-INIZCTEOSA-N 396.491 2.526 0 50 GFAA O=C(NCCCn1ccccc1=O)N1CCC[C@H](c2nc3ccccc3o2)C1 584903847 UKYSKYPRRJSQAJ-INIZCTEOSA-N 380.448 2.969 0 50 GFAA Cc1nc(C(=O)NC[C@@H]2CN3CCCC[C@H]3CO2)nn1-c1ccccc1C(C)C 1875254159 IYLYWIFMMZCDBN-ZWKOTPCHSA-N 397.523 2.682 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2ccc(Cl)c(F)c2N2CCOCC2)C1 1875371845 NCVJSOQYPUOKNM-CYBMUJFWSA-N 395.862 2.679 0 50 GFAA Cc1nn(CC(=O)N(C)Cc2ccc(Cl)s2)c(C)c1[C@@H]1COCCN1C 952893301 INXFZPOOEBVLGR-HNNXBMFYSA-N 396.944 2.877 0 50 GFAA CO[C@H]1CCCN(S(=O)(=O)c2cc(-c3cc(C(F)(F)F)n[nH]3)oc2C)C1 952979633 NZTZBSNFWKDHHI-JTQLQIEISA-N 393.387 2.796 0 50 GFAA COC(=O)C[C@H](c1ccsc1)c1c(O)n(CCc2cnc[nH]2)c(C)cc1=O 888090403 WXVIHNMOJWTGRW-OAHLLOKOSA-N 387.461 2.585 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2C[C@@H]3C[C@@H](C2)[C@@H]2CCCC(=O)N2C3)n[nH]1 888088255 BFHJERZMRANSDM-DOXZYTNZSA-N 394.475 2.558 0 50 GFAA COc1cc(CCNC(=O)N2CCN(c3cccc4[nH]ccc34)CC2)ccn1 888100185 TVSYUXSIAYXZIX-UHFFFAOYSA-N 379.464 2.646 0 50 GFAA Cc1cc(C)c(N2C[C@H](C(=O)Nc3cncnc3N3CCCC3)CC2=O)c(C)c1 186246636 NDCNNCBTLMPVJD-QGZVFWFLSA-N 393.491 2.994 0 50 GFAA NC(=O)c1nccnc1C(=O)N1CCC(Cc2cc(Cl)ccc2Cl)CC1 170651935 WXRJOXXTMYHXCR-UHFFFAOYSA-N 393.274 2.977 0 50 GFAA Cc1cc2[nH]cc(C(=O)N(Cc3ccccc3)Cc3scnc3C)c(=O)n2n1 1506426412 IDRQWUMUYYHROY-UHFFFAOYSA-N 393.472 2.939 0 50 GFAA Cc1cccc(-c2ncc(CN3CC[C@@]4(C(=O)O)CCCN(C)[C@@H]4C3)cn2)c1 1529161440 JJMKHMPTGRWASO-KNQAVFIVSA-N 380.492 2.823 0 50 GFAA COc1ccccc1CCNC(=O)Cn1nc(-c2ccc(Cl)cc2)ccc1=O 5388552 BPORIVMLKNNCDJ-UHFFFAOYSA-N 397.862 2.931 0 50 GFAA Cc1c(C(=O)N[C@@H](C)Cc2cccnc2)cnn1-c1nccc(-c2cccnc2)n1 12040896 WACPCBUOLICJBS-HNNXBMFYSA-N 399.458 2.789 0 50 GFAA CO[C@@H]1CCCN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)C1 12455514 VBRTUHKGCCEQIQ-HXUWFJFHSA-N 386.492 2.717 0 50 GFAA COC(=O)CCC(=O)N1CC[C@@]2(CCCN(Cc3cc(OC)ccc3F)C2)C1 12717865 JJFJQLAFOIOVFH-OAQYLSRUSA-N 392.471 2.602 0 50 GFAA COC(=O)C1CCN(C(=O)c2cn(Cc3cccc4ccccc34)nn2)CC1 12753940 AROMQNIRILLLMS-UHFFFAOYSA-N 378.432 2.505 0 50 GFAA COc1cc(CNC[C@@H]2CCCO2)ccc1Oc1nnnn1-c1ccccc1 13845281 IBILLJXSWPAQQX-KRWDZBQOSA-N 381.436 2.732 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCN(Cc2ccc(O)c(Cl)c2)C[C@H]1O 15069260 PPSAQBNSFGFVOS-UYAOXDASSA-N 375.900 2.550 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCCc1ccc(Cl)cc1)CCCC3 169778622 QIZGHWJPDLPTMC-UHFFFAOYSA-N 398.894 2.855 0 50 GFAA CC(C)CN1CCC2(CC1)OCCc1cc(C(=O)NCCCCO)sc12 1857688068 RTLLQQOTHRTKAV-UHFFFAOYSA-N 380.554 2.770 0 50 GFAA O=C(O)[C@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc(Cl)cc1)CC2 1857692559 KIRHJSKFIVRUNH-QGZVFWFLSA-N 388.899 2.862 0 50 GFAA NC(=O)[C@@H]1CCCN(CCCn2ccnc2-c2coc(-c3ccccc3)n2)C1 1857694579 SIKVITNUVGAFMP-QGZVFWFLSA-N 379.464 2.793 0 50 GFAA Cc1c(C(=O)N2CCC(c3nnc4n3CCCCC4)CC2)nc2ccccn12 1857700389 GPRFYIRBRMEHJT-UHFFFAOYSA-N 378.480 2.980 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)c3ccccc3C)CC(=O)N2[C@H]1c1ccccc1 1857723588 MLNRZUUOBPGPBM-CUWPLCDZSA-N 392.455 2.582 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)NCCc1csc(C(C)C)n1 1857735864 CSLBFHWQHSHTGK-UHFFFAOYSA-N 380.539 2.841 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)NC1CCN(c3ccc(C)cn3)CC1)CO2 157895438 KDNDTWPTDOLZQO-QGZVFWFLSA-N 381.476 2.735 0 50 GFAA CC(=O)NCC(=O)O[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 835542269 GYCLGOJUIVWEKF-IAGOWNOFSA-N 376.453 2.807 0 50 GFAA Cn1cc(N2C[C@@H](C(=O)N3CCC(c4cc5ccccc5[nH]4)CC3)CC2=O)cn1 858852786 KQAGBASWMZENPO-KRWDZBQOSA-N 391.475 2.661 0 50 GFAA Cc1nc2n(c1CNC(=O)N=c1cc(-c3ccc(F)cc3)n(C)[nH]1)CCCC2 2325782098 YGWGTMWEWFCBEP-UHFFFAOYSA-N 382.443 2.811 0 50 GFAA Cn1nccc1NC(=O)C(=O)NC1(Cc2ccc(Cl)cc2Cl)CCC1 2325798575 BXKIKGBZOVZHAK-UHFFFAOYSA-N 381.263 2.947 0 50 GFAA NC[C@H](CC(=O)Nc1cnc2[nH]ncc2c1)c1ccc(Br)s1 2325861387 OKOKKPAGVXCVTM-QMMMGPOBSA-N 380.271 2.853 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)N[C@H]3CCc4ccccc4NC3=O)ccc21 2325889725 NAOICHAYDFCDPQ-IBGZPJMESA-N 389.455 2.835 0 50 GFAA CCc1c(C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)csc1C 1055522 JYGPYOBLNWKPSV-UHFFFAOYSA-N 394.518 2.892 0 50 GFAA O=C(NC(=S)NCc1ccco1)c1ccccc1I 1078735 MSHIKHLRNPGGGM-UHFFFAOYSA-N 386.214 2.689 0 50 GFAA O=C(O)c1ccc(NCc2cccnc2)c(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 1117041 JNYJLYZTBDSDPA-HZPDHXFCSA-N 377.400 2.848 0 50 GFAA Cc1cc(C)n2ncc(CN3CCc4nc(Cc5ccccc5)nn4CC3)c2n1 2356143510 KUWVWOAPNSMADF-UHFFFAOYSA-N 387.491 2.587 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356149870 DFNPXMRJIINGQW-QFIPXVFZSA-N 393.443 2.608 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Nc2ccc(OC)c(Cl)c2)C1=O 2356149896 DOAKUCAIJBYDNN-LJQANCHMSA-N 395.887 2.984 0 50 GFAA O=C(c1csc2c1CCCC2)N1CCN(S(=O)(=O)c2ccccc2)CC1 6690901 KLXCWAICIFXIAT-UHFFFAOYSA-N 390.530 2.774 0 50 GFAA CCOc1ccc(NC(=O)CCc2nnc3n(C)c(=O)c4sccc4n23)cc1 8592226 GLGJVXHOJVTVOT-UHFFFAOYSA-N 397.460 2.613 0 50 GFAA COCc1ncc(CN(Cc2cccnc2)Cc2ccc3c(c2)OCO3)cn1 55280790 PHWOIDVGHAODRQ-UHFFFAOYSA-N 378.432 2.949 0 50 GFAA C[C@H](NC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)[C@H]1C[C@H]2CC[C@H]1C2 248266893 TVCGGRWCWYNRMB-IQWQSGHPSA-N 384.476 2.752 0 50 GFAA COc1ccc(C(=O)N[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1-c1ccccc1 117696837 MONRMNCQSWSKLK-LJQANCHMSA-N 390.443 2.631 0 50 GFAA Cc1nc([C@@H](C)NC(=O)c2coc(COc3cccc4cccnc34)n2)n[nH]1 67649006 BBOPHKHDOBDGRI-LLVKDONJSA-N 378.392 2.719 0 50 GFAA O=C(Cn1c(=O)[nH]c2ccccc21)N1CCC[C@@H](c2nc3ccccc3o2)C1 67785077 INVIEZVSTJMBHN-CQSZACIVSA-N 376.416 2.877 0 50 GFAA C[C@H](Oc1ncccc1C(=O)NCCC(=O)N1CCCCCC1)C(F)(F)F 252480311 BZPJYWGGCLFNAY-ZDUSSCGKSA-N 387.402 2.934 0 50 GFAA OCC[C@@H]1CN(Cc2cnn(-c3ccccc3)c2)CCN1Cc1ccccc1 23128657 WEEDDXMMGASAPE-HSZRJFAPSA-N 376.504 2.941 0 50 GFAA O=C(NCc1ccc(CN2CCCC2=O)cc1)Nc1cnn(C[C@@H]2CCCO2)c1 127842889 WRDMMLKLTVRYPB-IBGZPJMESA-N 397.479 2.506 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(C(=O)Cc3ccn(C)c3)C2)c1 12438606 MTHBIZNIUFMOBE-GOSISDBHSA-N 397.519 2.911 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N(C)CCc2nc3cc(F)ccc3[nH]2)nn1 12193027 XPTHUACWTGQRJX-UHFFFAOYSA-N 392.438 2.965 0 50 GFAA CCC(CC)CN1CC2(CCN(Cc3cnc(COC)nc3)CC2)OC1=O 72447277 FIBQTWHOGYZFKT-UHFFFAOYSA-N 376.501 2.846 0 50 GFAA COc1ccc([C@H]2CCCN2CCC(=O)Nc2ccc(C(N)=O)cc2)cc1OC 363343912 BJFZFUYEOVDYOS-GOSISDBHSA-N 397.475 2.968 0 50 GFAA Cc1cc2n(n1)[C@H](C(F)(F)F)CCN2C(=O)c1ncn(-c2ccccc2)n1 485475932 GKRGVTKPAGQOJG-ZDUSSCGKSA-N 376.342 2.926 0 50 GFAA O=C(Nc1cccn(CC(F)(F)F)c1=O)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 154509460 GYGHBWABXYSNGH-YUTCNCBUSA-N 385.386 2.880 0 50 GFAA Cc1cc(NS(=O)(=O)c2ccc3c(c2)CN(C(=O)C(C)(C)C)CC3)no1 77376910 HXBUIENLPRUQFN-UHFFFAOYSA-N 377.466 2.715 0 50 GFAA Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1CN(C)C[C@@H](O)CO 72427300 UEQGLRPXGQIHCM-QGZVFWFLSA-N 387.430 2.911 0 50 GFAA O=C(CCc1nc(-c2ccco2)no1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 218295853 OWWSANSNNQTDAN-HNNXBMFYSA-N 394.387 2.556 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)Nc3ccc4c(c3)NC(=O)CS4)cn21 333928929 XWKDRRTYXKQVJK-JTQLQIEISA-N 378.479 2.625 0 50 GFAA COc1ccc(NC(=O)c2cn(-c3cccc(C)c3)nn2)c(Br)n1 156870956 FMDMGDSVSXCBRF-UHFFFAOYSA-N 388.225 2.994 0 50 GFAA O=C(Cn1cn[nH]c1=O)N[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 157256159 XGWIXDXSOUQJFO-HIFRSBDPSA-N 382.386 2.823 0 50 GFAA CC(C)[C@@H]1CN(CC(=O)N2CCCCC2)CCC(=O)N1Cc1ccc(F)cc1 71763378 IAQNHKXMRHGINX-FQEVSTJZSA-N 389.515 2.897 0 50 GFAA Cc1nc2ccc(C(=O)N3CCN(C4CCCC4)[C@@H](CCO)C3)cc2nc1C 72480487 IHZBJYJRCFYKGN-IBGZPJMESA-N 382.508 2.698 0 50 GFAA CCN(CC(=O)Nc1ccc(OC)cc1)[C@H](C)C(=O)N1C[C@H](C)C[C@@H](C)C1 241338604 MCFWPNHAIIKYRG-BRWVUGGUSA-N 375.513 2.849 0 50 GFAA C[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)c3nonc23)C1 17077449 AUBNAXODWVFDHF-UONOGXRCSA-N 378.498 2.880 0 50 GFAA Cn1cc(CCC(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95382999 ALPKPLXNQLYOTO-KSEOMHKRSA-N 382.483 2.581 0 50 GFAA COc1ccc(CNC(=O)CC[C@H]2CCCN(C3CCNCC3)C2)c(OC)c1 95523824 NMRBFLBZPCFFNA-QGZVFWFLSA-N 389.540 2.564 0 50 GFAA CN(C)Cc1nnc(C2CCN(Cc3c(Cl)cncc3Cl)CC2)n1C 96148563 GLCWTHVZBVJWIT-UHFFFAOYSA-N 383.327 2.958 0 50 GFAA Cc1ccc2nc([C@H](C)NC(=O)Cn3nc(C)c4ccccc4c3=O)[nH]c2c1 91305966 KABFKEDXGLWTGI-AWEZNQCLSA-N 375.432 2.767 0 50 GFAA O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCN(Cc2ccc(F)c(Cl)c2)CC1 245326017 IPNCPTBPSQGIRF-LBTBCDHLSA-N 394.874 2.870 0 50 GFAA COC(=O)/C=C1/CC[C@@H]2[C@H](C(=O)C[C@H]3[C@@](C)(C(=O)OC)[C@@H](O)CC[C@]23C)[C@H]1C 257347282 CFNLOOTYKUBPGV-PZUKUXQESA-N 392.492 2.677 0 50 GFAA CN(Cc1n[nH]c2c1CCC2)C(=O)c1ccc(-c2csc(C(N)=O)c2)cc1 534632893 DAVLASOUEWPROF-UHFFFAOYSA-N 380.473 2.998 0 50 GFAA O=C(NCc1ccccn1)c1cccc(-c2ccc(CN3CCOCC3)cn2)c1 299777512 QKKDDEPTDUUZGQ-UHFFFAOYSA-N 388.471 2.906 0 50 GFAA Cc1ccc(F)cc1CN1CCOC2(CCN(C(=O)Cc3ccncc3)CC2)C1 826567298 HRUBPFCUNQYLMB-UHFFFAOYSA-N 397.494 2.965 0 50 GFAA CCN(CC)C[C@H]1CCCN1C(=O)c1ccc(-c2cnc3ncnn3c2)cc1 584886359 CLZGERRRUCQWDA-LJQANCHMSA-N 378.480 2.738 0 50 GFAA COc1cc(CNC(=O)N2CC[C@H](C)C2)ccc1CNC(=O)N1CC[C@@H](C)C1 1875272650 CDPHKWZEFONLGU-JKSUJKDBSA-N 388.512 2.798 0 50 GFAA CC[C@@H](C)n1ncc2c(C(=O)N[C@H]3c4ccccc4OC[C@@H]3O)cc(C)nc21 1875297840 FNBJQRCWWDFREI-FMEYXAORSA-N 380.448 2.935 0 50 GFAA Cn1ccnc1[C@@H]1CN([C@H]2CCc3c(F)ccc(F)c32)C[C@H]1NC(=O)C1CC1 1875282605 LDSNTBWYSSVVIY-OLMNPRSZSA-N 386.446 2.680 0 50 GFAA Cn1cc(CN(C(=O)[C@@H]2CCn3c(C(=O)c4ccccc4)ccc32)C2CC2)nn1 1875274721 UOGPCIJDRGCKCA-GOSISDBHSA-N 389.459 2.526 0 50 GFAA CCc1nnc2n1C[C@@H](NC(=O)N1CCC[C@H](c3cc(O)cc(F)c3)C1)CC2 1875293915 HSCDANQGMMUKQZ-BBRMVZONSA-N 387.459 2.589 0 50 GFAA COc1ccc(CNC(C)=O)cc1S(=O)(=O)NC1CC(C2CCCC2)C1 1875322892 MHHSSNYOWLVIGN-UHFFFAOYSA-N 380.510 2.578 0 50 GFAA CCC[C@H](C)N(C)C(=O)c1cncc(-c2cn(-c3cncc(C(=O)O)c3)nn2)c1 1875327570 ZVCYRLVCIFUPGP-ZDUSSCGKSA-N 394.435 2.683 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)cc1 1875373527 DQUXJJVRXCPMSW-UHFFFAOYSA-N 377.444 2.992 0 50 GFAA COCCN1CC[C@@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2Cl)C1 952983646 WHZUDYQUIAZNNH-LBPRGKRZSA-N 381.325 2.582 0 50 GFAA Cc1ccnc(-c2noc(CC3CCN(C(=O)c4cnn5c4CCC5)CC3)n2)c1 881654335 OMMSONOMCZZKEQ-UHFFFAOYSA-N 392.463 2.678 0 50 GFAA CNC(=O)c1cccc(NC(=O)CCCc2nc(-c3ccncc3)no2)c1C 952979011 GKSXSTPCLCIOGB-UHFFFAOYSA-N 379.420 2.761 0 50 GFAA COc1ccc(C(=O)N2CCC(NC(=O)N[C@]34CCC[C@H]3C4)CC2)c(OC)c1 888101720 NBHXQDXNLGMFLY-QKKBWIMNSA-N 387.480 2.550 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1ccc(CO)cc1)c1cccc2ncccc12 1565508082 GIRWWJONVOUGIT-SFTDATJTSA-N 378.428 2.693 0 50 GFAA C[C@@H](O)CN(C(=O)Nc1ccc(Cl)c(Cl)c1)C1CCS(=O)(=O)CC1 170091140 KAVVFQCOLNZZAT-SNVBAGLBSA-N 395.308 2.785 0 50 GFAA CCn1c(S)nc2cc(C(=O)N[C@H]3CCCCC[C@@H]3OC)ccc2c1=O 170653346 UZPXGKVIPMIQIL-HOCLYGCPSA-N 375.494 2.783 0 50 GFAA NC(=O)c1ccc(-c2nc(Cn3cnc4cccc(F)c4c3=O)cs2)cc1 170650920 HOJGRWGNLCGOJU-UHFFFAOYSA-N 380.404 2.806 0 50 GFAA Cc1cc(C)cc(-n2ncc3c(=O)n(Cc4ncnn4C(C)(C)C)cnc32)c1 282151315 FNWXWFJZTKHAGT-UHFFFAOYSA-N 377.452 2.594 0 50 GFAA COc1ccc(C2=NN(S(C)(=O)=O)[C@@H](c3cnc4ccccc4n3)C2)cc1 225505166 VRQRZHUPESTEQO-LJQANCHMSA-N 382.445 2.749 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2c2cccc(OC)c2)cc1 1191601525 ANXRXCCHPJCMBM-LJQANCHMSA-N 388.489 2.971 0 50 GFAA CC(=O)NCC(=O)N1C[C@H]2CN(C3CCCCC3)C[C@@]2(CCc2ccccc2)C1 1772819888 WQVSWQVUCJJHDD-QPPBQGQZSA-N 397.563 2.848 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)nn2)n1 13008910 GHUDMBNIFGUXGC-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA O=C(NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12)c1ccc(F)c(F)c1 169776317 PBJRMOKRKKYJLW-UHFFFAOYSA-N 396.357 2.865 0 50 GFAA Cc1cnccc1N1CCC(N2C[C@H](COc3ccc(F)cc3)OCC2=O)CC1 1857698436 RMFDDLYSHSVVGX-HXUWFJFHSA-N 399.466 2.804 0 50 GFAA COc1cc(CN2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc(OC)c1 1857718686 ODRZVAWCKHZKBM-XPNTWCBSSA-N 394.471 2.978 0 50 GFAA Cc1ccc(CC(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1F 1857739241 GAKACLQBZZMLKA-MZKRTTBSSA-N 394.446 2.978 0 50 GFAA C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NCCC[C@@H]1CC1(Cl)Cl 846590788 WYOKOGOEOLYMRL-WDEREUQCSA-N 397.299 2.583 0 50 GFAA Cn1nnc([C@H]2CN(C(=O)C3(c4ccc(Cl)cc4)CCCCC3)CCO2)n1 2100482558 ILKHVVXWSHYPCM-MRXNPFEDSA-N 389.887 2.666 0 50 GFAA CCN(Cc1cccc(C)c1)C(=O)Nc1ccc2c(c1)S(=O)(=O)CC(=O)N2 2325761177 MGIDCHAJDXYLHN-UHFFFAOYSA-N 387.461 2.775 0 50 GFAA CCCN1CCN(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c2cc(F)ccc21 2325816254 SDAXEKMBZXBFEB-SFHVURJKSA-N 399.466 2.674 0 50 GFAA Cn1c(SCC(=O)N2CCN(c3ccccc3)CC2)nnc1-c1ccco1 1118643 PYUWNSFAKQSSDO-UHFFFAOYSA-N 383.477 2.516 0 50 GFAA COc1ccc([C@@H]2CC(=O)c3cnc(NC[C@H]4CCCO4)nc3C2)cc1OC 2111723 RKRQPQBKWSMWIS-LSDHHAIUSA-N 383.448 2.997 0 50 GFAA biogenic Cc1c(C(N)=O)sc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)c1C(=O)OC(C)C 6184387 STINFIHLUWESGO-MNOVXSKESA-N 396.465 2.550 0 50 GFAA CCCS(=O)(=O)N1CC[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 11841992 QCLIJJFDRHZTBU-GOSISDBHSA-N 386.464 2.519 0 50 GFAA O=C(NCC1CCOCC1)[C@H]1CCC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 12075652 PYMAXMYHUJWNIH-INIZCTEOSA-N 398.425 2.987 0 50 GFAA CO[C@H]1CCCN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)C1 12455517 VBRTUHKGCCEQIQ-FQEVSTJZSA-N 386.492 2.717 0 50 GFAA COc1cc(C(C)=O)ccc1OCc1cc(C(=O)N2C[C@H](C)O[C@H](C)C2)no1 12571603 JLIPBXABVJBBMJ-BETUJISGSA-N 388.420 2.714 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cccc3nonc23)C[C@@H]1CCO 19641511 XXLBMFOSCVWZAC-IBGZPJMESA-N 396.491 2.690 0 50 GFAA Cc1c(C)n(CCCN2CCOCC2)c2ncnc(NCc3cccnc3)c12 20573290 ZJRRZRKMDRJDHL-UHFFFAOYSA-N 380.496 2.778 0 50 GFAA CCOc1ccc(CN2CCc3nnc([C@@H](C)NC(=O)C(C)C)n3CC2)cc1 20599919 SBXPXZTVNZJMSY-MRXNPFEDSA-N 385.512 2.568 0 50 GFAA CN1CCCC[C@@H]1CCNC(=O)c1ccc(NCc2cnc3ccccn23)nc1 23250498 BDLNJYKODYDNAZ-GOSISDBHSA-N 392.507 2.946 0 50 GFAA COc1ccc(NC(=O)[C@H]2CCCN(c3ccc4nncn4n3)C2)cc1Cl 32106394 MJPNWCSXLWZLKB-LBPRGKRZSA-N 386.843 2.641 0 50 GFAA CCCCC[C@H](O)/C=C/[C@@H]1[C@H](O)C[C@H](O)[C@@H]1CCCC[C@@H](CC(=O)O)OC 43772097 UBKBNBIEPZZFBF-CCVBBRSESA-N 386.529 2.892 0 50 GFAA in-vitro CCCCC[C@@H](O)/C=C/[C@@H]1[C@H](O)C[C@H](O)[C@@H]1CCCC[C@@H](CC(=O)O)OC 43772099 UBKBNBIEPZZFBF-GOLYVKFISA-N 386.529 2.892 0 50 GFAA in-vitro C[C@H](NC(=O)Cn1nnc2ccccc2c1=O)c1ccc(OC(F)(F)F)cc1 46241425 JZGLECLGVQRPPI-NSHDSACASA-N 392.337 2.568 0 50 GFAA CCOC(=O)CNc1ccccc1C(=O)N1CCN(c2ccc(C)cc2)CC1 55252824 WINUISCMPUFXRB-UHFFFAOYSA-N 381.476 2.932 0 50 GFAA Cc1ccn2c(CN3CCC[C@H](CO)C3)c(C(=O)N3CCCCCC3)nc2c1 71761403 YFZIACIRDZBSBG-SFHVURJKSA-N 384.524 2.863 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@H](Nc3ccc4c(c3)OCCO4)C2)cc1 72145038 MWWXWTSJMCXCCJ-INIZCTEOSA-N 378.436 2.514 0 50 GFAA CN(C)c1nc2c(c(=O)[nH]1)CCN(C(=O)C(c1ccccc1)c1ccccc1)C2 72153625 IYKMUXXTLGOCHT-UHFFFAOYSA-N 388.471 2.553 0 50 GFAA O=C(NC[C@@]1(O)CCCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1)C1CC1 72154094 TUCCADMDBKPYIO-GOSISDBHSA-N 384.398 2.589 0 50 GFAA Cc1nc(NCCNC(=O)Nc2ccc(F)cc2)cc(-n2cnc(C)c2C)n1 72446884 JIBINGZQMZNNMN-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(c3ncccc3C(=O)O)C2)cc1OC 72480344 BWAGFRUBFVOJEP-QGZVFWFLSA-N 399.491 2.940 0 50 GFAA COC[C@H](NC(=O)c1ccc2nc(-c3ccccc3)cn2c1)c1ccnn1C 82093022 WMONHYCDNRIYEO-SFHVURJKSA-N 375.432 2.852 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)nc1 91997729 YUJMZGYTYPMAGM-UHFFFAOYSA-N 378.476 2.830 0 50 GFAA Cc1cc(C)c2nc(C)cc(C(=O)N3C[C@@H]4CCN(C)C[C@]4(C(=O)O)C3)c2c1 92062193 OOLKOVVCCMUEIY-AOMKIAJQSA-N 381.476 2.639 0 50 GFAA Cc1nnc(N2CCC[C@@H](c3nnc(Cn4ccnc4)n3C)C2)c2ccccc12 95389084 XCUCHEJFNPRJQZ-MRXNPFEDSA-N 388.479 2.696 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3cccnc3)C[C@H]2CCO)o1 104468883 ICJLNGMHKZLCQK-HXUWFJFHSA-N 380.492 2.843 0 50 GFAA O=C(Nc1ccc(F)cc1OCC(F)F)N1CCC[C@H]1CN1CCOCC1 181414166 DFTLWQWDECBOJA-AWEZNQCLSA-N 387.402 2.798 0 50 GFAA CN(C)CCn1ccc2ccc(NC(=O)[C@H]3COCCN3CC3CCC3)cc21 185704216 DOBDJQAHZQPSNN-OAQYLSRUSA-N 384.524 2.642 0 50 GFAA O=C1N[C@H](c2ccsc2)[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 227190247 ICEPCWLFVBBDPY-CWSCBRNRSA-N 376.381 2.914 0 50 GFAA O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccc(C(=O)O)nc1 238007243 YLESTAVWYOLECL-UHFFFAOYSA-N 394.353 2.592 0 50 GFAA C[C@@H]1CC[C@@H](C(=O)O)CN1C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 263243438 RWDVXSFOBHDKCI-CZUORRHYSA-N 388.851 2.875 0 50 GFAA CCc1nnc(C)cc1C(=O)N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1 273540662 WPAQEBYEBUCTQU-UHFFFAOYSA-N 386.883 2.528 0 50 GFAA Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@@H](c3nc(O)n[nH]3)C2)cc1Cl 407988392 CLXWRNXHVJUTRR-SECBINFHSA-N 391.280 2.694 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@H](O)C3)csc2C1 426411559 VAUQYULMAQSLPR-AWEZNQCLSA-N 375.494 2.508 0 50 GFAA CCOC(=O)c1cncc(-c2cccc(C(=O)NCc3noc(CC)n3)c2)c1 426430905 ACHGOAZQWCFGLT-UHFFFAOYSA-N 380.404 2.801 0 50 GFAA CC(C)c1cc(CNC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)on1 426621834 WIWAQQFPTHDTGN-UHFFFAOYSA-N 386.452 2.554 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)Cc3cnccn3)csc2C1 426712586 GISIEVRBZADCMN-UHFFFAOYSA-N 397.504 2.973 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCO[C@@H](C(F)F)CC2)(c2ccccc2)CC1 870648428 LXVRYBZGWXNBCT-QGZVFWFLSA-N 392.446 2.615 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N3CC[C@H](O)CC(C)(C)C3)c(C)s2)n[nH]1 1506418548 QYDNRKJELWGCRW-ZDUSSCGKSA-N 383.539 2.927 0 50 GFAA NC(=O)Cc1nc([C@H]2CCn3nccc3C2)n(-c2ccc(Cl)c(Cl)c2)n1 1857670774 BQBVXZGCHZSXBX-JTQLQIEISA-N 391.262 2.528 0 50 GFAA C/C=C/CCCC(=O)N1CCC2(CC1)CN(Cc1ccncc1)C[C@@H]2C(=O)O 1857684971 LXPSCQXNEQDSEX-LSTKMXGYSA-N 385.508 2.953 0 50 GFAA CCc1ccccc1CN1C[C@H](C(=O)O)C2(CCN(Cc3cc[nH]n3)CC2)C1 1857685575 YHQITSJAHXLVMA-HXUWFJFHSA-N 382.508 2.771 0 50 GFAA O=C(c1ccc2[nH]c3c(c2c1)CCCC3)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857738209 WYSOGBCKEAPYRM-KNQAVFIVSA-N 379.460 2.610 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)[C@H]3CC[C@H](C)CC3)CC(=O)N2[C@H]1c1ccccc1 1875247561 KIUDWCQAXLRATL-UPNGQEOPSA-N 398.503 2.786 0 50 GFAA CC(C)Oc1ccc2[nH]ccc(=NC[C@]3(N4CCOCC4)CCCOC3)c2c1 1875265590 KJUDNYUSGUGLNL-JOCHJYFZSA-N 385.508 2.737 0 50 GFAA Cc1ccc(N2N=C(C(=O)NCc3cccc4nsnc34)CCC2=O)cc1 1875307594 FOYFGCZNCYWLMA-UHFFFAOYSA-N 379.445 2.799 0 50 GFAA C[C@@H](NC(=O)[C@H](O)CN1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1875308678 RLLTZTZEFWETBJ-FOIQADDNSA-N 399.466 2.712 0 50 GFAA C[C@@H](Cc1ccc(F)cc1Cl)N[C@@H]1C[C@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875311543 DUCROZJLHMDVIS-YDOWWZDFSA-N 395.862 2.734 0 50 GFAA CC(C)C[C@@H](CNC(=O)[C@H](C)n1cncn1)NC(=O)CC1(C)CCCCC1 1875329419 VEWIQNYYRDIUBF-IRXDYDNUSA-N 377.533 2.847 0 50 GFAA CCOC(=O)c1oc(NS(=O)(=O)c2cccc(F)c2)nc1C(F)(F)F 1875340205 QGWXEZNIMLPFAU-UHFFFAOYSA-N 382.291 2.810 0 50 GFAA CC(C)(O)CN1CCc2c(cccc2NC(=O)c2n[nH]cc2-c2ccncc2)C1 2325798145 QGADHUVFXRYLHC-UHFFFAOYSA-N 391.475 2.853 0 50 GFAA O=C(Nc1sncc1Br)[C@H]1CCCN1C(=O)c1ccccc1O 2325803353 BOSWYCZUIQUBPE-LLVKDONJSA-N 396.266 2.855 0 50 GFAA CC(C)CC1(C(=O)Nc2ccc3c(c2)C(=O)N([C@H]2CCC(=O)NC2=O)C3)CCC1 2325888000 JZRUJJPXBXVOHM-KRWDZBQOSA-N 397.475 2.603 0 50 GFAA CCCn1nnc(NC(=O)c2cc(I)ccc2Cl)n1 1100131 NZJCUEZNPWLRMX-UHFFFAOYSA-N 391.600 2.593 0 50 GFAA CC(C)=CCN1CC[C@H]2[C@@H]1CCN2C(=O)Cn1c(C)cc(=O)c2ccccc21 2356135755 RWQLUZHHNUMBCH-SFTDATJTSA-N 379.504 2.951 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)N2CCN(C3CC3)C[C@H]2C)cc1Cl 2356153094 RBCHUGBNSSYWHP-SNVBAGLBSA-N 379.309 2.859 0 50 GFAA CN(C)c1ncccc1C(=O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356162684 OXRNPLQWROWHOH-QHCPKHFHSA-N 392.503 2.945 0 50 GFAA COc1ccc(NS(=O)(=O)c2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1 3417607 WMDLSPZOAUCNND-QGZVFWFLSA-N 376.434 2.614 0 50 GFAA COc1cccc(CCc2nnc(CCC(=O)NCCc3cscn3)o2)c1 20119831 UIBYUYTUGHQHOF-UHFFFAOYSA-N 386.477 2.611 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@H](Cn2cccn2)C1)c1ccsc1 111087344 WTPOHSICBYYTFX-INIZCTEOSA-N 396.472 2.738 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)Nc2ccc(C(=O)NC(C)C)cc2)CC1=O 108325242 RINYYOPLJYZEAM-MRXNPFEDSA-N 395.459 2.825 0 50 GFAA COc1ccc(CCN(C)[C@H]2CCCN(Cc3ccc(CO)o3)C2)cc1OC 20293422 JKNGAENUPVBXPP-SFHVURJKSA-N 388.508 2.928 0 50 GFAA OCC[C@@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1Cc1ccc(F)cc1 20205445 FPCZGRYSYVVRKF-HXUWFJFHSA-N 386.467 2.666 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)c1cc(Cn2cnc3ccccc32)[nH]n1 67895051 AIWMOHZOEUKLKB-UHFFFAOYSA-N 377.452 2.592 0 50 GFAA COc1ccc2cc([C@H]3CN(c4cc(NCCO)ncn4)CCO3)ccc2c1 71762030 ULYRRIZENXUZCA-LJQANCHMSA-N 380.448 2.621 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)[C@H]3CSCCS3)CC2)cn1 328633732 MGBQDXDFERSSGN-GDBMZVCRSA-N 380.583 2.789 0 50 GFAA Cc1ccc(S(=O)(=O)NC(=O)O[C@@H](C)c2sc3ncnn3c2C)cc1 4060324 VTWBTQAYISBOSG-NSHDSACASA-N 380.451 2.584 0 50 GFAA Cn1cc(CN(CCO)Cc2cccs2)c(-c2ccc3c(c2)OCCO3)n1 11933555 VQCSLNGCRDZKSD-UHFFFAOYSA-N 385.489 2.914 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1nnc(C2CC2)s1 71280131 CERGPYOQJHFBQB-UHFFFAOYSA-N 387.852 2.931 0 50 GFAA O=C(Nc1cccnc1N1CCC(CO)CC1)c1cccc(OCC(F)F)n1 127693434 MZKAPGVYXGVNQY-UHFFFAOYSA-N 392.406 2.582 0 50 GFAA CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)NCc2ccccn2)CC1 363943027 CLUYTQDFHCGSBW-UHFFFAOYSA-N 385.443 2.601 0 50 GFAA CN(Cc1nc(-c2ccoc2)no1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 155617732 GXLJKJMBETVHIC-ZDUSSCGKSA-N 379.825 2.943 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1ccc(O[C@H]2CCOC2)cc1 279108695 YIERTZGQMWDGBL-NRFANRHFSA-N 381.476 2.644 0 50 GFAA Cc1cccc(OC[C@@H]2CCCN(C(=O)c3cnc4sccn4c3=O)C2)c1 77505776 MADMGCMQSOKKJN-OAHLLOKOSA-N 383.473 2.996 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 72140586 VXIZQHNFBRQYET-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CCNC(=O)C(C)(C)CNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 378200227 LAJFOMRGSWIWRZ-AWEZNQCLSA-N 380.920 2.628 0 50 GFAA CN1CCN(c2ncccc2CNC(=O)CCc2c[nH]c3ccccc23)CC1 14976013 MTTNAKRPBMMKGB-UHFFFAOYSA-N 377.492 2.564 0 50 GFAA CCn1c(S)nc2cc(C(=O)N[C@H]3CCCCC[C@H]3OC)ccc2c1=O 170653350 UZPXGKVIPMIQIL-GOEBONIOSA-N 375.494 2.783 0 50 GFAA CS(=O)(=O)Nc1ccc(F)c(NC(=O)N(Cc2nccs2)C2CC2)c1 426740581 RQPVFUFNVAAPPP-UHFFFAOYSA-N 384.458 2.850 0 50 GFAA Cc1cc(C)nc(CNC(=O)N2CCN(c3nsc4ccccc34)CC2)n1 426613683 VGBXDNAJHHVHQT-UHFFFAOYSA-N 382.493 2.735 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(Cc1cccc(F)c1F)CC2 95510625 OSLXDGSXCYEZCD-UHFFFAOYSA-N 386.446 2.974 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2[nH]cnc2-c2ccccc2)CC1=O 426724065 YGZGAFWLOIBQTH-UHFFFAOYSA-N 376.416 2.574 0 50 GFAA O=S(=O)(Cc1cccc(Cl)c1)NCc1ccncc1OC[C@H]1CCOC1 288727730 ZNBKDKIWTSRYHI-HNNXBMFYSA-N 396.896 2.770 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1cc(O)ccc1OC)CC2 91747061 HNROPMRTHPVDGG-UHFFFAOYSA-N 376.497 2.642 0 50 GFAA CCc1nnc(-c2cccc(NC(=O)N3CCN(Cc4ccco4)CC3)c2)[nH]1 96163184 FPRSPQFXQDPQKW-UHFFFAOYSA-N 380.452 2.977 0 50 GFAA O=C(N[C@H]1CC(=O)N(c2ccc(F)cc2)C1)c1cccc(Cn2cccn2)c1 91444815 POVSCVYTDLYNSX-SFHVURJKSA-N 378.407 2.606 0 50 GFAA O=C(CCSc1nc(O)c2ccccc2n1)N[C@H](Cc1ccccc1)C(=O)O 252571475 XZLPSQYCOIRYNI-MRXNPFEDSA-N 397.456 2.630 0 50 GFAA Cc1ccc(NC(C)(C)C(=O)N(Cc2ccccn2)C[C@@H]2CCC(=O)N2)cc1 1506396597 VPRNRJJEKHHGGZ-IBGZPJMESA-N 380.492 2.888 0 50 GFAA Cn1cnc(NC(=O)C2(c3ccccc3)CCN(Cc3ccccc3)CC2)n1 1940195191 NONMWYJNZNXZBL-UHFFFAOYSA-N 375.476 2.988 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1ccc(F)cc1)Nc1ccc2scnc2c1 952965600 AMZFLAZYFRDYFA-QGZVFWFLSA-N 398.463 2.765 0 50 GFAA COc1ccc2ccccc2c1CNC(=O)N1CCN(c2ccnc(C)n2)CC1 184925190 ACEBYHHSTKKBFT-UHFFFAOYSA-N 391.475 2.979 0 50 GFAA CN1C(=O)Cc2cc(NC(=O)[C@H]3CCCN(C(=O)Cc4ccccc4)C3)ccc21 194611327 AICUHURUCRNWEA-KRWDZBQOSA-N 391.471 2.625 0 50 GFAA Cc1ccc(-c2nc([C@@H]3CC(=O)N(C4CCCC4)C3)n(-c3cnn(C)c3)n2)o1 1772811701 XRFFXQCVYRJKMR-CQSZACIVSA-N 380.452 2.828 0 50 GFAA CCOc1ccccc1NC(=O)CSc1nnc(COc2ccccc2)n1N 5069093 XSPQMFDDDZTFRR-UHFFFAOYSA-N 399.476 2.700 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2cccc(I)c2)C1 5592433 FYLWKESJVOWILJ-GFCCVEGCSA-N 387.217 2.707 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)CN(CC)CC)C1 12594993 PBSOBYIWFMOLLO-NRFANRHFSA-N 378.488 2.882 0 50 GFAA CC(C)CCN[C@H]1CCc2c(c(C(=O)N3CCOCC3)nn2CC(C)C)C1 14752377 UVCMJWDQORLHOU-KRWDZBQOSA-N 376.545 2.505 0 50 GFAA COCCn1c(CN(C)C(C2CC2)C2CC2)cnc1S(=O)(=O)CC(C)(C)C 15069619 KVAYTNGMWAHHFC-UHFFFAOYSA-N 397.585 2.970 0 50 GFAA Cn1ccc2c(C(=O)NC[C@@H]3CCC[C@H](NC(=O)Cc4cc[nH]n4)C3)cccc21 1857675692 HDOXCOFTHZBNMF-CVEARBPZSA-N 393.491 2.549 0 50 GFAA CCCc1nc(CN(C)C(=O)C2CCN(c3nc4nc(C)ccc4o3)CC2)no1 1857697530 CBSDUFUAAXAJPN-UHFFFAOYSA-N 398.467 2.742 0 50 GFAA Cc1ccc([C@H]2COCCN2S(=O)(=O)c2ccc3c(c2)OCCCO3)o1 265299795 MMIPILGQNYIJCV-OAHLLOKOSA-N 379.434 2.512 0 50 GFAA Cc1nc(C)c(CNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)s1 266276010 YNACQNIPJXGNFR-UHFFFAOYSA-N 375.475 2.885 0 50 GFAA C[C@@]1(O)CCOC2(CCN(C(=O)C(c3ccccc3)c3ccccc3)CC2)[C@H]1O 1704344411 POMKAPPIEVBKLK-XZOQPEGZSA-N 395.499 2.712 0 50 GFAA C[C@H](O)CN1CCN(C[C@H](CN(C)Cc2ccccc2)c2ccccc2)CC1 864097581 XCCOOLFQKFXATP-URXFXBBRSA-N 381.564 2.901 0 50 GFAA COC[C@]1(O)CCOC[C@H]1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 1875278515 GPDZFWKPFGMBCV-FYYLOGMGSA-N 394.471 2.586 0 50 GFAA O=C(Cc1ccc(C(=O)O)cc1)NC1CCN(c2nc3ccccc3[nH]2)CC1 1875286227 LISCTROTEVZNRL-UHFFFAOYSA-N 378.432 2.589 0 50 GFAA c1ccc(-c2nc(NCc3nc([C@H]4CCOC4)n[nH]3)c3ccsc3n2)nc1 1875339319 FCCNFGXBWLNGRT-NSHDSACASA-N 379.449 2.987 0 50 GFAA CCc1cccc(F)c1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397334 WEZDLCYFRYZYEQ-QGZVFWFLSA-N 399.514 2.865 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)[C@@H](C)C1 1875381186 MRPAJLROIZXBHE-HNNXBMFYSA-N 399.491 2.843 0 50 GFAA c1ccc(Sc2nc(Sc3ccccn3)nc(N3CCOCC3)n2)nc1 1875391156 ORNUJILALXPCLL-UHFFFAOYSA-N 384.490 2.801 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)c2cc(OC)cc3c2OCC3)c(F)c1 1875386265 MAXLCJCSXHMWLO-UHFFFAOYSA-N 384.407 2.501 0 50 GFAA Cc1[nH]c2ccccc2c1CCC(=O)N[C@H]1CCN(c2cnnc(O)c2Cl)C1 2325807650 JXPVQAUNAVGOHO-ZDUSSCGKSA-N 399.882 2.953 0 50 GFAA COc1ccc(OC)c(NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)c1 816930 ZPAQZHRGTJCSHL-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA NC(=O)CSc1nnc(-c2cccnc2)n1-c1cccc(C(F)(F)F)c1 1058164 XSWQVASEBQJVNH-UHFFFAOYSA-N 379.367 2.926 0 50 GFAA COc1ccc(S(=O)(=O)N[C@H]2C[C@H]3CC[C@H]2C3)cc1C(=O)N1CCCCC1 101785644 DJYKBYCMIDUIAN-MPGHIAIKSA-N 392.521 2.788 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4c[nH]nc4C)C3)C2)c1OC 15068979 HTSUAGZGTUSBCK-JOCHJYFZSA-N 398.507 2.864 0 50 GFAA O=C(c1ccc(NC[C@H]2CCCCO2)nc1)N1CCC(Cn2cccn2)CC1 20600147 UYHNQTLWVMFFNV-LJQANCHMSA-N 383.496 2.812 0 50 GFAA CC(C)NC(=O)CNC(=O)c1csc2nc(-c3ccccc3Cl)cn12 67868874 KLCHZDTVELUYGC-UHFFFAOYSA-N 376.869 2.971 0 50 GFAA c1ccc(CNc2ncc(CN3CCC[C@H](CN4CCOCC4)C3)cn2)cc1 215192675 VZYJRWGWWPJZBD-HXUWFJFHSA-N 381.524 2.633 0 50 GFAA O=S(=O)(CCn1ccnc1-c1ccc([C@H]2CCCCO2)o1)N1CCCC1 77537626 HPTRVCDAFDUPJE-OAHLLOKOSA-N 379.482 2.810 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@H](C(=O)NCCc4ccccc4)C3)nn12 32094334 SWHXLIKWIMRFSJ-SFHVURJKSA-N 392.507 2.823 0 50 GFAA O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)N1CCC[C@H](C2CC2)C1 377346635 PBZRHGNVIVHBCH-INIZCTEOSA-N 395.500 2.697 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccccn2)C(=O)c2cc(-c3ccccc3)on2)N1 77542101 BVMJAGBHINWREN-KRWDZBQOSA-N 376.416 2.658 0 50 GFAA CC(C)c1cc(C(=O)N2CCC(n3cc(-c4ccccn4)nn3)CC2)n(C)n1 48308327 MKGQTQNNPKQZNH-UHFFFAOYSA-N 379.468 2.674 0 50 GFAA Nc1ncc(-c2ccc(C(=O)NC3CCN(Cc4ccco4)CC3)cc2)cn1 426705700 MTMUDPPUWGRXDT-UHFFFAOYSA-N 377.448 2.713 0 50 GFAA O=C1N[C@H]2CCC[C@@H]1CN(C(=O)Nc1ccc(CCc3ccccn3)cc1)C2 96163820 TZFAYDAXRSNEJZ-XLIONFOSSA-N 378.476 2.999 0 50 GFAA O=C(c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)cc1)N1CCCCC1 239439155 ZMTXTZVBIWXYBD-RPZLJYRGSA-N 376.456 2.870 0 50 GFAA Cc1ccc(NC(=O)N2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)cc1Cl 91782118 BMGWSWOZCVZANM-LJQANCHMSA-N 378.904 2.809 0 50 GFAA CSCCC(=O)N1C[C@H](C2CC2)[C@@H](NC(=O)Cc2c[nH]c3ccccc23)C1 95373288 RSRPFQMMDNDMNX-MJGOQNOKSA-N 385.533 2.817 0 50 GFAA O=C1CC[C@]2(CCCN(S(=O)(=O)c3c(F)cccc3F)C2)CN1C1CC1 91663430 IYXSHSZXHIVOEB-SFHVURJKSA-N 384.448 2.521 0 50 GFAA COc1cncc([C@H](NC(=O)c2cc(-c3ccccc3)on2)[C@H]2C[C@@H](O)C2)c1 243932475 BVQSCOJZZUDZLT-PTSWNOGYSA-N 379.416 2.987 0 50 GFAA Cc1ccc([C@@H]2[C@H](C(=O)OC(C)C)C(=O)C[C@@](C)(O)[C@H]2C(=O)OC(C)C)cc1 244691873 JKLWHFRPHNOWMT-JPAWQOSXSA-N 390.476 2.938 0 50 GFAA CN(C[C@H]1CCCC[C@H]1O)C(=O)c1cccnc1-n1cc(Br)cn1 294946490 IPOUNWFHYVELMB-IUODEOHRSA-N 393.285 2.653 0 50 GFAA O=C(NCCn1ccc2ccc(Cl)cc21)[C@@H](Cc1ccccc1)n1cnnn1 252479402 BEGCZDCTUQLOKX-LJQANCHMSA-N 394.866 2.881 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCCc3nc4c(s3)CCCC4)C2)no1 371378743 KZPVPKQTLRHYNE-ZDUSSCGKSA-N 375.498 2.845 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)N[C@H](C)C2CCCCC2)cc1 952971393 NWNLCBXVEVZREF-MRXNPFEDSA-N 381.542 2.931 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@H](Cn3cncn3)C2)ncn1 275653564 KRWBHQVFLOWEEA-ZWOKBUDYSA-N 385.516 2.600 0 50 GFAA O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N[C@@H]1CCCc2c(O)cccc21 190316174 QOGKNYLXACAZPX-MRXNPFEDSA-N 383.839 2.893 0 50 GFAA CCN(c1ccccc1C)S(=O)(=O)NC(=O)C[C@@H]1OCCc2ccccc21 191008130 UEAKEKBUJGBSCY-IBGZPJMESA-N 388.489 2.886 0 50 GFAA Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CCCN(C(=O)c2ccco2)CC1 1506414861 IORIWEWEQVUPMM-UHFFFAOYSA-N 378.432 2.966 0 50 GFAA CC1=C(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)OCCO1 1506405493 FBCKMYKEDUHYMF-SFHVURJKSA-N 390.455 2.690 0 50 GFAA Cc1ccc(F)cc1CC(=O)N1CC[C@H](O)[C@@](Cc2ccccc2)(C(=O)O)C1 1704343169 UIWIGYLELMRMPJ-UGKGYDQZSA-N 385.435 2.584 0 50 GFAA CC(=O)c1cccc(N2CN=c3s/c(=C\C=C\c4ccccc4)c(=O)n3C2)c1 1138873 QOZUDQZGPLLTQE-CDVYDLBASA-N 389.480 2.661 0 50 GFAA CSc1ccccc1N1C(=O)CN(C(=O)Cc2ccc3c(c2)OCO3)C[C@@H]1C 12097140 TUDRPIMYXAMRNK-AWEZNQCLSA-N 398.484 2.944 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 12429886 ZOZDMNBIJMZFTJ-OAHLLOKOSA-N 398.532 2.514 0 50 GFAA CC(=O)NCCC(=O)N1CCO[C@H](CC(c2ccccc2)c2ccccc2)C1 12457650 BJJGLIXTYLNBRK-OAQYLSRUSA-N 380.488 2.962 0 50 GFAA O=C(Cc1ccccc1)N1CCC[C@@]2(CN(Cc3nccs3)CC[C@H]2O)C1 1857695068 SCDBPOPLFZUJNU-WIYYLYMNSA-N 385.533 2.561 0 50 GFAA CC(C)CN1CCC2(CC1)OCCc1sc(C(=O)N3CCC[C@@H]3CO)cc12 1857705535 LKBVBKFDSZKSJI-MRXNPFEDSA-N 392.565 2.865 0 50 GFAA CCCc1nc(CNC(=O)[C@H]2CC(=O)N(c3nnc(CCC)s3)C2)cs1 1857716467 NGFWHESJJLOHGM-NSHDSACASA-N 393.538 2.569 0 50 GFAA Cc1cc(C)nc(CN(C)C(=O)[C@H]2CC(=O)N(c3nnc(C(C)C)s3)C2)c1 1857721333 KLHUBZJAEVVHNZ-AWEZNQCLSA-N 387.509 2.685 0 50 GFAA C[C@@H](NC(=O)N[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C)c1cccc(S(N)(=O)=O)c1 241897379 TYFXVEQOJQUCHG-KJPHAFAOSA-N 379.526 2.909 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C/OC)C(=O)OC 14686818 DAXYUDFNWXHGBE-KFFVICKMSA-N 384.476 2.700 0 50 GFAA biogenic Cc1ccc([C@@H]2COCCN2S(=O)(=O)c2ccc3c(c2)OCCCO3)o1 265299793 MMIPILGQNYIJCV-HNNXBMFYSA-N 379.434 2.512 0 50 GFAA O=C(NS(=O)(=O)Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CC(=O)[C@@H]1C2 873582789 VMOSXKZGPKNBPA-CKLFPEKLSA-N 376.261 2.555 0 50 GFAA C=CC(=O)NC[C@@H](NC(=O)[C@H]1CCCN(C(C)=O)C1)c1ccc2ccccc2c1 1875386347 NXNASBDSDIGUFA-LEWJYISDSA-N 393.487 2.558 0 50 GFAA CN(CCC(F)F)C(=O)CCN1C(=O)COc2cc(Br)ccc21 2325781678 ZSZWJTPRCLIHTO-UHFFFAOYSA-N 391.212 2.678 0 50 GFAA O=S(=O)(c1ccccc1)n1c(CNCC23COC(C2)C3)cc2cccnc21 2325784259 MUQUJVZBGUSHHW-UHFFFAOYSA-N 383.473 2.542 0 50 GFAA C[C@H](CNC(=O)C(C)(C)C1CCCCC1)N(C)C(=O)C[C@@H]1CCC(=O)N1C 2325794326 YRRCTKIFNUKQLI-WBVHZDCISA-N 379.545 2.567 0 50 GFAA NC[C@@H](CC(=O)N=c1cc2ccccn2[nH]1)c1ccc(Br)s1 2325862446 UQAYVRFAEAOYAM-SNVBAGLBSA-N 379.283 2.651 0 50 GFAA CN1C[C@H](O)C[C@H]1CNC(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 887602967 NYKUSZPNLGSTIA-NSHGMRRFSA-N 392.503 2.664 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 665981 XISHVTWCFYEHKI-HNNXBMFYSA-N 383.423 2.654 0 50 GFAA CCC[C@H]1[C@H]2C[C@H](CN(C(=O)CCc3csc(=N)[nH]3)C2)[C@@H]2CCCC(=O)N12 2356140948 SGEBNSIHEHSTAD-FSDCSDTHSA-N 390.553 2.516 0 50 GFAA COc1cc(I)c(OC)cc1I 4127654 GLVOXVCTGAISRY-UHFFFAOYSA-N 389.958 2.913 0 50 GFAA in-vitro COc1ccc(Cn2cc(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cn2)cc1 109209689 LFVZCUVXIWZFFJ-IBGZPJMESA-N 381.436 2.568 0 50 GFAA CNC(=O)[C@@H]1CCCN(CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)C1 111266000 GFEUPPFRGLSWNY-UTKZUKDTSA-N 397.544 2.680 0 50 GFAA OCCOc1ccccc1CN1CCC[C@H](N2CCN(c3ccccc3)CC2)C1 23372914 MFVAXXHAGFZUGI-QHCPKHFHSA-N 395.547 2.844 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccccc3Cl)CC2)cc(-n2ccnc2)n1 65363118 XDSFYBLYCOKHHD-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3cc(-c4ccccc4O)n[nH]3)CC2)nc1 67804245 UJACWBVMDJAOLY-UHFFFAOYSA-N 378.432 2.610 0 50 GFAA CN(C)C(=O)c1ccc(C(=O)NC2CCN(CCc3ccccc3)CC2)cc1 170841668 MGCPLJFRTVXVMU-UHFFFAOYSA-N 379.504 2.825 0 50 GFAA Cn1c([C@@H]2CCCN2CC(=O)N2CCO[C@@H]3CCCC[C@H]32)nc2c1CCCC2 328621660 APUSNIQJYFUNBK-HSALFYBXSA-N 386.540 2.606 0 50 GFAA CC1(C)C(O)=Nc2ccc(S(=O)(=O)N3CC[C@H](Oc4cccnc4)C3)cc21 328612272 OFELSGYOEUVSNU-AWEZNQCLSA-N 387.461 2.803 0 50 GFAA Cc1nnc([C@H]2CN(S(=O)(=O)c3cc(Cl)sc3Cl)CCO2)o1 328609474 DKDPFMCKGZUISH-SSDOTTSWSA-N 384.266 2.509 0 50 GFAA CC(C)NS(=O)(=O)Cc1ccccc1CNc1nc2ccc(F)cc2n1C 431015871 XPCBTJQJIGVZNI-UHFFFAOYSA-N 390.484 3.152 0 50 GFAA C[C@@H](NC(=O)c1ccnc(N2CCN(C)CC2)c1)c1ncc(-c2ccccc2)o1 125530455 BEEQHPAONVUBRQ-MRXNPFEDSA-N 391.475 2.979 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@H]3[C@@H](CCCN3Cc3ccccc3)C2)cc1 156677833 IHIPNONWNDDBHH-SFTDATJTSA-N 377.488 2.912 0 50 GFAA CC[C@H](CO)NC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 71748475 JWJDUMKEENJZNM-OAQYLSRUSA-N 387.568 2.559 0 50 GFAA CC(C)c1nc(C(=O)N2CCC[C@@H](CCC(=O)N3CCOCC3)C2)cs1 14969729 SABOZNKDIVTGIT-HNNXBMFYSA-N 379.526 2.758 0 50 GFAA COCCN(C)C(=O)[C@@H]1CCCN(C2CCN(CCc3ccccc3)CC2)C1 71524743 IVYMXKDMGKDSBB-OAQYLSRUSA-N 387.568 2.510 0 50 GFAA CCc1ccc(C(=O)Nc2sccc2C(=O)N2CCN3CCOC[C@H]3C2)cc1 371870458 QFSYBWFJBTYPEK-QGZVFWFLSA-N 399.516 2.719 0 50 GFAA Cn1nc(-c2ccccc2)c2cc(C(=O)NC[C@@]3(O)CCCNCC3)sc21 72158449 WQIRTJGYUFDVOQ-HXUWFJFHSA-N 384.505 2.536 0 50 GFAA CC(C)n1cc(C(=O)N2CCC(C(=O)N3CCc4ccccc4C3)CC2)cn1 77424055 VLNVSTOCSZOMMU-UHFFFAOYSA-N 380.492 2.901 0 50 GFAA COc1cc(OC)c(C(=O)N2CCC[C@@](O)(C(F)(F)F)CC2)cc1OC 287869154 NHQIFINAXYHLAI-INIZCTEOSA-N 377.359 2.632 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(Cc3nccn3C(C)C)CC2)n1C 96179747 XXMBKZWYEWEGCQ-UHFFFAOYSA-N 382.516 2.525 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(Cc1ccc(OC)cc1F)CC2 91326988 CERVMGASRZYTIW-UHFFFAOYSA-N 386.471 2.843 0 50 GFAA CC(C)(C)n1nc(-c2cccnc2)nc1[C@H](c1cccnc1)N1CCOCC1 95527870 HKFFYJGZCJHUFJ-SFHVURJKSA-N 378.480 2.912 0 50 GFAA c1ccc(-c2cc(Cn3ccnc3-c3cn(C4CCNCC4)nn3)no2)cc1 91942999 HFSBDFRQFLHXEB-UHFFFAOYSA-N 375.436 2.769 0 50 GFAA Cc1nc(CC(=O)N2CCC(c3nccn3CCCN(C)C)CC2)cs1 95391908 MJKAUKLFAZOCHR-UHFFFAOYSA-N 375.542 2.548 0 50 GFAA Cn1cc(CNC(=O)CN2Cc3ccccc3O[C@H](c3ccsc3)C2)cn1 39353565 GYPXDHLICIKEQY-IBGZPJMESA-N 382.489 2.734 0 50 GFAA Cc1cc(C)nc(-c2cccc(C(=O)N3CCC4(CC3)OCCC[C@H]4O)c2)n1 299793586 GXLUIHCMEDAPQY-LJQANCHMSA-N 381.476 2.907 0 50 GFAA Cc1ccc2c(c1)[C@@H](NC(=O)N(C)C1CCS(=O)(=O)CC1)CC(C)(C)O2 584903112 UQRQZACJVBKHTR-INIZCTEOSA-N 380.510 2.816 0 50 GFAA COc1cc2c(cc1CN[C@H]1CCCN(C(=O)c3ccco3)C1)OCCCO2 952983814 RNNXPYPOVLKNRV-INIZCTEOSA-N 386.448 2.844 0 50 GFAA O=C1O[C@H]2CN(Cc3ccccc3Cn3cccn3)C[C@H]2N1Cc1ccccn1 1565507174 YNHBDSSACCSDQY-RTWAWAEBSA-N 389.459 2.532 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)on1 1565510917 PBTWFEDKXYUWGX-QAPCUYQASA-N 382.464 2.645 0 50 GFAA CCCOc1c(Br)cc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1OC 269216549 YJDPQJCGZHMLRV-SNVBAGLBSA-N 386.242 2.793 0 50 GFAA CCOC(=O)[C@H](COC)N(C(=O)/C=C/c1c(Cl)nc2sccn12)C1CC1 170607478 NAVQGBMKELNWHC-YBJDMEARSA-N 397.884 2.632 0 50 GFAA CCc1c(NC(=O)N(C)Cc2nc(CCOC)no2)cnn1-c1ccccc1C 191638748 FRFWMFCZPIHATK-UHFFFAOYSA-N 398.467 2.979 0 50 GFAA COc1cccc(N2C[C@@H](Nc3cc(C(=O)N4CCCCC4)ccn3)CC2=O)c1 1704336973 OEBZIRCJKFBCQB-KRWDZBQOSA-N 394.475 2.934 0 50 GFAA O=C(c1cccnc1NC1CCN(C(=O)N2CCCCC2)CC1)N1CCCC1 1704297327 MUXYLIYUPUZEGG-UHFFFAOYSA-N 385.512 2.800 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@](C)(O)C2)ccc1F 1704327299 BWWZBZJYBYRSPX-IBGZPJMESA-N 377.416 2.542 0 50 GFAA NC(=O)[C@@H]1CCCN(CCNC(=O)c2ccc3nc(C4CCCCC4)oc3c2)C1 11838251 VKWSOCCGAWDKRF-QGZVFWFLSA-N 398.507 2.803 0 50 GFAA Cc1c(C(=O)N2CCCN(C)CC2)sc2ncnc(NCc3ccco3)c12 12080227 JIGAKNSWXCQDQP-UHFFFAOYSA-N 385.493 2.983 0 50 GFAA CCCNC(=O)N1CC[C@]2(CCCN(Cc3cc(OC)ccc3F)C2=O)C1 12432416 QEQOENRILLVWNA-HXUWFJFHSA-N 377.460 2.768 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2F)CN(C(=O)c2cccnc2)CC1=O 14753196 GVQQAFWTWQFMLI-LJQANCHMSA-N 399.466 2.747 0 50 GFAA Cc1ccc(C(=O)N2CC[C@]3(CCCN(Cc4ccccc4F)C3)C2)c(=O)[nH]1 14965403 DGCHIQBPSQZNPF-QFIPXVFZSA-N 383.467 2.951 0 50 GFAA Cc1ccc(CN2CCN(Cc3cccn3-c3cccnc3)C[C@@H]2CCO)o1 19854088 ICJLNGMHKZLCQK-FQEVSTJZSA-N 380.492 2.843 0 50 GFAA O=C(OCc1ccccc1)[C@H]1[C@@H]2C(=O)N(Cc3ccccc3)C[C@@]23C=C[C@H]1O3 165573528 VPPDEEZJOFBAPZ-URFJDIBFSA-N 375.424 2.712 0 50 GFAA Cc1cc(=O)c(O)c(C2(CC(=O)N[C@@H](CO)Cc3ccccc3)CCCCC2)o1 1857526328 AQDILIVYZQEKHS-GOSISDBHSA-N 399.487 2.966 0 50 GFAA COc1ccc(-c2cccc(C(=O)N3CCc4[nH]nc(C(=O)O)c4C3)c2)cc1 1857673100 NVGYVKXWXCZABX-UHFFFAOYSA-N 377.400 2.982 0 50 GFAA O=C(CCCCc1nc2ccccc2s1)N1CC[C@@]23OCCN2C(=O)C[C@@H]13 1857740438 NXYNLEQGWSZYDQ-UZLBHIALSA-N 385.489 2.569 0 50 GFAA O=C([C@H]1CC12CCNCC2)N1CCO[C@@H](c2ccccc2Br)C1 236589469 HHAQPJDXAHZPIT-GDBMZVCRSA-N 379.298 2.739 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CC[C@@H](C(=O)O)C3)cc2)c(C)c1Br 237660754 QFKUYOPWEJCWBD-CYBMUJFWSA-N 392.253 2.798 0 50 GFAA CC1(C)CN(c2nccn3nnnc23)[C@H]1c1nccn1-c1cccc(Cl)c1 952893545 JFJPXNMHZAHQGE-AWEZNQCLSA-N 380.843 2.946 0 50 GFAA CC(C)[C@@H]1C[C@H](C(=O)NS(=O)(=O)c2ccccc2Br)CCO1 1875283734 CSBSTWUPGSJQAC-YPMHNXCESA-N 390.299 2.705 0 50 GFAA COc1cn(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1C[C@H](C)CNC[C@H]1C 1875301573 MZQLVJAIJXCIRN-CHWSQXEVSA-N 396.413 2.970 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@]1(CN[C@@H]1CCS(=O)(=O)C1)c1ccccc1 1875340051 JIKMSFJYLJWGJQ-YLJYHZDGSA-N 394.537 2.690 0 50 GFAA C=CC(=O)NCCc1ccc(CNC(=O)[C@H]2CCOc3c(F)cccc32)cc1 1875386251 LVQNGBNUNCZAJY-SFHVURJKSA-N 382.435 2.853 0 50 GFAA CC(C)c1ncsc1C(=O)N[C@@]1(c2ccc(S(C)(=O)=O)cc2)CCOC1 888100902 WVEZDHDDCPEZMI-SFHVURJKSA-N 394.518 2.716 0 50 GFAA O=C1C[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C(=O)N1CCc1ccccc1 18250346 ZFELRYDVEYVUHF-HXUWFJFHSA-N 397.906 2.832 0 50 GFAA Nc1ncnc2c1ncn2[C@@H]1CCN(CCSc2ccc(F)cc2F)C1 2325804124 WQJTZHQNLKXLIS-GFCCVEGCSA-N 376.436 2.726 0 50 GFAA COC(=O)c1coc(C2CN(C(=O)CO[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)C2)n1 2325811017 XTPQJVBVEUWBPZ-JLJPHGGASA-N 378.469 2.864 0 50 GFAA CC[C@@H](C)[C@H](C(=O)N1CCN(c2ccc3nncn3n2)CC1)c1ccccc1 136401404 XILJZJZQFIBARW-UZLBHIALSA-N 378.480 2.603 0 50 GFAA O=C(CCc1nc2ccc(F)cc2[nH]1)N1CCC[C@@]12CCCN(C1CC1)C2=O 2356137216 SKVUVKRMYGWHNU-OAQYLSRUSA-N 384.455 2.781 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC(Cc4ccc(O)nc4)CC3)cc2)n1 2356147648 HIUKGDNLVNZTEJ-UHFFFAOYSA-N 389.459 2.921 0 50 GFAA N=c1ncc(CN2CC[C@H]3[C@@H]2CCN3Cc2cnc(-c3ccccc3)s2)c[nH]1 2356149629 MRWSRRUYFLEZGH-OALUTQOASA-N 392.532 2.861 0 50 GFAA CN1CC[C@H](O)[C@@]2(CCCN(c3nc4c(c(C(F)(F)F)n3)CCCC4)C2)C1 2356154132 JCRGOORKKBGRKD-YJBOKZPZSA-N 384.446 2.657 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(F)cc2)cc1Cl 2877450 YUWJEYRJLLRYTJ-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA Cc1c(NC(=O)Nc2ccc3c(c2)OCCO3)n(C)c(=O)n1-c1ccccc1 4855560 BCHUSZGGSFMSTF-UHFFFAOYSA-N 380.404 2.900 0 50 GFAA Cc1csc(CN(C)C[C@]2(O)CCCN(Cc3cccc(F)c3F)C2=O)n1 55253457 VSAXWUHSNVHKGS-LJQANCHMSA-N 395.475 2.715 0 50 GFAA O=C(c1cc(COc2ccccc2)on1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 102447372 TVRCXQIDWVTCMR-HOTGVXAUSA-N 391.427 2.675 0 50 GFAA O=C(C[C@H]1CCOc2ccccc21)N1CCN(C(=O)c2ccc(O)cc2)CC1 117970634 CPBIPJRXPYINCD-QGZVFWFLSA-N 380.444 2.633 0 50 GFAA COc1ccccc1-c1nnc(SCC(=O)Nc2nc(C)cs2)n1C 8297980 KSDQCBMIJJMQGA-UHFFFAOYSA-N 375.479 2.986 0 50 GFAA COC(=O)c1sccc1NC(=O)CN1CCC(Oc2ccncc2C)CC1 225674127 AWDZBFLLFFSOLO-UHFFFAOYSA-N 389.477 2.720 0 50 GFAA CCN(Cc1ccncc1)[C@H]1CCCN(C(=O)CSc2nnc(C)s2)C1 23128600 GXIRMMIEAKFIRA-INIZCTEOSA-N 391.566 2.847 0 50 GFAA Cc1nnnn1[C@H](Cc1ccccc1)C(=O)NCc1nc(C(C)(C)C)cs1 118333539 FTWKOKGBBUFCCS-OAHLLOKOSA-N 384.509 2.836 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(O)c(Cl)c3)C[C@H]2CCO)CC1 104629317 UVSQEFISMDOTDA-LJQANCHMSA-N 395.975 2.787 0 50 GFAA C[C@]12C(=O)N(c3ccc(I)cc3)C(=O)[C@@H]1[C@H]1C=C[C@H]2C1 101867541 RFKPHBPWISGQRV-CGEOFPBHSA-N 379.197 2.993 0 50 GFAA CCn1nc(C(=O)O)c2c1CCN(C(=O)[C@@H](C)Oc1cccc(Cl)c1)C2 67673531 UAHZNWLVBAMPFA-LLVKDONJSA-N 377.828 2.607 0 50 GFAA O=C(Nc1ncns1)c1cccc(CN2CCC[C@H](Cn3ccnc3)C2)c1 67981847 DZSZRDGAOMKLQT-INIZCTEOSA-N 382.493 2.899 0 50 GFAA Cc1cnccc1-n1nc(C2CC2)nc1-c1cc(C)c(C)c(S(N)(=O)=O)c1 65466689 LAKPGENGUGVJRO-UHFFFAOYSA-N 383.477 2.779 0 50 GFAA Cc1ccccc1C1(C(=O)N2CCN(CC(=O)NC3CCCCC3)CC2)CC1 171321356 UQRKKRBACVKFEY-UHFFFAOYSA-N 383.536 2.620 0 50 GFAA CCC(=O)c1ccc(OC[C@@H](O)CN2CCN(c3ccccc3OC)CC2)cc1 20472127 ILFMELQOXITTOP-IBGZPJMESA-N 398.503 2.850 0 50 GFAA COC[C@@H](NC(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CCCO1 469090293 QOOUXLNHRVRJFC-CVEARBPZSA-N 394.269 2.763 0 50 GFAA Cc1ccc(-n2cccn2)cc1NC(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 252493936 NGSLZSJQDXUUMH-MRXNPFEDSA-N 379.468 2.705 0 50 GFAA CNC(=O)c1ccc(CN(C)C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cc1 172191456 NGLQWYBBWZPWAG-LJQANCHMSA-N 398.482 2.996 0 50 GFAA Cc1c(COc2ccccc2)cccc1NC(=O)C(=O)N1CC[C@H](CCO)C1 475693749 KSMRLXQUZQDLJV-QGZVFWFLSA-N 382.460 2.743 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(Cc3ccc(O)cc3)C2)cc1 12573944 AQFSJUDELQBBEP-QGZVFWFLSA-N 390.505 2.591 0 50 GFAA COc1ccccc1-c1cn([C@@H]2c3ccccc3C3(CCNCC3)[C@H]2O)nn1 72166946 PXBDVXNHUFDGPU-RTWAWAEBSA-N 376.460 2.539 0 50 GFAA CC(=O)N1CCc2cc(NS(=O)(=O)c3ccc(C(=O)O)c(Cl)c3)ccc21 438815663 SYYGERRUPKFFFS-UHFFFAOYSA-N 394.836 2.748 0 50 GFAA Cc1nccn1CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71751503 IUGYHDFQLCGNGZ-IBGZPJMESA-N 386.471 2.616 0 50 GFAA CN(C)CCN1C[C@@]2(CCCN(c3noc(-c4ccccc4)n3)C2)CCC1=O 72411188 VIGLPGWLZJFHBG-OAQYLSRUSA-N 383.496 2.507 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)C1 71681220 CRPLIDFERHFFLC-GOSISDBHSA-N 394.519 2.763 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)N3CCN(C)C[C@H]3c3ccccc3)CC2=O)cc1 241316893 LVUJVPPZPWRGND-RXVVDRJESA-N 393.487 2.563 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@]3(CC2)CN(C)C(=O)O3)c(-c2ccccc2)n1 72146556 IGMXKNLFTZIACV-OAQYLSRUSA-N 380.448 2.899 0 50 GFAA COc1cccc(-c2noc([C@@H](C)NC(=O)NC3(c4noc(C)n4)CCC3)n2)c1 173518806 JOXFFNAGZYVKJX-LLVKDONJSA-N 398.423 2.876 0 50 GFAA COc1cc2ccnc(N3CCN(C(=O)N4CCCCC4)CC3)c2cc1OC 44122745 NUCHURBXRKYYTO-UHFFFAOYSA-N 384.480 2.980 0 50 GFAA Cn1ncnc1[C@H]1COCCN1Cc1csc(COc2ccc(F)cc2)n1 284861437 SCJMWKJKQIMRPI-MRXNPFEDSA-N 389.456 2.563 0 50 GFAA O=C(Cn1ccc([C@@H]2CCCNC2)n1)NCc1ccccc1OC(F)(F)F 426485623 LYKZNBPHIXXXQC-CYBMUJFWSA-N 382.386 2.565 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1CC(=O)N(C2CC2)C1 176768715 NQNNESFLJDKWQG-SNVBAGLBSA-N 377.803 2.936 0 50 GFAA CC[C@@H](O)c1cc2n(n1)CCN(C(=O)c1cnc(C)nc1-c1ccccc1)C2 223423505 NEHDXBHDEICUBH-LJQANCHMSA-N 377.448 2.748 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(Cc2ccccc2C(=O)O)CC1 82120060 GARPLDPBKMNLIB-UHFFFAOYSA-N 385.416 2.892 0 50 GFAA CCCN1CCc2nc[nH]c2C12CCN(C(=O)c1onc3c1CCCC3)CC2 426549872 DFOCEPRGMSHZON-UHFFFAOYSA-N 383.496 2.676 0 50 GFAA C[C@H](CNC(=O)Cn1nc(C(F)(F)F)c2c1CCC2)Cn1cc(Cl)cn1 20607544 JQALCEHIKYJSFL-SNVBAGLBSA-N 389.809 2.693 0 50 GFAA COc1cc(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)ccn1 92020281 XMZPBBCFLYPGBW-UHFFFAOYSA-N 383.496 2.755 0 50 GFAA CCCCOCC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95361960 YVCDINQXSZOMQS-MTNREXPMSA-N 386.492 2.621 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3cnc(C)cn3)C2)c1 95496884 RCHJIYQEVGZNCT-KRWDZBQOSA-N 396.491 2.742 0 50 GFAA CNC(=O)CN1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95525852 PCOYNXCOZNIUOS-UHFFFAOYSA-N 393.915 2.602 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)N1c1ccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 239433482 XTMMVXNSTFFHAS-NNKBLXFJSA-N 392.455 2.902 0 50 GFAA O=S(=O)(NC[C@H]1CCCN(C2Cc3ccccc3C2)C1)c1cccs1 95500758 DHWARMUQMMIYMN-OAHLLOKOSA-N 376.547 2.906 0 50 GFAA Cc1ccc(-c2nnn(C)n2)cc1NC(=O)NC[C@@H]1OCCc2ccccc21 96138611 WRHPGJMJNMGWTM-SFHVURJKSA-N 378.436 2.621 0 50 GFAA CCn1nccc1C(=O)N1CCC(CNC(=O)Cn2ccc3ccccc32)CC1 823608986 YQHVYROFDLFXNQ-UHFFFAOYSA-N 393.491 2.526 0 50 GFAA CCCN(Cc1ccccc1OC)C(=O)NCC(C)(C)N1CCN(C)CC1 584892115 VCRFYYLHUVIQPH-UHFFFAOYSA-N 376.545 2.643 0 50 GFAA O=C(N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)N1CCC2(CCCO2)CC1 584891815 YVHJCWCTNNUTAX-HNNXBMFYSA-N 377.872 2.800 0 50 GFAA Cc1ccc(N(CC(=O)NCCn2c(C)cc3ccccc32)S(C)(=O)=O)cc1 670455450 MGTBTWTWFWVBPS-UHFFFAOYSA-N 399.516 2.841 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCN(c3ccc(F)cc3F)CC2)nc(O)n1 952981945 ZCIHOKLXKFYWDQ-UHFFFAOYSA-N 376.407 2.621 0 50 GFAA COC(=O)c1ccccc1NC(=O)Nc1ccccc1C(=O)N1CCOCC1 886025167 BHHWRKSZMMBWRK-UHFFFAOYSA-N 383.404 2.590 0 50 GFAA CCN1CCC[C@H](CN(C)S(=O)(=O)c2ccc3nc(O)cc(C)c3c2)C1 952975391 YYOPONXQPWOMLY-OAHLLOKOSA-N 377.510 2.601 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N[C@H]3CCCO[C@@H]3c3cnn(C)c3)c2)no1 275423194 DKRMKYAORTVZTH-DLBZAZTESA-N 382.424 2.820 0 50 GFAA C[C@H](NC(=O)Cc1cn2ccccc2n1)c1cc(F)ccc1N1CCC(O)CC1 755455709 UNGPHTIJYFILET-HNNXBMFYSA-N 396.466 2.854 0 50 GFAA O=C(c1cccc(-c2cccc(F)c2)c1)N1C[C@H](Cc2cnccn2)[C@@H](O)C1 1616084617 SZYXNAVMJUWUBJ-RXVVDRJESA-N 377.419 2.958 0 50 GFAA O=c1ccc(-c2ccccc2)nn1CCNC1CCN(Cc2ccco2)CC1 1506416431 GPCYLBWAKQRTJQ-UHFFFAOYSA-N 378.476 2.758 0 50 GFAA COc1ccc(-n2ccnc2CN2CCC[C@]3(CCc4cnc(N)nc43)C2)cc1 1704307221 WAFRJJYIBRVLRL-QFIPXVFZSA-N 390.491 2.733 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCc1cnn(C)c1 11933386 AXQXAHUQDXYTML-FQEVSTJZSA-N 386.515 2.905 0 50 GFAA O=C1CCC(CCC(=O)N2CCC[C@H](C(=O)c3ccc(Cl)cc3)C2)=NN1 12204056 IXRYOIUUTNEDEA-AWEZNQCLSA-N 375.856 2.808 0 50 GFAA COc1c(C)cc(C(=O)[C@@H]2CCCN(C(=O)CCCn3cncn3)C2)cc1C 13636679 NUUAFRXXQIZVMW-QGZVFWFLSA-N 384.480 2.805 0 50 GFAA COc1ccccc1CCNCc1c(C(=O)N2CCCC2)nc2ccccn12 19839640 YTYLXNQRUJUTAJ-UHFFFAOYSA-N 378.476 2.911 0 50 GFAA O=C(NCCNc1ccc(-n2cccn2)nn1)c1cccc(C(F)(F)F)c1 19924276 LLMVXNWHXCRPHH-UHFFFAOYSA-N 376.342 2.523 0 50 GFAA O=C1NCCC[C@]12CN(c1ccnc3c(C(F)(F)F)cccc13)CC[C@H]2O 1857690716 PWOUVZRLLKVRLV-CRAIPNDOSA-N 379.382 2.721 0 50 GFAA Cc1cnc(CN2C[C@@H]3[C@H](CNC(=O)C4(C)CCCCC4)[C@H]4CC[C@]3(C2)O4)cn1 1857729990 LTGBCGVOVPBFDB-DZCCDHAISA-N 398.551 2.851 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CCC3CCCC3)CC(=O)N2[C@H]1c1ccccc1 1857731506 SVODVSCWBMPPSG-IPJJNNNSSA-N 398.503 2.930 0 50 GFAA O=C(O)c1cc2c(nc1N1C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C1)CCC2 1857739441 JZMDOZCIRSQCAW-IIBYNOLFSA-N 389.455 2.857 0 50 GFAA Cc1ccc([C@@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCOCC2)cc1 252537326 KYLVLBVSTYGNNU-QGZVFWFLSA-N 396.413 2.557 0 50 GFAA Cc1nc2ccc(Br)cn2c1C(=O)N1CC[C@H](c2nccn2C)C1 373573237 FESXNCUBEMXZQJ-LBPRGKRZSA-N 388.269 2.768 0 50 GFAA CC(C)c1nn(C)cc1-c1noc([C@@H]2CCc3nnn(C4CCOCC4)c3C2)n1 952895956 YPVCXCANILCCEO-CYBMUJFWSA-N 397.483 2.809 0 50 GFAA Cc1ccccc1Nc1scnc1C(=O)N1C[C@H](CC(=O)O)O[C@H](C)C1 1875312513 NGBLJBKUCWDWTE-OLZOCXBDSA-N 375.450 2.899 0 50 GFAA CCc1ccnc(C(=O)NC[C@@H]2CCC[C@@H]2NC(=O)COc2ccc(F)cc2)c1 1875306824 CZFUAEQZUGHAOY-LPHOPBHVSA-N 399.466 2.877 0 50 GFAA Cn1cc([C@@H]2C[C@H]2CN(Cc2nc3cc(C(=O)O)ccc3n2C)C2CC2)cn1 1875396414 GPWOAQILQIMIQF-WMLDXEAASA-N 379.464 2.773 0 50 GFAA CN=[S@@]1(=O)CCC[C@]2(CCCN2C(=O)c2ccc(C(F)(F)F)nc2)C1 1875396182 YCKMASXQLVUKIT-SGANQWHYSA-N 375.416 2.967 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(CO)(Cc4ccccc4)CC3)nn(C)c21 1875403946 MIRKACHPKCMYKY-SJORKVTESA-N 397.519 2.900 0 50 GFAA Cc1cccnc1Oc1ccc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc1 2325785552 DLQJOOWSETXRRH-NSISKUIASA-N 392.459 2.948 0 50 GFAA CCc1ccccc1O[C@H](C(=O)N1Cc2[nH]c(=N)nc(O)c2C1)c1ccccc1 2325841372 RGDMXCDEJNNSQX-IBGZPJMESA-N 390.443 2.820 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CCN2CCC[C@H]2CO)c2ccccc2)cc1 245407234 AGZXDBVEMYBRGB-FPOVZHCZSA-N 388.533 2.861 0 50 GFAA COc1cccc(CCNC(=O)C[C@@H]2Sc3ccccc3NC2=O)c1OC 912760 TUCJPGOSIRSSLQ-KRWDZBQOSA-N 386.473 2.866 0 50 GFAA COc1ccc(NC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc1Cl 1109410 GDKSYUCOHLVEGJ-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA O=C(CCc1cnccn1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2356134193 CPEXCOFRRQUUOQ-HSZRJFAPSA-N 392.503 2.636 0 50 GFAA COc1cc(-c2onc(N3Cc4nc(C)nc(O)c4C3)c2C(=O)O)ccc1F 2356137925 AVFNZUPUBBKOPF-UHFFFAOYSA-N 386.339 2.512 0 50 GFAA CCN(CC)CCn1c(=N)n(C[C@H](O)COc2ccccc2)c2ccccc21 4859506 GYKBQIPGEJYPNV-SFHVURJKSA-N 382.508 2.704 0 50 GFAA Cc1cccc(CN2CCC(c3nn(C)c(=O)n3Cc3ccccc3)CC2)n1 67774278 WEFBWUYRYUJCTB-UHFFFAOYSA-N 377.492 2.713 0 50 GFAA Cc1ccc(CN2CCc3nnc([C@H](C)NC(=O)c4ccco4)n3CC2)cc1 23339725 GQJRYRAWIGDSFH-INIZCTEOSA-N 379.464 2.729 0 50 GFAA COc1cc([C@@H]2CC(=O)Nc3c2c(-c2ccccn2)nn3C)cc2c1OCO2 65534916 RDZWRPDCLZRNAH-LBPRGKRZSA-N 378.388 2.694 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c(C)c1 67603773 IWQJTYRZOKTUOW-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA Cc1ccc2[nH]c(=O)cc(C(=O)N3CCC[C@@H](Cn4cc(C5CC5)nn4)C3)c2c1 67868710 MNIONNIXNLBTKS-OAHLLOKOSA-N 391.475 2.858 0 50 GFAA COc1cc(CN2CCC[C@H](N(C)CCCN(C)C)C2)cc(OC)c1OC 23374956 DQMPLFFARQDGPG-SFHVURJKSA-N 379.545 2.560 0 50 GFAA CCN1CCN(c2ncc3c(n2)C[C@@H](c2ccc(OC)cc2OC)CC3=O)CC1 20101825 TVFKRYISKHEBPF-OAHLLOKOSA-N 396.491 2.548 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN(C)CC3(CO)CCC3)C2=O)cc1 67688806 ZFTXUZBUFZVHNG-QHCPKHFHSA-N 388.552 2.758 0 50 GFAA Cc1ccccc1-n1nc(-c2ccccc2)nc1[C@@H]1CCCN(CC(N)=O)C1 63882188 GVKMJNXCPJPHPD-GOSISDBHSA-N 375.476 2.907 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(c2cnccn2)CC1 67740194 LYKURNZILGZIGF-UHFFFAOYSA-N 378.436 2.776 0 50 GFAA COc1ccc([C@@H]2CC(c3cc(OC)ccc3OC)=NN2S(C)(=O)=O)cc1 252483666 FGTVXICJOKTSGZ-SFHVURJKSA-N 390.461 2.823 0 50 GFAA NC(=O)c1ccc(NC(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 171811669 JGXSXENPDFTTKS-OAHLLOKOSA-N 388.418 2.850 0 50 GFAA O=S(=O)(Nc1cccc2[nH]ncc12)c1ccc(I)cc1 3997390 LYUMCICBLJAVIP-UHFFFAOYSA-N 399.213 2.968 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](CC(=O)O)c2ccc(Cl)cc2)cc1 4689758 UVQIPZNXTNPIJW-INIZCTEOSA-N 396.852 2.793 0 50 GFAA CC(C)[C@@H](CO)Nc1ccc(C(=O)N2CCC(Oc3cccnc3)CC2)cn1 71745204 KIKOMIIGAOCEGF-LJQANCHMSA-N 384.480 2.589 0 50 GFAA CCOC(=O)c1ccc(-n2ccc3c(cnc4nc(SCC)nn43)c2=O)cc1 38783683 SZXHSRXXMFMRSF-UHFFFAOYSA-N 395.444 2.717 0 50 GFAA COc1ccc(C2(C(=O)N3CC[C@H](Cc4cccc(C(N)=O)c4)C3)CC2)cc1 72154719 IGFRZRSVIBNKAB-QGZVFWFLSA-N 378.472 2.917 0 50 GFAA CCn1ccnc(N2CCC(N[C@@H](C)c3ccc(OC)c(OC)c3)CC2)c1=O 365097429 YVXGQRIQDCOMND-HNNXBMFYSA-N 386.496 2.600 0 50 GFAA O=C(NCC1CCN(C(=O)c2ccccc2)CC1)[C@H]1COc2ccccc2C1 172552686 NXUPLYORSSPKDF-HXUWFJFHSA-N 378.472 2.906 0 50 GFAA O=C(c1coc(COc2cccc3cccnc23)n1)N1CCN2CCC[C@H]2C1 71315007 CBZYJDPBLGQCKP-INIZCTEOSA-N 378.432 2.722 0 50 GFAA C[C@@H]1CN(c2ccccc2F)CCN1C(=O)c1cccc(NS(C)(=O)=O)c1 241911249 UAXCLHWLGMEYKS-CQSZACIVSA-N 391.468 2.548 0 50 GFAA Cc1cc2nc(C(=O)N3CCC([C@H](O)Cc4ccccc4)CC3)cc(C)n2n1 77284792 MMVOFUOPAAOVLB-HXUWFJFHSA-N 378.476 2.802 0 50 GFAA CC1(S(=O)(=O)NCC2(c3cccc(Br)c3)CCOCC2)CC1 451090834 UVZQJZCMDYGIOQ-UHFFFAOYSA-N 388.327 2.969 0 50 GFAA COCc1nn2c(nnc3c(=O)n(Cc4cccnc4)ccc32)c1-c1ccccc1 40391322 QIRFMIPULXEARA-UHFFFAOYSA-N 398.426 2.696 0 50 GFAA C[C@](O)(CCc1ccccc1)C(=O)N1CCn2c(nnc2-c2ccccc2)C1 283193519 MBJSIYUKZGEKSU-QFIPXVFZSA-N 376.460 2.671 0 50 GFAA Cc1cccnc1CN1CCN(C(=O)c2ccc(CN3CCCC3)cc2)CC1 77471082 FNUHULRXYACWNT-UHFFFAOYSA-N 378.520 2.944 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3ccc(-n4ncc5ccccc54)cc3)C[C@H]21 284779365 LJSDEPXZPZUMTR-RTWAWAEBSA-N 391.475 2.962 0 50 GFAA CN(C[C@H]1CCCN(C(=O)CSc2ccc(Cl)cc2)C1)S(C)(=O)=O 289133013 VLGJKUNIKVLGPV-CYBMUJFWSA-N 390.958 2.562 0 50 GFAA COc1cc(NC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc(OC)c1OC 44903495 JHXWVRYAJOVYFF-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA C[C@@H](CNC(=O)Cn1nc(C(F)(F)F)c2c1CCC2)Cn1cc(Cl)cn1 20607543 JQALCEHIKYJSFL-JTQLQIEISA-N 389.809 2.693 0 50 GFAA CCc1cnc(C)nc1N1CCC2(CCC(=O)N(CCCn3ccnc3)C2)CC1 91326095 KHDHLVVJSBUTPU-UHFFFAOYSA-N 396.539 2.843 0 50 GFAA Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)C[C@@H]3NC(=O)NC3=O)s2)cc1 163061565 AVONBLAGMPSWOH-OCCSQVGLSA-N 386.477 2.544 0 50 GFAA CSC[C@@H]1CCCN(C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)C1 95498939 FBVFHRQKRGVMRZ-SNVBAGLBSA-N 377.919 2.594 0 50 GFAA CN1CCC(N2CCC(CN(Cc3ccncc3)Cc3cnn(C)c3)CC2)CC1 96879131 ZQPAZOCTYRZLQJ-UHFFFAOYSA-N 396.583 2.624 0 50 GFAA O=C(CSc1ccncc1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2=O 95387434 VSXFNXYNHZBCDZ-ZWKOTPCHSA-N 381.501 2.823 0 50 GFAA CSC[C@@H](CCO)NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 179682992 UAJLRMHKDWSKOF-BYCMXARLSA-N 376.881 2.722 0 50 GFAA O=C1CN(c2ccc(C(=O)N[C@H](c3ccccc3)C(F)(F)F)cc2)C(=O)N1 91997714 LZNIWJXUULHHPN-OAHLLOKOSA-N 377.322 2.776 0 50 GFAA COc1ccc(C(=O)N2CCCC2)c(OC2CCN(C(=O)c3cnco3)CC2)c1 95502755 IQIBLMWVCBQUEN-UHFFFAOYSA-N 399.447 2.603 0 50 GFAA C[C@@H]1CN(C(=O)C(C)(C)C)C[C@@H](C)N1C(=O)c1ccc(Br)cn1 293760848 UGRPHWWIZGHMHB-VXGBXAGGSA-N 382.302 2.952 0 50 GFAA COc1ccc2nc(CNC(=O)[C@@]3(C)CC[C@@H](C(=O)N(C)C)C3(C)C)[nH]c2c1 91574194 BGNWOHAPTZJSLN-LHSJRXKWSA-N 386.496 2.718 0 50 GFAA O=C(O)CCN(CC1CCN(C2Cc3ccccc3C2)CC1)C[C@@H]1CCCO1 95503930 PABKTUDBJJDULD-QFIPXVFZSA-N 386.536 2.822 0 50 GFAA Cc1cccc(N2C[C@@H](C(=O)Nc3cnn(Cc4ccncc4)c3)CC2=O)c1C 299724747 ZNRLFSFVZMWJHI-SFHVURJKSA-N 389.459 2.935 0 50 GFAA C[C@H]1Cc2cc(CNC(=O)N3CCC(N4CCSCC4)CC3)ccc2O1 534632591 HMXWEOKECHXEHX-HNNXBMFYSA-N 375.538 2.733 0 50 GFAA O=C(Cc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@H](C(=O)N2CCCC2)C[C@H]1O 1940198228 WNQRQNWWWHHRJZ-BHDDXSALSA-N 392.499 2.774 0 50 GFAA CC(C)C(=O)N1CCC[C@H](NS(=O)(=O)Cc2ccc(Cl)cc2F)C1 825524460 QRADEVYRXAYEIT-AWEZNQCLSA-N 376.881 2.546 0 50 GFAA Nc1nc2c(c(C(=O)N3CCC[C@H]3c3nc4ccc(F)cc4[nH]3)n1)CCCC2 952978944 MDZMICCNGYMGCL-INIZCTEOSA-N 380.427 2.930 0 50 GFAA CCO[C@H]1C[C@@](NC(=O)/C=C/c2ccc(NC(C)=O)cc2)(C(=O)OC)C1(C)C 170602673 KJXCXIJMWIZGQE-FDNMCCPZSA-N 388.464 2.521 0 50 GFAA CCCn1cc(S(=O)(=O)N2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)cn1 1529186348 XKYONBJOHVXFLT-RBUKOAKNSA-N 375.494 2.834 0 50 GFAA COc1c(Cl)cc(C(=O)N2C[C@H](C(=O)O)C3(CCOCC3)C2)cc1Cl 1800414157 LTILSNONCJWWHF-LLVKDONJSA-N 388.247 2.955 0 50 GFAA CCn1nc(C(C)C)cc1C(=O)N1CCCN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 1772705940 LCPYYJUNLCSNGD-FGTMMUONSA-N 384.524 2.913 0 50 GFAA Cc1cnc(C(=O)NC[C@@H]2Cc3cccc(-c4nc(C)cc(C)n4)c3O2)cn1 12126961 LEDUBZLEWQJZJS-INIZCTEOSA-N 375.432 2.592 0 50 GFAA CCS(=O)(=O)c1ncc(CN(Cc2ccccc2)CC2CC2)n1CCOC 12316600 YKKWUNBDRCFVPI-UHFFFAOYSA-N 391.537 2.735 0 50 GFAA Cc1[nH]c2ccc(Cl)cc2c1CCNC(=O)c1cn(C[C@H]2CCCO2)nn1 12701974 DLTWRJKNDVIIHL-CQSZACIVSA-N 387.871 2.873 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1ccc(Cl)cc1 12718900 BICFRFGJITZGNJ-GOSISDBHSA-N 382.855 2.919 0 50 GFAA Cc1c(CC(=O)N2CCC[C@H]2C(N)=O)c2c(n1CC(C)C)CC(C)(C)CC2=O 19953074 NFEMNEQGXHBKQW-INIZCTEOSA-N 387.524 2.626 0 50 GFAA COC(=O)CN(C)C(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857730208 LZGFZGOJBWDXIK-LBPRGKRZSA-N 379.844 2.719 0 50 GFAA O=C(CN1CCc2ccc(Cl)cc2C1)N1CCC(C(=O)N2CCCC2)CC1 153191870 OVHQYYPWWRECLN-UHFFFAOYSA-N 389.927 2.559 0 50 GFAA O=C1COc2c(cc(Cl)cc2NC(=O)[C@@H]2CCCN2c2nccs2)N1 367974146 RGJNMKHTLZMBOE-LBPRGKRZSA-N 378.841 2.735 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)[C@@H]1Cc3ccccc31)CC2 262867493 WBRMXNVMUZLFMT-QZTJIDSGSA-N 381.428 2.944 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)[C@@H](C)c3ccccc3C(F)(F)F)CC2)[nH]1 1875297834 FJTKTQGAGGYBSY-NSHDSACASA-N 382.386 2.866 0 50 GFAA CSC[C@H](Cc1ccc(F)cc1F)NC(=O)[C@H](N)CCc1ccccn1 1875326997 VKUXBXNIHFWPAR-FUHWJXTLSA-N 379.476 2.710 0 50 GFAA CCN1CCC(NC(=O)c2ccc(C(=O)NC(C)C)cc2)(C(F)(F)F)CC1 891209623 OUFXFUSUKUPLAG-UHFFFAOYSA-N 385.430 2.971 0 50 GFAA CC(C)(C)NS(=O)(=O)c1cccc(-c2nc(Cc3ccsn3)no2)c1 2325807098 ZSCGNLCXDKBCSZ-UHFFFAOYSA-N 378.479 2.861 0 50 GFAA COc1ccc(C2=NN(C(=O)COc3ccccc3)[C@](O)(C(F)(F)F)C2)cc1 1151758 IMWZJCWKGQCPMW-GOSISDBHSA-N 394.349 2.962 0 50 GFAA COCCCN1C(=O)c2ccc(C(=O)O[C@@H](C)C(=O)c3ccccc3)cc2C1=O 1941482 RJAKKNKTCOGUSO-AWEZNQCLSA-N 395.411 2.747 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(Cc2ccc(N3CCCC3=O)cc2)CC[C@H]1O 2356141779 PFTQAUUMYMPQPH-DENIHFKCSA-N 388.508 2.887 0 50 GFAA CS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(OCc3ccccc3)cc2)C1 4866328 YIHFHNGTUCXLEG-QGZVFWFLSA-N 388.489 2.876 0 50 GFAA O=C(O)CCNC(=O)N1CCN(C2=Nc3ccccc3Oc3ccccc32)CC1 6662327 LLSBRGCUVHBJQW-UHFFFAOYSA-N 394.431 2.673 0 50 GFAA CC(C)CN(C)C(=O)C[C@@H]1C(=O)NCCN1Cc1ccccc1C(F)(F)F 55244672 CAVAPJATFYABDW-MRXNPFEDSA-N 385.430 2.510 0 50 GFAA Cc1ccc(-c2nnc(CNC34C[C@@H]5C[C@H](C3)CC(n3cncn3)(C5)C4)o2)n1C 65428499 CHHWYJUUCDKZSJ-XBLGPDGASA-N 393.495 2.813 0 50 GFAA COc1cccc(CC2(CO)CCN(c3ccc(-c4nccn4C)nn3)CC2)c1 67724227 YVJPYTRFWOSWFB-UHFFFAOYSA-N 393.491 2.707 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(-c3ccc(O)cc3)nc2)CC1 67742282 TTWRAFYMQDKMLH-UHFFFAOYSA-N 379.460 2.929 0 50 GFAA O=C(COc1ccc(CN2CCC[C@@H](c3ccncn3)C2)cc1)N1CCCC1 215010615 XYVRRHRKBJBYOH-LJQANCHMSA-N 380.492 2.857 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cn1cncn1 173060688 ITKOQCTYONLFNY-HXUWFJFHSA-N 389.503 2.621 0 50 GFAA CC1(C)CN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)[C@@H]1c1ccncc1 367929232 IBXVLZSMHNTWSU-GOSISDBHSA-N 393.447 2.748 0 50 GFAA O=C(c1ocnc1C1CC1)N1CCCN(c2nnc(C(F)(F)F)s2)CC1 377526426 VNAQKMDWPIIEKA-UHFFFAOYSA-N 387.387 2.775 0 50 GFAA CCN1C(=O)[C@@H]2CN(c3ccnc4cc(C(F)(F)F)ccc34)CCN2C1=O 372731497 WHVNMNMEEZYTGW-HNNXBMFYSA-N 378.354 2.726 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)[C@@H](Oc2ccc(F)c(F)c2)c2ccccc2)CCO1 262465272 XIHGBRYFZUBVNF-KXBFYZLASA-N 391.370 2.787 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c1C 242324405 ZBBFEEGWMPCPSF-LALPHHSUSA-N 378.469 2.906 0 50 GFAA COc1ccc2c(c1)C1(CC1)CN([C@H](C)C(=O)Nc1ccc3[nH]c(=O)[nH]c3c1)C2 289629537 RVUGASOJGXZLNR-CYBMUJFWSA-N 392.459 2.739 0 50 GFAA Cc1n[nH]c(C)c1CCNC(=O)N1CCC(C(=O)N(C)Cc2ccccc2)CC1 426550358 DYNHNPWGTUYBGT-UHFFFAOYSA-N 397.523 2.649 0 50 GFAA C[C@H]1CN(Cc2nc(-c3c(F)cccc3F)cs2)CCN1S(C)(=O)=O 161680536 SJYZGDGYSIMJRX-NSHDSACASA-N 387.477 2.554 0 50 GFAA CN(Cc1cnn(-c2ccc(F)cc2)c1)C(=O)c1ccccc1-n1cnnc1 426358873 DABWPECQFKFNFJ-UHFFFAOYSA-N 376.395 2.864 0 50 GFAA CCN1CC2(CCN(C(=O)Cn3ccnc3)CC2)C[C@H](c2ccccc2)C1=O 91848880 NTTNWWMIPQUWCO-LJQANCHMSA-N 380.492 2.528 0 50 GFAA CN1C(=O)C2(CCN(C(=O)[C@@H]3COc4ccccc4C3)CC2)c2ccccc21 426574858 HZLMFYZCPKHEPP-KRWDZBQOSA-N 376.456 2.775 0 50 GFAA Cc1cc(CN2CCC3(CC2)CCN(Cc2cscn2)C[C@@H]3CO)on1 97288825 MOHVSMMLDXYSEY-MRXNPFEDSA-N 376.526 2.536 0 50 GFAA Cc1cc(NC(=O)NC[C@H]2CCCN(C(=O)OCc3ccccc3)C2)n(C)n1 96162891 OUJSXQCPOZQLHD-QGZVFWFLSA-N 385.468 2.899 0 50 GFAA Cc1ccnn1CC(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95369648 KIKMBKWDEPBJPR-ZLGUVYLKSA-N 386.446 2.559 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@@H]1CCS(=O)(=O)C1)c1ccccc1F 334157970 CUIJDNCLSWQMOE-OAHLLOKOSA-N 399.447 2.723 0 50 GFAA CN(CC1CCN(CCc2cccc(F)c2)CC1)C(=O)c1cn2cccnc2n1 95525612 DQXZHUOSYIOZDS-UHFFFAOYSA-N 395.482 2.895 0 50 GFAA CN(Cc1n[nH]c2c1CCCCC2)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 96132263 LXVIGAHBRNMMEM-UHFFFAOYSA-N 382.468 2.533 0 50 GFAA COCCN1CCC[C@@]2(CCN(Cc3noc(-c4ccc(C)cc4)n3)C2)C1=O 95356755 AENBWKPXSATSAJ-NRFANRHFSA-N 384.480 2.506 0 50 GFAA O=C(N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1)c1cccc(Cn2cccn2)c1 91444814 POVSCVYTDLYNSX-GOSISDBHSA-N 378.407 2.606 0 50 GFAA Cn1c(Cn2ccnc2)nnc1[C@H]1CCCN(Cc2ccc3[nH]ccc3c2)C1 95385426 DCJDZCFIFWNSED-SFHVURJKSA-N 375.480 2.921 0 50 GFAA Cc1cc(N2CCC(NCCCn3cncn3)CC2)nc(-c2ccccc2)n1 96139335 POOMYOAMVSSIEE-UHFFFAOYSA-N 377.496 2.692 0 50 GFAA O=S(=O)(C1CC1)N1CCC(N[C@@H]2CCCOc3cc4c(cc32)CCC4)CC1 181275074 IMMGCOALZSQLRA-HXUWFJFHSA-N 390.549 2.935 0 50 GFAA COc1cccc(OC)c1C(=O)N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 244619997 FJYVCKUASVYJLU-MRUHUIDDSA-N 383.444 2.881 0 50 GFAA CCOc1ccc(C[C@H](CNC(=O)c2ncoc2[C@H]2CCCO2)C(=O)O)cc1 299753726 ZDQFHPQUBRKIPF-GDBMZVCRSA-N 388.420 2.598 0 50 GFAA O=S(=O)(CC1CCOCC1)N1CCN(c2c(Cl)cccc2Cl)CC1 184313863 DWSLZKZVTPAKIV-UHFFFAOYSA-N 393.336 2.872 0 50 GFAA Cn1nc(C(F)(F)F)c2c(NC(=O)CCc3nc(-c4ccco4)no3)[nH]nc21 1940198379 LLUSXSGPMHCNLN-UHFFFAOYSA-N 395.301 2.530 0 50 GFAA COc1ccc(C(=O)NCCCn2ccnc2C(C)C)cc1N1CCOCC1 824730178 YVPYPAXXYNFAOE-UHFFFAOYSA-N 386.496 2.672 0 50 GFAA CN(C(=O)c1cccc2ccn(Cc3ccccc3)c12)[C@@H]1CCS(=O)(=O)C1 1875271910 LWBMAFRVZIRERB-GOSISDBHSA-N 382.485 2.949 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)[C@H]2C[C@@]23CCOc2ccccc23)c(F)c1 1875371245 UWCYLLUSZOBBNN-WZONZLPQSA-N 394.446 2.985 0 50 GFAA Cn1c(CN2CC(N3C[C@@H](c4nc(C5CC5)no4)CC3=O)C2)cc2ccccc21 877780429 QCUSAABQPDFSMR-INIZCTEOSA-N 391.475 2.639 0 50 GFAA O=C(c1ccccc1OC1CC1)N1CCN(C(=O)C2CC2)C2(CCOCC2)CC1 1775962865 PQPLQOJUSLSLMW-UHFFFAOYSA-N 398.503 2.862 0 50 GFAA C[C@H](CS(=O)(=O)NC(=O)c1csc([C@@H]2CCCO2)n1)c1ccccc1 167003885 GVDJSUAJJODQQL-DOMZBBRYSA-N 380.491 2.858 0 50 GFAA C[C@H]1CN(C(=O)NCc2ccccc2N2CCCCC2)CCN1CC(C)(C)O 186602489 FWCOZIWCJCFWAW-SFHVURJKSA-N 388.556 2.664 0 50 GFAA Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)COCCNC(=O)c1ccccc1 752332249 NOXHGOJCFPYSMX-QGZVFWFLSA-N 398.459 2.620 0 50 GFAA CCc1ccc(-n2nc(C(=O)N3CCCN(CC)C(=O)C3)c3c2CCC3)cc1 190431121 IYDNYSPTKQCETK-UHFFFAOYSA-N 380.492 2.618 0 50 GFAA CN(C)C[C@@]12CNC[C@H]1CN(C(=O)c1cccc(NCc3cccs3)c1)C2 1772707105 POFFVAMRLIHYQV-LAUBAEHRSA-N 384.549 2.583 0 50 GFAA O=C(O)CC[C@]12CN(CCOc3ccccc3)C[C@@H]1CN(Cc1ccccn1)C2 1772819197 QGQQDHPCYXJGSP-AUSIDOKSSA-N 395.503 2.759 0 50 GFAA O=C1CCCCN1c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1 11906604 HBDQGVDLHXPAIE-UHFFFAOYSA-N 388.445 2.776 0 50 GFAA CCc1ccc(CN(C)C(=O)c2cn(C[C@@H]3COc4ccccc4O3)nn2)cc1 12704132 PUAMUYZLMXPVNK-GOSISDBHSA-N 392.459 2.953 0 50 GFAA CCOc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)cc1 19787125 MCFOOHKBCRHZNV-QFIPXVFZSA-N 389.584 2.827 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N1CCOc2ccc(Cl)cc2C1 1857668161 CFTHKHNTRQBWSV-UHFFFAOYSA-N 393.896 2.976 0 50 GFAA C[C@@H](NC(=O)CN1CCN([C@H]2CCCN(C)C2)CC1)c1cccc2ccccc12 112638179 KXQZFKUNNGCZMB-CTNGQTDRSA-N 394.563 2.729 0 50 GFAA O=C(O)C1CCN(C(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)CC1 238030444 VXJDWBISRMAGPY-GFCCVEGCSA-N 385.247 2.670 0 50 GFAA CC1(C)CCCc2c(N3CCC[C@@H](n4cc(CO)nn4)C3)nc(Cl)nc21 848712412 JGRVZRREZDWSKE-CYBMUJFWSA-N 376.892 2.669 0 50 GFAA CCCCCC(=O)N1CCS(=O)(=NS(=O)(=O)c2ccc(C)cc2)CC1 808269845 LAFNALXBVPLBNJ-UHFFFAOYSA-N 386.539 2.574 0 50 GFAA Cn1c(CN2CCN(Cc3ccccc3F)[C@@H](CCO)C2)nc2ccccc21 20534172 RTAWVEYFFIMBCS-SFHVURJKSA-N 382.483 2.781 0 50 GFAA Cn1cc(N(C(=O)c2ccccc2)[C@@H](C(=O)NCC(F)F)c2ccccn2)cn1 2325826665 JCBXDKKTVKXOQW-GOSISDBHSA-N 399.401 2.585 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)NCc2cccnc2)c2ccccc2)cc1 880127 XLWLTEGSJWQUQJ-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA CCOC(=O)C(=Cc1cc(OC)c(OC)cc1Br)C(=O)OCC 2933076 GBZGYRHNRBVHFM-UHFFFAOYSA-N 387.226 2.976 0 50 GFAA O=C(CCCn1cncn1)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2)C1 12055212 RLNOJQGGQHWGEF-OAQYLSRUSA-N 385.487 2.712 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)[C@@H]1CCOC(C)(C)C1 12076712 SQSALKFAGIHLDT-QGZVFWFLSA-N 382.508 2.977 0 50 GFAA COCCSc1nnc(CCNC(=O)c2ccccc2C(F)(F)F)n1C 12202573 SCZVXLCMGYEHMV-UHFFFAOYSA-N 388.415 2.545 0 50 GFAA CN(C(=O)CCC1=NNC(=O)CC1)[C@@H]1CCCN(CCCc2ccccc2)C1 12576046 KZWWPZLLPZJZED-HXUWFJFHSA-N 384.524 2.588 0 50 GFAA O=C(CCN1CCN(c2ccc(F)cc2)CC1)Nc1nnc(C2CC2)s1 13323208 YOYJMMWQPQBNBK-UHFFFAOYSA-N 375.473 2.705 0 50 GFAA Cc1cccc(CN[C@H]2CCc3c(c(C(=O)N4CCSCC4)nn3C)C2)c1 14754413 NUTJZNBHBUGYQV-KRWDZBQOSA-N 384.549 2.565 0 50 GFAA COc1ccc(-c2ncc(CN[C@@H]3CCCN(c4ncccn4)C3)cn2)cc1 15080227 XPAUEWGNKIOFHW-GOSISDBHSA-N 376.464 2.701 0 50 GFAA O=C(c1ccccc1F)N1CC[C@H]2[C@H](CCC(=O)N2CCCn2ccnc2)C1 19112159 WVPCYLGOJQZNQM-APWZRJJASA-N 384.455 2.566 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(-c3ccccc3F)nc21 20605704 RYYSAJHYUSEQKP-UHFFFAOYSA-N 389.408 2.693 0 50 GFAA CC(C)CCn1c(CN2CCN(C(C)C)CC2)cnc1S(=O)(=O)C(C)C 22851537 IPBZPKAWMBVEFO-UHFFFAOYSA-N 384.590 2.637 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccccc3OC(F)F)C[C@@H]2N1Cc1ccccn1 55089431 FQMCBTJWBAIFCR-DOTOQJQBSA-N 375.375 2.888 0 50 GFAA Cc1nc2cc(C(=O)N3CCc4c(c(C(=O)O)nn4CC(C)C)C3)ccc2[nH]1 67642696 YILGALCRPGZKOA-UHFFFAOYSA-N 381.436 2.621 0 50 GFAA Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(C(=O)[C@@]2(C)CCCO2)CCO3)n1 67675765 ZJCPKHTVCDUFBA-OAQYLSRUSA-N 383.448 2.756 0 50 GFAA CCc1nc(C)c(C(=O)NCc2cccnc2N(C)CCc2ccccn2)o1 67975177 SMCQUEKKBWNLSQ-UHFFFAOYSA-N 379.464 2.944 0 50 GFAA COc1ccccc1C(=O)N1CCC[C@@H](Cn2cc(-c3cccnc3)nn2)C1 71763381 AITLRNQWAFZECH-MRXNPFEDSA-N 377.448 2.901 0 50 GFAA COc1ccc(-c2cn3cc(C(=O)N(C)C)nc3c(=O)n2CC=C(C)C)c(F)c1 72412292 ZNMANIPVQHSCKI-UHFFFAOYSA-N 398.438 2.979 0 50 GFAA O=C1CC[C@@]2(CCCN(S(=O)(=O)c3ccccc3Cl)C2)CN1C1CC1 91626092 ZJSBFMSQNGRTQF-GOSISDBHSA-N 382.913 2.896 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N[C@@H](C)c3nc(CC(C)C)no3)c(=O)[nH]2)cc1 92004262 CYMFNBSZNSRSDX-ZDUSSCGKSA-N 381.436 2.818 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)c1c(F)cccc1F)CC2 92062074 CGZQZRSHUUZTAT-UHFFFAOYSA-N 380.435 2.846 0 50 GFAA Cc1cccc(N2CCN([C@@H](C(=O)O)c3ccc(-n4cccn4)cc3)CC2)n1 95390639 MKGPZRIJPGQWIT-HXUWFJFHSA-N 377.448 2.524 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 95502066 QPQIPLJSKRULNW-AWEZNQCLSA-N 380.539 2.793 0 50 GFAA Nc1ccnc(C(=O)N2CCC3(CC2)CC(=O)N(Cc2ccc(Cl)cc2)C3)c1 95523034 NYJQVRNHOWWKJL-UHFFFAOYSA-N 398.894 2.972 0 50 GFAA CN(C[C@@H]1CCCN(CCc2cccc(C(F)(F)F)c2)C1)C(=O)c1nc[nH]n1 95524020 CZMDFEWSGJNQDL-HNNXBMFYSA-N 395.429 2.850 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)N2CCC(N3CCSCC3)CC2)c1 96130361 GBPLSYZXJYMDHG-UHFFFAOYSA-N 380.489 2.829 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2F)CC1)C(=O)c1ccno1 96151344 VSBGEZXKBWKDPF-UHFFFAOYSA-N 375.444 2.815 0 50 GFAA Cc1cc2oc(=O)cc(C)c2cc1NC(=O)N1CCC[C@]2(CN(C)C(=O)O2)C1 97717198 HFWHBPDHCPPCDM-FQEVSTJZSA-N 385.420 2.858 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 156410535 FFVBXCDQDGMHFB-LRDDRELGSA-N 379.482 2.510 0 50 GFAA Brc1cnc2c(NC[C@@H]3COC4(CCOCC4)O3)ccnc2c1 158384233 LTFATKNSXZVAKM-GFCCVEGCSA-N 380.242 2.726 0 50 GFAA CC(C)Oc1cccc([C@@H](O)CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)c1 172083927 WBGKYIJJBXDWMQ-SFTDATJTSA-N 396.487 2.928 0 50 GFAA Cc1nnc(-c2cccc(C(=O)NC3CCC(Oc4cnccn4)CC3)c2)o1 188639496 JNZIVXXBUAWVDT-UHFFFAOYSA-N 379.420 2.955 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(CNC(=O)CC[C@H]2CCCCN2C)cc1 225470362 GOGJZLZZQPYDAS-GOSISDBHSA-N 395.569 2.598 0 50 GFAA C[C@@H]1CN(C(=O)c2ccc(CNCc3cnc4ccccn34)cc2)C[C@@H](C)O1 237558990 ZUASCHWZXLNWRL-IAGOWNOFSA-N 378.476 2.874 0 50 GFAA Cc1cc(=O)oc2cc(O[C@H](C)C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)ccc12 238899387 GCWSGQPKIODBTC-RBSFLKMASA-N 387.432 2.876 0 50 GFAA biogenic COc1ccc([C@H](NC(=O)c2c(OC)ccc(F)c2F)[C@H]2C[C@H](O)C2)cn1 244716014 LGVUEMRPVLNUPT-PZROIBLQSA-N 378.375 2.619 0 50 GFAA COc1ccc(-n2c(C)nnc2SCC(=O)NC2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)cc1 247416603 MWOAIKFSWAPEHF-LUVWLHFXSA-N 384.505 2.837 0 50 GFAA Cc1ccccc1OC1CN(C(=O)C2CCN(C(=O)c3ccccn3)CC2)C1 252485511 GXFIUQBGBIUXKD-UHFFFAOYSA-N 379.460 2.532 0 50 GFAA Cc1c(C(=O)Nc2cncnc2N2CCCC2)nnn1Cc1ccc(F)cc1F 252490584 KXGWUCKBFITDFU-UHFFFAOYSA-N 399.405 2.556 0 50 GFAA Cc1noc(C)c1CCNC(=O)c1cc2n(n1)C[C@H](c1ccc(F)cc1)OC2 263616070 GVHXCJPRXLHSRG-LJQANCHMSA-N 384.411 2.871 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@@H](c2ccc(OC)cc2)C3)cc1 263616792 KOCLKZBFDRCZHA-GOSISDBHSA-N 380.404 2.819 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@H](c3nncn3C)C2)ncn1 275653646 KTCAQAKIXNWXDM-BXWFABGCSA-N 385.516 2.605 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 299754498 YPVITGAHYZKTAX-HBMCJLEFSA-N 383.536 2.758 0 50 GFAA biogenic O=C(c1cccc2cc[nH]c12)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328617614 CXIWPZOJYAIZCX-SFHVURJKSA-N 377.448 2.772 0 50 GFAA CCC(O)(CC)CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 363557705 KVPONURUCZYXNL-CQSZACIVSA-N 398.450 2.808 0 50 GFAA CC(=O)N1CC[C@H](NC(=O)c2ccnc(NC(=O)C3CC3)c2)c2ccccc21 367700613 WLZPEYHIYZZFOU-KRWDZBQOSA-N 378.432 2.658 0 50 GFAA C[C@H](C[S@@](C)=O)NC(=O)NCC1(c2ccc(Br)s2)CCC1 376442456 QAZRMVXSAWLPCG-LADRHHBVSA-N 393.372 2.999 0 50 GFAA CCCc1cc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)n2ncnc2n1 377161559 LOAUNGVEYKQUEK-QGZVFWFLSA-N 393.495 2.730 0 50 GFAA Cc1cnc([C@H](NC(=O)N2C[C@@H](C(=O)O)[C@H](C(F)(F)F)C2)C2CC2)s1 414625678 JQFCQWGFQVAIHM-GMTAPVOTSA-N 377.388 2.807 0 50 GFAA CN(Cc1ccccc1)C(=O)C1CCN(C(=O)NCCC[C@@H]2CCOC2)CC1 426538075 JKNSJPYIQCIQJZ-LJQANCHMSA-N 387.524 2.883 0 50 GFAA CN1Cc2ccc(CN(C)C(=O)c3cccc(-c4ccc(=O)n(C)n4)c3)cc2C1 534641459 FGERLWZMXDJQJM-UHFFFAOYSA-N 388.471 2.665 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1-c1cccc(C(=O)N[C@@H](C)Cn2cncn2)c1 584899946 XWDSSHPAMOODTI-JTQLQIEISA-N 378.358 2.814 0 50 GFAA Cc1cccc(-c2ncc(CN3CCC[C@H](C(=O)N4CCOCC4)C3)cn2)c1 670441983 AOCUKKVVCOMZJF-FQEVSTJZSA-N 380.492 2.523 0 50 GFAA CN1CCCN(CC(=O)Nc2ccc(NC(=O)CCc3ccccc3)cc2)CC1 823778405 WWIDGNOUTKLLPK-UHFFFAOYSA-N 394.519 2.834 0 50 GFAA O=C(COc1ccc(F)cc1F)NCC1CCN(C[C@@H]2CCCOC2)CC1 827841819 UATFLBLHOWXVEW-INIZCTEOSA-N 382.451 2.598 0 50 GFAA O=C(Nc1cnc2ccnn2c1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 888916885 OIJZJSWUXYVSSO-LBPRGKRZSA-N 388.378 2.731 0 50 GFAA COC[C@@H](C)N(Cc1cccc(OC)c1)C(=O)c1cccc(S(C)(=O)=O)c1 952964393 CUPXFFMRSJFPCW-OAHLLOKOSA-N 391.489 2.776 0 50 GFAA CN(C[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1cnc(N)nc1-c1ccccc1 1506405497 FCAWCECRWFLYGM-OAHLLOKOSA-N 393.491 2.589 0 50 GFAA CN(Cc1cc(=O)n2cc(Cl)ccc2n1)C[C@@H]1Cc2ccccc2CN1C 1529103930 IJERCIAPWTYKKD-IBGZPJMESA-N 382.895 2.836 0 50 GFAA COCc1cc(CN2C[C@H]3c4ccccc4OC[C@@]3(C(=O)O)C2)ccc1OC 1565508930 UHZRKPMOWWQUFN-AVRDEDQJSA-N 383.444 2.904 0 50 GFAA O=C(C1CCNCC1)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704307702 DHMPYKZNPSEILJ-QHCPKHFHSA-N 376.504 2.950 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@@H](C)Cn2cccn2)ccc1F 1704315431 DGSFVJNGWWFUGM-LBPRGKRZSA-N 387.415 2.570 0 50 GFAA CO[C@@H]1CCC[C@]12CCCN(C(=O)C1CCN(C(=O)c3ccccn3)CC1)C2 1704358338 IMUPIYNZXGJTHS-DENIHFKCSA-N 385.508 2.742 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@]1(CCCN(c3ncc(Cl)cc3F)C1)CC2 1857667785 ZJYVISNVMXJNLA-GOSISDBHSA-N 377.851 2.920 0 50 GFAA O=C(N[C@@H]1C[C@@H](C(=O)N2CCCCC2)CC[C@H]1O)c1ccc2cccc(F)c2n1 1857694527 QUSHSKJAMQIYHF-KFKAGJAMSA-N 399.466 2.646 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(Cc3cnc[nH]3)CC1)OCC2)N1CCCC1 1857695178 YDHIINUYIOKQJU-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA CC[C@@]1(C(=O)N2CCC(OC)CC2)C[C@@H]2CC[C@H]1N2C(=O)c1cccc(C)n1 1857708482 WMNJSFWRTTWPRS-DKZVUGQWSA-N 385.508 2.801 0 50 GFAA O=C1CCOC2(CCN(c3ncccn3)CC2)CN1C/C=C/c1ccccc1 1857714564 FDWSZNMCRNPEED-XBXARRHUSA-N 378.476 2.778 0 50 GFAA Cc1ccc(CN2CC3(CCN(C(=O)c4ccon4)CC3)OCCC2=O)c(C)c1 1857719789 VKSWCMULOZLCJU-UHFFFAOYSA-N 397.475 2.715 0 50 GFAA CN1C[C@@H]2CN(c3cc(-c4cccnc4)nc4ncnn34)C[C@H]2[C@@H]1c1ccccc1 1875260718 WUEJVJZOQLWMIV-KNKQGSTJSA-N 397.486 2.925 0 50 GFAA COc1cc(OC)cc([C@]2(F)CCN(C(=O)[C@H]3CCc4n[nH]c(C)c4C3)C2)c1 1875293716 AFGPFZNMLIXDII-QKKBWIMNSA-N 387.455 2.938 0 50 GFAA c1ccc(-c2nc(NCc3nc([C@@H]4CCOC4)n[nH]3)c3ccsc3n2)nc1 1875339218 FCCNFGXBWLNGRT-LLVKDONJSA-N 379.449 2.987 0 50 GFAA COC(=O)[C@H](CSCc1cccc(OC)c1)NC(=O)CCc1cscn1 1875383398 SBTRJOHYOUQNRW-INIZCTEOSA-N 394.518 2.676 0 50 GFAA Cc1ccc(CN2CCCN(S(=O)(=O)c3cnc4ccccn34)CC2)cc1 2325820636 UGGVDLWVZNEKHK-UHFFFAOYSA-N 384.505 2.539 0 50 GFAA CN(C(=O)[C@@H]1CC2(CC2)CO1)[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)cn2)C1 2325827738 OUTGAHMVVKNZOA-WMZOPIPTSA-N 385.508 2.621 0 50 GFAA O=C(NC[C@@H]1NCCc2ccccc21)c1cnc2cc(Br)ccn12 2325855925 VEQVPXPTOYUATC-HNNXBMFYSA-N 385.265 2.714 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(C(=O)CSc2nccn2C)CC1 2356144361 UAWCWONQYLFTHP-UHFFFAOYSA-N 387.505 2.611 0 50 GFAA c1ccc(CCc2nc3n(n2)CCN(Cc2ccc4c(c2)OCCO4)CC3)cc1 2356150157 OPCCIHXDPQSIMO-UHFFFAOYSA-N 390.487 2.893 0 50 GFAA O=C(O)c1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 823264 XZKWRAWHRSVFOK-UHFFFAOYSA-N 388.445 2.812 0 50 GFAA O=C(CCc1ccc(O)cc1)N1CCc2nc(CCc3ccccc3)nn2CC1 2356136031 DKELSYMTOSAAGW-UHFFFAOYSA-N 390.487 2.786 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(OCC(=O)N2CCCCCC2)c(Cl)c1 2871968 OJKRPEOYNAFLFB-UHFFFAOYSA-N 388.917 2.808 0 50 GFAA COc1ccc(-c2onc(N3CCCN(c4ncccn4)CC3)c2C(=O)O)cc1 2356157310 FHOUQZASFXXWST-UHFFFAOYSA-N 395.419 2.555 0 50 GFAA COc1ccc(CCNC(=O)[C@]2(C)CCC(=O)N2CCC(C)C)cc1OC 4893107 NUBKPVPLXLIUHW-NRFANRHFSA-N 376.497 2.790 0 50 GFAA aggregator O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21 4899721 YINDOSYVRZADBY-IBGZPJMESA-N 394.427 2.601 0 50 GFAA CCOc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCN(C)CC2)cc1 6700812 ZRGIOAIGPSSCOW-UHFFFAOYSA-N 397.475 2.876 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCC(N[C@@H](C)Cn4cncn4)CC3)cc2)n1 23153586 NTCTVPGBPYZAII-KRWDZBQOSA-N 379.512 2.728 0 50 GFAA CN1CCN(CC2(C)CCN(C(=O)c3ncc(Cc4ccccc4)o3)CC2)CC1 1329260719 JDBBWDPLWFIVKR-UHFFFAOYSA-N 396.535 2.755 0 50 GFAA Cc1cccc2[nH]c(CNC[C@]3(O)CCCN(Cc4ccc(F)cc4)C3=O)nc12 67678728 BXFIZVGWVQOVRG-JOCHJYFZSA-N 396.466 2.654 0 50 GFAA CCOc1ccc(C(=O)N2CCN(c3cc(N4CCCC4)nc(C)n3)CC2)cc1 67602191 UZLDYHHDSBAXEE-UHFFFAOYSA-N 395.507 2.746 0 50 GFAA Cc1ccc([C@H](CNC(=O)c2cc(=O)c3ccccc3o2)N2CCOCC2)cc1 28289572 ZXNOQAANHQJWAW-IBGZPJMESA-N 392.455 2.905 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3ccc(Cl)s3)CC2)C1 67740608 ZWXNLLXSRQFKFP-OAHLLOKOSA-N 399.988 2.841 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2CC[C@H](O)[C@H]2C1 329765453 XAFAXMGTGXKZKV-RCBQFDQVSA-N 398.463 2.978 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3ccc(CN(C)C)o3)CC2)OC1=O 77421927 GQWMRAATUPLLFT-HNNXBMFYSA-N 377.485 2.957 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)C1 12711999 AJPLRPQOXRCQBJ-HXUWFJFHSA-N 390.434 2.713 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCCN2C[C@@H](C)C[C@H](C)C2)cc1C(=O)O 237553447 HLVRRMDXYUQHCH-GJZGRUSLSA-N 382.526 2.730 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCCS(=O)(=O)C2)ccc1NC(=O)CC(C)C 286605343 BKJYEXSZPZNUMG-OAHLLOKOSA-N 380.510 2.534 0 50 GFAA COc1cc2c(cc1OC)CN(CCNC(=O)N1CCCc3occc3C1)CC2 460339338 CDQVTFDUFXSJMF-UHFFFAOYSA-N 399.491 2.813 0 50 GFAA O=C(CCc1ccccc1)N1CCCN(C(=O)[C@H]2COc3ccccc32)CC1 176265653 NTFPMYZCRLAQNU-FQEVSTJZSA-N 378.472 2.856 0 50 GFAA Cc1cc2nc(CCC(=O)N3CCCO[C@@H](Cn4cccn4)C3)[nH]c2cc1C 426623186 HKYMBUGFRKUNRE-QGZVFWFLSA-N 381.480 2.627 0 50 GFAA Cc1cc(C)n2nc(CC(=O)N3CCC[C@@H](COc4ccccc4C)C3)nc2n1 426620290 URFANAFNPXFIGH-GOSISDBHSA-N 393.491 2.910 0 50 GFAA Cc1nn(Cc2ccccc2Cl)c(C)c1NC(=O)c1c(C(=O)O)cnn1C 20602685 BLAMQXROTGTONX-UHFFFAOYSA-N 387.827 2.886 0 50 GFAA O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ccc(N2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 239433483 XTMMVXNSTFFHAS-ODJDQKDNSA-N 392.455 2.902 0 50 GFAA COc1ccc(-n2ncc([C@@H](C)NC(=O)CCc3nc(Cl)n[nH]3)c2C)cc1 91690521 UVYAJCSXNOYGAQ-LLVKDONJSA-N 388.859 2.771 0 50 GFAA CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 181175655 DOVOOSANLPYDPP-GOSISDBHSA-N 386.473 2.651 0 50 GFAA COc1ccccc1Cc1nc([C@@H]2C[C@@H](O)CN2)n(Cc2ccc(C)cc2)n1 96135719 XPXJTISOWZXRJF-MOPGFXCFSA-N 378.476 2.630 0 50 GFAA Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3ccc4c(c3)NC(=O)CNC4=O)C2)cc1 295378600 OWQIGVFMSHMSQS-YOEHRIQHSA-N 377.444 2.695 0 50 GFAA Cc1cc(N2CCC(NCC(=O)N3CCCC3)CC2)nc(-c2ccccc2)n1 96131938 HAFBXGRTUDBGPK-UHFFFAOYSA-N 379.508 2.633 0 50 GFAA O=C(c1ccc(CO)o1)N1CCN(c2ccccc2-c2ccccc2)C(=O)C1 91745892 LMNHZTZSLDQQJR-UHFFFAOYSA-N 376.412 2.928 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@H](n3cc(CO)nn3)C2)nn1C1CCCCC1 296635862 AHDILDBXNQLGNJ-KRWDZBQOSA-N 387.488 2.650 0 50 GFAA Cc1nc(CN2CCC3(CCC(=O)N([C@H]4CC[C@H](O)CC4)C3)CC2)cs1 244811390 SBVKFWMJHUIABE-IYARVYRRSA-N 377.554 2.960 0 50 GFAA O=C(Nc1cc(Cl)ccc1OC(F)(F)F)N1CCOC[C@@H]1c1nc[nH]n1 297157443 GNDFTBPUDSYCGE-SNVBAGLBSA-N 391.737 2.962 0 50 GFAA O=C(Cn1cnc2ccccc21)N1CCCN(C(=O)c2ccc(F)cc2)CC1 299177327 YBUYRLCVYQTASO-UHFFFAOYSA-N 380.423 2.550 0 50 GFAA CCC(CC)c1nc(Cn2ccn3nc(-c4ccccc4)c(CO)c3c2=O)no1 263615548 CYHXNWVWVKNXNA-UHFFFAOYSA-N 393.447 2.990 0 50 GFAA CN1CCN([C@@H]2CCN(C(=O)Nc3ccccc3Oc3cccnc3)C2)CC1 299781285 DIQZKEHQKAZVTC-QGZVFWFLSA-N 381.480 2.728 0 50 GFAA CCN(Cc1cnn(CC)c1)S(=O)(=O)c1ccc(-c2n[nH]c(C)c2C)o1 823086418 SDQMWRVTCBUPEX-UHFFFAOYSA-N 377.470 2.714 0 50 GFAA CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2C1)c1cn2cccnc2n1 822662136 FULFLEKKLXCRDX-MRXNPFEDSA-N 395.463 2.966 0 50 GFAA Cc1cccc(CN(C[C@H]2CCCO2)C(=O)NCc2cnc3cnccn23)c1 584893371 IQYMTVFFZJDQKF-LJQANCHMSA-N 379.464 2.929 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ncccc1Oc1ccccc1 1875401430 XYIKHZQMTLOPSE-KBAYOESNSA-N 378.432 2.640 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ncc(C(F)(F)F)cc1Cl 1875401384 WOYSGGODGTXFOB-ZWKOPEQDSA-N 388.777 2.520 0 50 GFAA C[C@@](CO)(c1ccc(Br)cc1)N1CCN(C(=O)C2CC=CC2)CC1 1456780044 KMPFWILEPZLQMX-LJQANCHMSA-N 393.325 2.767 0 50 GFAA CCN(CC)C(=O)Cc1ccc(NC(=O)N2CC[C@H](C(=O)O)[C@H](C)C2)cc1 952884224 LMBMSIGWQUCLTL-PBHICJAKSA-N 375.469 2.672 0 50 GFAA CC(C)Oc1ccc2[nH]ccc(=NC[C@@]3(N4CCOCC4)CCCOC3)c2c1 1875265591 KJUDNYUSGUGLNL-QFIPXVFZSA-N 385.508 2.737 0 50 GFAA COc1ccc(-c2nnc(C)o2)cc1NC(=O)c1ccc2c(c1)OCC(=O)N2 952984604 XHMNZXBTVZQYDT-UHFFFAOYSA-N 380.360 2.637 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)Cc2ccc3c(c2)OC(F)(F)O3)N1 952868976 JOKKJNWDSQCLMW-HNNXBMFYSA-N 375.375 2.684 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)NC2CC2)c1 869071664 LQWHJHFVERKSIN-FQEVSTJZSA-N 389.455 2.657 0 50 GFAA CCOCCN1C(=O)N[C@H]2c3ccccc3O[C@@]13CCN(CC(F)(F)F)C[C@H]23 1776006012 RJEYRLQCAGWETA-UWWQBHOKSA-N 399.413 2.762 0 50 GFAA Cc1nc2ncnn2c(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1C 301362819 PFWYAWMYEZMBHV-CYBMUJFWSA-N 381.358 2.612 0 50 GFAA O=C(N[C@H](CO)CC1CCCC1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 225542492 IXFPDSIHTLUUAO-KRWDZBQOSA-N 394.462 2.874 0 50 GFAA CCS(=O)(=O)C1CCN(C(=O)c2nn(-c3ccccc3Cl)cc2C)CC1 195287842 CIUVEODCXNCONM-UHFFFAOYSA-N 395.912 2.873 0 50 GFAA CCN(C[C@@H]1CCCCO1)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506402280 VSRWBIDKVYYRLZ-JTQLQIEISA-N 379.837 2.757 0 50 GFAA C[C@@H]1C(=O)N2CCC[C@H]2CN1CCCN1CCN(c2cccc(Cl)c2)CC1 1772705996 LLLIOUVQGIJQMM-XLIONFOSSA-N 390.959 2.547 0 50 GFAA O=C([C@H]1CCc2sc(-c3ccncc3)nc2C1)N1C[C@H]2[C@H]3CC[C@H](N3)[C@H]2C1 1772811881 AALVVUFNNLSRIN-ZOFXXKQRSA-N 380.517 2.519 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccc(F)cc2)C1)C(=O)CCc1cnn(C)c1 11933387 AXQXAHUQDXYTML-HXUWFJFHSA-N 386.515 2.905 0 50 GFAA O=C(Cc1ccccc1)NC(=S)Nc1cccc(C(=O)NC[C@@H]2CCCO2)c1 12138733 VCLKLDRJQTWKSU-SFHVURJKSA-N 397.500 2.651 0 50 GFAA CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCCN(C(=O)Cn2cncn2)C1 12571840 MKLGVOXJZGTPFU-ISPXXFMDSA-N 382.464 2.554 0 50 GFAA Cc1cc(C)nc(CCNC(=O)[C@H]2CCC(=O)N(CCCc3ccccc3)C2)n1 12573025 ZXBJAISPWDOJPJ-FQEVSTJZSA-N 394.519 2.624 0 50 GFAA CCCCN1CCN(c2ccc(C(=O)NCC[C@H]3CCCCN3C)cn2)CC1 12712703 VIZIPQPTOLUFHF-HXUWFJFHSA-N 387.572 2.608 0 50 GFAA COc1ccccc1CCN[C@@H]1CCc2c(c(C(=O)N3CCCCC3)nn2C)C1 14538086 JPWZPAMBZSBBFP-GOSISDBHSA-N 396.535 2.744 0 50 GFAA COc1cc(CNCC(C)(C)OC)ccc1OC[C@@H](O)CN1CCCCCC1 15073187 ALMPANGZQVJYNR-IBGZPJMESA-N 394.556 2.826 0 50 GFAA Cc1nc(N(C)C2CCCCC2)ncc1[C@H](C)NC(=O)CCC(=O)N(C)C 15076174 BRIZVTGBKOWEJU-AWEZNQCLSA-N 375.517 2.600 0 50 GFAA COc1ccccc1N1CCN(c2ncccc2CNCc2c[nH]c(C)n2)CC1 19595487 DQFMVIATOKXWBZ-UHFFFAOYSA-N 392.507 2.738 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2ccc3nonc3c2)C[C@@H]1CCO 19782337 IAPFIJRCZJPIPO-IBGZPJMESA-N 396.491 2.690 0 50 GFAA COc1cc(-c2nc(CNC(=O)[C@H]3COc4ccccc4O3)c(C)o2)ccc1O 1857702807 PRMFPNUCEQVYCV-LJQANCHMSA-N 396.399 2.820 0 50 GFAA CNC(=O)CCN(C)C(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857715237 IGJTVJZLTFXEPR-CYBMUJFWSA-N 392.887 2.682 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N[C@@H]1C[C@H]2CO[C@@H](c3ccccc3)CN2C1 1857720110 FFNJZJBOOIISCM-KGVIQGDOSA-N 394.519 2.552 0 50 GFAA N=c1[nH]c2cc(C(=O)NCCc3csc(-c4ncccn4)n3)ccc2s1 1857736113 LEQJFLWEIVNHDD-UHFFFAOYSA-N 382.474 2.595 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCCOc2ccccc2)CC[C@@H]1NC(=O)CC 1875248091 XNKKQISLGDMDNB-WDSOQIARSA-N 376.497 2.672 0 50 GFAA Cc1nc(NC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)c2c(C)csc2n1 328613957 USWVCWJHOZBMEM-SUMWQHHRSA-N 384.509 2.982 0 50 GFAA CCCCc1nnc(NC(=O)CN2CCC(CN3CCCCC3=O)CC2)s1 137498062 IOKNHHYFQRDWLE-UHFFFAOYSA-N 393.557 2.544 0 50 GFAA NCCc1cc(=O)[nH]c(-c2ccc(CN3CCC[C@H](C(F)(F)F)C3)cc2)n1 35999707 DFKOXSIKDWDMKN-HNNXBMFYSA-N 380.414 2.712 0 50 GFAA CCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(Br)c1 4113628 VYEOTFUHABBIMZ-AWEZNQCLSA-N 383.242 2.657 0 50 GFAA Cc1cc(C)n2nc(C(=O)N3C[C@H](C4CC4)O[C@H](c4ccccc4)C3)nc2n1 2100545143 QKGHIOWSNZTSGM-ZWKOTPCHSA-N 377.448 2.733 0 50 GFAA O=C(C[C@@H]1CN(C(=O)C2=CCCC2)C2(CCC2)CO1)N1CCC[C@H]1c1ncc[nH]1 2325785065 AAXKKCHMJPLLRO-MSOLQXFVSA-N 398.507 2.724 0 50 GFAA COC1CC2(CC(CNC(=O)c3cc4[nH]c(-c5ccccc5)cc(=O)n4n3)C2)C1 2325792063 ZMXYAMMDEQYNOO-UHFFFAOYSA-N 392.459 2.625 0 50 GFAA Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2ccccc2CN)CC3)c1 2325795098 DWUFTBJXXLSOSG-IBGZPJMESA-N 375.476 2.591 0 50 GFAA CC(C)Cc1n[nH]c2ccc(C(=O)NC3CC(n4cc([C@@H](C)O)nn4)C3)cc12 2325869733 ZAHAHWUSSLGVHH-LRVUVFPRSA-N 382.468 2.540 0 50 GFAA Cc1c(NC(=O)C(C)(C)C)cccc1C(=O)NN1C(=O)c2ccccc2C1=O 1108525 YWHZKBGBOAXSBB-UHFFFAOYSA-N 379.416 2.921 0 50 GFAA Cc1cc(C)nc(SCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1 2488773 WSBLAWNOKKYUBI-UHFFFAOYSA-N 376.507 2.863 0 50 GFAA CCc1cccc(C)c1NC(=O)CN(c1ccccc1)S(=O)(=O)N(C)C 2884888 XZOKDZOESSVHQS-UHFFFAOYSA-N 375.494 2.809 0 50 GFAA Cc1c(Cl)cccc1N=c1ncnc(Nc2ccc(C(=O)N(C)C)cn2)[nH]1 2356162827 LUSKYAVJQMEUQQ-UHFFFAOYSA-N 383.843 2.839 0 50 GFAA CCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)OC)C(C)C 4764708 ZWOBJLUDGBFODW-SJORKVTESA-N 378.469 2.785 0 50 GFAA COC(=O)C1=C(c2ccccc2)Nc2ncnn2[C@H]1c1cc(OC)ccc1OC 4838488 NGGCGAILKBDQRN-IBGZPJMESA-N 392.415 2.895 0 50 GFAA CC(=O)N1CCC(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)CC1 6730459 VVHHWHCOVOCWCN-UHFFFAOYSA-N 385.489 2.635 0 50 GFAA COC1(C(F)(F)F)CCN(C(=O)NCc2cc(F)cc3c2OCOC3)CC1 416689041 ONIKQAAAZKLKJJ-UHFFFAOYSA-N 392.349 2.945 0 50 GFAA Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(OCC(N)=O)cc1)CC(=O)N2 9165195 OIKOLZZTMJYSMV-QGZVFWFLSA-N 376.416 2.519 0 50 GFAA O=C(Cn1ncc(N2CCCCC2)cc1=O)NCc1cc2ccccc2s1 23543269 CAAHMUBBJOMACN-UHFFFAOYSA-N 382.489 2.765 0 50 GFAA OCC[C@H]1CN(Cc2cnn(-c3ccccc3)c2)CCN1CCc1ccccc1 22913008 UUHOGEVTXLMLMK-DEOSSOPVSA-N 390.531 2.984 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(Cc3cc4ccccc4[nH]3)CC2)C1 67920221 NNPNIDVNQSCXQB-LJQANCHMSA-N 398.551 2.607 0 50 GFAA Cc1ncccc1O[C@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1 328615381 AVEYMHAEMSGADC-LBPRGKRZSA-N 387.383 2.646 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C(=O)N1CCCC[C@@H]1C 363658532 CAONSSPEGISJCD-JENIJYKNSA-N 385.508 2.587 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CCn3ccnc3CC)CC2)OC1=O 77422725 NYPBXTWAFUEPDC-MRXNPFEDSA-N 376.501 2.838 0 50 GFAA O=C(N[C@H]1CCc2ncnn2C1)N1CCC(Cc2cccc(F)c2F)CC1 333632664 RCSJHWYCSDMDTR-HNNXBMFYSA-N 375.423 2.535 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CC[C@@H](c3ccccc3C(=O)O)C2)c1C 72161293 CYVSAZMRURCZBH-MRXNPFEDSA-N 383.448 2.807 0 50 GFAA Cc1ccccc1-n1nc(C(=O)N(CCC(=O)O)C2CCOCC2)c2c1CCC2 237744903 OTRWSGSXBUICOC-UHFFFAOYSA-N 397.475 2.765 0 50 GFAA CCCOc1cccc(CCNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)c1 129499927 KWPGLNNSSKFKFO-GOSISDBHSA-N 381.476 2.578 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCCc3noc([C@@H]4CCCO4)n3)cc2)n1 216039058 YHFOALQZSYASSB-SFHVURJKSA-N 395.463 2.755 0 50 GFAA CCN(CC(C)(C)C)C(=O)C[C@@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71748115 JTVFYWSXFIOYJQ-MRXNPFEDSA-N 375.513 2.870 0 50 GFAA C[C@@H](O)c1cc2n(n1)CCCN(Cc1ccccc1OCCn1ccnc1)C2 221415766 RMPRXKOHGTZXLG-QGZVFWFLSA-N 381.480 2.618 0 50 GFAA CCNC(=O)N1CCN(C(=O)c2ccccc2-c2ccccc2C(=O)O)CC1 263429033 MVNDTJHMWNLMJU-UHFFFAOYSA-N 381.432 2.539 0 50 GFAA Cc1cnc(CNC(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)cn1 426383313 PDTDVOMYPTWTMO-UHFFFAOYSA-N 397.504 2.940 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1CC1CCCCC1)NCc1cccc2[nH]ccc12 19792384 QRXVOJAEFHWHKY-HXUWFJFHSA-N 382.508 2.555 0 50 GFAA Cc1ccc([C@@H](NC(=O)c2[nH]nc3c2CN(C)CC3)c2cccnc2)c(C)c1 97655594 WPQPQPYSZWRHDS-FQEVSTJZSA-N 375.476 2.929 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N[C@@H](C)COc2ccccc2OC)c1 97527401 ITNSLAJYGLAZIV-ZDUSSCGKSA-N 387.436 2.652 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)[nH]n1 91934370 KXNAEXLRNXBZJV-VMPITWQZSA-N 378.476 2.886 0 50 GFAA O=C(CCc1cn2ccccc2n1)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 91427110 VDGPCTLYNZPEEG-QFIPXVFZSA-N 380.492 2.518 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)Nc1ccc(-c2nc(C)no2)cc1 96153547 UCCXNGHBDBOLRT-UHFFFAOYSA-N 387.469 2.879 0 50 GFAA COC(=O)c1cnc2c(c1)n(Cc1cn(C)nc1C)c(=O)n2C1CCCCC1 95372325 RDDKGOVWFAONPY-UHFFFAOYSA-N 383.452 2.580 0 50 GFAA O=C(c1cnc(-c2ccccn2)nc1O)N1CCCC[C@@H]1CCn1cccn1 91706614 GQZRTVVUFNUGFI-OAHLLOKOSA-N 378.436 2.526 0 50 GFAA COc1ccc(C(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)cc1-n1cnnn1 183245494 PUONBKVUXLYZDQ-QGZVFWFLSA-N 391.431 2.549 0 50 GFAA O=C(C[C@H]1N=C(O)N(c2cccc3ccccc23)C1=O)NCCc1ccccn1 252522930 BKRXZSDGXOCTSE-GOSISDBHSA-N 388.427 2.613 0 50 GFAA CC(C)[C@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2nc[nH]n2)CC1 252517478 JQHSGMZBUKVSBR-KZNAEPCWSA-N 383.496 2.933 0 50 GFAA Cc1cc(C)c(S(=O)(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1C 252484192 FQXWTDBCICAFJC-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA CS(=O)(=O)CCC(=O)N(CCc1ccc(Cl)cc1)Cc1cccnc1 825539363 XEWYMIWLIVIVPF-UHFFFAOYSA-N 380.897 2.741 0 50 GFAA N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1CN1CCOCC1 828116137 WXMXEVUDMOZDGZ-IBGZPJMESA-N 378.476 2.509 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1cccnc1 827696459 MNXIZDGWLCHUHM-HXUWFJFHSA-N 393.487 2.638 0 50 GFAA Cc1cc2ncnc(N[C@H]3CN(C(=O)[C@H]4C[C@H](N(C)C)C4)CC(C)(C)C3)c2[nH]1 1875327895 OTIGLYWPIXFONQ-BZUAXINKSA-N 384.528 2.646 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)[C@H]2C(=O)NC[C@@H]12 1875304147 BJWLSWNRJIDYTI-XFBWCDHKSA-N 388.468 2.861 0 50 GFAA Cn1ccc(-n2nc(CCCO)nc2[C@@H]2COc3ccc4ccccc4c3C2)n1 1875336045 QWVBYGJRYSCGAB-INIZCTEOSA-N 389.459 2.798 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](N[C@@H](C)c3cc4ccccc4[nH]3)C2)n1 1875397550 DMEPFRBVVXFTNN-DOTOQJQBSA-N 392.507 2.864 0 50 GFAA Cc1ncnc2c1C[C@H](C(=O)N1CCC[C@@H](CN(C)Cc3cccnc3)C1)CC2 1875290672 WMKDDTKNWPFEHD-VQTJNVASSA-N 393.535 2.656 0 50 GFAA C[C@H](C(=O)NCC[S@@](=O)c1ccccc1F)n1ccc(C(F)(F)F)n1 1875269372 GMWNJWFFSWWGBM-REFGNXHDSA-N 377.363 2.526 0 50 GFAA O=C(O)[C@@H]1CC2(CCCC2)CN1C(=O)c1ccc(S(=O)(=O)C(F)F)cc1 1875286229 LJIXIIVGCBJTRV-ZDUSSCGKSA-N 387.404 2.542 0 50 GFAA Cc1noc(-c2ccc(-c3cccc(C(=O)N4CC[C@@H]5CNC[C@@H]54)c3)nc2)n1 1565507300 CUJNLODNOWWCLP-APWZRJJASA-N 375.432 2.541 0 50 GFAA CCCCn1c(CN2CC[C@H](Nc3ncccn3)[C@@H](O)C2)nc2ccccc21 1565515680 VVDQXRMRFZGCII-HKUYNNGSSA-N 380.496 2.674 0 50 GFAA c1sc(C2CC2)nc1CN1CCC[C@@H](c2[nH]ncc2CN2CCOCC2)C1 275537962 MKFNQEUKEREGGL-MRXNPFEDSA-N 387.553 2.955 0 50 GFAA CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)c1cccnc1C(F)(F)F 188135754 FWWPFIOCOMFYLT-IBGZPJMESA-N 393.409 2.809 0 50 GFAA CC1=C(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)OCCO1 1506405492 FBCKMYKEDUHYMF-GOSISDBHSA-N 390.455 2.690 0 50 GFAA C[C@@H](C(=O)N1CCCN(Cc2cccs2)CC1)n1cnc2ccccc2c1=O 1506415178 MKKVQQPUEYWLQO-INIZCTEOSA-N 396.516 2.754 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N[C@@H]2CCCN(C)C2)cc1 1704304284 CJOCCAIFVSCEJU-MRXNPFEDSA-N 384.480 2.774 0 50 GFAA O=C([C@H]1CC2CCN1CC2)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1 1775978159 BVVMKHSUUCPJRW-QGZVFWFLSA-N 382.426 3.000 0 50 GFAA Cc1ccc2nc(N3CCC(C(=O)N4CCC[C@H](CO)C4)CC3)nc(C)c2c1 12218048 DCOKHWHNVNRCHY-KRWDZBQOSA-N 382.508 2.694 0 50 GFAA CCOC(=O)CCNC(=O)c1cnn(-c2ncc(C)c(-c3cccs3)n2)c1C 12281570 KSHQMENRFJRGRQ-UHFFFAOYSA-N 399.476 2.691 0 50 GFAA CNC(=O)c1nn(C)c2c1C[C@H](NCc1nc(-c3ccccc3)cs1)CC2 14755572 HGBPFUCYWVMZPL-CQSZACIVSA-N 381.505 2.550 0 50 GFAA C[C@@H](Cn1cccn1)C(=O)NCc1cccnc1N1CCc2ccccc2C1 14956175 IPYQYGWGKNTBCJ-KRWDZBQOSA-N 375.476 2.793 0 50 GFAA Cn1nnnc1SCCNC(=O)c1ccc2oc(-c3cccc(F)c3)nc2c1 14957299 KSDDWEAGRFXVTN-UHFFFAOYSA-N 398.423 2.680 0 50 GFAA CC[C@H]1C(=O)N(C)CCN1c1ccc(-c2nc(-c3ccccc3F)no2)cn1 15068254 VBHNOMZRINMXKM-INIZCTEOSA-N 381.411 2.995 0 50 GFAA Cc1ccc([C@@H]2NC(=O)N(CC(=O)N(C)c3ccccc3)C3=C2C(=O)OC3)cc1 169757941 CHJSAIHVAYUCCZ-FQEVSTJZSA-N 391.427 2.535 0 50 GFAA Cc1ccc(N2CCC3(CC2)OCCc2sc(C(=O)NC4CC4)cc23)nn1 1857682087 HMRRHYAGFZJQTL-UHFFFAOYSA-N 384.505 2.807 0 50 GFAA COc1ccc(-n2ccnc2-c2nccn2[C@@H]2COC3(CCNCC3)C2)cc1 1857697536 XTRSHEZCABLMBM-KRWDZBQOSA-N 379.464 2.828 0 50 GFAA N=c1[nH]c2cc(C(=O)N3CCc4nc[nH]c4[C@@H]3c3ccncc3)ccc2s1 1857715926 OGKYUBAAOMNHEA-KRWDZBQOSA-N 376.445 2.615 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)Nc3ccc(F)cc3)C1)CC2 1857729556 POBHIRZSXQCYTI-FQEVSTJZSA-N 385.443 2.899 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(C(=O)c3ccc(Cl)cc3)C[C@]23CC[C@H]1O3 1857734504 KPXMCHSZKNBNLR-TVKQPGBESA-N 376.884 2.876 0 50 GFAA Cc1ccc(-n2ncc(C(=O)N3CCO[C@H](C(=O)O)C3)c2C2CC2)cc1Cl 237782319 PXAFXPKCPCSJPX-INIZCTEOSA-N 389.839 2.637 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1cccc(Oc2ccccn2)c1 2325785801 NZURURSIRCRMTD-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA Cc1cn2ccnc(C(=O)N(C)C[C@@H](C)NC(=O)c3cc(C)c(F)c(C)c3)c2n1 2325793998 NREHIUQUPAILIW-CQSZACIVSA-N 397.454 2.684 0 50 GFAA Cn1cnnc1C1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)CC1 2325807866 ZONCEZCMXDBIJR-IBGZPJMESA-N 381.524 2.822 0 50 GFAA Cc1ccccc1[C@H]1CN(C(=O)c2nnn(Cc3ccccc3)c2C)CCN1 2325824759 PHKZOZFIACEWJU-HXUWFJFHSA-N 375.476 2.730 0 50 GFAA CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C 910537346 JNAQSAGWMWPYKK-UHFFFAOYSA-N 397.475 2.504 0 50 GFAA CCn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nnc1-c1ccco1 779318 PRCWUNIWRNXLMG-UHFFFAOYSA-N 386.433 2.695 0 50 GFAA COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)c(OC)c1 1015656 HHXJPAFIJSJMNP-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA CC[C@@H](C)NC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1 2960121 BCCAMGZDMILMDL-MRXNPFEDSA-N 390.505 2.801 0 50 GFAA Cc1cc(N2CCCS2(=O)=O)ccc1C(=O)N[C@@H]1CCOc2ccccc21 172721803 DLNOYDMLXAFXST-GOSISDBHSA-N 386.473 2.789 0 50 GFAA O[C@@H](COc1cc(Cl)ccc1Cl)CN1CCCN(c2cccnn2)CC1 247606953 LUEDEYABCLPCEE-OAHLLOKOSA-N 397.306 2.735 0 50 GFAA Cc1cc(Br)c2c(c1)[C@@](O)([C@H]1C(=O)Nc3ccccc31)C(=O)N2C 101015842 IOKGCPVYEXWMOL-RDTXWAMCSA-N 387.233 2.657 0 50 GFAA COc1ccc(-c2nnc(NS(=O)(=O)c3cn(CC(C)C)cn3)s2)cc1 135986004 YEFCKIKDOLLQLF-UHFFFAOYSA-N 393.494 2.867 0 50 GFAA Cc1nc(N2CCCCC2)cc(N2CCN(C(=O)c3ccc(F)cc3)CC2)n1 21793725 QUKWKQSYHRWYBG-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA CCOC(=O)CN(C(=O)c1cnc(-c2ncccn2)s1)c1ccccc1F 121858474 AQCPIMXJEHIDMD-UHFFFAOYSA-N 386.408 2.949 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(NCCc3c[nH]cn3)nc2)C1 67677687 UOZWIYYMXOKPGZ-QGZVFWFLSA-N 383.496 2.927 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)cc1C 39519008 KIDOOOMKUCVUAM-JOCHJYFZSA-N 389.584 2.745 0 50 GFAA Cc1nc([C@H](NC(=O)COc2ccccc2F)c2ccc3c(c2)OCCO3)no1 371011722 UTDRAQQJYDRCLQ-LJQANCHMSA-N 399.378 2.573 0 50 GFAA Cc1cn(-c2ccccc2Cl)nc1C(=O)N1CCCN(C(=O)C2CC2)CC1 158296997 ASNYAWSLDNNZSG-UHFFFAOYSA-N 386.883 2.919 0 50 GFAA COCCNC(=O)[C@@H]1CCCN(C2CCN(c3nccc4ccccc34)CC2)C1 71777176 QQDIUJFDYOHVPR-LJQANCHMSA-N 396.535 2.678 0 50 GFAA CNc1nnc(SCc2csc(-c3c(C)c(C)nn(C)c3=O)n2)s1 176575660 UVTOAVDADKIKKA-UHFFFAOYSA-N 380.524 2.706 0 50 GFAA COC(=O)C[C@@]1(c2ccccc2)C(=O)NC(=O)N1CCCOCc1ccccc1 44126561 QGGRJWAPHNVPFG-JOCHJYFZSA-N 396.443 2.604 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCO[C@H](c3cccc(O)c3)C2)[C@H]1c1ccccc1 178623581 YMJNARBXMPBTHD-JAXLGGSGSA-N 394.471 2.902 0 50 GFAA COCCCn1c(=S)[nH]c(=O)c2c(C(F)F)cc(-c3cnn(C)c3)nc21 20615676 HTSBBLJGBCZHRI-UHFFFAOYSA-N 381.408 2.829 0 50 GFAA COc1ccc(OC2CCN(C3CCCC3)CC2)c(C(=O)N[C@@H](C)CO)c1 95519580 LYFZSTFNLYAGDR-HNNXBMFYSA-N 376.497 2.592 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)Cc2csc(C(C)=O)c2)C1 95499671 IDTQYJYCGIACCI-MRXNPFEDSA-N 375.494 2.742 0 50 GFAA N[C@@H](C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1)c1ccccc1 95499243 AALQUVXVNPNPGJ-HXUWFJFHSA-N 375.476 2.732 0 50 GFAA O=C(NCC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1)c1cccs1 181466249 WIPKNPQEDXMRKZ-UHFFFAOYSA-N 386.399 2.557 0 50 GFAA O=C1COc2cccnc2N1CCCN1CCN(c2cccc(Cl)c2)CC1 95378939 YLDCIUZBMJRCDK-UHFFFAOYSA-N 386.883 2.673 0 50 GFAA O=C1CC2(CCN(C(=O)c3ccc(=O)[nH]c3)CC2)CN1C/C=C/c1ccccc1 91650886 SBPLOOHQUHFXJY-QPJJXVBHSA-N 391.471 2.543 0 50 GFAA CCn1ccc(CN2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 91779508 HACOKIDIHDQLEK-UHFFFAOYSA-N 381.524 2.745 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@H]1CCS(=O)(=O)C1)c1cccs1 334157923 MTMGPVIQYABMIA-AWEZNQCLSA-N 387.486 2.645 0 50 GFAA Cc1nn(CC(=O)N[C@@H](c2cccnc2)C(F)(F)F)c(=O)c2ccccc12 91494547 ZACAFHIHUSTLPO-INIZCTEOSA-N 376.338 2.520 0 50 GFAA Cc1oc2c(c1C(=O)N1C[C@@H]3c4ccccc4OC[C@]3(CO)C1)C(=O)CCC2 96135702 XZSAZDZNPQRMKO-IVZQSRNASA-N 381.428 2.718 0 50 GFAA CNc1ncc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccc(C(C)C)cc3)C2)cn1 92107123 ZZYHOVHADBJVCD-QGZVFWFLSA-N 381.480 2.653 0 50 GFAA O=C(O)c1cccc([C@@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCCC4)C2)c1 95354801 ZMBZEOXBKRBYTD-QGZVFWFLSA-N 380.444 2.972 0 50 GFAA Cc1nc2ccc(C(=O)N[C@@H](Cc3ccccn3)[C@H]3C[C@@H](O)C3)cc2nc1C 244691709 JHVMCNSNYLSOOS-HQRMLTQVSA-N 376.460 2.754 0 50 GFAA COc1ccc(CN[C@@H]2CNC(=O)c3cc(-c4ccc(F)cc4)nn32)cc1OC 263619148 XEQWDEOKWNHRRZ-FQEVSTJZSA-N 396.422 2.738 0 50 GFAA CCc1nc(CCNC(=O)c2cccc(-c3nc(N(C)C)n(C)n3)c2)cs1 299800981 UHUBPVDNNMIEBH-UHFFFAOYSA-N 384.509 2.540 0 50 GFAA Cn1cnc(-c2ccccc2)c1NC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21 886046154 MIGWFIKGBINANB-MRXNPFEDSA-N 381.457 2.987 0 50 GFAA COc1ccc([C@@H]2[C@H](CNC(=O)NCc3ccnc(N(C)C)c3)CCN2C)cc1 1775996457 XYVTWCZVIZIVOT-GHTZIAJQSA-N 397.523 2.648 0 50 GFAA C[C@H](NC(=O)NCC1CCN(C2CCCC2)CC1)[C@H](O)c1ccc(O)cc1 1565515467 XPCPVBRPYRBYAB-YWZLYKJASA-N 375.513 2.768 0 50 GFAA CNS(=O)(=O)c1csc(C(=O)N2CCc3c2cccc3C(F)(F)F)c1 185780500 NEIAKWHPZRLSGR-UHFFFAOYSA-N 390.408 2.878 0 50 GFAA Cc1ccnc(-c2ccc(NC(=O)N3CCN(C)[C@H](c4nccn4C)C3)cc2)n1 275521799 MHGCAZVYTXRBCZ-SFHVURJKSA-N 391.479 2.706 0 50 GFAA Cc1cc(C[C@@H](C)NC(=O)N2CCc3ccnc(O)c3C2)n(-c2ccccc2)n1 277160680 XKTHXDPAONBYDE-OAHLLOKOSA-N 391.475 2.980 0 50 GFAA O=C(Nc1ccccc1C(=O)N1CCO[C@@H](Cn2cccn2)C1)c1cccs1 111081845 MKVHPKOWOPZJSY-OAHLLOKOSA-N 396.472 2.738 0 50 GFAA CCc1ccccc1C(=O)N1C[C@H]2CN(CCCn3cccc3)C[C@@]2(CO)C1 1772709789 NKEYOLDFKKSRPQ-OFNKIYASSA-N 381.520 2.507 0 50 GFAA Cc1nc(CCN(C)C(=O)[C@H]2CCc3sc(-c4ccncc4)nc3C2)no1 1772806218 WMQLEMAAVGARPY-AWEZNQCLSA-N 383.477 2.703 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)CCc3c[nH]c4ccccc34)CC2)no1 1772700442 AXGBVESBFZTJEH-UHFFFAOYSA-N 380.448 2.772 0 50 GFAA CCc1cccc(C)c1NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 5985295 SOANYHTWTDIBHZ-UHFFFAOYSA-N 388.489 2.831 0 50 GFAA CN(CC(=O)N[C@@H]1CCCN(CCCc2ccccc2)C1)Cc1ccncc1 11820688 ZOLCHBVKWRICFM-JOCHJYFZSA-N 380.536 2.727 0 50 GFAA C[C@H](CN1CCCC1)CN(C)C(=O)c1cn(Cc2ccccc2Cl)nn1 12072937 CZJNLAKMSKKHSH-HNNXBMFYSA-N 375.904 2.784 0 50 GFAA Cc1ccc2c(c1)c1c3n2CCN(C[C@@H](O)CNCCCN(C)C)[C@H]3CCC1 12437175 MADDWMBZCFZGJC-AVRDEDQJSA-N 384.568 2.545 0 50 GFAA CCn1nc(C(=O)NCc2ccncc2)c2c1CC[C@H](NCc1ccsc1)C2 14745784 CDJLLIYKUMAVOO-KRWDZBQOSA-N 395.532 2.937 0 50 GFAA CCN(CC)CCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 15065329 KSBIEPIXZCCUBH-UHFFFAOYSA-N 387.524 2.538 0 50 GFAA Cc1nn(CCO)c(C)c1CN1CCC[C@@H]1c1ccc(C(=O)N(C)C)s1 19854047 RRYKRCQITDIUPC-MRXNPFEDSA-N 376.526 2.593 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)CCCc4ccccc4)nnc3c2)n1 169780449 HPARNJOUDYHIBA-UHFFFAOYSA-N 390.447 2.981 0 50 GFAA COCCN(CCOC)C(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857671967 AKRLQQZTSJQORY-AWEZNQCLSA-N 395.887 2.819 0 50 GFAA O=C(O)[C@@H]1CN(Cc2ccncc2)CC12CCN(C(=O)CC1CCCC1)CC2 1857683489 HJSHQXBRJZHXRO-IBGZPJMESA-N 385.508 2.787 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3CC[C@@]45OCCCN4C(=O)C[C@@H]35)c2)c1 1857740969 VTXAWEHSHAWNTO-OFNKIYASSA-N 392.455 2.926 0 50 GFAA Cn1ccc([C@@H](NC(=O)N2CCCc3c(cnn3C)C2)c2ccc(F)cc2)n1 413428641 QKXAHQGWKVTUND-IBGZPJMESA-N 382.443 2.540 0 50 GFAA CN1CCN(CC2(C)CCN(C(=O)NCc3ccc4c(n3)CCCC4)CC2)CC1 373226757 DNKXIGXQHVCGHS-UHFFFAOYSA-N 399.583 2.520 0 50 GFAA O=C(c1ccccc1O)N1CCN(Cc2ccn(-c3c(F)cccc3F)n2)CC1 157547087 RTTKULSQBRDJJK-UHFFFAOYSA-N 398.413 2.814 0 50 GFAA CCOc1cc(NC(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)ccc1C 265353975 DSHBOIFKZFZXEP-UHFFFAOYSA-N 382.464 2.847 0 50 GFAA CN1C[C@H]2CN(C(=O)NCCc3cccc(-c4ccccc4)c3)CCN2C1=O 2325744654 CCURBJUTWKGEHH-FQEVSTJZSA-N 378.476 2.657 0 50 GFAA Cc1nn(C)cc1-c1ccc(=NC(=O)Cc2cccc(CC(F)(F)F)c2)[nH]n1 2325766548 HJSFBOPZMXNJPF-UHFFFAOYSA-N 389.381 2.893 0 50 GFAA COc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)OC(C)(C)C)cc(OC)c1OC 2480345 KSQSGWVOVJVZBR-HNNXBMFYSA-N 394.493 2.847 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)NCCOC23CC4CC(CC(C4)C2)C3)cc1 4523795 GJHXVYLNFXFVGQ-UHFFFAOYSA-N 392.521 2.909 0 50 GFAA O[C@H](COc1ccc(Cl)cc1Cl)CN1CCN(c2ccccn2)CC1 4833927 RUDBXEDUVWLLJD-HNNXBMFYSA-N 382.291 2.950 0 50 GFAA O=C(c1cccnc1)[C@@H]1CCCN(Cc2nc(-c3ccc4c(c3)OCO4)no2)C1 11711997 FDNYZRCUYUXALB-MRXNPFEDSA-N 392.415 2.955 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@H](C(=O)c2cc(C)c(OC)c(C)c2)C1 11873310 PBDBLPKLANMBTA-INIZCTEOSA-N 390.480 2.870 0 50 GFAA COc1cccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3cc(C)on3)C2)c1 11873655 FYYWWWLSHDBVDF-INIZCTEOSA-N 385.464 2.940 0 50 GFAA Cc1ccc(CN(C)C[C@@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)o1 12298203 MZBVHFJXSMFWPA-FQEVSTJZSA-N 378.419 2.852 0 50 GFAA Cc1csc([C@H](C)NC(=O)c2cc(COc3ccc4c(c3)OCO4)[nH]n2)n1 12447100 OEEQYLWPWYYGNU-NSHDSACASA-N 386.433 2.973 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2CCCN(c3ccccn3)C2)CC1)N1CCCC1 12589350 IBDXMBJAULFTSJ-HXUWFJFHSA-N 398.551 2.939 0 50 GFAA CN1CCC[C@@H](CN(CCc2ccccc2)C(=O)Cn2nc3ccccc3n2)C1 12709459 KVSVHNIJNAHQPJ-HXUWFJFHSA-N 391.519 2.844 0 50 GFAA O=C(c1ccccc1)[C@@H]([C@H](c1ccccc1)N1CCOCC1)N1CCOCC1 19364533 DILBRNVHMMLSJR-FCHUYYIVSA-N 380.488 2.644 0 50 GFAA CCCCn1c(CN2CCN(CCC)CC2)cnc1S(=O)(=O)CC1CCC1 20598509 QDHCHCZDLPHXKS-UHFFFAOYSA-N 396.601 2.785 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3cccn3-c3cccnc3)C2)CC1 20855398 BSJYSYVMERBMLC-HXUWFJFHSA-N 397.523 2.611 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(Cn4nc(C)c(C)c4C)[nH]c3C2)c1 65373448 CEIQMTNOUCJBIB-INIZCTEOSA-N 379.464 2.658 0 50 GFAA O=C1N[C@@](Cc2ccc(F)cc2)(C2CCNCC2)C(=O)N1Cc1ccccc1F 67490256 FLSRBDHKOCCMCE-QFIPXVFZSA-N 399.441 2.998 0 50 GFAA OC1(Cn2ccnc2)CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67841912 QYVBKWQUHHPAGL-UHFFFAOYSA-N 375.476 2.860 0 50 GFAA CNC(=O)CNc1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cn1 67975176 FIIWFQMSXJQKGG-UHFFFAOYSA-N 380.492 2.725 0 50 GFAA COc1cccc(C[C@@H]2CN(C(=O)Cc3ccc4[nH]c(C)nc4c3)CCO2)c1 71754313 TZASQKUCGZEYLX-LJQANCHMSA-N 379.460 2.893 0 50 GFAA CCCN(Cc1ccc(Cl)cc1)C(=O)C[C@H]1C(=O)NCCN1CC(C)C 72153745 ZUEZPTHCMIQESS-SFHVURJKSA-N 379.932 2.925 0 50 GFAA Cc1ccnc(N2CCN(C(=O)c3ccc(C[C@H]4CCCNC4)cc3)CC2)c1 72172591 VCJQKDHZDFAIPD-HXUWFJFHSA-N 378.520 2.895 0 50 GFAA Cc1cc(C(F)F)nn1CC(=O)N1CCC([C@H](O)Cc2ccccc2)CC1 77388907 XLVXHWACFNRYLO-GOSISDBHSA-N 377.435 2.971 0 50 GFAA O=C(c1ccc2c(c1)OCCO2)N1CCC[C@@H]1c1nc(-c2ccccn2)no1 82121465 ATUSHYRDMGTESL-OAHLLOKOSA-N 378.388 2.880 0 50 GFAA Cc1ccn2c(F)c(C(=O)N3CC[C@]4(CCCN(CC5CC5)C4=O)C3)nc2c1 91644684 BWKLDAHVKJSSQE-OAQYLSRUSA-N 384.455 2.647 0 50 GFAA C[C@@H]1CCCN(c2ccccc2)N1C(=O)c1cnc(-c2cccnc2)[nH]c1=O 91655932 BVJLFJHLCIJZNA-OAHLLOKOSA-N 375.432 2.878 0 50 GFAA Cc1cc(C(=O)N2CCC3(CCC(=O)N(CCN(C)C)C3)CC2)ccc1F 91872993 WABJKUHLNPVBND-UHFFFAOYSA-N 375.488 2.541 0 50 GFAA O=C(NCc1cc(-c2ccccn2)no1)c1cnc(-c2cccs2)nc1O 92097711 UKDPXRNFBVVRTR-UHFFFAOYSA-N 379.401 2.891 0 50 GFAA O=C(CCc1ccncc1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95354498 YOYJCISUFMUHDR-MDNUFGMLSA-N 377.488 2.809 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(c3cccc([C@H](C)O)n3)CC2)CC1=O 95366233 VAERZPXHEIVFBN-HNNXBMFYSA-N 384.480 2.759 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)CN3CCCCC3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95375093 NYJVDGSGMOLCEH-MDNUFGMLSA-N 383.536 2.570 0 50 GFAA CC(C)n1ccnc1C1CCN(c2cc(C(=O)N3CCOCC3)ccn2)CC1 95501597 HJMADPSMIPZDDU-UHFFFAOYSA-N 383.496 2.715 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(C(=O)c2sc3ncn(C)c(=O)c3c2C)C1 95502444 BXYHRUJFVWBGDA-CYBMUJFWSA-N 385.493 2.540 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)NCC3(O)CCCCCC3)CC2)oc1C 118074982 FMTIHJNBWNXTRY-UHFFFAOYSA-N 392.544 2.888 0 50 GFAA NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC1(c2cccc(F)c2)CC1 124833419 CVJAKDUDGLPBRB-IBGZPJMESA-N 394.450 2.734 0 50 GFAA Cn1nccc1C1CCN(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)CC1 153174268 CINYFKHOBOMHGK-UHFFFAOYSA-N 387.459 2.807 0 50 GFAA O=C(NCc1cccc(-c2ccccn2)c1)N1CCCN(c2cccnn2)CC1 160196878 YJUGEYWXRIYTEE-UHFFFAOYSA-N 388.475 2.961 0 50 GFAA CC(C)Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3n[nH]c4ccccc34)C2)s1 169774366 ODWOIMGFSFKUOA-LLVKDONJSA-N 384.465 2.605 0 50 GFAA C[C@@]1(CO)CCN(C(=O)c2ccc(Cl)cc2I)C1 170596290 XZAJCRXZVCLDSM-CYBMUJFWSA-N 379.625 2.789 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1cc(Cl)nc(N(C)C)c1)C[C@H]2O 170626323 RBUAAUVGBFJSFL-CYBMUJFWSA-N 391.855 2.508 0 50 GFAA O=C(Nc1cnn(Cc2ccccn2)c1)N1CCC(OC[C@H]2CCCO2)CC1 177873301 QZYVLPPWTYSNSC-LJQANCHMSA-N 385.468 2.518 0 50 GFAA COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 186661817 XDFXSZUCKWCJET-AEFFLSMTSA-N 376.497 2.661 0 50 GFAA COCc1cccc(CNC(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1 190194810 HPWNTPJJTOCIIC-HSZRJFAPSA-N 397.519 2.611 0 50 GFAA Cc1ccc(CN2CC[C@@H](NC(=O)c3cc(F)c(F)c(O)c3F)C2=O)cc1 192294170 WRBDFMDTXDOHKP-CQSZACIVSA-N 378.350 2.649 0 50 GFAA CC(C)(CNC(=O)N1CCCN(C(=O)c2ccccc2)CC1)N1CCCCC1 193157517 MGMPUKBZESYDQC-UHFFFAOYSA-N 386.540 2.809 0 50 GFAA N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N[C@H](Cc1ccccc1)C1CC1 237844605 ODGVZRPOLWROIZ-XZOQPEGZSA-N 388.515 2.939 0 50 GFAA O=C(CCc1ccc(C(=O)O)cc1)NCc1ccccc1CN1CCCC1=O 238067798 NJXIUTHRLYFJTK-UHFFFAOYSA-N 380.444 2.756 0 50 GFAA CC(=O)c1cccc(O[C@H](C)C(=O)NC2CCN(Cc3ccncc3)CC2)c1 299341679 MLEUYRVFRYNIFG-QGZVFWFLSA-N 381.476 2.832 0 50 GFAA C[C@H](NC(=O)N1CC[C@H](N2CCCC2)[C@@H]1C)C(=O)N1c2ccccc2C[C@H]1C 334095075 QZKQXNHZZGAMMC-DFEOGRTESA-N 384.524 2.621 0 50 GFAA O=C(CCc1ccc2c(c1)CCO2)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 334162040 MMTNHOVIOHMMNR-LJQANCHMSA-N 378.428 2.848 0 50 GFAA Cc1cccc(CC2(O)CCN(C(=O)N[C@@H](C)c3nnc4n3CCCC4)CC2)c1 366321453 WLRJWAMKAHTMDQ-KRWDZBQOSA-N 397.523 2.763 0 50 GFAA COc1cc(NC2CCN(C[C@@H](O)COCC(F)(F)F)CC2)cc(OC)c1 368390660 BIABJOYFBKDKEC-OAHLLOKOSA-N 392.418 2.520 0 50 GFAA NC(=O)c1cc(OC2CCN(Cc3ccn(-c4ccc(F)cc4)n3)CC2)ccn1 374498531 VPMBIADOZYTNLL-UHFFFAOYSA-N 395.438 2.549 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCNC(=O)[C@H]2c2cccc(F)c2)cs1 426396668 UMHMZPKFKUBDHD-OAHLLOKOSA-N 376.457 2.788 0 50 GFAA Cn1cncc1-c1ccc(C(=O)NC[C@H]2CCCN(c3ncccn3)C2)cc1 426405748 PUAMNPWICJRXJR-MRXNPFEDSA-N 376.464 2.524 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)c1cccc(-c2c(C)nc(O)nc2O)c1 426442010 TZDTUZBKRPLGQO-UHFFFAOYSA-N 381.436 2.518 0 50 GFAA Cc1cc(C)c(CNC(=O)NC[C@H](O)COc2ccc(Cl)c(C)c2)cn1 584898610 RLOSLXWUIQZMLQ-INIZCTEOSA-N 377.872 2.899 0 50 GFAA CCC(CC)(CO)CNC(=O)Nc1ccc(C(=O)OC[C@H]2CCCN2)cc1 841279431 LKYBWVGZLUYIMX-QGZVFWFLSA-N 377.485 2.516 0 50 GFAA CCc1nc(CN2CC[C@](c3nc(-c4ccccn4)no3)(C(F)(F)F)C2)n[nH]1 952894272 YLKQZTHWXTXTLF-INIZCTEOSA-N 393.373 2.518 0 50 GFAA Cc1cc2cccc(C(=O)NC[C@H]3CCCN(CCn4cnnc4C)C3)c2o1 952981704 OUTBCOQWWCYEER-QGZVFWFLSA-N 381.480 2.783 0 50 GFAA CCc1c(C)nn(CC(=O)Nc2cc3nc(O)[nH]c3cc2N2CCCC2)c1C 1506400495 AMUOVQPGCZYMCK-UHFFFAOYSA-N 382.468 2.883 0 50 GFAA CCOc1ccccc1-c1nnc(NC(=O)Cn2nc(C)c(C(C)=O)c2C)o1 1506406625 QSBXTINSIBLJGE-UHFFFAOYSA-N 383.408 2.790 0 50 GFAA CCc1cc(NC[C@@H](c2cccnc2)N2CCCCC2)nc(N2CCOCC2)n1 1704301067 IOVZQPYVPUAJAT-FQEVSTJZSA-N 396.539 2.910 0 50 GFAA COc1cccc(OCCN2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1 1704343846 FXYUOAZLZBZZSF-QFIPXVFZSA-N 382.508 2.910 0 50 GFAA O=C(c1ccc[nH]1)N1C[C@H]2CN(Cc3cc[nH]n3)C[C@@]2(CCc2ccccc2)C1 1772804578 ATIHXWWXSYXZTD-XXBNENTESA-N 389.503 2.945 0 50 GFAA O=C(O)[C@H]1COCCN(Cc2ccc(OCCCCN3CCCCC3)cc2)C1 1772805246 IPUDUKMRJUUUBB-HXUWFJFHSA-N 390.524 2.865 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cnc3sccn3c2=O)C[C@@H](c2ccccc2)O1 1857712301 OGPQIPVDOMNKAI-SJORKVTESA-N 383.473 2.994 0 50 GFAA CNc1ncccc1C(=O)N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857713220 LOQJZQPBWAZOMF-XYJFISCASA-N 386.883 2.721 0 50 GFAA Cc1nc(N2CCC3(CC2)CN(Cc2ccc(Cl)s2)C(=O)CCO3)no1 1857715659 BSXUZYHWPGTPAB-UHFFFAOYSA-N 396.900 2.881 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCCC(C)(C)CO)CC3=O)sc2c1 1857733950 HEFWDBXZVVYBSN-CQSZACIVSA-N 389.521 2.873 0 50 GFAA O=C(N[C@@H]1C[C@@H]1C1CCN(C(=O)/C=C/c2cn[nH]c2)CC1)OCc1ccccc1 1875270929 LROLTMHQYKFZDF-NHQAVIFJSA-N 394.475 2.976 0 50 GFAA O=C(NC12COC(CO)(C1)C2)c1cc(-c2cccs2)nc2onc(C3CC3)c12 1875299781 VQKNXMSMZUOLLK-UHFFFAOYSA-N 397.456 2.852 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C)cc2O3)cc1Cl 1875394800 XEWLJZLSLYVEHW-HNNXBMFYSA-N 375.856 2.873 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)Cc1c[nH]c2cnccc12 1875401147 GWNOVGUYJBKYJG-QFBILLFUSA-N 394.479 2.983 0 50 GFAA Cc1c(C(=O)OCc2nc3cccnc3[nH]2)nnn1-c1ccc(Cl)cc1F 2325703742 ZBRBCPYFSWHBGI-UHFFFAOYSA-N 386.774 2.997 0 50 GFAA Cc1cnn([C@H]2CCCNC2)c1C(=O)N1CCC[C@@H](c2cc(O)cc(F)c2)C1 2325779089 GGICEFZCHCAEGD-QAPCUYQASA-N 386.471 2.981 0 50 GFAA Cn1nccc1CCC(=O)N1CCC[C@]12CCCN(Cc1ccccc1)C2=O 2356138647 OFLYPVGYULDUEP-QFIPXVFZSA-N 380.492 2.537 0 50 GFAA CCC[C@]1(C(=O)O)CCN(C2CCN(c3ccc(F)c(F)c3)CC2)C[C@@H]1O 2356161230 LNLZRMOVRASHNL-ICSRJNTNSA-N 382.451 2.871 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2cnn(Cc3ccccc3)c2)C1=O 2356165565 JMJMZMZDOSCFBR-QFIPXVFZSA-N 380.492 2.937 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Br)c(OC)c(OC)c1 707547 NRLLGGFVNSBKIJ-CYBMUJFWSA-N 399.241 2.657 0 50 GFAA COC(=O)c1ccccc1NC(=S)NC(=O)c1ccc(Br)o1 1003845 SPLFLNJWXXAODH-UHFFFAOYSA-N 383.223 2.956 0 50 GFAA Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)cc1 2850444 FGQWLTURIFWNIE-UHFFFAOYSA-N 381.476 2.921 0 50 GFAA Cc1cc(C)c(NC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1 3561797 FSQOALVUDWSOIM-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA COc1ccc(CNC(=O)C2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 4672206 RJWRURUOZUJKAD-UHFFFAOYSA-N 382.460 2.952 0 50 GFAA CCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)OC)C(C)C 4764704 ZWOBJLUDGBFODW-IRXDYDNUSA-N 378.469 2.785 0 50 GFAA O=C(CSc1nnnn1-c1ccccc1)Nc1ccc(Cl)c(C(=O)O)c1 4808819 BNRGGXJOSRJRBU-UHFFFAOYSA-N 389.824 2.745 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3ccccc3Cl)CC2)cc1OC 6715712 XOUUODIFFGWZKT-UHFFFAOYSA-N 396.896 2.868 0 50 GFAA CSc1ccccc1NC(=O)C1=CC(c2cccs2)=NS(=O)(=O)N1C 6800385 XTUKGMDCHUPUIN-UHFFFAOYSA-N 393.515 2.972 0 50 GFAA COc1ccc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3Cc3cccnc3)C2)cc1 11880831 HJYHYCGKDKQASR-QUCCMNQESA-N 379.460 2.744 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2cc(COc3cccc(C(C)=O)c3)[nH]n2)C1 12305569 CVWKYSNYTLNGGE-INIZCTEOSA-N 399.447 2.607 0 50 GFAA CCNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1 12544877 MYYDKYXGOQFPOK-UHFFFAOYSA-N 390.486 2.939 0 50 GFAA CCOC(=O)C1(CCc2ccccc2)CCN(C(=O)c2cc[n+]([O-])cc2)CC1 12570549 HMSLOTMUKHMDID-UHFFFAOYSA-N 382.460 2.738 0 50 GFAA O=C(NC1CCC1)[C@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1 14980881 RTECLDABVRXVKC-FQEVSTJZSA-N 381.564 2.999 0 50 GFAA Cc1ccc(C[C@@]2(CCC(=O)NC[C@H](C)Oc3cccnc3)CCC(=O)N2)cc1 15066689 HXBQBYLWBAZZPD-FDDCHVKYSA-N 395.503 2.945 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)N(C)CC(=O)Nc2cc(C(C)(C)C)on2)c1 16607326 BYLKJXYSWWPLRH-UHFFFAOYSA-N 379.482 2.848 0 50 GFAA Cc1ccc(NC(=O)CN2N=N[C@H]3C(=O)N(c4c(C)cccc4C)C(=O)[C@@H]32)cc1 18162421 SPEMQPCIQJLGQZ-IEBWSBKVSA-N 391.431 2.544 0 50 GFAA CN(Cc1c(C(=O)N(C)C)nc2ccc(Cl)cn12)C[C@H](O)c1ccccc1 20998764 QTSUHBZXOUVFHT-KRWDZBQOSA-N 386.883 2.855 0 50 GFAA O=C(c1coc(COc2ccccc2)n1)N1CCN(c2ccccc2)C(=O)C1 67446537 QNPNFMPWTDKYDB-UHFFFAOYSA-N 377.400 2.743 0 50 GFAA Cc1nc(N2CCN(C(=O)CCC3CCCCC3)CC2)cc(-n2ccnc2)n1 67623120 AOCAUAIIMXBXHV-UHFFFAOYSA-N 382.512 2.980 0 50 GFAA Cc1onc(C(=O)N2CCCN(Cc3ccc(F)cc3)[C@H](C(C)C)C2)c1CO 71497928 GVWYUVZKLYCWIK-IBGZPJMESA-N 389.471 2.987 0 50 GFAA c1ccc(-c2nc3c(c(NC[C@@H]4OCCc5ccccc54)n2)CCNCC3)nc1 72419241 XGSLOWKHMXUBGQ-NRFANRHFSA-N 387.487 2.953 0 50 GFAA CN(C)CCN1Cc2c(cccc2C(=O)N2CCC[C@@H]2c2cccnc2)C1=O 72432634 UEKUKSHXVFNJAM-HXUWFJFHSA-N 378.476 2.576 0 50 GFAA CC(C)CCN1C[C@]2(CCCN(C(=O)CCc3cc(O)no3)C2)CCC1=O 77539101 SFIIJMQFDVLFSB-HXUWFJFHSA-N 377.485 2.590 0 50 GFAA Cc1ccc([C@@H](C)NC(=O)CN2C(=O)C3(CCNCC3)Nc3ccccc32)cc1 82109657 PWJMKBQZHGJBOE-QGZVFWFLSA-N 392.503 2.753 0 50 GFAA Cc1nc(C)n(CCNC(=O)Nc2ccccc2OCCc2ccccn2)n1 95518772 HPYAZJQYEXVJBZ-UHFFFAOYSA-N 380.452 2.733 0 50 GFAA O=C(Nc1cnc2sccn2c1=O)N[C@H]1CCCN(Cc2ccccc2)C1 96149957 OTRYEDKYOUWWBQ-HNNXBMFYSA-N 383.477 2.542 0 50 GFAA CC1(C)[C@H]2CC[C@@]1(CS(=O)(=O)N1CCN(c3ccc(F)cc3)CC1)C(=O)C2 101031849 VYPMSMQOKWIUFB-MGPUTAFESA-N 394.512 2.673 0 50 GFAA O=S(=O)(c1c[nH]c2ncccc12)N1CCC[C@H]1c1ccc2c(c1)OCCO2 114735489 WCQAEHSLYVLGNJ-HNNXBMFYSA-N 385.445 2.860 0 50 GFAA Cc1ccc(C(=O)N2CCOC3(CCC3)C2)cc1S(=O)(=O)NC1CCCC1 128295443 YNJAWMYYTSVOIZ-UHFFFAOYSA-N 392.521 2.611 0 50 GFAA CC[C@H]1CCN(C(=O)C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)C1 131049135 MCUGFHSTTYSOMU-LBPRGKRZSA-N 396.417 2.618 0 50 GFAA O=C(CN1CCOC2(CCOCC2)C1)N[C@@H](Cc1ccccc1)c1ccccc1 135605850 SGDVMWZPHCOPIA-QFIPXVFZSA-N 394.515 2.968 0 50 GFAA CC(C)Oc1cc(CNC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)ccn1 162858934 LLIROYCIGQNAJH-NRFANRHFSA-N 383.492 2.683 0 50 GFAA COc1cccc(CC(=O)NC2CCN(c3cc(C(F)(F)F)ncn3)CC2)c1 169772332 XQZGWXXHUFLHKC-UHFFFAOYSA-N 394.397 2.832 0 50 GFAA CN(CCN(C1CC1)S(=O)(=O)c1ccc(Br)cc1F)C1CC1 170618793 QBYXCBSHKYBCLY-UHFFFAOYSA-N 391.306 2.836 0 50 GFAA C[C@H]1Cc2ccccc2N1C(=O)CN1CCC(c2nnc3ccccn23)CC1 171128356 JNTUVUTZHZVWMU-INIZCTEOSA-N 375.476 2.887 0 50 GFAA Cc1c(C(=O)NCc2ccnc(-n3ccnc3)c2)nnn1-c1ccccc1Cl 171534821 XWJFYIRLBLYIQX-UHFFFAOYSA-N 393.838 2.740 0 50 GFAA Cc1c(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)nnn1-c1ccccc1Cl 175742280 RQPISSREMYFOBF-UHFFFAOYSA-N 397.822 2.837 0 50 GFAA CNC[C@@H]1CCCN(S(=O)(=O)c2cc(Br)ccc2Cl)C1 237206509 VNQOAKFADKBAGN-JTQLQIEISA-N 381.723 2.723 0 50 GFAA Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(CC(=O)O)C1CCOCC1 237686623 CZCDOLUXUOCKDV-UHFFFAOYSA-N 378.425 2.963 0 50 GFAA Cc1ccc(NC(=O)NC(=O)[C@@H](C)N2C[C@@H](N)[C@H](c3ccccc3)C2)c(C)c1 261871840 XMGQYVCHEQPBBV-NZSAHSFTSA-N 380.492 2.767 0 50 GFAA CCNc1nc(C(=O)N2CCOC[C@H]2c2nc(-c3cccs3)no2)cs1 282667520 VNNBCSYZMMHBJC-NSHDSACASA-N 391.478 2.900 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)NCc1nccc(C(F)F)n1)CC2 288922863 XKRKPPQGUCGLQG-UHFFFAOYSA-N 378.379 2.699 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@H]1Sc2ccccc2NC1=O)c1ccc(F)cc1 299746463 XOYKZURYRWKWBL-GOEBONIOSA-N 388.420 2.961 0 50 GFAA Cc1nn(C)c2ncc(CNC[C@H]3CCc4nc(C(F)(F)F)cn4C3)cc12 328651787 WAWXRBMQZLWATJ-GFCCVEGCSA-N 378.402 2.844 0 50 GFAA Fc1ccc([C@@H]2CN(c3nccc(N[C@@H]4CCCOC4)n3)CCO2)c(Cl)c1 333189734 VMALJHYSFBIERA-PBHICJAKSA-N 392.862 3.438 0 50 GFAA CN1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)C[C@H]1c1nccn1C 333504684 WFCIDCXIKAPZDD-SFHVURJKSA-N 385.487 2.679 0 50 GFAA Cn1nccc1[C@@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1 366975240 JYZOJDDMKMAUMP-GFCCVEGCSA-N 383.374 2.556 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CC[C@H](N(C)C)C3)csc2C1 426401602 CHQZUMSAPACPKD-HNNXBMFYSA-N 388.537 2.687 0 50 GFAA COCc1nc([C@H]2CCOC2)cc(N(C)Cc2ccc(-n3cccn3)cc2)n1 426420806 RATGKKNKTCYLGL-KRWDZBQOSA-N 379.464 2.949 0 50 GFAA CCc1ccc(CCCC(=O)N2C[C@H]3COCC[C@@]3(O)[C@@H]3COCC[C@@H]32)cc1 426734010 MDKJEFSJXDVEBF-KGSLCBSSSA-N 387.520 2.587 0 50 GFAA Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)Cc1ccc(-n2cnnn2)cc1 447649181 GRAKCXOJGVUAAW-UHFFFAOYSA-N 395.373 2.522 0 50 GFAA CCOc1ccc(-c2ccc(C(=O)N[C@H](c3ncnn3C)C(C)C)cc2)nn1 534659676 IPVHZCRBJQLYKF-SFHVURJKSA-N 380.452 2.798 0 50 GFAA C[C@H](NC(=O)Cn1cnc2ccsc2c1=O)c1ccccc1-n1cccn1 670443362 KFQJUWQHXSTBGZ-ZDUSSCGKSA-N 379.445 2.521 0 50 GFAA C[C@H](NC(=O)Cc1noc(Cc2cnn(-c3ccccc3)n2)n1)c1ccccc1 770960138 NTOXEUHDDVQRJT-HNNXBMFYSA-N 388.431 2.661 0 50 GFAA O=C(c1cccnc1)N1CCC(NCCOc2cccc3cccnc23)CC1 828184606 FZQFBNIZWDZKFT-UHFFFAOYSA-N 376.460 2.903 0 50 GFAA CC(=O)N1CCc2sc(S(=O)(=O)N3CC=C(c4ccccc4)C3)cc2C1 849384016 KHYXGVAUKXKBEZ-UHFFFAOYSA-N 388.514 2.741 0 50 GFAA O=C1N[C@@H](CC(=O)N2CCN(c3ccnc4ccccc34)CC2)c2ccccc21 897721968 PTKHYLQYPYGTME-FQEVSTJZSA-N 386.455 2.758 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N(CCO)CC12CC3CC(CC(C3)C1)C2 952869453 KMDMMICOTCMNIT-UHFFFAOYSA-N 392.565 2.874 0 50 GFAA O=S(=O)(c1ccc(-c2ccno2)o1)N1CCCN(c2ccc(F)cc2)CC1 952967863 DWFDIKJOQVXDGS-UHFFFAOYSA-N 391.424 2.975 0 50 GFAA COc1cc(F)ccc1CN1CCOC2(CCN(c3ccc(C)nn3)CC2)C1 1506396840 KCLXSKJVHXJXSR-UHFFFAOYSA-N 386.471 2.804 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCC([C@@H](O)c2ccccn2)CC1 1506418459 TVZOAPWFDWMKGH-HXUWFJFHSA-N 390.505 2.841 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(S(=O)(=O)c3ccc(-c4n[nH]c(C)c4C)o3)C[C@@H]21 1704335338 DLIWSPLORLXFCG-ZRGWGRIASA-N 393.509 2.848 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)N1C[C@H]3[C@H]4CC[C@H](N4)[C@H]3C1)C2 1775981900 KDXIPUPOSFEAHU-ARKGTOAJSA-N 398.532 2.729 0 50 GFAA CN1CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC12CCOCC2 1775983693 RLUOMQBKPWBRIL-UHFFFAOYSA-N 377.492 2.693 0 50 GFAA CCC(=O)N1C[C@@H]2OC(=O)N(C3CCN(Cc4ccc(CC)cc4)CC3)[C@@H]2C1 1775994749 APYSTZVWABOARU-UXHICEINSA-N 385.508 2.655 0 50 GFAA Cc1cc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3n[nH]c4c3CCC4)C2)ccc1F 1857697936 BMAZSTFYNMLATH-HUUCEWRRSA-N 384.455 2.817 0 50 GFAA COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CC[C@H](c2ccccc2)N1 1857727471 SVUYZJKURSDDTA-NRSPTQNISA-N 391.471 2.862 0 50 GFAA O=S(=O)(N[C@@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1ccc(Cl)cc1Cl 1857727788 ZTKRTILPNGTXST-VNHYZAJKSA-N 391.320 2.523 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(Cc3cc4ccccc4n(C)c3=O)C1)CC2 1857729265 CDZMRKAUTLDIMQ-HSZRJFAPSA-N 390.487 2.823 0 50 GFAA Cc1c(C(=O)N[C@]2(CO)CCC(C)(C)C2)nnn1-c1cccc2cnccc12 1875278454 AKBWOMRXRFDJQG-OAQYLSRUSA-N 379.464 2.795 0 50 GFAA CC(=O)N(CC(=O)O)[C@@H]1CCCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1 1875279356 USQJJGSTWZIBOE-OAHLLOKOSA-N 381.860 2.968 0 50 GFAA CCOC(=O)[C@@H]1C[C@H]2C[C@@H]1C[C@H]2NC(=O)[C@@H](N)c1ccccc1C(F)(F)F 1875292915 WPOPSKGMYVBYCR-GUEXDDAASA-N 384.398 2.799 0 50 GFAA Cn1cccc1C(=O)N1CCC2(CCc3c(O)nc(-c4cccnc4)nc32)CC1 1940197226 AOLQICLZJJYFTJ-UHFFFAOYSA-N 389.459 2.703 0 50 GFAA O=C(O)c1cccc(CN2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)c1 2356152034 NMYCUJDOBOFMBL-WOIUINJBSA-N 386.492 2.645 0 50 GFAA COc1ccc(Br)cc1C(=O)NC(=S)Nc1ncccc1O 1153432 VSLWMEOWMUEBLF-UHFFFAOYSA-N 382.239 2.685 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(S(=O)(=O)c3cn(C)cn3)C2)[C@@H]2CCCCN12 2356157775 QGGUXMGBPVFIOA-XWSJACJDSA-N 394.585 2.720 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCC[C@@]3(CN(C)C(=O)O3)C2)cc1 2356160592 ZGNRWXFACWTWQR-OAQYLSRUSA-N 381.432 2.814 0 50 GFAA O=C(CCCn1cccn1)N1CCC[C@]12CCCN(CCc1ccccc1)C2=O 2356165492 BLHYAPYVBRMTSV-QHCPKHFHSA-N 394.519 2.890 0 50 GFAA CN(C)c1ccc(-c2ccnc(N3CCC([C@@H](O)c4nccn4C)CC3)n2)cc1 2356167720 ZPNXIRBXJRQVLW-HXUWFJFHSA-N 392.507 2.893 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCN1CCOCC1)c1ccc(Cl)cc1 20725496 DHOWDIJYGJDPNC-UHFFFAOYSA-N 387.867 2.654 0 50 GFAA O=C1N[C@@](Cc2ccccc2)(C2CCNCC2)C(=O)N1C1Cc2ccccc2C1 67974867 ORGKEMRVBRQWFR-DEOSSOPVSA-N 389.499 2.687 0 50 GFAA O=C(c1ccccc1O)N1CCN(C(=O)c2ccccc2OC2CCC2)CC1 118493582 AVAGEFBAADYAKC-UHFFFAOYSA-N 380.444 2.922 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)[C@@H]2CCOC2)n1CCCc1ccccc1 23366693 AGVCKKMTFLAOHC-GOSISDBHSA-N 391.537 2.530 0 50 GFAA O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C1CCN(C(=O)c2ccccc2)CC1 172815193 JCKRIGKOSMWAFE-UHFFFAOYSA-N 393.365 2.885 0 50 GFAA CC[C@H]1CN(C)c2ccccc2CN1C(=O)NC1CCN(c2ncccn2)CC1 153954316 HDUXIHDXPVNWOG-IBGZPJMESA-N 394.523 2.886 0 50 GFAA CCOC(=O)[C@H]1CCCN(Cc2cn(C)nc2-c2ccc3c(c2)OCCO3)C1 12713997 LVAHDOZFNVPGEY-INIZCTEOSA-N 385.464 2.633 0 50 GFAA CC[C@H]1CN(C(=O)c2c(C)cc(C)n(C)c2=O)CCC(=O)N1Cc1ccccc1 71661340 KKAWTTRECCSUNY-IBGZPJMESA-N 395.503 2.655 0 50 GFAA CNC(=O)CNc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)cn1 72428330 MGBGAGOBRQUPIB-UHFFFAOYSA-N 377.326 2.975 0 50 GFAA O=C(N[C@@H]1CCc2nnnn2CC1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 333675211 DGQFALCKYJYWCP-QAPCUYQASA-N 379.468 2.796 0 50 GFAA C[C@H](NC(=O)c1cc(C(=O)O)nn1-c1ccccc1)[C@@H]1COc2ccccc21 237581830 WRZUACKPQQCZIU-BBRMVZONSA-N 377.400 2.865 0 50 GFAA Cc1ccccc1[C@@H](CC(=O)O)NC(=O)Cc1ccc(N2CCCC2=O)cc1 237593386 WZYZZZQNNWWWMS-LJQANCHMSA-N 380.444 2.997 0 50 GFAA Cc1cc(CCNC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)on1 376487534 MBMZNXOLLDWSAQ-CYBMUJFWSA-N 382.386 2.972 0 50 GFAA CCn1ccnc1CN1CCC[C@H](CNC(=O)c2cccc(OC)c2OC)C1 76989319 HFBZLJJOZLAUQS-MRXNPFEDSA-N 386.496 2.562 0 50 GFAA O=C(Cn1c(Cc2ccccc2)nn(-c2ccc(Cl)cc2)c1=O)N1CCCC1 77537115 MKZVTDZZVHYLLL-UHFFFAOYSA-N 396.878 2.901 0 50 GFAA COC(=O)[C@@]1(C)CCN(C(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1 177222666 OQTTVGHZPIYGHE-NRFANRHFSA-N 396.422 2.827 0 50 GFAA NC(=O)c1ccc(CNC(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1 290857101 DMZCYUXOMYZEHL-FQEVSTJZSA-N 394.519 2.887 0 50 GFAA O=C([C@@H](O)c1ccc(Cl)cc1)N1CCC2(CC1)Nc1ccccc1NC2=O 82092655 ZPSNSDOMEYWRDE-KRWDZBQOSA-N 385.851 2.799 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NCc2cc(F)ccc2F)CN1C/C=C/c1ccccc1 20914262 PDCUHYAJTAXZCQ-LAMSDQTKSA-N 385.458 2.957 0 50 GFAA CC(C)Cc1noc(CN(C)C(=O)Nc2cc(F)cc3c2NC(=O)CC3)n1 96133583 BRSSPBVIGWQRNY-UHFFFAOYSA-N 375.404 2.956 0 50 GFAA Cc1ccc2cc(CN3C[C@H]4CC[C@@H]3CN(c3cnccn3)C4)c(=O)[nH]c2c1 91998088 CZJBFQGKZLWVJG-VQIMIIECSA-N 375.476 2.727 0 50 GFAA O=C(c1ccccc1Cl)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95521229 IQMLWTCRXSEORB-UHFFFAOYSA-N 398.894 2.989 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)N[C@H]4CCN(C)C4)cc3o2)cc1OC 95526694 MSKXULFTVLEWFK-INIZCTEOSA-N 395.459 2.870 0 50 GFAA Cc1nc[nH]c1CN1C[C@@H]2CC[C@H](C1)N(Cc1nc(-c3ccccc3)no1)C2 91974361 XJJBHSNOVWKRAT-FUHWJXTLSA-N 378.480 2.865 0 50 GFAA Cc1cc(C(F)(F)F)nc(CNC(=O)c2cccc(Cn3cccn3)c2)n1 91873000 CSCCWQOPKAYMLG-UHFFFAOYSA-N 375.354 2.979 0 50 GFAA Cc1cc(N2CCC(NCCCc3cccnc3)CC2)nc(N2CCCC2)n1 95497926 OQDURNFYFCYMCY-UHFFFAOYSA-N 380.540 2.971 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@H](c3ccc(F)cc3)N(C)C)CC2)CC1=O 95357552 ZLCLOEURRHBJTB-FQEVSTJZSA-N 389.515 2.926 0 50 GFAA CC(=O)c1c(COc2ccc(CCC(=O)O)cc2)n(O)c2ccccc2[n+]1=O 526055744 ISYNKZGZZZRILR-UHFFFAOYSA-O 383.380 2.592 0 50 GFAA Cc1nc(C)c(CCNS(=O)(=O)c2cc(C)c(Cl)c(C(=O)O)c2)s1 185017025 KUVGVHYTJZDDIJ-UHFFFAOYSA-N 388.898 2.941 0 50 GFAA O=C(O)[C@@H](c1c[nH]c2cc(F)ccc12)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 263586027 PBEOQKTUWUYVGP-VFGMZZLHSA-N 381.407 2.714 0 50 GFAA biogenic COc1ccc(C(=O)N2CCN(c3nccn4nc5c(c34)CCCC5)CC2)cc1 263616814 KRNGIEULCBEWPD-UHFFFAOYSA-N 391.475 2.579 0 50 GFAA COc1ccc(CN2CCC3(CC2)CN(C[C@@H]2CCCCO2)CCO3)cc1O 824733232 WXMYTBZFYNROOV-IBGZPJMESA-N 390.524 2.637 0 50 GFAA C[C@@H](OCc1ccc(F)cc1)C(=O)N1CC2(CCSCC2)C[C@@H]1C(=O)O 1875305936 NDNHNRHYDKCPTO-CZUORRHYSA-N 381.469 2.930 0 50 GFAA Cc1cnc(CNCC2CCN(C(=O)c3cnn(CC(C)C)c3C)CC2)cn1 1875326454 CGYBJZVGSPGHJA-UHFFFAOYSA-N 384.528 2.588 0 50 GFAA COc1cccc([C@H]2CCN(S(=O)(=O)N(C)Cc3ccccc3)C2)c1OC 952972491 VWECHAVSAMRLKT-KRWDZBQOSA-N 390.505 2.870 0 50 GFAA CC(C)c1noc(C2CCN(S(=O)(=O)N(C)Cc3ccccc3)CC2)n1 952962519 CETRKYSEHSRXNY-UHFFFAOYSA-N 378.498 2.749 0 50 GFAA COc1ccc([C@H]2CN(CCn3c(=O)oc4ccccc43)C[C@@H]2N(C)C)cc1 1565509631 OJXLHUBFRQFOCW-QUCCMNQESA-N 381.476 2.633 0 50 GFAA CN(C)CCOc1cccc(-c2noc([C@@H]3CCCN(C(=O)C4CC4)C3)n2)c1 273861854 MERNRZJCXCGMIO-QGZVFWFLSA-N 384.480 2.793 0 50 GFAA CS(=O)(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc(F)c(Cl)c1 169964806 JRWHDHTWKGKFMJ-INIZCTEOSA-N 382.844 2.804 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@H]1CCCC[C@@H]1CO 170590993 GBYQFLLILXWCIC-OCCSQVGLSA-N 380.901 2.555 0 50 GFAA O=S(=O)(Nc1ccc2c(c1)CN(CC(F)F)C2)c1ccc2c(c1)OCCO2 280979006 NDBGDYXWSNVZNO-UHFFFAOYSA-N 396.415 2.839 0 50 GFAA O=C(CN1CCN(C(=O)c2ccc(F)cc2Cl)CC1)NCC1CCCCC1 109638120 MRCDQBLMJURIKP-UHFFFAOYSA-N 395.906 2.933 0 50 GFAA COCCOCc1cc(C(=O)Nc2ccc(NC(=O)COC)cc2)ccc1F 741896926 FSZNUDXSWMKUKM-UHFFFAOYSA-N 390.411 2.826 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(C)c(C)cc2OC)C1 1260764885 SJIGKFGCOWGIDA-MRXNPFEDSA-N 382.526 2.581 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N[C@@H]1COC[C@H]1Cc1ccncc1 1529159067 NDMHUWHUXFPTAR-IEBWSBKVSA-N 376.460 2.683 0 50 GFAA Cc1cc(C[C@H]2CN(C(=O)Cc3csc(-c4ccccc4)n3)C[C@@H]2O)on1 1615737282 RKWIVRVGPITTLC-YJBOKZPZSA-N 383.473 2.711 0 50 GFAA O=C(NCCCc1ccccn1)c1ccc(N2CCN(C3CCCC3)CC2)nc1 11668238 NPIFQUYSUZNSMG-UHFFFAOYSA-N 393.535 2.904 0 50 GFAA CN(C[C@H]1COc2ccccc2O1)C(=O)c1cn(CCCc2ccccc2)nn1 11720029 JAHIQHOUAXOSLK-SFHVURJKSA-N 392.459 2.823 0 50 GFAA O=C(CSc1ccncc1)NC[C@H]1Cc2cccc(-c3cnccn3)c2O1 12080293 VJXSLJMDACWXQF-OAHLLOKOSA-N 378.457 2.751 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(C(=O)Nc3ccc(C)cc3)CC2)cc1 13324059 LHCGBRTZANAJJH-UHFFFAOYSA-N 389.477 2.542 0 50 GFAA CC[C@@H](C)CN1CCC2(CC1)C(=O)N(CCOC)C(=O)N2Cc1ccccc1 14532129 YCIICRYCFCYZFR-GOSISDBHSA-N 387.524 2.978 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)c1cnn(-c2ccccn2)c1C 14980609 RPFGQSNDGWUFRY-AWEZNQCLSA-N 386.477 2.932 0 50 GFAA COc1ccc(CN2CN=C(Nc3nc(C)c4cccc(OC)c4n3)NC2)cc1 19332230 OOPHTWDONKMOJW-UHFFFAOYSA-N 392.463 2.744 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3cccc(Cn4nc(C)cc4C)c3)CCN12 1857723908 BWKZLRFGBFEPAK-FCHUYYIVSA-N 396.535 2.874 0 50 GFAA Cc1cc(F)ccc1S(=O)(=O)N1CCO[C@@H](CN(C)C)[C@@H]1c1ccccc1 1857733956 HPCYHYVKSMHANT-ICSRJNTNSA-N 392.496 2.827 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)c2cc(Cl)c(OC)c(Cl)c2)C[C@H]1O 1857736964 XQZZHDYSLJQXEC-RHSMWYFYSA-N 376.280 2.988 0 50 GFAA O=S(=O)(N[C@H]1C[C@H]2CO[C@H](C3CC3)CN2C1)c1ccc(Cl)c(Cl)c1 1857737229 CDOMFZAZQIDNOY-MKBNYLNASA-N 391.320 2.523 0 50 GFAA COc1ccc(CCN2C(=O)O[C@H]3CN(C4Cc5ccccc5C4)C[C@H]32)cc1 206263390 IIONFXJPLUNHSM-YADHBBJMSA-N 378.472 2.910 0 50 GFAA C[C@@H](C(=O)NC1CCCC1)N1CCN(Cc2nnc(-c3ccccc3)s2)CC1 155182974 RYLBFOVFOKMRTL-INIZCTEOSA-N 399.564 2.770 0 50 GFAA C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NCCC[C@H]1CC1(Cl)Cl 846590787 WYOKOGOEOLYMRL-QWRGUYRKSA-N 397.299 2.583 0 50 GFAA CNC[C@H]1CCCN(C(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)C1 911633555 HNYAFNWQHFTKGY-DYESRHJHSA-N 377.488 2.842 0 50 GFAA CC(C)[C@@H]1CC(=O)c2nc(NC(=O)c3ccc4c(c3)N(C)C(=O)CO4)oc2C1 2100545359 QSGWIHMKQDXCMH-GFCCVEGCSA-N 383.404 2.683 0 50 GFAA O=C(Cc1cn2cc(Cl)cc(Cl)c2n1)N1CC[C@H](O)C(F)(F)CC1 2325770109 DJPNWWKZRXYKHV-LBPRGKRZSA-N 378.206 2.802 0 50 GFAA Cc1ncc(Cc2noc([C@H]3CCCN(S(=O)(=O)c4ccccc4)C3)n2)o1 2325850010 JDZHZCGXOCNMFW-AWEZNQCLSA-N 388.449 2.525 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1 840132 MZBKKWHPNNXOFV-UHFFFAOYSA-N 390.461 2.576 0 50 GFAA COCCNC(=O)[C@H](NC(=O)c1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2 5043526 NXERNWOMUZMEJX-NAVXVDNBSA-N 388.483 2.903 0 50 GFAA CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)c1cn(CCCc2ccccc2)nn1 11820046 PUGHILRAMBUGBZ-LJQANCHMSA-N 380.496 2.952 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccc(O)nc4)C3)C2)c1 12703458 WEMNIGDXQPCPES-JOCHJYFZSA-N 381.476 2.924 0 50 GFAA O=C(c1nc2ccccn2c1CNCCc1cccc(Cl)c1)N1CCOCC1 19637452 MWMXUEFAWKYBIC-UHFFFAOYSA-N 398.894 2.792 0 50 GFAA CN(CCc1ccccc1)C(=O)c1nc2sccn2c1CN[C@H]1CCOC1 20136770 HNJWANYCJATMBX-INIZCTEOSA-N 384.505 2.589 0 50 GFAA O=C(NCCc1nnc2n1CCN(Cc1ccccc1Cl)CC2)c1ccoc1 20205240 WVCCEZFXBBDDMJ-UHFFFAOYSA-N 399.882 2.555 0 50 GFAA COCCn1c(CN(C)[C@@H](C)c2ccon2)cnc1S(=O)(=O)CCC(C)C 20453466 DTWFGJNPNKNUOR-HNNXBMFYSA-N 398.529 2.530 0 50 GFAA CCc1nn2c(nnc3c(=O)n(CCC(=O)O)ccc32)c1-c1ccc(Cl)cc1 40395922 IITVHIRENRZCIS-UHFFFAOYSA-N 397.822 2.797 0 50 GFAA CCc1c(C)nn(C)c1NC(=O)c1ccc(CN2CCN3CCC[C@@H]3C2)cc1 65506262 GNZABDXONNKWTF-LJQANCHMSA-N 381.524 2.823 0 50 GFAA O=C(c1cc(CN2CCOCC2)on1)N1CCC2(C=Cc3ccccc32)CC1 67434109 NTSAPLILCYYDTF-UHFFFAOYSA-N 379.460 2.708 0 50 GFAA Cc1cc(CNC(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)n[nH]1 71736232 DUZYOZJOJHCFSL-HSZRJFAPSA-N 388.471 2.882 0 50 GFAA CN1C(=O)[C@](CC(=O)NCCn2ccnc2)(Cc2ccccc2)c2ccccc21 71752711 LMNMNVKWJIHRPN-QHCPKHFHSA-N 388.471 2.547 0 50 GFAA CCCc1cnc(C)nc1N1CCC(N2CCC[C@@H](C(=O)NC3CC3)C2)CC1 71753725 UAUBWOUVYVSVIQ-GOSISDBHSA-N 385.556 2.697 0 50 GFAA O=C(Cc1nc(-c2cccnc2)n[nH]1)N[C@@H]1CCCN(C2CCCCCC2)C1 72153160 DKLFRIHCSRCTBE-QGZVFWFLSA-N 382.512 2.713 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@@H](NS(=O)(=O)N3CCCC3)C2)cc1 72165177 YRKBADLQZVGGPC-HXUWFJFHSA-N 379.570 2.780 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(c3nc(N)nc4[nH]ncc34)CC2)C1 91690798 FVAQNKBSSZJGSF-INIZCTEOSA-N 377.496 2.641 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1cnccn1 95502501 YCBKDCWQOVUFEG-LJQANCHMSA-N 382.508 2.902 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](CNC(=O)c2cc3ccccc3[nH]2)C1 95507062 NKUXEIWGUFFMJW-OAHLLOKOSA-N 392.459 2.854 0 50 GFAA CC[C@@H](C(=O)N1CCC(c2nccn2Cc2ccccn2)CC1)n1cccn1 95518673 FUMMHOIDTNMZPU-IBGZPJMESA-N 378.480 2.880 0 50 GFAA COCc1noc(CCNC(=O)Nc2cc(F)c(C(F)(F)F)c(F)c2)n1 96131350 VHZIPDIXYRKJRP-UHFFFAOYSA-N 380.273 2.877 0 50 GFAA Cc1ccc(C)c(CNc2ncc(C(C)(C)C(=O)O)c(N3CCOCC3)n2)c1 96142150 OJVCLYJHKWDADF-UHFFFAOYSA-N 384.480 2.904 0 50 GFAA COc1ccccc1-n1nc(CCc2ccccc2)nc1C[C@H]1CNCCO1 96152253 FVXHRCPODLETJA-SFHVURJKSA-N 378.476 2.592 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)c1ccc(Cl)cc1Cl 104327914 WGFHSIVDHDSQFC-LDLTYYASSA-N 377.227 2.691 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)C[C@@H]3CCOc4ccccc43)CC2)cc1 117595001 QBOQRXGSHNYEJK-SFHVURJKSA-N 394.471 2.936 0 50 GFAA O=C(C[C@@H]1CCOc2ccccc21)N1CCN(C(=O)c2ccc(O)cc2)CC1 117970632 CPBIPJRXPYINCD-KRWDZBQOSA-N 380.444 2.633 0 50 GFAA CC(C)(C)c1ncc(NC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)cn1 118812723 MUGRTBAMNCZMBA-GOSISDBHSA-N 383.496 2.657 0 50 GFAA COc1ccc([C@H](NC(=O)c2cnc3c(cnn3C)c2O)C(F)(F)F)cc1 119499818 UVAGLCBKHQCZLN-AWEZNQCLSA-N 380.326 2.716 0 50 GFAA CCOc1ccc(-c2noc(CCC(=O)N[C@H]3c4ccccc4C[C@H]3O)n2)cc1 154011726 LGPNABGXANWDHB-NQIIRXRSSA-N 393.443 2.842 0 50 GFAA COc1cc(C(=O)OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc(OC)c1C 170594562 VLHYHAACEPYYSA-OAHLLOKOSA-N 395.452 2.805 0 50 GFAA CC(C)COC(=O)N1CCC(C(=O)N[C@H](Cc2nnc[nH]2)c2ccccc2)CC1 170601783 LFGYTRRDRVIQCF-GOSISDBHSA-N 399.495 2.709 0 50 GFAA Cn1cc([C@@H](OC(=O)CN2C(=O)CCCc3ccccc32)C(F)(F)F)cn1 170626411 JQSBGSDUPDJERY-QGZVFWFLSA-N 381.354 2.936 0 50 GFAA CCc1nsc(N2CCCN(C(=O)N[C@H](c3nccs3)C3CC3)CC2)n1 175928618 GUFGWZSDNXOULU-AWEZNQCLSA-N 392.554 2.930 0 50 GFAA COC(=O)C[C@H](c1cc(F)c(F)c(F)c1)c1c(O)n2ccccc2nc1=O 205971062 OIGMVHDJTNTRMJ-SNVBAGLBSA-N 378.306 2.512 0 50 GFAA O=C(O)c1cccc(-c2nc3c([nH]2)CCN(C(=O)Cc2ccc(O)cc2)C3)c1 222293094 WYLWZLWANPCDON-UHFFFAOYSA-N 377.400 2.608 0 50 GFAA O=S(=O)(Nc1nnc2ccccn12)c1cc(Br)ccc1Cl 225549872 HNWLXRJRPDQTMG-UHFFFAOYSA-N 387.646 2.946 0 50 GFAA CCOc1ccc(OC[C@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)cc1 225835852 WWKCPAAOUHAXQF-OPAMFIHVSA-N 397.427 2.646 0 50 GFAA O=C(O)CN(C(=O)CCc1ncc(-c2ccccc2F)o1)C1CCOCC1 238098535 WPEWANVYUFGXQA-UHFFFAOYSA-N 376.384 2.506 0 50 GFAA COc1cc(OC)cc(N2CC[C@H](N(C)c3ccc(C(F)(F)F)nn3)C2=O)c1 271035051 DNWICFVBEWMPBO-AWEZNQCLSA-N 396.369 2.754 0 50 GFAA O=C(NCc1ncnn1-c1ccccc1)N1CCCN2c3ccccc3C[C@H]2C1 292704334 YKPSIRNBRCNIPH-IBGZPJMESA-N 388.475 2.614 0 50 GFAA CCS(=O)(=O)C[C@@H](C)N(C)C(=O)[C@H]1C[C@@]12CC(C)(C)Oc1ccccc12 328605431 NPHRZOKNKKOMMX-KKVAFCGZSA-N 379.522 2.787 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3ccn4ccnc4c3)CC2)cn1 328631587 KRYRAIRJIJVVMA-KRWDZBQOSA-N 378.480 2.902 0 50 GFAA Cc1ccccc1-c1noc(CCCC(=O)N2CCC[C@@]3(CN(C)C(=O)O3)C2)n1 426470879 OTHOJWWLWBSVJW-OAQYLSRUSA-N 398.463 2.811 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCc3nccn3C)csc2C1 426651376 RNVABFGDTHSXFB-UHFFFAOYSA-N 385.493 2.575 0 50 GFAA CN1CCC[C@H](CCNC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)C1 459244666 AWXQILBHGDPUOL-QGZVFWFLSA-N 378.948 2.899 0 50 GFAA Cc1ccc(-n2cccn2)cc1S(=O)(=O)NCc1n[nH]c2c1CCCCC2 670468905 IGFZBRYZBNUPGS-UHFFFAOYSA-N 385.493 2.651 0 50 GFAA Cc1cc(F)cc2c1CN(C[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)CC2 800472652 WZLNTINERUFMIV-FQEVSTJZSA-N 377.481 2.803 0 50 GFAA CN1CCC(n2nnc3c2C[C@H](c2nc(CCC(F)(F)F)no2)CC3)CC1 952894933 PPCXFALTTKSCSF-LLVKDONJSA-N 384.406 2.695 0 50 GFAA COc1c(F)ccc(C(=O)Nc2ccccc2N2C(=O)N[C@@H](C)C2=O)c1F 952980564 XHMZHUQYCFGQSD-VIFPVBQESA-N 375.331 2.670 0 50 GFAA O=C(NC[C@@H]1CCCN(c2nc3ccccc3s2)C1)c1cc2ncccn2n1 1506401046 ZMAYXQZPQACAMX-AWEZNQCLSA-N 392.488 2.985 0 50 GFAA CN(C)C[C@H]1[C@@H]2CN(C(=O)[C@H]3CCc4sc(-c5ccncc5)nc4C3)C[C@H]12 1772819823 UWESDNISXSCDRE-LUKYLMHMSA-N 382.533 2.576 0 50 GFAA O=C(c1ccc(C(F)(F)F)cc1C(F)(F)F)N1C[C@@H]2COC[C@]2(C(=O)O)C1 1775981371 LKSCFFGIGXSCID-YMTOWFKASA-N 397.271 2.897 0 50 GFAA COc1ccc(-c2ccc3c(O)nc(=O)n(Cc4ccccc4)c3n2)c(O)c1 1857526340 BMWUHRLRMRBJGU-UHFFFAOYSA-N 375.384 2.927 0 50 GFAA CC1(C(=O)N2C[C@@H](C(=O)O)C3(CCN(Cc4cccnc4)CC3)C2)CCCC1 1857706140 BELGMCZRQXMQBS-SFHVURJKSA-N 385.508 2.787 0 50 GFAA C[C@@H]1CN2C[C@@H](NC(=O)c3ccccc3OC(F)(F)C(F)F)C[C@H]2CO1 1857710392 VBVUUORJMGJTII-WOPDTQHZSA-N 376.350 2.515 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857720539 YQWVSBMKDYUMKA-FPOVZHCZSA-N 380.492 2.772 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N[C@H](C)c1ccc2c(c1)OCCO2 1857737601 UNSHAEYXBGMVMI-GFCCVEGCSA-N 389.477 2.550 0 50 GFAA O=C(CCc1cccnc1)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1875247273 IKSBECKURKRBLD-UHFFFAOYSA-N 378.476 2.894 0 50 GFAA O=C(CC(F)(F)F)N[C@H]1CCN(C(=O)c2cc(O)cc(C(F)(F)F)c2)C1 1875268301 PGGDWCFPEMFIEF-JTQLQIEISA-N 384.276 2.694 0 50 GFAA O=C(NCc1nc(C(F)(F)F)n2c1CCCC2)N1CC[C@@H](CO)CC12CC2 1875301289 JETFDMHJGXMXKB-GFCCVEGCSA-N 386.418 2.685 0 50 GFAA COC(=O)c1cc(C2CCN(C(=O)c3cc4ccc(F)cc4cn3)CC2)[nH]n1 1875324792 BIOHUBMMPYJFMN-UHFFFAOYSA-N 382.395 2.903 0 50 GFAA CC(C)NC(=O)NCCN1CC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1 1875327221 PKVYGIQNHFCAKI-OAHLLOKOSA-N 387.311 2.505 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N2CCC(C(F)(F)F)CC2)OCC(=O)N1C 1940195782 MHWOUZWOIOJOQF-SJORKVTESA-N 384.398 2.694 0 50 GFAA CCCOc1cc(Cl)c(CN2CCO[C@H](c3nnn(C)n3)C2)cc1OCC 2100473609 LFARKWGLWJHKTB-KRWDZBQOSA-N 395.891 2.625 0 50 GFAA O=C(NCCc1nc(-c2ccc3c(O)ncnc3c2)no1)c1ccc(F)cc1F 2325736401 BLZKEELWVWCDBJ-UHFFFAOYSA-N 397.341 2.636 0 50 GFAA CN(Cc1cc(Br)ccc1Cl)C(=O)[C@H]1NCCc2nn(C)cc21 2325795684 SXRMGXUKVPWOKB-HNNXBMFYSA-N 397.704 2.681 0 50 GFAA O=C(NCc1ccc(CN2CCc3ccccc32)cc1)c1onc2c1CNCC2 2325859545 AIPHRFQYZHDEIG-UHFFFAOYSA-N 388.471 2.813 0 50 GFAA O=C(c1ccn2ncnc2c1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356157986 UZLMZOUMNRSQSW-JOCHJYFZSA-N 389.459 2.527 0 50 GFAA COC(=O)Cc1c(C)c2ccc(OCC(=O)Nc3ccc(F)cc3)cc2oc1=O 1115101 KBHPXMAJTLZLJH-UHFFFAOYSA-N 399.374 2.974 0 50 GFAA COc1ccc(CNC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1 1173054 XHWPJBMIHRZYTQ-UHFFFAOYSA-N 390.505 2.901 0 50 GFAA CCOc1ccc(N(CC(=O)Nc2c(F)cccc2F)S(C)(=O)=O)cc1 2853879 QAEYYAIUNTWYMJ-UHFFFAOYSA-N 384.404 2.768 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2OCC)CC1 6701596 ZTSNCDXGLHSGJH-UHFFFAOYSA-N 375.874 2.703 0 50 GFAA COc1cc(C)ccc1OCc1cc(C(=O)NCCc2nc(C)cc(C)n2)no1 11873640 WBSLNVQJZJYNLQ-UHFFFAOYSA-N 396.447 2.950 0 50 GFAA COc1ccc(-n2c(CNC(=O)c3ccc4c(c3)OCO4)nnc2SC)cc1 12080064 GJXNMIBECWSKPQ-UHFFFAOYSA-N 398.444 2.657 0 50 GFAA COc1ccccc1OCc1cc(C(=O)NCc2ccc3c(c2)OCO3)n[nH]1 12306926 ZGHVVTZXNHOQHU-UHFFFAOYSA-N 381.388 2.656 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)CCn2cccn2)CC1 12585544 XDAPSDLGENMSFR-UHFFFAOYSA-N 399.491 2.696 0 50 GFAA COC(=O)CCCC(=O)N[C@H]1CCCc2c1cnn2-c1ccc(F)cc1F 12725612 ZLQSSKLNUBNSDW-HNNXBMFYSA-N 377.391 2.987 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@]1(O)CNCc1cccc(F)c1 14951942 OILNJVWALFDHCU-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA O=C1C[C@H](N2CCN(c3ccccn3)CC2)C(=O)N1c1cccc2ccccc12 19720811 BGYIKDHEQDYLOZ-FQEVSTJZSA-N 386.455 2.689 0 50 GFAA CN(CCc1ccccn1)c1ncccc1CNC(=O)c1cnc2ccccn12 67878629 UDIFTPBAPBUJHM-UHFFFAOYSA-N 386.459 2.733 0 50 GFAA O=C(NCCc1ccco1)[C@@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71736192 HXRRIPPUOGGUJJ-HXUWFJFHSA-N 396.535 2.710 0 50 GFAA Cc1ccc(OC2(C(=O)N(C)Cc3n[nH]c4c3CCCC4)CCNCC2)cc1 77299400 DCSWNYZFCVSBIA-UHFFFAOYSA-N 382.508 2.757 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3ccc4c(=O)n(C)cnc4c3)CC2)cc1 77485752 AHBGBLKVMISNRR-UHFFFAOYSA-N 377.444 2.926 0 50 GFAA COCCN1CC2(CCC1=O)CCN(Cc1noc(-c3ccccc3)n1)CC2 91494592 DQCJYIBOWBJKHM-UHFFFAOYSA-N 384.480 2.588 0 50 GFAA CCOc1ccccc1CN1CCC[C@@H](c2nnc(Cn3ccnc3)n2C)C1 95370441 DWZAYABGMAZJHT-GOSISDBHSA-N 380.496 2.838 0 50 GFAA CN1CCN(C[C@@H]2CN(Cc3ccc4c(c3)Cc3ccccc3-4)C[C@@H]2CO)CC1 95371837 YLOIOPUSVMAOQC-DHIUTWEWSA-N 391.559 2.546 0 50 GFAA O=C(CN1CCC[C@H](c2ccccc2)C1)NCc1ccccc1-n1cncn1 95384847 FSBWEVBAFRIZKF-FQEVSTJZSA-N 375.476 2.763 0 50 GFAA O=C(c1cnn(-c2ccccc2)c1)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95392758 KXYAYWYMRYUXLI-LAUBAEHRSA-N 380.492 2.588 0 50 GFAA COc1cc(CN2CCCOCC2)ccc1OC[C@H](O)CN1CCCCCC1 95515155 TVIUTONYCYTJKX-HXUWFJFHSA-N 392.540 2.533 0 50 GFAA Cc1nc(N2CCC(NC[C@@H](O)c3ccc(O)cc3)CC2)c2ccsc2n1 96132280 QNGDGVWZBXHNFF-GOSISDBHSA-N 384.505 2.997 0 50 GFAA Cc1nc(CCNC(=O)Nc2ccc3c(c2)OC(F)(F)O3)nc2c1CCC2 96163200 CQDBSZAKHBAPNK-UHFFFAOYSA-N 376.363 2.959 0 50 GFAA Cc1ccc(F)c(NC(=O)N2CCc3nnc(Cc4cccnc4)n3CC2)c1 96165209 SWARLEVTMYTCBQ-UHFFFAOYSA-N 380.427 2.802 0 50 GFAA CCn1nc(C)c(CN2CCC(c3nnc(CN4CCCC4)n3C)CC2)c1C 96180627 VZXLCXRUPSUWBG-UHFFFAOYSA-N 385.560 2.624 0 50 GFAA O=C1C[C@H](N2CCN(c3cccc(Cl)c3)CC2)C(=O)N1CCc1ccccc1 100052958 ZFELRYDVEYVUHF-FQEVSTJZSA-N 397.906 2.832 0 50 GFAA O=C(Cc1noc(CCCn2nnc(-c3ccccc3)n2)n1)Nc1ccccc1 109545291 XVDQLUJDYUZISS-UHFFFAOYSA-N 389.419 2.537 0 50 GFAA Cn1c(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)nc2ccccc2c1=O 119853078 XJUGGHIQBSNPHL-UHFFFAOYSA-N 396.878 2.545 0 50 GFAA Cc1cc(Br)c(S(=O)(=O)n2cccn2)cc1Br 170615116 ZHGMQVDGCNSHJP-UHFFFAOYSA-N 380.061 2.954 0 50 GFAA Cc1c(Br)c2ccccc2n1CC(=O)NS(=O)(=O)CCCF 170649656 YAPHLRYTYLKXLL-UHFFFAOYSA-N 391.262 2.518 0 50 GFAA O=CNc1ccc(C(=O)N2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1 174245126 AVTZGFLHRLPQRW-UHFFFAOYSA-N 385.851 2.897 0 50 GFAA O=C(c1ccc(COc2ccc(F)cc2)o1)N1CCN(C[C@@H]2CCOC2)CC1 178113210 NIJVVGBUTCBTCR-INIZCTEOSA-N 388.439 2.792 0 50 GFAA CCc1nc(CN2CCN([C@H](C)c3nc(-c4ccc(C)cc4)no3)CC2)n[nH]1 185184468 UTZWZVFQDGOPJC-OAHLLOKOSA-N 381.484 2.604 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN1C(=O)c1cc2ccc(OC(F)(F)F)cc2[nH]1 194537396 KNJRJMAJHRNGLQ-HNNXBMFYSA-N 381.354 2.950 0 50 GFAA C[C@H]1CCO[C@H]1C(=O)N[C@@H]1CC(C)(C)C[C@](C)(CNC(=O)[C@H]2OCC[C@H]2C)C1 241644386 PQHRHACFUFRSPA-RZTQSGEPSA-N 394.556 2.654 0 50 GFAA O=C(Nc1nc2ccccc2s1)N(CC(F)F)C1CCS(=O)(=O)CC1 253431657 SQBJWNWCPZXOQO-UHFFFAOYSA-N 389.449 2.973 0 50 GFAA COC(=O)c1cn([C@@H]2CCCc3c2[nH]c2ccc(OC)cc32)cc2c(=O)[nH]nc1-2 263588126 PIFASBOYYLOYRB-QGZVFWFLSA-N 392.415 2.878 0 50 GFAA NC(=O)N1CCCN(C(=O)CCSc2ccccc2Br)CC1 264225339 VISFLMGWORMXSQ-UHFFFAOYSA-N 386.315 2.544 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OCc4ccccc4)cc3)C(=O)[C@H]2C1 278227462 YDVWABZWCCVOEK-QFBILLFUSA-N 394.427 2.986 0 50 GFAA O=C(NCCc1c[nH]c2cc(F)ccc12)[C@H]1CCS(=O)(=O)c2ccccc21 284613087 INUQQUIVDCDBRQ-KRWDZBQOSA-N 386.448 2.927 0 50 GFAA Cn1cc2c(n1)CCC[C@@H]2C(=O)N1CCC[C@H](c2nnc3n2CCCCC3)C1 329817101 FFKVFWPUVUCSMC-HOTGVXAUSA-N 382.512 2.564 0 50 GFAA C[C@@H](NC(=O)CC(C)(C)C)C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 363781708 QLSLQEHBFFZZSD-KGLIPLIRSA-N 381.467 2.848 0 50 GFAA Nc1cnc(-c2cccc(C(=O)N3CCC([C@@H](O)c4ccccn4)CC3)c2)cn1 426615018 CQLHWHDLQDISMT-OAQYLSRUSA-N 389.459 2.707 0 50 GFAA CCCNC(=O)c1cccc(C(=O)N2CCC[C@@H]2c2nc(C(=O)O)cs2)c1 910116486 ZATKUDVILXGXOC-OAHLLOKOSA-N 387.461 2.958 0 50 GFAA CCN(C(=O)[C@H](C)OC(=O)c1cc(Cl)ccc1-n1cnnn1)c1ccccc1 915245073 ISQAMBNBOABHPV-ZDUSSCGKSA-N 399.838 2.914 0 50 GFAA O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)c1cncc2nc(C(F)(F)F)[nH]c12 1448794088 WFPCIFGNEUVPBR-QMMMGPOBSA-N 380.330 2.846 0 50 GFAA Cc1nc(C(=O)N2CCCN(C(=O)c3cc(O)nc4ccccc34)CC2)cs1 1506413280 IYLWJCWFNIWXNQ-UHFFFAOYSA-N 396.472 2.694 0 50 GFAA C[C@H](CN1CCCC1)CN(C)S(=O)(=O)c1cc(C(=O)O)c(Cl)cc1F 1506418045 NNKKJPQRSMTLFI-NSHDSACASA-N 392.880 2.530 0 50 GFAA Cc1noc(-c2ccc(N3CC[C@H](c4ccc5c(c4)OCO5)[C@@H](O)C3)nc2)n1 1565507764 KOECQAHWPULYDQ-CVEARBPZSA-N 380.404 2.524 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@@](C)(O)C2)ccc1F 1704327300 BWWZBZJYBYRSPX-LJQANCHMSA-N 377.416 2.542 0 50 GFAA CCc1nc(C)c(C(=O)N2CCC3(CC2)CN(C(=O)CC(C)(C)C)CCO3)o1 1775989897 ACBODNHXZUOYTN-UHFFFAOYSA-N 391.512 2.815 0 50 GFAA C[C@@H]1[C@H](C(=O)N2CCC3(CC2)C[C@@H](C)N(C(=O)/C=C/c2ccco2)C3)CCN1C 1775996698 FAPMITWKNNAWNR-YLFWBSLLSA-N 399.535 2.863 0 50 GFAA CN1CCn2nc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2C1=O 1857670337 IMDBGCUWBPEQIH-CQSZACIVSA-N 381.461 2.556 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)Cc4ccc(C(F)(F)F)cc4)[C@@H]2CC(=O)N13 1857713799 OFONCHNHIBBASY-FCEWJHQRSA-N 396.409 2.832 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCc4cccnc4N)C3)nc2c1 1857727749 YTGJZYKVWNFJES-CQSZACIVSA-N 395.463 2.737 0 50 GFAA O=C([C@@H]1CCc2n[nH]cc2C1)N1CC(Oc2ccc(Br)cc2)C1 1875302243 GWCWYBVQKWUYCL-LLVKDONJSA-N 376.254 2.567 0 50 GFAA CN1CCc2nc3ccccc3c(C(=O)N[C@@H]3[C@H]4CC[C@@H]3C[C@H](CO)C4)c2C1 1875321616 OLNVQEKMGXTQEH-OFWUGVANSA-N 379.504 2.750 0 50 GFAA Cc1cccc(F)c1CN[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397512 COAZNTOZSLEXIH-MRXNPFEDSA-N 385.487 2.611 0 50 GFAA O=C(NCC12CC(CN1C(=O)C[C@@H]1C[C@H]1C1CC1)C2)c1occ2c1CCOC2 2325794023 OETSRKDMJWITFM-SNPGZUAJSA-N 384.476 2.509 0 50 GFAA C[C@H](Sc1nncn1C)c1cccc(NC(=O)c2ccn(CCN(C)C)n2)c1 2325800720 CQVVSOCWGLBWBU-AWEZNQCLSA-N 399.524 2.679 0 50 GFAA O=C(NCCN1CCN(c2ccccc2)CC1)c1conc1-c1ccccc1 2325842744 HDALTXHFJAMQLL-UHFFFAOYSA-N 376.460 2.894 0 50 GFAA C=CC(=O)Nc1ccc(O)c(C(=O)NCCCc2nc(-c3ccccc3)no2)c1 2325889028 TZPUVXOQVXPAEQ-UHFFFAOYSA-N 392.415 2.929 0 50 GFAA COc1cc(-c2cc(=NC(=O)c3cccc(C(C)=O)c3)[nH][nH]2)cc(OC)c1OC 2356138916 SSACQIGKAODZNK-UHFFFAOYSA-N 395.415 2.979 0 50 GFAA CCn1c(SCC(=O)Nc2cc(C)ccc2OC)nnc1-c1cnccn1 2522406 KFTDBWWRMJUVHK-UHFFFAOYSA-N 384.465 2.803 0 50 GFAA CCCOC(=O)c1c(NC(=O)c2nc3ncccn3n2)sc2c1CCCC2 2808416 ORKZDPDNLSFVBZ-UHFFFAOYSA-N 385.449 2.884 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CSc2nc(-c3ccncc3)n[nH]2)cc1 4271931 ASUAGIXEXGHGIC-UHFFFAOYSA-N 383.433 2.774 0 50 GFAA CCC(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 4814358 PYJXANVLEJLDQR-UHFFFAOYSA-N 381.432 2.760 0 50 GFAA COC(=O)Cc1cc(=O)nc(NC(=N)Nc2ccc(Oc3ccccc3)cc2)[nH]1 4990974 IILPLYAILHJBBS-UHFFFAOYSA-N 393.403 2.736 0 50 GFAA O=C(O)[C@@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 6726488 NXXBTQPXCGPQEY-SZUQWTIJSA-N 382.504 2.981 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1)NC1CCC1 11934662 UBORSXXJHYPCJJ-JOCHJYFZSA-N 391.515 2.678 0 50 GFAA Cc1cnc(C)c(-c2ccc3c(c2)C[C@@H](CNC(=O)Cn2nc(C)cc2C)O3)n1 11996049 QRIYVJNZTOMACL-IBGZPJMESA-N 391.475 2.694 0 50 GFAA CC(C)S(=O)(=O)N1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cccs2)C1 12184755 OHIVRAHOVGCJHO-NVXWUHKLSA-N 384.567 2.732 0 50 GFAA CCOC(=O)[C@@]1(Cc2cccc(OC)c2)CCCN(C(=O)c2cnsn2)C1 12437498 DFKPUFGCGAPRTI-LJQANCHMSA-N 389.477 2.575 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2)CCCN(C(=O)CN(CC)CC)C1 12594986 PBSOBYIWFMOLLO-OAQYLSRUSA-N 378.488 2.882 0 50 GFAA CCOCCCN[C@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14539230 BJRMZLCRAKDJIQ-SFHVURJKSA-N 384.524 2.566 0 50 GFAA Cc1noc(C)c1CC(=O)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 14949839 GFHWVBQLRHFLHU-GOSISDBHSA-N 377.444 2.904 0 50 GFAA CCOC(=O)CNC(=O)N1CCC[C@H](C(=O)c2ccc(C(F)(F)F)cc2)C1 14976874 KIHCHHUPRPMMKC-ZDUSSCGKSA-N 386.370 2.873 0 50 GFAA CCCN(CC1CC1)C(=O)c1cn(CC(C)C)cc(C(=O)NC(C)C)c1=O 14998494 RNIOUDNXIMDLBB-UHFFFAOYSA-N 375.513 2.905 0 50 GFAA CSc1ccccc1N1C(=O)C[C@@H](Nc2ccc(N3CCOCC3)cc2)C1=O 16293612 OJGVXXJLTOFANI-QGZVFWFLSA-N 397.500 2.989 0 50 GFAA CCCNC(=O)c1cc(S(=O)(=O)Nc2cccnc2Cl)ccc1OC 16648660 IALSQIDWWOJIRS-UHFFFAOYSA-N 383.857 2.684 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c(C(=O)OC)c1C 17080795 OZSUIVWESWOGIQ-MNOVXSKESA-N 395.433 2.625 0 50 GFAA CSc1n[nH]c(-n2ccc3c(cnc4c(-c5ccccc5)c(C)nn43)c2=O)n1 19818827 SXWNYOMWQAYHMV-UHFFFAOYSA-N 389.444 2.849 0 50 GFAA O=C(c1ccc(CN2CCOCC2)cc1)N1CCN(c2ccccc2F)CC1 19953509 DJTYPUCYZADKLH-UHFFFAOYSA-N 383.467 2.620 0 50 GFAA CCOC(=O)CN(C)c1ccc(-c2nc(-c3cccc(OC)c3OC)no2)cn1 20784812 MXGPBNLLPKIJSI-UHFFFAOYSA-N 398.419 2.815 0 50 GFAA CCn1cc(CN[C@@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)c(C)n1 55107969 YNXQMFOMGUMPJM-LJQANCHMSA-N 398.555 2.766 0 50 GFAA O=C(c1cc(-n2cnnn2)ccc1O)N1CCC[C@@H](CCc2ccccc2)C1 71775906 GMGQJQNHBZAODD-KRWDZBQOSA-N 377.448 2.853 0 50 GFAA CCCNC(=O)C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72153788 PBHPKGKJRNLERY-FQEVSTJZSA-N 381.476 2.696 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N2CC[C@H](c3ccccc3C(=O)O)C2)c1C 72161292 CYVSAZMRURCZBH-INIZCTEOSA-N 383.448 2.807 0 50 GFAA CC[C@H](O)C(=O)Nc1nn(-c2ccc(F)cc2)c2cccc(N3CCOCC3)c12 77520946 FGHHDJASLYFNFD-SFHVURJKSA-N 398.438 2.711 0 50 GFAA CN(CCC1(O)CCCC1)C(=O)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1 92028018 OYCQDBCZVRJSNB-QGZVFWFLSA-N 376.472 2.718 0 50 GFAA CCc1ncc(C(=O)N2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95358462 ZWXUDOUNLAACMD-KSEOMHKRSA-N 392.503 2.750 0 50 GFAA Cc1ncc(S(C)(=O)=O)c(N2CCC[C@H](C(=O)c3sccc3C)C2)n1 95372699 BHRLNCUVCWZFQD-ZDUSSCGKSA-N 379.507 2.658 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1S(=O)(=O)N1CCC[C@]2(CCOC2)C1 95375244 STIUIFVDIXNQHU-IBGZPJMESA-N 375.494 2.680 0 50 GFAA COc1ccc(Cl)cc1[C@H](C(=O)O)N1CCN(Cc2cccnc2)CC1 95387408 MINHAVXZFDAGOP-GOSISDBHSA-N 375.856 2.687 0 50 GFAA COc1ccccc1-n1nc(-c2ccncc2)nc1CCCN1CCCC1=O 96150503 NFNYWJUMIQOUOS-UHFFFAOYSA-N 377.448 2.893 0 50 GFAA O=C(NCC(=O)N(Cc1ccccc1)Cc1ccco1)c1ccc2c(c1)OCO2 120576702 QULCETMMCUZLFO-UHFFFAOYSA-N 392.411 2.967 0 50 GFAA O=C(CN1CCOCC12CCC2)NC[C@H](c1ccccc1Cl)N1CCCC1 178487929 RYRGGNCRESPGAW-LJQANCHMSA-N 391.943 2.848 0 50 GFAA CC1(C(=O)N2CCC(Cn3cncn3)CC2)CCN(Cc2ccccc2)CC1 189412414 XWMFBGGWFDQKAO-UHFFFAOYSA-N 381.524 2.819 0 50 GFAA COc1ccc(N2C[C@@H](CN3CCN(C(=O)OC(C)(C)C)CC3)OC2=O)cc1 221539978 UTXVGVTZQUIFHB-QGZVFWFLSA-N 391.468 2.573 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccc(Cl)cc2OC)C2CC(O)C2)cn1 222815873 RIZNRROAJNCORG-OOKWDQIISA-N 376.840 2.994 0 50 GFAA COc1cc(CNCC2(O)CCOCC2)ccc1OCc1c(C)noc1C 237133937 WDCTUPAACYGLRL-UHFFFAOYSA-N 376.453 2.510 0 50 GFAA Cc1c(C(=O)Nc2cccc(Oc3ccccn3)c2)nnn1C1CCNCC1 237795347 UXSKXBACWYMRIY-UHFFFAOYSA-N 378.436 2.951 0 50 GFAA O=C(N[C@H]1CC2(CCCC2)Oc2ccccc21)c1cn(C2CCNCC2)nn1 237900061 VQSXYOBZVUJBEZ-KRWDZBQOSA-N 381.480 2.769 0 50 GFAA C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)[C@H]2CSCN2C(=O)c2ccccc2)C1 241124127 JFUWFOXPLAYQLI-SFNKJDCFSA-N 389.565 2.684 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)nc1)N1C[C@@H](CO)[C@@H](c2ccsc2)C1 249192009 AJSIIEFHJDYLHN-WCQYABFASA-N 392.424 2.559 0 50 GFAA CC(C)(C)c1cc(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)O)CC3)cc2)[nH]n1 262476835 JYNSTZCPJBUTQZ-UHFFFAOYSA-N 398.463 2.896 0 50 GFAA COc1ccc(CN[C@@H]2CNC(=O)c3cc(-c4cccc(OC)c4)nn32)cc1 263616810 KRGFPYYQTJMBMM-FQEVSTJZSA-N 378.432 2.599 0 50 GFAA CN(C)C(=O)c1ccc(CNc2cccc(S(=O)(=O)N3CCCCC3)c2)[nH]1 278980530 PJVWPWWYOMZIJM-UHFFFAOYSA-N 390.509 2.503 0 50 GFAA C[C@@H]1CN(C(=O)Nc2ccnn2Cc2ccc(F)cc2)CC2(CCOCC2)O1 279536736 LLMHKDVEDVKABX-OAHLLOKOSA-N 388.443 2.872 0 50 GFAA O=C(N1CCOC[C@@H]1c1nc(-c2ccccc2)no1)C(F)(F)C1(O)CCCC1 285808931 DRLFGPAEOHWZDB-CQSZACIVSA-N 393.390 2.577 0 50 GFAA O=C(O)CCN(C(=O)/C=C/c1cc(Cl)c2c(c1)OCCO2)C1CCOCC1 328595383 SXLRLVVIHJQVLY-OWOJBTEDSA-N 395.839 2.607 0 50 GFAA COc1ccc(NC(=O)CCN2CCC3(CC2)C[C@@H]3C(=O)N(C)C2CC2)cc1 369508994 FXIRLCSPASUVKP-LJQANCHMSA-N 385.508 2.747 0 50 GFAA CC1CCC(N2CCC(N(C)C(=O)[C@@H]3CC34CCS(=O)(=O)CC4)CC2)CC1 375131295 LOKLJCUREHYFOS-KVZIAJEVSA-N 396.597 2.703 0 50 GFAA Cc1nc2n(n1)C[C@@H](NC(=O)NC[C@@H]1CCCCN(Cc3ccccc3)C1)CC2 378110778 LRRLDWMFVZWBKR-PMACEKPBSA-N 396.539 2.503 0 50 GFAA CC[C@@H]1CN(S(=O)(=O)c2cc(Cl)c(OC)cc2C)C[C@@]2(CCOC2)O1 408339772 MEDSJHMJGWRZHS-CXAGYDPISA-N 389.901 2.616 0 50 GFAA COc1ccc(NC(=O)N2CCCC[C@H]2CCN2CCN(C)CC2)c(F)c1 426433936 BZEIZCAJACTOJV-INIZCTEOSA-N 378.492 2.858 0 50 GFAA O=C(NCCc1cccs1)N(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 426595024 OVRKXOUUFSNKNV-MRXNPFEDSA-N 378.519 2.690 0 50 GFAA Cc1nnc(CN(C)C(=O)c2cccc(-c3ccc(N4CCCC4)nn3)c2)o1 534653069 VQQKKWOQOBVCNM-UHFFFAOYSA-N 378.436 2.707 0 50 GFAA O=C1C[C@H](C(=O)N2CCC(OCc3ccccc3)CC2)CN1Cc1cccnc1 827696458 MNXIZDGWLCHUHM-FQEVSTJZSA-N 393.487 2.638 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)c2nnc(O)c3ccccc23)cc1 952860522 PQQDAYUXSXTMCL-UHFFFAOYSA-N 375.388 2.664 0 50 GFAA CCCC[C@@H]1C(=O)N(C)CCN1S(=O)(=O)c1ccccc1C(F)(F)F 952978524 AKLILJVFFKWKPL-CYBMUJFWSA-N 378.416 2.727 0 50 GFAA Cc1cccc(CC(=O)N2CCCN(C(=O)c3n[nH]c4ccccc34)CC2)c1 1529158719 KFEKADMVUFBBEH-UHFFFAOYSA-N 376.460 2.789 0 50 GFAA COc1ccc([C@H]2CN(C(=O)Cc3ccc(F)c(C)c3)C[C@@H]2NC(C)=O)cc1 1565506010 XOFADDLWOPAHKN-CTNGQTDRSA-N 384.451 2.816 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1cnccn1)C2 1565516125 DFHURDOHOXTXFH-CVEARBPZSA-N 382.464 2.878 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)COCC(F)(F)C(F)F)C[C@@H]2N(C)C)cc1 1565528318 AQHIARQYESVNLU-CABCVRRESA-N 376.394 2.768 0 50 GFAA COc1ccccc1S(=O)(=O)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857678978 OQNQSYCVYGBBOJ-WMQCIHAUSA-N 387.501 2.842 0 50 GFAA CCc1ccc(CN2CCC3(CC2)CN(C(=O)C2CCCC2)C[C@H]3C(=O)O)nc1 1857690354 IDERNURPRUEPBO-FQEVSTJZSA-N 399.535 2.959 0 50 GFAA Cn1cc(CCn2ccnc2-c2ccccc2OCCCN2CCOCC2)cn1 1857698002 CZEVXPYFQFDMFB-UHFFFAOYSA-N 395.507 2.627 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2[C@H]3CN(C(=O)c4ccco4)C[C@]34CC[C@H]2O4)cc1 1857720870 OVDCSVNYEARTTE-KCXPTXFHSA-N 380.444 2.638 0 50 GFAA O=C(CCc1ccncc1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857730626 XSEWKRXAKIFMOX-JOCHJYFZSA-N 378.476 2.894 0 50 GFAA O=C(CC1CC(=O)NC(=O)C1)NCc1ccc(CN2CCCCCCC2)cc1 2325779587 QUZGPGSINRCQLQ-UHFFFAOYSA-N 385.508 2.512 0 50 GFAA CCOc1ccc(/C=C/C(=O)N[C@@H]2C[C@H](Cn3ccnc3)C[C@H]2O)cc1OCC 2325786051 ZHZTUPRHVNJUCV-SAHZGGGTSA-N 399.491 2.650 0 50 GFAA Cc1nc(N2CCN(C)CC2)ccc1NC(=O)c1ccn(-c2ccccc2F)n1 2325786679 PSDBHDZXVWHTMW-UHFFFAOYSA-N 394.454 2.719 0 50 GFAA CN1CCc2sc(-c3cnn4c3CN(C(=O)OC(C)(C)C)CC4)cc2C1=O 2325792007 SLFKZQYHVFXOGY-UHFFFAOYSA-N 388.493 2.990 0 50 GFAA O=C(NC[C@H]1CCN1Cc1ccccc1)C(=O)Nc1cnc2ccc(F)cc2c1 2325857772 OHKZXCWIQZAJLA-LJQANCHMSA-N 392.434 2.703 0 50 GFAA CC(C)[C@@H](O)c1cn(-c2cccc(CNC(=O)c3ccc4c(c3)CCO4)c2)nn1 2325869711 YOTPDCZUEDEGFL-OAQYLSRUSA-N 392.459 2.822 0 50 GFAA COc1ccc(-c2cc(C(F)F)n3ncc(C(=O)N4CCOCC4)c3n2)cc1 649568 PRGUGWPVKZIZPE-UHFFFAOYSA-N 388.374 2.815 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 1111628 VMDVNAVOFXPWEI-AWEZNQCLSA-N 382.507 2.873 0 50 GFAA COC(=O)c1ccc(CSc2nnc(CNC(=O)c3cccs3)o2)o1 4034980 UTXWWBZFNLNRDW-UHFFFAOYSA-N 379.419 2.733 0 50 GFAA COc1cc([C@H]2SCC(=O)N2CCN2CCCCC2)cc(OC)c1OC 4181116 WXUKFOWEGZUIDZ-LJQANCHMSA-N 380.510 2.772 0 50 GFAA biogenic CCCCCSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(F)cc1 5027675 LMGGFRMSMLWCMD-UHFFFAOYSA-N 390.484 2.903 0 50 GFAA COc1cc(-c2n[nH]cc2CN2CCCC[C@@H]2CCO)cc(OC)c1OC 12316621 DKMYSQDNZXLHQM-MRXNPFEDSA-N 375.469 2.839 0 50 GFAA C[C@@]1(CCC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)CCC(=O)N1 12508469 SLKFVGQCPBUBKE-SFHVURJKSA-N 383.414 2.803 0 50 GFAA COc1ccc(Cl)cc1NC(=S)NCCc1ccc(S(N)(=O)=O)cc1 13545201 DQXYOFJHXPKYTK-UHFFFAOYSA-N 399.925 2.525 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3cccc(NS(C)(=O)=O)c3)CC2)c1C 13677423 PISHDHXHLLHGJA-UHFFFAOYSA-N 387.505 2.637 0 50 GFAA Cc1nnc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCC(C)CC3)c2)s1 16623170 OXTLCHVRLDPVEQ-UHFFFAOYSA-N 398.485 2.659 0 50 GFAA Cc1ccc(OC[C@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 19367368 JNRYJUTXVLWOMH-HXUWFJFHSA-N 398.503 2.590 0 50 GFAA COCc1nn2c(ncc3c(=O)n([C@@H](C)C(=O)O)ccc32)c1-c1ccc(F)cc1 40397136 ALHOVPJGLQAKND-NSHDSACASA-N 396.378 2.642 0 50 GFAA Cc1nnc(SCCNC(=O)[C@@H]2CCCN2C(=O)C2CCCCC2)s1 55310012 OLZJDPVPQVMMSR-AWEZNQCLSA-N 382.555 2.626 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1C/C=C/c1ccccc1)NCCC1=CCCCC1 55360101 WZBRDTDAECZTFF-SQEWALACSA-N 381.520 2.897 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc3ccccc3n2)CN1Cc1ccccc1 64066660 YSZWCLQZZQHOON-NQIIRXRSSA-N 389.455 2.781 0 50 GFAA COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cccc(C(=O)Nc2c(C)cccc2C)c1 65399337 HILLMAKMIBYARQ-MOPGFXCFSA-N 382.460 2.664 0 50 GFAA CC[C@@H]1CN(C(=O)c2cnc3ccnn3c2C)CCC(=O)N1Cc1ccccc1 71745792 ZUDYMPXAOREUOI-GOSISDBHSA-N 391.475 2.691 0 50 GFAA CCc1nc(C)c([C@H]2CN(C)C[C@@H]2C(=O)NCc2ccc3c(c2)CCCO3)[nH]1 72149061 QMGZIVPZJIFOIW-ROUUACIJSA-N 382.508 2.567 0 50 GFAA CCc1nc(N2CCC[C@H](c3cc(N4CCOCC4)nc(C)n3)C2)ncc1C 72422682 WZORWGYCBUDXOT-KRWDZBQOSA-N 382.512 2.666 0 50 GFAA Cc1nc(CNC(=O)[C@H]2CC[C@@H](NS(=O)(=O)c3ccccc3C)C2)cs1 72425627 DYMKMZPWSZRLJA-LSDHHAIUSA-N 393.534 2.523 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(CCCC1CCCC1)CCN2Cc1ccccc1 72475408 HDAHOBMJEKOMRQ-LEWJYISDSA-N 376.566 2.940 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCN(c2cccc(O)c2)CC1 77540553 IAZXNZZNTCXKEX-UHFFFAOYSA-N 378.432 2.724 0 50 GFAA Cc1ccc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cc1N1CCNC1=O 92099224 WQMKDBISIIDCEX-FQEVSTJZSA-N 378.476 2.654 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3ccccc3-n3cncn3)C[C@H]2N(C)C)cc1 95507448 AYAWGHBERMFPHV-PZJWPPBQSA-N 375.476 2.746 0 50 GFAA NC[C@@H]1CCN(C(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)C1 95530425 JIGMSOWEUSOIHF-SFHVURJKSA-N 394.519 2.546 0 50 GFAA COc1ccc(Cc2noc(-c3ccc(N4CCC[C@H](CO)C4)nc3)n2)cc1 96767055 XNFAPVXDLROTFP-INIZCTEOSA-N 380.448 2.940 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)Nc1ccccc1 112016539 XTXWYFVUDOEOFU-AEFFLSMTSA-N 379.460 2.682 0 50 GFAA COCCN1CCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1=O 121072434 YTIJLGQVNKCEKO-UHFFFAOYSA-N 391.471 2.620 0 50 GFAA O=C(CN1CCN(c2ncnc3ccsc23)CC1)Nc1ccc(Cl)cn1 124451728 QSGMQJUPRUCVMT-UHFFFAOYSA-N 388.884 2.500 0 50 GFAA CCn1c(C)cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)c1C 134262484 JLHOBRXUWAGDJP-NRFANRHFSA-N 383.448 2.783 0 50 GFAA CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 154285273 UAEUWDAPLZJGIW-QRVBRYPASA-N 385.508 2.925 0 50 GFAA O=C(COc1ccc2c(c1)CCCC2)NCc1ccnc(O[C@@H]2CCOC2)c1 162834423 IGUBPSHQFXQDCN-HXUWFJFHSA-N 382.460 2.823 0 50 GFAA O=C(CN1C(=O)N[C@@H](c2ccccc2Cl)C2=C1COC2=O)Nc1ccccc1 169758038 MNZAAKPJKLXQNI-SFHVURJKSA-N 397.818 2.856 0 50 GFAA O=C1NC(=O)C2(CCC(c3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)N1 170623549 IPOZXWGLTQHAIH-UHFFFAOYSA-N 380.326 2.991 0 50 GFAA O=S(=O)(CC1CCOCC1)NCc1ccc(Oc2cccc(F)c2)nc1 173086110 FMRFPRJPZVGYSC-UHFFFAOYSA-N 380.441 2.859 0 50 GFAA COc1cccc(-c2cc(C(=O)NC3CCN(Cc4ccncc4)CC3)[nH]n2)c1 178011076 OYHKKXWJSMFFFI-UHFFFAOYSA-N 391.475 2.875 0 50 GFAA C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(N(C)CC(=O)O)CC1 186625429 ICRQGULBDPEYIG-OAHLLOKOSA-N 376.497 2.759 0 50 GFAA CCOC1CC(CNCc2csc(-c3ccccn3)n2)(N2CCOCC2)C1 195459618 TVPUIDDOEBRZRI-UHFFFAOYSA-N 388.537 2.565 0 50 GFAA CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCc2ncnc(OC)c2C1 195498833 MSJCTMSUXNUJQM-QGZVFWFLSA-N 384.480 2.510 0 50 GFAA Cc1noc(C)c1CO[C@@H]1COCC[C@H]1NC(=O)c1ccc(-c2cc[nH]n2)cc1 219297940 NHBVNOXAJASUFW-WOJBJXKFSA-N 396.447 2.786 0 50 GFAA Cc1ccc(NC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)cc1S(N)(=O)=O 252500147 SNTKVPZCJSKAKB-GFCCVEGCSA-N 379.404 2.837 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)NC[C@H]1CCOC1)CC2 276602583 VOLYSZAWROGJEG-AEFFLSMTSA-N 391.537 2.697 0 50 GFAA O=C([C@H]1CCN(c2ccccc2Cl)C1)N1CCCN(c2cccnn2)CC1 290206438 IHMOKPDFSRPPBP-INIZCTEOSA-N 385.899 2.695 0 50 GFAA Cn1cnn(-c2ccc(NCc3c(Cl)cccc3N3CCOCC3)cc2)c1=O 293184890 HNLSWTNHQYMESA-UHFFFAOYSA-N 399.882 2.673 0 50 GFAA O=C(COC[C@H]1CCOC1)Nc1ncccc1CN1CCc2ccccc2CC1 362176537 GMQMCZWIMMYBNB-SFHVURJKSA-N 395.503 2.674 0 50 GFAA O=C(c1cnc2n1CCCC2)N1CCN(c2ncc(Cl)cc2Cl)CC1 372156791 LUHAPWCCZJSEOG-UHFFFAOYSA-N 380.279 2.884 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2c2ncc(C(F)(F)F)cc2Cl)C1 373031806 YNVHVWJXJCWVCM-CABZTGNLSA-N 391.777 2.656 0 50 GFAA COc1ccc(/C=c2\sc3n(c2=O)[C@H]2c4ccccc4O[C@@](C)(N=3)[C@H]2C)cc1 390834928 SPPATLZLYNEZKJ-SIRFVXAQSA-N 392.480 2.715 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1CCN(C(=O)c3ccco3)CC1)c(C)n2C 426382963 BGASGSILEVRXGA-UHFFFAOYSA-N 381.432 2.687 0 50 GFAA Cn1cc(C(=O)N2CCN(c3ncnc4ccsc34)CC2)c(-c2ccoc2)n1 447517361 KOLDSAODHDRJTJ-UHFFFAOYSA-N 394.460 2.647 0 50 GFAA C[C@@H]1CCC[C@H](NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)CC1 468092994 BAGAJSHKQJWJRF-CVEARBPZSA-N 381.542 2.898 0 50 GFAA Cc1cccc(N2CCN(CC(=O)NCc3ccc4c(c3)nc(C)n4C)CC2)c1 827836054 WWFCMYCOGJZNDA-UHFFFAOYSA-N 391.519 2.629 0 50 GFAA Cc1nonc1CC(=O)N1CCC[C@H](CNC(=O)c2cc3ccccc3s2)C1 827928151 BQBJUZAJMYKOCQ-CQSZACIVSA-N 398.488 2.804 0 50 GFAA COCc1nc(C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2Cl)n(C)n1 864097097 KJEJMFRGUVNZFA-SSDOTTSWSA-N 377.754 2.520 0 50 GFAA COc1ccc(CNC(=O)C2CCN(C(=O)c3cnc(C)c(C)c3)CC2)cc1 952965487 SDFIDGIMWHRBNB-UHFFFAOYSA-N 381.476 2.876 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)N(C)CCc2scnc2C)CC1=O 1506428291 OIQBHYPBKRMQCQ-MRXNPFEDSA-N 387.505 2.510 0 50 GFAA O=C(CCN1CCCCCC1=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1529133103 BRNMILSAXBNVAU-NQIIRXRSSA-N 395.503 2.701 0 50 GFAA COc1cccc(-c2nccn2-c2ccc3c(c2)nnn3C)c1O[C@@H](C)C(=O)O 1775980682 HFBADTDWGDCXCF-LBPRGKRZSA-N 393.403 2.682 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)N3CCc4c(Cl)cccc4C3)CC2=O)s1 1857682876 PQSYMLNVRQSNKG-GFCCVEGCSA-N 390.896 2.692 0 50 GFAA O=C1CC[C@H](NC(=O)c2cccc(-c3nc4cc(Cl)ccc4o3)c2)C(=O)N1 1857798096 OROSIRKZRXOJEF-ZDUSSCGKSA-N 383.791 2.683 0 50 GFAA C[C@@H]1CC2(CCN(c3ncc(Cl)cn3)CC2)CN1C(=O)CN(C)C1CCC1 1875312765 UGTSKKNUDZOOOE-OAHLLOKOSA-N 391.947 2.822 0 50 GFAA O=C1C[C@@H]2CCCCN2CCCN(C(=O)Cc2cccs2)CCCCN1 2100533322 KHAKFJJIHKZDFG-KRWDZBQOSA-N 377.554 2.664 0 50 GFAA Cc1cc(CN2CC[C@@]3(C2)c2ncn(C)c2CCN3C(=O)C[C@H](C)C(C)C)on1 2325776913 NKFJDVIFVBKHLD-KSFYIVLOSA-N 399.539 2.885 0 50 GFAA CCCc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H]3CCCC(=O)N3)[C@@H](C)C2)cc1 2325826438 BDOAHIBLSKJEDV-PWIZWCRZSA-N 399.535 2.522 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N2CC[C@](O)(c3cccc(C(F)(F)F)c3)C2)C1 2325889521 VBWZUBVQCOBWNJ-AUUYWEPGSA-N 396.409 2.550 0 50 GFAA Cc1ccc2cccc(OCCNC(=O)c3ccnc4c3nc(C)n4C)c2n1 2356139357 WQYDJRPRCGTOKC-UHFFFAOYSA-N 375.432 2.942 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(Br)cc1F 1128910 GIMQLVMWKGZDIC-UHFFFAOYSA-N 376.185 2.937 0 50 GFAA O=C(N[C@@]1(C(F)(F)F)N=C(O)N(c2ccc(Cl)cc2)C1=O)c1cccnc1 2863489 WATNJNBNMWNSQR-OAHLLOKOSA-N 398.728 2.684 0 50 GFAA CSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(Br)c1 4011367 LEFMSGXTLUHQKW-ZDUSSCGKSA-N 385.283 2.983 0 50 GFAA CCOc1ccc(-n2c(N)c(C(=O)N3CCN(C)CC3)sc2=S)cc1 20235008 PLKCFOMWSPKGBV-UHFFFAOYSA-N 378.523 2.637 0 50 GFAA Cc1ccccc1Nc1nc(N)nc(CN2CCN(c3ccc(F)cc3)CC2)n1 54147004 RBYXFGNOBOXKTC-UHFFFAOYSA-N 393.470 2.967 0 50 GFAA CCCN1C(=O)[C@@H]2ON(c3ccccc3)[C@H](c3ccc(O)c(OC)c3)[C@H]2C1=O 101962985 NYPLHDDUBFFRLX-GUDVDZBRSA-N 382.416 2.657 0 50 GFAA O=C(NCCn1ccc2ccc(F)cc21)c1cc(-n2cnnn2)ccc1Cl 170625261 XGXUGTSRXLNNSS-UHFFFAOYSA-N 384.802 2.840 0 50 GFAA Cc1ccsc1CN(CCO)C(=O)CCCn1cnc2ccccc2c1=O 65396261 WBBYFPHESLOVSY-UHFFFAOYSA-N 385.489 2.568 0 50 GFAA Cn1nccc1NC(=O)c1cccc(CN2CCC(Oc3ncccn3)CC2)c1 67513998 MBQRZTZAUJHGHV-UHFFFAOYSA-N 392.463 2.506 0 50 GFAA Cn1ncc(C(=O)Nc2ccc(OCCN3CCCC3)cc2)c1-n1cccc1 409413889 FYSZWAJNVOITGM-UHFFFAOYSA-N 379.464 2.938 0 50 GFAA CCOc1ccc(CCCNC(=O)c2ccc(-n3cnnc3)nc2)cc1OCC 65421942 QBBLGTMADMGNEU-UHFFFAOYSA-N 395.463 2.822 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)c3cccc(Cn4cccn4)c3)CC2)nc1 67974314 MMNNZWDOGCIUBC-UHFFFAOYSA-N 376.460 2.759 0 50 GFAA COc1cccc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)c1OC 36385762 WCHFCYRNVANFBK-OAQYLSRUSA-N 384.520 2.815 0 50 GFAA COc1cccc(CS(=O)(=O)C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)n1 122589590 IJXISEOLQSBKTD-HNNXBMFYSA-N 389.395 2.627 0 50 GFAA Cn1cc(Cl)c(C(=O)OCC(=O)Nc2nc(-c3ccccc3)cs2)n1 2750557 NNHMSWLNWQYXRD-UHFFFAOYSA-N 376.825 2.993 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2cnc3c(c2)c(C)nn3C)n1C 328650269 VMPQXVUAKGURQJ-GOSISDBHSA-N 380.496 2.702 0 50 GFAA Cc1cnc(CCNC(=O)N2CCN(c3ncnc4ccsc34)CC2)s1 173600230 DLFWQNDHJOZQHH-UHFFFAOYSA-N 388.522 2.531 0 50 GFAA Cc1ccc(O[C@@H]2CCN(S(=O)(=O)c3ccc(C(F)(F)F)nc3)C2)cn1 328628927 OERKLBKTMIPLAB-CYBMUJFWSA-N 387.383 2.646 0 50 GFAA C[C@@H]1CN(C(=O)COc2ccccc2)[C@H](C)CN1C(=O)COc1ccccc1 6183220 DAJHWAPCPADMDS-QZTJIDSGSA-N 382.460 2.592 0 50 GFAA CC(C)[C@](C)(O)CNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 363421887 FCVYAKQJKZJYKS-XMSQKQJNSA-N 384.476 2.673 0 50 GFAA COC(=O)CCCC[C@@H]1SC[C@@H](NC(=O)c2ccccc2)[C@H]1OC(C)=O 12379843 PVEAODUKPHUVRQ-SOLBZPMBSA-N 379.478 2.566 0 50 GFAA biogenic CC(C)[C@@H](NC(=O)c1cccs1)C(=O)Nc1ccc2c(c1F)CCNC2 261650712 DFAYTYHMCQJLSP-QGZVFWFLSA-N 375.469 2.926 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCc2c[nH]cn2)(Cc2ccccc2)c2ccccc21 71748206 VRWOMEYGZFAMTB-HSZRJFAPSA-N 388.471 2.616 0 50 GFAA CCN1C(=O)[C@H]2CN(C(=O)c3sccc3-c3ccc(C)cc3)CCN2C1=O 369382793 FOQGYULRSYPVJP-MRXNPFEDSA-N 383.473 2.832 0 50 GFAA O=C(NCCNC(=O)N1CCC(Cc2cccnc2)CC1)c1ccccc1F 378418478 QEHRRKBZGQLDEI-UHFFFAOYSA-N 384.455 2.615 0 50 GFAA Cn1cccc1[C@H]1CCCCN1C(=O)CNC(=O)c1cnc2ccccc2c1O 174398530 NQXRQHVISWSEDD-LJQANCHMSA-N 392.459 2.763 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)C2CCCCC2)c1)N1CC[C@@H]2CNC[C@@H]2C1 333351118 RLFDFYXFHCOQKA-HZPDHXFCSA-N 391.537 2.866 0 50 GFAA CCN1CCC(N[C@@H]2C[C@@H](C(=O)NC)N(Cc3ccc4ccccc4c3)C2)CC1 20166324 RNCZFRNJGMPRKK-PKTZIBPZSA-N 394.563 2.603 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCn3ccnc3C)csc2C1 426501714 DZYNODDFWYESFA-UHFFFAOYSA-N 399.520 2.846 0 50 GFAA O=C(CCc1ccccc1)C(=O)N1CCC2(CCC(=O)N(CC3CC3)C2)CC1 91907275 MRRZJGZVLNDXQF-UHFFFAOYSA-N 382.504 2.830 0 50 GFAA CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(-c3cscn3)cc2)C1 95503741 QNHDFZKHXAWKNX-CQSZACIVSA-N 379.507 2.810 0 50 GFAA Cc1csc(CNS(=O)(=O)c2cccc(C(=O)N3CCCCC3)c2)n1 95373956 QYXVAGOAYSDAEC-UHFFFAOYSA-N 379.507 2.556 0 50 GFAA Cc1c(CC(=O)N[C@@H]2CCOC2)c2c(n1Cc1ccccc1F)CCCC2=O 95517893 ALXRUYIJKRRRFO-MRXNPFEDSA-N 384.451 2.951 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)NCCc3noc([C@H]4CCCO4)n3)cc2)o1 95503303 CJEYATXOXUWINB-CQSZACIVSA-N 384.396 2.644 0 50 GFAA CCN1CCN(C[C@@H]2CN(Cc3cccc(-c4ccc(C)o4)c3)C[C@@H]2CO)CC1 95369939 NCWNMTBOWXMNSB-DHIUTWEWSA-N 397.563 2.933 0 50 GFAA O=C(c1cccc(S(=O)(=O)N2CCC[C@H]2c2nccs2)c1)N1CCCC1 95359599 GPCOMFGCEPNQAY-INIZCTEOSA-N 391.518 2.905 0 50 GFAA CCOC(=O)[C@@H]1CC=C2[C@@H]3CC[C@]4(O)C[C@H](O)CC[C@]4(CO)[C@@H]3CC[C@]21C 253595424 DDRIWSPLTXTFNE-WMSQRZRXSA-N 378.509 2.577 0 50 GFAA Cn1ccnc1SCC(=O)NC[C@@H](c1ccc(F)cc1)N1CCCCC1 299799213 QJXVXHCEMFEJRX-KRWDZBQOSA-N 376.501 2.995 0 50 GFAA CC[C@@H](c1cccnc1)N(C)C(=O)NCc1csc(N2CCOCC2)n1 584893008 URIHAKOHAFRZIU-INIZCTEOSA-N 375.498 2.667 0 50 GFAA O=C1CC[C@@H](n2cc(Nc3cnc4cc(Br)ccc4n3)cn2)CN1 1875294394 GWHABVNZWGFVRD-GFCCVEGCSA-N 387.241 2.784 0 50 GFAA COc1cccc(C[C@H](NC(=O)N2CC[C@@H](C(=O)N3CCCC3)C2)C2CC2)c1 1875257246 KCHJIBBVMCJBEW-QUCCMNQESA-N 385.508 2.670 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1cc(C)ccn1 1875313443 QPXQWIYLXFVYSC-LBPRGKRZSA-N 398.868 2.576 0 50 GFAA COc1cc(-c2noc([C@]3(C(F)(F)F)CCN(c4ccccn4)C3)n2)ncn1 952894961 PWRNDCBTIMOEEH-INIZCTEOSA-N 392.341 2.641 0 50 GFAA O=C(N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1)N1CC(N2CC[C@@H](O)C2)C1 876278978 JAMDQJUTAISAEU-YLJYHZDGSA-N 397.523 2.645 0 50 GFAA CCc1nnc(N2CCC[C@@H](CNC(=O)c3cc(=O)c4ccccc4o3)C2)s1 952873394 WIOJQFPNOKGBQH-ZDUSSCGKSA-N 398.488 2.853 0 50 GFAA C[C@@H](CN(C)C(=O)Cc1ccccc1OCc1ccccc1)N1CCOCC1 952968622 CWRXGIBRDATBEY-IBGZPJMESA-N 382.504 2.987 0 50 GFAA C[C@@H]1CCc2[nH]nc(C(=O)N3CC[C@@H](Nc4cnc5ccccc5n4)C3)c2C1 1775987000 OMDUFRVXRMSAKS-ZIAGYGMSSA-N 376.464 2.804 0 50 GFAA O=C(c1cn2ccccc2n1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 275403501 BESCKIDJVVKKJM-INIZCTEOSA-N 377.448 2.623 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)nc1 186809995 DYBRLKPVEMQPML-UHFFFAOYSA-N 397.328 2.964 0 50 GFAA NC(=O)c1ccc(CNC(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1 171308316 IMHFNHUVBNOSOD-KRWDZBQOSA-N 391.830 2.861 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cn1)N1CCO[C@@H](CCc2ccccc2)C1 194926194 QEBYIHPIUMXJFJ-FQEVSTJZSA-N 396.491 2.784 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(Cc3ncccc3C)CC2)cc1Cl 1506431227 GDEIVTBRKPJBIZ-UHFFFAOYSA-N 395.912 2.559 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(S(=O)(=O)c2c(C)noc2C)CC1 1704342328 MEUNWBWMPYNKCC-UHFFFAOYSA-N 392.477 2.553 0 50 GFAA CCc1cc(S(=O)(=O)N2CCC(c3ccnc(O)c3)CC2)ccc1OC 1772810567 JWOVANLOLMJVID-UHFFFAOYSA-N 376.478 2.927 0 50 GFAA CCCS(=O)(=O)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 12200472 NXNIXOXQZZLBQJ-GOSISDBHSA-N 386.464 2.519 0 50 GFAA CCN(CC)C(=O)c1cn([C@H]2CCCN(Cc3ccc(F)cc3F)C2)nn1 12218520 ODFLTEGIIVDJAE-INIZCTEOSA-N 377.439 2.875 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCCc1cccc(OC)c1)C2 14748924 OAUXWSQEAVIEFK-GOSISDBHSA-N 396.535 2.837 0 50 GFAA CCc1ccc(-c2ccc(N(C)Cc3ccccc3)nn2)cc1S(N)(=O)=O 16648230 LNQIHBYZQFYTEC-UHFFFAOYSA-N 382.489 2.990 0 50 GFAA Cc1ccc(CN(C)Cc2c(C(=O)N3CCOCC3)nc3c(C)cccn23)o1 19112698 KDKIYCBCEVAMFW-UHFFFAOYSA-N 382.464 2.649 0 50 GFAA O=C(COc1ccc(F)cc1)NCc1nnc2ccc(-c3ccccc3)nn12 169778305 VARWETZBRJDEQN-UHFFFAOYSA-N 377.379 2.626 0 50 GFAA COc1c(Cl)cc(Cl)cc1C(=O)N[C@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1 1857724180 OWAWKJGPHJZPCP-HEHGZKQESA-N 385.291 2.984 0 50 GFAA COc1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)ccc1C 1857726733 DGEDRLJGYHHRFE-VIZSFHNOSA-N 392.455 2.918 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2N[C@H](C)CC(=O)N2CCCCCC2)cn1 328654727 XSQWVMQBRWRBRC-MDYRTPRTSA-N 375.517 2.834 0 50 GFAA CC(C)OC(=O)[C@@H]1C[C@](C)(O)C(=O)[C@H](C(=O)OC(C)C)[C@H]1c1ccc(F)cc1 245238274 IHNLSGUEYFDDLL-WOYCLPQFSA-N 394.439 2.769 0 50 GFAA CC(=O)Nc1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)O)C2=O)cc1 19880938 ZDCZXHYKEDGPMY-MRXNPFEDSA-N 384.413 2.767 0 50 GFAA COc1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cc1Cl 151325683 KESKFKJDTWUQSA-MRXNPFEDSA-N 388.851 2.975 0 50 GFAA CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCC(OC3CCCC3)CC1)CC2 161575255 HETPVYZCLYSKNR-OAHLLOKOSA-N 375.517 2.850 0 50 GFAA Cc1noc([C@@H](C)NC(=O)[C@@H](Cc2ccccc2)N2Cc3ccccc3C2=O)n1 906461867 ZISPRLKELQVNRN-AUUYWEPGSA-N 390.443 2.823 0 50 GFAA Cc1ccc(CN2CC[C@@](O)(c3nc(C4CC4)no3)C2)c(-c2ccnn2C)c1 809761100 UDAHQMJOXXYBBY-NRFANRHFSA-N 379.464 2.749 0 50 GFAA COc1cccc([C@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)c1OC 956269 HVBGHCIUWJHKJM-KRWDZBQOSA-N 392.419 2.618 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)[C@@H]3CCCOC3)CC1)OCC2 2356170124 WDOQLRJGSKMXLI-MRXNPFEDSA-N 375.465 2.521 0 50 GFAA CC(C)C[C@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)N1CCOCC1 4991212 RGELUNHVLZEOQR-ONUXSRJRSA-N 376.541 2.983 0 50 GFAA Cc1cc(N2CCN(Cc3ccccc3)CC2)n2nc(C(F)(F)F)nc2n1 54284456 YTNLDTZSGSUBBS-UHFFFAOYSA-N 376.386 2.774 0 50 GFAA CC(=O)N[C@H](CC(=O)N(CCC(N)=O)c1ccc(F)cc1)c1ccc(C)cc1 115441078 PGZAMLZUUBSODQ-LJQANCHMSA-N 385.439 2.610 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)C1 248157132 RMMLCACMIFSMMB-PCCBWWKXSA-N 398.551 2.693 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCC(Cc4nnc(CO)n4C)CC3)oc2c1 55405262 SDTRFGRSXLIUKC-UHFFFAOYSA-N 382.464 2.765 0 50 GFAA O=C1NCCN(Cc2c(F)cccc2Cl)[C@@H]1CC(=O)N1CCCCCCC1 55271217 MOOBTAKYEJPCNE-GOSISDBHSA-N 395.906 2.962 0 50 GFAA CN1C(=O)COc2cc3c(cc21)[C@H](c1ccc2cccc(O)c2n1)CC(=O)N3 65527312 OOQKIOCPMCDDAH-CYBMUJFWSA-N 375.384 2.770 0 50 GFAA Cc1ccccc1Oc1ncccc1CNC(=O)[C@H]1CSC(C)(C)C(=O)N1 67850870 XBXRFKWSNKHDJT-OAHLLOKOSA-N 385.489 2.809 0 50 GFAA COc1ccccc1[C@@H]1CCN(C(=O)c2ccccc2OCC(=O)N(C)C)C1 153154060 NMHYZUKVHWATNB-MRXNPFEDSA-N 382.460 2.792 0 50 GFAA O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N1CC[C@]2(CCCOC2)C1 478793502 GIHFJOAEJGRTCF-OAQYLSRUSA-N 389.471 2.642 0 50 GFAA CCCC(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1nc(-c2cccc(OC)c2)no1 174656570 AJVBFVUFRKQBTH-CJNGLKHVSA-N 386.452 2.714 0 50 GFAA Cn1cccc(C(=O)Nc2ncccc2CN2CCc3ccccc3CC2)c1=O 366346476 GZQDBOPHFKDLPR-UHFFFAOYSA-N 388.471 2.633 0 50 GFAA C[C@H](NC(=O)c1ccoc1)C(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 363728011 VUWHIYCXTFKJLI-AGKXRFJRSA-N 395.503 2.815 0 50 GFAA CC(C)c1ccc(N2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3CCSCC3)[C@@H]4C2=O)cc1 77301460 VNMCLCOYUKYELV-JYLXEMOASA-N 398.528 2.672 0 50 GFAA C[C@@H](CNC(=O)c1ccc(C(=O)N(C)C)cc1)c1nc(-c2ccccc2)no1 125802597 JYPNBSSGKSCYJT-AWEZNQCLSA-N 378.432 2.972 0 50 GFAA CO[C@@H]1CC[C@H]2OCCN(C(=O)CCc3nc(-c4cccs4)no3)[C@@H]2C1 127351500 FUYOKUITOMSSFF-MGPQQGTHSA-N 377.466 2.526 0 50 GFAA COc1nc2c(cc1CNc1ncnc3c1CCC3)C(=O)N(C1CCCC1)C2 71707932 MCXSFSPCDLTXED-UHFFFAOYSA-N 379.464 2.879 0 50 GFAA CC(C)(C)N1C(=O)NC(=O)[C@]2(Cc3c(Cl)cccc3N3CCC[C@H]32)C1=O 229889775 WDFXRWOELWJQGT-IFXJQAMLSA-N 375.856 2.728 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NCc3ccn4ccnc4c3)C2)cc1 178358907 BDKAJKUCVFJSNU-LJQANCHMSA-N 376.460 2.811 0 50 GFAA O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCC[C@@H](OCCO)C1 178656667 SHVWOCKADGTNRM-HXUWFJFHSA-N 395.459 2.527 0 50 GFAA CO[C@@]12CC[C@@H](O)C[C@@H]1N(Cc1cc3ccccc3nc1N1CCOCC1)CC2 426383769 IGPICRAVXRQLSK-UNWVZKJWSA-N 397.519 2.576 0 50 GFAA CCCc1nnsc1C(=O)N1CC[C@]2(CCCN(C3CCCC3)C2=O)C1 95378071 JRIPRTGUQNIUGZ-LJQANCHMSA-N 376.526 2.888 0 50 GFAA Cc1ccc(CC(=O)N2C[C@@H]3CC[C@H](C2)N(Cc2c(C)noc2C)C3=O)cc1 95522040 OHBASCMQHWKQIR-RBUKOAKNSA-N 381.476 2.792 0 50 GFAA O=C1N(CC2CC2)CCC[C@]12CCN(Cc1cnc(-c3ccccn3)nc1)C2 92097203 HLGQMMJLPGTLQD-JOCHJYFZSA-N 377.492 2.763 0 50 GFAA Cc1cc(N2CCC(N[C@@H](C)Cn3cncn3)CC2)nc(-c2ccccc2)n1 95520077 SXUFQICOVNJFNU-KRWDZBQOSA-N 377.496 2.691 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)cn1 95506539 HCBYIHKIFPIZIR-AWEZNQCLSA-N 382.493 2.760 0 50 GFAA O=C(Cc1n[nH]c2ccccc12)N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252527708 DEQDWYWGZHAUFL-DMPWYTOCSA-N 377.444 2.669 0 50 GFAA Cc1nccn1CCNC(=O)CC[C@H]1N=C(O)N(c2ccc(C(C)C)cc2)C1=O 252489126 JGIRECKCPJINCX-GOSISDBHSA-N 397.479 2.541 0 50 GFAA CCOC(=O)/C=C1\C[C@@H]2[C@H]3[C@@H]4[C@H]5[C@@H]([C@@H]6O[C@H]6[C@H]5[C@@H]5/C(=C/C(=O)OCC)C[C@H]2[C@H]45)[C@H]13 257347052 PQZHGKNYSHTADS-PSOWOOILSA-N 396.483 2.757 0 50 GFAA CCOc1ccc2nc(N3CCC(NCc4nccn4C)CC3)nc(C)c2c1 299776014 JVZOLYLRSARQHY-UHFFFAOYSA-N 380.496 2.829 0 50 GFAA Cc1ccc(NC(=O)CN(C)C)cc1NC(=O)[C@@H]1CC(=O)Nc2ccc(F)cc21 823676128 HBXKYCDBSDVIJO-MRXNPFEDSA-N 398.438 2.699 0 50 GFAA COc1ccc(-n2cccn2)c(CN2CCN(Cc3ncccc3C)CC2)c1 824628583 CNEJUSLUNMJBHT-UHFFFAOYSA-N 377.492 2.902 0 50 GFAA COc1ccc(NC(=O)c2ccc(N3CCCC3=O)cc2)cc1C(=O)N(C)C 824704473 ZEOPHKKNVCJTND-UHFFFAOYSA-N 381.432 2.776 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 268950731 SQBGNDLRKANEHL-PEYYIBSZSA-N 391.855 2.728 0 50 GFAA O=C(CCCc1cccs1)N[C@@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3 670437241 RKSPKQVHLCYYPH-PDGCRQIGSA-N 395.572 2.755 0 50 GFAA CC(C)Cn1nnc2c1C[C@@H](c1nc(-c3ccc4c(O)ncnc4c3)no1)CC2 952893227 IGBYVPRQHHKVPO-ZDUSSCGKSA-N 391.435 2.905 0 50 GFAA COc1ccc2c(c1)CC[C@H](NC(=O)[C@H](C)n1c(C)nc3ccccc3c1=O)C2 1875259191 LGPOMJUPGUYIPZ-KSSFIOAISA-N 391.471 2.948 0 50 GFAA Cc1cc(CN2C(=O)CCN(CCn3cnc4c3CCCC4)C2=O)cc(C)n1 1875315585 AEKPEQAZXGJKLZ-UHFFFAOYSA-N 381.480 2.628 0 50 GFAA Cc1nc(C)c(CNC(=O)[C@]2(O)CCc3cc(Br)ccc3C2)o1 888100416 LLKZBCASGLMXNM-KRWDZBQOSA-N 379.254 2.590 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)Cn1cnc2ccccc2c1=O)OC(C)C 187399802 QUPAQTIZTWHEIB-HXUWFJFHSA-N 395.459 2.688 0 50 GFAA COC(=O)[C@@H](NC(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1)c1cncn1C 225556426 ILJNQJOVELLWKE-QRWLVFNGSA-N 393.443 2.885 0 50 GFAA C[C@H](NC(=O)[C@@H]1COc2ccccc2C1)C(=O)Nc1cccc(N2CCCC2)c1 195356147 HGTWILMJLNDVRX-WMZOPIPTSA-N 393.487 2.981 0 50 GFAA CCn1ncc(S(=O)(=O)N2CCC[C@@H](C(=O)CCc3ccccc3)C2)c1C 1506418662 UTDQYGKEGNJYIV-GOSISDBHSA-N 389.521 2.814 0 50 GFAA O=C1CCCCCN1CCC(=O)N1C[C@H]2CCC[C@](O)(c3ccccc3)[C@H]2C1 1704339885 PMJHNNYWWGSLRP-RFWXGWTQSA-N 384.520 2.925 0 50 GFAA CCn1cc(C(=O)N2CCCN(C(=O)c3cc(-c4ccccc4)on3)CC2)cn1 1772711820 GFMAFGHFMWLWDZ-UHFFFAOYSA-N 393.447 2.546 0 50 GFAA O=C([C@@H]1CCc2sc(N3CCOCC3)nc2C1)N1CCOc2ccccc2C1 1772809719 DGUAWWKETPMBMN-OAHLLOKOSA-N 399.516 2.506 0 50 GFAA COc1ccc(-n2ncc([C@H](C)NS(=O)(=O)c3c(C)n[nH]c3C)c2C)cc1 11879316 UTMLASIKTWIQSX-NSHDSACASA-N 389.481 2.569 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(Cc2nccn2C)CC1 12305458 SIFXZROYIIZUSO-UHFFFAOYSA-N 394.479 2.715 0 50 GFAA COC(=O)c1ccc(-c2noc(CN(C)C[C@H]3Cc4ccccc4O3)n2)cc1 12432230 UZZWDKIPPAXQQO-QGZVFWFLSA-N 379.416 2.959 0 50 GFAA O=C(NCCCn1ccc2ccccc21)[C@H]1CCC(=O)N(Cc2ccccn2)C1 12434871 KLOATCQBOWVXAC-IBGZPJMESA-N 390.487 2.981 0 50 GFAA COCCn1c(CN2CCCCO2)cnc1S(=O)(=O)C1CCCCCC1 12445518 YKYNELXZHFALDM-UHFFFAOYSA-N 385.530 2.553 0 50 GFAA CCN(C(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(C)c1 16606917 OTFMUXYAKGXSDD-UHFFFAOYSA-N 388.489 2.683 0 50 GFAA CCC[C@H](C)c1n[nH]c2c1CN(C(=O)CCn1c(=O)[nH]c3ccccc31)CC2 19757152 UQAHSAVXXJRIIN-AWEZNQCLSA-N 381.480 2.931 0 50 GFAA COC(=O)CC[C@H]1CN(Cc2ccccc2Cl)CC[C@H]1N1CCN(C)CC1 19850931 ZPDOXWJLKUVGNJ-AZUAARDMSA-N 393.959 2.731 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(N(C)C)cc4)C3)nn2)n1 169778169 FQXOXNHIBQBEAO-INIZCTEOSA-N 395.467 2.605 0 50 GFAA CC(C)(C)N1C[C@@H](C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)CC1=O 1857670162 XPYCMTQIEJYTSZ-INIZCTEOSA-N 380.492 2.651 0 50 GFAA Cc1cccc(C)c1CN1CCC2(CC1)CN(Cc1cnc[nH]1)C[C@H]2C(=O)O 1857683036 QFGLZGCKJIILFW-FQEVSTJZSA-N 382.508 2.825 0 50 GFAA Cc1cc(=O)cc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)o1 1857722146 PMWJDGWSLHGSCC-TXPKVOOTSA-N 388.851 2.546 0 50 GFAA COc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccco4)[C@H]4CC[C@]3(C2)O4)c1 1857723318 ZPHMEJZPTFILFL-JZJXAQOMSA-N 382.460 2.698 0 50 GFAA CCCC(=O)N1CCC(C2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1 1857729694 HZQNSVVSRXBSOS-UHFFFAOYSA-N 383.496 2.620 0 50 GFAA CC(=O)OC[C@@H]1O[C@@H]2OC3(CCCCC3)O[C@@H]2[C@H]2OC3(CCCCC3)O[C@H]12 101158208 AVMIIKLVEDAPFQ-IGKNDFSCSA-N 382.453 2.795 0 50 GFAA biogenic O=C(O)[C@H]1CCCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)C1 136157094 SVXQUEFEPFQFEX-NSHDSACASA-N 378.226 2.572 0 50 GFAA Cc1cc(C2CCC2)nc(N2C[C@@H]3CN(C(=O)C4CCCC4)C[C@]3(C(=O)O)C2)n1 253480248 VQJHVVXCTCCVNH-JTSKRJEESA-N 398.507 2.592 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCNC[C@@H]1c1cccc(Cl)c1 261740564 DJLCPYFBEAEKSU-GOSISDBHSA-N 392.908 2.839 0 50 GFAA C[C@@H](Nc1nc(-c2cccnc2)nc2c1CCC2)c1cccc(S(N)(=O)=O)c1 263906425 HCYAICUAGWGPMQ-CYBMUJFWSA-N 395.488 2.848 0 50 GFAA NCc1ccccc1C1CCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)CC1 2325795662 SBRBOYBKGSUVKO-UHFFFAOYSA-N 390.487 2.763 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)[C@@H](N)Cc1cccnc1F 2325808342 RQXQVNJGDPXWMG-LBPRGKRZSA-N 395.360 2.644 0 50 GFAA CCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2cnccn2)cc1 900846 QZXDXAUJVQBPML-UHFFFAOYSA-N 396.472 2.940 0 50 GFAA CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(Cl)cc1 1075917 KBSCOPUUYYEEAR-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA COc1ccc(-c2nc3s/c(=C\c4cc(C)c(O)c(C)c4)c(=O)n3n2)cc1 2544598 WKWRIECDGBTNHF-YBEGLDIGSA-N 379.441 2.697 0 50 GFAA O=C(c1ccc2nc(N3C(=O)c4ccccc4C3=O)sc2c1)N1CCOCC1 2710371 NPFSGJVAIBQGJT-UHFFFAOYSA-N 393.424 2.569 0 50 GFAA Cc1cccc(OCC(=O)NC(=S)Nc2ccccc2N2CCOCC2)c1 2818664 KOOTUNPHICKPLX-UHFFFAOYSA-N 385.489 2.724 0 50 GFAA CS(=O)(=O)N(CC(=O)NCCSCc1ccccc1)c1ccccc1F 5007834 COIJMKCNFYBEND-UHFFFAOYSA-N 396.509 2.641 0 50 GFAA Cc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1S(=O)(=O)N1CCOCC1 6401734 BWGUEUMPNRBJBB-MRXNPFEDSA-N 388.489 2.507 0 50 GFAA CCOc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCOCC2)cc1 7389837 NUWKXQVKKSMRPC-UHFFFAOYSA-N 384.432 2.961 0 50 GFAA COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2cccc(NC(C)=O)c2)CC1=O 9342127 RBEFZZJFGNNZPC-HNNXBMFYSA-N 381.432 2.954 0 50 GFAA CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@H](NC(=O)c2cccs2)C1 11817323 LWHRASUASFFHHR-OAHLLOKOSA-N 386.521 2.943 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)c3ccccc3C)C2)nn1 11910457 NIDXCUJOYKWCAR-QGZVFWFLSA-N 383.496 2.621 0 50 GFAA CCOCCOc1cccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1 12404334 XFFQDMIMTJYCIK-UHFFFAOYSA-N 398.459 2.827 0 50 GFAA CCn1ncc(CN(CC2CCN(CCOC)CC2)C[C@@H]2CCCO2)c1C 12439386 YDWYADXWTMFMGW-NRFANRHFSA-N 378.561 2.551 0 50 GFAA COc1ccccc1CCNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2OC)C1 12596696 PGGBWXLPUWUENQ-IBGZPJMESA-N 396.487 2.801 0 50 GFAA COc1ccccc1OCC(=O)NC[C@H]1CCCN(C2CCSCC2)C1 12708230 LGPGZKCIWBWOQH-MRXNPFEDSA-N 378.538 2.798 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCc1ccc(OC)cc1)C2 14733389 ZWWRZQQGCJVTJY-QGZVFWFLSA-N 382.508 2.795 0 50 GFAA CCNC(=O)c1cn([C@@H](C)CC)cc(C(=O)NCc2ccc(F)cc2F)c1=O 14882899 VDNNTGZRCRTPRM-LBPRGKRZSA-N 391.418 2.777 0 50 GFAA Cc1ncccc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 14978999 GXQJJMOAXPSKQO-AWEZNQCLSA-N 377.366 2.940 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N3CCN(C(C)C)CC3)nc2)cc1 15076008 QWNXOPQKAVMGHF-UHFFFAOYSA-N 396.535 2.983 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(C(F)(F)F)cc2)CN1Cc1ccncc1 32561907 KMORFEFJQJSVEK-MSOLQXFVSA-N 392.425 2.579 0 50 GFAA Cc1ccccc1-n1cc(C2=CCN(CC(=O)Nc3ccn(C)n3)CC2)cn1 65435552 NYIDSRZUJLKXJG-UHFFFAOYSA-N 376.464 2.642 0 50 GFAA c1ccc([C@@H]2CCN(CCn3ccnc3-c3cc4n(n3)CCCNC4)C2)cc1 72480897 IOCYSMAINRBVDY-LJQANCHMSA-N 376.508 2.729 0 50 GFAA O=C(Cc1ccc(O)cc1)N1CCC(c2nccn2Cc2cccnc2)CC1 91693760 AVTXQOGRQBZQTP-UHFFFAOYSA-N 376.460 2.981 0 50 GFAA CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1ccc2c(c1)OCCO2 115588156 HJVQSVYSKYNIMZ-KRWDZBQOSA-N 388.489 2.747 0 50 GFAA O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccn(-c2ccccc2)n1 155063135 ZEWCXHVGQDSXNY-LJQANCHMSA-N 388.471 2.836 0 50 GFAA COC(=O)C1=NOC2(CCN(C(=O)C3(c4ccc(F)cc4F)CCC3)CC2)C1 155908884 HVASGRGBCBRUFQ-UHFFFAOYSA-N 392.402 2.697 0 50 GFAA CC[C@@]1(c2ccc(NCc3ccc(-n4cncn4)cc3)cc2)CCC(=O)NC1=O 159039471 DWFIGZMDSMVBGI-QFIPXVFZSA-N 389.459 2.964 0 50 GFAA COc1ccc(-c2ccc3nnc(CNC(=O)Cc4ccc(F)cc4)n3n2)cc1 169778534 ZHICZFCPBINMLM-UHFFFAOYSA-N 391.406 2.798 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@H](c3cccc(OC)c3)C2)c1 170615370 RDAIBNGPXMAUAH-IBGZPJMESA-N 390.461 2.823 0 50 GFAA COC[C@@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)C1CC1 191610609 RQKUMUXGVCOJST-CQSZACIVSA-N 397.353 2.744 0 50 GFAA COc1cc(OC)c([C@@H](CC(=O)O)c2c(O)ccc(C(C)=O)c2O)cc1OC 217831173 MAKKLEZGSWAREZ-CYBMUJFWSA-N 390.388 2.933 0 50 GFAA biogenic O=C(O)[C@H]1CN(C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)CCO1 238143766 NHARZAFNLXILSV-CQSZACIVSA-N 384.413 2.996 0 50 GFAA Cc1ccc(C2(O)CCN(CCC(=O)Nc3cc(F)ccc3F)CC2)nc1 243932483 BVVMRINRXPVFSV-UHFFFAOYSA-N 375.419 2.980 0 50 GFAA O=C(Nc1ccccc1Oc1ccccc1)C(=O)N[C@H]1CCc2cn[nH]c2C1 252549299 RCWQOSVNORVFMX-HNNXBMFYSA-N 376.416 2.814 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCn1cnc2ccccc2c1=O 253403556 HGHIKYSUAQJXSW-FXAWDEMLSA-N 382.508 2.510 0 50 GFAA biogenic O=C(CN1CCN(Cc2ccc(C(=O)O)cc2)CC1)Nc1ccccc1Cl 263571290 JEOCLJZZBKGGSO-UHFFFAOYSA-N 387.867 2.795 0 50 GFAA CCN1CCO[C@@H](CNC(=O)N[C@@H](C)c2cn(C)nc2C)[C@@H]1c1ccccc1 286760676 IDBKNDJSKBAKKH-YSSFQJQWSA-N 385.512 2.551 0 50 GFAA CCc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@](O)(C(F)(F)F)CC1 287954880 SMMDKHLYWATORC-INIZCTEOSA-N 393.427 2.572 0 50 GFAA Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3ccc4c(c3)NC(=O)CNC4=O)C2)cc1 295378597 OWQIGVFMSHMSQS-WMLDXEAASA-N 377.444 2.695 0 50 GFAA CCCC(=O)N[C@H]1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1 299589409 BQYVYKOMHRABFN-JKSUJKDBSA-N 391.537 2.650 0 50 GFAA CC(=O)Nc1ccc(F)c(NC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1 299778103 PDWRJFNXUMDKTG-INIZCTEOSA-N 378.448 2.549 0 50 GFAA CN1C[C@]2(CCN(C(=O)Nc3cccc(NC(=O)C4CCCC4)c3)C2)OC1=O 299801891 YWNJCIGNDNIJNO-FQEVSTJZSA-N 386.452 2.874 0 50 GFAA CC(C)[C@H]1OCCC[C@@H]1Nc1cc(N2CCC(O)(C(F)(F)F)CC2)ncn1 328628834 HPMOADCQDLVBFL-XJKSGUPXSA-N 388.434 2.986 0 50 GFAA O=S(=O)(c1cccc2c1OC(F)(F)O2)N1CC2(CCOCC2)[C@@H]1C1CC1 333219957 WHZSELGBQKFBOQ-HNNXBMFYSA-N 387.404 2.588 0 50 GFAA Cc1c(C(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)sc2cccc(F)c12 364040606 YPAKIDFVLYUGQB-OAHLLOKOSA-N 389.496 2.903 0 50 GFAA CNC(=O)c1ccc(NC(=O)N2CCN(c3ccc(F)cn3)CC2)cc1Cl 376829572 VBKULMYHTVRUNL-UHFFFAOYSA-N 391.834 2.588 0 50 GFAA CC(C)c1nc(CNC(=O)N2CCN(c3nsc4ccccc34)CC2)no1 426551960 JJRIHQYGWGZHAT-UHFFFAOYSA-N 386.481 2.835 0 50 GFAA Cc1cc(C)n(CC(=O)NCC[C@@H](c2ccc(F)cc2)c2ccco2)c(=O)n1 670453927 KMQKGPLMMLBARJ-SFHVURJKSA-N 383.423 2.931 0 50 GFAA CCOC1CC2(C1)C[C@@H]2NC(=O)c1c(F)ccc(S(=O)(=O)CC2CC2)c1F 874807785 YLFUILBUJTUTFW-IHBYNMNLSA-N 399.459 2.836 0 50 GFAA COCCCOc1ccc(C(=O)N=[S@@](C)(=O)c2ccc(OC)cc2)cn1 925984349 JARREAVBNJKTCV-SANMLTNESA-N 378.450 2.803 0 50 GFAA Cn1nccc1C1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1C(=O)Nc2c(F)cccc21 935867330 RPCYJWBYOGTALN-HUORLRHWSA-N 382.439 2.922 0 50 GFAA Cc1ccn2cc(C(=O)NC34C[C@@H]5C[C@H](C3)CC(n3cncn3)(C5)C4)nc2c1 952969205 SKHYYMBVMRJAPB-XBLGPDGASA-N 376.464 2.712 0 50 GFAA C[C@@H]1CCN(CC(=O)N(C)[C@@]2(c3ccccc3Cl)CCCCC2=O)C[C@H]1O 956933821 NQTHJRWZXINVCK-FQELHTAISA-N 392.927 2.840 0 50 GFAA Cc1cccc(CCNC(=O)[C@@H]2CCc3sc(N4CCOCC4)nc3C2)c1 1772806371 XHGZTVGAFGJUHF-QGZVFWFLSA-N 385.533 2.752 0 50 GFAA Cc1cnc(C(=O)N2CCCN(Cc3cc(CN4CCCC4)cs3)CC2)cn1 1772813479 CUMJHPQVRVTKCM-UHFFFAOYSA-N 399.564 2.790 0 50 GFAA C[C@H]1CCc2[nH]nc(C(=O)N3CC[C@@H](Nc4cnc5ccccc5n4)C3)c2C1 1775986999 OMDUFRVXRMSAKS-UONOGXRCSA-N 376.464 2.804 0 50 GFAA CC(C)c1ocnc1C(=O)N(C)CC[C@@H](NC(=O)[C@@H]1CCCCO1)C(C)C 1775997215 YDSNNSNKGKVZCS-CVEARBPZSA-N 379.501 2.970 0 50 GFAA O=C(NCc1ccccc1)[C@@]12C[C@@H](n3cc(COc4cccc(O)c4)nn3)[C@@H]1C2 1775997634 NEDRCBAHMUPLQF-VWPQPMDRSA-N 390.443 2.830 0 50 GFAA COc1cc(-c2nccn2[C@H]2CCN(C)C2=O)ccc1OCCN1CCCCC1 1857667318 QBEQGRGIKBPCHA-SFHVURJKSA-N 398.507 2.827 0 50 GFAA CCc1nccn1CCC(=O)N[C@@H]1CC[C@H](NC(=O)C(C)(C)c2ccccc2)C1 1857674267 AJWSKTZJJSGJII-MOPGFXCFSA-N 396.535 2.967 0 50 GFAA CN(C)c1nc(N2CCCC2)c2c(n1)C1(CC2)CCN(C[C@@H]2CCCO2)CC1 1857694234 GVEZEYCPASIYJZ-KRWDZBQOSA-N 385.556 2.602 0 50 GFAA COc1ccc(Cc2nc([C@H]3CCc4ncnn4C3)n(C(C)(C)C)n2)cc1OC 1857695426 JEYZEKIZTLYPMS-HNNXBMFYSA-N 396.495 2.963 0 50 GFAA O=C(O)[C@]1(CCCc2ccccc2)CN(Cc2cccc3ccnn23)CC[C@@H]1O 1875248653 DUXGLNFBNLQFJW-JTHBVZDNSA-N 393.487 2.995 0 50 GFAA CC(C)(C)c1ccc([C@@H]2CN(C(=O)c3nn[nH]c3C(F)(F)F)CCN2)cc1 1875321332 DTBKETYAZQADMQ-ZDUSSCGKSA-N 381.402 2.908 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](C)c3cccc(F)c3)C2)c1C 1875397066 JMVCYHZWKSZLFL-MAUKXSAKSA-N 385.487 2.864 0 50 GFAA CC[C@@H]1OCC[C@H]1C(=O)NCC(C)(C)CN(C)C(=O)c1c[nH]c2nccc-2c1 2325794941 XLXKFTNABWYTTE-SJORKVTESA-N 386.496 2.544 0 50 GFAA Cn1cc(-c2ccc3c(n2)N(C(=O)N[C@H]2CCCn4nccc42)CCC3)cn1 2325798323 MNSDFXYTSLOISU-KRWDZBQOSA-N 377.452 2.676 0 50 GFAA C[C@H]1C(=O)N(CCc2ccccc2)Cc2nnc(CCc3ccc(O)cc3)n21 2356141478 CXRKWRSOPRAYOC-INIZCTEOSA-N 376.460 2.915 0 50 GFAA CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1cccc(Br)c1 655134 RWENQPZDLGZXSQ-UHFFFAOYSA-N 389.315 2.664 0 50 GFAA COC(=O)CN(c1cc(C)cc(C)c1)S(=O)(=O)c1ccc(OC)c(OC)c1 840729 AEMYHZHDDOZYPF-UHFFFAOYSA-N 393.461 2.689 0 50 GFAA COc1cccc(NC(=O)CSc2nc(O)cc(=O)n2-c2ccc(C)cc2)c1 1101514 LVRSUJQMTABWHQ-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)nn1C(F)F 2356141962 XQMWXMBCPCEXIG-LJQANCHMSA-N 390.438 2.563 0 50 GFAA O=C(CSc1nnc(-c2cccs2)n1-c1ccccc1)N1CCOCC1 2849447 CCVYDEQDCFPISO-UHFFFAOYSA-N 386.502 2.947 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3cc(OC)cc(OC)c3)n2)cc1 3055688 LGBKVJKSQDSAPC-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA Cc1cc(C)cc(NC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1 3566040 LAASDFMQXMSCLU-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA CCOc1cccc(C(=O)Nc2ccc(N3CCOCC3)c(C(=O)OC)c2)c1 4711522 HYQFBRCXCVQIKM-UHFFFAOYSA-N 384.432 2.961 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)cc1 4810951 VEPVZEPUAQGDGI-QGZVFWFLSA-N 390.480 2.851 0 50 GFAA COC(=O)c1ccccc1NC(=O)C1CCN(C(=O)Cc2ccccc2)CC1 4845646 FLTUPQMQIJKFBL-UHFFFAOYSA-N 380.444 2.893 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)CCn2cncn2)CCO3)s1 67674175 GFLPTLLACLONAP-UHFFFAOYSA-N 384.461 2.832 0 50 GFAA O[C@H](COc1ccc(CNC2CCOCC2)cc1)CN1CCc2ccccc2C1 20207664 BPTDFBKZWFODQP-QHCPKHFHSA-N 396.531 2.753 0 50 GFAA CCc1c(C(=O)N[C@@H]2CS(=O)(=O)c3ccccc32)cnn1-c1ccccc1 118686679 NRGQOFAVTAOOEY-QGZVFWFLSA-N 381.457 2.693 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNc2nc(CCN)nc3ccccc23)n1 65393907 SLEZXPWWKDNUNO-UHFFFAOYSA-N 376.386 2.903 0 50 GFAA Cc1ncc(S(=O)(=O)N2CCC(N3CCc4cc(F)ccc43)CC2)s1 282619675 MGNNNEAPUCAJNV-UHFFFAOYSA-N 381.498 2.806 0 50 GFAA CCCSc1ncc(CN2CCC[C@@H](c3nnc(CN(C)C)n3C)C2)cn1 72480770 HQBYYRPINCIJKP-MRXNPFEDSA-N 389.573 2.548 0 50 GFAA COc1ccc(CC[C@@H](C)NC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)cc1 328625752 KYXNLUUWBXECSW-FXCLAUTBSA-N 384.524 2.867 0 50 GFAA Cc1ccc([C@H]2O[C@H]3CO[C@@H](c4ccc(C)cc4)O[C@H]3[C@@H]([C@H](O)CO)O2)cc1 38189451 LQAFKEDMOAMGAK-LYSZKAAZSA-N 386.444 2.553 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCN(C(=O)c2cc3c(cc2O)CCCC3)C1 328603970 HXNVDSGVGKVWOH-MRXNPFEDSA-N 396.491 2.716 0 50 GFAA COCCN1C(=O)C[C@@H](CNCC2CCC(C)CC2)[C@@H]1c1cnn(C)c1C 328629145 OLSLSTQUZIGMBH-LBXAFLOASA-N 376.545 2.680 0 50 GFAA O=C(Nc1cnn(Cc2ccccc2)c1)N[C@H]1CCN(Cc2ccccc2)C1=O 363120208 PASZCIPZFQKOJN-FQEVSTJZSA-N 389.459 2.854 0 50 GFAA CC1([C@@H]2CCCN(C(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)C2)OCCO1 363722530 KZLTWIVRIXVLCE-MOPGFXCFSA-N 386.492 2.683 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3cc(N4CCNC4=O)ccc3F)CC2)c1 155261264 KHASJKKQRCBRQQ-UHFFFAOYSA-N 382.439 2.626 0 50 GFAA O=C(NCc1cccnc1)[C@H]1CCCN(C2CCN(Cc3nccs3)CC2)C1 71760150 ONNMRQKTFHFIFJ-SFHVURJKSA-N 399.564 2.531 0 50 GFAA C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 375603754 BRJWGNWZQOLIGO-ZVRFWKBXSA-N 381.476 2.664 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)NCc2cc(-c3ccccc3)on2)C[C@H]1C(F)(F)F 263257748 PXKVPYISAZELFC-CHWSQXEVSA-N 383.326 2.746 0 50 GFAA CCCn1ncnc1[C@H](C)NC(=O)c1cccc(-c2ccc(C(=O)O)cn2)c1 426641493 JCBWZBVEJRYLHW-ZDUSSCGKSA-N 379.420 2.939 0 50 GFAA Cc1cc2c(cc1CN1C[C@H]3CC[C@@H]1CN(Cc1nc[nH]c1C)C3)OCCO2 95386105 RHMZZZRNGDTBMG-PKOBYXMFSA-N 382.508 2.894 0 50 GFAA O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc([C@H]2CCCNC2)cc1 95383405 NNMUDQMFWYLYPX-FQEVSTJZSA-N 378.520 2.943 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)C[C@@H](O)c3cccc(F)c3)CC2)cc1 179790968 AAFVHBWSTIEVQQ-HXUWFJFHSA-N 384.451 2.979 0 50 GFAA O=C(c1cc(=O)c2cc(Cl)ccc2o1)N1CCN(CCc2ccncc2)CC1 95099724 HQZLBBMXOGJACM-UHFFFAOYSA-N 397.862 2.842 0 50 GFAA CNC(=O)CNC(=O)Cc1c2c(n(C3CCCCC3)c1C)CC(C)(C)CC2=O 95516667 XXJZWGSRAWDXED-UHFFFAOYSA-N 387.524 2.862 0 50 GFAA CC(C)n1ccnc1C1CCN(C(=O)CC[C@H](C)N2CCN(C)CC2)CC1 95526152 GRQKPFATEYCMCG-SFHVURJKSA-N 375.561 2.586 0 50 GFAA COc1ccc(CN(C)Cc2ccon2)cc1OC[C@@H](O)CN1CCCCC1 95531805 URDKGGABNHFPTN-IBGZPJMESA-N 389.496 2.541 0 50 GFAA CCc1nnc(CN2CCC(C(=O)Nc3ccc(-n4cccn4)cc3)CC2)o1 95529084 CDJDWJIXZRGPLK-UHFFFAOYSA-N 380.452 2.668 0 50 GFAA COc1ccccc1N1CCN(Cc2cc(C(N)=O)oc2C(C)(C)C)CC1=O 91770673 LQARZJAHIBSXEA-UHFFFAOYSA-N 385.464 2.533 0 50 GFAA O[C@H]1[C@H](N2CCC(CCn3cccn3)CC2)c2ccccc2C12CCNCC2 23145933 UIGCMCGRJZAKMU-YADHBBJMSA-N 380.536 2.722 0 50 GFAA O=C(CCc1cccc(F)c1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccn1)C2=O 91770788 RASBNSMCWKKKLZ-FXAWDEMLSA-N 381.451 2.803 0 50 GFAA O=C([C@H]1CCCN(Cc2ccco2)C1)N1CCCN(Cc2ccccn2)CC1 95353491 BXDMUCDDOWTDKJ-IBGZPJMESA-N 382.508 2.621 0 50 GFAA CC(C)O[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91906366 SVNSKDWYTCVFAY-SFHVURJKSA-N 387.524 2.669 0 50 GFAA Cc1nnc(-c2cccc(C(=O)N[C@H]3CC(=O)N(c4c(F)cccc4F)C3)c2)o1 180879416 WOIPZCKAWSZNFT-AWEZNQCLSA-N 398.369 2.859 0 50 GFAA COc1ccc(C(=O)N2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)cc1F 95502893 ZQLZCBJBWIKOHI-QGZVFWFLSA-N 392.471 2.762 0 50 GFAA CN(Cc1ccc2c(c1)OCO2)C(=O)Nc1cccc(N2CCN(C)C2=O)c1 95506568 LPQPZVSPZPTNRE-UHFFFAOYSA-N 382.420 2.951 0 50 GFAA COc1nn(C)c(C)c1NC(=O)NC[C@@H](C)Cn1nc(C)cc1C(F)(F)F 96139063 LOAFSHUZINJDQB-SECBINFHSA-N 388.394 2.719 0 50 GFAA O=C1NC(=O)[C@@H]2[C@@H]1[C@@H]1C=Cc3cc(F)ccc3N1[C@H]2C(=O)c1ccccc1Cl 245256118 NVPOKVXVPBYCIS-WNRNVDISSA-N 396.805 2.835 0 50 GFAA COc1ccc(CNC(=O)c2ccccc2OC[C@@H]2CCCO2)cc1C(=O)O 299748482 HEFQKEJIYDIOOX-HNNXBMFYSA-N 385.416 2.881 0 50 GFAA COc1ccc(-c2cc3n(n2)[C@@H](NCc2cccc(OC)c2)CNC3=O)cc1 263616314 IAXYIWQNDKGVJV-HXUWFJFHSA-N 378.432 2.599 0 50 GFAA Cn1c(=O)c(C(=O)N[C@@H]2CCCN(Cc3cccc(O)c3)C2)cc2ccccc21 828924909 FEPYGDUJBRLTOK-GOSISDBHSA-N 391.471 2.639 0 50 GFAA CN(Cc1ccccc1)C[C@@H](O)CN1CCC2(CC1)C[C@H](N)c1ccccc1O2 1875284267 UKFXSZNZWNWELV-IRLDBZIGSA-N 395.547 2.796 0 50 GFAA O=C(c1ccn2nncc2c1)N1CCC[C@@H]1c1nc(Cc2ccc(F)cc2)no1 1875295270 VZLQIIGLIMHSBT-QGZVFWFLSA-N 392.394 2.820 0 50 GFAA C[C@@H](C(=O)N1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1)S(N)(=O)=O 1875283139 HNKUJTBIWXYKHU-SJCJKPOMSA-N 378.881 2.643 0 50 GFAA C=CC(=O)NCc1ccc(CNC(=O)Cc2ccc3c(c2)CCCO3)c(F)c1 1875386159 KKKHDIIGSSCFSF-UHFFFAOYSA-N 382.435 2.812 0 50 GFAA CCc1ccnc(C(=O)NC[C@H]2CCC[C@@H]2NC(=O)COc2ccc(F)cc2)c1 1875306823 CZFUAEQZUGHAOY-APWZRJJASA-N 399.466 2.877 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)NCc1cc2ccccc2o1 1875401813 SSFZRYFKVKNSPO-DOTOQJQBSA-N 381.436 2.950 0 50 GFAA Cc1nc2ccc(C(=O)N[C@H]3CCOC[C@@H]3Oc3ccccn3)cc2nc1C 1565515199 OSWSPRGXLVYKQO-HKUYNNGSSA-N 378.432 2.608 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3ccc(O)c(Cl)c3)C[C@@H]2NC(C)=O)cc1 1565530651 YCCPTYFIXPCXBV-AEFFLSMTSA-N 388.851 2.799 0 50 GFAA COc1ccc([C@@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C(F)F)cc1F 170605718 VKANFAAWWXUFMP-CZUORRHYSA-N 384.398 2.905 0 50 GFAA C[C@@]1(c2ccc(C(=O)N[C@@H]3C[C@H]3c3cccc(Cl)c3)cc2)NC(=O)NC1=O 280889381 BKCRJRLGMJGSCZ-YRNRMSPPSA-N 383.835 2.681 0 50 GFAA COc1ccccc1[C@@H](C)NC(=O)CN1C(=O)O[C@]2(CCc3ccccc32)C1=O 225826009 DQLRNVXJVLULQW-PEBXRYMYSA-N 394.427 2.693 0 50 GFAA COc1ccnc(NC2CCN(C(=O)NCC3(c4ccc(F)cc4)CC3)CC2)n1 189842388 UGYLIIAAKGZKJM-UHFFFAOYSA-N 399.470 2.942 0 50 GFAA COc1cccc(-c2cc(CNc3ccc(C(=O)N4CCOCC4)cn3)on2)c1 1704337582 ANZRPSKNJZQHNX-UHFFFAOYSA-N 394.431 2.830 0 50 GFAA COc1ccc2nc(NC(=O)Cn3ccc4oc(=O)cc(C)c4c3=O)sc2c1 1772491284 QAEYPDGDDNDTSP-UHFFFAOYSA-N 397.412 2.520 0 50 GFAA Cc1noc2nc3c(c(C(=O)N4CCC[C@]5(CCc6c[nH]nc65)C4)c12)CCC3 1775979677 XWVGZNKIKLREGF-NRFANRHFSA-N 377.448 2.863 0 50 GFAA CN(CCn1cccn1)Cc1cc2ccc(F)cc2n(Cc2ccncc2)c1=O 12243301 XAZYCEVNXZSMNQ-UHFFFAOYSA-N 391.450 2.912 0 50 GFAA CCOc1ccc2nc(N3CCC(C(=O)NC[C@H]4CCCO4)CC3)nc(C)c2c1 14886452 SPZZMBSWBBSZPT-GOSISDBHSA-N 398.507 2.849 0 50 GFAA Cc1c(CC(=O)N[C@@H](C)Cn2cncn2)c2c(n1CC(C)C)CC(C)(C)CC2=O 15076983 WBWBSKYDQBZWEU-HNNXBMFYSA-N 399.539 2.947 0 50 GFAA Cc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 16605028 SITPZPGFXKYTQB-QGZVFWFLSA-N 382.460 2.835 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cccc3c2OCO3)C[C@@H]1CCO 19792365 RKCILQMNCUQMNQ-FQEVSTJZSA-N 398.503 2.883 0 50 GFAA CC(C)Cc1nc2ccc(NC(=O)[C@@H](c3ccccc3)n3cnnn3)cc2[nH]1 206230178 WSLYGFZQRMDMQP-LJQANCHMSA-N 375.436 2.976 0 50 GFAA Cc1cc(C)n(CCCNC(=O)C[C@@H]2CCCN(c3nc4ncccc4o3)C2)n1 1857668203 SHRJBKWKWHKERG-KRWDZBQOSA-N 396.495 2.849 0 50 GFAA O=C(Cc1ccc(O)c(F)c1)N1CC[C@@]2(CN(CC3CCCCC3)CCO2)C1 1857691462 MJVNIHXSKURUSR-JOCHJYFZSA-N 390.499 2.957 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCC(C(=O)O)(c2ccccc2)CC1)c1ccccc1 236689346 MDSBZMRMYHPBGQ-FQEVSTJZSA-N 394.471 2.899 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3CC[C@H](C1)C(=O)N3CC1CC1)OCCCO2 247917779 BUIUBMBSXSQIQM-AEFFLSMTSA-N 386.492 2.689 0 50 GFAA Cc1cc(=O)[nH]c(-c2cccc(CN3CCC(O)(c4cccnc4)CC3)c2)n1 19720930 NCPHVNQVRPGZGS-UHFFFAOYSA-N 376.460 2.624 0 50 GFAA CCCNC(=O)c1ccc(N2CCC(NC(=O)c3ccccc3C)CC2)nc1 264840521 GQOWOGPOPMHOBG-UHFFFAOYSA-N 380.492 2.929 0 50 GFAA C[C@@]1(O)N(CCN2C(=O)OC3(CCCCC3)[C@@]2(C)O)C(=O)OC12CCCCC2 12402064 HICUHVBHPGWBEU-HDICACEKSA-N 396.484 2.714 0 50 GFAA O=C(CCC(=O)c1cccs1)NCCCNC(=O)C1Cc2ccccc2C1 2325825815 DDJOBMMHOMZNPU-UHFFFAOYSA-N 384.501 2.749 0 50 GFAA O=C(NCCO)c1cccc2c1-c1ccc(I)cc1C2 2911259 VORFVQUPWQECEC-UHFFFAOYSA-N 379.197 2.585 0 50 GFAA Cc1nc2sccn2c1CN1CCC(CCC(=O)NC[C@@H]2CCCO2)CC1 11819097 YCYXCZSHVJDXCN-KRWDZBQOSA-N 390.553 2.992 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)c1 11938330 KWZYIVZKEBKZIV-UHFFFAOYSA-N 381.480 2.775 0 50 GFAA C[C@@H](CCn1cccn1)NC(=O)c1cc(COc2ccc(F)cc2F)on1 12226968 WMOHHZDTARPRNL-LBPRGKRZSA-N 376.363 2.937 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2cn(Cc3ccc(F)cc3Cl)nn2)C1 12575506 AOEGQEHEUBCBIC-CYBMUJFWSA-N 394.834 2.534 0 50 GFAA COc1cccc(CC(=O)N2CCC(n3nccc3NC(=O)C3CC3)CC2)c1 12709976 JIOVEZBCMIYTHA-UHFFFAOYSA-N 382.464 2.646 0 50 GFAA COCCNC(=O)[C@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1 12716527 NBTOPOWWIFMTEZ-KRWDZBQOSA-N 380.492 2.611 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1ccncc1)CC2 14755460 PIZTXYNULQVOAI-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA CCN(CC)CCN(C)[C@@H]1CCc2c(c(C(=O)N3CCCCC3)nn2CC)C1 23251410 OYBLXSWGCYDIMP-GOSISDBHSA-N 389.588 2.660 0 50 GFAA Cc1csc(NC(=O)CCC(=O)N2CCN(c3ccc(F)cc3)CC2)n1 40288228 HGTWPMMTAMRKTQ-UHFFFAOYSA-N 376.457 2.658 0 50 GFAA CCn1cc(C(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)cn1 55042423 XTEFJVJVVMGMLN-FQEVSTJZSA-N 381.524 2.638 0 50 GFAA O=C(CCc1ccccc1)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 65362707 BRXXEHMCMPNJHG-UHFFFAOYSA-N 388.475 2.897 0 50 GFAA CCn1nc(C)c(NC(=O)CN2CCC[C@@H]2c2nc(-c3ccncc3)no2)c1C 65395566 OQLKFWGAKNDEBO-MRXNPFEDSA-N 395.467 2.740 0 50 GFAA CN1CCCn2nc(C(=O)N3CCC[C@H]3c3nc(-c4ccccc4)no3)cc2C1 65526813 JHOMXSCUIFQHPU-SFHVURJKSA-N 392.463 2.746 0 50 GFAA O=C(NCc1nc(-c2cccc(F)c2)c(-c2ccccn2)[nH]1)c1ccc(=O)[nH]c1 67473533 YRKHGTZYCSXBAF-UHFFFAOYSA-N 389.390 2.896 0 50 GFAA COc1cccc(-c2c[nH]nc2C2CCN(Cc3cn[nH]c3C(=O)O)CC2)c1 67605647 YJXQCUPZKHIXAV-UHFFFAOYSA-N 381.436 2.886 0 50 GFAA CC[C@H](OC)C(=O)N1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67965438 LELFBWWDJHQYBI-IBGZPJMESA-N 380.492 2.706 0 50 GFAA COc1ccc(CN2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1 91504055 QVKCEWOCRTXWFG-UHFFFAOYSA-N 380.492 2.704 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC(n4c(=O)[nH]c5ccccc54)CC3)cn2c1 91754657 XEITVHOWMKIHKN-UHFFFAOYSA-N 375.432 2.763 0 50 GFAA CC(C)CN1CC2(CCN(C(=O)[C@@H](O)c3ccccc3Cl)CC2)CC1=O 95356478 OIRCBBKMXTYCCS-SFHVURJKSA-N 378.900 2.871 0 50 GFAA CN1CCc2n[nH]c(C(=O)N3CCC[C@](C)(Cc4ccc5c(c4)OCO5)C3)c2C1 95508049 ZADBGFIQFFRTEL-JOCHJYFZSA-N 396.491 2.611 0 50 GFAA O=C1[C@H]2CC[C@H](CN(c3nc(-c4ccccc4)no3)C2)N1Cc1cscn1 95526176 UHMWLNJSWKTYLP-GOEBONIOSA-N 381.461 2.821 0 50 GFAA OCC[C@@H]1CN(c2noc(-c3ccccc3)n2)CCN1CCc1ccccc1 106981157 IIVDXYGLLGMMQZ-HXUWFJFHSA-N 378.476 2.852 0 50 GFAA COc1ccc([C@@H](CC(=O)N2CCc3c(nc(C(C)C)n3C)C2)NC(C)=O)cc1 112664401 DDNPXFAXSXCITL-GOSISDBHSA-N 398.507 2.704 0 50 GFAA N=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1c1cc(Cl)ccc1N1CCCCC1 137422962 HESQPLIUTFWITD-HUUCEWRRSA-N 385.942 2.984 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CCC[C@H](N)C3)cc2Br)no1 158568356 ZFPUZBSAUHAMIX-ZDUSSCGKSA-N 394.269 2.888 0 50 GFAA Cc1nn(C)cc1C(=O)/C=C/c1ccc(OCC(=O)O)c(Br)c1 170643081 CFAHFEPZTGSXIL-HWKANZROSA-N 379.210 2.851 0 50 GFAA Cc1cc(C(=O)NC2CCN(C(=O)Cc3n[nH]c4ccccc34)CC2)c(C)o1 171015050 HGAPZIZBKONEGB-UHFFFAOYSA-N 380.448 2.736 0 50 GFAA Cc1ccc2ncc(C(=O)N(C)[C@H]3CCCN(Cc4ccccc4)C3)c(=O)n2c1 173705750 CEVREKQSJLTBQH-IBGZPJMESA-N 390.487 2.740 0 50 GFAA COCCN1C[C@H](C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)c2)CC1=O 181181173 GFANMXYRMWHRLR-GOSISDBHSA-N 380.444 2.722 0 50 GFAA C[C@H](CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1)N1CCCCC1=O 193488337 KBCSQAQOEJSCCD-QGZVFWFLSA-N 387.524 2.621 0 50 GFAA COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1[C@@H]2CCc3ccccc3[C@H]21 230231456 FTYWNJYTBOLOBU-KVSKMBFKSA-N 386.473 2.509 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1 238147379 PTUGXVVFWKSSJS-FUHWJXTLSA-N 384.407 2.506 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)CCO1 238195644 IKKLVXUANSZSTK-CQSZACIVSA-N 378.812 2.630 0 50 GFAA COc1ccc(S(=O)(=O)N2C[C@@H](CO)[C@@H](c3ccsc3)C2)c(C)c1F 249422934 DVFCDUNCYMRWGB-UONOGXRCSA-N 385.482 2.601 0 50 GFAA NC(=O)[C@@H]1C[C@@H](C(=O)O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21 253185538 PZLZBGBHBUGRNT-DJJJIMSYSA-N 394.427 2.586 0 50 GFAA COc1cccc(Cn2ccn3nc(-c4cccc(F)c4)c(CO)c3c2=O)c1 263618065 RCILONMNXFSXEB-UHFFFAOYSA-N 379.391 2.851 0 50 GFAA C[C@]1(C(=O)Nc2nc3ccc(S(=O)(=O)N4CCCC4)cc3s2)CCCO1 267951429 MKCBIAHHEPHWOO-QGZVFWFLSA-N 395.506 2.588 0 50 GFAA O=C(c1c[nH]nc1[C@@H]1CCOC1)N1CCN(Cc2ccc(F)cc2Cl)CC1 275273170 JRJMDHGTISDBJM-CQSZACIVSA-N 392.862 2.664 0 50 GFAA Cc1cc(CS(=O)(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)no1 276416457 BULDRWGIIQZGBQ-LBPRGKRZSA-N 390.292 2.988 0 50 GFAA CSCC(=O)N1CCc2c(cnc(C)c2CNC(=O)c2ccsc2)C1 299771108 ZSYGLJVNPUUJKX-UHFFFAOYSA-N 375.519 2.629 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN(C(=O)COC2CCCCC2)CC1 328631537 KOUYBHVAYFANBK-LJQANCHMSA-N 388.512 2.556 0 50 GFAA O=C(Nc1ccc(OC(F)F)c(F)c1)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 333795928 FGXWVFYGDVNJMF-MRXNPFEDSA-N 392.399 2.860 0 50 GFAA Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CC2(CCCC2)c2c(F)cccc21 362859751 ICZJMYWVLGNQMU-UHFFFAOYSA-N 380.423 2.871 0 50 GFAA O=C(CCc1nc(-c2nc[nH]n2)no1)N1CCC[C@@H](c2ccc(F)cc2)CC1 378491477 GWAHCZPADMNFAB-CYBMUJFWSA-N 384.415 2.723 0 50 GFAA CC(C)Cn1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(C(F)F)n1 450746750 LAMSRIMKOSASHK-UHFFFAOYSA-N 393.438 2.638 0 50 GFAA Cc1ccc(NC(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)cc1S(C)(=O)=O 455018942 FVHAKAHVMHMAOT-ZDUSSCGKSA-N 394.415 2.972 0 50 GFAA CCc1ccccc1Nc1nc(N)nc(COC(=O)c2cc(C)nc(O)c2)n1 777135930 APKVYPHEOZZKEY-UHFFFAOYSA-N 380.408 2.526 0 50 GFAA O=C1O[C@@H](C(=O)Nc2nc(-c3ccc4ccccc4n3)n[nH]2)Cc2ccccc21 820139262 AMPUKRMSQPTCOX-QGZVFWFLSA-N 385.383 2.740 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)N(C)C[C@@H](C)CN3CCCC3)cc12 952980949 QYQKYPCHQVSUMH-CQSZACIVSA-N 377.510 2.601 0 50 GFAA c1ccc(C23CN4CCN(CC(C4)[C@@H]2NCc2ccc(-n4ccnc4)cc2)C3)cc1 952985317 UXMNKXOQZKJAKU-QNVARPAVSA-N 399.542 2.530 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1C(=O)O 958742365 YPDCMLLDWKGJBL-ZWKOTPCHSA-N 395.411 2.741 0 50 GFAA COc1nccnc1N1CCC(CNC(=O)c2cnoc2-c2ccccc2)CC1 1506425569 PQAJSLYDTUCIOA-UHFFFAOYSA-N 393.447 2.787 0 50 GFAA Cc1noc(C)c1C(=O)N1C[C@H]2COC[C@@H](C1)CN2C/C=C/c1ccccc1 1772703959 OIEJTBHMCGESBT-XXGTVTCJSA-N 381.476 2.778 0 50 GFAA O=C(Cn1c2ccccc2c2cc(Cl)ccc21)N1C[C@H]2[C@H](C1)C2(CO)CO 1772709976 TYVOUPVEIZNBRO-IRXDYDNUSA-N 384.863 2.507 0 50 GFAA CCC(=O)N1CCC[C@@H](c2nc(-c3cccnc3O)nn2-c2cccnc2)CC1 1772804484 AZZSSEJVBVUBGF-OAHLLOKOSA-N 392.463 2.936 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(C(=O)NC(C)C)C[C@@]2(CCc2ccccc2)C1 1772808005 DXUXSRXSUCQVMN-SIKLNZKXSA-N 387.524 2.534 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(S(=O)(=O)c3cc(F)ccc3C)C1)CC2 1857673090 GIOTWEMBRXFFOZ-IBGZPJMESA-N 391.468 2.607 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)N[C@H]3CC[C@H](O)CC3)sc12 1857688402 HSISHDPFLWGCRV-WKILWMFISA-N 378.538 2.665 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(C(=O)c4ccco4)C[C@]34CC[C@H]2O4)c(C)o1 1857713332 VNMWYFRSMKPRJK-BIZBXSGISA-N 384.432 2.539 0 50 GFAA COc1ccccc1CC(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857736960 SCHILYQEIVRSAT-NOXFTYBFSA-N 392.455 2.539 0 50 GFAA COc1cccc(CN2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)n1 1875245270 RVMBWYIABITWRH-DENIHFKCSA-N 384.476 2.751 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCc3c2[nH]c2ccccc32)c(C)n(C)c(=O)c1C(N)=O 1875249014 DYHUKWDRDWNAIM-HNNXBMFYSA-N 392.459 2.641 0 50 GFAA CCCc1cc(C(=O)N[C@@H]2CCN(c3ncnc(CC)c3F)C[C@H]2CC)n[nH]1 1875334107 YHIUTHXQBSFVCN-CZUORRHYSA-N 388.491 2.889 0 50 GFAA O=C(c1cn2ccsc2n1)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 2100543530 UCGCYIWHPLBXDN-GJZGRUSLSA-N 377.853 2.624 0 50 GFAA NC(=O)C1(NC(=O)c2nc(-c3ccccc3C(F)(F)F)c3ccccn23)CC1 2325793847 JVRWSRHZMVHKCF-UHFFFAOYSA-N 388.349 2.768 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc3c(c2)N(C(=O)C(C)(C)C)CCO3)CC1 2325888411 QIVLLMZUEZYKEC-UHFFFAOYSA-N 399.491 2.821 0 50 GFAA CN1CCC(N2CCC(CN=c3[nH]oc(-c4ccccc4)c3C(=O)O)CC2)CC1 2356143629 QFEVTPALDWZHRL-UHFFFAOYSA-N 398.507 2.680 0 50 GFAA COc1cccc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)c1OC 2356154587 AZHKZJDPLOIHNV-QFIPXVFZSA-N 396.491 2.680 0 50 GFAA Cn1cncc1C(=O)N1C[C@@H]2C[C@H](C1)[C@@H]1CCCCN1[C@H]2Cc1ccccc1 2356159137 NOWPHHDITVIXLB-ANULTFPQSA-N 378.520 2.978 0 50 GFAA COC(=O)[C@@]12COC[C@@H]1CN(C(=O)CCCCc1nc3ccccc3s1)C2 2356168701 BOJJWQWDMHKSCN-XOBRGWDASA-N 388.489 2.657 0 50 GFAA CC(=O)c1cccc(NC(=O)CN(Cc2ccc(Cl)cc2)S(C)(=O)=O)c1 1117001 IFRBJIQQNYJXCC-UHFFFAOYSA-N 394.880 2.943 0 50 GFAA COc1ccc(OC[C@@H](O)CNC(=O)c2ccc(Br)cc2)cc1 1126910 YFFPOPZKNCSQAI-AWEZNQCLSA-N 380.238 2.627 0 50 GFAA CCn1nnnc1-c1ccc(OC)c(S(=O)(=O)Nc2ccc(C)cc2C)c1 1481430 GNWBADHWYSYMBL-UHFFFAOYSA-N 387.465 2.786 0 50 GFAA CCCN1CCC[C@@]2(CCCN2S(=O)(=O)c2cc(C)c(C)cc2OC)C1=O 2356138079 DRZBGZCCBPKBBH-HXUWFJFHSA-N 394.537 2.868 0 50 GFAA CCCOc1ccc(C(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)cc1 2356142357 OXEPEOFSFADJSR-NFBKMPQASA-N 397.471 2.996 0 50 GFAA COC(=O)c1sccc1NC(=O)CSc1nnnn1-c1ccccc1C 2860717 QHQCKYHOQZYONK-UHFFFAOYSA-N 389.462 2.550 0 50 GFAA N=c1[nH]nc(CCNC(=O)c2ccc(-c3nccc4ncccc34)cc2)s1 2356156862 UKPQAMBYKYLHTP-UHFFFAOYSA-N 376.445 2.533 0 50 GFAA CC(C)CS(=O)(=O)c1ncc(CN(C)[C@@H]2CCOC2)n1Cc1ccccc1 20208386 YSALJNSJELJZHG-GOSISDBHSA-N 391.537 2.582 0 50 GFAA CCNC(=O)[C@@H](C)N1C(=O)C2(CCN(CCC(C)C)CC2)Nc2ccccc21 55153208 ZMWJOAAEKQAKNK-QGZVFWFLSA-N 386.540 2.850 0 50 GFAA O=C(O)c1ccc2c(c1)n(CCN1CCCC1)c(=O)n2Cc1ccc(F)cc1 55242570 ONRAZBTXMWOXIX-UHFFFAOYSA-N 383.423 2.784 0 50 GFAA CC[C@@H](C(=O)N1N=C(C(F)F)C[C@@]1(O)C(F)F)n1nc(C)c(Cl)c1C 6554827 JHZHZDBHJPVTFV-LKFCYVNXSA-N 384.761 2.912 0 50 GFAA Cc1c[nH]c(=O)n1-c1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCCC[C@H]2C)cc1 251021964 PHJCFPZLWMIBMP-DDUZABMNSA-N 385.464 2.714 0 50 GFAA COCCN1C[C@@H](c2nc(C(C)C)nn2-c2cccc3cccnc23)CC1=O 65386104 YDBKUKUVUNRPRL-INIZCTEOSA-N 379.464 2.901 0 50 GFAA CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(S(=O)(=O)c2cccc3ccccc23)C1 328907868 CLQINHLPRNOVKL-WBVHZDCISA-N 398.488 2.986 0 50 GFAA O=C1c2ccc(C(=O)N3CCOc4ccccc43)cc2C(=O)N1Cc1cccnc1 32520183 PRTPOEHJOVOYBK-UHFFFAOYSA-N 399.406 2.917 0 50 GFAA Cn1cc(I)c(C(=O)Nc2ccc(-c3ccno3)cc2)n1 4760968 QPQDDTRXJNYTJZ-UHFFFAOYSA-N 394.172 2.932 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN(C)C2CCCCC2)c1C(=O)OC(C)C 6008350 VIGSLMSELIBVBM-UHFFFAOYSA-N 395.525 2.924 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2cn3ccsc3n2)c2ccccc2C12CCNCC2 72468168 HHZWHUSRFGEGRC-SJORKVTESA-N 382.489 2.517 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)Nc1ccccc1N1CCCC1=O 363183660 BTLIRVNUVOIUIS-UHFFFAOYSA-N 376.420 2.716 0 50 GFAA O[C@H]1[C@H](NCCCn2ncc3ccccc32)c2ccccc2C12CCNCC2 72172552 GVFYCKRXQZSILZ-YADHBBJMSA-N 376.504 2.753 0 50 GFAA Cn1ncc(N2CC[C@@H](CNc3ncc(C(F)(F)F)cc3Cl)C2)cc1=O 77406546 CYGNSJWJOAUUHR-JTQLQIEISA-N 387.793 2.786 0 50 GFAA O=C(O)CCc1cc2n(n1)CCCN(Cc1ccccc1Cn1cccn1)C2 72424428 JRVKOWLQHXRYCY-UHFFFAOYSA-N 379.464 2.551 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3ccc(CN(C)C)o3)CC2)OC1=O 77421924 GQWMRAATUPLLFT-OAHLLOKOSA-N 377.485 2.957 0 50 GFAA O=C(NCc1noc(-c2cccc(F)c2)n1)c1ccnc(NC(=O)C2CC2)c1 376050154 KAUOJYNRHPLFFD-UHFFFAOYSA-N 381.367 2.549 0 50 GFAA CC(C)(C)c1ncc(NC(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)cn1 132670371 ZVWDLWBMRBSXEE-CQSZACIVSA-N 389.406 2.979 0 50 GFAA O=C(CCCc1nc(-c2ccco2)no1)NCc1ccccc1-n1cncn1 222923782 ZHBXSRNCJHXZMZ-UHFFFAOYSA-N 378.392 2.549 0 50 GFAA O=C(C1CCN(C[C@@H](O)COc2ccccc2F)CC1)N1CCc2ccccc21 194973185 PILUEQGOLLTUGY-LJQANCHMSA-N 398.478 2.867 0 50 GFAA O=C(c1ccccc1N1CCCC1)N1C[C@H]2CC[C@@H]1CN(c1ncccn1)C2 91603193 VOQUEFOMXMXWAX-ZWKOTPCHSA-N 377.492 2.818 0 50 GFAA COCCN(Cc1c(C)nn(C)c1C)C(=O)N[C@H](C)c1nc2ccccc2[nH]1 426641343 IHSKTCDFDUFDEJ-CQSZACIVSA-N 384.484 2.832 0 50 GFAA CN(Cc1cnccn1)C(=O)c1ccccc1S(=O)(=O)Cc1ccccc1 426531813 QQODYTVRPOSUMP-UHFFFAOYSA-N 381.457 2.723 0 50 GFAA O=C(O)CN1CC2(CCC1=O)CCN(C(=O)c1cccc3ccccc13)CC2 91350925 XMIJONOOAFMGBO-UHFFFAOYSA-N 380.444 2.769 0 50 GFAA Cc1cc(N2CCC(NCc3nc[nH]c3C)CC2)nc(-c2ccccc2O)n1 95512197 OETRQWWZDWSJOR-UHFFFAOYSA-N 378.480 2.948 0 50 GFAA CC[C@@H](O)Cn1nc(COc2ccccc2)nc1-c1nn(C)c(C)c1Cl 96150488 GYVUFEMWDNLOAX-CYBMUJFWSA-N 375.860 2.990 0 50 GFAA Cc1nc(C)c(CC(=O)N[C@H]2CCCc3nc(-c4ccccc4)ncc32)c(=O)[nH]1 91526356 XBSBAIHBRRKMKY-SFHVURJKSA-N 389.459 2.580 0 50 GFAA COc1ccc(Br)c(C(=O)N(CCC(=O)O)C[C@@H]2CCCO2)c1 299742253 AWBLRNWIIOJYHV-LBPRGKRZSA-N 386.242 2.554 0 50 GFAA O=C(O)[C@@H]1CCCN1C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 299746467 XPMGIXORAAKNSV-ZDUSSCGKSA-N 386.408 2.824 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C[C@@H](O)[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 252427035 SHIBSTMRCDJXLN-VTQONZODSA-N 390.520 2.575 0 50 GFAA biogenic,in-vitro CCN(C[C@H](O)c1cccc(O)c1)C(=O)Nc1cc(C(=O)OC)ccc1OC 299774622 HNYNJUOBYDUUDY-KRWDZBQOSA-N 388.420 2.775 0 50 GFAA COc1ccc([C@@H]2C[C@@H](C)N(S(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1 1875260152 VECIRGWFAYAGPU-CZUORRHYSA-N 375.446 2.960 0 50 GFAA Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N1CC[C@@H](Cc2cccc(Cl)c2)C1 1875255555 XRNBBZCAQOGLLC-AWEZNQCLSA-N 396.896 2.902 0 50 GFAA CC1(O)C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Oc2ccccc2C(N)=O)nc1 1875262803 MHPXANUEIPEPSP-YLQYIJTPSA-N 396.447 2.883 0 50 GFAA CCOC(=O)c1cnc(C)nc1Cn1nnc(-c2cccc(C(F)(F)F)c2)n1 1875298993 VJUHPGOEPUZMKU-UHFFFAOYSA-N 392.341 2.682 0 50 GFAA CC(C)C[C@H]1C[C@H](C(=O)N=c2[nH][nH]c3ccc(Br)cc23)CC(=O)N1 1875359046 RZRAKTXFYBWJKA-JQWIXIFHSA-N 393.285 2.627 0 50 GFAA Cc1cc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)ccc1F 1875397219 QHKIZZSTXUMNQZ-QGZVFWFLSA-N 385.487 2.611 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)C1(c3cccc(F)c3)CCC1)CCO2 1875395729 KDFYKTSRLQFQPS-UHFFFAOYSA-N 394.512 2.737 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(Cc4ccccc4)C(=O)C3(C)C)n[nH]c21 1875395212 RJRWWUXKBPWMRX-CABCVRRESA-N 396.491 2.695 0 50 GFAA O=C(CCc1ccc2[nH]ccc2c1)N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O 1875403682 YGKXBOOQUKXKBR-GDIGMMSISA-N 386.883 2.906 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(CCN(C)C)Cc3ccc(F)c(F)c3)n[nH]c21 1875290456 HPAPVKPSIADWQK-OLZOCXBDSA-N 392.450 2.914 0 50 GFAA O=C1C[C@H](C(=O)N2CCC3(CCc4ccccc43)CC2)CN1Cc1cccnc1 952860310 LWIXOSXUKRHKET-FQEVSTJZSA-N 389.499 2.937 0 50 GFAA CCNS(=O)(=O)c1cccc(C(=O)N[C@@H](CC)c2ccc(OC)cc2)c1 170615785 UGPYIQRODKIYJU-SFHVURJKSA-N 376.478 2.875 0 50 GFAA CCNC(=O)[C@@H]1CCN(Cc2ccccc2CS(=O)(=O)c2ccccc2)C1 1506398473 CBXOKYCUBOCMKW-GOSISDBHSA-N 386.517 2.619 0 50 GFAA O=C1CCCN1CCC(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704343950 HVLLAPZKKFSBEW-UHFFFAOYSA-N 381.476 2.571 0 50 GFAA CC(C)Nc1ncc(CN2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)cn1 1615726973 YYSZYDFJKISIEO-RXVVDRJESA-N 377.492 2.881 0 50 GFAA O=C(c1ccno1)N1CCC[C@H](c2ncnn2-c2cnc3ccccc3n2)CC1 1772818508 SKBQRVFTVUCQNQ-AWEZNQCLSA-N 389.419 2.608 0 50 GFAA CC1(C(=O)N2CCC(N3CCC[C@H](C(=O)NCCc4ccccc4)C3)CC2)CC1 12074456 UKZGPLUFDJEYBD-FQEVSTJZSA-N 397.563 2.848 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)CC[C@]2(Cc3ccsc3)CCC(=O)N2)C1 12244082 AQIXFVNJTIAVKO-JXFKEZNVSA-N 392.521 2.521 0 50 GFAA CCCCn1c(CN2CCC[C@@]3(CCCN(C)C3)C2)cnc1S(=O)(=O)CC 12434242 PYWHRKJVSNBCBO-HXUWFJFHSA-N 396.601 2.785 0 50 GFAA CC[C@@H](Oc1ccc(OC)cc1)C(=O)Nc1ccccc1C(=O)N1CCOCC1 14397558 CCEYIVNQPKQENP-HXUWFJFHSA-N 398.459 2.964 0 50 GFAA COc1ccc(C(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)cc1F 169779709 ZULPZSRMGPYCJZ-UHFFFAOYSA-N 396.422 2.728 0 50 GFAA Cc1nn(C)cc1-n1ccnc1-c1ccc(OCC(=O)N2CCCCC2)cc1 1857690030 SLBWRWATYHVCTM-UHFFFAOYSA-N 379.464 2.973 0 50 GFAA O=C(c1ccc2c(c1)OCO2)N1CCC2(CCc3c(O)nc(C4CC4)nc32)CC1 1857714953 UOVLLWZLSUYCKH-UHFFFAOYSA-N 393.443 2.909 0 50 GFAA CCN=c1ncc(-c2nccn2[C@@H]2CC(=O)N(c3ccccc3Cl)C2)c[nH]1 1857719692 RNOHBJJUQZRSEF-CQSZACIVSA-N 382.855 2.825 0 50 GFAA Cc1cccc(N2C[C@@H]3[C@H](CNC(=O)c4ccc(F)cc4)[C@H]4CC[C@]3(C2)O4)n1 1875245338 VTYXDANJZZLMSK-JZJXAQOMSA-N 381.451 2.943 0 50 GFAA CCOc1cc(/C=c2\sc3nc4ccccc4n3c2=O)ccc1OC(C)=O 12411496 MSXXSGFJMFSFIR-WQRHYEAKSA-N 380.425 2.781 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCc3ccc4c(c3)CCCO4)cn12 2100539352 DRFUCGZSIBQDQV-LJQANCHMSA-N 380.448 2.674 0 50 GFAA CC[C@@H](C(=O)N1CC2(CCN(C(=O)C34CCC(CC3)C4)C2)C1)N(CC)CC 2325793518 YGPOYNXFRTXWKN-DKTYTTGXSA-N 375.557 2.748 0 50 GFAA COc1cccc([C@H]2CNCCN2C(=O)NCc2nc3cc(C)ccc3n2C)c1 891889285 TYMDJCRERCBGRG-HXUWFJFHSA-N 393.491 2.746 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)/C=C/c2ccc(Cl)c(Cl)c2)cc1 1140362 URJFRYCOLQKSTB-XBXARRHUSA-N 385.272 2.970 0 50 GFAA Cc1sc2[nH]c(SCc3ccc(C(=O)NCCO)cc3)nc(=O)c2c1C 9704209 UVGBEQDVKCYQHP-UHFFFAOYSA-N 389.502 2.616 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)CSc2ccccn2)C1)c1ccc(F)cc1 12432081 VVMACAYQUATVAE-OAHLLOKOSA-N 387.480 2.981 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCc1ccc(OC)cc1)C2 14733388 ZWWRZQQGCJVTJY-KRWDZBQOSA-N 382.508 2.795 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)CCN2CCCCO2)C1)c1ccccc1Cl 15067831 FLMVDVSACHMMRU-MRXNPFEDSA-N 393.915 2.726 0 50 GFAA O=c1c2cnc3nc(-c4ccc(Cl)cc4)nn3c2ccn1C[C@@H]1CCCO1 15106541 NAJCXIHOPSWDFN-AWEZNQCLSA-N 381.823 2.939 0 50 GFAA O=c1cc(COc2ccccc2)nc(-c2ccc(CN3CCC[C@H](O)C3)cc2)[nH]1 19865365 ULIDKWPZPOYGEK-FQEVSTJZSA-N 391.471 2.973 0 50 GFAA O=c1c(CN2CCN(Cc3ccsc3)[C@H](CCO)C2)coc2ccccc12 20537975 CLEZOBVMMJEJDM-GOSISDBHSA-N 384.501 2.923 0 50 GFAA COc1ccc(-n2ccnc2CN2CCN(CC=C(C)C)[C@@H](CCO)C2)cc1 20906415 NPUQZVKCLXRXJJ-FQEVSTJZSA-N 384.524 2.716 0 50 GFAA COC(=O)c1ccc(CN2CC[C@@H](N(C)Cc3cc(C)no3)CCC2=O)cc1 20994017 GLYSKRDGFVWCJD-SFHVURJKSA-N 385.464 2.783 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)[C@@H](C)C2=O)c1 55134150 SMTYMMYNYPNGGC-INIZCTEOSA-N 389.455 2.710 0 50 GFAA c1ccc(CN2CC[C@@H](NCc3noc(-c4ccc5c(c4)OCO5)n3)C2)cc1 67688714 SNTXIFBWGBKRHN-QGZVFWFLSA-N 378.432 2.829 0 50 GFAA C[C@H](Cn1cccn1)C(=O)N1CCOc2c(O)cc(-c3cccnc3)cc2C1 67920725 NIHIYPWLHODFLB-OAHLLOKOSA-N 378.432 2.708 0 50 GFAA COCC(=O)N1CC[C@]2(O)CCN(Cc3c(C)sc4ccccc34)C[C@@H]2C1 95352335 AQVRCCALJFTHTK-IIBYNOLFSA-N 388.533 2.641 0 50 GFAA O=C(c1cccs1)[C@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 95383808 YEXWDKAMFFNUFQ-HNNXBMFYSA-N 388.489 2.908 0 50 GFAA CCOc1cccc(OCCN(C)C(=O)Cn2c(=O)ccc3ccccc32)c1 95520047 ZNKXNBSIWHINCA-UHFFFAOYSA-N 380.444 2.938 0 50 GFAA C[C@H](c1ccccc1)N1C(=O)C[C@@H](Nc2ccc(N3CCOCC3)cc2)C1=O 96203287 GRZHBPUNYRXKMH-OXQOHEQNSA-N 379.460 2.824 0 50 GFAA COc1c(Br)cccc1CCNC(=O)[C@@H](C)NC(=O)c1ccco1 125197341 UBALMVNWDFOTNK-LLVKDONJSA-N 395.253 2.528 0 50 GFAA Cc1cc(NC(=O)CN2CCN(C(=O)[C@H](C)c3ccc(Cl)s3)CC2)no1 175189573 VUHVNLWYECIFQZ-GFCCVEGCSA-N 396.900 2.584 0 50 GFAA O=C(CCc1nc(-c2ncccn2)no1)N[C@H]1CCN(c2cccc(Cl)c2)C1 176319326 WEEFPFZLKVEAAW-AWEZNQCLSA-N 398.854 2.508 0 50 GFAA CCCCN1C(=O)CC[C@H](C(=O)N2CC[C@H](CN)C2)[C@H]1c1ccccc1OC 178584442 DABVYYFAZJAKIN-PLMTUMEDSA-N 387.524 2.582 0 50 GFAA O=C(Cc1cccc(Br)c1)NS(=O)(=O)c1ccc2c(c1)COC2 181305892 PQTYIRKVBBHELQ-UHFFFAOYSA-N 396.262 2.527 0 50 GFAA COc1ccnc(N2CCN(C(=O)NCc3c(C)oc4ccccc34)CC2)n1 186159084 SHQNHFACFFPSCM-UHFFFAOYSA-N 381.436 2.572 0 50 GFAA C[C@@H](NC(=O)[C@@H]1COc2ccccc2C1)C(=O)Nc1cccc(N2CCCC2)c1 195356151 HGTWILMJLNDVRX-AEFFLSMTSA-N 393.487 2.981 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)[C@H](C)C1 225680748 SUFNZSBFNQAHBB-OLZOCXBDSA-N 388.434 2.690 0 50 GFAA O=C(c1ccccc1Cl)[C@@H]1[C@@H]2C(=O)NC(=O)[C@H]2[C@@H]2C=Cc3cc(F)ccc3N21 245256117 NVPOKVXVPBYCIS-FJIDUMEYSA-N 396.805 2.835 0 50 GFAA CSc1cccc(CN2C[C@@H]3OC(=O)N(CCN4CCCCC4)[C@@H]3C2)c1 247549338 VKCZZCWQUCHSBO-MOPGFXCFSA-N 375.538 2.899 0 50 GFAA O=c1[nH]nc([C@@H]2CCCN(Cc3nnc(-c4cc5c(s4)CCCC5)o3)C2)o1 284267833 MPJYBUNZSBIYCG-GFCCVEGCSA-N 387.465 2.733 0 50 GFAA COc1ccc(CNC(=O)c2cccc(OC[C@H]3CCCO3)c2)cc1C(=O)O 299753511 YJHMVCQGBOTIGM-QGZVFWFLSA-N 385.416 2.881 0 50 GFAA CCOc1ccc(C(F)(F)F)cc1NC(=O)N1CCN([C@H]2CCNC2)CC1 299756724 DXYRZRPCEWHHRI-AWEZNQCLSA-N 386.418 2.616 0 50 GFAA O[C@@H]1CN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC[C@H]1Nc1ncccn1 299763024 FYVPHBGMNWDXIL-IAGOWNOFSA-N 384.871 2.567 0 50 GFAA CC(=O)NCc1ccc(-c2cccc(C(=O)N3CCC4(CCO4)CC3)c2)nc1 299763199 YYTDOYTZXGPTLM-UHFFFAOYSA-N 379.460 2.780 0 50 GFAA CC(C)C(=O)NC[C@H]1CCCN(C(=O)Nc2c[nH]nc2-c2nccs2)C1 333293091 ATVMOWFKTSSAPU-GFCCVEGCSA-N 376.486 2.549 0 50 GFAA CC1(C)CN(C(=O)CSc2nccn2C(C)(C)C)C[C@]2(CCCOC2)O1 333304851 UGOZKMZVTDEWTJ-IBGZPJMESA-N 381.542 2.917 0 50 GFAA C[C@@H]1CN(C(=O)Nc2cccc(OCc3cscn3)c2)CCS(=O)(=O)C1 333406417 GFHBLETVCVIDAJ-CYBMUJFWSA-N 395.506 2.621 0 50 GFAA Cc1nc(-c2cccc(NC(=O)CN[C@H]3CCC(=O)NC34CCC4)c2)cs1 367259298 VLOMTUWMEDWLMP-KRWDZBQOSA-N 384.505 2.848 0 50 GFAA CCCc1c(NC(=O)N2C[C@@H](C)O[C@@]3(CCOC3)C2)cnn1-c1cc(C)ccn1 373937204 VYOAEUPBQUZCDZ-IERDGZPVSA-N 399.495 2.940 0 50 GFAA CCN1CCC[C@H](CN(C)S(=O)(=O)c2cc(-n3cccn3)ccc2C)C1 952968679 KYFIKSOMGIHOJH-QGZVFWFLSA-N 376.526 2.533 0 50 GFAA CCn1cncc1CN1CCCN(C(=O)c2ccc(OC)c(Cl)c2)CC1 1775982357 UBPNOBIQOAKHRL-UHFFFAOYSA-N 376.888 2.913 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CCC[C@]2(CCc3c[nH]nc32)C1 1775982904 UQEFYFKBXCOFHZ-QFIPXVFZSA-N 376.460 2.540 0 50 GFAA O=C(C1CCN(c2nc3ccc(Cl)cc3o2)CC1)N1CCC[C@H](CO)C1 1857697314 OXBYYDWDXBAKPL-ZDUSSCGKSA-N 377.872 2.929 0 50 GFAA Cc1cc(NC(=O)C(=O)N[C@@H](C)c2ccc(NC(N)=O)cc2)cnc1C(F)F 1875300103 LJVXSVZZTBZARU-JTQLQIEISA-N 391.378 2.634 0 50 GFAA Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N[C@@H]3C[C@H]4CNC[C@@H]3C4)c12 1875302092 ZMDRIONKVHPXNA-KCQAQPDRSA-N 381.505 2.733 0 50 GFAA O=C(Nc1cccc(-c2ncc3n2CCCC3)c1)C(=O)NC1[C@@H]2C[C@@H]2[C@H]2C[C@@H]12 1875307933 WTXRXQMYWIKUTM-BRSBDYLESA-N 376.460 2.596 0 50 GFAA Cc1cccc(OC[C@@H](O)CNC(=O)[C@@H](Cc2ccc(O)cc2)C(F)(F)F)c1 1875318103 FGNYTIHTHABJME-FUHWJXTLSA-N 397.393 2.978 0 50 GFAA CCOc1ccccc1C(=O)Nc1ccsc1C(=O)N=c1nc(C)[nH]n1CC 1875354773 OPVVMJBFDAAEFE-UHFFFAOYSA-N 399.476 2.993 0 50 GFAA CCc1nc([C@H]2OCC(=O)N(C(C)C)[C@@H]2c2ccccc2)n(-c2ccnn2C)n1 2100547554 KOOMWMJEAZMREI-UXHICEINSA-N 394.479 2.613 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)C[C@H]1O 2325786715 XQDBTSWBLKWBHT-GFOJFJKKSA-N 395.455 2.663 0 50 GFAA COCC1(NCc2coc(-c3ccc(Br)cc3)n2)CCNCC1 2325805012 JGULZYAOIJYDLC-UHFFFAOYSA-N 380.286 2.962 0 50 GFAA CC1(CC(=O)N2CC3(C[C@@H](NC(=O)c4ccoc4C4CC4)c4nccn43)C2)CC1 2332237738 JSQFSPQRBQBPNZ-MRXNPFEDSA-N 394.475 2.956 0 50 GFAA CCC[C@]1(C(=O)O)CCN(Cc2cc3cc(OCC)ccc3nc2O)C[C@H]1O 2356162286 GEQJYXGURNALML-NQIIRXRSSA-N 388.464 2.777 0 50 GFAA CC(C)CSc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccc(Cl)cc1 634897 OXEUSGKYASOZDF-UHFFFAOYSA-N 392.912 2.884 0 50 GFAA O=C(NCc1ccco1)c1ccccc1NC(=O)[C@H]1COc2ccccc2O1 798498 DPCOFDXRINTVHF-LJQANCHMSA-N 378.384 2.988 0 50 GFAA COc1cccc(CNc2nc3ccccc3n2CCN2CCOCC2)c1OC 809681 HXNOGRDINYYJLQ-UHFFFAOYSA-N 396.491 2.998 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1 1144975 XBOZHLZNFQKHAU-UHFFFAOYSA-N 389.477 2.667 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3Cl)CC2)cc1 1176419 UQGKPUWGNVFBCC-UHFFFAOYSA-N 378.881 2.795 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)Nc1cnn(Cc2ccc(F)cc2Cl)c1 2804923 NSVJQGFSLSTQRU-UHFFFAOYSA-N 383.836 2.865 0 50 GFAA CC(=O)N[C@@H](O[C@H](NC(C)=O)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 3123330 BWTSRGSOSAIODU-WDSKDSINSA-N 394.897 2.668 0 50 GFAA CC(C)[C@@H]1Cc2c(sc3c2-c2n[nH]c(=S)n2-c2nnc(S)n2-3)CO1 5899026 MUGLCSNKZBMAQY-ZETCQYMHSA-N 378.508 2.938 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NC3CCCC3)C2)cc1 6702071 MVKNMKDIMYOJTG-OAHLLOKOSA-N 380.510 2.545 0 50 GFAA COc1ccc(OC)c(NC(=O)CSc2nnc(-c3ccccn3)n2C)c1 6741862 HMRJJOLGRWBROI-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA CC1=NN(C(=O)[C@@H](C)Cn2nc(C(F)(F)F)cc2C)[C@](O)(C(F)(F)F)C1 6787450 LBJVAORUMNJEIL-JVXZTZIISA-N 386.296 2.706 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)NC[C@H]1Cc2cccc(-c3cnccn3)c2O1 11871910 YUNPGXANGDEONX-MRXNPFEDSA-N 389.411 2.535 0 50 GFAA CN1CCC[C@H]1CCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 11874299 KCQIBVCCGHXMSH-IBGZPJMESA-N 399.535 2.681 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)Cn1ccnc1 11936681 FSKAZFJMDYPRMU-HXUWFJFHSA-N 384.524 2.695 0 50 GFAA Cc1nnc(SCC(=O)N[C@H]2CCCN(C3Cc4ccccc4C3)C2)s1 12431544 UOTJKRCRNLULMI-INIZCTEOSA-N 388.562 2.687 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)C3=CCCCC3)C2)cc1 14961786 QASMMRIIKKBMBD-INIZCTEOSA-N 392.521 2.713 0 50 GFAA CN(CCCN1CCCCC1)C(=O)c1cn(Cc2cccc(Cl)c2)nn1 14976660 XHUNFJVPXCYWFR-UHFFFAOYSA-N 375.904 2.928 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)C(=O)c2ccco2)CC1 15063310 OERSCNQCKFCZJE-UHFFFAOYSA-N 384.476 2.884 0 50 GFAA COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ncn(Cc2cccc(C)c2)n1 20606544 VOTDYYFAUFCALZ-GOSISDBHSA-N 380.404 2.933 0 50 GFAA CNc1ncccc1CN1CCC2(CC1)c1ccccc1[C@@H](n1ccnc1)[C@@H]2O 20868877 GPISMYQJCODEHD-RTWAWAEBSA-N 389.503 2.818 0 50 GFAA Cc1cc(=O)[nH]c(-c2cccc(CN3CCN(C(=O)c4cccs4)CC3)c2)n1 20993017 GGHIZYYONXGKCL-UHFFFAOYSA-N 394.500 2.765 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NCc2ccc(F)cc2)CN1Cc1cccc(Cl)c1 32560961 NZBKIYGXADWCCZ-MOPGFXCFSA-N 375.875 2.958 0 50 GFAA O=C(Cc1n[nH]c(-c2cncc(Br)c2)n1)NCCc1cccs1 32605308 CVIFWCIGHVNSTH-UHFFFAOYSA-N 392.282 2.592 0 50 GFAA Cc1ccc(N2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)nn1 65365445 GETOPJAYMLUXLQ-UHFFFAOYSA-N 387.292 2.603 0 50 GFAA COc1ccccc1S(=O)(=O)N1CC[C@@](C)(O)[C@@H](Cc2ccccc2)C1 67434932 LEUPDWWLKXQZLD-FXAWDEMLSA-N 375.490 2.700 0 50 GFAA O=c1oc2ccccc2n1CCN1CCC(c2nnc3n2CCCCC3)CC1 67740910 YTFZAOWRBBRQTL-UHFFFAOYSA-N 381.480 2.792 0 50 GFAA O=C1O[C@@H]2CN(CCc3c[nH]c4ccccc34)C[C@@H]2N1CCc1ccccn1 67841843 QVQAPYTZHHRGPW-LEWJYISDSA-N 376.460 2.853 0 50 GFAA COC(=O)c1cccc(C(=O)N2CCC3(CC2)C(=O)N(C)c2ccccc23)c1 72163015 DIBMWBKKFYIQCH-UHFFFAOYSA-N 378.428 2.624 0 50 GFAA CCc1nccn1CC(=O)N1CCC[C@H](C(=O)c2ccc(OC)cc2OC)C1 72170465 JZGDBQCEJBENOE-HNNXBMFYSA-N 385.464 2.584 0 50 GFAA Cc1c(F)cccc1NC(=O)C[C@H]1COCCN1C(=O)Cc1cccs1 72475063 HYTLZZRHWZPZSH-AWEZNQCLSA-N 376.453 2.994 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)n[nH]1 91468387 TVJGUIXJBLQSFJ-AWEZNQCLSA-N 394.397 2.792 0 50 GFAA CN(CC(=O)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1)C1CCCC1 95354714 UEWGTDNRPFHCTI-MDNUFGMLSA-N 383.536 2.655 0 50 GFAA COc1cc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c(OC)cc1Cl 101576200 DDSKZNRHZAQHLF-RYUDHWBXSA-N 392.839 2.637 0 50 GFAA CCS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1 160629783 QSQNIHONOOVNKR-MRXNPFEDSA-N 391.493 2.510 0 50 GFAA O=C(c1cc(OCc2ccccc2)ccc1O)N1CCC(N2CCNC2=O)CC1 170634664 YJNWSKUANHHSHG-UHFFFAOYSA-N 395.459 2.601 0 50 GFAA Cc1csc(NC(=O)[C@@H]2CCCN(C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)C2)n1 170638281 AVINFTYNRVNRDH-BARDWOONSA-N 392.525 2.625 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)ccc1-n1cncn1 173149668 YHQGHIZRHYPRAY-UHFFFAOYSA-N 395.507 2.686 0 50 GFAA NC(=O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)C1 175408685 NTYHEHCJZVYIAI-HXUWFJFHSA-N 386.540 2.860 0 50 GFAA Cc1nccc(N2CCN(C(=O)Cc3csc(-n4c(C)ccc4C)n3)CC2)n1 184953409 JNEUYLDZBISAIA-UHFFFAOYSA-N 396.520 2.540 0 50 GFAA Cc1nn(-c2ccc(C(=O)N[C@@H]3C[C@@H]4OCC[C@@H]43)cc2)c(=O)c2ccccc12 222244802 HCXXJLSOYRJAAH-AQNXPRMDSA-N 375.428 2.601 0 50 GFAA Cc1nc([C@@H]2CCCCN2C(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n[nH]1 225502090 VTXKIOLYRRHIQX-OALUTQOASA-N 395.507 2.648 0 50 GFAA N[C@H]1CC[C@@H](C(=O)N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)C3)C1 247751521 STVNSLMVYWJXFC-FOPBSNOLSA-N 381.520 2.668 0 50 GFAA O=C(c1ccccc1)N1CCC(C(=O)N2CC[C@@H](Oc3ccccn3)C2)CC1 268676926 BZGAAYVFFBIVBN-LJQANCHMSA-N 379.460 2.614 0 50 GFAA CCC[C@@]1(CO)CCN(C(=O)C2CCN(C(=O)c3ccc(F)cc3F)CC2)C1 290548604 HOJJOAJNBTXCNM-OAQYLSRUSA-N 394.462 2.828 0 50 GFAA CC[C@H]1CCc2nc(NC(=O)[C@@H]3COCCN3CC(F)(F)F)sc2C1 332216185 WUVPVYWDHSVPMK-JQWIXIFHSA-N 377.432 2.860 0 50 GFAA C[C@H]1CN(c2ccccc2NC(=O)NC2(CO)Cc3ccccc3C2)C[C@H](C)O1 363130838 BIUQJCOPTLNQHM-IRXDYDNUSA-N 395.503 2.952 0 50 GFAA COc1ccc(NC(=O)CN2C[C@H](C)C(=O)N(C)c3ccccc32)cc1OC 363583426 ROLZRUNIJKXOJI-AWEZNQCLSA-N 383.448 2.761 0 50 GFAA NC(=O)c1ccc(NC(=O)N2CC[C@@]3(CCCN(Cc4ccccc4)C3)C2)cn1 378336232 QZSDNHGEWUJWSI-JOCHJYFZSA-N 393.491 2.701 0 50 GFAA Cc1c(Cl)cccc1CNC(=O)N1CCC2(CC1)CN(C)CCCN2C 534671787 ZKSGHPNCFXYEHW-UHFFFAOYSA-N 378.948 2.960 0 50 GFAA Cc1ccc2nc([C@H](NS(=O)(=O)c3cc(C(N)=O)cs3)C(C)C)[nH]c2c1 670454150 GCTWDHJMYVVIQJ-OAHLLOKOSA-N 392.506 2.707 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@]2(C(=O)O)CC[C@H]1CN2C(=O)OCc1ccccc1 710032102 LIIWKAFNCBXSHP-MGPUTAFESA-N 390.436 2.862 0 50 GFAA Cc1ccc(NC(=O)[C@@H](O)c2ccc(Cl)cc2)cc1S(=O)(=O)N(C)C 813363617 NJXGXMUSZIDOHQ-INIZCTEOSA-N 382.869 2.571 0 50 GFAA CCCS(=O)(=O)N1CCC(NC(=O)N[C@H](C)C2CCC(F)(F)CC2)CC1 847282718 YBAYRSZMJBISAJ-CYBMUJFWSA-N 395.516 2.704 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@@H]3CCN(C)C[C@@H]3c3cnn(C)c3)cc2)c1C 849596506 ORDZZMWGMQCYTP-NHCUHLMSSA-N 392.507 2.897 0 50 GFAA Cc1cc(CC(C)C)nc(N2CC[C@H](NCc3nc(-c4ccccn4)no3)C2)n1 952864904 NRVRNWPZSHWUTN-INIZCTEOSA-N 393.495 2.797 0 50 GFAA CCc1nc(C)c(C(=O)NCC2CCN(C(=O)c3ccccc3OC)CC2)o1 952972628 WEHYZKVGNLXGQI-UHFFFAOYSA-N 385.464 2.836 0 50 GFAA COc1cccc([C@H]2CCN(Cc3cnc(N4CCOCC4)s3)C2)c1OC 1506412329 WYYCIEFVYKGUBM-HNNXBMFYSA-N 389.521 2.986 0 50 GFAA C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)CCc1nc2ccccc2[nH]c1=O 1506414756 RVUHYEPMOPPXLR-CQSZACIVSA-N 393.443 2.847 0 50 GFAA COc1ccc(OCC2CCN(c3nccc(N4CCC[C@@H](O)C4)n3)CC2)cc1 1704358600 PDUDXKIVJDIVLB-GOSISDBHSA-N 398.507 2.742 0 50 GFAA CC(C)(CN1CCN(C(=O)c2ccco2)CC1)NC(=O)C(C)(C)C(C)(F)F 1775997929 VLHBUEUKQKLIFB-UHFFFAOYSA-N 385.455 2.614 0 50 GFAA Cn1c(CNC(=O)[C@]2(C)CC23CCNCC3)nc2cc(C(F)(F)F)ccc21 1857687481 SYWVFXLBQXQIPV-KRWDZBQOSA-N 380.414 2.988 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2c(F)cccc2Cl)N1CC1CCOCC1 1857705309 BPWIMOBGPVAOBV-HOTGVXAUSA-N 380.847 2.721 0 50 GFAA Cc1ccc(CN2C[C@@H]3[C@H](CNC(=O)c4cccnc4)[C@H]4CC[C@]3(C2)O4)s1 1857710300 PSIOBQBHGOBHJT-QEUVDIPISA-N 383.517 2.861 0 50 GFAA COc1cc(-c2nc(Cn3ccnc3-c3cccn(C)c3=O)c(C)o2)ccc1O 1857715799 IYZAVQSYMLMRDM-UHFFFAOYSA-N 392.415 2.975 0 50 GFAA CCCn1cc(CNC(=O)[C@H]2CC(=O)N(c3nc4ccccc4s3)C2)cn1 1857727536 SIWUAXUTGCHQHX-AWEZNQCLSA-N 383.477 2.572 0 50 GFAA CN(C)C1(CNC(=O)c2cc(Br)ncc2F)Cc2ccccc2C1 1875365260 VNTSIXHGSNDDDF-UHFFFAOYSA-N 392.272 2.812 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccccc1Oc1ccncc1 1875400496 BNFTZURYMUOIER-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccccc1-n1ccc(C2CC2)n1 1875400720 JLHDQETUMHYIGG-QFIXIFRTSA-N 391.475 2.516 0 50 GFAA CCC[C@@]1(CO)CN(C(=O)c2ccc(-c3noc(C(C)C)n3)cc2)CC[C@H]1O 2100544922 BFNNVHCVJNXVBF-UTKZUKDTSA-N 387.480 2.846 0 50 GFAA O=C(N[C@H](CO)c1ccccc1)c1ccccc1Cn1cc(-c2cccnc2)nn1 2325861355 NOWRJJCWLUSNNN-JOCHJYFZSA-N 399.454 2.852 0 50 GFAA COc1cc(C(C)=O)ccc1OC[C@@H](O)Cn1nc(C)c(Br)c1C 644408 PIAPEILCXSUDKS-AWEZNQCLSA-N 397.269 2.914 0 50 GFAA COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCc2ccc3c(c2)OCO3)cc1 844467 CPLVEVCCUOIRRT-IBGZPJMESA-N 396.399 2.795 0 50 GFAA CC(=O)Oc1cccc(/C=c2\sc3nc(-c4ccc(C)cc4)nn3c2=O)c1 1134015 QIPVOGIXQOVZBC-BOPFTXTBSA-N 377.425 2.599 0 50 GFAA COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC2CCCC2)cc(OC)c1OC 1189018 FJLZPVQCELLXMH-QGZVFWFLSA-N 390.436 2.826 0 50 GFAA COCCCNC(=O)/C(=C\c1ccc(OC)cc1)NC(=O)c1ccc(C)cc1 2707342 NSVJSHVVINUJSP-HMMYKYKNSA-N 382.460 2.927 0 50 GFAA COC(=O)c1ccc(N2CCOCC2)c(NC(=O)c2cccc(C)c2OC)c1 4710625 SPZFNPJECMZUSR-UHFFFAOYSA-N 384.432 2.879 0 50 GFAA O=C(Nc1cccc2cccnc12)c1cccc(N2C(=O)CCS2(=O)=O)c1 11998156 VFVCDSRRKQXCGR-UHFFFAOYSA-N 381.413 2.554 0 50 GFAA CCc1noc(C)c1C(=O)N1CCC(CCC(=O)NCc2cccnc2)CC1 12447858 PHKCYFHEDPEDKH-UHFFFAOYSA-N 384.480 2.889 0 50 GFAA Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)c2n[nH]c(=O)c3ccccc23)C1 12717136 NNFTXXMVTMTFFY-QHCPKHFHSA-N 391.471 2.689 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](NCCc1ccc(F)cc1)C2 14732456 WEGCKRMSKASTJM-GOSISDBHSA-N 384.499 2.875 0 50 GFAA CCN1CCN(C(=O)CCC2CCN([C@H](C)Cn3nc(C)cc3C)CC2)CC1 15062001 YMQGBTCJOKZBEB-HXUWFJFHSA-N 389.588 2.545 0 50 GFAA COc1ccc(CCN(C)[C@@H]2CCCN(Cc3ccc(CO)o3)C2)cc1OC 20293419 JKNGAENUPVBXPP-GOSISDBHSA-N 388.508 2.928 0 50 GFAA CCOC(=O)CC1(NC(=O)[C@@H](C)Oc2ccc3c(c2)OCO3)CCCCC1 20453698 OBJQHQZWGKIZBW-CQSZACIVSA-N 377.437 2.955 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)NC[C@H]3CCCO3)CC2)CC1 55182836 MPCXFRROFGMLFH-HSZRJFAPSA-N 399.579 2.967 0 50 GFAA CCn1nc(C(=O)N2C[C@@H](NC(=O)C3CC3)[C@H](c3ccc(C)cc3)C2)cc1C 77488242 PWIQHDNOTOXOCO-AZUAARDMSA-N 380.492 2.654 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3cnc(NCC)nc3)CC2)OC1=O 77504228 HLJUSGVLMXPBQE-UHFFFAOYSA-N 389.500 2.916 0 50 GFAA O=C1CC[C@]2(CCCN(c3ccc(-c4ccccc4)nn3)C2)CN1CCCO 82099321 YZLRKDLSJCPLSV-QFIPXVFZSA-N 380.492 2.735 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(CCOc1ccccc1)C2 95372009 PNJLKBQADBXZRH-XPNTWCBSSA-N 388.552 2.905 0 50 GFAA Cc1ccc(NC(=O)N[C@@H](C)Cc2ncccc2C)cc1NC(=O)CN(C)C 96137634 WLORNLCAFSHPIK-INIZCTEOSA-N 383.496 2.951 0 50 GFAA CCc1noc(-c2ccc(NC(=O)N3CCC[C@]4(CC3)CNC(=O)O4)cc2)n1 97468206 TUCHJLHSLXNPGD-IBGZPJMESA-N 385.424 2.795 0 50 GFAA CCn1nccc1C(=O)N1CCC2(CC1)c1[nH]cnc1CCN2CC=C(C)C 97480270 QHHQRGUSWLSKNG-UHFFFAOYSA-N 382.512 2.582 0 50 GFAA COc1c(Br)cccc1CCNC(=O)[C@H](C)NC(=O)c1ccco1 125197105 UBALMVNWDFOTNK-NSHDSACASA-N 395.253 2.528 0 50 GFAA CNc1nc(N2CCC(NC(=O)c3ccoc3C)CC2)ncc1Br 132324458 PQYVAVAVVZYJGI-UHFFFAOYSA-N 394.273 2.581 0 50 GFAA CCCOc1ccc(-c2nc(C(=O)NCCN3CCOCC3)cs2)cc1 133876160 TXZPGVDCBFLVKY-UHFFFAOYSA-N 375.494 2.661 0 50 GFAA CN(c1cccnn1)C1CCN(C[C@H](O)Cc2ccccc2C(F)(F)F)CC1 152932497 ASKNNQVRYMSQGS-QGZVFWFLSA-N 394.441 3.000 0 50 GFAA O=S(=O)(c1ccc(CN[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@@H]23)cc1)N1CCOCC1 165713215 AJDYMPQWJUBBCZ-BVJIBDCISA-N 390.549 2.622 0 50 GFAA Cc1ccc([C@@H]2NC(=O)N(CC(=O)Nc3ccc(F)cc3)C3=C2C(=O)OC3)cc1 169764773 QOVINZDEKOEIBG-IBGZPJMESA-N 395.390 2.650 0 50 GFAA COc1ccc(Cn2c(C3CCN(C(=O)c4ccccc4)CC3)n[nH]c2=O)cc1 169777242 NBDFDNBLIFSODD-UHFFFAOYSA-N 392.459 2.648 0 50 GFAA CC(C)c1ccc(/C=C/C(=O)N[C@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 170591866 RKKOTKLEDHZQIX-OUXAZZEQSA-N 377.506 2.676 0 50 GFAA COCCOc1ccc(S(=O)(=O)NCc2nc(-c3cccs3)c[nH]2)cc1 170619730 FSARBGBUALCZBW-UHFFFAOYSA-N 393.490 2.642 0 50 GFAA COc1cc(OC)cc(S(=O)(=O)N2C[C@@H](n3ccnc3)Cc3ccccc32)c1 178331081 DILYVWQTGNZQBW-INIZCTEOSA-N 399.472 2.893 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3cn(C4CCNCC4)nn3)CC2)cc1C 178430328 SWIVDSTZMMDMCJ-UHFFFAOYSA-N 383.496 2.503 0 50 GFAA CCc1nccn1[C@@H]1CCCN(S(=O)(=O)CCc2ccc3c(c2)CCO3)C1 189634905 PYQHGGAKXJKOLD-GOSISDBHSA-N 389.521 2.590 0 50 GFAA CN1CC[C@H]2[C@@H](CCCN2C(=O)NC2CCN(CCc3ccccc3)CC2)C1 246046660 XQEXVPXHJKDNJV-UNMCSNQZSA-N 384.568 2.819 0 50 GFAA O=C(CCn1cnc2ccccc21)N[C@@H](c1ccc2c(c1)CCO2)[C@H]1C[C@@H](O)C1 252553303 VJMDWGJUMYILLC-IXFSTUDKSA-N 391.471 2.990 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)CCCCN1C(=O)c2ccccc2C1=O 253430202 DWIMDOJGRVXNLA-UHFFFAOYSA-N 386.473 2.525 0 50 GFAA CS(=O)(=O)N1CCCc2cc(-c3nc(-c4ccc(CN)cc4)no3)ccc21 261985332 JRWCDRDMFSNMPV-UHFFFAOYSA-N 384.461 2.575 0 50 GFAA O=C1CCCc2nc(O)c(C(=O)N3CCNC[C@@H]3c3cccc(Cl)c3)cc21 262070797 SKEBQLKMJUPLDL-QGZVFWFLSA-N 385.851 2.746 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc(N2CCNC2=O)ccc1Cl 262424818 QXLMQWGUWWIXKB-RLCCDNCMSA-N 391.855 2.728 0 50 GFAA CCOc1cc(C(=O)N[C@H]2C[C@@H](OCC)C23CCC3)ccc1OCC(=O)O 268939134 IRPYGNMPBMJQTN-DLBZAZTESA-N 377.437 2.626 0 50 GFAA CCCOc1c(Br)cc(C(=O)N2CCC[C@@H]2C(=O)O)cc1OC 269093741 XLXDTIPSPZBYHN-GFCCVEGCSA-N 386.242 2.936 0 50 GFAA Cc1cc(C(=O)N2CC[C@@H]3OCc4cnnn4[C@H]3C2)c2cccc(Cl)c2n1 299763750 QRUXEGGSIKQBCG-IRXDYDNUSA-N 383.839 2.774 0 50 GFAA CCN1CCN(C2CCN(C(=O)N[C@H](C)Cc3ccccc3F)CC2)C1=O 374589954 CPALZNUILATFOE-OAHLLOKOSA-N 376.476 2.688 0 50 GFAA COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCCn1cccn1 409415072 SMIVRFQMPQEAJZ-VQTJNVASSA-N 376.545 2.793 0 50 GFAA biogenic Cc1ccn2cc(CNC(=O)N(C)C[C@@H]3CC(=O)N(C4CCCC4)C3)nc2c1 426428314 MHTCREIFQUJXPD-INIZCTEOSA-N 383.496 2.575 0 50 GFAA CO[C@@H]1CCN(C(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)C1 426517980 TWTMSYZKPHZJEF-CQSZACIVSA-N 375.494 2.772 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@H]3CO)csc2C1 426550692 XHUNJSGVAHDMPH-AWEZNQCLSA-N 375.494 2.508 0 50 GFAA O=C(NC1(CO)CCSCC1)c1cc(OC(F)F)cc(OC(F)F)c1 458077816 NZFVBDRBIYHIPB-UHFFFAOYSA-N 383.363 2.877 0 50 GFAA O=C(Nc1ccc2ncsc2c1)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@H]3C2)C1 888102292 PAFPWZRFHWKHRO-KBMXLJTQSA-N 399.520 2.646 0 50 GFAA CSCc1noc(CN2CCC(CNC(=O)c3sc(C)nc3C)CC2)n1 952974578 VBUMZYIPLGLYFK-UHFFFAOYSA-N 395.554 2.648 0 50 GFAA O=C(NCCN1N=C(c2ccccc2)CCC1=O)c1ccc(CN2CCCC2)o1 952983184 ITDVMSHXJBBAHD-UHFFFAOYSA-N 394.475 2.632 0 50 GFAA O=C(CCCc1cccs1)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@H](O)C1 1704299815 TUPOKWQQYCOWTK-WIYYLYMNSA-N 387.501 2.978 0 50 GFAA COc1ccccc1-c1ncc(CN(CCN(C)C)Cc2[nH]cnc2C)cn1 1704313091 NPVDRCHFQODGSG-UHFFFAOYSA-N 380.496 2.748 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(Cc3ccc4c(c3)OCCO4)C1)CC2 1704338050 KDRNZENIXWDGAI-QFIPXVFZSA-N 380.492 2.794 0 50 GFAA O=C(Cc1ccsc1)N1C[C@@H]2CN(Cc3ccccc3Cl)C[C@@]2(CO)C1 1772816049 FNHXKWBOYIELPX-PXNSSMCTSA-N 390.936 2.897 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCc3[nH]nc(C4CC4)c3CC2)cn1 1857671965 AJAQGQNTEZYCOO-UHFFFAOYSA-N 377.448 2.722 0 50 GFAA CCn1cncc1CNC(=O)C[C@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857700050 KKYHZLMLKQHKEU-OAHLLOKOSA-N 397.479 2.976 0 50 GFAA O[C@H]1CN(c2nnc(CC(F)(F)F)o2)C[C@H]1Cc1ccnc2ccccc12 1875241043 MQNBXPHBVGFWOT-DOMZBBRYSA-N 378.354 2.762 0 50 GFAA COCCn1nnc([C@H]2CN(Cc3ccccc3-c3ccccc3)CCO2)n1 1875249319 SQCPLWHKKCGPKY-HXUWFJFHSA-N 379.464 2.560 0 50 GFAA Cc1nc(-c2ccccn2)cc(=NC[C@@H]2CCCCN2C(=O)C(F)(F)F)[nH]1 1875266454 SUBAAPGPBPCYSA-ZDUSSCGKSA-N 379.386 2.624 0 50 GFAA Cc1cccc2cc(C(=O)N3CCc4c(cnn4C)[C@H]3C(=O)N(C)C)sc12 1875394784 WOJZGSYWXKWJSE-KRWDZBQOSA-N 382.489 2.771 0 50 GFAA CC(C)S(=O)(=O)CC[C@@H]1N=C([C@@H]2CCOC2)c2ccc(Cl)cc2NC1=O 2325796282 GLGOCGALWNVTFC-DOMZBBRYSA-N 398.912 2.700 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)NCc2ccc3c(c2)CCCO3)OCC(=O)N1C 2356152449 JOEPPKHXKCNVND-YADHBBJMSA-N 394.471 2.535 0 50 GFAA CCCN1C(=O)c2ccc(-c3nc4ccc(OC(C)=O)cc4c(=O)o3)cc2C1=O 1119759 HEZNHDXGESSFQV-UHFFFAOYSA-N 392.367 2.786 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(NC(C)=O)cc2)cc1 2832707 AZLQWDVVKVAMEP-UHFFFAOYSA-N 389.477 2.976 0 50 GFAA biogenic COc1cc(CN2CCC[C@@H](C(=O)N3CCCCC3)C2)cc(OC)c1OC 4745196 RZYNIPPEJBIZJE-QGZVFWFLSA-N 376.497 2.937 0 50 GFAA CCn1c(SCC(=O)N2CCOCC2)nnc1-c1cn(CC)c2ccccc12 4758201 BETNSWZAQQCDET-UHFFFAOYSA-N 399.520 2.891 0 50 GFAA CCOC(=O)CC1(NC(=O)[C@H](C)Oc2ccc3c(c2)OCO3)CCCCC1 20453700 OBJQHQZWGKIZBW-AWEZNQCLSA-N 377.437 2.955 0 50 GFAA Cc1ccc2[nH]c([C@H]3CCCN(C(=O)COc4ccc(C(N)=O)cc4)C3)nc2c1 120195137 WXVGIUYEPQDWJR-INIZCTEOSA-N 392.459 2.755 0 50 GFAA O=C(O)[C@H]1CN(C(=O)CCC(=O)N2CCc3sccc3C2)Cc2ccccc21 262189052 QWQIWMUCLUKJRC-KRWDZBQOSA-N 398.484 2.624 0 50 GFAA O=C(NC1CC1)c1noc([C@@H]2CCCN2Cc2ccn(-c3ccc(F)cc3)n2)n1 375277059 WXOXFHPWJPWRGE-KRWDZBQOSA-N 396.426 2.624 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1ccccc1-n1cncn1 72423718 VMBOGVSZJQTJGI-UHFFFAOYSA-N 386.459 2.929 0 50 GFAA Cc1nc(C2CC2)ncc1C(=O)N1CCOC[C@H]1CC(=O)Nc1ccccc1F 72428866 QITUAUIXMUZZPU-OAHLLOKOSA-N 398.438 2.671 0 50 GFAA CCc1ccc([C@H]2CN(C(=O)c3ccc(-n4nnnc4C)cc3F)CCO2)cc1 451149624 RMUIBUWCURDGCJ-HXUWFJFHSA-N 395.438 2.886 0 50 GFAA Cc1nn2c(ncc3c(=O)n(-n4cnnc4)ccc32)c1-c1ccc(Cl)cc1 40397639 MOOJZSFXZURHPO-UHFFFAOYSA-N 377.795 2.576 0 50 GFAA O=C(c1ccc(N2CCO[C@@H](c3ccc(Cl)cc3)C2)nc1)N1CCOCC1 71748462 LXFLXUZLZGQKQG-GOSISDBHSA-N 387.867 2.785 0 50 GFAA Cc1oc(-c2ccccc2)nc1CC(=O)N[C@@H]1CCCN(c2cnccn2)C1 220503716 VYUDHJIREAHKQQ-QGZVFWFLSA-N 377.448 2.768 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N(Cc1ccccn1)C[C@H]1CCCO1 426510896 VPWRYKDZJFNCCE-LJQANCHMSA-N 379.464 2.663 0 50 GFAA O=C1C[C@H](CNC(=O)N2CCC[C@@H]2c2ccncc2)CN1Cc1ccccc1 179304224 AIMYLUDYWKDEGE-UYAOXDASSA-N 378.476 2.977 0 50 GFAA C[C@H](C1CCN(C(=O)c2cc(COc3ccccc3)[nH]n2)CC1)N1CCOCC1 20999083 QTXCGKTYZPBOFQ-QGZVFWFLSA-N 398.507 2.562 0 50 GFAA O=C(O)Cn1nccc1[C@H]1CCCN(C(=O)Cc2c(F)cccc2Cl)C1 426415310 IKADPQTXEHVAHG-LBPRGKRZSA-N 379.819 2.709 0 50 GFAA Cc1nc(CCNC2CCN(c3ncnc4[nH]cnc34)CC2)sc1Cl 96151083 XSVHJOIXAGBXDB-UHFFFAOYSA-N 377.905 2.572 0 50 GFAA O=C(N[C@@H]1CCS(=O)(=O)C1)N1CCCC(c2ccccc2)(c2ccccc2)C1 91320038 QPRFTVSDMVQSTM-HXUWFJFHSA-N 398.528 2.965 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)NCC2(Cn3ccnc3)CC2)cc1Cl 97117018 ROQWNGNWTZJAID-UHFFFAOYSA-N 375.860 2.840 0 50 GFAA CCOC(=O)N1CCC[C@@H](CCC(=O)N2CCN(Cc3ccccc3)CC2)C1 95516985 LQMIUPYICVNSQY-FQEVSTJZSA-N 387.524 2.980 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@@H](C(=O)C(C)(C)C)N4N=CC=C[C@@H]4[C@@H]3C2=O)c(C)c1 253487325 IPZGPHQTJJWIDX-OWSLCNJRSA-N 379.460 2.633 0 50 GFAA C[C@@H](CN(Cc1ccccc1)C(=O)c1cc(N2CCNC2=O)ccc1F)C(=O)O 299749112 JGUZZIKTZFYZFV-AWEZNQCLSA-N 399.422 2.718 0 50 GFAA Cn1nc(C(F)(F)F)c2cc(C(=O)N[C@H]3C[C@H](c4cc(O)ncn4)C3)sc21 253535474 UJHPWTGSMQEYFK-ZKCHVHJHSA-N 397.382 2.825 0 50 GFAA Cn1cnc2ccc(NC(=O)CCCc3nc(O)c4ccccc4n3)cc2c1=O 252497751 QOZKEYGHZLUPFN-UHFFFAOYSA-N 389.415 2.544 0 50 GFAA COc1ccc(-c2ccno2)cc1S(=O)(=O)NCc1cn2ccc(C)cc2n1 670453176 UBTYZUPISAYCQX-UHFFFAOYSA-N 398.444 2.785 0 50 GFAA COc1ccc(NC(=O)COCc2nc(C)no2)cc1NC(=O)OC(C)(C)C 1875258507 GDOXVVDXLHCXCY-UHFFFAOYSA-N 392.412 2.889 0 50 GFAA CC(C)[C@H](Oc1ccc(Br)cc1)c1noc(Cn2ncnn2)n1 1875286335 QKAMKVXOIQJENQ-ZDUSSCGKSA-N 379.218 2.643 0 50 GFAA NS(=O)(=O)C[C@@H]1CCN(C(=O)c2ccc(Sc3ccccc3)cc2)C1 1875327218 PGUTUFSWTQISCE-CQSZACIVSA-N 376.503 2.588 0 50 GFAA Cn1c(N2CCN(c3ccc(C(F)(F)F)cc3)C(=O)C2)nc2cnccc21 1875331637 QSRVYORAGUIKGU-UHFFFAOYSA-N 375.354 2.840 0 50 GFAA COc1ccccc1-c1ccnc(C2CCN(C(=O)[C@@H]3C[C@]34CCNC4)CC2)n1 952894505 NNAZHTLNCAOPIW-MBSDFSHPSA-N 392.503 2.858 0 50 GFAA O=C(c1cnccn1)N1CCC(N2CCC([C@@H](O)c3cccs3)CC2)CC1 952986472 ZVXOWRJVLAMJRG-LJQANCHMSA-N 386.521 2.588 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCCN(c3ccncc3C)CC2)cn1 952991222 QQIBYYPIZZSBJY-UHFFFAOYSA-N 391.475 2.937 0 50 GFAA C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)N1CCC(c2ccncn2)CC1 886074534 LVOFVDDOGSJNCE-PXNSSMCTSA-N 394.523 2.671 0 50 GFAA O=C(CCCc1ccc2nc(O)[nH]c2c1)N1CCOc2ccccc2[C@H]1CO 887109936 WZDJRPLTKJZEGG-GOSISDBHSA-N 381.432 2.546 0 50 GFAA O=C(c1c[nH]nc1-c1ccccc1)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565510559 ZMCLVMJTPNUMBB-APWZRJJASA-N 380.492 2.792 0 50 GFAA CCCCN1CCOC[C@H]1C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1 170597864 KLFQGUNXOHLNLQ-SFHVURJKSA-N 396.553 2.839 0 50 GFAA CNC(=O)c1sc2nc(CCSc3ccc(OC)cc3)[nH]c(=O)c2c1C 170616533 ZJTGKFWYRGKHOW-UHFFFAOYSA-N 389.502 2.996 0 50 GFAA C[C@H]1CN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CCN1CCO 187291236 XJELTTGGIOMVHS-SFHVURJKSA-N 377.488 2.828 0 50 GFAA Fc1cc([C@@H]2CN(Cc3nnc4n3CCOC4)CCO2)c(Cl)cc1Cl 280998848 FVPULZQUGFQVKH-AWEZNQCLSA-N 387.242 2.828 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)N1CC2(CCOCC2)c2ccccc21 189791153 NESGEBYPTLWDRN-UHFFFAOYSA-N 394.471 2.910 0 50 GFAA Cc1ccc(C(=O)NC2CC2)cc1NC(=O)CN1C(=O)CCc2ccccc21 110222135 AHNHUVBTQYSUSJ-UHFFFAOYSA-N 377.444 2.805 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)N[C@H](c2ccccc2)C(C)(C)CO)ccc1C 225657879 DJLQDGJSEFZEJG-LJQANCHMSA-N 390.505 2.992 0 50 GFAA CCn1ccnc1[C@H]1OCCC[C@@H]1N[C@@H](C)Cn1cc(Br)cn1 190432537 BLHDQDSGHLCOHG-QEJZJMRPSA-N 382.306 2.760 0 50 GFAA CSC1(CNC(=O)[C@@H](Cc2c[nH]c3cc(F)ccc23)NC(C)=O)CCC1 194484012 GAYJNOXTCCVBHR-QGZVFWFLSA-N 377.485 2.756 0 50 GFAA C[C@@H]1C[C@@H](O)CN1C(=O)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 788345631 UDNNZEZCXQTVOS-GDBMZVCRSA-N 377.460 2.516 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccccc2Br)C(N)=O)cc1 1145077 MKTNTZKELBHDMX-XNTDXEJSSA-N 375.222 2.714 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CN(Cc3cnc[nH]3)C[C@]2(CCc2ccccc2)C1 1772808390 OWJAYHSFQZSHIU-NZQKXSOJSA-N 390.535 2.710 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1)[C@H]1CCCO1 11966098 VLRDVESDIFMCFM-IEBWSBKVSA-N 376.472 2.635 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(CCCc3ccccc3)CC2)O1)c1cnccn1 12213883 DTKHCFZHTDGRNX-HXUWFJFHSA-N 394.519 2.853 0 50 GFAA CNC(=O)c1cn(C2CCCCC2)cc(C(=O)NCCc2ccccc2)c1=O 12217578 XFOLTDJPGBQMNQ-UHFFFAOYSA-N 381.476 2.686 0 50 GFAA CC(C)Oc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NCCCO)cc1 12382747 QGARZDJIQPWIMJ-HMMYKYKNSA-N 382.460 2.743 0 50 GFAA biogenic O=C1CCC(C(=O)N2CCC[C@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)=NN1 12594385 SEZSUIXDVXXBDP-INIZCTEOSA-N 389.455 2.626 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(NCc3cnn(C)c3C)nc2)CCN1C(C)C 12716781 ADPLYPSLABGULH-IBGZPJMESA-N 384.528 2.680 0 50 GFAA COc1ccccc1-n1cc(CNC(=O)c2cn(C3CCCCC3)nn2)cn1 12718175 VGNXRONVNZROLV-UHFFFAOYSA-N 380.452 2.908 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2cccc(OC(C)C)c2)ccc1OC 13679927 CJCOATBFSQDQTM-UHFFFAOYSA-N 378.450 2.643 0 50 GFAA CN1CCC(N2CCN(C/C(Cl)=C/c3ccccc3)C[C@@H]2CCO)CC1 19226971 WGZAFJFJUYKEML-SACXWWFQSA-N 377.960 2.729 0 50 GFAA Cc1noc(C)c1C(=O)N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1 1857692510 INRWQOWQFCLPGQ-IXDOHACOSA-N 375.856 2.889 0 50 GFAA COc1ccccc1CN(Cc1ccncc1)C(=O)[C@H]1CC[C@@H](N)[C@H](OC)C1 1857707937 AKHPQZVHYBDSSM-FBBABVLZSA-N 383.492 2.761 0 50 GFAA Cc1cnc(CN2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)[nH]1 1857708900 SUOQVZZFLZJFBA-NRFANRHFSA-N 376.464 2.756 0 50 GFAA O=C(c1cnc2ccccc2c1)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857724019 ICZRDYCHXXQGMD-GMAHTHKFSA-N 394.446 2.802 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1 931379220 GTCCLFLSIRFRIK-SFHVURJKSA-N 388.512 2.591 0 50 GFAA COc1ccc(NC(=S)NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 881770 AXHJJMTWXKXSOJ-UHFFFAOYSA-N 376.434 2.848 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccccc1C(=O)O)c1cccc2ccccc12 2982576 FJPPVKUUHDUHBS-UHFFFAOYSA-N 398.440 2.943 0 50 GFAA COc1ccc(CCNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1OC 2998489 HICSMDPMDBUIQI-UHFFFAOYSA-N 376.840 2.963 0 50 GFAA CC(=O)N[C@H](O[C@@H](NC(C)=O)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 3123331 BWTSRGSOSAIODU-PHDIDXHHSA-N 394.897 2.668 0 50 GFAA Cc1cccc(NC(=O)N2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)c1 9875999 QXGZSUUAWHJXLT-IBGZPJMESA-N 381.432 2.511 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2ccc(N(C)CCC3CCOCC3)nc2)C1 20920777 OXUSAQJTUDQCSG-GOSISDBHSA-N 375.513 2.833 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccco3)n1)CCN(C(=O)[C@H]1CCCO1)C2 20601012 LQIKYYLNJYXBPC-MRXNPFEDSA-N 380.404 2.764 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)N1CCC[C@@H](c2nnc[nH]2)C1 252569082 VXWWGGDZCKRRML-OAHLLOKOSA-N 391.431 2.942 0 50 GFAA CCc1nc(NC(=O)Cn2nc(-c3cccc(OC)c3)ccc2=O)sc1C 61717926 VZTOICCJIXBECM-UHFFFAOYSA-N 384.461 2.885 0 50 GFAA CN(Cc1c(F)cccc1Cl)S(=O)(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 153361212 GFQIIPWDTGTLMN-KMUNFCNLSA-N 376.881 2.559 0 50 GFAA CCCS(=O)(=O)Nc1ccc(C(=O)Nc2cccc(C(C)=O)c2O)cc1 328596605 HNRFVBVVTVKJJL-UHFFFAOYSA-N 376.434 2.999 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@H](O)COCc2cccs2)n1C 328629623 IKPWLQGGXKCJTO-MAUKXSAKSA-N 391.537 2.551 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ncccc2O)CCC(=O)N1Cc1ccc(F)cc1 71759335 IDAPSAFAUHYXGT-QGZVFWFLSA-N 385.439 2.826 0 50 GFAA CCN(CC)C(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72131857 BKUAMDGKLQSHIZ-JOCHJYFZSA-N 393.531 2.877 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3cc(C(C)C)nc(N)n3)CC2)OC1=O 72473164 NRQGAINAATXMGG-CQSZACIVSA-N 389.500 2.798 0 50 GFAA O=C(N[C@H]1C[C@H]2CC[C@H]1C2)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 225267919 BTKKATXWCSPENV-WDSOQIARSA-N 376.522 2.533 0 50 GFAA Cc1scnc1CSc1nnc(C2CCNCC2)n1C[C@H]1CCCO1 426495897 YEBNJPWRHQMEQQ-CQSZACIVSA-N 379.555 2.981 0 50 GFAA Cn1nnc(-c2cccc(NC(=O)N3CCCC[C@H]3CCn3cccn3)c2)n1 426678250 YISDOZQVIMCEMY-KRWDZBQOSA-N 380.456 2.550 0 50 GFAA COCc1nc(NCc2ccc(-n3ccnc3C)cc2)cc(C2CC(N)C2)n1 222542641 ZPLDNBMAYXIYQZ-UHFFFAOYSA-N 378.480 2.934 0 50 GFAA NC(=O)c1ccc(N2CCCC2)c(NC(=O)c2ccnc(OC3CCC3)c2)c1 179462140 HYNJVLKIPFEYLG-UHFFFAOYSA-N 380.448 2.964 0 50 GFAA CCc1cccc(OCCCN(C)C(=O)[C@@H]2CCCN(C(=O)N(C)C)C2)c1 95385020 ZFPGULUPXOPUDI-GOSISDBHSA-N 375.513 2.870 0 50 GFAA CNc1cc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(OC)cc2)C3)ccn1 95382907 RWYKEJGXDXFPLB-PKOBYXMFSA-N 380.492 2.869 0 50 GFAA COc1c(F)c(F)c(CN2CC(=O)N(C)c3ccccc3C2=O)c(F)c1F 95522939 BAXSCJFFJRJMAV-UHFFFAOYSA-N 382.313 2.870 0 50 GFAA CC(C)[C@@]12O[C@H]3[C@H]4C[C@H]([C@H]3O)[C@@H](C(=O)N1c1ccc(Br)cc1)[C@H]42 238900252 IFAYFRXLRHFRHC-RKCAFXDWSA-N 378.266 2.790 0 50 GFAA CCCc1nc(C(=O)N2C[C@@H](NC(C)=O)[C@H](c3ccc(OC)cc3)C2)cs1 95520749 CNJXNOPORWIAEZ-DLBZAZTESA-N 387.505 2.849 0 50 GFAA CCc1cc(C(=O)N(CCc2ccccc2)CC2CCN(C)CC2)cc(=O)[nH]1 95527987 BYEVBLULFLQEGR-UHFFFAOYSA-N 381.520 2.964 0 50 GFAA NC(=O)Cn1ccnc1[C@H]1CCCN(C(=O)CCCc2ccc(Cl)cc2)C1 95510589 SVJOAUSQYJNUCX-INIZCTEOSA-N 388.899 2.751 0 50 GFAA O=C(Nc1ccccc1CN1CCOCC1)N1CCC[C@H](Cn2ccnc2)C1 96153811 JDXSSUMAIHXWNH-GOSISDBHSA-N 383.496 2.659 0 50 GFAA CCc1nc2n(n1)C[C@@H](NC(=O)c1ccc(OC)c(OC3CCCC3)c1)CC2 182437860 JFMRJAUXHCVRCV-HNNXBMFYSA-N 384.480 2.915 0 50 GFAA O=C(Nc1cc(-n2cnnn2)ccc1F)N1CCO[C@H](CCc2ccccc2)C1 184821793 KKPHXZNGSXKHJS-QGZVFWFLSA-N 396.426 2.667 0 50 GFAA COc1cc(NC2CCN(C(=O)c3cnccc3N(C)C)CC2)cc(OC)c1 183877943 IUTOGBUJTOHYIO-UHFFFAOYSA-N 384.480 2.882 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCc1nc(-c2cccs2)no1 299750506 NPRUJWGNLPAVCD-UPJWGTAASA-N 375.450 2.975 0 50 GFAA O=C(O)C[C@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccc(F)cc1 299750027 MLKLDDJTKXFQDJ-AWEZNQCLSA-N 392.818 2.815 0 50 GFAA CCN1CCN(C(=O)NC[C@@H](c2ccccc2C)N2CCC(C)CC2)CC1=O 534667670 ZAFYUKZANZQRCG-FQEVSTJZSA-N 386.540 2.642 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)cc1OC 263616162 HLOZUMTXSQBRAN-GOSISDBHSA-N 398.394 2.958 0 50 GFAA O=C(c1csc(-c2cccs2)n1)N1CCCN(C(=O)[C@H]2CCCO2)CC1 368908941 FUVMRXHTFCEUDV-CQSZACIVSA-N 391.518 2.725 0 50 GFAA O=C(NC[C@@H]1CCCN(c2ncccn2)C1)Nc1ccccc1-n1cccn1 299766354 NPFCSJDNLGPGIN-INIZCTEOSA-N 377.452 2.700 0 50 GFAA COc1ccc([C@H](C)N)cc1C(=O)N1CCO[C@H](COc2ccc(F)cc2)C1 1875315807 ILSZELMRCNMDJF-KSSFIOAISA-N 388.439 2.774 0 50 GFAA COc1ccc2nc(CN3CCN(c4ccc(C(=O)O)cc4)C[C@@H]3C)[nH]c2c1 1875312500 NASYTLIMCJNOAA-AWEZNQCLSA-N 380.448 2.980 0 50 GFAA C[C@H](CCNC(=O)NCc1cn(C2COC2)nn1)c1cccc(C(F)(F)F)c1 1875289033 PZMANPAMVALVRE-GFCCVEGCSA-N 397.401 2.861 0 50 GFAA CC(C)C[C@@H](CNC(=O)N(C)C[C@H]1CCS(=O)(=O)C1)Cc1ccccc1 1875295045 CLLGIXQJNHMXON-RTBURBONSA-N 380.554 2.968 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC(NC2CCC2)CC1)c1ccco1 1875271861 XXLZGFONDPFDCA-FQEVSTJZSA-N 395.503 2.754 0 50 GFAA Cc1nc(C(=O)N2CCC3(CC[C@@H](CNC(=O)c4ccco4)O3)CC2)cs1 952978149 KEOVKVNZNRUAKN-AWEZNQCLSA-N 389.477 2.628 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)COCc2nc3ccc(F)cc3[nH]2)CC1 952989854 YKKWQFFSNGKWHN-UHFFFAOYSA-N 397.454 2.661 0 50 GFAA CC(C)(C)c1oc(C(N)=O)cc1CN1C[C@@H]2CC[C@H]1CN(c1ncccn1)C2 1565514362 XJHQOKYCHUGIHV-HOCLYGCPSA-N 383.496 2.567 0 50 GFAA CC(=O)Nc1ccc(C)c(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)c1 275588172 ALSABMVKHBCNHG-UHFFFAOYSA-N 395.459 2.987 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2cccc(OCc3ccccn3)c2)cn1 275724791 ZFXVBIHGDRHAAD-IRLDBZIGSA-N 391.475 2.504 0 50 GFAA Cc1c(C(=O)O)cnn1-c1ccc(C(=O)Nc2cccc(-c3nnc[nH]3)c2)cc1 170671416 XNLLBIAEXXOBQC-UHFFFAOYSA-N 388.387 2.916 0 50 GFAA COC(=O)[C@H]1CSCN1S(=O)(=O)c1ccc(SC(F)(F)F)cc1 225547023 FQHSXOQWCWMMGK-SNVBAGLBSA-N 387.426 2.535 0 50 GFAA O=C1CCCCN1CCC(=O)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704298078 DFCVASNWQYGTLL-UHFFFAOYSA-N 395.503 2.961 0 50 GFAA O=C(COc1ccccc1)NC[C@H]1Cc2cc(F)cc(-c3cncnc3)c2O1 11995315 PFLPHMGMDMKBOK-GOSISDBHSA-N 379.391 2.781 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@@H](C(=O)c2ccc(OC)cc2C)C1 12204923 OEMXRMMJJZNKEK-OAHLLOKOSA-N 376.453 2.561 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)c1[nH]nc3c1CCCC3)CC2)[C@@H]1CCCO1 12317791 QJDSJOILTOPICB-IBGZPJMESA-N 394.475 2.605 0 50 GFAA CCOC(=O)C1(Cc2ccc(OC)cc2)CCN(C(=O)[C@H]2CCCO2)CC1 12459161 VGJYXPFJVQUTOJ-GOSISDBHSA-N 375.465 2.589 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCCc1ccccc1F)C2 14535206 WDZYXUQUVUKIIO-QGZVFWFLSA-N 384.499 2.968 0 50 GFAA Cc1c(CC(=O)N[C@H](C)Cn2cncn2)c2c(n1CC(C)C)CC(C)(C)CC2=O 15076985 WBWBSKYDQBZWEU-OAHLLOKOSA-N 399.539 2.947 0 50 GFAA COc1ccccc1N1CCN(CC(=O)Nc2nc3c(s2)CCCC3)CC1 16621913 YDVQFFZSGHPVMX-UHFFFAOYSA-N 386.521 2.791 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(Cc2ccc(Br)cc2)CC1 19790299 JNSBKOQOLAUURP-UHFFFAOYSA-N 395.322 2.956 0 50 GFAA COCCCN1CC[C@@H](O)[C@]2(CCCN(C(=O)c3ccccc3Cl)C2)C1 1857688181 WQUSXECJXUKVMU-UYAOXDASSA-N 380.916 2.666 0 50 GFAA Cc1cc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c2c(C)noc2n1 1857694770 XAIFRZGARJEUAC-ZIFCJYIRSA-N 392.459 2.784 0 50 GFAA O=C([C@@H]1CC(=O)N(c2cccc(Cl)c2)C1)N1CCc2[nH]nc(C3CC3)c2CC1 1857701654 XNUYTANVVMXUIJ-CQSZACIVSA-N 398.894 2.921 0 50 GFAA O=C(CCc1ccccc1)NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3 1857718237 PRPRHEPFSCNURY-JZJXAQOMSA-N 397.544 2.872 0 50 GFAA CN(C)C[C@H]1[C@H]2CN(C(=O)c3csc(-c4ccccc4)n3)C[C@]23CC[C@H]1O3 1857728838 OCUUUPAFISZZLS-LTVCHDBBSA-N 383.517 2.991 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CCOC2(CCOCC2)C1 1857730358 NUZHBHAKFHRAAE-CYBMUJFWSA-N 388.493 2.621 0 50 GFAA CCn1nccc1NC(=O)N1CCCCC[C@@H]1c1noc(-c2cnn(C)c2)n1 329513452 NVKBGCPDXWJYSI-CQSZACIVSA-N 384.444 2.836 0 50 GFAA O=C1CC[C@H](C(=O)NCC2(c3ccc(Br)cc3)CCCC2)CN1 151468070 LKZMZGKWAQZEAR-ZDUSSCGKSA-N 379.298 2.903 0 50 GFAA CCS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1 160629663 QSQNIHONOOVNKR-INIZCTEOSA-N 391.493 2.510 0 50 GFAA Cc1ccc2cnccc2c1NC(=O)C(=O)NCCc1ccc2c(c1)CCOC2 2325797826 WCRCOMNPKOOODE-UHFFFAOYSA-N 389.455 2.913 0 50 GFAA COc1cc(C(=O)NC(=S)Nc2ccc(C)cc2O)cc(OC)c1OC 1183280 ZIIHNIJGMXCXIA-UHFFFAOYSA-N 376.434 2.853 0 50 GFAA CC(C)(C)n1ccc(-c2nc(-c3ccccn3)nn2[C@@H]2CCS(=O)(=O)C2)c1 2356139687 HOFBORFKZITZIZ-OAHLLOKOSA-N 385.493 2.923 0 50 GFAA CC[C@@H](C)C(=O)NCc1ccnc(CNC(=O)c2cn3cc(Cl)ccc3n2)c1 2356141472 CQTSCRSZCDEWBM-CYBMUJFWSA-N 399.882 2.975 0 50 GFAA CC(C)CC[C@H]1[C@H]2C[C@H](CN(C(=O)c3csc(=N)[nH]3)C2)c2cccc(=O)n21 2356141642 KBECUUKSMWFQEW-KEYYUXOJSA-N 386.521 2.954 0 50 GFAA CCNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1c(C)cc(C)cc1C 2865950 YREGVAMTPXUHNU-UHFFFAOYSA-N 388.533 2.981 0 50 GFAA COc1cc(Nc2nccc(N3CCC[C@@H](O)C3)n2)c(Cl)cc1C(=O)O 2356167877 GYSPSGWXHGMVGD-SNVBAGLBSA-N 378.816 2.542 0 50 GFAA CCOc1ccc(N2C(=O)C[C@@H](N3CCC(N4CCCCC4)CC3)C2=O)cc1 4164071 YSABIJDLIQPKRJ-HXUWFJFHSA-N 385.508 2.668 0 50 GFAA CCc1n[nH]c(SCC(=O)Nc2ccc(I)cc2)n1 4811045 DZOVWUJWCJOIPD-UHFFFAOYSA-N 388.234 2.703 0 50 GFAA O=C(Nc1ccccc1C(=O)O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 4865398 TUPNHUTYYDQELT-UHFFFAOYSA-N 388.445 2.812 0 50 GFAA CN(C(=O)CCc1nc(-c2ccco2)no1)[C@@H]1CCN(c2ccccc2F)C1=O 112328156 AULFDRQBSDLHKN-OAHLLOKOSA-N 398.394 2.665 0 50 GFAA CN(C)C(=O)c1ccc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)cc1 113190562 NHJVKNJSMPNXDF-UHFFFAOYSA-N 394.475 2.730 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NC[C@@](C)(O)c1ccccc1 114546597 BUGHHVZGBHMNDN-AUSIDOKSSA-N 396.487 2.714 0 50 GFAA O=C(c1ccno1)N1CCC[C@]2(CCN(Cc3cccn3-c3cccnc3)C2)C1 67757242 BDDZOVTWDMYAHC-JOCHJYFZSA-N 391.475 2.989 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CCN(Cc1nc3ccccc3[nH]1)C2 20857608 ZSZPGWFUMDWKPS-UHFFFAOYSA-N 378.480 2.574 0 50 GFAA Cc1cc(C)c(-n2cccn2)c([C@H]2CC(=O)Nc3c2c(C)nn3CC(=O)O)c1 65526885 GUKACXAYTSVNGG-CQSZACIVSA-N 379.420 2.553 0 50 GFAA COc1ccc([C@H]2c3[nH]c4ccccc4c3C[C@@H]3C(=O)N(C)C(=S)N23)cc1O 22018294 KDBIECCTXGPLJB-BEFAXECRSA-N 393.468 2.955 0 50 GFAA O=C(C[C@H]1CCCN1C(=O)CN1C(=O)c2ccccc2C1=O)c1cccs1 122709175 PFESCZDMIIQJQD-CYBMUJFWSA-N 382.441 2.608 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNc2ncc(C(=N)O)cc2Cl)CC(=O)N1C 328611908 NCNKVPOFKPKJGJ-MEDUHNTESA-N 390.875 2.600 0 50 GFAA O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)N1CC[C@H](N2CCCC2)C1 151995108 ZWRIHNYOVYMBOQ-SFHVURJKSA-N 384.455 2.738 0 50 GFAA Cc1ccc(N2CC[C@H](NC(=O)c3cccc(-c4nnc(C)o4)c3)C2=O)cc1 173243579 QIGTUKCFZHUMCM-SFHVURJKSA-N 376.416 2.889 0 50 GFAA COc1ccc(C(=O)NCCNc2nc(C)cc(N3CCCCC3)n2)cc1OC 65365259 ICPSLTLIXAMMDV-UHFFFAOYSA-N 399.495 2.634 0 50 GFAA NC(=O)[C@H]1CCCN1C(=O)Cc1csc(-c2ccc(OC(F)(F)F)cc2)n1 71375797 GYUYJHDANBCRKI-CYBMUJFWSA-N 399.394 2.728 0 50 GFAA COc1ccc(F)c(CN2CCC3(CC2)C[C@H](C(=O)O)N(C(=O)C2CC2)C3)c1 72440387 ZAOPBFNEYHYLKW-GOSISDBHSA-N 390.455 2.512 0 50 GFAA C[C@H]1Cc2ccccc2N1CCNC(=O)NCc1ccnc(-n2ccnc2)c1 363454915 UVVLLQLPMQIGKM-INIZCTEOSA-N 376.464 2.518 0 50 GFAA CCCn1c(=O)n(CCC(=O)N2CCC[C@H](CCC(=O)O)C2)c2ccccc21 237013941 OSUMMBLICSNKKN-MRXNPFEDSA-N 387.480 2.707 0 50 GFAA O=C(c1cccs1)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71752195 IRIXKBIKZUMGJJ-MRXNPFEDSA-N 375.538 2.687 0 50 GFAA CN1CCC(NC(=O)C[C@@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71754438 BPCRUKXNYDPHMZ-XMMPIXPASA-N 391.515 2.744 0 50 GFAA CC(C)[C@@H]1CN(C(=O)CN2CCCC2=O)CCCN1Cc1ccc(F)cc1 71752041 KUJJNVJBCIHEGW-IBGZPJMESA-N 375.488 2.507 0 50 GFAA CC1(C)CN(C(=O)Cn2cc(NC(=O)C[C@@H]3C[C@H]3c3ccccc3)cn2)CCO1 375190644 GHKLDQSTHPDZDV-HKUYNNGSSA-N 396.491 2.653 0 50 GFAA Cn1nncc1CNC(=O)N1CCc2[nH]c3c(Cl)cc(Cl)cc3c2C1 377052001 QSBSZOKTRLSXCZ-UHFFFAOYSA-N 379.251 2.871 0 50 GFAA COc1cccc(C(=O)NCC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 290656050 NSBAGZJQIQRUFH-QGZVFWFLSA-N 398.463 2.829 0 50 GFAA COc1ccc(F)cc1-c1ccc(C(=O)NCCN2CCC[C@H](CO)C2)cc1 426563062 HCTFMUFNZOMYOL-INIZCTEOSA-N 386.467 2.935 0 50 GFAA Cc1n[nH]c(Cc2ccc(NC(=O)NCCc3noc(C4CCC4)n3)cc2)n1 96163387 BWBCPRAPXGYXBT-UHFFFAOYSA-N 381.440 2.719 0 50 GFAA COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@H]1C[C@H]1C(=O)O)CC2 268880524 DEFHSJCLNQXTIX-PMUMKWKESA-N 387.457 2.960 0 50 GFAA CCc1cccc(CC)c1NC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O 239433123 XFZPBVOYCCNMOD-FKAIMOKRSA-N 378.472 2.803 0 50 GFAA O=C(c1cnc([C@@H]2CCCO2)s1)N1CCC(CCCN2CCOCC2)CC1 180304546 SOMLOAHCYRLVBA-KRWDZBQOSA-N 393.553 2.959 0 50 GFAA O=C(c1cccc(Cl)c1)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95525717 WJXUTCRKJZBHOH-UHFFFAOYSA-N 398.894 2.989 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)N1CCC2(CC1)[C@@H](O)C[C@H]2O 91779381 XYQWZKZYWJARMT-OYRHEFFESA-N 381.472 2.542 0 50 GFAA O=C(c1ccccc1-c1ccccc1)N1CC[C@]2(CCCN(CCO)C2=O)C1 91997570 CTEZVDFERUHCNR-HSZRJFAPSA-N 378.472 2.801 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)C1 238089508 PKHISXPPSRZIQN-HZMBPMFUSA-N 385.247 2.531 0 50 GFAA COCc1ccc(C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2CC(=O)O)o1 299745952 UGEWFWIFLRBTIM-OAHLLOKOSA-N 389.404 2.658 0 50 GFAA COc1ccc(-c2ccccc2NC(=O)N2CCN3CCN(C)C[C@@H]3C2)cc1 299775403 JEICTXHFPIELAZ-GOSISDBHSA-N 380.492 2.826 0 50 GFAA COCCn1nc(C(=O)NC2(c3ccccc3OC)CC2)c2c1[C@H](C)O[C@H](C)C2 1875404022 QLTBSTOZQOTMMW-CABCVRRESA-N 399.491 2.979 0 50 GFAA CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@]2(c3cccnc3)C[C@@H]2C1 1875329250 MRXKTYIRPGBYMV-VIZSFHNOSA-N 393.487 2.929 0 50 GFAA COCCc1nsc(N2CC[C@H](N(C)C(=O)c3cnc(C(C)C)s3)C2)n1 1875312490 MZMXTVVCILGXBJ-LBPRGKRZSA-N 395.554 2.658 0 50 GFAA O=C(Cc1ccc(-n2cnnc2)cc1)OCc1nc(Cc2ccccc2)no1 1875340579 IZIZFHSATXHOTH-UHFFFAOYSA-N 375.388 2.527 0 50 GFAA Cc1cc(NC(=O)c2cc(-c3ccccn3)[nH]n2)ccc1NC(=O)CN(C)C 952990809 TXXACJVISLCZRK-UHFFFAOYSA-N 378.436 2.533 0 50 GFAA O=C(N[C@@H]1CCc2c[nH]nc2C1)N[C@@H]1CCCc2c1cnn2Cc1ccccc1 1319170008 DRJLBNIICDJAJP-IEBWSBKVSA-N 390.491 2.889 0 50 GFAA Cc1nc([C@H]2CCCN2S(=O)(=O)c2cnn(C3CCOCC3)c2)cs1 188007332 GHIYRUUUGGRKBB-MRXNPFEDSA-N 382.511 2.525 0 50 GFAA CCN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1 110815809 ZCCYNOFJQFVTNP-MRXNPFEDSA-N 376.476 2.624 0 50 GFAA Cc1nc([C@H]2CCCCN2C(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)n[nH]1 225502032 VTXKIOLYRRHIQX-RBUKOAKNSA-N 395.507 2.648 0 50 GFAA O=C(NC[C@H](c1ccc(Cl)cc1)N1CCOCC1)c1ccn(CC(F)F)n1 193937845 OHGXJDYLRGQKDP-MRXNPFEDSA-N 398.841 2.605 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@@H](CNC(=O)CN2CCCCC2)C3)n1 11979823 BFSYAJTYNGLCPO-MRXNPFEDSA-N 398.482 2.805 0 50 GFAA Nc1ncc(CN2CCC[C@H](CNC(=O)c3cccc4ccccc34)C2)cn1 12385911 JVTQNAKCOGOQDS-MRXNPFEDSA-N 375.476 2.854 0 50 GFAA O=C(N[C@H]1CCCN(c2ncccn2)C1)c1csc(Cc2ccccc2)n1 12433216 SYIRBFWZEUUBLU-INIZCTEOSA-N 379.489 2.923 0 50 GFAA Cc1c(CC(=O)N2CCOCC2)c2c(n1Cc1ccc(F)cc1)CCCC2=O 14981466 VJHXWUCDIOIRML-UHFFFAOYSA-N 384.451 2.904 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)cc(OC)c1 19840144 GFROITFONXIPGT-NRFANRHFSA-N 384.520 2.815 0 50 GFAA COc1ccc(Cl)cc1C(=O)NCc1nnc2cc(-c3nc(C)no3)ccn12 169776250 SXWPBTFJYSIVSO-UHFFFAOYSA-N 398.810 2.680 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCc4cn(C)nc4C)C3)nc2c1 1857671805 QVGNQUOJYCWQKK-HNNXBMFYSA-N 397.479 2.801 0 50 GFAA CCCc1cnc(C)nc1N1C[C@@H]2[C@H](CNC(=O)C3(C)CC3)[C@H]3CC[C@]2(C1)O3 1857711029 XUGQXUHZHPHKQA-KCXPTXFHSA-N 384.524 2.638 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857713307 USRZSLXBGSKUCW-UNMCSNQZSA-N 382.435 2.735 0 50 GFAA CN1CCC(Cn2ccnc2-c2cc3n(n2)CCCNC3)(c2ccccc2)CC1 1857729960 KUPIASFGFNMURH-UHFFFAOYSA-N 390.535 2.904 0 50 GFAA COc1ccccc1Cc1nc([C@H]2CC[C@@H](O)[C@H](N)C2)n(-c2ccncc2C)n1 1875241015 LJLHQOTWMOANIX-YQVWRLOYSA-N 393.491 2.526 0 50 GFAA Cc1ncn(C)c1C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 1875241096 PDRUHPZQBPLEBG-UHFFFAOYSA-N 383.496 2.642 0 50 GFAA O=C(Nc1ccc2c(c1)OCO2)N1CC[C@H](c2ccc3c(c2)OCO3)[C@@H](O)C1 210429730 AAHNBPZVSHGPSB-CABCVRRESA-N 384.388 2.526 0 50 GFAA O=C(NCc1ccccc1CN1CCC[C@@H]1CO)C1=Cc2cc(F)ccc2OC1 125126148 KQPVONJUYWCQQX-OAQYLSRUSA-N 396.462 2.875 0 50 GFAA Cc1nccnc1-c1cc(=O)[nH]c(-c2cccc(CN3CCSCC3)c2)n1 23310674 KXWMXZMLXSJWIA-UHFFFAOYSA-N 379.489 2.751 0 50 GFAA O=C1CN(Cc2ccccc2OCc2cccnc2)CCN1CC(F)(F)F 809711590 ZPTCZCGPVNGUHB-UHFFFAOYSA-N 379.382 2.867 0 50 GFAA Fc1cc([C@H]2CN(c3ccc(-c4nn[nH]n4)nn3)CCO2)c(Cl)cc1Cl 826372233 NPPBZBQXBWNHHG-CYBMUJFWSA-N 396.213 2.681 0 50 GFAA COc1ccc(-c2cc(C(=O)N[C@]3(C)CCO[C@@H]3C3CC3)nn2C)cc1OC 935367546 SHTWHCKHURMOPS-TZIWHRDSSA-N 385.464 2.792 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCc3ccc(O)nn3)C2=O)cc1 2100534521 MDNWQIYCPHXEGX-QFIPXVFZSA-N 394.475 2.611 0 50 GFAA CCOc1ccc(/C=C/C(=O)N[C@@H]2C[C@@H](Cn3ccnc3)C[C@H]2O)cc1OCC 2325786050 ZHZTUPRHVNJUCV-NHPSWGCTSA-N 399.491 2.650 0 50 GFAA CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccc(C(=O)O)cc2)c1 754870 YPIOGALIYXGWLF-UHFFFAOYSA-N 376.434 2.668 0 50 GFAA CCOC(=O)c1ccc(NC(=O)[C@H](CC)Sc2nc(C)cc(=O)[nH]2)cc1 818402 CFNDEWOSIJUMLA-AWEZNQCLSA-N 375.450 2.764 0 50 GFAA COc1ccc(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(C)=O)cc1OC 1061326 LHIDERXJRPKMPO-SFHVURJKSA-N 381.432 2.871 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2cc(Cl)c(C)cc2OC)CC1 1069744 PHEDXUZRUHNNIZ-UHFFFAOYSA-N 375.874 2.621 0 50 GFAA COC(=O)c1sc2ncccc2c1NC(=O)NS(=O)(=O)c1ccccc1 4054699 LICDYUVPDXBRCC-UHFFFAOYSA-N 391.430 2.593 0 50 GFAA O=C(O)CCN1C(=O)c2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2C1=O 4826915 NHIZKXWHZLKHNE-UHFFFAOYSA-N 386.791 2.592 0 50 GFAA CC(=O)c1ccc(N2CCN([C@@H]3CC(=O)N(c4ccc(C)cc4)C3=O)CC2)cc1 5091390 YOLCYEOWNQIZQS-OAQYLSRUSA-N 391.471 2.652 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3nc(C)c[nH]3)n[nH]2)c(Cl)c1 12317472 QALBVSPUOUEAMY-UHFFFAOYSA-N 389.843 2.954 0 50 GFAA CC(C)Nc1nc(NC(C)C)nc(Oc2ccc(=O)n(Cc3ccccc3)n2)n1 12382669 UILTYBUFAALDMD-UHFFFAOYSA-N 395.467 2.910 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2cccn2-c2cccnc2)C1)N1CCOCC1 12436262 JBAKRERPBXXYMU-IBGZPJMESA-N 382.508 2.723 0 50 GFAA O=C(NCCCc1ccccc1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12597196 HPCXLOISERVSPB-NRFANRHFSA-N 397.563 2.848 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCCc1cccc(F)c1)C2 14531486 NEWKNCMITHBGAF-SFHVURJKSA-N 384.499 2.968 0 50 GFAA CCn1cc(CN2CCC3(CC2)C(=O)N(Cc2ccccc2)C(=O)N3C)c(C)n1 14536062 HICLATXBMZMOQX-UHFFFAOYSA-N 395.507 2.640 0 50 GFAA COc1ccc(CN2CCC(n3cc(C(=O)NCC(C)C)nn3)CC2)cc1C 15067084 NJJJXGDBUICGSF-UHFFFAOYSA-N 385.512 2.818 0 50 GFAA O=C(c1nn2cccnc2c1Cl)N1CCN(Cc2ccc(Cl)cc2)CC1 20028601 AMLDWOHYTNFOMQ-UHFFFAOYSA-N 390.274 2.994 0 50 GFAA O=C1CC[C@@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)CN1CC1CCCCC1 20820902 DJTNUBFJIHLBND-LJQANCHMSA-N 399.535 2.860 0 50 GFAA Cc1cccc(Nc2nc(N)nc(CN3CCN(Cc4ccccc4)CC3)n2)c1 22708952 UQKLASFQGKFJOA-UHFFFAOYSA-N 389.507 2.824 0 50 GFAA Cc1oc(-c2ccccc2Cl)nc1CN1CCN(CC(=O)NC(C)C)CC1 23367743 WLJBKHSTFHYZMQ-UHFFFAOYSA-N 390.915 2.946 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)c2cnc(-c3cccnc3)nc2)C[C@H]1O 67920539 QCAUQWOTYPBIQH-IAGOWNOFSA-N 380.473 2.899 0 50 GFAA COc1ccc(F)cc1-c1cc(C(=O)O)cc(S(=O)(=O)N2CCCC2)c1 71750521 VLUYNMAJETVCPR-UHFFFAOYSA-N 379.409 2.984 0 50 GFAA COc1nc2c(cc1CNC1CCN(C(C)C)CC1)C(=O)N(C1CCCC1)C2 71775941 SUHWGTZIQIEXGN-UHFFFAOYSA-N 386.540 2.951 0 50 GFAA Cc1cc(=O)oc2cc(O[C@@H](C)C(=O)N3CCn4cncc4C3)c(Cl)cc12 72158426 LRDROPIGRRXYEE-LBPRGKRZSA-N 387.823 2.761 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(Cc2ccc(-c3cc[nH]n3)s2)CC1 72171582 YRNVWQPAEAFFTB-UHFFFAOYSA-N 388.518 2.645 0 50 GFAA COc1cc(CN2CCC3(CC2)Nc2ccccc2NC3=O)cc2c1OCO2 82148399 VLXXBKMDLJWSRP-UHFFFAOYSA-N 381.432 2.823 0 50 GFAA CSc1cccc(NC(=O)NCCNc2cc(-n3ccc(C)n3)ncn2)c1 82230580 ZYNWCURNHYJJCK-UHFFFAOYSA-N 383.481 2.926 0 50 GFAA CCS[C@@H](C)C(=O)N1CCC2(CCC(=O)N(Cc3cnc(C)cn3)C2)CC1 95356102 YYPZOIHYZUUFHS-INIZCTEOSA-N 390.553 2.658 0 50 GFAA O=C(CN1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N2)NCC1CCCCC1 95370444 DUDZVMGVCIDGEC-HXUWFJFHSA-N 383.536 2.821 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)CN3C(=O)CCc4ccccc43)CC2)n1 95524541 IWMIYYWCYPKFFX-UHFFFAOYSA-N 382.464 2.878 0 50 GFAA CCN(C(=O)c1ccc(NC(=O)NC[C@@H]2COCCO2)cc1)c1ccccc1 95526556 VAMYZGTUHXNORE-LJQANCHMSA-N 383.448 2.890 0 50 GFAA Cc1oc(CN(C)C(=O)[C@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)cc1C(=O)O 120743042 APLCRQFSDMRNGI-BBRMVZONSA-N 384.432 2.854 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[C@@H](Oc4cccnc4)C3)cn2)n1 127875774 YKUAKRPQRPLFSU-GOSISDBHSA-N 378.436 2.964 0 50 GFAA C[C@@](O)(CNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1 131044290 WZAFTGQCPCSTHK-FDDCHVKYSA-N 398.478 2.631 0 50 GFAA CC[C@H](NC(=O)c1nnn(C2CCNCC2)c1C)c1ccccc1OC(F)F 151553502 LGQKVUVNYWWQKL-HNNXBMFYSA-N 393.438 2.994 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4ccccc4F)nnc23)n1 169780592 BGIJOIYCKGZHAP-UHFFFAOYSA-N 380.383 2.801 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)cc1 174879444 PAPDVQNCOYOAEN-WOJBJXKFSA-N 387.501 2.960 0 50 GFAA Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NC1CCN(CCc2ccccc2)CC1 176012573 PXPMLVRJNNFURN-UHFFFAOYSA-N 396.535 2.813 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)C1CCN(c2ccc(Cl)cn2)CC1 238021854 GLSGUAJSANSXMY-GOSISDBHSA-N 399.878 2.990 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccccc2-n2cccn2)[C@H]2C[C@@H](O)C2)cn1 244840232 UJHLCVSSGFKEBQ-YRNRMSPPSA-N 378.432 2.518 0 50 GFAA O=C(c1ccc(F)cc1)N1CCC(C(=O)N2CCC3(CCNCC3)CC2)CC1 252506002 VVNFUOXNKHCSDL-UHFFFAOYSA-N 387.499 2.670 0 50 GFAA CCC[C@H](NCC(=O)Nc1nc(-c2ccc(OC)cc2OC)cs1)C(=O)O 263561898 CKQBGHABZWFTMI-ZDUSSCGKSA-N 393.465 2.609 0 50 GFAA Cc1nc2ccc(NC(=O)N3CCC[C@H](c4cc(C(N)=O)[nH]n4)C3)cc2s1 273381744 DVIOLZMEDFPVNX-NSHDSACASA-N 384.465 2.838 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)[C@H]1Cc3ccccc3O1)CC2 277783920 XUTZYLHUQNBLED-OXJNMPFZSA-N 397.427 2.608 0 50 GFAA Nc1ncncc1CNC(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 280573845 KPGQGAHHMFUCEE-UMSPYCQHSA-N 394.248 2.706 0 50 GFAA Cc1nc(CCN(C)C(=O)c2cnnn2-c2c(Cl)cccc2Cl)no1 286226686 NPWAUFOEMUYAGU-UHFFFAOYSA-N 381.223 2.580 0 50 GFAA CCN1CCC[C@@H](CN(C)C(=O)CC[C@@H]2CC[C@H](C)O2)[C@@H]1c1cnn(C)c1 328632135 RQCIMJXSOIDBNZ-MEZWHVQBSA-N 376.545 2.999 0 50 GFAA Cc1cc(F)cc(C(=O)N2CCC3(CC2)CN([C@@H]2CCSC2)CCO3)c1 825138987 GFOKXMPRCBYYHN-GOSISDBHSA-N 378.513 2.947 0 50 GFAA Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)C1 880985549 WPJWJVOLCUIPIY-AWEZNQCLSA-N 399.472 2.742 0 50 GFAA CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)Nc1cc(-n2ccnn2)ccc1F 888100911 ZXMVKNRHQUCARH-RHSMWYFYSA-N 384.415 2.729 0 50 GFAA Cc1ccccc1CN1C[C@H](c2cnn(C)c2)[C@@H](C(=O)N2CCOCC2(C)C)C1 888103622 QJNQFSPELSMUOU-RTWAWAEBSA-N 396.535 2.582 0 50 GFAA C[C@@H](CCC(=O)Nc1ccc(OC2CCN(C)CC2)cc1)N1CCN(C)CC1 952973784 HSXWCJMEQIGGOG-SFHVURJKSA-N 388.556 2.514 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCN(c3nsc4ccccc34)CC2)c1C 952978894 ZWWMJVKVOIAMEJ-UHFFFAOYSA-N 397.504 2.661 0 50 GFAA Cc1nn(C)c(C)c1[C@@H](C)N(C)S(=O)(=O)c1ccc2oc(=O)ccc2c1 1506418613 DVDIGVDFVNMOIB-CYBMUJFWSA-N 375.450 2.525 0 50 GFAA O=C(c1cncc(N[C@H](CCn2cncn2)c2ccccc2)n1)N1CCCC1 1529110277 KWRGVLKUHCQNTP-QGZVFWFLSA-N 377.452 2.548 0 50 GFAA COc1ccc(-c2cc(CNc3nccc(N4CCC[C@@H](O)C4)n3)no2)cc1 1704300916 ZKBKOPNVNMNGIY-MRXNPFEDSA-N 381.436 2.713 0 50 GFAA Cc1ncc(C)c(N2CC[C@@H](O)[C@]3(CCCN(C(=O)Cc4ccccc4)C3)C2)n1 1857691609 SDETZBNNKYFZDX-OFNKIYASSA-N 394.519 2.516 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N[C@H]4CC[C@H](O)CC4)C3)nc2c1 1857714005 HKCBXMNZYBFTFI-BZUAXINKSA-N 387.480 2.863 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4ccncc4)[C@H]4CC[C@]3(C2)O4)c(C)cn1 1857721975 AQGISLGYRJDWPI-XHYAQGIWSA-N 378.476 2.507 0 50 GFAA CCCC(=O)NC[C@H]1[C@H]2CN(c3noc(-c4ccccc4)n3)C[C@]23CC[C@H]1O3 1857733856 BOXOOZXOKPRFKM-BIZBXSGISA-N 382.464 2.637 0 50 GFAA CCC[C@]1(CO)CCN(C(=O)c2nc(-c3ccc(F)cc3)[nH]c2C)C[C@H]1O 1875248573 YHHUUPWCFSAUQZ-OXQOHEQNSA-N 375.444 2.510 0 50 GFAA C[C@@H]1C[C@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)CC(=O)N1 1875270417 JPXAYQHEUGFARX-BDAKNGLRSA-N 382.233 2.714 0 50 GFAA O=C(c1ccn(CCn2cccn2)n1)N1CCC[C@H](c2cc(O)cc(F)c2)C1 1875299522 NQRGIBNONQKVGO-HNNXBMFYSA-N 383.427 2.644 0 50 GFAA O=S(=O)(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1ccccc1C1CC1 1875398918 IZYNRKYOKUVOPN-CSMYWGQOSA-N 395.912 2.532 0 50 GFAA NC(=O)[C@@H](CC(=O)N[C@@H](CO)c1cccc(O)c1)c1ccc(Cl)cc1Cl 2325851145 QEAGIDJZUQKMHI-HOCLYGCPSA-N 397.258 2.508 0 50 GFAA Cc1ccn2cc(C(=O)N3CCC[C@]4(CCc5cnc(N(C)C)nc54)C3)nc2c1 2356153829 WUONURIJOMYNQB-QFIPXVFZSA-N 390.491 2.619 0 50 GFAA COc1ccccc1N1CCN(CCC(=O)Nc2ccc3c(c2)OCO3)CC1 895092 JHXAQQSRWIEIMW-UHFFFAOYSA-N 383.448 2.575 0 50 GFAA CC1=C(C(=O)OC(C)C)[C@H](c2cccc(Br)c2)n2nnnc2N1 4809939 YSRGMAKDQJLTTQ-ZDUSSCGKSA-N 378.230 2.676 0 50 GFAA C[C@@H](NC(=O)C1CCN(S(=O)(=O)N(C)C)CC1)c1ccc(C(C)(C)C)cc1 10276083 AQLDSMUWPXXPIB-OAHLLOKOSA-N 395.569 2.680 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 11710954 NZHSBZHGLUSYEL-OAQYLSRUSA-N 387.430 2.727 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)c1cn(CCc2ccccc2)nn1 12074577 HKIGYTMFAYZUQY-UHFFFAOYSA-N 389.503 2.915 0 50 GFAA COc1ccc(CNCCCSC)cc1OC[C@H](O)CN1CCCCC1 12112256 FSHBQUZVZFBDIE-GOSISDBHSA-N 382.570 2.764 0 50 GFAA CN(Cc1cnc2ccccn12)c1nc2nonc2nc1NCc1cccs1 12192758 QBBSTNBXIUQEEL-UHFFFAOYSA-N 392.448 2.971 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(N(CC)Cc3nccn3C)nc2)CCN1C(C)C 12313728 QWSXOVXOBYJCOX-IBGZPJMESA-N 398.555 2.786 0 50 GFAA O=C(NCc1ccccc1)c1cc(COc2ccc(-n3cncn3)cc2)on1 12747083 IHVFLRKHFXPNRW-UHFFFAOYSA-N 375.388 2.764 0 50 GFAA CCNC(=O)C1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)CC1 13679612 KQUGACMGADXDCB-UHFFFAOYSA-N 379.309 2.671 0 50 GFAA COC(=O)/C=C1/N=C(Nc2nc(C)cc(C)n2)N(c2ccc(C)c(C)c2)C1=O 17138148 OWMRWDGXQKFWPW-MHWRWJLKSA-N 379.420 2.582 0 50 GFAA O=C(c1ccc(N2CCSCC2)nc1)N1CCCC[C@H]1CCn1cccn1 19642149 CEUSOWQKGLMQSY-SFHVURJKSA-N 385.537 2.916 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN(c3ccc4nncn4n3)C2)cc1Cl 32106391 MJPNWCSXLWZLKB-GFCCVEGCSA-N 386.843 2.641 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccccc2F)CN1Cc1sccc1C 39388238 OYHPROPAMWCNJO-CJNGLKHVSA-N 376.453 2.742 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)c3ccc4c(c3)OCCO4)n2)c(F)c1 44891403 LEMSDWLLBOSTNI-UHFFFAOYSA-N 396.374 2.712 0 50 GFAA Cn1ncc(C(=O)N2CCC(O)(c3ccc(Cl)cc3)CC2)c1-n1cccc1 49546548 UDUOEFSQPIVUGB-UHFFFAOYSA-N 384.867 2.988 0 50 GFAA O=C1NCCN(Cc2ccc(Cl)c(F)c2)[C@H]1CC(=O)N1CCCCCC1 55341995 ZBXMGNROQRRWIJ-KRWDZBQOSA-N 381.879 2.572 0 50 GFAA CS[C@@H](C)Cc1c(-c2ccccc2)ncn1CCCN(CCO)CCO 65422557 MFDXOGLTGJRUOG-KRWDZBQOSA-N 377.554 2.521 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)n1 67601780 FLYXPRMKDFTEQC-UHFFFAOYSA-N 389.887 2.841 0 50 GFAA CNC(=O)CN(C)c1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cn1 67724953 PULTWQILKOAPRM-GOSISDBHSA-N 380.492 2.674 0 50 GFAA Cc1nccn1CCN(C)C[C@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67974249 MJQAXTBINLLQKB-HSZRJFAPSA-N 398.551 2.800 0 50 GFAA O=c1n(Cc2cccc(F)c2F)nc(C2CCNCC2)n1Cc1ccccc1 71405589 FBHOQUAYYMQQCZ-UHFFFAOYSA-N 384.430 2.887 0 50 GFAA Cc1ccc(C(=O)N2CCN(c3ccc(-n4ccc(C)n4)nn3)CC2)c(C)c1 72437781 CVPNGQMXRHAHOC-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA COc1cc(-c2nccn2[C@@H]2CCCN(c3ncccn3)C2)cc2c1OCO2 77564096 NUMXBRZNVJBMMI-OAHLLOKOSA-N 379.420 2.919 0 50 GFAA Cc1ccccc1C(=O)N1CCN(c2cc(-n3cnc(C)c3C)ncn2)CC1 82230565 IZNJTSNOGPPAOR-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CN(C(=O)CN1CC[C@]2(CCCN(CC3CCC3)C2=O)C1)C1CCCCC1 91518575 GYEVYALCYYBJHH-JOCHJYFZSA-N 375.557 2.892 0 50 GFAA COCCCN(Cc1ccc(C)cc1)C(=O)[C@H]1CCCN(C(=O)N(C)C)C1 95382160 RRQUMRCTTAPWIE-IBGZPJMESA-N 375.513 2.754 0 50 GFAA CNCC(=O)N1CCC(CCC(=O)NCc2cccc(C(F)(F)F)c2)CC1 95516645 RZIWCYQNRCBDAW-UHFFFAOYSA-N 385.430 2.560 0 50 GFAA CN(C)C(=O)N1CCC(CCC(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1 95527624 UWFJERIUWSCINW-FQEVSTJZSA-N 386.540 2.551 0 50 GFAA Cc1ncncc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3ccccc3)C2)C1 95528811 IWUAFTKVGFXPHX-QHCPKHFHSA-N 392.503 2.873 0 50 GFAA CCNC(=O)[C@@H]1C[C@H](NC(=O)CCc2ccccc2)CN1Cc1ccccc1 96139745 RPPKVBHTLFPVPQ-SFTDATJTSA-N 379.504 2.515 0 50 GFAA O=C(O)c1cc(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)ccc1NCc1cccnc1 100582027 PMIVVJRCJYEVKM-IYBDPMFKSA-N 377.400 2.848 0 50 GFAA COC(=O)c1ccc(NC(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)cc1 100613783 BASZDTQMIDQKEX-UHFFFAOYSA-N 378.384 2.692 0 50 GFAA biogenic COc1ccc(/C=C/CN2CCN(Cc3cccc(C)n3)[C@H](CCO)C2)cc1 105277301 ARQZKKFTOZQFAM-UKKYDJSUSA-N 381.520 2.981 0 50 GFAA C[C@H](NC(=O)c1n[nH]c2ccccc2c1=O)c1cccc(N2CCCC2=O)c1 111582814 XVWFRLCPXRJQHV-ZDUSSCGKSA-N 376.416 2.541 0 50 GFAA O=C(c1ccc(S(=O)(=O)C(F)F)cc1)N1CCN(c2cccs2)CC1 156509448 FMVSWBQCCNPDSK-UHFFFAOYSA-N 386.445 2.707 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1cc3ccccc3c(OC)n1)C[C@@H]2O 169966993 FXQKZFISQVHAGK-KRWDZBQOSA-N 394.427 2.950 0 50 GFAA CO[C@H](CNC(=O)N1CCC(NC(=O)c2ccoc2C)CC1)c1ccccc1 171165053 IFFMIYZQLVKLTA-LJQANCHMSA-N 385.464 2.880 0 50 GFAA CCCn1c(NC(=O)c2cc(S(=O)(=O)NC)oc2C)nc2ccccc21 175875582 QMYZSNYOAKBFML-UHFFFAOYSA-N 376.438 2.508 0 50 GFAA COC(=O)C[C@@H](c1ccc(OC)cc1)c1c(O)n2cc(Cl)ccc2nc1=O 205954067 ICYOUTVQXFMTHK-AWEZNQCLSA-N 388.807 2.757 0 50 GFAA Cc1nn(-c2ccc(C(=O)N(C)C[C@@H]3CCCO3)cc2)c(C)c1CCC(=O)O 237230265 IUZJLCKBOZSOIL-SFHVURJKSA-N 385.464 2.757 0 50 GFAA O=C(O)CCN(C(=O)CCc1ncc(-c2ccccc2F)o1)C1CCOCC1 238064582 JFVBKFJLBIYDGK-UHFFFAOYSA-N 390.411 2.896 0 50 GFAA O=C(O)CCC/C=C/C[C@@H]1[C@H](O)C[C@H](O)[C@@H]1/C=C/[C@@H](O)COc1ccsc1 245204672 FYBFDIIAPRHIQS-GFSYJYLESA-N 396.505 2.603 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(C(=O)[C@H]2CCO[C@@H]2c2cnn(C)c2)CC1 275357451 VTLMJKALHFNPBS-PKOBYXMFSA-N 388.899 2.808 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OC4CCCC4)c(F)c3)C(=O)[C@@H]2C1 278264730 YCARLYMICNIYPI-WBMJQRKESA-N 390.411 2.867 0 50 GFAA O=C(O)CCN(C(=O)COc1cccc(C(F)(F)F)c1)C1CCOCC1 408513270 JOOBNMXJIGPRSB-UHFFFAOYSA-N 375.343 2.567 0 50 GFAA CCn1cc(CN(CCOC)C(=O)NCc2nc3c(s2)CCCC3)cn1 426519343 WAWZWPNIHRAIDM-UHFFFAOYSA-N 377.514 2.597 0 50 GFAA Cc1noc2nc(C3CC3)cc(C(=O)NCCc3noc(C(F)(F)F)n3)c12 426534096 RZQMDGMZXXLLGE-UHFFFAOYSA-N 381.314 2.783 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)N1CCCC[C@@H]1CN1CCCC1 426566846 GEWHBSSLRFUOCN-MRXNPFEDSA-N 379.526 2.881 0 50 GFAA CCOc1ccccc1CCNC(=O)N1CCC[C@H](C(=O)c2nccn2C)C1 426661381 UHODRJLZTIQMLT-KRWDZBQOSA-N 384.480 2.666 0 50 GFAA COc1ccccc1CN(C(=O)NC[C@H](C)N1CCOCC1)C1CCCC1 584889455 VIKZDQWUUPNQIH-KRWDZBQOSA-N 375.513 2.870 0 50 GFAA O=C(c1ccccc1Cn1cncn1)N1CC[C@H](Oc2ccc(C3CC3)cn2)C1 858077154 KGZICTXTNXBGBE-IBGZPJMESA-N 389.459 2.892 0 50 GFAA Cc1ncnc(N2CCN(Cc3ccccc3OCCn3ccnc3)CC2)c1C 952977112 OUPWJHQVYKBNON-UHFFFAOYSA-N 392.507 2.691 0 50 GFAA COC[C@@H]1CCCN(S(=O)(=O)N(Cc2ccc3[nH]ccc3c2)C2CC2)C1 1506422252 NFGNYSGMNLLZES-MRXNPFEDSA-N 377.510 2.736 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(CCCOc3ccc(C(N)=O)cc3)C1)CC2 1704312613 VZAXECLRNYKCIB-JOCHJYFZSA-N 380.492 2.633 0 50 GFAA CC(C)NC(=O)c1cc2c(s1)CCOC21CCN(C(=O)c2ccc[nH]2)CC1 1857683441 GOSAOEYPJLUZDA-UHFFFAOYSA-N 387.505 2.919 0 50 GFAA CCCCc1ncc(CN2C[C@@H]3COC[C@]3(C(=O)NCC3=CCCCC3)C2)[nH]1 1857691702 XDVDFJCQKWCXPH-XMSQKQJNSA-N 386.540 2.817 0 50 GFAA O=C1CC2(CCN(CCC(F)(F)F)CC2)OCCN1C[C@@H]1CCCCO1 1857691903 GBFYNSJUKBWUBW-HNNXBMFYSA-N 378.435 2.591 0 50 GFAA Cc1ccc(-c2cc(C(=O)N[C@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)n[nH]2)o1 1857716563 ARDKMWRZIKYAEK-XGHQBKJUSA-N 392.459 2.922 0 50 GFAA O=C(c1cccc2ncsc12)N1CCN(Cc2ccc3c(c2)OCO3)CC1 1866345099 MPQPTSFHTUEUDJ-UHFFFAOYSA-N 381.457 2.983 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=O)N[C@@H]2C[C@H](C)c3ccccc32)C1 1875255021 JFDPGHJAVZLCOZ-JFTQMJAMSA-N 392.463 2.844 0 50 GFAA CCn1c(=O)c(=O)n(CC(=O)N2c3ccccc3[C@H](C)[C@H]2C)c2ccccc21 1875281055 NIWQHKNNQLQASE-HUUCEWRRSA-N 377.444 2.722 0 50 GFAA Cc1cc(C)cc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875301588 OUYOHMZICJZNSC-LJQANCHMSA-N 381.524 2.781 0 50 GFAA NCc1ccoc1C(=O)N(CCc1ccc(Cl)cc1)C[C@@H](O)C(F)(F)F 1875315373 REOPQMBNJJFOPJ-CQSZACIVSA-N 390.789 3.000 0 50 GFAA CC(C)(C)OC(=O)N1CCC(NC(=O)c2cc(C(F)(F)F)ncc2N)CC1 1875329294 OZPFZTABCMYWNZ-UHFFFAOYSA-N 388.390 2.812 0 50 GFAA C[C@H]1CN(C(=O)c2cnc3cc[nH]c3c2)CC[C@@H]1NC(=O)c1coc(C2CC2)n1 1875333659 GLSBMFSATUDKBC-WFASDCNBSA-N 393.447 2.709 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCOc3ccc(Br)cc32)CC1 2325885443 LYOXKOOLMZCNNJ-UHFFFAOYSA-N 379.254 2.599 0 50 GFAA CCC(C)(CC)C(=O)N1CC2(C[C@H](NC(=O)c3c(C)noc3C)c3nccn32)C1 2332237880 PSDGPAUWCAFCHE-HNNXBMFYSA-N 399.495 2.727 0 50 GFAA Cc1cccc(-c2noc(CCC(=O)N3CCC[C@]34CCCN(C)C4=O)n2)c1 2356135432 DVNXGBTXEJIEQS-NRFANRHFSA-N 382.464 2.591 0 50 GFAA Cc1cc(=O)oc2cc(OCC(=O)Nc3nnc([C@@H]4CCCO4)s3)ccc12 959142 JIKXROFULWIXNB-ZDUSSCGKSA-N 387.417 2.822 0 50 GFAA biogenic CCc1ccccc1N(CC(=O)NCc1ccc(Cl)cc1)S(C)(=O)=O 2982122 BIULEGHUOBSPQG-UHFFFAOYSA-N 380.897 2.985 0 50 GFAA O=C(c1cc2nc(C3CC3)cc(C(F)(F)F)n2n1)N1CCC2(CC1)OCCO2 4820999 BASKUVOVPOIOSS-UHFFFAOYSA-N 396.369 2.605 0 50 GFAA COc1ccc(C(=O)N(Cc2ccc(F)cc2)[C@H]2CCS(=O)(=O)C2)cc1 4855526 RIGOGORIHFLUFS-KRWDZBQOSA-N 377.437 2.664 0 50 GFAA O=C(CCc1ccccc1)N1CCN(c2ccc(Nc3ccccn3)nn2)CC1 11697517 WZEJIYNQSMOVES-UHFFFAOYSA-N 388.475 2.897 0 50 GFAA O=C(CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1)NCc1ccco1 12323528 WZXMNOGZSDGIJH-UHFFFAOYSA-N 386.839 2.798 0 50 GFAA O=C1[C@H]2CCCC[C@@H]2C(=O)N1c1ccc(S(=O)(=O)N2CCCCC2)cc1 12374520 QDJPHNGEQDEMOF-IRXDYDNUSA-N 376.478 2.541 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1ccc(F)cc1 12382683 XJTOZJAEUQGOBW-WIRSXHRWSA-N 394.439 2.769 0 50 GFAA CCOc1ccc(/C=c2\sc3n(c2=O)CN(c2ccc(C)cc2)CN=3)cc1 13785684 KTUAVOMCJGKOKB-UNOMPAQXSA-N 379.485 2.501 0 50 GFAA O=C(CC[C@@]1(Cc2cccs2)CCC(=O)N1)NCc1ccc2c(c1)OCO2 14960954 BBFXWAJTSQKODF-FQEVSTJZSA-N 386.473 2.765 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nc1ccncc1 16607437 YEQOWECSFLFALY-UHFFFAOYSA-N 375.450 2.517 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccccc1)CC2 20762220 TWAXKVFHZBGLEJ-AVRDEDQJSA-N 394.471 2.808 0 50 GFAA biogenic Cc1cccc(CN2CCc3nnc([C@@H](C)NC(=O)c4ccco4)n3CC2)c1 20911356 OHGNPESXKXIDAV-MRXNPFEDSA-N 379.464 2.729 0 50 GFAA CN1C(=O)N(C)C(=O)C(CC(=O)c2ccccc2)(CC(=O)c2ccccc2)C1=O 22205554 XWSYSSVEQJSQCO-UHFFFAOYSA-N 392.411 2.569 0 50 GFAA COc1ccc(-c2noc(CN3CCC(N4C[C@H](C)O[C@H](C)C4)CC3)n2)cc1 23130266 BVQMMWQQIANTDR-IYBDPMFKSA-N 386.496 2.819 0 50 GFAA C[C@@H](NC(=O)Nc1nnc(C(F)(F)F)s1)c1nc(-c2ccncc2)no1 23340457 BLUACOXLHLPVPS-ZCFIWIBFSA-N 385.331 2.885 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)C[C@@H]2CCCCO2)n1Cc1ccccc1 55226806 TUACVRZOGDRKKM-IBGZPJMESA-N 391.537 2.726 0 50 GFAA Cn1nc(-c2ccccc2)c2c1NC(=O)C[C@H]2c1cccnc1N1CCOCC1 65386679 UACAPFVMFCEDLY-KRWDZBQOSA-N 389.459 2.793 0 50 GFAA Cc1nc2ncccn2c1C(=O)N(C)[C@@H]1CCCN(C2Cc3ccccc3C2)C1 67742648 VTDQIVSYQQWAFA-LJQANCHMSA-N 389.503 2.742 0 50 GFAA C[C@@H]1CN(Cc2c(C(=O)N(C)Cc3ccccc3)nc3ccccn23)CCN1C 71440547 VSKYVHVYBJDLOZ-GOSISDBHSA-N 391.519 2.742 0 50 GFAA CC(C)[C@@H]1CN(CC(=O)NC(C)(C)C)CCC(=O)N1Cc1ccc(F)cc1 71746469 UKKFJYQDZKHVSE-SFHVURJKSA-N 377.504 2.799 0 50 GFAA CC(C)=CCC/C(C)=C/CN1CCCn2nc(CNS(C)(=O)=O)cc2C1 82166742 BFSCOQNCEVDBQY-RQZCQDPDSA-N 380.558 2.831 0 50 GFAA O=C(COCc1nc2ccccc2[nH]1)N1CC[C@H](Cc2cccc(CO)c2)C1 91876836 BSZNZDFSKPAXDJ-QGZVFWFLSA-N 379.460 2.663 0 50 GFAA O=c1ccc(-c2ccccc2)nn1CCn1cc(-c2ccc(Cl)nc2)nn1 91973829 NJQNSKVGSJGPBK-UHFFFAOYSA-N 378.823 2.917 0 50 GFAA CCc1cc(C(=O)N2CCC3(CCC(=O)N(CCc4cccnc4)C3)CC2)no1 92004037 HLNCFUHDVWXYMC-UHFFFAOYSA-N 396.491 2.720 0 50 GFAA COc1ccc([C@@H]2CN(c3cc(C(=O)NC4CC4)ccn3)C[C@H]2N(C)C)cc1 95364564 PDITXMQNKWRYBO-VQTJNVASSA-N 380.492 2.516 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1cccc(Cl)c1)CC2 95497201 GCNQKCNQCQECGF-UHFFFAOYSA-N 386.883 2.989 0 50 GFAA Cc1ccc(C)c2c1NC(=O)[C@H]2CC(=O)NCc1ccccc1-n1cncn1 102750881 GKSAHGVVZIQHEF-INIZCTEOSA-N 375.432 2.626 0 50 GFAA Cc1cnccc1NC(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C 121624021 ZVOFDPKOUPVZNN-UHFFFAOYSA-N 376.482 2.789 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)[C@H]2CCCN2Cc2ccccc2)cn1 122078166 CHGPMRUXZUJKBZ-HXUWFJFHSA-N 375.476 2.857 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N3CCN(C4CCOCC4)CC3)cc2F)n1 175864483 NHLWTHOWCHUKBD-UHFFFAOYSA-N 386.471 2.565 0 50 GFAA O=S(=O)(N[C@@H]1CCCN(c2ccccc2F)C1)c1ccc2c(c1)OCO2 183183743 UGJSJUOXICRTRY-CYBMUJFWSA-N 378.425 2.502 0 50 GFAA O=C(O)[C@H]1Cc2ccccc2CN1C(=O)CCc1nc(-c2cccs2)no1 238027687 SDDYLLYJGXNAOI-CQSZACIVSA-N 383.429 2.769 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cc1c[nH]c2ccccc12 247956649 VTIAEDWOARXBNT-AEFFLSMTSA-N 388.471 2.869 0 50 GFAA CC(C)c1ccc(-n2cnnc2SCC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)cc1 249628238 UNRBRRQYWANZOD-JGKKSEDXSA-N 398.532 2.711 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1)c1noc2c1CCCC2 262429411 JCLYUGNNSJEYBN-MRXNPFEDSA-N 397.431 2.885 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNC/C=C/c2ccc(C#N)cc2)CC(=O)N1C 328619906 GKDNLKGUDAVMNV-BUAGJPILSA-N 377.492 2.731 0 50 GFAA Cc1nc(C)c(C(=O)N2CCCN(C(=O)c3cc(Cl)cn3C)CC2)s1 368885824 QKYJPZCNCZHBEG-UHFFFAOYSA-N 380.901 2.740 0 50 GFAA Cc1cc(S(=O)(=O)N2CC[C@H](C)C[C@H]2[C@@H](C)O)sc1Br 408425355 FTOXCVKUROQKHU-GDPRMGEGSA-N 382.345 2.989 0 50 GFAA COc1ccc(OC)c(CNC(=O)N(C)C[C@H]2Cc3ccccc3CN2C)c1 426566784 BGMQWBIRPXLRFB-LJQANCHMSA-N 383.492 2.902 0 50 GFAA Cc1c(C(=O)N2CCN(c3ccc4nccn4n3)CC2)[nH]c2ccc(F)cc12 426623385 XUMWIMBQFPCWLG-UHFFFAOYSA-N 378.411 2.621 0 50 GFAA CC(C)C(=O)N1CCC[C@H](NC(=O)N2CC(Oc3cccc(Cl)c3)C2)C1 584888966 OBKIESZWURGTLZ-HNNXBMFYSA-N 379.888 2.760 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)N[C@H](C)c3nncn3C(C)C)c(C)s2)n[nH]1 670467537 CYGIKLQDWWGOCA-LLVKDONJSA-N 394.526 2.967 0 50 GFAA Cn1cc(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c(C(F)(F)F)n1 742728612 KZGNXROSCYUKIP-UHFFFAOYSA-N 381.333 2.736 0 50 GFAA C[C@@H](NC(=O)Cc1cn2ccccc2n1)c1cc(F)ccc1N1CCC(O)CC1 755455713 UNGPHTIJYFILET-OAHLLOKOSA-N 396.466 2.854 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N[C@H](C)c1cc2n(n1)CCCC2 912034613 ASRKVPVJRHAYMR-CQSZACIVSA-N 375.494 2.894 0 50 GFAA Cn1ccnc1-c1ccccc1C(=O)N1CCCN(C(=O)c2ccco2)CC1 1506401550 JHIKKTVZRBEVQE-UHFFFAOYSA-N 378.432 2.668 0 50 GFAA CNC(=O)CCc1ccccc1NC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 1615697923 LCQGLOIKJFOALL-MSOLQXFVSA-N 385.508 2.733 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(S(=O)(=O)c3cc(C(=O)O)ccc3Cl)C[C@@H]21 1704353023 IQAYFXWOXWHFBO-IIYDPXPESA-N 387.885 2.600 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1cc(OC)c(Cl)cc1OC 1857670884 HOEVJUGOQSFVLN-JECHBYEQSA-N 389.901 2.671 0 50 GFAA CC(C)CCC(=O)N1C[C@@H]2[C@H](CNC(=O)c3cccs3)[C@H]3CC[C@]2(C1)O3 1857712844 VEVFMAWVOUDWNK-QCBUCWTNSA-N 376.522 2.920 0 50 GFAA O=C(O)c1ncn(C2CN(C(=O)OCC3c4ccccc4-c4ccccc43)C2)n1 1857784210 POQUEDKDZABBLV-UHFFFAOYSA-N 390.399 2.782 0 50 GFAA CCCc1ccc(CN2C[C@@H]3[C@H](CNC(=O)CSC)[C@H]4CC[C@]3(C2)O4)o1 1875247012 PCMHYIYJIAKQSR-JRBPQWBISA-N 378.538 2.691 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2cnc(C)cc2C)CC[C@H]1NC(=O)CC 1875248684 GITUMDXUWQQSKY-QXAKKESOSA-N 375.513 2.805 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4cnccc4C)[C@H]4CC[C@]3(C2)O4)c1 1875249245 OFFBGMMOTPSPTQ-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC(OCc3ccccc3OC)CC2)CC1 1875364999 SUBYOZMBHMOOKG-UHFFFAOYSA-N 386.492 2.627 0 50 GFAA O=C(c1[nH]nc(C(F)(F)F)c1Br)N1CC[C@H]1C1CCOCC1 1875396327 BWDWHZCRFVENRI-QMMMGPOBSA-N 382.180 2.832 0 50 GFAA COc1ccc(N2C[C@H](C(=O)Nc3ncc4c(n3)CCC4)CC2=O)cc1Cl 2100545017 FKRBOTRUXSBUTC-GFCCVEGCSA-N 386.839 2.619 0 50 GFAA Cn1cc(SCC(=O)N2C[C@@H](O)[C@H](Cc3ccccn3)C2)c2ccccc21 2100556945 VZWPXAPWRWFNLV-DNVCBOLYSA-N 381.501 2.727 0 50 GFAA Cc1c(C(=O)N[C@H](C)C2=CCN(C)CC2)nnn1Cc1ccc2ncccc2c1 2325745000 GPWYICYJCRMIHX-OAHLLOKOSA-N 390.491 2.563 0 50 GFAA O=C(NCC[S@@](=O)c1ccccc1F)c1ccc2c(c1)nc(O)n2C1CC1 2325757181 IRGUGFHCHXPPOY-HHHXNRCGSA-N 387.436 2.754 0 50 GFAA COC(=O)c1cncc2c(N3CCN([C@H](C)c4cccnc4)CC3)nccc12 2325802266 VHFFDQLKUJJNQK-OAHLLOKOSA-N 377.448 2.695 0 50 GFAA Cc1cc(C(F)(F)F)n2nc(C(=O)NC[C@@H]3NCCc4sccc43)cc2n1 2325810664 WSNGFKVPJZOWGK-LBPRGKRZSA-N 395.410 2.735 0 50 GFAA COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c1ccc(OC)cc1OC 815867 APWWXLISOSQZOI-UHFFFAOYSA-N 375.421 2.625 0 50 GFAA COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC(=O)c2ccccc2)cc1 956304 LPCVKIWIUNFFOA-QGZVFWFLSA-N 382.441 2.872 0 50 GFAA Cc1cc(=O)oc2cc(OCC(=O)NCCc3nc4ccccc4[nH]3)ccc12 2816522 NHYDKAMBHGWVSG-UHFFFAOYSA-N 377.400 2.715 0 50 GFAA aggregator,biogenic CCN(CC)C(=O)c1sc(NC(=O)/C=C/C(=O)O)c(C(=O)OC(C)C)c1C 4903842 SICPCLVXKDVDOB-CMDGGOBGSA-N 396.465 2.683 0 50 GFAA CCCNC(=O)c1cc(=O)n(CC(=O)Nc2cccc(F)c2)c2ccccc12 12411172 ZYMQVFLKTUJYTM-UHFFFAOYSA-N 381.407 2.919 0 50 GFAA biogenic,in-vitro CCN1CCC[C@@H]1CNC(=O)CCC1CCN(C(=O)c2ccoc2C)CC1 12591986 SMWVETDTOJLTIH-GOSISDBHSA-N 375.513 2.821 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN2CCC(COC)CC2)cc1OC 12712501 PYOJCSNPKOLBRG-HXUWFJFHSA-N 394.556 2.635 0 50 GFAA O=C(NCCc1ccccc1C(F)(F)F)c1cc(CN2CCC[C@H](O)C2)on1 12763312 YOUHIRDQJOLTMX-AWEZNQCLSA-N 397.397 2.623 0 50 GFAA COc1ccc(C(=O)N2CCCCCC2)cc1S(=O)(=O)N1CCCCC1 13945924 YXLRAZUQYNUORG-UHFFFAOYSA-N 380.510 2.886 0 50 GFAA Cc1cccc(NC(=O)COc2ccc(CN(C)S(C)(=O)=O)cc2)c1C 14398774 UELOITBKLZTQSO-UHFFFAOYSA-N 376.478 2.712 0 50 GFAA CC(C)N1CCN(C(=O)CCc2nnc(Cc3c[nH]c4ccccc34)o2)CC1 19217680 QMYZSSVGCGZULZ-UHFFFAOYSA-N 381.480 2.627 0 50 GFAA COC(=O)Cc1ccc(NC(=S)N2CCN(Cc3ccccc3)CC2)cc1 19815293 YLQLYYPFICNPOT-UHFFFAOYSA-N 383.517 2.917 0 50 GFAA CSCCCN1CCC[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 20323292 NFGRMVWNQIAAHY-LJQANCHMSA-N 391.581 2.750 0 50 GFAA O=C(c1cccnc1)N1CC[C@H]2[C@H](CCC(=O)N2CCc2ccccc2F)C1 23153632 ZWYCVWLGTHZYKP-QUCCMNQESA-N 381.451 2.917 0 50 GFAA CC(C)c1nnc2ccc(N3CCC[C@@H](C(=O)NCc4ccc(F)cc4)C3)nn12 32072008 GMMYBBGABWZJGX-MRXNPFEDSA-N 396.470 2.920 0 50 GFAA Cc1nn(-c2ccc3nnc(C)n3n2)c2c1[C@H](c1ccc(F)cc1)CC(=O)N2 33271380 WPLWKMYJHXBVAP-AWEZNQCLSA-N 377.383 2.540 0 50 GFAA CCn1c(CN2CCN(Cc3cccc(C)n3)[C@H](CCO)C2)nc2ccccc21 39364333 CEZNWMMDSSNNIH-HXUWFJFHSA-N 393.535 2.828 0 50 GFAA NC(=O)NCCN1CCc2onc(C(c3ccccc3)c3ccccc3)c2C1 67435152 QTFHINUBWKHXDD-UHFFFAOYSA-N 376.460 2.881 0 50 GFAA Cc1nc(N2CCCC2)cc(N2CCN(C(=O)c3ccc(C)c(C)c3)CC2)n1 67604386 OMCVLFXFIXIAKX-UHFFFAOYSA-N 379.508 2.964 0 50 GFAA Cc1ncc(CC(=O)N2CCC[C@@H](c3[nH]ncc3-c3ccc(F)cc3)C2)c(=O)[nH]1 67842257 FWOSCANTLZUAMY-OAHLLOKOSA-N 395.438 2.556 0 50 GFAA NC(=O)c1noc(CN2CCC[C@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)n1 71614153 DAYGDSORTJULCX-HNNXBMFYSA-N 390.443 2.515 0 50 GFAA COc1c(F)ccc(C(=O)N2CCc3c(nc(C)nc3N3CCCC3)C2)c1F 71745811 ORAFZOVOJQGINF-UHFFFAOYSA-N 388.418 2.871 0 50 GFAA O=C(N1CCC[C@@H](N2CCN(c3ccc(F)cc3)CC2)C1)C1(O)CCCCC1 72131985 FTFWJQOTROBPSV-HXUWFJFHSA-N 389.515 2.634 0 50 GFAA CNc1ncc(C(=O)N2CCC[C@H](C(=O)c3cc(C)c(OC)c(C)c3)C2)cn1 72166832 PZCQYPXGMJTOJF-HNNXBMFYSA-N 382.464 2.879 0 50 GFAA CCCOc1ccc(Cl)cc1CNC(=O)[C@H]1CC2(CCNCC2)CN1C 72476589 BJTWUGWVAMDWMY-QGZVFWFLSA-N 379.932 2.819 0 50 GFAA CCn1ccnc1CN1CCC[C@@H](CNC(=O)c2cccc(OC)c2OC)C1 76989322 HFBZLJJOZLAUQS-INIZCTEOSA-N 386.496 2.562 0 50 GFAA COc1ccc(CN(C)C2CCOCC2)cc1OC[C@@H](O)CN1CCCCC1 95525083 RBSPHDIFBJMERX-FQEVSTJZSA-N 392.540 2.532 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2CCC(O)(c3ccc(Cl)cc3)CC2)CC1 97713591 YKHXRIQNLVTBQT-UHFFFAOYSA-N 393.915 2.544 0 50 GFAA O=C(Cn1cn[nH]c1=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 122445757 YZXSZGWVIHPHAR-HNNXBMFYSA-N 395.850 2.654 0 50 GFAA O=C(CCN1C(=O)CCC1=O)Nc1ccc(-c2nc3ccccc3s2)cn1 136014365 VRVZSYUAACWSRN-UHFFFAOYSA-N 380.429 2.836 0 50 GFAA O=C([C@H]1CCCN1C(=O)Cc1ccccc1)N1CCO[C@@H](c2cccs2)C1 161880946 ISNDXQMBPHQDNJ-QZTJIDSGSA-N 384.501 2.882 0 50 GFAA Cc1cccc(OCC(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)c1 169779694 BADHMVMAHCYYER-UHFFFAOYSA-N 392.459 2.654 0 50 GFAA C[C@H](c1nnnn1C1CC1)N1CCN(C(=O)c2cccc3ccccc23)CC1 170611913 UJWTXWVIKZPQQN-OAHLLOKOSA-N 376.464 2.680 0 50 GFAA COc1c(C)cnc(CN2CCC(N(C)C(=O)Cc3cc(C)on3)CC2)c1C 172127813 USOPYZUVDNICGW-UHFFFAOYSA-N 386.496 2.669 0 50 GFAA O=C(NCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)c1cc2ccccc2[nH]1 173048513 GHHGLUSFGHMMCX-SFHVURJKSA-N 391.427 2.990 0 50 GFAA COc1cc(F)c(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)cc1F 182602394 GIIGCIZCRHFKSV-HNNXBMFYSA-N 376.359 2.922 0 50 GFAA O=C(Cc1c(F)ccc(Br)c1F)OCCNC(=O)c1ccncc1 225724333 NDCICOASAMYTAO-UHFFFAOYSA-N 399.191 2.638 0 50 GFAA C[C@H](C(=O)Nc1nc(-c2ccccc2)cs1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 238899395 GFSSTFKBUHKJGQ-RZQILNRJSA-N 393.468 2.944 0 50 GFAA O=C(NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)[C@H]1CSc2ccccc2O1 252494014 NIJJEEIXGAIMFK-DNVCBOLYSA-N 396.468 2.784 0 50 GFAA C[C@H](C(=O)Nc1ccc2sc(C(=O)O)cc2c1)S(=O)(=O)C1CCOCC1 262045732 DRSMZSXENBLBDB-SNVBAGLBSA-N 397.474 2.520 0 50 GFAA CCCCOc1c(Cl)cc(C(=O)N2CCO[C@@H](C(=O)O)C2)cc1OCC 262926770 FTGLUCJBKHADLC-OAHLLOKOSA-N 385.844 2.843 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2ccc(F)c(Br)c2)CC1 275695675 NANBIMLOSDVSDU-UHFFFAOYSA-N 387.249 2.599 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)Nc3ccc(C(F)(F)F)nc3)C2)n(C)n1 278261545 XIGNRJSXMHHKID-ZDUSSCGKSA-N 382.390 2.933 0 50 GFAA Fc1ccc([C@H]2CN(c3nccc(N[C@@H]4CCCOC4)n3)CCO2)c(Cl)c1 333189735 VMALJHYSFBIERA-RHSMWYFYSA-N 392.862 3.438 0 50 GFAA CCS(=O)(=O)Cc1noc(C2CCN(c3nc4ccccc4s3)CC2)n1 371967730 WAJAWTLPGHLLJE-UHFFFAOYSA-N 392.506 2.998 0 50 GFAA O=C1C[C@H](NC(=O)N2CCC(OCc3ccccn3)CC2)c2ccccc2N1 426624724 DQOAQUSBEFRTMK-IBGZPJMESA-N 380.448 2.856 0 50 GFAA COCCn1ccnc1CN1CCC(CNC(=O)c2cccc(F)c2C)CC1 824466029 CLHZHQFANZXZPV-UHFFFAOYSA-N 388.487 2.619 0 50 GFAA CN1CCC[C@H]1C(=O)N1CCC(CNC(=O)c2ccccc2C(F)(F)F)CC1 952974288 ZSKIEJBEQOCAJL-KRWDZBQOSA-N 397.441 2.768 0 50 GFAA O[C@H]1CCCN(c2ccnc(NCC3CCN(CCc4ccccc4)CC3)n2)C1 1529092008 UEEWHCAEUCXXII-NRFANRHFSA-N 395.551 2.804 0 50 GFAA CCC[C@H]1COC[C@H]2CN(C(=O)c3ccc(CN4CCC(C)CC4)o3)CCN12 1529119131 CAWHCRMOGJCMJC-RBUKOAKNSA-N 389.540 2.837 0 50 GFAA Cc1ccc2nc(C(=O)N3CCN4[C@@H](c5ccccc5)COC[C@H]4C3)c(F)n2c1 1529119933 OLIZZFMNRIUKCK-QZTJIDSGSA-N 394.450 2.680 0 50 GFAA O=C(CCOc1ccccc1)N1CC[C@H]2[C@@H]1CC(=O)N2Cc1ccc(F)cc1 1857689970 QWQXQNOEMWQZLY-PMACEKPBSA-N 382.435 2.997 0 50 GFAA CO[C@H]1COCC[C@@H]1NC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857708379 QPVTWWGIWUVSLJ-RDJZCZTQSA-N 393.871 2.618 0 50 GFAA Cc1c(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)cnc2ccnn12 1857712082 QSPPYAQXJNZYHL-NVXWUHKLSA-N 386.496 2.599 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3ccccc3OC(F)F)C[C@]23CC[C@H]1O3 1857712707 NIFFPGUFQUKUFS-DKYLXPRQSA-N 380.435 2.794 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4cc5c(cc4Cl)OCO5)[C@@H]2CC(=O)N13 1857722833 PFXINYHEBPWEPP-YJLNNSPDSA-N 378.856 2.626 0 50 GFAA COc1ccccc1Cn1nc(-c2c[nH]nc2C)nc1[C@H]1CC[C@@H](OC)[C@H](N)C1 1857734097 DRWAOGYQMNGXPK-POZUXBRTSA-N 396.495 2.643 0 50 GFAA Cn1cc(CN[C@@H](CCc2c[nH]nc2C(F)(F)F)C(=O)O)c(C2CCCC2)n1 1875291001 LCQZCIBYYFIDLY-AWEZNQCLSA-N 399.417 2.995 0 50 GFAA C[C@@H]1CC(CO)(CO)CN1C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)F 1875297057 ASCMVCZTYZPNLJ-ZWNOBZJWSA-N 396.356 2.786 0 50 GFAA C[C@@H](NC(=O)N1CCS(=O)(=O)CC[C@H]1C)c1ncc(-c2ccc(F)cc2)o1 1875300408 BWLLBWVCEYFJNV-CHWSQXEVSA-N 395.456 2.760 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2cc(Br)c3cn[nH]c3c2)CC1 1875380723 XMJIQFVKSICQGO-UHFFFAOYSA-N 377.242 2.689 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@H]2C(=O)N=c1cc(CC(C)(C)C)[nH][nH]1 1875392995 CPBWXZNIJWRTNU-DHUIEDIVSA-N 385.512 2.570 0 50 GFAA Cc1cc(C2CCN(C(=O)C(=O)Nc3ccc4nc(C)c(C)nc4c3)CC2)on1 2325819034 OLKDVOLCFSZJOL-UHFFFAOYSA-N 393.447 2.888 0 50 GFAA COc1ccc2nc(O)c(CN3CCC[C@]4(CCc5c[nH]c(=N)nc54)C3)cc2c1 2356158429 KAUIULVGJBOHOA-QFIPXVFZSA-N 391.475 2.632 0 50 GFAA O=C(c1cnn2c(C(F)(F)F)cc(-c3cccs3)nc12)N1CCOCC1 845043 PWJHGUSMJFXEKT-UHFFFAOYSA-N 382.367 2.949 0 50 GFAA CCOc1cc([C@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3nnnn32)ccc1O 1111654 HACHBZVYAOVIHE-SFHVURJKSA-N 392.419 2.705 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)Nc1cccc(SC)c1 1116785 KOOYTJTYGDSDRN-UHFFFAOYSA-N 394.518 2.985 0 50 GFAA O=S1(=O)CC[C@@H](CCN2CCC3(CC2)OCCc2c3[nH]c3ccccc23)C1 2356145786 WNVCQHDVXWSVGA-MRXNPFEDSA-N 388.533 2.857 0 50 GFAA COc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 3209678 OYSHHJUHIWDRGC-UHFFFAOYSA-N 380.491 2.796 0 50 GFAA O=C1C[C@@H](NC2CCCCC2)C(=O)N1c1ccc(I)cc1 4723374 XIFNHAZJYIVXCK-CQSZACIVSA-N 398.244 2.845 0 50 GFAA COc1ccc(S(=O)(=O)NCc2cccnc2)cc1NC(=O)c1ccccc1 4749134 WXRGJTZXQREQFA-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA COc1cc(CNCCSc2nnnn2C)ccc1OCc1ccccc1C 4998064 YOSIRMXFPHFCBV-UHFFFAOYSA-N 399.520 2.988 0 50 GFAA Cc1nc(NC(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)nn1C(C)C 55370311 KZZRAWICHCQNBD-UHFFFAOYSA-N 383.456 2.679 0 50 GFAA CCN(CC)[C@@H](CNC(=O)CCNC(=O)c1ccccc1F)c1ccco1 55386914 FUGHVCPOOQBEAT-KRWDZBQOSA-N 375.444 2.738 0 50 GFAA Cc1ccccc1CNC(=O)CN1C[C@H](CNC(=O)OC(C)(C)C)C[C@H]1C 230109609 KNNXOVNYLSQPBB-SJORKVTESA-N 375.513 2.846 0 50 GFAA CC[C@@H]1CCCCN1C(=O)C1=CC(c2ccc(C)cc2)=NS(=O)(=O)N1C 20467448 IJLQDURVWSTJJH-MRXNPFEDSA-N 375.494 2.649 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2C[C@H](O)c2ccc(F)cc2F)n1C 328625540 DFYRTJJSCBLKCD-HKUYNNGSSA-N 377.435 2.924 0 50 GFAA CC(C)c1ccc(CN2CCC[C@@](O)(CN3CCC(N(C)C)CC3)C2=O)cc1 67726562 HSSAHJKPKPTEBQ-HSZRJFAPSA-N 387.568 2.690 0 50 GFAA CC(C)OCC(=O)N1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 67834350 DRHAMSWXIHYKIA-UHFFFAOYSA-N 380.492 2.706 0 50 GFAA COc1ccc(OC)c(Cc2nnc(CCC(=O)NC(C3CC3)C3CC3)o2)c1 11768059 GNCFARILVWEPLI-UHFFFAOYSA-N 385.464 2.915 0 50 GFAA CCn1cc(S(=O)(=O)Nc2ccn(Cc3ccc(F)cc3Cl)n2)cn1 2804620 KLHKHGRESZKHDG-UHFFFAOYSA-N 383.836 2.741 0 50 GFAA N[C@@H]1CCO[C@H]1C1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 333836466 UIXSXBYCYZDKFT-NMLBUPMWSA-N 391.487 2.584 0 50 GFAA Cc1nc2n(n1)CCN(C(=O)NCc1ccc(Oc3cccnc3)c(F)c1)C2 364114442 KTXIVSBAQAIDEK-UHFFFAOYSA-N 382.399 2.638 0 50 GFAA O=C([C@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1)N1CC=CC1 71589646 GJEAYZZLDJPXLA-NRFANRHFSA-N 379.548 2.729 0 50 GFAA O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)Nc1nc2ccccc2s1 32843330 AQZKODBLWDKBDP-WHOFXGATSA-N 376.507 2.961 0 50 GFAA biogenic C/C=C/c1ccc(OCC(=O)N2CCC[C@@H](N(C)CC(=O)O)CC2)c(OC)c1 262937946 NAXBNUPQRXOJLM-UKINESCASA-N 390.480 2.505 0 50 GFAA COc1ccc(-c2cc(C(=O)N(C)C3CCN(c4cnccn4)CC3)n[nH]2)cc1 370201028 GLTJPFPCEFFMGK-UHFFFAOYSA-N 392.463 2.616 0 50 GFAA Cc1cc(F)ccc1OC1(C(=O)O)CCN(C(=O)c2[nH]ncc2Cl)CC1 72432087 OEDDVROHNONTAC-UHFFFAOYSA-N 381.791 2.649 0 50 GFAA CC1CCN(S(=O)(=O)c2ccccc2S(=O)(=O)Nc2ccccc2)CC1 242389534 ZYBQCOWFEZRRPD-UHFFFAOYSA-N 394.518 2.908 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N[C@@H](C)c1ccc(OCC(=O)O)cc1 263189445 XQHFMUCXLYONJQ-NSHDSACASA-N 387.436 2.743 0 50 GFAA CN(Cc1nccs1)C(=O)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 15074152 AAUBOJRIJCOYFX-HNNXBMFYSA-N 375.469 2.722 0 50 GFAA C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)c1cccc(N2CCCC2)c1 176311093 UZTVTDOVCNXVEX-CQSZACIVSA-N 388.493 2.817 0 50 GFAA COc1cc(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)cc2c1OCO2 43040727 SVJHNFAAJWCXPJ-HXUWFJFHSA-N 398.503 2.535 0 50 GFAA O=C(NCCN1CCC(O)CC1)c1cccc(-c2cc(O)c(F)c(F)c2)c1 426431950 OCDBXHBIHJMLCQ-UHFFFAOYSA-N 376.403 2.524 0 50 GFAA CO[C@@]12CC[C@H](OCCO)C[C@@H]1N(C(=O)c1cccc3c(C)c(C)[nH]c13)CC2 426562999 MYAOZWZBBAZOLN-XWFZLUIHSA-N 386.492 2.946 0 50 GFAA CC(=O)Oc1c(Br)cc(Br)c(OC(C)=O)c1C(=O)O 44125684 QSOJTJVVIGRUDJ-UHFFFAOYSA-N 395.987 2.760 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)c1ccc(N2CCOCC2)cc1 82230239 FIQXUQCRQPRPMR-UHFFFAOYSA-N 378.432 2.845 0 50 GFAA O=C([C@H](O)[C@H](O)c1nc2ccccc2s1)N1CC[C@@H](Cc2ccccc2)C1 180808957 AYUNLJBSWADZGP-ZYSHUDEJSA-N 382.485 2.782 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(c3nc(N)nc4[nH]ncc34)CC2)C1 91690796 FVAQNKBSSZJGSF-MRXNPFEDSA-N 377.496 2.641 0 50 GFAA COc1ccccc1OCC(=O)NC[C@H]1CCCN(Cc2cncs2)C1 95522330 HEYXGIQFSNEXDJ-OAHLLOKOSA-N 375.494 2.559 0 50 GFAA CN1C(=O)C[C@H](C(=O)O)C12CCN(Cc1cccc(OC3CCCC3)c1)CC2 95380979 LJLFPQVWNORXCR-LJQANCHMSA-N 386.492 2.906 0 50 GFAA CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1cnc(-c3ccccc3)nc1C)CC2 91663080 MTDBOMSBMNRBFZ-MOPGFXCFSA-N 381.476 2.844 0 50 GFAA O=C(c1ccccc1-n1cccn1)N1C[C@@H]2CC[C@H](C1)N(CC1CCC1)C2=O 91551063 BWAYUEQJIKKNPI-ZWKOTPCHSA-N 378.476 2.735 0 50 GFAA Cc1sc2ncnc(N3CCC(NCc4nnc(N)s4)CC3)c2c1C 95518518 INDQJUYXUAZZLH-UHFFFAOYSA-N 375.527 2.500 0 50 GFAA COc1cccc(N2CCN(C(=O)[C@@H]3CCOc4ccccc4C3)CC2=O)c1 97681895 HIBSDRGETAMUNI-QGZVFWFLSA-N 380.444 2.512 0 50 GFAA COC(=O)c1cc(NC(=O)N2CCC[C@@H](N3CCCC3=O)C2)ccc1Cl 96130943 FUNFPDGYIAMNNC-CYBMUJFWSA-N 379.844 2.745 0 50 GFAA COc1ccccc1CNC(=O)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244715769 LBYRIORHEQUUHN-QAQDUYKDSA-N 395.459 2.744 0 50 GFAA Cc1nn(C(C)C)c(C)c1S(=O)(=O)N[C@@H](Cn1cccn1)c1ccccc1 607362766 GVLVRMVCPAUEFY-SFHVURJKSA-N 387.509 2.997 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)NC[C@@H]3CC(=O)N(C4CCCC4)C3)cc2)[nH]1 299801045 YBQNIXMMIMITRE-AWEZNQCLSA-N 382.468 2.693 0 50 GFAA Cn1cc(N2CCC[C@@H]2CNC(=O)c2nccnc2Sc2ccccc2)cn1 1875392334 WJGGLTFWNWOIMF-OAHLLOKOSA-N 394.504 2.760 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1[C@H]1COCCN1C(=O)CCc1ncc[nH]1 952887121 IFVGYLHJLRDQFO-GOSISDBHSA-N 379.464 2.745 0 50 GFAA CO[C@@H](C)c1nsc(N2CCC(c3nccc(-c4cnn(C)c4)n3)CC2)n1 952894374 NWSCGSWUMHSYBY-LBPRGKRZSA-N 385.497 2.820 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1[C@H]1COCCN1C(=O)C=C1CCNCC1 952895021 QNHRHIYWPTTYHW-OAQYLSRUSA-N 394.519 2.758 0 50 GFAA COCCN(C)c1ccc(NC(=O)Nc2ccc3ccc(=O)n(C)c3c2)nc1 1875270251 BLQNUUBPJPIECQ-UHFFFAOYSA-N 381.436 2.660 0 50 GFAA Nc1nc2c(c(C(=O)N(Cc3cnn(-c4ccccc4)c3)C3CC3)n1)CCCC2 952979704 YXZGVALREFWCFH-UHFFFAOYSA-N 388.475 2.928 0 50 GFAA O=C(NC[C@@H]1CNCC[C@@H]1c1ccc(F)cc1)N1CCO[C@H](C(F)F)CC1 892149488 DWFCSYIHGFAZMB-UAGQMJEPSA-N 385.430 2.584 0 50 GFAA CC(C)c1nc2c(n1C)CCN(S(=O)(=O)c1ccc3c(c1)CCCO3)C2 271300958 CAMYMXZMZUZHRP-UHFFFAOYSA-N 375.494 2.616 0 50 GFAA CNS(=O)(=O)c1cccc([C@H](C)Nc2nccc3c2C(=O)OC3(C)C)c1 1337836609 DFVQUOODZUHJML-NSHDSACASA-N 375.450 2.568 0 50 GFAA CN1CCN(C(=O)c2ccnc(-c3cc(OC(F)(F)F)ccc3O)c2)CC1 1244457146 WZWFZUGLXUOEQT-UHFFFAOYSA-N 381.354 2.740 0 50 GFAA COc1ccc2cc(NC(=O)N3CCC(N4CCO[C@H](C)C4)CC3)ccc2n1 171280304 LKVLDIYCEHHIQG-OAHLLOKOSA-N 384.480 2.960 0 50 GFAA Cc1nc2ncnn2c(NC[C@H](O)COc2cccc(C(F)(F)F)c2)c1C 301362822 PFWYAWMYEZMBHV-ZDUSSCGKSA-N 381.358 2.612 0 50 GFAA Cc1cc(S(=O)(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)sc1Cl 191920600 MKFZTRBJFOODHO-JTQLQIEISA-N 382.960 2.640 0 50 GFAA COc1cccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)N(C)C)c1 192770779 HQDPAOAOCGHRMC-RTWAWAEBSA-N 395.503 2.719 0 50 GFAA COc1ccc(F)cc1[C@@H](C(=O)O)N1CCC2(CC1)Nc1ccccc1NC2=O 1529089955 DDKPKDFKWRIQPU-SFHVURJKSA-N 399.422 2.859 0 50 GFAA CC[C@H](C)NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(OC)cc1 5954029 FMEZFDCCGJZPRC-HNNXBMFYSA-N 376.478 2.805 0 50 GFAA CCN1C[C@@H](CN(C)Cc2nc(-c3ccc(C(=O)OC)cc3)oc2C)CC1=O 11662495 SLBLQSJIEAFSTI-OAHLLOKOSA-N 385.464 2.737 0 50 GFAA Cc1cc(C)n2cc(CNC(=O)CC[C@@]3(Cc4ccco4)CCC(=O)N3)nc2c1 12053220 VBHRWHNVVGCRCM-QFIPXVFZSA-N 394.475 2.832 0 50 GFAA COC[C@@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CC2CCCCC2)C1 12446449 KYJKWDKAPOAUAR-QGZVFWFLSA-N 383.558 2.725 0 50 GFAA CCn1nc(C)c(CN2C[C@H]3[C@@H](C2)OC(=O)N3CCc2ccc(OC)cc2)c1C 19222546 SCFKNNMVHVQIGQ-LEWJYISDSA-N 398.507 2.776 0 50 GFAA O=C(CCc1nc(-c2nnc[nH]2)no1)NCc1ccc(OC2CCCCC2)cc1 156126391 WTKQHNPCKXNLPP-UHFFFAOYSA-N 396.451 2.815 0 50 GFAA COc1ccc(S(=O)(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)cc1 1857682906 VJMXNZKXYKQDPO-WMQCIHAUSA-N 387.501 2.842 0 50 GFAA CN(C)[C@@H]1CS(=O)(=O)[C@H]2CN(Cc3ccc(-c4ccccc4Cl)o3)C[C@@H]12 1857685346 IPXHGIBXUWJRAO-WDYCEAGBSA-N 394.924 2.759 0 50 GFAA COc1ccc(O)cc1CN1CC[C@@]23O[C@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857721127 AETPGCPNQOFHRQ-VWPQPMDRSA-N 380.444 2.675 0 50 GFAA Cc1cc(O)ccc1C(=O)N1CCO[C@@H](CN2CCCCC2)[C@@H]1c1cnn(C)c1 1857725422 WDYWEFMFLDBVHK-SFTDATJTSA-N 398.507 2.502 0 50 GFAA CCn1cc([C@@H]2N=C(O)CC[C@H]2Nc2nn3cc(C(C)(C)C)nc3s2)cn1 328630476 PXRJNKFQVJGZNI-DOMZBBRYSA-N 387.513 3.577 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N(C)Cc2ccc(C(=O)O)cc2)cc1 237046174 DWRFTNUKFHFVIS-LJQANCHMSA-N 380.444 2.843 0 50 GFAA O=S(=O)(c1cnn([C@@H]2CCOC2)c1)N1CCC[C@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 333437851 JCRJNAFIELAJKM-KFGODFMUSA-N 379.526 2.824 0 50 GFAA NC(=O)c1cc(NCc2nnc(-c3ccc(Br)o3)o2)ccc1F 133253184 LSUCKAIAGJJSET-UHFFFAOYSA-N 381.161 2.942 0 50 GFAA Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N1CCO[C@H](C(=O)O)C1 263016738 SBSPVDMVEOHXSI-ZDUSSCGKSA-N 396.852 2.610 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CCO[C@H](c2cccs2)C1 161880820 ISNDXQMBPHQDNJ-ROUUACIJSA-N 384.501 2.882 0 50 GFAA CN(C)S(=O)(=O)[C@@H]1CCCN(c2nc(Cl)nc3c2CCCC3(C)C)C1 848703578 KOVACAXVADVIOP-GFCCVEGCSA-N 386.949 2.604 0 50 GFAA CN(Cc1nccn1CC(F)(F)F)S(=O)(=O)[C@H]1C[C@H]1c1cccc(F)c1 914054872 LGKHDVZHYIRKSD-KBPBESRZSA-N 391.390 2.902 0 50 GFAA COc1cc([C@@H]2SCC(=O)N2CCN2CCCCC2)cc(OC)c1OC 4181118 WXUKFOWEGZUIDZ-IBGZPJMESA-N 380.510 2.772 0 50 GFAA biogenic C[C@@H](NCc1nn(C)c2ccccc12)c1ccc(N2CCCS2(=O)=O)cc1 2325735759 NVKXKNVARAPDNZ-OAHLLOKOSA-N 384.505 2.964 0 50 GFAA Cc1nc(-c2ccc(CNC(=O)c3cn(-c4cccc(Cl)c4)nn3)cc2)n[nH]1 2325869534 SBUONXGRXAZIOL-UHFFFAOYSA-N 393.838 2.944 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC[C@@H](O)COc3ccc4cc[nH]c4c3)cn2)n1 905052138 MGZDNDODYZBXJV-LJQANCHMSA-N 391.475 2.895 0 50 GFAA Cc1c(Cc2c(C)n(C)n(-c3ccccc3)c2=O)c(=O)n(-c2ccccc2)n1C 622215 QATHNKNPUVVKHK-UHFFFAOYSA-N 388.471 2.873 0 50 GFAA in-vitro COc1ccc(Cc2nnc(NS(=O)(=O)c3ccc(OC)cc3)s2)cc1 789827 IKJLSRGZJRPIJK-UHFFFAOYSA-N 391.474 2.947 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cc(OCC)c(OCC)c(OCC)c2)CC1 851811 CUGYRUOSUQPISY-UHFFFAOYSA-N 394.468 2.797 0 50 GFAA COc1ccc(S(=O)(=O)NC2CCCC2)cc1I 1049441 WMZDMQCMVKYRCH-UHFFFAOYSA-N 381.235 2.521 0 50 GFAA CCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(Br)cc1 1142072 UZFXFIOORJDVGJ-UHFFFAOYSA-N 397.294 2.929 0 50 GFAA CCc1c(O)nc(SCC(=O)N(CC)CC)n(-c2ccc(C)cc2)c1=O 1230448 OZAAZKHUIPWNNH-UHFFFAOYSA-N 375.494 2.769 0 50 GFAA Cn1cc(Cl)c(C(=O)NCCCn2nc(C(F)(F)F)cc2C2CC2)n1 2780409 DGSASXFPNGXKPH-UHFFFAOYSA-N 375.782 2.986 0 50 GFAA CCOC(=O)C1CCN(C(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)CC1 4543825 GDYIZBGLODCXMO-VOTSOKGWSA-N 377.437 2.527 0 50 GFAA CCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(NC(C)=O)cc1 6244064 XQUAWPQLNSMYJG-UHFFFAOYSA-N 389.477 2.976 0 50 GFAA CCCOc1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br 8714708 RJUHGEGYFFWDBE-LLVKDONJSA-N 378.288 2.695 0 50 GFAA O=C(O)C1CCN([C@@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2=O)CC1 9426937 MCATYWYBZHIWMS-LJQANCHMSA-N 394.427 2.907 0 50 GFAA CCNC(=O)c1cn([C@@H](C)CC)cc(C(=O)NCc2ccc(F)c(F)c2)c1=O 11814216 OPEFECJUZILDBG-LBPRGKRZSA-N 391.418 2.777 0 50 GFAA CC(C)NC(=O)C1CCN(C2CCN(C(=O)c3ccc(F)cc3)CC2)CC1 11878696 VGRHHWWSHLOIHB-UHFFFAOYSA-N 375.488 2.667 0 50 GFAA CN(C)CCCNC(=O)c1c(-c2ccccc2)c(-c2ccccc2)nn(C)c1=O 12016329 SGLCDYPREIWMFK-UHFFFAOYSA-N 390.487 2.796 0 50 GFAA COc1ccccc1/C=C/CN1CCC(n2cc(C(=O)NC3CC3)nn2)CC1 12037434 JRJLMQAZVVVDIE-GQCTYLIASA-N 381.480 2.529 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)N1CCC(c2nnc3ccccn23)CC1 12409715 DJAJGVZWYMGTAB-UHFFFAOYSA-N 376.869 2.951 0 50 GFAA COc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NCCCN(C)C)cc1 13303386 FXXOLWVBSYRXJX-CAPFRKAQSA-N 381.476 2.534 0 50 GFAA COc1cc(OC)cc(N2C(=O)C[C@H](NCCc3ccc(Cl)cc3)C2=O)c1 20149221 VSQIRNVPMUXLOS-SFHVURJKSA-N 388.851 2.821 0 50 GFAA COc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)cc1OC 20406581 ZRXUZYATBUVKKV-FQEVSTJZSA-N 388.483 2.912 0 50 GFAA CC1CCN(C(=O)c2coc(CN3CCN(Cc4ccccc4)CC3)n2)CC1 20601198 OWNPKJCMQSZCCB-UHFFFAOYSA-N 382.508 2.865 0 50 GFAA O=S1(=O)C=C[C@H](NC2CCN(c3cccc(-c4cscn4)c3)CC2)C1 23430319 LBUAWMHIVZUEQQ-INIZCTEOSA-N 375.519 2.679 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(F)cc3F)CC2)cc(-n2cccn2)n1 35597326 OPEPATXKPKIOFG-UHFFFAOYSA-N 399.405 2.603 0 50 GFAA Fc1ccc(-c2n[nH]cc2CNC[C@H](c2cccnc2)N2CCOCC2)cc1 55575362 LYTRJZXENHYYBZ-HXUWFJFHSA-N 381.455 2.774 0 50 GFAA CCNc1cc(C)nc(N2CCN(C(=O)COc3ccc(Cl)cc3)CC2)n1 67620943 BPLNGPVLPVWTIX-UHFFFAOYSA-N 389.887 2.598 0 50 GFAA COC(=O)c1cc(C(=O)NCc2cccnc2Oc2ccccc2C)n(C)n1 67742990 KYHUTVDXUPGGPH-UHFFFAOYSA-N 380.404 2.632 0 50 GFAA Cc1ccccc1N1CCN(c2nccc(-c3cc(C(=O)O)ccn3)n2)CC1 71661294 AQKPTMVMALDTGU-UHFFFAOYSA-N 375.432 2.872 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(c4cc(C)nc(N)n4)C3)C2)c1OC 72143123 YQZQCLNUFALWCM-QFIPXVFZSA-N 397.523 2.877 0 50 GFAA CCc1n[nH]c(SCC(=O)N[C@@H](C)c2cnn(-c3cccc(F)c3)c2C)n1 91526598 HKISNMXNZISEMS-NSHDSACASA-N 388.472 2.970 0 50 GFAA COc1ccc(F)c(F)c1C(=O)N1C[C@H]2CC[C@@H]1CN(C1CCOCC1)C2 95387068 SBLHINMHPNSTRU-DZGCQCFKSA-N 380.435 2.689 0 50 GFAA O=C(Nc1ccc(-c2nc3ccccc3o2)cc1)C1CCN(C(=O)CO)CC1 95526541 UZSVSYRJTDLDIV-UHFFFAOYSA-N 379.416 2.664 0 50 GFAA C[C@@H](NC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1)C1=CCCCC1 96179673 ANHFAETYOXTDRT-MRXNPFEDSA-N 387.480 2.935 0 50 GFAA O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)Nc1nc2ccccc2s1 104695209 AQZKODBLWDKBDP-CORIIIEPSA-N 376.507 2.961 0 50 GFAA CC(=O)Nc1cc(S(=O)(=O)NCCN2c3ccccc3C[C@H]2C)ccc1F 121809091 PCGAINBHODWNKK-CYBMUJFWSA-N 391.468 2.514 0 50 GFAA C[C@H]1CN(c2ccc(NCc3cnc(N4CCOCC4)nc3)cc2)C[C@H](C)O1 124845229 GDFGYAXIEFAAJB-IRXDYDNUSA-N 383.496 2.539 0 50 GFAA CC(C)CN1CC[C@@H](CNC(=O)N2CCC(c3nnc4ccccn34)CC2)C1 133812871 MAPWICNGUGDTMI-KRWDZBQOSA-N 384.528 2.596 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1 140175293 GTVYUKBSRLBHEG-IBGZPJMESA-N 379.460 2.561 0 50 GFAA Cc1ccc(N2CCCN(C[C@H](O)Cc3ccccc3C(F)(F)F)CC2)nn1 152929433 WOYDTAYKJHWCAK-QGZVFWFLSA-N 394.441 2.920 0 50 GFAA Cc1ccccc1C(=O)NC1CCN(C(=O)[C@@H](C)Oc2cccc(CO)c2)CC1 161683937 RXAIHSICZPSZBP-QGZVFWFLSA-N 396.487 2.676 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2ccc(C(F)(F)F)nc2)C[C@H]1C(=O)O 169725751 KXAFYYVYZFPVIP-NSHDSACASA-N 375.347 2.611 0 50 GFAA Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccoc4)ccn3n2)c(C)c1 169775702 CQRQJZYFPCKAFF-UHFFFAOYSA-N 376.416 2.803 0 50 GFAA CC(C)N(C(=O)[C@@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)C(C)C 170616584 ZTWAKOHPIMUCMT-SJLPKXTDSA-N 389.496 2.511 0 50 GFAA COc1ccccc1CN1CCN(S(=O)(=O)c2cccc3cnccc23)CC1 170821853 ZCKFCYFXDMYNST-UHFFFAOYSA-N 397.500 2.750 0 50 GFAA O=C(N[C@@H]1CCc2[nH]ncc2C1)c1cccc(-n2nccc2C(F)(F)F)c1 172219184 MPTXSOYOOWBRMR-CYBMUJFWSA-N 375.354 2.902 0 50 GFAA O=C(NCc1nccn1CCc1ccccc1)N[C@H]1c2ccccc2C[C@@H]1O 175922676 IFDVYNGPPJVYFI-FPOVZHCZSA-N 376.460 2.583 0 50 GFAA O=C(NCc1ccc(Cl)cn1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 180829444 WJJVGGQOPZRPLU-UHFFFAOYSA-N 385.855 2.925 0 50 GFAA CN(C(=O)Cc1coc(-c2ccc(F)cc2)n1)c1ccc(N2CCOCC2)nc1 182963601 FRFLFXRTQOKFIF-UHFFFAOYSA-N 396.422 2.918 0 50 GFAA Cc1cc(C)cc(OCC(=O)N2CCN(C(=O)c3cc(F)ccc3F)CC2)c1 195037209 JMYMUKYHTNJJQP-UHFFFAOYSA-N 388.414 2.945 0 50 GFAA Cc1cccnc1CNC(=O)[C@@H]1C[C@H](C(=O)O)N(C)[C@@H]1c1cccc(Cl)c1 211534727 GIEZSVGAEUZQDQ-KBAYOESNSA-N 387.867 2.806 0 50 GFAA CCOC(=O)C1([C@H](C)NCCCCOC)CCN(C(=O)OC(C)(C)C)CC1 225406273 WMZSMBYQJKCEGT-INIZCTEOSA-N 386.533 2.972 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@@H](CCC(=O)O)C1)c1c(F)cccc1F 236717704 ZTHXNQCHVPWCOL-XJKSGUPXSA-N 382.407 2.636 0 50 GFAA C[C@H](C(=O)Nc1ccc(Br)cc1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O 239025268 BIKOHLLBMQDSFE-CDYMVBJSSA-N 391.265 2.807 0 50 GFAA C[C@@H]1[C@@H](NC(=O)CN2C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C2=O)CCC[C@H]1C 241121735 JDPIQTJSTHWUOZ-BDFQZXNOSA-N 396.491 2.572 0 50 GFAA NC(=O)CCN(Cc1ccccc1)C[C@H](O)CO[C@H]1CCCc2ccccc21 247710672 JAYVWTVWLVAGBS-UNMCSNQZSA-N 382.504 2.819 0 50 GFAA Cn1cc([C@H](NS(=O)(=O)c2ccc(C(C)(C)C)cc2)[C@H]2C[C@@H](O)C2)cn1 252571264 XQWGVWSMDNACMD-RPVQJOFSSA-N 377.510 2.508 0 50 GFAA O=C(NC[C@@H](CO)Cc1cccnc1)c1cccc(-c2noc(C3CC3)n2)c1 253432256 JOGJYMGWONAZNT-HNNXBMFYSA-N 378.432 2.590 0 50 GFAA NC(=O)N[C@H](CC(=O)N1CCC[C@H]1C(=O)O)c1cccc(Oc2ccccc2)c1 262718143 TVPOQCDASVAQIS-MSOLQXFVSA-N 397.431 2.654 0 50 GFAA CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1 263089617 HRQKTVVQQSSBKL-UHFFFAOYSA-N 375.446 2.889 0 50 GFAA CCCNC(=O)C1CCN(C(=O)c2ncn3c2CO[C@@H](c2ccccc2)C3)CC1 263619107 WYLXCXQNPFUEQU-LJQANCHMSA-N 396.491 2.533 0 50 GFAA COc1ccc(Nc2cc(N3CCC[C@H](c4nncn4C)C3)ncn2)c(OC)c1 271580605 DOVBTRIGWHVOFE-AWEZNQCLSA-N 395.467 2.750 0 50 GFAA CNC(=O)C1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)CC1 287168325 JHDYFGUNLWOJBB-ZCFHBRKKSA-N 385.508 2.505 0 50 GFAA Cc1cccnc1OC1CCN(c2cc(N3CCCC[C@@H]3CO)ncn2)CC1 290919207 HYUXVEORFRRYAP-QGZVFWFLSA-N 383.496 2.579 0 50 GFAA CC(=O)N1CCC(NC(=O)Nc2ccnn2Cc2ccc(Cl)cc2)CC1 299790567 BSEPMXWNGGVHNO-UHFFFAOYSA-N 375.860 2.717 0 50 GFAA O=C1CCCN1c1ccc(S(=O)(=O)Nc2cc(-c3cccnc3)on2)cc1 369555439 CLFNHYSAZROHPB-UHFFFAOYSA-N 384.417 2.664 0 50 GFAA O=C(NCC1(c2ccc(Br)s2)CCC1)[C@H]1CCc2nn[nH]c2C1 375928134 RJIUINOIXUZESS-JTQLQIEISA-N 395.326 2.972 0 50 GFAA Cc1nc(CCNC(=O)N(C)Cc2ccc3c(c2)OCO3)nc2c1CCCC2 426667692 XSCDXKZHOGXXAS-UHFFFAOYSA-N 382.464 2.777 0 50 GFAA CC(C)Cc1ncc2c(n1)CN(C(=O)Nc1ccccc1CC(=O)N(C)C)C2 426693729 LRKPGMHKNIKMMO-UHFFFAOYSA-N 381.480 2.854 0 50 GFAA O=C1CN(C(=O)N[C@@H]2COC3(CCCCC3)C2)CCN1CCc1ccccc1 426701647 QXHMLKUHDKNUBK-IBGZPJMESA-N 385.508 2.575 0 50 GFAA C[C@H](NC(=O)c1cn2ccccc2n1)c1cc(F)ccc1N1CCC(O)CC1 748072873 VQYXIMQLGLSSDR-AWEZNQCLSA-N 382.439 2.926 0 50 GFAA O=C(NCc1nncn1CCc1ccccc1)c1ccc(C(F)(F)F)nc1 828163296 VAVNBEKYCJKBKR-UHFFFAOYSA-N 375.354 2.865 0 50 GFAA Cc1ccncc1[C@@H]1CCN(S(=O)(=O)c2ccc(N3CCCC3=O)cc2)C1 888077509 FVYBQUQLUZRCTC-MRXNPFEDSA-N 385.489 2.695 0 50 GFAA CCN1C[C@@H](CN(C)S(=O)(=O)c2ccc(-c3csc(C)n3)s2)CC1=O 952967892 FFFYHQHTWWKDDK-GFCCVEGCSA-N 399.563 2.669 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)NC1CCN(C[C@@H]2CCCO2)CC1 1506414591 GHZDZLWTHVZAEZ-KRWDZBQOSA-N 393.915 2.737 0 50 GFAA C[C@H]1C(=O)N2CCC[C@@H]2CN1c1nnnn1-c1ccc(Oc2ccccc2)cc1 1772703190 JYXSWJXXNNPLCA-DOTOQJQBSA-N 390.447 2.654 0 50 GFAA COc1cc(C)c(C(C)C)cc1S(=O)(=O)N1C[C@H]2CCCN2C(=O)[C@H]1C 1772706905 HSAPVJJAVJJGJT-HUUCEWRRSA-N 380.510 2.511 0 50 GFAA CN1CCOC2(CCN(S(=O)(=O)c3ccc(-c4ccccc4)cc3)CC2)C1 1772807257 STXVLIAXYSOMDC-UHFFFAOYSA-N 386.517 2.839 0 50 GFAA Cc1ccc(-c2nc(-c3nc4ccccn4c3C)n(C[C@H]3COCCO3)n2)o1 1857666874 XJTMVKUVRQHIKY-HNNXBMFYSA-N 379.420 2.885 0 50 GFAA Cc1ccc2nc(N3C[C@H](C(=O)NCCc4ccccn4)CC3=O)sc2c1 1857667247 GLTDRVWZJYBJLJ-CQSZACIVSA-N 380.473 2.712 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2nn(C)c3ccccc23)[C@H]1c1ccccc1 1857684677 XVXDFKAAMATVFR-FPOVZHCZSA-N 378.476 2.717 0 50 GFAA O=C(O)[C@@H]1CN(CCc2ccccc2)CC12CCN(Cc1ccccn1)CC2 1857692547 KBOLLTRDVPKZQP-NRFANRHFSA-N 379.504 2.923 0 50 GFAA O=C(c1cccc2[nH]ccc12)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857707996 DUEFYANGHSNICK-SFTDATJTSA-N 389.455 2.810 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)NCCCc3ccccc3Cl)CC2=O)s1 1857716041 TZAKKAYIHAXSJR-CYBMUJFWSA-N 392.912 2.856 0 50 GFAA COc1ccccc1CCC(=O)N1CCC2(CCc3c(O)nc(C)nc32)CC1 1857719617 QTRBTMWLLVGAGE-UHFFFAOYSA-N 381.476 2.938 0 50 GFAA COc1ccc(C)cc1CN1CCN(C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875288430 CKUBTUYXDYOXCA-JKSUJKDBSA-N 398.507 2.707 0 50 GFAA O=C1CCN(Cc2cscn2)C(=O)N1C[C@H]1CCN(c2ccc(F)cc2)C1 1875293475 RLFMKHIQKUZFPM-AWEZNQCLSA-N 388.468 2.963 0 50 GFAA CSC[C@H](Cc1ccc(F)cc1F)NC(=O)[C@@H](N)CCc1ccccn1 1875327001 VKUXBXNIHFWPAR-WMZOPIPTSA-N 379.476 2.710 0 50 GFAA O=C(c1cc2ccccc2n1Cc1ccncc1)N1CC(NC2CCOCC2)C1 2325774146 FGMVKJRGLLGKSA-UHFFFAOYSA-N 390.487 2.678 0 50 GFAA CCCN(Cc1ccc(F)cc1C)C(=O)c1cc(S(=O)(=O)N(C)C)cn1C 2325782112 ZFOCJTJMOLTNLN-UHFFFAOYSA-N 395.500 2.775 0 50 GFAA Cc1cc(C(=O)NC[C@@]2(C)CCCN(C(=O)COCC3CC3)C2)nn1C(C)C 2325794191 UPMBTWFFADCUST-OAQYLSRUSA-N 390.528 2.558 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CCN[C@@H](c4cn[nH]c4)C3)cc2F)n1 2325803540 NBODCOHYAMIYGI-QGZVFWFLSA-N 383.431 2.530 0 50 GFAA N[C@@H](CNC(=O)Cc1cn2cc(F)ccc2n1)c1ccccc1Br 2325856220 GIKLSBTVSXNYIU-HNNXBMFYSA-N 391.244 2.595 0 50 GFAA CN1C(=O)[C@H](CC(=O)Nc2ccc(Cl)cc2)N(Cc2ccco2)C1=S 1125697 ZKJNGTCHEMHBLB-AWEZNQCLSA-N 377.853 2.889 0 50 GFAA Cc1nn(C[C@H](C)C(=O)NCc2ccc3c(c2)OCO3)c(C)c1Br 2793990 FTPHDVGWSKHASA-JTQLQIEISA-N 394.269 2.944 0 50 GFAA CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O 4763710 GTXSTEDIVHHJQL-KBMXLJTQSA-N 396.509 2.650 0 50 GFAA CCOc1ccc(NC(=S)N2CCC(C(N)=O)(N3CCCCC3)CC2)cc1 4916350 JEEXXDQNZCSNHW-UHFFFAOYSA-N 390.553 2.588 0 50 GFAA CCOc1ccc(N(CC(=O)N(C)C)S(=O)(=O)c2ccc(F)cc2)cc1 5028141 QZMNPSGOSNHRFH-UHFFFAOYSA-N 380.441 2.508 0 50 GFAA CC(=O)c1ccc(N2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)cc1 8457101 YNASEQKWOARWQV-UHFFFAOYSA-N 380.416 2.678 0 50 GFAA CCS(=O)(=O)N1CCC[C@@H](C(=O)NC(c2ccccc2)c2ccccc2)C1 10302685 PCWXMULQBKVCLZ-LJQANCHMSA-N 386.517 2.954 0 50 GFAA Cc1c(C(=O)N(C)[C@H]2CCOC2)sc2ncnc(NCc3ccccn3)c12 11913378 FLDIHRRNVNSXGC-AWEZNQCLSA-N 383.477 2.868 0 50 GFAA O=C(CN1CCCCC1=O)N[C@@H]1CCCc2c1cnn2-c1ccc(F)cc1F 12111751 DAXGNLYPYAMMOQ-MRXNPFEDSA-N 388.418 2.657 0 50 GFAA Cc1ccc(OC2CCN(Cc3ccncc3)CC2)c(C(=O)N[C@H]2CCOC2)c1 12304621 FJSWSGNGVSLGHV-IBGZPJMESA-N 395.503 2.952 0 50 GFAA Cc1ncc(CN2CCCC[C@@H]2C(=O)Nc2ccc(-n3cccn3)cc2)cn1 12713052 GAFVVMRQNVXHHN-HXUWFJFHSA-N 376.464 2.964 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1 13545226 XGPRTNUAFMBVAG-INIZCTEOSA-N 388.489 2.526 0 50 GFAA CN1C(=O)N(CCc2ccccc2)C(=O)C12CCN(Cc1cccnc1)CC2 14543347 YWDAWQYUYRHMMC-UHFFFAOYSA-N 378.476 2.553 0 50 GFAA O=C(O)COCC(=O)Nc1sc2c(c1C(=O)NC1CCCCC1)CCCC2 17080624 RJBGFKOEEAIZAB-UHFFFAOYSA-N 394.493 2.729 0 50 GFAA CCc1ccc(NC(=O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19361630 HOMJMZLCVGUBSG-UHFFFAOYSA-N 381.476 2.734 0 50 GFAA Cc1cc(C(=O)N2CCC(n3cc([C@H](C)O)nn3)CC2)ccc1-n1cccc1 20560759 XYUAIAUJMMTRNI-INIZCTEOSA-N 379.464 2.908 0 50 GFAA COc1ccc(C(=O)N2CCN(C(=O)[C@H]3Cc4ccccc4S3)CC2)cc1 31132886 BOCCDCPINDXHMO-LJQANCHMSA-N 382.485 2.697 0 50 GFAA CSc1ccc([C@H]2CC(=O)Nc3c2c(C)nn3-c2ccc3nncn3n2)cc1 33011410 MDRUAPFDMLCGNA-CQSZACIVSA-N 391.460 2.814 0 50 GFAA Cn1nc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)c(Cl)c1C(F)(F)F 33026164 CHVZDNSDCDHJOM-UHFFFAOYSA-N 381.763 2.748 0 50 GFAA CCCN1CCC(N2CCN(Cc3ccc(OC)c(C)c3)[C@H](CCO)C2)CC1 39537361 IPFMAMAKPUOSHG-JOCHJYFZSA-N 389.584 2.747 0 50 GFAA CCCS(=O)(=O)c1ncc(CN(C)Cc2ccccc2)n1C[C@H]1CCCO1 55153885 GWSLOFPKXRQFCG-LJQANCHMSA-N 391.537 2.878 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccc(F)cc4F)CC3)ncn2)n1 67603727 OPTCCLAHWXIIAC-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA CN(C)C(=O)CCN1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67871890 BKFQHQHTBDIQLG-UHFFFAOYSA-N 375.856 2.780 0 50 GFAA O=C([C@@H]1C[C@@H](O)CN1)N1CCc2onc(-c3ccc(-c4ccccc4)cc3)c2C1 67966567 JTVLFURMFJVODP-QUCCMNQESA-N 389.455 2.616 0 50 GFAA CC(=O)N1CCC(N2CCC(=O)N(Cc3ccc(F)cc3)[C@@H](C(C)C)C2)CC1 71415546 FBQXFXTVXVKKNK-OAQYLSRUSA-N 389.515 2.896 0 50 GFAA COc1ccc(F)c(CN2CCC(N3CCC[C@@H](C(=O)NC4CC4)C3)CC2)c1 71738753 UHKVMJHRIGLTNW-MRXNPFEDSA-N 389.515 2.789 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(c3nccc4ccccc34)CC2)C1 71777177 QQDIUJFDYOHVPR-IBGZPJMESA-N 396.535 2.678 0 50 GFAA O=C(c1cn(C2CCCCC2)nn1)N1CCc2[nH]cnc2[C@H]1c1ccncc1 72133650 FFJPKTIMJFIABA-LJQANCHMSA-N 377.452 2.689 0 50 GFAA COc1ccc(C(=O)N2CCc3c(nc(-c4ccccc4)[nH]c3=O)C2)c(C)c1 72161270 DNGQJHIWNAAUEF-UHFFFAOYSA-N 375.428 2.952 0 50 GFAA Cc1ccccc1CN(C(=O)C[C@H]1C(=O)NCCN1Cc1ccoc1)C(C)C 72167334 ILFHQYSWKFLDBL-FQEVSTJZSA-N 383.492 2.716 0 50 GFAA COc1cccc(OC[C@@H]2CCCN(C(=O)c3cnn4cc(C)cnc34)C2)c1 77471445 XOINHLZOHOOREH-MRXNPFEDSA-N 380.448 2.978 0 50 GFAA O=C(Cn1c(-c2ccccc2)nn(-c2ccccc2Cl)c1=O)NCC1CC1 77506191 CQPXMKRBFVYXNA-UHFFFAOYSA-N 382.851 2.881 0 50 GFAA COCCN1CC2(CCC1=O)CCN(Cc1ncc(C)c(OC)c1C)CC2 91321528 VKKFLUMAOTUJTO-UHFFFAOYSA-N 375.513 2.558 0 50 GFAA Cc1ncc(C(=O)N2C[C@@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95365992 KYABWEMFOLCEDC-XUVXKRRUSA-N 384.430 2.766 0 50 GFAA CN(C)CCN(C[C@@H]1CCCN(Cc2ccccc2F)C1)C(=O)c1cnco1 95511826 RREJSJAIBZDJHY-QGZVFWFLSA-N 388.487 2.730 0 50 GFAA COc1ccccc1CN1CCC(CN(CC(C)C)C(=O)c2ncn[nH]2)CC1 95519335 KJMZSZCOWRKWEC-UHFFFAOYSA-N 385.512 2.824 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95527396 UYEDCDVHARVDDC-INIZCTEOSA-N 376.464 2.558 0 50 GFAA CCOc1ccc(NC(=O)NCCN2CCC[C@@H](CO)C2)cc1C(F)(F)F 96137326 PBNFSESOSNWOEW-CYBMUJFWSA-N 389.418 2.930 0 50 GFAA CCc1ccccc1OCC(=O)N1CCN(c2ncnc3sccc23)CC1 123819375 MKWQRVIBONDVTF-UHFFFAOYSA-N 382.489 2.981 0 50 GFAA CC(C)c1noc(-c2ccn3c(CNC(=O)Cc4ccc(F)cc4)nnc3c2)n1 169776272 WCSPYXBFQHZUPQ-UHFFFAOYSA-N 394.410 2.901 0 50 GFAA Cc1nc(-c2ccc(S(=O)(=O)NCc3nncn3C3CC3)s2)cs1 170619718 FXOFISPCUDAMHR-UHFFFAOYSA-N 381.508 2.585 0 50 GFAA Cc1nc(C[C@@H]2CCCN(C(=O)Nc3ccc(F)c(C(=O)N(C)C)c3)C2)no1 176063035 KZPHKRFHXLNERW-ZDUSSCGKSA-N 389.431 2.706 0 50 GFAA CN(CCC1CCN(c2ccncc2)CC1)[C@@H]1CCCN(c2cnn(C)c2)C1=O 179396124 ATGKSQRNQIFDPX-OAQYLSRUSA-N 396.539 2.549 0 50 GFAA O=C([C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F)N1CCC2(CC1)OCCO2 192148699 IPWDJGNIIVCVJR-IAGOWNOFSA-N 398.425 2.662 0 50 GFAA Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(N4CCCC4)ccn3)C2)n1 194461507 XWUSPQSFPKOOET-QGZVFWFLSA-N 393.491 2.876 0 50 GFAA Cc1ccc2nc(CCNC(=O)[C@@H](C)c3n[nH]c(=O)c4ccccc34)[nH]c2c1 215628745 PDMNFAKBSCBBIM-ZDUSSCGKSA-N 375.432 2.570 0 50 GFAA Cc1ccc(NC(=O)[C@@H](C)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)c1 221892071 UGKOHVPSRFHPLJ-SJORKVTESA-N 391.512 2.856 0 50 GFAA COc1ccc([C@H](O)[C@H](C)NC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)cc1 221998418 SDOOUSACWMLWBM-VNBZBWLYSA-N 386.473 2.980 0 50 GFAA C[C@H](O)CN1CCN(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)[C@@H](C)C1 241869077 SUFNZSBFNQAHBB-STQMWFEESA-N 388.434 2.690 0 50 GFAA O=S(=O)(c1cnn(-c2ccccc2)c1)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 246338103 LMSBLZKNAGQMAE-OXJNMPFZSA-N 386.521 2.510 0 50 GFAA CN(C)S(=O)(=O)c1ccc2oc(SC[C@H]3CC4(CCC4)C(=O)O3)nc2c1 253431652 SQAHBFQHWZWIQA-LLVKDONJSA-N 396.490 2.656 0 50 GFAA O=c1c2cc(-c3cccs3)nn2ccn1C[C@H](O)c1ccc2c(c1)OCO2 263616683 KASBLAKKFUSYMQ-HNNXBMFYSA-N 381.413 2.687 0 50 GFAA C[C@@H]1Sc2ccc(C(=O)Nc3cc(CSCCO)ccn3)cc2NC1=O 269619069 NEJCAGBFVQNHGL-NSHDSACASA-N 389.502 2.992 0 50 GFAA O=C1NCCN1c1ccc(C(=O)N2CCC[C@@H]2Cn2cnc3ccccc32)cc1 270182346 XFWFSKDYTRTRMU-GOSISDBHSA-N 389.459 2.871 0 50 GFAA O=S(=O)(/C=C/c1ccc(Br)cc1)NC[C@H]1CCc2nccn2C1 275218549 BTDJSUZAMPCWLY-DNGMOHDESA-N 396.310 2.798 0 50 GFAA Cn1ccnc(N2CCC[C@H](NCc3cccc(OC4CCCC4)c3)C2)c1=O 275543947 MVWLGLTVLBNPAB-SFHVURJKSA-N 382.508 2.860 0 50 GFAA O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CC[C@@H](n2cccn2)C1 291702270 IBRWCZTWHAMBTO-LJQANCHMSA-N 381.480 2.666 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)NC[C@H]3CC(=O)N(C4CCCC4)C3)cc2)[nH]1 299801048 YBQNIXMMIMITRE-CQSZACIVSA-N 382.468 2.693 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CC[C@@H](CN)C4)csc3C2)nc1 426503200 AKEAEVODBIHPFJ-INIZCTEOSA-N 384.549 2.685 0 50 GFAA O=C(NCCc1cn[nH]c1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 462134785 FEAAMMCZCNEKPB-LJQANCHMSA-N 377.448 2.501 0 50 GFAA CSCC(=O)N1CCC2(CC1)CN(C(=O)c1cccc(Cl)c1)CCO2 824881431 TZMPRSPTDPHANJ-UHFFFAOYSA-N 382.913 2.537 0 50 GFAA O=C(NCc1noc(-c2ccccc2F)n1)N[C@@H]1CCO[C@H]1c1cccnc1 888101038 QLMDYMPEIOPGNB-WBVHZDCISA-N 383.383 2.600 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)n(C)n1 1529167084 GAUBOBVJXAMAAZ-VGOFRKELSA-N 392.503 2.842 0 50 GFAA CSCc1ccc(C(=O)N2C[C@@H]3CN(C4CCCCC4)C[C@]3(C(=O)O)C2)o1 1565505997 AXNCKKTUOSUOSI-XOBRGWDASA-N 392.521 2.934 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cncnc4)C[C@H]2CN(Cc2cc[nH]n2)C3)cc1 1772814023 FSOFNJICPYFMQK-GMAHTHKFSA-N 388.519 2.767 0 50 GFAA CCc1ccccc1CN1C[C@H](C(=O)O)C2(CCN(Cc3cnc[nH]3)CC2)C1 1857685148 PIWAZPAMINZPFT-HXUWFJFHSA-N 382.508 2.771 0 50 GFAA CCN1CCC[C@@H](n2ccnc2-c2ccc(OCCN3CCOCC3)cc2)C1 1857727018 IBXSUHOKUOUWIJ-HXUWFJFHSA-N 384.524 2.918 0 50 GFAA COc1cc2nccc(N3CC[C@@H](CNC(N)=O)C3)c2cc1Br 1875266412 MQVFYMLKNTZBOQ-JTQLQIEISA-N 379.258 2.501 0 50 GFAA O=C(Nc1cccc(-c2nnnn2C2CC2)c1)c1cc2c(cc1F)CCNC2 1875304749 TWIWCFVRFJWEHL-UHFFFAOYSA-N 378.411 2.712 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1cc(-c2ccccc2Cl)no1 1875402625 JDONWNFTCHMIFL-CSMYWGQOSA-N 386.839 2.761 0 50 GFAA O=C(N[C@H]1CC[C@H]1c1ccc(F)cc1F)N1CCS(=O)(=O)C[C@H]1C1CCC1 1875404900 ZWIAEYOKDMSBDO-SZMVWBNQSA-N 398.475 2.820 0 50 GFAA Cc1cnn(C)c1C(=O)N(C)C1CC(NC(=O)c2cc3c(C)ccc(F)c3[nH]2)C1 2325793994 NLQIKWZOCUBAOZ-UHFFFAOYSA-N 397.454 2.690 0 50 GFAA CCOc1ccccc1N1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1 689336 BXYHGZUHEMLLMJ-UHFFFAOYSA-N 376.478 2.605 0 50 GFAA CC(=O)c1cccc(N(CC(=O)Nc2ccc(F)cc2F)S(C)(=O)=O)c1 1065789 UHQVVLGBWPHHGI-UHFFFAOYSA-N 382.388 2.572 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)C(c2ccccc2)c2ccccc2)cc1 1140316 FOZJOXKODJQGNI-UHFFFAOYSA-N 380.469 2.782 0 50 GFAA COC(=O)COc1ccc(Br)cc1/C=C1\SC(=O)N(C)C1=O 1186567 SSIGUEQTMCQROT-WDZFZDKYSA-N 386.223 2.667 0 50 GFAA COc1ccc(-n2c(CNC(=O)[C@@H]3CCOC(C)(C)C3)nnc2SC)cc1 12131289 LNESILFLQPBKGH-CYBMUJFWSA-N 390.509 2.819 0 50 GFAA O=C(Cc1ccccc1)NCc1cccnc1N1CCN(c2ccccn2)CC1 12200678 PBJSEWZEFHOUOO-UHFFFAOYSA-N 387.487 2.662 0 50 GFAA O=C(c1cccc(OC2CCN(Cc3cccnc3)CC2)c1)N1CCOCC1 12449181 ZQGYBAMXTIEQNF-UHFFFAOYSA-N 381.476 2.597 0 50 GFAA CCc1ccc(S(=O)(=O)N2CCC[C@H](CNC(=O)c3cccnc3)C2)s1 12479443 NFDWXGGCAPNLQK-CQSZACIVSA-N 393.534 2.536 0 50 GFAA O=C(NCc1ccccc1-n1cncn1)[C@@H]1CCC(=O)N(C2CCCCCC2)C1 12707237 RLPXZTICOQQVIA-GOSISDBHSA-N 395.507 2.845 0 50 GFAA COc1ccc(CN(C)C(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 14820109 KIYKKIHSGAXJKO-UHFFFAOYSA-N 388.489 2.752 0 50 GFAA CCOC(=O)[C@]1(CCOC)CCCN(Cc2cc(OC)c3c(c2)OCO3)C1 15063946 RXTJQVBMPOFTLS-FQEVSTJZSA-N 379.453 2.606 0 50 GFAA Cn1c(COc2ccc(Br)cc2)nnc1SCC(=O)NC1CC1 17081217 BTDNHJWTGUPUJA-UHFFFAOYSA-N 397.298 2.527 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)N2CCC[C@H](CN3CCCCC3)C2)cc1 19224348 PMXFCPLTHBSZCI-QGZVFWFLSA-N 393.553 2.786 0 50 GFAA O=C1C[C@H](N2CCN(C3CCCCC3)CC2)C(=O)N1c1ccc(Cl)cc1 19809597 QHQNUURBBSFXLV-SFHVURJKSA-N 375.900 2.922 0 50 GFAA CCOc1ccccc1NC(=O)CN1CCN(Cc2cccc(OC)c2)CC1 20190219 AERASUMDZZQTPC-UHFFFAOYSA-N 383.492 2.850 0 50 GFAA O=C(c1cn2c3c(cccc3c1=O)CC2)N1CCN(c2ccc(F)cc2)CC1 20453120 KFMZFLBVRDHMQR-UHFFFAOYSA-N 377.419 2.659 0 50 GFAA CN1Cc2ccccc2C[C@@H]1CNCc1c[nH]nc1-c1ccc2c(c1)OCO2 20600266 JLWCKEKBWBREMI-LJQANCHMSA-N 376.460 2.952 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cccc(F)c3F)C[C@@H]2CCO)CC1 22925935 BNIMRXBFSNUKOA-IBGZPJMESA-N 381.511 2.706 0 50 GFAA Cc1cc(C(=O)N(Cc2ccccn2)CC(C)C)cc(S(N)(=O)=O)c1C 55036043 JAQOMXGAAZKECF-UHFFFAOYSA-N 375.494 2.644 0 50 GFAA Cc1ccc(NC(=O)c2cc3c(=O)[nH]c(=O)n(Cc4ccco4)c3nc2C)cc1 67630414 ONRKXBQTOHRATE-UHFFFAOYSA-N 390.399 2.595 0 50 GFAA COc1c(F)ccc(C(=O)N[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)c1F 72161875 GSXNTZXLOZUMPC-CQSZACIVSA-N 392.377 2.686 0 50 GFAA CCn1c(CN2CCCC2)nnc1C1CCN(C(=O)c2ccccc2O)CC1 82106803 QGLLUFHCYNBBHR-UHFFFAOYSA-N 383.496 2.619 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2ccccc2-c2nc[nH]n2)C[C@H]1c1ccc(F)cc1 91876380 FVWHWFRSFOPPJC-DLBZAZTESA-N 380.379 2.551 0 50 GFAA O=C(c1cnn2ccccc12)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95386046 ZDXFRKDDYPNAOT-GOSISDBHSA-N 386.459 2.994 0 50 GFAA O=C(NCc1cccnc1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 95499460 KWOPPMNHLALXIT-UHFFFAOYSA-N 379.460 2.791 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3cscn3)C2)nc(C)n1 95507573 UVHRBTTXGGVJFJ-OAHLLOKOSA-N 382.493 2.815 0 50 GFAA O=C(Nc1ccc2c(c1)COC2)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 96151766 XLWBTKRZMVLOEQ-IBGZPJMESA-N 386.473 2.938 0 50 GFAA COc1c[nH]c(C(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCCC2)cc1=O 97515108 PTFWNADPEKYZQW-INIZCTEOSA-N 375.856 2.604 0 50 GFAA COc1cc(OC)c(CN2CCN(CC(C)(C)C)[C@H](CCO)C2)c(OC)c1 104422537 CNDYKVYPBJKCPL-MRXNPFEDSA-N 380.529 2.627 0 50 GFAA COc1ccc(-c2nc(C(=O)N3CCC[C@@H](Cn4ccnn4)C3)cs2)cc1 124702345 NTNVWERMXJRMDD-CQSZACIVSA-N 383.477 2.963 0 50 GFAA CC(C)c1noc(-c2cn([C@@H]3CCN(C(=O)[C@@H](C)Oc4ccccc4)C3)nn2)n1 169778140 WBPXIDCNIUKTFL-HUUCEWRRSA-N 396.451 2.692 0 50 GFAA CN(Cc1nc(C(C)(C)NC(=O)OC(C)(C)C)no1)c1cccc(CO)c1 170590926 QMRPFJVYKMZNOU-UHFFFAOYSA-N 376.457 2.958 0 50 GFAA CC(C)(C)c1ccc(C(=O)C(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)cc1 170630481 ZMZINWWVEOAJPC-UHFFFAOYSA-N 393.487 2.615 0 50 GFAA O=C(CCc1nnc(-c2ccsc2)o1)NCc1ccnc(-n2ccnc2)c1 194658571 JZJYWESZROEEGL-UHFFFAOYSA-N 380.433 2.628 0 50 GFAA O=C(COc1ccc(CN2CCC[C@H](c3ccncn3)C2)cc1)N1CCCC1 215010565 XYVRRHRKBJBYOH-IBGZPJMESA-N 380.492 2.857 0 50 GFAA COCc1nc([C@H]2C[C@H](NC(=O)c3c(F)ccc(C)c3Cl)C2)cc(=O)[nH]1 223206400 KUKWLSWAIBVYNG-PHIMTYICSA-N 379.819 2.693 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccccc2CNC(=O)CCNC(=O)[C@@H]2C[C@H]2C)C1 229764588 IIQJQXAGHGWZPW-BMQTXXJKSA-N 385.552 2.943 0 50 GFAA C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)CN3CCCC3=O)cc2F)C[C@H](C)O1 229836246 RNXNCWBMRGWJGT-ILXRZTDVSA-N 392.475 2.572 0 50 GFAA Cc1sc2nc(CS[C@H](C)C(=O)NC[C@@H](C)C[C@H](C)O)[nH]c(=O)c2c1C 230136013 NHNIXAFEQQHUOU-OUJBWJOFSA-N 397.566 2.746 0 50 GFAA COCC[C@H](Cc1cccc(Br)c1)C(=O)N1CCC(C(=O)O)CC1 237116255 XRBCURAMVWUZBE-OAHLLOKOSA-N 398.297 2.968 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)N[C@H]2CCc3ccccc32)cc1 239760974 CIWVVJNFWZIZIB-VQTJNVASSA-N 384.501 2.952 0 50 GFAA COc1ccccc1[C@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)[C@@H]2C3CCN(CC3)[C@H]12 240662410 PKTQFPPHXQPTIX-IZHZWAPYSA-N 384.520 2.635 0 50 GFAA Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1nn(C)c(=O)c2ccccc12 252444062 YOTIDOANGYFEDL-UYAOXDASSA-N 388.471 2.690 0 50 GFAA CCCOc1nc(C)ccc1C(=O)N[C@@H](C)Cn1ncc2ccccc2c1=O 252494338 NSMFQMZFXOSGBS-HNNXBMFYSA-N 380.448 2.707 0 50 GFAA Cc1nn(C)c2ncc(C(=O)N[C@@H](C)[C@H]3CCN(Cc4ccccc4)C3)cc12 252535717 GRALOZNBSAJZSJ-YJBOKZPZSA-N 377.492 2.917 0 50 GFAA Cn1ccc2ccc(NC(=O)C[C@H]3N=C(O)N(Cc4ccccc4)C3=O)cc21 252536685 JDVMTGYIHJGARB-QGZVFWFLSA-N 376.416 2.832 0 50 GFAA Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1 299188415 BHBPPPUEBPIYCM-IBGZPJMESA-N 393.487 2.592 0 50 GFAA COc1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1OCc1csc(C)n1 299740739 BNYRJMIRPAKECK-CYBMUJFWSA-N 376.434 2.586 0 50 GFAA Cc1ccc(CC(=O)NCc2cc3n(n2)CCN(C(=O)C2CCC2)C3)cc1C 299771585 UMPRGMQCLNPFIQ-UHFFFAOYSA-N 380.492 2.501 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccn2)CC1 328623313 BWNQFLMDSJLIMI-MRXNPFEDSA-N 383.448 2.885 0 50 GFAA CCOC(=O)c1c(C)oc2nc(CN3CCC[C@]4(CCCCO4)C3)nc(N)c12 369676571 QODIRUIXEIWIGF-HXUWFJFHSA-N 388.468 2.825 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 378505236 BVFHONGJIDVWJB-VGSWGCGISA-N 379.504 2.963 0 50 GFAA COc1ccnc(N2CCN(C(=O)c3ccc(-c4cc(C)ccn4)cc3)CC2)n1 426477441 SZSIBAQGPNERMU-UHFFFAOYSA-N 389.459 2.818 0 50 GFAA Cn1ccnc1[C@H]1CCCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1 444802791 ONYZSUPPUMNELA-HNNXBMFYSA-N 389.463 2.634 0 50 GFAA COc1ccc(-n2ccc(C(=O)N3CCc4ccccc4[C@H]3C(=O)O)n2)cc1 486024829 DHSIHTBMJUGFQY-IBGZPJMESA-N 377.400 2.705 0 50 GFAA O=C(NCc1noc(-c2ccco2)n1)N(Cc1ccccn1)C[C@H]1CCCO1 534646678 DAMWYQUQOCEBEZ-OAHLLOKOSA-N 383.408 2.615 0 50 GFAA Cc1cc(C(C)(C)C)cc(S(=O)(=O)NCCN2CCC[C@H](CO)C2)c1C 670434041 SAMBURXOAYKQMN-KRWDZBQOSA-N 382.570 2.584 0 50 GFAA Cc1ccc2oc(=O)n(CCC(=O)N[C@@H](C)c3nc(-c4ccncc4)no3)c2c1 670449531 ZLBPKBXPZBUHGX-ZDUSSCGKSA-N 393.403 2.615 0 50 GFAA CCn1cnc2c1CCN(Cc1nnc(C(=O)Nc3ccc(OC)cc3)s1)C2 933259535 PYARIHKZXQMVQI-UHFFFAOYSA-N 398.492 2.574 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1C[C@@H]2CN(CC3CCC3)C[C@]2(C(=O)O)C1 1565529740 SYPVPDBMUWCMDD-DJJJIMSYSA-N 380.847 2.738 0 50 GFAA CCCn1cc(C(=O)N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)c(C)n1 1615941123 POVQHWHLOVDOJT-UWJYYQICSA-N 378.476 2.825 0 50 GFAA O=C(CCN1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1)NC1CCCCC1 1704315196 PYKVVSMMVGJMFH-XMSQKQJNSA-N 381.520 2.909 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@@H](c2nc3ccccc3o2)C1 1772810143 CLRCUGAZULUENT-CQSZACIVSA-N 382.420 2.672 0 50 GFAA COc1ccccc1-c1ccc(C(=O)N2C[C@@H]3CCOC[C@]3(C(=O)O)C2)cc1 1857669343 MVFDPMMAFMTYGO-HTAPYJJXSA-N 381.428 2.926 0 50 GFAA O=C(NCCCO)c1cc2c(s1)CCOC21CCN(C2CCCC2)CC1 1857685977 COHYHZHHBAANMD-UHFFFAOYSA-N 378.538 2.667 0 50 GFAA CCCN1CCC2(CC1)OCCc1sc(C(=O)NCCn3cccn3)cc12 1857693947 UEPNHTVOXZZVLT-UHFFFAOYSA-N 388.537 2.648 0 50 GFAA O=C(NCc1cscn1)[C@@]12CCCCN1C[C@@H](NC1Cc3ccccc3C1)C2 1857706375 HOAWHIXHQFEFQL-UGKGYDQZSA-N 396.560 2.513 0 50 GFAA CC1(NC(=O)[C@@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CCNCC1 1857727481 UBZKBVPRWSBHHV-CYBMUJFWSA-N 376.888 2.956 0 50 GFAA CCn1nc2c(c1C(=O)NCc1cccnc1-n1ccnc1C)C[C@H](C)O[C@@H]2C 1875314487 YYLSXRWQPTZYJV-UONOGXRCSA-N 394.479 2.744 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CCC[C@@]3(CCCN(C)C3=O)[C@H]2C)cn1 1940197815 TXSBCNTZUBCWJN-ZHRRBRCNSA-N 396.491 2.744 0 50 GFAA O=C(O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@H]2CCCn3cnnc32)CC1 2325778011 XEJOTMHESXCMBJ-ROUUACIJSA-N 382.464 2.653 0 50 GFAA O=C(NCCC1CCS(=O)(=O)CC1)NC[C@@H]1CCCc2ccccc2C1 2325784428 DITOFFHGOPVORW-QGZVFWFLSA-N 378.538 2.696 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N=[S@@](C)(=O)c2ccc(Br)cc2)C1 2325889348 LTMCCQOWKUGWTC-MYODQAERSA-N 399.310 2.857 0 50 GFAA COC(=O)C1=C(C)NC(=O)C[C@H]1c1cc(OC)c(OC)cc1Br 844433 PWHHWYFJZCZJKL-JTQLQIEISA-N 384.226 2.517 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)c1cccc(I)c1 1198041 QZHRYUCSVZOEAS-UHFFFAOYSA-N 381.169 2.950 0 50 GFAA COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC 1575139 ZGLXUQQMLLIKAN-SVIJTADQSA-N 398.411 2.918 0 50 GFAA biogenic,in-vitro COc1cc(C(=O)N2CCC[C@]23CCCN(CCc2ccccc2)C3=O)ccn1 2356148106 HMSLKRMQYVZYFE-QHCPKHFHSA-N 393.487 2.930 0 50 GFAA CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCCCC2)cc1Cl 6697831 VRHISPWTFSCLFQ-UHFFFAOYSA-N 388.917 2.762 0 50 GFAA Cc1cccn2c(=O)c(C(=O)N3CCN(c4ccc(Cl)cc4)CC3)cnc12 8601993 VIQVIKWNYCRJHG-UHFFFAOYSA-N 382.851 2.619 0 50 GFAA O=C(/C=C/c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1)NCc1ccco1 105242942 BYZGCFBUMIPGGX-ITGZGJQXSA-N 388.423 2.921 0 50 GFAA O=C1N[C@](CCCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cccnc1 67934687 PGQUVSUKFWOBHA-HSZRJFAPSA-N 392.503 2.895 0 50 GFAA CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccccc2Br)C[C@H]1O 252511531 HRNBQTRDEHEKDM-DGCLKSJQSA-N 376.316 2.867 0 50 GFAA COC(=O)C[C@H]1C(=O)NCCN1Cc1nc(-c2ccc3ccccc3c2)oc1C 39421108 RBLORVLMIYXLDI-IBGZPJMESA-N 393.443 2.667 0 50 GFAA CCn1c(-c2cnn(C(C)(C)C)c2)nc2cc(S(=O)(=O)N(C)C)ccc21 123848235 RKQRTPUQQXJIIN-UHFFFAOYSA-N 375.498 2.925 0 50 GFAA CC(C)S(=O)(=O)c1ccccc1NC(=O)N1CCC(N2CCCC2)CC1 151264223 IYLGPUGBQVLQFU-UHFFFAOYSA-N 379.526 2.961 0 50 GFAA COc1cccc(CC(=O)N2CCC[C@H](n3ncc(N(C)C(C)C)cc3=O)C2)c1 328605737 OYHBYFXMGFLIFM-SFHVURJKSA-N 398.507 2.503 0 50 GFAA CCn1c(C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)n[nH]c1=S 5679243 UVOXSHKDDMJPJQ-UHFFFAOYSA-N 382.511 2.537 0 50 GFAA Cc1ccc(-c2nc(C)c(C(=O)N3CCN4C(=O)N=C(O)[C@@H]4C3)s2)c(C)c1 329242053 ABLBSZNIZNOPOZ-AWEZNQCLSA-N 384.461 2.952 0 50 GFAA COCCCNC(=O)C1CCN(C2CCN(Cc3ccccc3C)CC2)CC1 71751163 MHFOHBUGMRLLKC-UHFFFAOYSA-N 387.568 2.824 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@H](c1ccc2c(c1)CCO2)C1CC(O)C1 219097913 MZRITAFOFZJVMR-CNXQINBVSA-N 381.428 2.521 0 50 GFAA O=C(O)[C@H]1CC12CCN(C(=O)C1CCN(C(=O)CCc3ccccc3)CC1)CC2 262374842 BNFDNBCGAAVQPP-LJQANCHMSA-N 398.503 2.571 0 50 GFAA O=C([C@@H]1COCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 72421318 BHTSIADYLHFGFK-NRFANRHFSA-N 381.472 2.577 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2ccc(N3CCCC3=O)cc2)C[C@H]1c1ccccc1 262773879 AONYHPVYNFLVFB-RBUKOAKNSA-N 378.428 2.754 0 50 GFAA O=C(Nc1ccnc(O[C@@H]2CCOC2)c1)c1cnn(-c2ccc(F)cc2F)c1 127496909 FVZBXEIHYYFUAM-OAHLLOKOSA-N 386.358 2.966 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1F)S(=O)(=O)Cc1cnn(C)c1C(F)(F)F 130357892 XQOVAIKOQIFCFB-VIFPVBQESA-N 393.362 2.520 0 50 GFAA Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1C[C@H](c2ccccc2)[C@](F)(CO)C1 452946879 VKBCDWAZHKSCAH-QVKFZJNVSA-N 387.455 2.728 0 50 GFAA Cc1ccc2nc(Cn3nc([C@@H]4CCCNC4)n(-c4ccccc4)c3=O)cn2c1 71765568 DQQSBADTOHSUOK-QGZVFWFLSA-N 388.475 2.505 0 50 GFAA O=C(c1nn(-c2ccc(Cl)cc2)cc1O)N1CCN(Cc2ccncc2)CC1 176989721 HMVBYYGQMDGTLZ-UHFFFAOYSA-N 397.866 2.584 0 50 GFAA C[C@@H]1c2nnc(C3CCCC3)n2CCN1C(=O)NCc1ncnn1C(C)(C)C 288255342 CGQXZJZNPOBZRU-CYBMUJFWSA-N 386.504 2.569 0 50 GFAA Cc1nn(C)c(=O)c(C(=O)N2CCc3cc(Br)cc(F)c32)c1C 177806129 WLRVAYRMEGHHCL-UHFFFAOYSA-N 380.217 2.502 0 50 GFAA O=C(c1cccc(N2CCOCC2)c1)N1CCC([C@H](O)c2ccccn2)CC1 222690957 CITBLBXSMGGLFH-NRFANRHFSA-N 381.476 2.504 0 50 GFAA CCn1cc([C@H]2C(C(=O)Nc3ccccc3OC)=C(C)Nc3ncnn32)c(C)n1 20607174 PULVLYJCOVZCJE-SFHVURJKSA-N 393.451 2.739 0 50 GFAA CCc1ccc(CN(C)S(=O)(=O)c2cccc(C(=O)N(C)CC)c2)nc1 95367990 AKGYPIZGMXHUSK-UHFFFAOYSA-N 375.494 2.557 0 50 GFAA CCc1ocnc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2CC=C(C)C 97446956 YDCIGRDJPYPUKE-UHFFFAOYSA-N 383.496 2.916 0 50 GFAA CN(C)S(=O)(=O)N[C@H]1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 91636456 IQPQNTKNIQWQNU-KRWDZBQOSA-N 376.526 2.943 0 50 GFAA O=C(O)[C@@H](c1ccc(NC(=O)N2CCOCC2)cc1)N1CCc2ccccc2C1 95382278 QMMUEXVNXCJHCV-HXUWFJFHSA-N 395.459 2.735 0 50 GFAA Cc1nc(CN2CCC[C@H](CCC(=O)NCc3ccc(F)c(F)c3)C2)n(C)n1 95522817 AEXXVKXHSSKVEH-OAHLLOKOSA-N 391.466 2.710 0 50 GFAA COc1ccc(N2CCN(Cc3cc(=O)c4cc(F)ccc4[nH]3)[C@H](C)C2=O)cc1 91846931 CPWLJGGGIMHGNN-CQSZACIVSA-N 395.434 2.913 0 50 GFAA C[C@@H](O)C(=O)N1CCC(Oc2ccc(C(=O)NC3CCCC3)cc2Cl)CC1 95502994 MSBSSYYKTOQTNB-CYBMUJFWSA-N 394.899 2.763 0 50 GFAA Cc1nc(CNC(=O)c2ccc3c(c2)[nH]c(=O)n3[C@H]2CC[C@H](O)CC2)cs1 244774141 POMDBPPSIAKFRI-SHTZXODSSA-N 386.477 2.501 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCOC[C@H]1c1ncn(Cc2ccccc2)n1 297201509 UVTYJBMVGQJVSF-KRWDZBQOSA-N 383.839 2.589 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N(C)C[C@@H]3CCCC[C@@H]3O)CC2)cc1 182659899 ARMSKQVLFYZTLC-ICSRJNTNSA-N 387.524 2.792 0 50 GFAA CN(CCC(=O)O)C(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 299753895 ZSCZOOIQWQMNAP-BBRMVZONSA-N 386.370 2.548 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)CCCc1cccs1 266334305 KWIAGFSWLAHERR-CQSZACIVSA-N 381.523 2.882 0 50 GFAA COc1ccc2[nH]cc(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 263585027 DIBXVFCFCQWWDD-LSDHHAIUSA-N 377.444 2.640 0 50 GFAA biogenic CCN(C[C@H]1CCCCO1)S(=O)(=O)c1cc(-c2ccno2)ccc1OC 823086816 KZGSVUPSVNEAOB-OAHLLOKOSA-N 380.466 2.930 0 50 GFAA CC1CCC(N(C)C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)CC1 1875350573 SDBMZKXBDWTNIU-UHFFFAOYSA-N 381.436 2.739 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccccc1Oc1cccnc1 1875402747 MKGVWOITRDPANQ-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA COCCCOCC(=O)N1CCC(c2nccc(-c3ccccc3OC)n2)CC1 952894222 XPZOPWWUPXKYEL-UHFFFAOYSA-N 399.491 2.911 0 50 GFAA COCCn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)NCCCc1c(C)noc1C 1875392989 CFSJKPMALLODCP-LDQXTDLNSA-N 386.496 2.551 0 50 GFAA O=C(Cn1ncc2ccccc2c1=O)Nc1ccc(OC[C@@H]2CCCCO2)cc1 952979298 VVJUIIRTHDPEFA-IBGZPJMESA-N 393.443 2.983 0 50 GFAA Cc1nc(-c2cccc(NC(=O)N[C@@H](C)c3nc(C(F)(F)F)n[nH]3)c2)n[nH]1 1465558866 USTCIYKCJKSYIQ-ZETCQYMHSA-N 380.334 2.800 0 50 GFAA C[C@@H]1CN(C(=O)NCCc2csc3ccccc23)CCN1CC(C)(C)O 187624141 VOMWOBCRQOBLIR-OAHLLOKOSA-N 375.538 2.930 0 50 GFAA CN(Cc1cccc(Cl)c1Cl)C(=O)c1cc(N2CCNC(=O)C2)ccn1 188545084 QVAMSBYVLVXCOK-UHFFFAOYSA-N 393.274 2.597 0 50 GFAA COc1ccccc1/C=C(/C(=O)NC[C@H](CO)[C@@H]1CCOC1)c1ccccc1 225488651 URBRQVCTHMKOTI-JJTSJLALSA-N 381.472 2.997 0 50 GFAA CC(C)(C)OC(=O)N1CCC[C@@H]1c1nc(C(=O)C2C(=O)CCCCC2=O)no1 225552299 UGSBYBFMIPYAAT-LLVKDONJSA-N 391.424 2.653 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@@H]4CC(=O)N(C5CC5)C4)CC3)oc12 189156760 ULPWFALQRCTHOY-OAHLLOKOSA-N 382.464 2.789 0 50 GFAA CC1(NC(=O)c2ccc(-n3ncc(C(=O)O)c3C(F)(F)F)cc2)CCOCC1 191616504 VWFVRPZZDLQCAM-UHFFFAOYSA-N 397.353 2.888 0 50 GFAA CC1(C)C[C@H](O)CCN(C(=O)c2c(N3CCOCC3)noc2-c2ccccc2)C1 1704312175 MNOVZMHMIVTSGV-QGZVFWFLSA-N 399.491 2.801 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1cc2ccccc2o1 5704920 RETHAVDDKIWMEX-UHFFFAOYSA-N 380.400 2.923 0 50 GFAA COc1ccccc1NC(=O)[C@H](C)Sc1nnnn1-c1ccccc1OC 11692800 IMEFESCJQUAMEV-LBPRGKRZSA-N 385.449 2.799 0 50 GFAA Cn1cc(CN2CCC(n3nccc3NC(=O)Cc3ccccc3)CC2)cn1 12074755 ABZMJTMYRYFSRT-UHFFFAOYSA-N 378.480 2.635 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2)CC1 12364823 NCDDRAFMFSXOFI-HDICACEKSA-N 382.460 2.592 0 50 GFAA CC(C)(C)c1ccc(S(=O)(=O)N2CCN(C(=O)c3ccncc3)CC2)cc1 12381747 YYJIAKKCYJGZAJ-UHFFFAOYSA-N 387.505 2.526 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)N(C)Cc3ccccn3)CCC2=O)cc1 12449503 KZPSWCSZZABLCS-SFHVURJKSA-N 381.476 2.530 0 50 GFAA CN(C)C1(CNC(=O)[C@H]2CCC(=O)N(CCc3ccccc3)C2)CCCCC1 12582966 NWHGLFWCKRVKFW-FQEVSTJZSA-N 385.552 2.848 0 50 GFAA Cc1ccc([C@@H]2[C@H](C(=O)OC(C)C)C(=O)C[C@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 13387772 JKLWHFRPHNOWMT-IWQHBPENSA-N 390.476 2.938 0 50 GFAA CCOC(=O)c1nn(CC)c2c1CN(C(=O)c1cc(-c3ccsc3)n[nH]1)CC2 14536088 VWZIQWSPGVDTNC-UHFFFAOYSA-N 399.476 2.730 0 50 GFAA CCc1ccc(CN2C[C@H](n3cnnn3)C[C@H]2C(=O)NC2CCCCCC2)cc1 14990672 WWGBSIXUASCQTJ-RTWAWAEBSA-N 396.539 2.890 0 50 GFAA COc1ccc(N([C@@H](C)C(=O)N[C@@H](C)c2ccccc2)S(C)(=O)=O)cc1 15769432 RZTDLPNHAIPQMA-GJZGRUSLSA-N 376.478 2.727 0 50 GFAA Cc1cc(CC(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)on1 1857710435 XHDZQUUVDCLQNI-SOLBZPMBSA-N 375.856 2.510 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CC[C@H](O)[C@@](CO)(Cc2ccc(F)cc2)C1 1857733193 ZBKUQQQWIMEYFP-ICSRJNTNSA-N 379.378 2.532 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCc4cccc(CO)c4)CC3=O)sc2c1 1857741039 ZILGPNFMLSUSSS-INIZCTEOSA-N 395.484 2.766 0 50 GFAA CC(C)N=c1[nH]c(C2CC2)nc2c1CC[C@@]21CCCN(Cc2nccn2C)C1 1875246204 APPXFANGSRWVHD-JOCHJYFZSA-N 380.540 2.810 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1C[C@H](c2ccc(C)cc2)[C@@H](N(C)C)C1 213239162 JISANVKUYRPVAK-CTNGQTDRSA-N 384.524 2.706 0 50 GFAA O=S(=O)(N[C@H]1CCCN(c2cccc(F)c2)C1)c1cccc2c1OCCO2 116368174 BVVSTYQZGTZGFP-HNNXBMFYSA-N 392.452 2.544 0 50 GFAA COc1cc(CC(=O)N(CCC(=O)O)Cc2cccc(F)c2F)ccc1O 2325762923 SNXQBQYQAJDLNZ-UHFFFAOYSA-N 379.359 2.725 0 50 GFAA O=C(Nc1ccc(Br)cn1)c1cc2ncc(Br)cn2n1 632762 VDQRHBVBAPADAK-UHFFFAOYSA-N 397.030 2.902 0 50 GFAA CN1C(=O)[C@H](CC(=O)Nc2ccc(F)cc2)N(CCc2ccccc2)C1=S 1185305 CCJHSYWXZLGPFH-KRWDZBQOSA-N 385.464 2.825 0 50 GFAA CC(=O)N1C(=O)N(c2ccccc2)[C@H]2[C@@H]1N(c1ccccc1)C(=O)N2C(C)=O 1216563 GBFHVGKAHIMKKO-ROUUACIJSA-N 378.388 2.616 0 50 GFAA COc1ccccc1[C@@H]1NC(=O)N[C@](O)(C(F)(F)F)[C@H]1C(=O)c1ccccc1 2502096 MTWSQTLPVMNEGM-RVKKMQEKSA-N 394.349 2.799 0 50 GFAA CC[C@@H]1CN(C(=O)c2cc3c(s2)CCOC32CCNCC2)CCN1C(C)C 2356159812 RDTLOXNBJRRIGT-MRXNPFEDSA-N 391.581 2.844 0 50 GFAA COc1ccc(-c2nc(C[S@](=O)CC(=O)NCc3cccnc3)c(C)o2)cc1 4924676 VRKCHOIJRFZQSF-MUUNZHRXSA-N 399.472 2.619 0 50 GFAA aggregator COc1ccc(Cl)cc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)cn1C 6818947 XCVFSOMCGZLMEC-UHFFFAOYSA-N 397.884 2.724 0 50 GFAA O=c1c(-c2ccccc2)nnc2sc(Cc3ccc4c(c3)OCCO4)nn12 8393779 NRCWJNMIKIUJNA-UHFFFAOYSA-N 378.413 2.575 0 50 GFAA CCn1c(SCC(=O)Nc2nccs2)nnc1-c1ccc2c(c1)OCO2 9426900 FFNYKQNLNGEAHP-UHFFFAOYSA-N 389.462 2.881 0 50 GFAA CC[C@@H](C)C(=O)N1CCc2c(c(C(=O)O)nn2CCc2ccc(OC)cc2)C1 67588293 ZFJQKBRXBNHIFS-CQSZACIVSA-N 385.464 2.763 0 50 GFAA C[C@H](c1nc(N)nc(Nc2ccccc2)n1)N1CCC[C@@H](c2ccnn2C)C1 229495291 XNLHAZHXYUFTLF-HUUCEWRRSA-N 378.484 2.872 0 50 GFAA C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCN(C2CCOCC2)C1=O 331502647 BGWVZCYKNLAFJO-CXAGYDPISA-N 398.425 2.780 0 50 GFAA Cc1nc(NCCNC(=O)Nc2ccc(C)c(F)c2)cc(-n2ccnc2C)n1 65361942 ZLGSZURUTAFUAE-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA CN1CC2(CCN(C(=O)CO[C@H](c3ccccc3)C(F)(F)F)CC2)CC1=O 72410732 CJIYUGVUJFKBBY-QGZVFWFLSA-N 384.398 2.778 0 50 GFAA Cn1cc(CNC(=O)N2[C@H]3C=C(c4ccnn4C)C[C@H]2CC3)c(C(F)(F)F)n1 283588554 KDNHBQJCVRKGSV-ZIAGYGMSSA-N 394.401 2.702 0 50 GFAA O=C([C@@H]1CCCN1C(=O)Cc1ccccc1)N1CCC(C2CCOCC2)CC1 124447929 VGMQXVARUJPQIZ-NRFANRHFSA-N 384.520 2.885 0 50 GFAA CCOc1cc(C)c(CN2CCCN([C@H]3COC[C@@H]3O)CC2)cc1C(C)C 215542824 IKZFLTVEFHTLKJ-SFTDATJTSA-N 376.541 2.785 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCn3ccnc3)csc2C1 426479684 HTXLXFLDWMMKBG-UHFFFAOYSA-N 385.493 2.538 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)CCCc1ccc(F)cc1 517040510 RMDFYHLVRREMFK-KRWDZBQOSA-N 393.484 2.960 0 50 GFAA Cn1c2c(cc(C(=O)NCc3cc4ccc(F)cc4nc3O)c1=O)CCCC2 426424246 KERUKAPHHMCZAA-UHFFFAOYSA-N 381.407 2.587 0 50 GFAA O=C(NCCSc1ncn[nH]1)Nc1ccc(OC[C@H]2CCCCO2)cc1 96180004 POSITAYCYSGZFZ-OAHLLOKOSA-N 377.470 2.666 0 50 GFAA COc1ccccc1N1CCN(Cc2cnn(-c3cccc(F)c3)c2)CC1=O 426674414 XQDKDHBOVKJMMD-UHFFFAOYSA-N 380.423 2.869 0 50 GFAA COc1ccccc1[C@H]([C@@H](O)C(=O)c1c[nH]c2ccccc12)N1CCN(C)CC1 96822488 TVHUIRWEOFXBRT-FYYLOGMGSA-N 393.487 2.709 0 50 GFAA COc1ccc(C(=O)N2CCC(c3nccn3CCCN(C)C)CC2)c(O)c1 95531584 FUAMTZJWKPQRQS-UHFFFAOYSA-N 386.496 2.569 0 50 GFAA COCCOc1cccc(NC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1 96140663 LZJRFLMMNNJVOA-GOSISDBHSA-N 383.448 2.634 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccccc2-c2ncc[nH]2)[C@H]2C[C@@H](O)C2)cn1 244595050 DNSPJQZMWOCSFP-KHYOSLBOSA-N 378.432 2.722 0 50 GFAA C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@H](CC(=O)O)c2cccs2)C1=O 299744022 NIRFWNHIUQTLBB-QWHCGFSZSA-N 388.445 2.584 0 50 GFAA NC(=O)N[C@@H](CC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc(Oc2ccccc2)c1 299743363 NIHPNQRIIALQKP-QAPCUYQASA-N 397.431 2.512 0 50 GFAA CC(=O)N[C@H]1CCCN(C(=O)CN2CCc3c(-c4ccccc4)cccc32)C1 184518560 VLXHHQLUIWMPHW-IBGZPJMESA-N 377.488 2.843 0 50 GFAA CSCC[C@H](CO)NC(=O)Cc1csc2nc(-c3ccccc3)cn12 252497786 QPROHUFDGCBAIS-CQSZACIVSA-N 375.519 2.836 0 50 GFAA COC(=O)c1cc(-c2cccc(C(=O)NCCc3nnc(C)s3)c2)cn1C 534660524 PTBZSKPTNQWAPA-UHFFFAOYSA-N 384.461 2.611 0 50 GFAA Cc1cc(S(=O)(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)cc1F 584571614 GJAXCNJQIKUWON-QWHCGFSZSA-N 396.871 2.757 0 50 GFAA COc1cc(C(=O)O)ccc1-c1ccc(C(=O)N[C@@H]2CN3CCC2CC3)cc1 670458653 IFSHVBQXDNUGTP-LJQANCHMSA-N 380.444 2.884 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2C[C@H](O)[C@H]2C1 1875269560 YWTXDGWBZURJKA-WBAXXEDZSA-N 378.407 2.526 0 50 GFAA O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC2(CC(CO)C2)C1)c1cccs1 1875299506 NDNGZSRFIQJTHN-KZMDNLFVSA-N 398.528 2.757 0 50 GFAA Cc1cccc(-c2ccc(C(=O)N[C@@H](C(N)=O)c3ccc(F)cc3)c(O)n2)c1 1875260833 GOEUGBOWNYXADK-GOSISDBHSA-N 379.391 2.858 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCC=C(c2cccc(O)c2)C1 1875312414 BHAFXWDWURYDPI-QFIPXVFZSA-N 376.456 2.981 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)c2nc3ccccc3s2)CC[C@H]1C(F)(F)F 1875385857 DDLLJEFXLLORAX-PWSUYJOCSA-N 383.395 2.992 0 50 GFAA Cc1ccccc1OC[C@@H]1CCCN(S(=O)(=O)c2cc(C(N)=O)cs2)C1 952990328 XHYMDOICKPTLIG-CQSZACIVSA-N 394.518 2.635 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1)Nc1ccc2scnc2c1 952965597 AMZFLAZYFRDYFA-KRWDZBQOSA-N 398.463 2.765 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(-n3cncn3)c(C)c2)c2cnccc2NC1=O 1775961883 GUQUVAZRGPWWNC-AWEZNQCLSA-N 376.420 2.596 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@@H](C)Nc2cc(C(F)(F)F)nc3ncnn23)cc1 185841991 ATMASOHSDIFVMW-LLVKDONJSA-N 399.398 2.726 0 50 GFAA CCOc1cccc(C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)[C@H]2c2cnn(C)c2)c1 276881042 BROFNQIEQGXTHM-OXJNMPFZSA-N 398.507 2.937 0 50 GFAA Cn1ccc([C@@H]2NC(=O)N(Cc3nc(-c4ccc(Cl)cc4)cs3)C2=O)n1 170613937 JAQRDJORKHVDRN-HNNXBMFYSA-N 387.852 2.990 0 50 GFAA Cc1sccc1CC(=O)N1CCC(NS(=O)(=O)c2ccccc2)CC1 170604822 ORWTXFMHIMRNFH-UHFFFAOYSA-N 378.519 2.569 0 50 GFAA Cc1nc(-c2cccc(C(=O)NS(=O)(=O)C[C@@H]3CCCCO3)c2)cs1 170645654 IFEOARJZOFOWDE-HNNXBMFYSA-N 380.491 2.747 0 50 GFAA O=C(NCc1ccco1)NCc1nc(-c2c(Cl)nc3sccn23)no1 225552747 VCTVZDXQKKBWOT-UHFFFAOYSA-N 378.801 2.692 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)OCC(=O)N1C 1529118881 PMLQQSJLTCWXOF-GSLHCMNLSA-N 382.504 2.930 0 50 GFAA COc1c(Cl)cc(Cl)cc1C(=O)N1CC[C@@]2(CO)CCCN(C)[C@@H]2C1 1704337850 FRKDYPSTERLVJR-CRAIPNDOSA-N 387.307 2.921 0 50 GFAA CN(CCc1cnn(C)c1)C(=O)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 1772813018 SVSJNCVEQGMFIZ-MRXNPFEDSA-N 381.505 2.745 0 50 GFAA COc1ccc(-c2cc(=O)[nH]c(SCc3nc4ccccc4c(=O)[nH]3)n2)cc1 5151870 OOQSPOQJSVITMM-UHFFFAOYSA-N 392.440 2.974 0 50 GFAA O=C([C@@H]1CCCN(c2nc(-c3ccccc3)nc3c2CCC3)C1)N1CCOCC1 11818349 HKMASADMCQLLJN-GOSISDBHSA-N 392.503 2.708 0 50 GFAA Cc1c(C(=O)N2CCOCC2)sc2ncnc(N(C)CCc3ccccn3)c12 11996059 JKWJOQNPSOCXMY-UHFFFAOYSA-N 397.504 2.546 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCC(=O)N(Cc3ccc(F)c(F)c3)CC2)CC1 15066970 XHYUKVSHDIWWHB-INIZCTEOSA-N 395.450 2.620 0 50 GFAA O=C1CCN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CCN1 15075250 PCWJMPAHEKFTBZ-UHFFFAOYSA-N 377.448 2.633 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)Nc1nnc(C(F)(F)F)s1 16647628 VMXYYKJGLYSRFY-UHFFFAOYSA-N 379.385 2.993 0 50 GFAA O=C1C[C@@H](N2CCN(c3ccccc3F)CC2)C(=O)N1c1cccc(Cl)c1 19757455 VJMOJFBSKWCRJW-GOSISDBHSA-N 387.842 2.933 0 50 GFAA c1ccc(CN2CCC[C@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)nc1 19810698 GYVXTWJGESOZDA-NRFANRHFSA-N 394.519 2.593 0 50 GFAA Cc1ccc2occ(CN3CCc4nnc([C@H]5CCCO5)n4CC3)c(=O)c2c1 19839202 DKRSJSUEFWRJDD-GOSISDBHSA-N 380.448 2.603 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4cc(F)ccc4F)nnc23)n1 169775999 DTXQTNAFBPZUON-UHFFFAOYSA-N 384.346 2.550 0 50 GFAA O=C(NCCN1CCCOCC1)N1CC[C@@H](c2ccccc2C(F)(F)F)C1 1857527443 KGCOQXZUYULZRR-OAHLLOKOSA-N 385.430 2.927 0 50 GFAA CC[C@@]1(C(=O)N2CCSCC2)C[C@@H]2CC[C@H]1N2C(=O)c1ccn(C)c1C 1857678038 REVCJDVCZVAZAN-XAUMDUMWSA-N 375.538 2.682 0 50 GFAA COc1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(c3nccs3)C2)c2cccnc12 1857714003 HIZIUGLTCWEVGN-CQSZACIVSA-N 396.472 2.711 0 50 GFAA Cc1ccccc1CC(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857728735 AXLVXVVOVISHNU-VIZSFHNOSA-N 376.456 2.839 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)C(=O)c1cc(N2CCOCC2)ccn1 131428627 BHGLYCDWHTYQFD-UHFFFAOYSA-N 386.399 2.666 0 50 GFAA COCCN1C[C@@H]2CC[C@H]1CN(C(=O)CSc1nc3cc(C)ccc3[nH]1)C2 248343128 ZSLRTNIWIXMSFO-HOTGVXAUSA-N 388.537 2.533 0 50 GFAA C[C@@H](O)CNC(=O)c1cccc(OCc2ccn(-c3ccc(F)cc3F)n2)c1 252497532 QKABGTGJNXTUMS-CYBMUJFWSA-N 387.386 2.840 0 50 GFAA c1cc(CN[C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)c2[nH]ccc2c1 264842412 HDBFYTFXZHABME-IBGZPJMESA-N 392.507 2.553 0 50 GFAA C[C@@H]1Cc2ccc(F)cc2CN1C(=O)NCc1cccc(-n2cc(CN)nn2)c1 2325761981 WOHUHGJDIDBOJH-CQSZACIVSA-N 394.454 2.522 0 50 GFAA CCS(=O)(=O)Nc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)cc1 2325774222 RPUBEJQCVFJESZ-OALUTQOASA-N 385.489 2.552 0 50 GFAA O=C(O)[C@H](CCc1ccc(C(F)(F)F)cc1)NCC1CCS(=O)(=O)CC1 2325789773 LXFBSPLKODEGSD-HNNXBMFYSA-N 393.427 2.506 0 50 GFAA CN1CCN(C(=O)CN=c2cc[nH]c3ccc(Oc4ccccc4)cc23)CC1 2325857600 IDLRFLFWMUIBLQ-UHFFFAOYSA-N 376.460 2.635 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)N3CCC(c4ccccc4)CC3)ccc2N1 880984353 HCONWLCVSBPQMR-UHFFFAOYSA-N 399.472 2.824 0 50 GFAA Cc1ccc2nc(-c3ccc4c(c3)OCO4)cc(C(=O)NN3CCOCC3)c2c1 5048345 UXQCIUZOQBEAPO-UHFFFAOYSA-N 391.427 2.916 0 50 GFAA CC(=O)Nc1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 5556494 TYIADPJKSZYBHH-UHFFFAOYSA-N 387.461 2.682 0 50 GFAA CC1CCN(C(=S)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)CC1 5940168 HNEYNYRMSMGLRA-UHFFFAOYSA-N 391.522 2.706 0 50 GFAA O=C(Nc1ccccn1)c1cccc(S(=O)(=O)NCCOc2ccccc2)c1 6209791 HJGLMWRNIXGJEM-UHFFFAOYSA-N 397.456 2.691 0 50 GFAA COc1ccc(CCNC(=O)[C@@H]2CC(c3ccccc3OC)=NO2)cc1OC 6738372 KBPOMSHLBANNFA-FQEVSTJZSA-N 384.432 2.564 0 50 GFAA biogenic Cc1ccc(NC(=S)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 7560990 MYQXTXHUJYSKTG-UHFFFAOYSA-N 393.509 2.837 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNC(=O)c2ccc3ccccc3c2)CC1 11934071 HDJIAONADLHNBL-UHFFFAOYSA-N 388.471 2.833 0 50 GFAA C[C@@H](CNC(=O)c1ccncc1)Oc1cccc(CN(C)Cc2cnccn2)c1 12329920 VLPSAQQYZHFTKD-KRWDZBQOSA-N 391.475 2.701 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)c3cnc(C)cn3)CC2)cc1 12473012 ATPNFEOPCYKSOX-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA COCCCNC(=O)[C@@H]1C[C@H](COc2ccc(C)nc2)CN(CC(C)C)C1 14536219 JKWNPODTVPWZPH-RBUKOAKNSA-N 377.529 2.516 0 50 GFAA CCOC(=O)c1cnn(-c2nc(-c3ccccc3)cs2)c1CN[C@H](C)CO 15068371 MRYMFZILWUJVIL-CYBMUJFWSA-N 386.477 2.643 0 50 GFAA COc1ccc(-n2ccnc2CN2CCN(CCC(C)C)[C@@H](CCO)C2)cc1 19730708 KPEDHAPTJMPOKC-FQEVSTJZSA-N 386.540 2.796 0 50 GFAA COCCOC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)[C@@H]1c1cccc(N)c1 19881385 GUJDTMSUOZMUQI-LJQANCHMSA-N 388.464 2.645 0 50 GFAA COCCN1CCN(C(=O)c2csc3nc(-c4ccc(F)cc4)cn23)CC1 20256074 KQYPWIQVQSHUCJ-UHFFFAOYSA-N 388.468 2.606 0 50 GFAA CN1CCC[C@@H](NC(=O)c2cc(-c3cnc(N(C)C)nc3)nc3ccccc23)C1 23619023 JDKBBELKZDJCTD-MRXNPFEDSA-N 390.491 2.582 0 50 GFAA Cc1c(O)nc(-c2ccccc2CN2CCC(C(N)=O)CC2)nc1C(F)(F)F 48360814 MKKJKQAODVPWSK-UHFFFAOYSA-N 394.397 2.874 0 50 GFAA COc1cccc(-n2cc(-c3ccnc(N(C)CCn4cccn4)n3)cn2)c1 55244348 IHJYQRVKHLIJBS-UHFFFAOYSA-N 375.436 2.671 0 50 GFAA COc1ccccc1[C@H](C)N(C)C(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 55358390 KIRZHWNZOVDCQV-AWEZNQCLSA-N 376.478 2.793 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cccc(F)c3C)CC2)C1 67739395 MCYNVDXPQWFYJZ-IBGZPJMESA-N 391.531 2.573 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC(c3[nH]ncc3Cc3ccccc3)CC2)[nH]n1 67884036 BHZUXTAJLIYMIR-UHFFFAOYSA-N 377.448 2.946 0 50 GFAA O=C(NCCc1ccccc1)[C@H]1CCCN(C2CCN(CC(F)F)CC2)C1 71753969 DGEAYEMAPSIMFA-SFHVURJKSA-N 379.495 2.787 0 50 GFAA CC(C)n1cc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 72150427 FDUHBDRCOZJIIF-PWRODBHTSA-N 380.492 2.872 0 50 GFAA O=C(O)[C@H](c1cccc(CO)c1)N1CCC(O)(c2ccc(Cl)cc2)CC1 95366136 QFQXJMLKIUNCHD-SFHVURJKSA-N 375.852 2.942 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)c1ccc(N3CCN(C)CC3)cc1)CC2 95366147 KRSSFGMDHOYVAN-UHFFFAOYSA-N 379.504 2.688 0 50 GFAA CCc1cc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)on1 95371596 WJDVSNBRVWVQQN-ZLGUVYLKSA-N 395.459 2.668 0 50 GFAA COc1ccc(F)cc1CN1C[C@@H]2CC[C@H](C1)N(Cc1cscn1)C2=O 95501876 NEBRDXQVHNPDDS-SUMWQHHRSA-N 375.469 2.914 0 50 GFAA COc1ccccc1CN1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95502018 LXHCBXIBZATYPT-UHFFFAOYSA-N 380.492 2.704 0 50 GFAA CCn1c(=O)n(CC)c2cc(NC(=O)N[C@@H](C)CCn3cccn3)c(C)cc21 96138056 KTXOBGPLEXFWIQ-HNNXBMFYSA-N 384.484 2.948 0 50 GFAA CC(=O)NC[C@@H]1CCC2(CCN(C(=O)Nc3cccc4cccnc34)CC2)O1 97819593 IOTSYWQAFOGLFH-KRWDZBQOSA-N 382.464 2.916 0 50 GFAA CC(=O)c1cccc(CN2CCN(C3CCN(C(C)C)CC3)[C@H](CCO)C2)c1 104446179 UIGARGGLIGTSFC-HSZRJFAPSA-N 387.568 2.631 0 50 GFAA O=C(N[C@H]1CCc2[nH]ncc2C1)c1cccc(-n2ccc(C(F)(F)F)n2)c1 123179611 IBMZEOASBDNFQK-ZDUSSCGKSA-N 375.354 2.902 0 50 GFAA CCn1nc(C)c(-c2cc(C(=O)NC[C@H]3CCCN4CCCC[C@@H]34)n[nH]2)c1C 169680678 OMWBHPIRMTYQED-APWZRJJASA-N 384.528 2.904 0 50 GFAA CN(C)CCn1ccc(NC(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)n1 173930038 CPMQOVNQCGNNEG-HNNXBMFYSA-N 382.468 2.997 0 50 GFAA CCc1nc2ccccc2n1C1CCN(CCN2C(=O)NC(C)(C)C2=O)CC1 180968177 AWWAHUHKLQCNDY-UHFFFAOYSA-N 383.496 2.566 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2CCN([C@@H](C)c3ccccn3)CC2)nn1 183828587 LRZQHGFCAOTLTF-INIZCTEOSA-N 394.454 2.629 0 50 GFAA CCC[C@]1(C)C(=O)NCCN1C(=O)c1nc(C(C)C)n(-c2cccc(F)c2)n1 189807839 RYRKDNPBUOTGQQ-HXUWFJFHSA-N 387.459 2.661 0 50 GFAA C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 192566484 HBVPHAXSOXGVAQ-YWZLYKJASA-N 398.434 2.729 0 50 GFAA CC(C)(C)C(=O)/C=c1\[nH]c(=O)/c(=C\c2c[nH]nc2-c2cccc(Cl)c2)s1 221853730 QAWOJVCTCHKBPL-JTHWEQIXSA-N 387.892 2.704 0 50 GFAA CCn1nccc1CN(CCO)c1cc(C(F)(F)F)nc(-c2ccncc2)n1 225461727 BXBNUZXRMMYOHM-UHFFFAOYSA-N 392.385 2.773 0 50 GFAA COC(=O)c1cc(S(=O)(=O)Nc2cc(F)ccc2C)c(C(=O)OC)s1 225534018 CBGHHGMXCCOTNO-UHFFFAOYSA-N 387.410 2.570 0 50 GFAA Cn1cc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)c(-c2ccoc2)n1 225720294 MVLMVWZEUDHVQA-UHFFFAOYSA-N 380.448 2.807 0 50 GFAA CC(C)C(=O)Nc1ccc2[nH]cc([C@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c2c1 227173763 OQFYKPKKUCEUSB-SJKOYZFVSA-N 387.436 2.685 0 50 GFAA Cc1ccc([C@@H]2COCCN2C(=O)c2ccc(-n3ncc(C(=O)O)c3C)cc2)o1 237983290 ITDMGGPVVBCXBZ-SFHVURJKSA-N 395.415 2.994 0 50 GFAA C[C@H](C(=O)NC(=O)NC(C)(C)C)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 241969536 UXENSPPBZGRRTI-ZBFHGGJFSA-N 389.496 2.998 0 50 GFAA CC(=O)N[C@H](CC(=O)NCCC(C)(C)C(=O)O)c1ccc(Br)cc1 262881499 CFVKPGJWPPCGBP-CQSZACIVSA-N 399.285 2.634 0 50 GFAA CC(=O)NC[C@H]1CCn2ncc(C(=O)Nc3cc(F)ccc3NC(C)C)c2C1 277097966 DVIBJBDAOPMEFI-AWEZNQCLSA-N 387.459 2.793 0 50 GFAA Cc1ccc([C@@H]2CCN(C(=O)NCc3ccc(S(N)(=O)=O)s3)C2)c(C)c1 280041669 SEXQGUJFTQTTHQ-CQSZACIVSA-N 393.534 2.711 0 50 GFAA Cc1nccn1-c1ncccc1CNC(=O)C1(c2ccc(N(C)C)cc2)CC1 294546333 KPMLSBXCAMIVGK-UHFFFAOYSA-N 375.476 2.990 0 50 GFAA CC(=O)N(c1ccc(NC(=O)N2CCN(c3ccccn3)CC2)cc1)C1CC1 297254568 XXIAJABYHUXBJU-UHFFFAOYSA-N 379.464 2.951 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1CCc3nc(C)nc(O)c3CC1)c(C)n2C 426389907 SOPUJRQBUXKFIF-UHFFFAOYSA-N 380.448 2.540 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)N(CCO)Cc2ccccc2)n1 426420054 JAWSODDMUOVJFA-UHFFFAOYSA-N 382.386 2.550 0 50 GFAA Cc1ccccc1CN(C[C@H]1CCCO1)C(=O)NCCN1CCCOC1=O 426545524 ZTYSWSBNFKYMPF-GOSISDBHSA-N 375.469 2.528 0 50 GFAA CCCc1ccc(S(=O)(=O)N2CCN(c3ccccc3OC)C(=O)C2)cc1 426598874 MKSRDBIPATYRKI-UHFFFAOYSA-N 388.489 2.685 0 50 GFAA O=C(Cn1nc(Cc2ccccc2)c2ccccc2c1=O)NC[C@H]1CCCCO1 426661187 GLNFYHDWWQVORM-GOSISDBHSA-N 391.471 2.673 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2oc3ccccc3c2COc2ccccc2)CCO1 485830961 UJEJUWAQPHALTR-GOSISDBHSA-N 381.384 2.937 0 50 GFAA O=C1C[C@]2(CCCN(Cc3csc(C4CC4)n3)C2)N(C(=O)c2ccccc2)N1 888103724 WBWQJYJJRYNHHQ-NRFANRHFSA-N 396.516 2.932 0 50 GFAA Cc1nc(-c2cc(Cl)ccc2Cl)sc1C(=O)N1C[C@@H](O)C[C@H]1CO 935460836 DYTQOUDBMMMFNC-QWRGUYRKSA-N 387.288 2.993 0 50 GFAA Cn1cc(C(=O)N2Cc3cnn(-c4ccc(F)cc4)c3CC(C)(C)C2)nc1O 952894615 SHXZIEBPJATDDA-UHFFFAOYSA-N 383.427 2.675 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2ccc(Cl)s2)cc1OC 1529159003 MERNXHXYMLPTMW-RHSMWYFYSA-N 397.880 2.993 0 50 GFAA Cn1cc(CCNC(=O)N2CC[C@H](c3ccc4ccccc4c3)[C@@H](O)C2)cn1 1565516604 MTYCPKAODHKTHX-RTWAWAEBSA-N 378.476 2.676 0 50 GFAA CC(C)(Oc1ccccc1)C(=O)N[C@H]1CCOC[C@@H]1OCc1cscn1 1565526954 CXCUJFDUOBZAQL-IRXDYDNUSA-N 376.478 2.791 0 50 GFAA CCc1ncc(C(=O)N2CCCN([C@H]3CCN(c4ccc(F)cc4)C3)CC2)cn1 1775979034 SEOXUXLFAAQKPM-FQEVSTJZSA-N 397.498 2.605 0 50 GFAA O=C(NC1(c2cccc(F)c2)CCOCC1)c1ccc2c(c1)CCS2(=O)=O 1875274034 BEOHTSDJYBZARD-UHFFFAOYSA-N 389.448 2.591 0 50 GFAA Cn1cc(C[N@]2C[C@@H]2COc2cccc(C(=O)NCc3ccccc3)c2)cn1 1875385190 OBKSQORBDSQECO-FQRUVTKNSA-N 376.460 2.613 0 50 GFAA COCCn1ccnc1CN1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1 2100555483 TZONOUFLZXVFJI-UHFFFAOYSA-N 399.539 2.803 0 50 GFAA CCCC(CCC)C(=O)N[C@H]1CCCCN(C(=O)[C@@H]2CCC(=O)N(CC)C2)C1 2325863954 BAGNVQWQNGBJHD-MOPGFXCFSA-N 393.572 2.959 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@]21CCCN(Cc2cnn(-c3ccccc3F)c2)C1 2356144081 IRJOPGJHYGLUTL-NRFANRHFSA-N 378.455 2.694 0 50 GFAA Cc1ccc2nc(CN3CCC[C@@]34CCCN([C@H]3CC[C@H](O)CC3)C4=O)cn2c1 2356164368 QKRWJHIZEZNCHN-JTAQYXEDSA-N 396.535 2.903 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3F)CC2)cc1 783911 PBRNINVNCQVRCK-UHFFFAOYSA-N 392.452 2.874 0 50 GFAA CC(C)C[C@@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)N1CCOCC1 4991213 RGELUNHVLZEOQR-RQJZOYDLSA-N 376.541 2.983 0 50 GFAA Cc1cccc(N2CCN(C(=O)CCn3cnc4ccccc4c3=O)CC2)c1C 5245981 WDUGUEKVDCHFPO-UHFFFAOYSA-N 390.487 2.752 0 50 GFAA O=C(Nc1ccc(Cl)cc1)N1CCN(S(=O)(=O)c2ccccc2)CC1 6730894 HHVBPPDPSLBCAX-UHFFFAOYSA-N 379.869 2.878 0 50 GFAA O=C(Cc1ccncc1)N1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 12304555 SLFIUUJSOCHYAB-JOCHJYFZSA-N 381.451 2.805 0 50 GFAA Cc1cc(C)n(-c2ccc(N3CCN(C(=O)c4c(F)cccc4F)CC3)nn2)n1 13009095 GNCORMLMPMLSTH-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA COCCC(=O)N1CCC(Oc2ccc(C(=O)NCCCSC)cc2)CC1 15061587 JJFMBAAWNDCCEH-UHFFFAOYSA-N 394.537 2.576 0 50 GFAA COc1ccc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)cc1O 19641025 RPAHUKRJHLNHSQ-NRFANRHFSA-N 384.520 2.902 0 50 GFAA Cn1ccnc1CN1CCN(Cc2c[nH]nc2-c2cc3ccccc3o2)CC1 19811131 KMPSOZHUMSICNH-UHFFFAOYSA-N 376.464 2.874 0 50 GFAA COc1cc(CN2CCN(Cc3ccsc3)[C@@H](CCO)C2)cc(OC)c1 20599099 ZDYQMPNHRQLTIF-SFHVURJKSA-N 376.522 2.834 0 50 GFAA CCOC(=O)/C(=C/[C@@H]1OC(C)(C)O[C@H]1COCc1ccccc1)CC(=O)O 39140606 FZYHGYQWFISLQT-DAPLNWGVSA-N 378.421 2.688 0 50 GFAA Cc1ccc(NC(=O)CC(=O)N[C@@H](C)c2cn3ncsc3n2)cc1Cl 55244686 QFOJZDOCRKRREY-JTQLQIEISA-N 377.857 2.959 0 50 GFAA CCN(C(C)=O)[C@H]1CCN(Cc2ccc(C(=O)Nc3c(C)noc3C)cc2)C1 65395084 HUBSPXXCAUBWDH-IBGZPJMESA-N 384.480 2.986 0 50 GFAA O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1ccc2c(c1)OCCO2 71279374 NKLUHLRUNSMSIQ-UHFFFAOYSA-N 397.818 2.974 0 50 GFAA O=C(O)c1cc(-c2ccccc2F)cc(S(=O)(=O)N2CCSCC2)c1 71759585 FHYRPAYGSOMVCL-UHFFFAOYSA-N 381.450 2.928 0 50 GFAA COCC1(C(=O)N2C[C@@H](c3cccc(OC)c3)[C@@H]3[C@H]2C2CCN3CC2)CCC1 72143922 XDICEBCQCUOBOQ-PWRODBHTSA-N 384.520 2.901 0 50 GFAA Cc1ncsc1C(=O)N1CCC2(CCC(=O)N(CCc3cccnc3)C2)CC1 91782429 RXEIAXOQLZQNNX-UHFFFAOYSA-N 398.532 2.934 0 50 GFAA O=C(O)[C@@H]1CCCN1C(=O)c1cnc(Cc2c(Cl)cccc2Cl)nc1O 91951414 QSACEULUEHGISX-ZDUSSCGKSA-N 396.230 2.769 0 50 GFAA O=C(c1ccc(-c2ccccc2)[nH]c1=O)N1C[C@@H]2CC[C@H](C1)N(CC1CC1)C2 95511359 LHBDUWPGGCLRKR-IEBWSBKVSA-N 377.488 2.988 0 50 GFAA Cn1nc(-c2ccccc2)cc1NC(=O)N1CCC(Oc2ncccn2)CC1 96138618 KHAIXTGJIBQGGU-UHFFFAOYSA-N 378.436 2.952 0 50 GFAA CCN(C[C@H](O)c1cccc(O)c1)C(=O)Nc1ccccc1CC(=O)N(C)C 97514430 XVVPDDAHUUJULQ-IBGZPJMESA-N 385.464 2.610 0 50 GFAA O=C(NCCc1cnn(-c2ccccc2)c1)c1cc(=O)[nH]c2cc(F)ccc12 132619053 KLVKEBXKKLPXAQ-UHFFFAOYSA-N 376.391 2.825 0 50 GFAA Cc1cc2nc3n(c(=O)c2n1CC(=O)NCCCc1ccccc1)CCCCC3 169778352 AOASWWGSVWYQDH-UHFFFAOYSA-N 392.503 2.982 0 50 GFAA Cn1c(=O)n(CCC(=O)NCCN2CC=C(C(C)(C)C)CC2)c2ccccc21 170599183 YOWOOKUMXAPHOD-UHFFFAOYSA-N 384.524 2.525 0 50 GFAA COC(=O)c1c(C)n(C)c2ccc(OC(=O)Cn3c(C)c(C)sc3=O)cc12 170654474 ASZGSCZRYWVVPS-UHFFFAOYSA-N 388.445 2.719 0 50 GFAA O=C(NCc1nc2cc(F)ccc2[nH]1)[C@H]1CCCN(C(=O)c2ccccc2)C1 176709763 CBIYXLPRHXEEMR-HNNXBMFYSA-N 380.423 2.871 0 50 GFAA COCc1cccc(S(=O)(=O)Nc2ccccc2-c2nnnn2C(C)C)c1 181798153 NXKDQXCVWIIXNJ-UHFFFAOYSA-N 387.465 2.868 0 50 GFAA O=C(N[C@@]1(CO)CCOC1)c1csc(-c2ccc(Br)s2)n1 182837549 UUONUSZZZCBMMK-CYBMUJFWSA-N 389.296 2.515 0 50 GFAA C[C@H]1CN(CCC(=O)Nc2cccc(Br)c2)CCN1CC(C)(C)O 189946780 AOGHSSKNUNRAIJ-AWEZNQCLSA-N 398.345 2.555 0 50 GFAA COc1ccccc1-n1ncc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c1C 194795390 XMJZSWIVSZQVEB-SFHVURJKSA-N 398.507 2.516 0 50 GFAA C[C@H](N)[C@H]1CCCCN1C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 237556234 GHIYTVJEELLYOQ-ZUZCIYMTSA-N 378.270 2.633 0 50 GFAA Cc1cccc(N2CCN(CCC(=O)N[C@@H](C)Cc3cccc(C)n3)CC2)c1 244678758 IJMPPPCENLAKMP-FQEVSTJZSA-N 380.536 2.958 0 50 GFAA CC(C)N1CCC[C@@H](CNC(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)C1 291112944 XDPXYCQWIJHKGI-SIKLNZKXSA-N 391.531 2.883 0 50 GFAA O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1nc(N2CCCC2)ncc1Cl 299753944 ZYCIBRWLEDWYJE-UBHSHLNASA-N 378.860 2.588 0 50 GFAA Cc1sc2c(C)cccc2c1S(=O)(=O)N1CCC(c2nc(O)n[nH]2)CC1 333839023 KUZGIHLJHUMZLY-UHFFFAOYSA-N 392.506 2.910 0 50 GFAA O=C(Nc1ccccc1-c1nc[nH]n1)C1CCN(C(=O)c2ccccc2)CC1 378426420 VYNDZTPKAFJOMG-UHFFFAOYSA-N 375.432 2.963 0 50 GFAA CCCc1cc(C(=O)N2CC[C@]3(OC)CC[C@H](Oc4ccccn4)C[C@H]23)n(C)n1 426465395 AVZOTPMMIBAKMU-LQBOVUBWSA-N 398.507 2.999 0 50 GFAA C[C@H](Cc1cnccn1)NC(=O)N1CCC(c2nc3ccccc3n2C)CC1 426484840 QSXAZCSCGISKKI-OAHLLOKOSA-N 378.480 2.884 0 50 GFAA Cc1ccc(C2(O)CCN(C(=O)NCc3ccc4nsnc4c3)CC2)nc1 426580740 JTPIJFAGKZDRTB-UHFFFAOYSA-N 383.477 2.588 0 50 GFAA CC(=O)NCc1cc(O[C@H]2CCN(c3ncnc4c(C)cccc34)C2)ccn1 886062825 PKJQQSIKQRJCOG-SFHVURJKSA-N 377.448 2.627 0 50 GFAA CN(C[C@@H](O)CN1Cc2cnn(-c3ccc(F)cc3)c2CC(C)(C)C1)C1CC1 952893169 SMERLXGSLXCJOO-HXUWFJFHSA-N 386.515 2.851 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCC[C@@]2(CN(C)C(=O)O2)C1 952973050 REWZTKPZCQKLLK-GOSISDBHSA-N 379.844 2.745 0 50 GFAA Cc1ccc(-c2ccc(C(=O)N3CCC4(CC3)C(=O)N(C)C(=O)N4C)cc2)o1 952976874 HUMQOCJEBGLACI-UHFFFAOYSA-N 381.432 2.754 0 50 GFAA O=C(c1cccnc1)N1CCCN(Cc2cccc(Cn3cccn3)c2)CC1 1529153866 WFWLTAGIPHZTMX-UHFFFAOYSA-N 375.476 2.675 0 50 GFAA O=C(c1cccnc1N1CCCN(C2Cc3ccccc3C2)CC1)N1CCCC1 1529184521 ACRQOHPWCFFUBO-UHFFFAOYSA-N 390.531 2.997 0 50 GFAA O=S1(=O)C[C@@H]2[C@H](C1)N(Cc1ccccc1)CCN2CCCC1CCCC1 1565528336 HDAHOBMJEKOMRQ-RTWAWAEBSA-N 376.566 2.940 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)N[C@H]1COC[C@H]1Cc1ccncc1 1615963515 NDMHUWHUXFPTAR-MJGOQNOKSA-N 376.460 2.683 0 50 GFAA COc1cccc2c1C1(CCN(c3cccc(C(=O)N(C)C)n3)CC1)OCC2 1704303833 BSMJRBOPNONBIW-UHFFFAOYSA-N 381.476 2.860 0 50 GFAA COc1ccc2c(c1)CCOC21CCN(c2cccc(C(=O)N(C)C)n2)CC1 1704307426 YWULONZVFLBEIH-UHFFFAOYSA-N 381.476 2.860 0 50 GFAA CC[C@@H](NC(=O)c1ccc(OC)c(Oc2ccc(CN)cc2F)c1)C(=O)OC 1857691848 YXAKSUXGPCNQBE-OAHLLOKOSA-N 390.411 2.767 0 50 GFAA O=C(c1ccc(N2CCCC2)c(Cl)c1)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857733383 IUMBRGPAEPJTEL-XLIONFOSSA-N 389.883 2.504 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2ccc3c(c2)ncn3C)[C@H]1c1ccccc1 1857733987 IXPAPZCMLUVSCD-SFTDATJTSA-N 378.476 2.717 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N4CC(c5ccccn5)C4)CC3=O)sc2c1 1857736631 OLZBBOJUBDHNLI-AWEZNQCLSA-N 392.484 2.979 0 50 GFAA Cc1cccc([C@@H](CC(=O)Nc2n[nH]c(-c3ccncc3)c2C)NC(N)=O)c1 1875254334 BMMJNNYSFCSCHO-MRXNPFEDSA-N 378.436 2.827 0 50 GFAA NS(=O)(=O)c1ccc(NC(=S)N(Cc2cccc(O)c2)CC2CC2)cc1 1875266673 ZKERLYXKNPCLQI-UHFFFAOYSA-N 391.518 2.649 0 50 GFAA CN1[C@H]2CC[C@H]1CC(CC(=O)NCCC1(CNc3ncnn4cccc34)CC1)C2 1875327666 FEMZIRZFUDLNOM-ROUUACIJSA-N 396.539 2.691 0 50 GFAA Cn1ccc(-n2nc(CCCO)nc2[C@H]2COc3ccc4ccccc4c3C2)n1 1875336046 QWVBYGJRYSCGAB-MRXNPFEDSA-N 389.459 2.798 0 50 GFAA O[C@@H]1CN(c2ccc(Cl)cn2)C[C@]12[C@H](c1ccccc1)[C@H]2CN1CCOCC1 2100556877 UJHCEHQIPLEVMW-UGESXGAOSA-N 399.922 2.648 0 50 GFAA Cc1ccc(C(C)(C)NC(=O)C[C@@H]2CN(C(=O)[C@@H]3C[C@H]3C)C3(CCC3)CO2)cn1 2325785353 RGVZOBXMVCOLNR-ATZDWAIDSA-N 399.535 2.938 0 50 GFAA FC(F)(F)c1cc(N2CCN(Cc3nccnc3C(F)(F)F)CC2)ncn1 2325807624 HUSZSRLMJHBYKO-UHFFFAOYSA-N 392.307 2.626 0 50 GFAA Cc1[nH]c2ccccc2c1CCC(=O)N[C@@H]1CCN(c2cnnc(O)c2Cl)C1 2325807649 JXPVQAUNAVGOHO-CYBMUJFWSA-N 399.882 2.953 0 50 GFAA CNC(=O)Cc1nc([C@H]2CC[C@@H](N)CC2)n(-c2ccc(C(F)(F)F)cc2)n1 2356160025 ZOBKOBCSDBIMNX-BJHJDKERSA-N 381.402 2.560 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cc4ncccn4n3)C2=O)cc1 2356136062 FOUSHFQEHNLHRT-JOCHJYFZSA-N 389.459 2.840 0 50 GFAA CN(C(=O)c1ccc(CS(C)(=O)=O)o1)C1CCN(Cc2ccccc2)CC1 113092984 ISOUNBPICWIZFR-UHFFFAOYSA-N 390.505 2.561 0 50 GFAA Cc1c(C)n(CCN2CCOCC2)c2ncn3nc(-c4cccs4)nc3c12 20573226 SHILNFHCQZVTSU-UHFFFAOYSA-N 382.493 2.757 0 50 GFAA CN(C)[C@@H]1c2ccccc2C2(CCN(Cc3cccc4nonc34)CC2)[C@H]1O 20386833 GTPHGQYXDILUMO-RTWAWAEBSA-N 378.476 2.734 0 50 GFAA CCn1c([C@@H]2CCCN(C(=O)CCCc3c[nH]c4ccccc34)C2)n[nH]c1=O 67802894 WSAPMFIFMVBNTO-MRXNPFEDSA-N 381.480 2.802 0 50 GFAA CCc1c(C(=O)N[C@H]2CS(=O)(=O)c3ccccc32)cnn1-c1ccccc1 118686681 NRGQOFAVTAOOEY-KRWDZBQOSA-N 381.457 2.693 0 50 GFAA CCc1oc(C(N)=O)cc1CN1CC=C(c2cnn(CC(F)(F)F)c2)CC1 67804323 MBRFEZCPIWVASD-UHFFFAOYSA-N 382.386 2.989 0 50 GFAA CC(=O)N[C@H](C(=O)N1CCc2[nH]nc(CSc3ccccc3)c2C1)C(C)C 20389675 OERJAGBVHKRMEH-IBGZPJMESA-N 386.521 2.747 0 50 GFAA Cc1ccccc1C[C@@H](CO)CNc1ncnc2ccc(S(C)(=O)=O)cc12 252501482 UFRCXNXLZJPIJG-OAHLLOKOSA-N 385.489 2.605 0 50 GFAA CC(=O)N[C@H](CC(=O)NCCCN1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 252528053 DZCRISVAEFNDDJ-HNAYVOBHSA-N 395.931 2.524 0 50 GFAA O=C(c1cccnc1)N1CCC(N2CC[C@@H](c3ccc(F)cc3)[C@H](O)C2)CC1 65454680 QLUSVCMYJKVRLR-LEWJYISDSA-N 383.467 2.676 0 50 GFAA C[C@H](CCNC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1)[S@](C)=O 477194391 PBMHFVGDZDCTHI-ZCDIYMNCSA-N 391.459 2.740 0 50 GFAA COC(=O)CC(C)(C)CC(=O)N1CC[C@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 253418565 UKMVHONIOUSOTR-CABCVRRESA-N 382.501 2.824 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCN([C@@H]3CCc4ccccc4C3)CC2)n(C)n1 72408518 JLKWDFDWZRPUBQ-OAQYLSRUSA-N 380.536 2.934 0 50 GFAA Cc1onc(-c2ccccn2)c1C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 152716518 FWEFUQNEUIRQAJ-OAHLLOKOSA-N 398.369 2.859 0 50 GFAA CCN1CCC[C@@H](CN(C)Cc2nnc(C3CCC3)n2C)[C@@H]1c1cnn(C)c1 328648073 UJVIYAYPFYEFQZ-FXAWDEMLSA-N 385.560 2.721 0 50 GFAA CC(C)CNC(=O)C[C@@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72138945 YKGUAHXKGTVPSL-OAQYLSRUSA-N 379.504 2.816 0 50 GFAA O=C(N1CCS(=O)(=O)CC1)N1CCC[C@@H]1c1nc(C2CCCCC2)co1 365305791 BGPPGQRBOMKNGR-MRXNPFEDSA-N 381.498 2.710 0 50 GFAA C[C@H](NC(=O)c1ccc(NC(=O)c2scnc2C(C)(C)C)cc1)C(=O)O 262942404 MFLUVNQBKRJBLM-JTQLQIEISA-N 375.450 2.896 0 50 GFAA O=C(NCc1ccoc1)[C@H]1CCCN(C2CCN(Cc3cccnc3)CC2)C1 71551776 MSMNFASLDDKPAZ-FQEVSTJZSA-N 382.508 2.667 0 50 GFAA Cc1cc(C(=O)N2CCC(CN)CC2)nn1-c1ccc(Br)cc1 237678266 BMOBQOXNOQAQMH-UHFFFAOYSA-N 377.286 2.754 0 50 GFAA CCN1CC2(CCN(C(=O)[C@H]3CCCCN3Cc3ccccc3)CC2)OC1=O 77287659 LTIUNMAKBBYQPX-LJQANCHMSA-N 385.508 2.874 0 50 GFAA O=C(NC[C@@H]1CCCCN1S(=O)(=O)c1c[nH]c2ncccc12)c1ccccc1 175341098 PAKOCEBJNVSUQO-INIZCTEOSA-N 398.488 2.536 0 50 GFAA O=C(NC[C@@H](Cc1ccccc1)C(=O)O)c1cccc(Nc2cnccn2)c1 238198189 UQXPGLYONTXURS-QGZVFWFLSA-N 376.416 2.894 0 50 GFAA CCc1nsc(N2CCCN(C(=O)N[C@@H](c3nccs3)C3CC3)CC2)n1 175928601 GUFGWZSDNXOULU-CQSZACIVSA-N 392.554 2.930 0 50 GFAA COCC(=O)N1CCCN(C(=O)NC2c3ccccc3-c3ccccc32)CC1 426360231 OZCHROMBOCQPFN-UHFFFAOYSA-N 379.460 2.647 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)N2CCN(c3ccc(F)cc3F)CC2)n1 426370782 QRQCFHFWRQANLR-CQSZACIVSA-N 377.439 2.698 0 50 GFAA Cc1ccc([C@H](C)NC(=O)CN2C(=O)C3(CCNCC3)Nc3ccccc32)cc1 82109658 PWJMKBQZHGJBOE-KRWDZBQOSA-N 392.503 2.753 0 50 GFAA Cc1[nH]c2ccccc2c1CC(=O)N1CCC(c2nnc(CN(C)C)n2C)CC1 96137700 OBDSOUAGOHWSQM-UHFFFAOYSA-N 394.523 2.615 0 50 GFAA Cc1nccn1CCC(=O)N1CCC(c2nccn2Cc2cccnc2)CC1 91707910 SYUVKPOBDSUTEM-UHFFFAOYSA-N 378.480 2.628 0 50 GFAA CCOc1cccc(CN2CCN(C)[C@]3(CCC(=O)N(CC4CC4)CC3)C2)c1 95352587 LDKCTYFSNXYERN-QHCPKHFHSA-N 385.552 2.994 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)n1cccn1 91677131 XJHQUFZOOMMHKQ-IBGZPJMESA-N 395.507 2.661 0 50 GFAA CCCn1nccc1S(=O)(=O)N1CCC[C@@H](c2cccc(C(=O)O)c2)C1 95354798 IXOBFRPYTWOIKK-MRXNPFEDSA-N 377.466 2.560 0 50 GFAA Cc1ccc(CS(=O)(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cc1F 184250864 LZBIFWBIKXUFKX-UHFFFAOYSA-N 392.500 2.700 0 50 GFAA CCO[C@H]1CN(C(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)C[C@H]1CO 1875268111 XOFRIHGHBDSHAZ-BBRMVZONSA-N 392.887 2.514 0 50 GFAA COC(=O)[C@@H](CSCc1cccc(OC)c1)NC(=O)CCc1cscn1 1875383399 SBTRJOHYOUQNRW-MRXNPFEDSA-N 394.518 2.676 0 50 GFAA Cc1ccc(-c2ccc(O)nn2)cc1NC(=O)c1ccc2c(=O)n(C)cnc2c1 952873657 YEYTZAJKHAXMNU-UHFFFAOYSA-N 387.399 2.657 0 50 GFAA Cc1cc(NC(=O)[C@@H]2CCCN(C3CCOCC3)C2)ccc1N1CCCC1=O 952978307 BPFFCOFSIGCBNN-QGZVFWFLSA-N 385.508 2.951 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 952963137 HVINTSDCBKLSJI-MRXNPFEDSA-N 380.452 2.869 0 50 GFAA Cc1cc(-c2nnc(N3CCC(CC(N)=O)CC3)n2Cc2ccccc2)co1 1341304821 ONSGKXQODRIWPJ-UHFFFAOYSA-N 379.464 2.987 0 50 GFAA COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 170591078 RHAPTCDMPXQXMU-UHFFFAOYSA-N 390.417 2.543 0 50 GFAA O=C1CN(c2ccnc(C(=O)Nc3ccccc3CCC(F)(F)F)c2)CCN1 188320471 CPJHNCRIQQXVII-UHFFFAOYSA-N 392.381 2.765 0 50 GFAA O=C(NS(=O)(=O)c1cccc(-c2nnco2)c1)c1ccc2c(c1)CCC=C2 793175339 XTZOZFICYQYCGZ-UHFFFAOYSA-N 381.413 2.815 0 50 GFAA NC(=O)COc1cccc(C(=O)N2C[C@H](C3CC3)O[C@H](c3ccccc3)C2)c1 1529151912 HALTYTCQQNJNEP-VQTJNVASSA-N 380.444 2.543 0 50 GFAA COc1cccc([C@H]2CN(C(=O)c3cc(Cl)ccc3O)C[C@@H]2C(=O)O)c1 212962656 PGABBFCMGFMGQM-CVEARBPZSA-N 375.808 2.995 0 50 GFAA Cc1ccc2nc(C)cc(C(=O)N3CCCN(C(=O)[C@@H]4CCOC4)CC3)c2c1 1772705922 DQWCNJXBSDQUBH-QGZVFWFLSA-N 381.476 2.563 0 50 GFAA CSCC(=O)N1C[C@H]2CN(C(=O)c3ccc[nH]3)C[C@]2(CCc2ccccc2)C1 1772706493 QVQHGSFLQBZWGU-AVRDEDQJSA-N 397.544 2.911 0 50 GFAA CC1(C)Cc2nc3[nH]nc(NC(=S)NC(=O)c4ccccc4)c3cc2CO1 5156607 PAHQBZOLPLXSLY-UHFFFAOYSA-N 381.461 2.936 0 50 GFAA COc1cc(OC)c(NC(=O)CSc2nc3c(c(=O)[nH]2)CCC3)cc1Cl 11905499 FKOJMUHLTUMHEI-UHFFFAOYSA-N 395.868 2.660 0 50 GFAA CCOC(=O)C[C@@H](NC(=O)c1cn(Cc2ccccc2Cl)nn1)C(C)C 12112378 KULSFHAFVTYIAD-OAHLLOKOSA-N 378.860 2.687 0 50 GFAA Cc1cccc(CN2CCC[C@]3(CCN(C(=O)Cc4cccnc4)C3)C2=O)c1 12440517 YVWXSFHUMFQJSW-HSZRJFAPSA-N 377.488 2.974 0 50 GFAA CC(C)Cc1ccc(CN2CCC[C@H](NC(=O)CCN3CCOCC3)C2)cc1 15080719 DPRQUSMETAAYPW-QFIPXVFZSA-N 387.568 2.688 0 50 GFAA O=C1C[C@H](NC2CCCCC2)C(=O)N1c1ccc(I)cc1 19771139 XIFNHAZJYIVXCK-AWEZNQCLSA-N 398.244 2.845 0 50 GFAA COc1cc(CNC(=O)c2nccc3[nH]ccc23)c(Br)cc1O 1857531717 MEUXGOHGNWYOAP-UHFFFAOYSA-N 376.210 2.970 0 50 GFAA CC[C@H](C(=O)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1C(=O)Nc1ccccc1)n1cccn1 1857679250 QMUVQCOOJZBDKA-IVDHNXQLSA-N 393.491 2.988 0 50 GFAA Cc1n[nH]c(C)c1-n1ccnc1-c1ccccc1OCC(=O)NC[C@@H]1CCCO1 1857690303 GCOLWHMTKHVNIY-INIZCTEOSA-N 395.463 2.553 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1)NCCc1cnn[nH]1 1857729208 NCGSXJBGLUFRRZ-LBPRGKRZSA-N 388.859 2.565 0 50 GFAA COc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3ccoc3)[C@H]3CC[C@]2(C1)O3 1857736125 LTFYZKZETPSCIT-XHYAQGIWSA-N 382.460 2.698 0 50 GFAA C[C@H](NC(=O)[C@H](C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)[C@@H]1C[C@H]2CC[C@H]1C2 333480442 XUHUZIMQSSZNKP-HAXSJCRZSA-N 383.536 2.597 0 50 GFAA COC(=O)c1cccc(C(=O)NC[C@H]2Cc3cc(-c4cnccn4)ccc3O2)c1 12055486 NYUPOZZFAGMOOD-GOSISDBHSA-N 389.411 2.664 0 50 GFAA CC(C)[C@H](CNC(=O)NCc1cccc(S(N)(=O)=O)c1)Cc1ccccc1 241144878 JTVSJEHGTXSCME-SFHVURJKSA-N 389.521 2.648 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(C)c(C(=O)N2CC[C@@]3(CCCOC3)C2)c1 375337222 LUHWGWKQUPBUQK-FQEVSTJZSA-N 394.537 2.668 0 50 GFAA CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCCn1ncc2ccccc2c1=O 2325732303 NYFBVSTYWYVOIN-IMFGXOCKSA-N 385.508 2.990 0 50 GFAA COCC1CC(NC(=O)C(=O)NCc2ccc(C)cc2O[C@@H](C)CC(C)C)C1 2325760760 KETVJNPAJHWZED-MUYFXNHWSA-N 390.524 2.966 0 50 GFAA NC1CCN(C(=O)c2cnc(NCc3cc(-c4ccccc4)ns3)nc2)CC1 2325798745 VZVBLXKHUJBPKL-UHFFFAOYSA-N 394.504 2.776 0 50 GFAA COC(=O)c1ccc(NC(=O)CCC(=O)Nc2ccc(C(=O)OC)cc2)cc1 672533 CEKNBZHRQWVLPU-UHFFFAOYSA-N 384.388 2.617 0 50 GFAA biogenic CCc1nnc(NC(=O)CSc2nnc(-c3ccc(F)cc3)n2C)s1 4736190 GAMNACXDCCGTDD-UHFFFAOYSA-N 378.458 2.766 0 50 GFAA COc1cc(OC)cc(N2C(=O)C[C@@H](NCCc3ccc(Cl)cc3)C2=O)c1 4891391 VSQIRNVPMUXLOS-GOSISDBHSA-N 388.851 2.821 0 50 GFAA COc1ccc(/C=C/CN2CCC(n3cc(C(=O)NC4CC4)nn3)CC2)cc1 11841375 WUYRCVZHDMBBER-NSCUHMNNSA-N 381.480 2.529 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=O)c2coc(COc3ccc(F)cc3)n2)C1 12714180 CBJOWSUPGHTZTQ-ZDUSSCGKSA-N 376.384 2.808 0 50 GFAA Fc1ccc(-c2cnnc(NC[C@H](c3cccnc3)N3CCOCC3)n2)cc1 19608741 CCQZKDAACAFPMG-LJQANCHMSA-N 380.427 2.558 0 50 GFAA COc1ccc2cc(Br)ccc2c1CC(=O)N1CCN(C)CC1 20500269 DFEBDVSIGMFRRN-UHFFFAOYSA-N 377.282 2.927 0 50 GFAA C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@H]1CCN1CCCC1=O 20861178 CRWJBJOYWYRKSA-CVEARBPZSA-N 388.464 2.576 0 50 GFAA CNC(=O)[C@@H](C)N(C)C(=O)c1coc(COc2ccc3ccc(OC)cc3c2)n1 67743716 VMARSFRJEXIBIW-CYBMUJFWSA-N 397.431 2.622 0 50 GFAA COC(=O)c1cc2c(=O)n(-c3ccc(OC)cc3)ccc2nc1/C=C/N(C)C 72406635 HPWUQCAQGOLOJE-PKNBQFBNSA-N 379.416 2.713 0 50 GFAA CC(C)(C)COC(=O)N1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 82116076 YOVHFVVYNUPFIJ-HXUWFJFHSA-N 376.501 2.840 0 50 GFAA CC[C@H](OC)C(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91636819 FXMIBPQHIUHWJM-KRWDZBQOSA-N 380.435 2.731 0 50 GFAA CCc1c(C(=O)N2CCN(C)[C@]3(CCC(=O)N(CC)CC3)C2)csc1C 95383524 AGWRTBMMAXZUGK-FQEVSTJZSA-N 377.554 2.778 0 50 GFAA O=C(c1cnc(N2CCOCC2)nc1)N1CCCC[C@@H]1CCc1ccccc1 95386427 KLUMNJKUXDDBER-HXUWFJFHSA-N 380.492 2.941 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)N1CC(Oc2ccccc2Cl)C1 95508484 WNZSOBNYKDKWAR-INIZCTEOSA-N 384.863 2.946 0 50 GFAA Cc1ncncc1C(=O)N1CCC[C@H](CCC(=O)NCc2ccccc2F)C1 95518683 DVVXVNWIBVDSAS-MRXNPFEDSA-N 384.455 2.873 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)c2cc(=O)cc(C)o2)C1 95519136 WPBPIOZWABFALF-GOSISDBHSA-N 398.503 2.984 0 50 GFAA CCC[C@@H]1C=CCN1C(=O)c1ccc(OC2CCN(C(=O)COC)CC2)cc1 95530229 OJFGOQGVGNRIIB-GOSISDBHSA-N 386.492 2.884 0 50 GFAA COc1ccc([C@@H](NC(=O)NC2(c3noc(C)n3)CCC2)c2nccn2C)cc1 116525148 PONJOBGBDQVUPN-MRXNPFEDSA-N 396.451 2.588 0 50 GFAA Cc1cccn2c(NC(=O)N3C[C@@H](CO)OC[C@H]3C)c(-c3ccccc3)nc12 119110217 UFLCKBYGIPAFPE-WBVHZDCISA-N 380.448 2.923 0 50 GFAA C[C@H](N[C@H](C)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2)C1CCOCC1 125412458 WEQLQLDUVNTJJT-VPGYMZKXSA-N 377.529 2.574 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)C1 130426405 SEIMMKPYYSVARD-WFASDCNBSA-N 398.381 2.612 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2cnn(C)c2n1 131256044 KXMFLUSKVDCWHM-AEFFLSMTSA-N 377.492 2.917 0 50 GFAA CC(C)(CC(=O)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1)c1ccccc1 135867989 UOULPQOYIZODTC-IBGZPJMESA-N 386.517 2.965 0 50 GFAA O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NCc1ccccc1CN1CCOCC1 139663752 BLWGYCJFGIQVLB-UOYQGRGCSA-N 398.547 2.856 0 50 GFAA O=C(Cn1cc(Br)ccc1=O)Nc1ccc2nc(S)oc2c1 158377385 FRVIQJZLZCGCQT-UHFFFAOYSA-N 380.223 2.679 0 50 GFAA CCc1c(C(=O)N2CCC[C@@H](CNC)C2)nnn1-c1ccc(OC(C)C)cc1 159106674 CAEORDRKRDGVOT-INIZCTEOSA-N 385.512 2.689 0 50 GFAA CCCn1cnnc1COC(=O)Cc1ccccc1I 170617320 JICQFVJSEJJRQL-UHFFFAOYSA-N 385.205 2.579 0 50 GFAA CC(C)CC(=O)N[C@@H](C(=O)NCc1cccnc1-n1ccnc1)c1ccccc1 171367571 MAASRVWMRPZTEL-HXUWFJFHSA-N 391.475 2.787 0 50 GFAA COc1ccccc1-n1cc(S(=O)(=O)N2CCCN(C)c3ccccc32)cn1 173181145 DMKVFCULJFZRIL-UHFFFAOYSA-N 398.488 2.916 0 50 GFAA CC1([C@@H]2CCCN(C(=O)NC3CCN(Cc4ccccc4)CC3)C2)OCCO1 182463804 XLMYMLCAICGCSY-LJQANCHMSA-N 387.524 2.836 0 50 GFAA Cc1nc2c(c(C)c1CC(=O)NCc1ccc(Cl)cc1F)c(=O)[nH]n2C 188661866 VTPWWXQQDIMTLL-UHFFFAOYSA-N 376.819 2.530 0 50 GFAA C[C@H](c1nnnn1C1CC1)N1CCO[C@H](c2cccc(Br)c2)C1 191975835 KCTJIHDMCDYKOH-ABAIWWIYSA-N 378.274 2.905 0 50 GFAA CCN(C)C(=O)[C@H](C)NC(=O)NCCc1cccc(OCc2ccccc2)c1 241316785 LUWSRRAAXALTQN-KRWDZBQOSA-N 383.492 2.974 0 50 GFAA COc1cccc(N2CC[C@@H](CNC(=O)N3CCOc4cc(O)ccc4C3)C2)c1 287534906 BUFJWQUZKGKLGZ-INIZCTEOSA-N 397.475 2.831 0 50 GFAA CCCS(=O)(=O)c1ccccc1C(=O)N1CC[C@H](n2cc(Cl)cn2)C1 290872231 FNLNEOSECSSMSG-AWEZNQCLSA-N 381.885 2.807 0 50 GFAA C[C@@H](O)C1CCN(c2cc(N3CCC([C@@H](C)O)CC3)c3ccncc3n2)CC1 328590374 FDENFUXPAXJACV-HZPDHXFCSA-N 384.524 2.824 0 50 GFAA O=C(N1CCC[C@@H](c2nc(O)n[nH]2)C1)[C@@]12CCC[C@@H]1CN(Cc1ccccc1)C2 329062291 JZXXUKNEUYSSIN-JBYIUTFZSA-N 395.507 2.519 0 50 GFAA CN1Cc2c(NC(=O)N3CCCN4c5ccccc5C[C@@H]4C3)cccc2C1=O 333949534 XJZSBVCCUOFIDW-MRXNPFEDSA-N 376.460 2.941 0 50 GFAA C[C@H](NC(=O)N1CCN(CC2CCCC2)CC1)c1nc(-c2cccnc2)no1 426685242 FAKLFGJKSXLRRU-HNNXBMFYSA-N 384.484 2.710 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N[C@H]1CCCN(Cc2cccs2)C1 670469346 DNCYTSBCKOLYLR-HNNXBMFYSA-N 396.516 2.698 0 50 GFAA Cc1ocnc1C(=O)N1CCC(CNC(=O)c2ccc3ncsc3c2)CC1 828169863 GNIGFGKXYSZWHH-UHFFFAOYSA-N 384.461 2.875 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@@H](C)[C@@](C)(CO)C1 888101816 XGRBCOCPQUOXJA-BDJLRTHQSA-N 376.375 2.754 0 50 GFAA Cc1noc2ncc(C(=O)N3CCN(c4ccc(C(=O)O)cc4)C[C@H]3C)cc12 911317271 JIFYTUCVQZBPNA-GFCCVEGCSA-N 380.404 2.580 0 50 GFAA COc1ccc(Cc2cnc(NC(=O)[C@@H]3COCCN3CC(F)F)s2)cc1 952845667 AXXBLGNWWQKBSN-HNNXBMFYSA-N 397.447 2.647 0 50 GFAA O=C([C@@H]1CCOc2ccc(Cl)cc21)N1CCN(c2ncncc2Cl)CC1 952845772 UNNWCVWYOAPWOC-CYBMUJFWSA-N 393.274 2.998 0 50 GFAA O[C@H](c1cccs1)C1CCN(Cc2cnc(N3CCOCC3)s2)CC1 952984084 NPXMXDHTOMOKOI-KRWDZBQOSA-N 379.551 2.987 0 50 GFAA COC[C@@H](C)N(Cc1cccc(F)c1)C(=O)c1ccc(-c2nnn(C)n2)cc1 1506417419 IHMTXTBFEVJGGA-CQSZACIVSA-N 383.427 2.694 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN([C@@H]3CCN(c4ccccc4)C3)CC2)cc1 1506425924 SNORDOZAOJPEGJ-HXUWFJFHSA-N 385.533 2.580 0 50 GFAA O=C([C@H]1CCc2sc(-c3ccncc3)nc2C1)N1CCC(n2cnnc2)CC1 1772816055 FRXOEYHQONNMGW-HNNXBMFYSA-N 394.504 2.765 0 50 GFAA C[C@H](CC(=O)N[C@@](C)(CNC(=O)c1cc(C2CC2)[nH]n1)C1CC1)c1ccncc1 1775997166 XHKCZWFAJMQCHF-PEBXRYMYSA-N 395.507 2.891 0 50 GFAA CCn1nc(-c2nc(COc3cccc(F)c3)nn2-c2cnn(C)c2)cc1C 1857670691 XJJYUVAMLQUVPV-UHFFFAOYSA-N 381.415 2.911 0 50 GFAA CCc1nccn1CCC(=O)N1CCc2nn(C)c(-c3ccccc3)c2CC1 1857680502 OJXQYXNOCRMMIB-UHFFFAOYSA-N 377.492 2.864 0 50 GFAA CC(C)N=c1[nH]c(-c2ccccc2)nc2c1CCC21CCN([C@@H](C)C(N)=O)CC1 1857687102 KSHVFIPRSLBIIR-INIZCTEOSA-N 393.535 2.539 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NC[C@@H]1COc2ccccc2O1 1857709737 OMJDLUDLGURAJJ-GFCCVEGCSA-N 382.445 2.732 0 50 GFAA CC(C)[C@@H]1CN2C[C@@H](NC(=O)c3cc(-n4cccn4)ccc3Cl)C[C@H]2CO1 1857726150 GTTWDTCDYNEURO-QOKNQOGYSA-N 388.899 2.753 0 50 GFAA N[C@@H]1CN(C(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)[C@@H]2COC[C@H]12 1875292858 VEGLWVOYGPDNQH-RBSFLKMASA-N 397.422 2.556 0 50 GFAA C=CC(=O)N1C[C@H](NC(=O)C(C)(C)n2ccc(C3CC3)n2)Cc2ccccc21 1875389615 VGMXIOBYRJGBFP-QGZVFWFLSA-N 378.476 2.756 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N2CCC[C@]23CCC[S@](=N)(=O)C3)c1 1875395951 QUDGZUAMLOWHMZ-BCHFMIIMSA-N 377.510 2.594 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)c1cnc2c(n1)CCCC2 1875401886 VAYAKGROQMGEQU-RDTXWAMCSA-N 396.495 2.847 0 50 GFAA COC(=O)[C@@]12COC[C@@H]1CN(C(=O)C(C)(C)Oc1cc(C)ccc1C(C)C)C2 2100477241 VQTPSFUCEIOCMR-AOMKIAJQSA-N 389.492 2.924 0 50 GFAA CC(C)(C)c1cc2c(NCc3cccc(-n4cc(CN)nn4)c3)nccn2n1 2325800066 LUIIKFLEOSXUGW-UHFFFAOYSA-N 376.468 2.678 0 50 GFAA Cn1cc(N(C(=O)c2ccccc2)[C@H](C(=O)NCC(F)F)c2ccccn2)cn1 2325826666 JCBXDKKTVKXOQW-SFHVURJKSA-N 399.401 2.585 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC(OCc4cccnc4)CC3)cc2)n1 2356153142 TYOXKRWOKUIXJQ-UHFFFAOYSA-N 389.459 2.942 0 50 GFAA Cn1cnnc1S[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1 797124 YJSLERVIOOTPTK-KBPBESRZSA-N 386.930 2.850 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2C)cc1 905558 TWDSQUTYCODVOA-UHFFFAOYSA-N 382.445 2.623 0 50 GFAA COc1ccc(C(=O)NC(=S)NCc2cccnc2)cc1Br 1093222 DLJABJIMQXRAGE-UHFFFAOYSA-N 380.267 2.657 0 50 GFAA CSc1ccccc1-n1nnnc1SCC(=O)NCc1cccs1 2871896 KPWNGUAFUWNDIH-UHFFFAOYSA-N 377.520 2.854 0 50 GFAA CCOC(=O)[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)CCn2cccn2)C1 11815276 OWSPJDRQTHAKCW-NRFANRHFSA-N 387.455 2.827 0 50 GFAA Cc1cc(C)c(C(=O)N[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)o1 11879981 OWAYLHYKOPHGRQ-INIZCTEOSA-N 384.480 2.967 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C2CCN(C(C)=O)CC2)cc1 11933248 JGCSLPNYOIFDJY-UHFFFAOYSA-N 387.568 2.892 0 50 GFAA O=C(Nc1ccccc1)[C@@H]1CCCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 12866545 WIAOHLAXMASLRO-GFCCVEGCSA-N 390.369 2.998 0 50 GFAA COCCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1/C=C/c1ccccc1 13123926 YJTIBKAOZXCIGQ-ROJDOSBLSA-N 386.473 2.867 0 50 GFAA O=C1CCC(CCC(=O)N2CCO[C@@H](Cc3cccc4ccccc34)C2)=NN1 14947989 VZRHIURFNBKBAY-IBGZPJMESA-N 379.460 2.656 0 50 GFAA COCCn1c(CN(C)Cc2ccccc2)cnc1S(=O)(=O)CC(C)(C)C 15068671 CLNKISOXVPUAKK-UHFFFAOYSA-N 393.553 2.981 0 50 GFAA Cc1nccn1CCCNC(=O)c1coc(CN2CCc3ccccc3C2)n1 15078663 BIGDEVKVIBXBFW-UHFFFAOYSA-N 379.464 2.558 0 50 GFAA COc1cccc(N2CCC(N3CCC[C@H](N4CCC(CO)CC4)C3)CC2)c1 23374534 IXQMMZHSJRRFCV-QFIPXVFZSA-N 387.568 2.833 0 50 GFAA Cc1cc(=O)[nH]c(S[C@@H](C)C(=O)N[C@@H](C)c2cnn(-c3ccccc3)c2)n1 32577731 YPPYAZAUKPMANF-KBPBESRZSA-N 383.477 2.622 0 50 GFAA COc1ccccc1OCCN(C)C(=O)c1ccc(CSc2ncn[nH]2)o1 55053774 ALJVANCHVBDVSZ-UHFFFAOYSA-N 388.449 2.850 0 50 GFAA CC(C)c1nsc(NC(=O)c2ccc(CN3CCC[C@H](C(N)=O)C3)cc2)n1 65383585 WUJCIUCPLDOGBA-HNNXBMFYSA-N 387.509 2.611 0 50 GFAA CCc1c(C)cc(C(=O)N2CCC[C@H](N(C)Cc3ccccc3)C2)c(=O)n1C 72144920 YEOPWHWEVWGEEI-IBGZPJMESA-N 381.520 2.993 0 50 GFAA O=C(NC[C@H](c1ccc(F)cc1)N1CCCC1)c1cn(-c2ccccc2)nn1 72168446 FMXZTOBFJVPSHX-HXUWFJFHSA-N 379.439 2.973 0 50 GFAA CCc1nc(N2CCC[C@@H](c3cc(N4CCOCC4)nc(C)n3)C2)ncc1C 72422683 WZORWGYCBUDXOT-QGZVFWFLSA-N 382.512 2.666 0 50 GFAA COc1cc(F)c(CN2CCC([C@@H](C)N3CCN(C)CC3)CC2)cc1OC 77302885 QRIKKCVMCLIRJL-MRXNPFEDSA-N 379.520 2.691 0 50 GFAA O=C(Cn1ccc(=O)cc1)N1CCC[C@@H](c2[nH]ncc2Cc2ccccc2)C1 77319820 DGLDCVQEFKVIDB-GOSISDBHSA-N 376.460 2.568 0 50 GFAA CC(=O)N1CCN(C(=O)c2cnc3c(c2)nc(-c2ccccc2Cl)n3C)CC1 77453436 RUGZUNLREIVILQ-UHFFFAOYSA-N 397.866 2.593 0 50 GFAA O=C1c2ccccc2C(=O)N1Cc1cn(Cc2ccc(Br)cc2)nn1 81275833 XOAJJVZMFZBEDX-UHFFFAOYSA-N 397.232 2.885 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@H]2CC[C@@H]1CN(Cc1nc3ccccc3[nH]1)C2 91847758 JJZQWQPJEBELBO-JKSUJKDBSA-N 379.464 2.791 0 50 GFAA O=C(CCc1ccsc1)N1CCC2(CC1)CC(=O)N(C[C@@H]1CCCO1)C2 95370995 CCPYCRLQRBDZST-KRWDZBQOSA-N 376.522 2.701 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(F)cc1F)CC2 95505617 LBMUPDZJYRXOAQ-UHFFFAOYSA-N 388.418 2.614 0 50 GFAA COCCn1c(CN2C[C@H]3CC[C@H]2C3)cnc1S(=O)(=O)CC1CCCCC1 102534432 VIESYNRKSFLCJX-ROUUACIJSA-N 395.569 2.868 0 50 GFAA CN(Cc1nccn1C(F)F)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 122064105 RSDQRTVQQUEJAS-KKUMJFAQSA-N 390.438 2.864 0 50 GFAA CC(C)OC1CCC(NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)CC1 159403799 LLHCRLDDOJGYGL-UHFFFAOYSA-N 375.494 2.688 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)c4cc(C)cc(C)c4)nnc23)n1 169776024 PKWCUHBPZCPADN-UHFFFAOYSA-N 376.420 2.889 0 50 GFAA COCCC1(CNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)CCCCC1 170599332 SWXOEBVTIICEHT-IRXDYDNUSA-N 378.513 2.655 0 50 GFAA O=C(NS(=O)(=O)Cc1ccc(Cl)nc1)[C@H]1SCCc2ccccc21 170645632 KCLXCSXWKOVQDQ-HNNXBMFYSA-N 382.894 2.712 0 50 GFAA O=C(c1cccnc1N1CCOCC1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 170995176 SDNYXJJYLKCXND-FQEVSTJZSA-N 399.466 2.643 0 50 GFAA C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCC(NC(=O)C2CC2)CC1 171271886 OACHAGNCWCNODD-LBPRGKRZSA-N 384.398 2.990 0 50 GFAA Cc1ccc(S(=O)(=O)NCCNC(=O)c2[nH]c3ccc(C)cc3c2C)cc1 178446676 PKADKHJVIBSVGF-UHFFFAOYSA-N 385.489 2.801 0 50 GFAA Cc1ccc(OCCN2CCN(C)[C@@]3(CCC(=O)N(C)CC3)C2)c(Cl)c1 230196354 WGNPJUXFTXSEPN-HXUWFJFHSA-N 379.932 2.656 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)[C@@H](c2ccccc2)C1 249703345 KIABDLIGCTZPGT-HXUWFJFHSA-N 399.516 2.639 0 50 GFAA CC(C)c1ccc(N2C(=O)[C@@H](CCC(=O)NCc3ccccn3)N=C2O)cc1 252489433 JRARQBRJZFEMES-GOSISDBHSA-N 380.448 2.931 0 50 GFAA CC1(C2CCN(C(=O)NCc3ccc(-n4ccnc4)c(F)c3)CC2)OCCO1 270140643 IGDDJDSOLFPJTB-UHFFFAOYSA-N 388.443 2.696 0 50 GFAA CCc1nnc([C@@H]2CN(C(=O)Nc3cnn(-c4ccccc4)c3C)CCO2)o1 276074400 UWPGKABWIPXHBY-INIZCTEOSA-N 382.424 2.732 0 50 GFAA CCOc1ccccc1CN1CCN(C(=O)c2ccnc3c2ncn3C)[C@H](C)C1 288257456 TXLQRKNOWVYXNP-MRXNPFEDSA-N 393.491 2.714 0 50 GFAA CN(C)CCN(C(=O)[C@@H]1CC1(Cl)Cl)c1ccc(Br)cn1 328589908 PGSXMQALLPAVBR-JTQLQIEISA-N 381.101 2.933 0 50 GFAA NC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1CCN(c2ccccc2F)C1 378132768 WXEFSQURADWXMQ-WMLDXEAASA-N 389.858 2.518 0 50 GFAA COc1cccc([C@H](O)CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)c1 378146508 WSFSQMIYQDUDOA-WOJBJXKFSA-N 382.460 2.540 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CC[C@@H](N(C)C)C3)csc2C1 426401608 CHQZUMSAPACPKD-OAHLLOKOSA-N 388.537 2.687 0 50 GFAA Cn1c(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc2c(=O)n3ccccc3nc21 464460452 KXIHFMZZEKNLKU-ZDUSSCGKSA-N 398.422 2.907 0 50 GFAA CC[C@@H](NC(=O)N1CCC(C(=O)NCc2ccccn2)CC1)c1cccnc1 534583400 RTINNQSDISHZCL-LJQANCHMSA-N 381.480 2.666 0 50 GFAA COc1cccc2ncnc(N3CCN(c4cccc5nc(O)[nH]c45)CC3)c12 895913981 FRIVURPBQJDJIQ-UHFFFAOYSA-N 376.420 2.547 0 50 GFAA Cc1ccc(OCCC(=O)NCc2nc(C)cc(O)n2)c(Br)c1 911864349 OFXURKOUQLSXIH-UHFFFAOYSA-N 380.242 2.647 0 50 GFAA COCCn1ncc2ccc(NC(=O)c3ccccc3SCC(N)=O)cc21 1264814001 RKMJDCKVMQTKJX-UHFFFAOYSA-N 384.461 2.512 0 50 GFAA CCOc1cc(C)c(Cl)cc1S(=O)(=O)N[C@H](C)c1nnc(N)s1 1506403636 YILOLEISIUIYIP-MRVPVSSYSA-N 376.891 2.520 0 50 GFAA O=C(c1ccc(COc2ccccc2)cc1)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1704280494 HZCRBEMPAWIYFX-DENIHFKCSA-N 389.455 2.731 0 50 GFAA COc1cccc(F)c1CN1CCCN(C(=O)[C@@H](C)N2CCCCC2)CC1 1775981977 FJGGICWDXGVBLT-QGZVFWFLSA-N 377.504 2.743 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3C[C@H](C(=O)O)C4(CCOCC4)C3)n[nH]2)cc1 1800411374 IODUFPGFHMGNMN-MRXNPFEDSA-N 383.448 2.593 0 50 GFAA C[C@@H](C(=O)N1CCC2(CCc3c(O)nc(C(C)(C)C)nc32)CC1)N1CCCC1 1857716299 GHJUSKJIIWGJTC-HNNXBMFYSA-N 386.540 2.770 0 50 GFAA CCn1ccnc1CN(C)C(=O)C1CCN(c2nc3nc(C)ccc3o2)CC1 1857717477 VBBPCONKHDZNFW-UHFFFAOYSA-N 382.468 2.623 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N[C@H]1C[C@H]2CO[C@@H](C(C)C)CN2C1 1857731608 MARZKCODVZJYKU-JENIJYKNSA-N 396.553 2.595 0 50 GFAA CCc1ccccc1-c1nccn1[C@@H]1C[C@H]2CO[C@@H](CC(=O)N(C)C)CN2C1 1857733714 VXCMJDBSKCPKPU-QYZOEREBSA-N 382.508 2.605 0 50 GFAA CN(CC1CCC1)C(=O)[C@H]1CC(=O)N(c2nnc(Cc3ccccc3)s2)C1 1857739273 HGCNBBDHVCVEOJ-INIZCTEOSA-N 384.505 2.740 0 50 GFAA CN1CCN(c2ncnc3ccc(-c4ccc([C@H]5CNC(=O)C5)cc4)cc23)CC1 1875249184 JXVKTSAQQKUSDU-LJQANCHMSA-N 387.487 2.652 0 50 GFAA Cc1[nH]c2ncnc(NC(=O)[C@@H](CCS(C)(=O)=O)c3ccccc3)c2c1C 1875265416 JAXSRJZIONAWLC-HNNXBMFYSA-N 386.477 2.732 0 50 GFAA O=C(NC[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)[C@@H]1NCCC12CC2 1875287798 ZYVWAGKGHHMXCR-PMACEKPBSA-N 375.472 2.642 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1cnnc(-c2ccccc2)c1 1875401853 UNJMOHFCYBOKIA-WMZOPIPTSA-N 390.447 2.591 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H]3COC[C@H]3Cc3ccncc3)cc2)n1 1940194813 UPLWDNPOYUEJFF-FGZHOGPDSA-N 390.487 2.931 0 50 GFAA Cc1ccc(C)c(OCCCN(C)C(=O)[C@H]2OCC(=O)N[C@@H]2c2ccccc2)c1 1940196884 BCFFRHZTHXTTBL-YADHBBJMSA-N 396.487 2.787 0 50 GFAA CC(C)[C@H](O)C(=O)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1940197212 ZNDZJTHNJXDXFN-KRWDZBQOSA-N 381.476 2.673 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N2CCc3ccccc3CC2)CC1=O 2100482519 FQAOTMGHCZQDAN-FQEVSTJZSA-N 378.472 2.671 0 50 GFAA O=C(NCc1ccc(F)cc1F)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356157558 LKBHSKNTZCKLIX-ZWWNWMABSA-N 397.425 2.913 0 50 GFAA O=C(CCOc1ccccc1)N1CCc2nc(Cc3ccccc3)nn2CC1 2356169330 PWXAELZCBWHTKA-UHFFFAOYSA-N 376.460 2.723 0 50 GFAA O=C(C[C@@H]1CS(=O)(=O)C[C@H]1CC(=O)Oc1ccccc1)Oc1ccccc1 4076203 GVCFLJQZKCZCLA-HZPDHXFCSA-N 388.441 2.639 0 50 GFAA Cc1cc(S(=O)(=O)N2CCCCC2)ccc1OCC(=O)NC1CCCC1 6729010 QAHSXQOLVGYPKY-UHFFFAOYSA-N 380.510 2.607 0 50 GFAA COc1ccc(N[C@@H]2CCCN(C(=O)CCCN3CCCC3=O)C2)cc1OC 11938012 UAZKXYYSVUJLKV-QGZVFWFLSA-N 389.496 2.509 0 50 GFAA O=C(NCC1CCOCC1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 11996969 ZWCMUWJDFXPSOZ-UHFFFAOYSA-N 386.492 2.623 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@H](NC(=O)CN2CCCC2=O)C1 12021052 NIUDXRUONYUMEC-QGZVFWFLSA-N 384.455 2.764 0 50 GFAA O=C(NCc1ccccc1F)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12387292 RZVKHWLZMNUBAW-SFHVURJKSA-N 387.499 2.555 0 50 GFAA CCCn1cc(C(=O)N[C@@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)c(C)n1 12438943 SPKBQYRUYAOFER-QGZVFWFLSA-N 388.899 2.828 0 50 GFAA O=C(Nc1nnc([C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)s1)[C@@H]1CCCO1 12862843 OBYZZRVZLAMFDR-GWCFXTLKSA-N 392.868 2.830 0 50 GFAA C/C=C(\C)CN1CCC2(CC1)C(=O)N(CCOC)C(=O)N2Cc1ccccc1 14534013 AHPGHEYYRIOIJK-JJPRUIFNSA-N 385.508 2.898 0 50 GFAA COC(=O)CC[C@H]1CN(Cc2c[nH]c3ccccc23)CC[C@H]1N1CCOCC1 14993873 NWHKNKFHAKGGTE-LAUBAEHRSA-N 385.508 2.644 0 50 GFAA CSc1cccc(CN2CCC[C@@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 15073279 BSONDTSBSVEYKE-LJQANCHMSA-N 394.504 2.987 0 50 GFAA CC[C@@H](C(=O)Nc1c(C)noc1C)n1ccc(C(=O)Nc2c(C)noc2C)n1 20617648 ZGAXVSDAUFJRMP-AWEZNQCLSA-N 386.412 2.935 0 50 GFAA CCCn1ncc(NC(=O)Cn2cc(-c3ncnc4scc(C)c34)cn2)n1 23431736 QRVOJNXMMMNRJV-UHFFFAOYSA-N 382.453 2.503 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@@H](CNC(=O)[C@H]2CCCN(C)C2)C3)n1 39393911 AKYRJSNWLNNYOH-ZWKOTPCHSA-N 380.492 2.522 0 50 GFAA COc1ccccc1-c1c2c(=O)n(Cc3ccncc3)ccc2nc2ncnn12 40398201 BTIDPXCOSOANNB-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA O=C(C(=O)N1CCC[C@@H](N2CCN(c3ccc(F)cc3)CC2)C1)c1ccccc1 55182458 IRQJJAZSGOSZGF-OAQYLSRUSA-N 395.478 2.822 0 50 GFAA CC1=C(C(=O)N(C)Cc2csc(C(C)C)n2)[C@@H](c2cccnc2)NC(=O)N1 67654930 VBODBLHJWSKZJL-MRXNPFEDSA-N 385.493 2.948 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCCc2c[nH]cn2)Cc2ccccc2C1 72172473 BFCPTAJYORTSIQ-UHFFFAOYSA-N 388.515 2.781 0 50 GFAA C[C@H](CCC(=O)N1CCC(c2nccn2CC2CCC2)CC1)N1CCOCC1 91830710 WSQCFAWNMHLQJK-GOSISDBHSA-N 388.556 2.890 0 50 GFAA O=C(C1CC1)N1CCC[C@H](Cn2cc(-c3ccc(-n4cccn4)cc3)nn2)C1 91943713 ZKRUHLUVADWSTA-INIZCTEOSA-N 376.464 2.779 0 50 GFAA O=C1CC[C@@]2(CCCN(C3Cc4ccccc4C3)C2)CN1CCc1c[nH]cn1 92019854 IGQPGICBQXPKCB-HSZRJFAPSA-N 378.520 2.824 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95501067 NWUGYFMGWMNUBO-ZDUSSCGKSA-N 382.493 2.620 0 50 GFAA COc1cc(CN(C)Cc2cccnc2)ccc1OC[C@H](O)CN1CCCC1 95529996 CIVQLGMWMSDFJT-HXUWFJFHSA-N 385.508 2.558 0 50 GFAA CCC(=O)Nc1cc(NC(=O)N2CCC[C@H](CN3CCOCC3)C2)ccc1C 97713706 VTARIMREACVTBO-QGZVFWFLSA-N 388.512 2.920 0 50 GFAA CN(c1cccnn1)C1CCN(C(=O)c2csc(-c3ccccn3)n2)CC1 109640327 UXWWYGNHOVCNEY-UHFFFAOYSA-N 380.477 2.736 0 50 GFAA O=C(CN1CCN(c2ncnc3sccc23)CC1)Nc1ccc(F)cc1F 127546347 CQBWABBMPQCDJQ-UHFFFAOYSA-N 389.431 2.730 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cc(F)cc2nccnc12 129943988 GBXMMXPUQBVORT-KRWDZBQOSA-N 378.407 2.690 0 50 GFAA CCC1(CO)CCN(C(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)CC1 130138606 ACXKVLKQBAHHEG-ZDUSSCGKSA-N 382.863 2.843 0 50 GFAA C[C@@](O)(CNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1 131043857 WZAFTGQCPCSTHK-WZONZLPQSA-N 398.478 2.631 0 50 GFAA Cc1ccc(NC(=O)c2ccc3c(c2)[nH]c(=O)n3CC(F)(F)F)cc1C(N)=O 161687539 UMSJKJLZFCAGOW-UHFFFAOYSA-N 392.337 2.552 0 50 GFAA COc1ccc(-c2cc(N3CCC[C@H](NC(=O)c4ccccn4)C3)[nH]n2)cc1 169753882 PCLJAQIXKBRZLN-INIZCTEOSA-N 377.448 2.879 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cc(=O)n4cccc(C)c4n3)C2)nc1 174598772 JEUNQJMOONZLPN-KRWDZBQOSA-N 391.475 2.557 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCC(Cc3nccn3C)CC2)[C@@H]1c1ccccc1 178621485 ZQPYSVKSYUJQOO-UGKGYDQZSA-N 394.519 2.811 0 50 GFAA O=C([C@H](Cc1ccccc1)Nc1ncnc2ccc(F)cc12)N1CCOCC1 185511098 RPVMIZBQNDMEQH-IBGZPJMESA-N 380.423 2.651 0 50 GFAA CC[C@@H](C)c1ccccc1OCC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 186647157 YBYIHXVYPNEJGI-SJORKVTESA-N 376.497 2.976 0 50 GFAA CN(C)Cc1ccc(CSCCNC(=O)[C@H]2COc3ccccc3O2)o1 215488519 XHPNBRDPEAINCK-GOSISDBHSA-N 376.478 2.531 0 50 GFAA O=C(O)CC[C@@]1(CCC(=O)NCc2ccc(Cl)c(Cl)c2)CCC(=O)N1 218199857 RTKZHQYUBCGTFD-QGZVFWFLSA-N 387.263 2.903 0 50 GFAA CCOc1cccc(CN2CC[C@H]3[C@H](CCC(=O)N3CCc3cnc[nH]3)C2)c1 219365717 PVEITTVUBUJPPQ-NQIIRXRSSA-N 382.508 2.864 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)s1 253378390 CMIXUTARBJITRU-DAYGRLMNSA-N 379.503 2.782 0 50 GFAA Cc1cc(S(=O)(=O)NC[C@H]2CCc3nccn3C2)sc1Br 275358235 VDHJQCBQSRIQAC-SNVBAGLBSA-N 390.328 2.556 0 50 GFAA Cn1cc(NC(=O)CN2CCN(c3ccccn3)CC2)c(C2CCCCC2)n1 295844993 RTHHXOKNZBOERC-UHFFFAOYSA-N 382.512 2.624 0 50 GFAA Cc1cccc(N2C[C@H](C(=O)N3CCC(c4ccncn4)CC3)CC2=O)c1C 298360989 OZCBWTHQXHMOLC-GOSISDBHSA-N 378.476 2.853 0 50 GFAA O=C(NC1CCN(Cc2ccncc2)CC1)c1ccc(Cn2ccnc2)cc1 298908805 CFDJUZWDJXPDIK-UHFFFAOYSA-N 375.476 2.721 0 50 GFAA C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N(CC(=O)O)C1CCOCC1 299747018 BVSFNULQCSVVPH-JTQLQIEISA-N 376.236 2.853 0 50 GFAA O=C(NC[C@H]1Cc2cc(F)cc(-c3ncccn3)c2O1)c1onc2c1CCCC2 426487834 CXAZJEFCGYQPOI-CQSZACIVSA-N 394.406 2.883 0 50 GFAA CN1C[C@]2(CCCN(C(=O)NCc3nc(-c4ccccc4)cs3)C2)OC1=O 426719964 OUQBUPYHWWDSEM-IBGZPJMESA-N 386.477 2.936 0 50 GFAA C[C@@H](NC(=O)c1cnn(C)c1Cc1ccccc1)c1ccc2c(c1)NC(=O)CO2 444844148 BVZIKEIMZLGQPO-CQSZACIVSA-N 390.443 2.833 0 50 GFAA Cc1[nH]nc(-c2ccc(S(=O)(=O)NCc3cc(CC(C)C)no3)o2)c1C 821483384 RMTKCFQNJBVHJX-UHFFFAOYSA-N 378.454 2.952 0 50 GFAA Cc1ccccc1C(=O)N1NC(=O)C[C@@]12CCN(Cc1c(F)cccc1F)C2 888103328 CPDMAXPBMZAMHG-OAQYLSRUSA-N 385.414 2.795 0 50 GFAA O=C(c1cccc(N2CCNC2=O)c1)N1CCC2(CC1)OCCc1ccsc12 1323550849 HOQRCLHNLOIRGM-UHFFFAOYSA-N 397.500 2.982 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)CN(C)C3CCCC3)CC2)cc(C)c1O 1529189134 ICTXXYGXPGUWNM-UHFFFAOYSA-N 387.524 2.558 0 50 GFAA CCc1cc(N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)nc(N(C)C)n1 1704337024 QKDZXJUSLIWAQG-UZLBHIALSA-N 377.492 2.693 0 50 GFAA CS[C@H](C)CC(=O)N1CC[C@]2(NC(=O)Cc3ccn(C(C)C)n3)CCC[C@@H]12 1775991344 KYGMBCHJDWITNY-WRWLIDTKSA-N 392.569 2.788 0 50 GFAA COC(=O)[C@]1(c2ccccc2)CCN(c2cc(C(N)=O)c3ccccc3n2)C1 1857676860 UPIULWLERLPCTI-JOCHJYFZSA-N 375.428 2.655 0 50 GFAA O=C(NCCCO)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1ccncc1 1857697493 WLRUHHLXLXKUMO-QZNHQXDQSA-N 379.504 2.546 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 1857737602 UNSHAEYXBGMVMI-LBPRGKRZSA-N 389.477 2.550 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2ccccc2C(=O)OC)C[C@H](C2CC2)O1 1875243467 IBUJRINRZFVESI-NVXWUHKLSA-N 381.494 2.832 0 50 GFAA Cn1c(NS(=O)(=O)c2ccc3c(c2)N(C(=O)C2CC2)CC3)nc2ccccc21 1875304383 JDKDWOSVJCQLAM-UHFFFAOYSA-N 396.472 2.673 0 50 GFAA CC(C)Cc1ccc2c(N)c(C(=O)N3CC[C@H]([C@H]4CNC(=O)C4)C3)sc2n1 1875313467 RJIUSSLIEFYQTC-QWHCGFSZSA-N 386.521 2.675 0 50 GFAA O=C([C@H]1CNc2ccnn2C1)N1CCc2[nH]nc(-c3ccc(Cl)cc3)c2C1 1875323799 UNRZRJRVVBVATF-ZDUSSCGKSA-N 382.855 2.553 0 50 GFAA O=C(c1ccncc1F)N1CC[C@H](O)[C@](CCCc2ccccc2)(C(=O)O)C1 1940195264 RLYRNZOAWHVUOU-GHTZIAJQSA-N 386.423 2.521 0 50 GFAA Cn1nccc1-c1ccccc1CN[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 2325786068 ZUIAARAYLMWWIN-LXGCGDOSSA-N 385.899 2.866 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(O)cc2)ccc1OC 1136345 POMUGIRBVAYUQC-UHFFFAOYSA-N 378.450 2.684 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 1137325 VTUBCYOVSZDDSV-UHFFFAOYSA-N 386.470 2.703 0 50 GFAA CCN1C(=O)[C@H](CC(=O)Nc2ccc(F)cc2)N(Cc2ccco2)C1=S 2728303 UYKOULSNMOLPPC-HNNXBMFYSA-N 375.425 2.765 0 50 GFAA O=C(NCc1ccccn1)[C@H]1CCCN(C2CCN(Cc3ccoc3)CC2)C1 11820675 IJXNXNFNNGRLQF-IBGZPJMESA-N 382.508 2.667 0 50 GFAA O=C(CCN1CCCO1)N1CC[C@]2(CCCN(Cc3cccc(F)c3F)C2)C1 11842689 HWSWJCAIINOADS-NRFANRHFSA-N 393.478 2.807 0 50 GFAA C[C@H](NC(=O)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl)c1ccccc1 12003407 SBSNPNPYLKGMGI-LBPRGKRZSA-N 392.864 2.898 0 50 GFAA COc1ccc(CN2C(=O)N(C)C3(CCN(Cc4ccoc4)CC3)C2=O)cc1 14539516 YXNZYYJVHBXQKJ-UHFFFAOYSA-N 383.448 2.717 0 50 GFAA CCN(CC)C(=O)c1cn(C2CCN(C(=O)/C=C\c3cccc(F)c3)CC2)nn1 14994014 LGVKEBKLYMJPHM-HJWRWDBZSA-N 399.470 2.776 0 50 GFAA O=C(CSc1ccccn1)NC[C@@H]1Cc2c(F)ccc(-c3ncccn3)c2O1 20776406 WAFPXHYOHOTAGG-ZDUSSCGKSA-N 396.447 2.890 0 50 GFAA O=C(NCc1ccccc1F)N1CCC(n2cc(CN3CCCC3)nn2)CC1 23153580 JSPVLKINTWFZPJ-UHFFFAOYSA-N 386.475 2.560 0 50 GFAA COC[C@H](C)N1CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC1 39518633 OOWSXVHEVLEYHK-HNNXBMFYSA-N 397.947 2.510 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(Cn3nc(C)c(C)c3C)[nH]c2C1 65371663 ZVGWVKKDZNKTDQ-OAHLLOKOSA-N 379.464 2.658 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)n1 67629807 JACHVXALLOKGNT-UHFFFAOYSA-N 377.851 2.972 0 50 GFAA O=C(N1CCc2[nH]nc(-c3ccc(F)c(F)c3)c2C1)C1(Cn2cccn2)CC1 67956278 DBIMADSBXUBUOQ-UHFFFAOYSA-N 383.402 2.917 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)CCCc4ccccc4)CC3)ncn2)n1 72437663 XBLZXXWKERXCKE-UHFFFAOYSA-N 390.491 2.642 0 50 GFAA Cc1ncccc1Oc1ncnc(N2C[C@@H]3CCN(Cc4c[nH]cn4)[C@@H]3C2)c1C 82115915 XNRUWHBBAPBUOG-FUHWJXTLSA-N 391.479 2.715 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)c(O)c1 91476038 HOYZXTBPVPADBF-KRWDZBQOSA-N 386.492 2.724 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCN(Cc2ccncc2)CC1 95352486 IFEIJURTHVXJGM-SFHVURJKSA-N 375.856 2.687 0 50 GFAA Cc1cnc(C(=O)N2C[C@@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95352884 CUAIHLWXVRXSMU-DFQSSKMNSA-N 384.430 2.766 0 50 GFAA COc1ccc2c(c1)OC[C@]1(C(=O)O)CN(C(=O)Cc3ccc(F)c(C)c3)C[C@H]21 95382121 QOFLIHCSBMOGNA-VGOFRKELSA-N 399.418 2.775 0 50 GFAA Cc1nn(C)c2nc(N(Cc3ccccc3)[C@H]3CCS(=O)(=O)C3)sc12 95497975 UTGVVMINVYJJSN-AWEZNQCLSA-N 376.507 2.532 0 50 GFAA COc1cc(OC)cc(C(=O)NC[C@@H]2CCCN(C(=O)c3cc[nH]c3C)C2)c1 95505684 CNBDKWRAROIBKB-HNNXBMFYSA-N 385.464 2.623 0 50 GFAA CN1CC[C@H](N(C)C(=O)Nc2ccc(C(=O)NCCc3ccccc3)cc2)C1 95512897 YAAWCXNDHXPZFC-FQEVSTJZSA-N 380.492 2.827 0 50 GFAA CCSc1ccc(NC(=O)N2CCC3(CC2)C(=O)N(C)C(=O)N3C)cc1 97744836 KUFFVOXIKSLYPK-UHFFFAOYSA-N 376.482 2.689 0 50 GFAA CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@H](N3CCCC3)C2)c1 127935006 NJARJGOTZTZYBS-PXNSSMCTSA-N 386.540 2.985 0 50 GFAA O=C([C@H]1OCCc2ccccc21)N1CCN(c2ncnc3sccc23)CC1 155416271 GBSCEJYYFHJINI-KRWDZBQOSA-N 380.473 2.654 0 50 GFAA O=C(COc1ccc2c(c1)CCCC2)N1CCN(C(=O)c2ccccc2O)CC1 157652630 IKWDFAOWKXWOAG-UHFFFAOYSA-N 394.471 2.634 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)C4(c5ccccc5)CC4)C3)nn2)n1 169778151 DJTKCAKECGTDRN-INIZCTEOSA-N 392.463 2.957 0 50 GFAA CCNC(=O)C1(NCc2csc(CNC(=O)c3ccccc3)n2)CCCC1 170605291 NCSHWNJAWOFALM-UHFFFAOYSA-N 386.521 2.612 0 50 GFAA Cc1nc(N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2=O)c2cnn(C)c2n1 185782865 YFKRHUNQFIQIJP-CYBMUJFWSA-N 390.369 2.908 0 50 GFAA Cc1ccc(OC2CCN(C(=O)c3ccccc3N3CCOCC3)CC2)nc1 185895555 WOBJIHGRUMGLQO-UHFFFAOYSA-N 381.476 2.910 0 50 GFAA Cn1cnc(-c2ccc(NC(=O)N3C[C@@H](CO)[C@H](c4ccsc4)C3)cc2)n1 189327546 VFWWIPZKKVSALT-RDJZCZTQSA-N 383.477 2.783 0 50 GFAA CCOc1ccc(S(=O)(=O)N(c2ccccc2)C2CCN(C)CC2)cn1 191945425 FBCRAYJRRUGFEO-UHFFFAOYSA-N 375.494 2.770 0 50 GFAA CS(=O)(=O)Nc1cc(C(=O)Nc2ccc(N3CCC3=O)cc2)ccc1Cl 225611710 OMLLLMCOTLGRCV-UHFFFAOYSA-N 393.852 2.701 0 50 GFAA Cc1csc(-c2cccc(S(=O)(=O)N3C[C@@H]4CCC[C@H](C3)C4O)c2)n1 225708874 JZNJXZVXSANTQO-FKEKPDDDSA-N 378.519 2.900 0 50 GFAA C[C@@H]1CCCN(C(=O)C(=O)O[C@H](C)C(=O)Nc2ccc(Br)cc2)C1 225840747 XOASAVYKWWHDFQ-VXGBXAGGSA-N 397.269 2.578 0 50 GFAA COc1ccc(OC)c(N2C[C@H](C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@@H]43)CC2=O)c1 245225403 UNOBQMYAIVCNDI-DYRALMAWSA-N 398.503 2.998 0 50 GFAA COCCN(C)c1ccc(CNc2ccc(-c3nnnn3C3CC3)cc2)cn1 252494135 NMBGMRWBIPXCPV-UHFFFAOYSA-N 379.468 2.765 0 50 GFAA C[C@H]1C[C@H](Nc2cnc(N3CCOCC3)c(Br)c2)[C@H](C)CN1C 253430849 MBEQOAGNOIHSSM-WWGRRREGSA-N 383.334 2.821 0 50 GFAA COC[C@H]1CN(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)CCO1 266390083 OJXLJOCJIJLISY-GOSISDBHSA-N 387.411 2.957 0 50 GFAA C[C@@H]1CN(C(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CC(=O)N1 296298257 RUJXENJOKYNNPJ-CQSZACIVSA-N 385.489 2.670 0 50 GFAA Cc1nonc1CNCc1cc2ccc(F)cc2n(CCN2CCCCC2)c1=O 299785750 NTEHZYSBYBAESS-UHFFFAOYSA-N 399.470 2.608 0 50 GFAA Cc1ccc2c(c1)CC[C@@H](C(=O)Nc1cccnc1N1CCC(CO)CC1)O2 366859303 SVOCXTOJZBPXNT-FQEVSTJZSA-N 381.476 2.931 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N1CCC(S(=O)(=O)N2CCCC2)CC1 374434213 LXSSPPFLJWLMQZ-UHFFFAOYSA-N 389.521 2.517 0 50 GFAA CCNC(=O)CCN1CC[C@]2(CCCN(Cc3cc(OC)ccc3F)C2)C1 426488532 ZTACAQDORXEJKO-OAQYLSRUSA-N 377.504 2.648 0 50 GFAA Cc1cc(C)n(CCNC(=O)N2CCC(O)(c3ccc(Cl)cc3)CC2)n1 426519194 FTNLHIJBDVZDBH-UHFFFAOYSA-N 376.888 2.847 0 50 GFAA COc1cccc(OC[C@H]2CCCN(C(=O)NCCCN3CCCC3)C2)c1 426627695 LXLWJVTVALRHOL-SFHVURJKSA-N 375.513 2.982 0 50 GFAA Cc1cc(C(=O)N2CCCC[C@@H]2c2cccc(F)c2)c2c(O)nc(=O)n(C)c2n1 426662379 VOQDZKXWVFZKQX-MRXNPFEDSA-N 396.422 2.849 0 50 GFAA COc1cccc(CN2CC[C@]3(OC)CC[C@@H](NC(=O)CSC)C[C@H]23)c1 534581474 OJDCGQWQKGWLOV-IMFGXOCKSA-N 378.538 2.686 0 50 GFAA CC(C)NC(=O)c1ccc(NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)cc1 821809872 ARBRXHVCXOJKEI-SFHVURJKSA-N 379.460 2.779 0 50 GFAA Cn1ccnc1-c1ccccc1C(=O)N[C@@H]1CCCN(C(=O)c2ccco2)C1 828184271 UPXONBOFYCTDQI-OAHLLOKOSA-N 378.432 2.715 0 50 GFAA COc1cc2c(cc1OC)CN(CC(=O)N1CCC[C@@]3(C1)CC3(F)F)CC2 846582658 ZEYMDKWBFGZXLN-IBGZPJMESA-N 380.435 2.710 0 50 GFAA Oc1ncnc2cc(-c3noc([C@@H]4CCc5nnn(C6CCC6)c5C4)n3)ccc12 952892546 DVYAHDXGKPNJOH-GFCCVEGCSA-N 389.419 2.974 0 50 GFAA CN1CCC[C@H](c2nc(-c3cn(C)c4ccccc34)n(-c3cnn(C)c3)n2)C1 1772815958 AUGXRRGTSAKJOB-HNNXBMFYSA-N 375.480 2.969 0 50 GFAA Cc1nc[nH]c1CN1CCC2(CC1)OCCc1sc(C(=O)NC(C)C)cc12 1857667952 XFPNLSKXOFTUTB-UHFFFAOYSA-N 388.537 2.982 0 50 GFAA O=C(NCc1csc(Cc2ccccc2)n1)[C@@H]1CC(=O)N(c2nccs2)C1 1857674175 VSXDYOHAXUKZEH-CQSZACIVSA-N 398.513 2.860 0 50 GFAA CCc1c(C)cc(C(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)c(=O)n1C 1857676140 KIGCHAHTIYNQOD-VNZMSGEBSA-N 394.515 2.854 0 50 GFAA O=C(NC1CCC1)c1cc2c(s1)CCOC21CCN(c2ncccn2)CC1 1857685504 WGXABGMGGHVTFV-UHFFFAOYSA-N 384.505 2.889 0 50 GFAA CCNC(=O)c1ccc(N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)nc1 1857697818 NOISJPTULQYLOH-JOCHJYFZSA-N 393.491 2.689 0 50 GFAA O=C(C[C@H]1CCCN(c2nc3ncccc3o2)C1)N1CCC(c2ncc[nH]2)CC1 1857731763 OHLWHKQYALGYOO-OAHLLOKOSA-N 394.479 2.959 0 50 GFAA O=C([C@H]1CCCO1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857733850 BLGLRASVGDUJKP-QGZVFWFLSA-N 379.460 2.835 0 50 GFAA O=C(c1c(O)cccc1O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857739357 JFMAYXFEWSZIPX-VQIMIIECSA-N 383.444 2.985 0 50 GFAA Cc1cc(=O)cc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)[nH]1 1857740149 AUBHZKVZQTZKDL-UYAOXDASSA-N 382.460 2.571 0 50 GFAA Cc1ccc(-c2cc(C(=O)N[C@H]3CC34CCN(C(=O)c3ccoc3)CC4)n[nH]2)o1 1875341929 ORDAEQGRWXXBIC-SFHVURJKSA-N 394.431 2.996 0 50 GFAA CCc1nc([C@@H]2CN(C(=O)C3(c4ccccc4C)CCC3)Cc3c[nH]nc32)n[nH]1 1875393759 RROLSFFMFQKTLU-MRXNPFEDSA-N 390.491 2.995 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3Cc2cnc(N3CCCC3)s2)no1 2100545007 NVRHYABPJBXODD-IRXDYDNUSA-N 387.509 2.529 0 50 GFAA COC(=O)C1=CN(C[C@H]2CCCO2)C=C(C(=O)OC)C1c1ccc(F)cc1 909473 ASQCUFZOVOTEKQ-OAHLLOKOSA-N 375.396 2.518 0 50 GFAA CCOc1ccc(NC(=S)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 2853382 SIDBPSQQJQZIGO-UHFFFAOYSA-N 385.898 2.919 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)C(=O)c1cn(Cc2ccccc2F)nn1 11934822 WBGAUDSPHHGVOL-UHFFFAOYSA-N 390.422 2.923 0 50 GFAA O=C(c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)N1CCc2ccccc21 12003482 IFGVVEZBAZCINU-UHFFFAOYSA-N 390.848 2.609 0 50 GFAA Cc1cccc(CN[C@@H]2CCc3c(sc4ncn(CCN(C)C)c(=O)c34)C2)c1 12128236 KHRVTKFUHFOXTM-QGZVFWFLSA-N 396.560 2.975 0 50 GFAA CN1C(C(=O)N2CCCc3ccccc32)=CC(c2ccc(F)cc2)=NS1(=O)=O 15673398 GCVPDVTZTVLBGO-UHFFFAOYSA-N 399.447 2.668 0 50 GFAA O=C(NC[C@H]1CCCO1)C(=O)Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1 17028882 HZPWEALSZGYALZ-NSOUWEPUSA-N 389.521 2.845 0 50 GFAA Cn1c(SCc2cc(=O)n3ccsc3n2)nnc1-c1ccc2c(c1)OCO2 17081687 SCWMCFHLNUAGNF-UHFFFAOYSA-N 399.457 2.573 0 50 GFAA OCC[C@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1CCCc1ccccc1 20600137 AIPZATLZPMRPKD-QFIPXVFZSA-N 396.531 2.959 0 50 GFAA COc1ccccc1[C@@H]([C@H](O)C(=O)c1c[nH]c2ccccc12)N1CCN(C)CC1 23119754 TVHUIRWEOFXBRT-GMAHTHKFSA-N 393.487 2.709 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(F)cc3F)CC2)cc(-n2ccnc2)n1 67622865 NNTDQWYVZFGWLQ-UHFFFAOYSA-N 399.405 2.603 0 50 GFAA Nc1nc2c(c(-c3ccccc3)n1)CN(C(=O)c1cc(=O)c3ccccc3o1)C2 67965119 DWPIQLQWMOZEJD-UHFFFAOYSA-N 384.395 2.988 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCc2cnn(C)c2)Cc2ccccc2C1 72139097 NKYIOJVOMITBMG-UHFFFAOYSA-N 388.515 2.748 0 50 GFAA Cc1ccc(Oc2ccc(C(=O)N3CCN(c4ccc(C)nn4)CC3)cc2)nn1 72437216 WQMFMOYOJKFNKY-UHFFFAOYSA-N 390.447 2.638 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)c3cccnc3OC)CC2)OC1=O 77436993 QXEIIOFYHALJCI-UHFFFAOYSA-N 375.469 2.953 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4cccnc4)CC3)CC2=O)c1 77540057 ZWSBGJOEWSKOME-UHFFFAOYSA-N 379.460 2.745 0 50 GFAA C[C@@H](C1CCN(C(=O)c2ccc(N3CCCC3)cc2)CC1)N1CCN(C)CC1 82120225 ULBLEVAMUJESPA-IBGZPJMESA-N 384.568 2.775 0 50 GFAA Cc1ccn(CCC(=O)N2CCC[C@H](c3nccn3Cc3cccnc3)C2)n1 95356650 NCJXJBVFJVGYHY-IBGZPJMESA-N 378.480 2.628 0 50 GFAA CN(Cc1nc(-c2ccncc2)no1)C(=O)c1cccc([C@@H]2CCCNC2)c1 95391690 IBFSFLUMQGEIAM-GOSISDBHSA-N 377.448 2.871 0 50 GFAA COc1ccc(F)c(CN2C[C@@H]3CC[C@H](C2)N(Cc2cscn2)C3=O)c1 95503997 NEAVYGDGMQERJF-XJKSGUPXSA-N 375.469 2.914 0 50 GFAA O=C(CCC1CCN(C(=O)C2CC2)CC1)N[C@@H]1CCN(Cc2ccccc2)C1 95513241 FQGWSXDQBPREQK-OAQYLSRUSA-N 383.536 2.806 0 50 GFAA Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccco3)C2)cc1N1CCNC1=O 96133446 KGPAZGDHSKMUFW-QGZVFWFLSA-N 396.491 2.760 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)Nn3cnc4ccccc43)CC2)oc1C 111900420 VTTQRYXEQAQGJI-UHFFFAOYSA-N 382.468 2.806 0 50 GFAA O=C(N[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1cnc2sccn2c1=O 121728543 JNCZFWYULSETTL-ZYHUDNBSSA-N 395.362 2.941 0 50 GFAA COC(=O)c1ncsc1S(=O)(=O)N[C@H]1C[C@H]2CCCc3cccc1c32 161965540 RHPMRRLJDGHEIL-YPMHNXCESA-N 378.475 2.773 0 50 GFAA COc1ccccc1OCC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 169844621 LIUJYPFNUXGNPD-UHFFFAOYSA-N 386.423 2.588 0 50 GFAA Cc1ccc(-c2nnc3n2CCCCC3)cc1NS(=O)(=O)C[C@H]1CCCO1 172365141 MTSAUAXZKBOGHB-MRXNPFEDSA-N 390.509 2.901 0 50 GFAA CCn1cc([C@H]2CN(Cc3nc(-c4ccc(OC)cc4OC)no3)CCO2)cn1 190800694 PXILYVMQXHBWBK-GOSISDBHSA-N 399.451 2.544 0 50 GFAA C[C@H]1CN(C(=O)C2CCN(c3ccc(Cl)cn3)CC2)C[C@@]2(CCCOC2)O1 225470613 DLFRIYQHIZEOFU-MGPUTAFESA-N 393.915 2.748 0 50 GFAA Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCNC[C@@H]1c1cccc(F)c1 261688289 CFNWVHICPMSNHP-MRXNPFEDSA-N 385.468 2.778 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)c2cccc(Cl)c2Cl)C1 275805051 VAGLMDCNOCLSCY-LLVKDONJSA-N 380.279 2.712 0 50 GFAA CCCS(=O)(=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)cc1 299748659 HVDMAHDPLVHWPV-UAGQMJEPSA-N 379.478 2.728 0 50 GFAA O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCC(Cc2cc(F)ccc2F)CC1 456840003 OZAISCYXJTXODR-UHFFFAOYSA-N 399.397 2.590 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2cccc(O)c2)C1)c1ccc(SCCO)cc1 670456650 ZZSPBWCITXGWHJ-GOSISDBHSA-N 386.517 2.871 0 50 GFAA CCC(=O)N1CCOC2(CCN(C(=O)c3cnoc3-c3ccccc3)CC2)C1 822533877 FKJWXIMUZLVHFM-UHFFFAOYSA-N 383.448 2.585 0 50 GFAA NCc1cc(NC(=O)N[C@@H]2CCCN3CCSC[C@@H]23)cc(C(F)(F)F)c1 926163451 XGPPFMLAGARUNA-CABCVRRESA-N 388.459 2.865 0 50 GFAA C[C@@H]1CCc2[nH]nc(C(=O)NC3CCN(C(=O)c4ccccc4F)CC3)c2C1 1333085332 JEHLGDYGAYDQHE-CYBMUJFWSA-N 384.455 2.708 0 50 GFAA CN1CC[C@H](C(=O)N[C@H]2C[C@@]3(CCNC3)Oc3ccccc32)c2ccccc21 1342237959 YIQGYEHNMMSYKY-WCAVRKLYSA-N 377.488 2.982 0 50 GFAA C[C@@H](C(=O)N(Cc1cocn1)Cc1cocn1)c1nnc(O)c2ccccc12 1506419410 BQPSMIRSKHXJDE-GFCCVEGCSA-N 379.376 2.644 0 50 GFAA COc1cc2nc(N[C@@H]3CCCN(C(=O)c4ccco4)C3)nc(N)c2cc1OC 1529139796 UUOODZDXDLAMJA-GFCCVEGCSA-N 397.435 2.539 0 50 GFAA Cc1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)c3ccc4nccnc4c3)C1)CC2 1857690405 AYXSABZHQAEDDV-NRFANRHFSA-N 375.432 2.554 0 50 GFAA COCC1(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)CCC1 1857719327 KAUDDOGYJKMALQ-FGTMMUONSA-N 378.900 2.787 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC(c5ncc[nH]5)CC4)CC3)nc2n1 1857722869 QTBNZQFOEOTOOD-UHFFFAOYSA-N 394.479 2.877 0 50 GFAA COc1cc(Cl)cc2cc(C(=O)N3C[C@H](O)[C@H](Cc4cc(C)[nH]n4)C3)oc12 1857726114 XHLMDZICPNSXCE-DOMZBBRYSA-N 389.839 2.802 0 50 GFAA CO[C@@H]1CC[C@H](C(=O)NCC2CC2)C[C@H]1NC(=O)CCCc1ccc(F)cc1 1875245891 CINWCLRTQGUXBR-DFQSSKMNSA-N 390.499 2.975 0 50 GFAA O=C(NCC(=O)N1CCOC[C@H]1Cc1c[nH]c2ccccc12)c1ccccc1F 1875264897 AIYWTLAUJHQGFY-MRXNPFEDSA-N 395.434 2.507 0 50 GFAA Cc1cccc(N2CCC[C@H](NC(=O)c3ccnc(N4CCCCC4)n3)C2=O)c1 1875319087 YSRKYBPDOBFUKK-IBGZPJMESA-N 393.491 2.701 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](Cc1ccnnc1)C(=O)N1CC[C@H]1Cc1ccccc1 2325763840 ILQCZLAWQOFPIG-OALUTQOASA-N 396.491 2.756 0 50 GFAA C[C@H](N)Cn1cc(CNC(=O)c2csc3c(Br)cccc23)nn1 2325788330 YVNNRVCWYKMCCH-VIFPVBQESA-N 394.298 2.533 0 50 GFAA COC(=O)Cc1ccc(Br)c(S(=O)(=O)Nc2ccccc2)c1 2325809466 SPXSHHDTAFLBRO-UHFFFAOYSA-N 384.251 2.965 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC[C@]23CCCN(Cc2ccccc2)C3=O)n1 2356147736 MIFAEQWOLPHIIK-FQEVSTJZSA-N 386.883 2.871 0 50 GFAA Cc1cc(N2CC[C@](O)(c3ccccc3)[C@@H](O)C2)nc(Nc2ccc(O)cc2)n1 2356153037 OGMWUCUWZXBKIW-UGKGYDQZSA-N 392.459 2.693 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCO[C@@H](c2ccccn2)C1 2356154539 ZNJSVNIRAVZXSX-QGZVFWFLSA-N 399.516 2.508 0 50 GFAA CCn1ncc(S(=O)(=O)Nc2ccn(Cc3cccc(Cl)c3)n2)c1C 2805057 YWMMYEDTIAUVEX-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA COc1ccc(CN2CCNC(=O)[C@H]2CC(=O)NC2CCCCCC2)cc1C 11933419 OJTCALGJHQDKHD-LJQANCHMSA-N 387.524 2.533 0 50 GFAA CC1(C)CS(=O)(=O)N(c2ccc(Cl)c(C(=O)NCc3ccco3)c2)C1=O 12003574 IXDDGKKHPQQIDP-UHFFFAOYSA-N 396.852 2.566 0 50 GFAA CCCn1c(C)c(CC(=O)N(C)CC(=O)OCC)c2c1CC(C)(C)CC2=O 12469769 YIRRXEYNVHDTIB-UHFFFAOYSA-N 376.497 2.926 0 50 GFAA CC(C)CCN[C@@H]1CCc2c(c(C(=O)N3CCOCC3)nn2CC(C)C)C1 14752375 UVCMJWDQORLHOU-QGZVFWFLSA-N 376.545 2.505 0 50 GFAA COC(=O)[C@@H](C)NC(=O)Cc1c2c(n(Cc3ccccc3)c1C)CCCC2=O 14964103 IWFVBBMBILABDZ-CQSZACIVSA-N 382.460 2.584 0 50 GFAA CC(=O)c1cccc(CN2CCC(n3nccc3NC(=O)[C@@H]3CCOC3)CC2)c1 19851019 LJNCMOILJSCOKS-LJQANCHMSA-N 396.491 2.898 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN([C@H]2CCCC[C@@H]2OC)CC1 20228038 DDSPTLXNWPWAQQ-ROUUACIJSA-N 378.513 2.788 0 50 GFAA COC[C@H](c1ccccn1)N(C)C(=O)CCc1nc(-c2ccccc2OC)no1 55108619 VEWMUKJCEYCOGP-QGZVFWFLSA-N 396.447 2.919 0 50 GFAA CCN(C(C)=O)[C@@H]1CCN(Cc2ccc(C(=O)Nc3c(C)noc3C)cc2)C1 65395083 HUBSPXXCAUBWDH-LJQANCHMSA-N 384.480 2.986 0 50 GFAA CC(C)c1cc(C2CCN(C(=O)c3ccc(Cn4cnnn4)cc3)CC2)[nH]n1 67695184 FFUGLVWXQRACCH-UHFFFAOYSA-N 379.468 2.588 0 50 GFAA CCC[C@H](C(=O)N1CCc2c(nc(-c3cccnc3)[nH]c2=O)C1)n1cccc1 71756838 NCBOKNUAOJVZSB-GOSISDBHSA-N 377.448 2.560 0 50 GFAA CN(C)CCCNC(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71758829 QLKNLRRBAKJXET-QHCPKHFHSA-N 379.504 2.602 0 50 GFAA CCCCNC(=O)Cn1nc(-c2ccccc2)n(CCc2ccccc2)c1=O 77554521 GVIOFPKPLOCNCW-UHFFFAOYSA-N 378.476 2.871 0 50 GFAA Cc1ccc(N2C[C@@H](Cc3ccccc3)N(C(=O)c3ccnn3C)CC2=O)cc1 82120483 MKGHMDMIUSTYSZ-HXUWFJFHSA-N 388.471 2.829 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cccc(F)c3)CC2)CN1CCc1c[nH]cn1 91664988 ZXGUZEMVBFWQSO-UHFFFAOYSA-N 384.455 2.636 0 50 GFAA COCCN1CCC[C@]2(CCN(Cc3noc(-c4ccc(C)cc4)n3)C2)C1=O 95356754 AENBWKPXSATSAJ-OAQYLSRUSA-N 384.480 2.506 0 50 GFAA O=C(O)c1ccc([C@H]2CCCN(C(=O)c3nc4ccccc4[nH]c3=O)C2)cc1 95373680 USSGAWPPMULHFB-HNNXBMFYSA-N 377.400 2.641 0 50 GFAA O=C([C@H](O)C1CCCCC1)N1CCC(c2nccn2Cc2ccncc2)CC1 95498708 XTFZKBRNSYPDQI-HXUWFJFHSA-N 382.508 2.974 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)cc1 95529388 WGGUUGURQAKPBX-GOSISDBHSA-N 386.463 2.686 0 50 GFAA COc1cccc(NC(=O)N2CCCN(C(=O)[C@H]3CCCO3)CC2)c1Cl 96148737 WWUPYFXRRYBINZ-OAHLLOKOSA-N 381.860 2.594 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc(Cl)nc(N2CCCC2)c1 112580039 QJVYZDMLZPLDSJ-OAHLLOKOSA-N 375.860 2.963 0 50 GFAA O=C(O)[C@H]1CCCN(C(=O)c2cnn(-c3ccc(Br)cc3)c2)C1 136108144 IDNPLVYDEXPIEB-NSHDSACASA-N 378.226 2.572 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)c1cn(-c2ccccc2)nn1 155677430 UTLKHOUBOBALQZ-YJBOKZPZSA-N 393.447 2.732 0 50 GFAA COc1ccccc1N1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)nc2)C1=O 157124983 SHDVZUXKHRIBHR-GFCCVEGCSA-N 379.338 2.644 0 50 GFAA Cc1noc(C2CCN(CC(=O)N[C@H](c3ccccc3)c3nccs3)CC2)n1 170985016 CYRYJCWEKNBTBY-GOSISDBHSA-N 397.504 2.920 0 50 GFAA CO[C@H](C)c1noc(CN2CCCN(Cc3nc4c(F)cccc4[nH]3)CC2)n1 177464586 SQULKJDGRFRNEC-CYBMUJFWSA-N 388.447 2.500 0 50 GFAA COCCC(=O)N1CCC(NC(=O)c2ccc(N(C)c3ccccc3)nc2)CC1 178142179 OIMAMAOSLJWUMJ-UHFFFAOYSA-N 396.491 2.607 0 50 GFAA O=C(OCc1ccccc1)N1CCC(CN2CCCN(C(=O)C3CC3)CC2)CC1 194566222 FKNFJKPQISOFBL-UHFFFAOYSA-N 399.535 2.980 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1Oc1cccc(F)c1)c1ccccc1-n1cccn1 222844190 USIGJUUZQCUKAM-UYAOXDASSA-N 381.407 2.978 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCC[C@H]2OCC[C@@H]12 230227035 APGBLPZJCNTXFY-RRFJBIMHSA-N 392.912 2.961 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)C1 237507457 WIPWSYJONCRBLI-QFBILLFUSA-N 386.517 2.860 0 50 GFAA O=C(Nc1cnn(C[C@H]2CCCCN2C(=O)c2cccnc2)c1)c1cccnc1 241401123 NBIDKBQVOVMZOO-LJQANCHMSA-N 390.447 2.620 0 50 GFAA Cc1ccc(N2C[C@H](C(=O)NCCCN3CCCC[C@H]3C)CC2=O)cc1F 248085725 FHAVVXFAEOBHMZ-IAGOWNOFSA-N 375.488 2.868 0 50 GFAA Cc1cc(NC(=O)c2cccc(-n3ccnn3)c2)cc(N2CCN(C)CC2)c1 252489812 KBHBUFHCOMNXQP-UHFFFAOYSA-N 376.464 2.580 0 50 GFAA COc1ccc(C(C)(C)CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)OC)cc1 253420562 YJFATNGLJRJHTM-MRXNPFEDSA-N 380.485 2.629 0 50 GFAA CC(=O)O[C@H]1CC[C@]2(C)[C@H](CC[C@@]34O[C@@H]3C3=C(C)C(=O)O[C@@]35O[C@H]5[C@H]42)C1(C)C 261493004 WDPSZJMRQVJIBN-CLAXDQGUSA-N 388.460 2.890 0 50 GFAA biogenic Cc1ccc2c(c1)CC[C@@H](C(=O)N1CCOc3ccc(S(C)(=O)=O)cc31)O2 279805315 HFXPMSJFGCVRPP-IBGZPJMESA-N 387.457 2.518 0 50 GFAA CNC(=O)c1ccc(CS(=O)(=O)NC2[C@H]3CC[C@H]2Cc2ccccc2C3)cc1 296027498 NKTWRJLCKDQCLJ-PMACEKPBSA-N 398.528 2.659 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)[C@@H]1CCCN1Cc1ccccc1 299425245 JERFAJYLXYYDNB-NRFANRHFSA-N 393.487 2.762 0 50 GFAA COc1ccc(S(=O)(=O)CCN/C(O)=C2\C=C(c3cccnc3)N=N2)cc1 334159395 WKVDFZSWGUPZMJ-ZCXUNETKSA-N 386.433 2.688 0 50 GFAA COc1cc(/C=C/C(=O)N2CCC[C@@]23CCOC3)cc(Br)c1O 367655146 YOGAJPHFEBLCCT-IDOMTICXSA-N 382.254 2.958 0 50 GFAA CS(=O)(=O)Cc1noc(CN2CC[C@@H](Cc3ccc(C(F)F)cc3)C2)n1 375158320 ILGZFFOQWMWOHB-ZDUSSCGKSA-N 385.436 2.616 0 50 GFAA Cc1cccc(-c2cccc(CNC(=O)C(=O)N[C@@H]3CC[C@H]4CNC[C@@H]4C3)c2)c1 419512775 KXQTWEYONSPJPQ-FDFHNCONSA-N 391.515 2.783 0 50 GFAA CCN(CC)CC(=O)N1CC[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2=O)C1 426383369 UVCZNTUKOVJBDZ-NRFANRHFSA-N 393.478 2.648 0 50 GFAA O=C(NCC1=CCCCC1)c1cccc(-c2nccc(N3CC[C@H](O)C3)n2)c1 426563415 SBYZBUXZEVGNKB-IBGZPJMESA-N 378.476 2.945 0 50 GFAA Cc1nn(-c2ccccc2)c(N)c1-c1ccc(C(=O)N2CCN(C)CC2)cc1 426739859 TUTJHPWNYSCKAO-UHFFFAOYSA-N 375.476 2.818 0 50 GFAA COC(=O)[C@@H]1CN(C(=O)[C@@H]2CC(=O)Nc3ccccc32)C[C@@H]1c1ccccc1 456970741 YONUTSBAQZQLNP-KZNAEPCWSA-N 378.428 2.528 0 50 GFAA Cc1ccc(C(=O)N2CCC(C(=O)NC[C@H]3COc4ccccc4O3)CC2)cc1 827758171 PKQBQDMVGOZGEJ-IBGZPJMESA-N 394.471 2.803 0 50 GFAA CC(=O)NCc1ccc(S(=O)(=O)N2CCN(C)c3cc(Cl)ccc32)cc1 859433862 FRUMPXLXEKBKJB-UHFFFAOYSA-N 393.896 2.621 0 50 GFAA COc1cccc(NC(=O)c2cc(F)ccc2NC(=O)N2CCN(C)CC2)c1 886024585 JUWSYPZXYKIAON-UHFFFAOYSA-N 386.427 2.866 0 50 GFAA CCNc1cnc(-c2noc([C@H]3CCc4nnn(C5CCCC5)c4C3)n2)cn1 952893166 HZDDBCASZKTYPW-LBPRGKRZSA-N 380.456 2.938 0 50 GFAA COc1ccc(-n2ccnc2CN2CCCN(C(=O)c3ccco3)CC2)cc1 952971343 JOXLKAQFXHHUTC-UHFFFAOYSA-N 380.448 2.822 0 50 GFAA CN(Cc1cc(-c2ccccn2)no1)S(=O)(=O)c1ccc(-c2cc[nH]n2)o1 952988674 KCEWVASDELLRRR-UHFFFAOYSA-N 385.405 2.540 0 50 GFAA CC(C)(C)c1ccc(C(C)(C)C)c(NC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2O)c1 1565514599 QUTHKUOKDMMOIL-HOTGVXAUSA-N 382.526 2.561 0 50 GFAA CC(C)c1ccc(CN2CCN(Cc3cccnc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 1565529705 JOIGALTYICEICG-YADHBBJMSA-N 399.560 2.688 0 50 GFAA O=C(c1cnc(O)cc1O)N1C[C@@H]2CC[C@H]1CN(CCCc1ccccc1)C2 1565530986 CCBBLLJEJKAYEQ-MSOLQXFVSA-N 381.476 2.662 0 50 GFAA CN(C)C[C@]12CN(C(=O)C3C(C)(C)C3(C)C)C[C@@H]1CN(c1ccncc1F)C2 1772812106 APTYSKZDULRFPI-NYHFZMIOSA-N 388.531 2.729 0 50 GFAA c1cnc(Oc2ccc(Cc3noc([C@H]4CCc5nn[nH]c5C4)n3)cc2)nc1 1775960476 NRTMBCFTWWQRNA-ZDUSSCGKSA-N 375.392 2.633 0 50 GFAA CNC(=O)[C@@]12CCCN(Cc3c(C)nn(-c4ccccc4)c3C)[C@H]1CN(C)CC2 1857705831 XMLAQIJABBMAIE-JTHBVZDNSA-N 395.551 2.521 0 50 GFAA CC(C)=CCN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)c(N2CCNC2=O)c1 1857706659 YOLWFIMWVFOOJF-KXTWHKPSSA-N 396.535 2.931 0 50 GFAA OC[C@@H]1[C@@H](c2ccccc2)[C@]12CN(Cc1ccc(OC(F)F)cc1)C[C@@H]2O 1857726518 VNINQABNDBTGGO-RCLSDMTESA-N 375.415 2.857 0 50 GFAA Cc1cc(O)ccc1C(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857731275 NLXIDEXAPJJAFY-KNKQGSTJSA-N 378.428 2.615 0 50 GFAA CCCOCC(=O)NC[C@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@]23CC[C@H]1O3 1857731381 QRDMNUFORSOGBM-GPQLQYNLSA-N 390.499 2.656 0 50 GFAA CCn1c(=O)c(=O)n(CC(=O)N2c3ccccc3[C@@H](C)[C@H]2C)c2ccccc21 1875281056 NIWQHKNNQLQASE-LSDHHAIUSA-N 377.444 2.722 0 50 GFAA C[C@@H](Oc1ccc(Br)cc1Cl)c1noc(Cn2ncnn2)n1 1875285920 GRRIVSBMXIDISS-SSDOTTSWSA-N 385.609 2.660 0 50 GFAA CCc1cccc(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397303 VEXHBWOZVYTTMS-LJQANCHMSA-N 381.524 2.726 0 50 GFAA COc1cccc(-n2cc(CN(C)C(=O)c3ccnc4c3nc(C)n4C)cn2)c1 2100557648 XVSUTSYDJSAHRB-UHFFFAOYSA-N 390.447 2.743 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(OC)cc(OC)c1 1129549 PHDLCFJTWAUHTC-UHFFFAOYSA-N 375.377 2.760 0 50 GFAA COc1ccc([C@H](O)CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1 134125003 WXAKFKOVVWPKJM-VQTJNVASSA-N 382.460 2.540 0 50 GFAA Cc1ccc2c(-c3ccc(C(=O)N4CCNC(=O)[C@H]4CCO)cc3)cccc2n1 2356151309 CKFBIZAGGWXAFD-OAQYLSRUSA-N 389.455 2.533 0 50 GFAA O=C(Cc1ccccc1F)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356152622 SAMMELHMKXDDRX-JBYIUTFZSA-N 388.483 2.655 0 50 GFAA CC(C)OCCCNS(=O)(=O)c1ccc[n+](C/C=C\c2ccccc2)c1 4795631 AGZMMEAAZJLIBD-WDZFZDKYSA-N 375.514 2.781 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc2oc(CC)nc2c1 114680261 HOUZQPNWOZIGJE-OAHLLOKOSA-N 379.482 2.923 0 50 GFAA Cc1ccccc1CN1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 20418622 UBJSXODWWOCJDP-UHFFFAOYSA-N 388.518 2.506 0 50 GFAA Cc1ccc(CNC[C@@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)s1 55342401 IAKMVJWVDOBNCG-IBGZPJMESA-N 380.460 2.978 0 50 GFAA COc1cccc(CN(C)[C@H](C)c2ccon2)c1OCCN1CCOCC1 55393498 XABHSLDLTOAEMU-MRXNPFEDSA-N 375.469 2.587 0 50 GFAA COc1c(C(=O)N2CCN(C(=O)c3cc4ccccc4s3)CC2)c(C)nn1C 468960610 KLTRQGYOJMFXPX-UHFFFAOYSA-N 398.488 2.550 0 50 GFAA CCN(CC)C(=O)N1CCC2(CC1)CN(Cc1ccccc1F)CCN2C 67459687 VNTAXHNPCIBJLE-UHFFFAOYSA-N 376.520 2.870 0 50 GFAA C[C@H](C(=O)N[C@H]1CCCCC[C@H]1CO)n1c(S)nnc1-c1cccs1 252516367 SFXIRZAYMYSRFM-AGIUHOORSA-N 380.539 2.914 0 50 GFAA CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCN(Cc3ccc4c(c3)OCO4)CC1)CC2=O 20113723 CIWHWNOFXQKTNT-PKTZIBPZSA-N 398.503 2.845 0 50 GFAA biogenic O=C(Nc1cnn(Cc2cccc(C(F)(F)F)c2)c1)c1nc2ncccn2n1 2808394 QROFHBQOTOTBLF-UHFFFAOYSA-N 387.325 2.640 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)c2ccc3c(c2)CCC3)cn1 328620456 HAVRLTBFGQBJHT-RBUKOAKNSA-N 375.494 2.590 0 50 GFAA Cc1noc(C)c1CN1CCN(C(=O)c2cnn(CC(C)C)c2C2CC2)CC1 153330248 KLHXWRVBVILTCJ-UHFFFAOYSA-N 385.512 2.979 0 50 GFAA CCc1ccccc1NC(=O)N1CCN(c2cc(-n3ccc(C)n3)ncn2)CC1 72437516 ZARGGXHUTMEXBR-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA COc1cc(C2(C(=O)N3CCC[C@H](N4CCNC4=O)C3)CCCC2)ccc1C 363034537 SVPHUEOLXTXWAS-SFHVURJKSA-N 385.508 2.832 0 50 GFAA COc1ccc(C[C@@H]2CN(Cc3cnc(-c4ccccn4)nc3)CCO2)cc1 71614070 AOQPJIMVHVJMGG-HXUWFJFHSA-N 376.460 2.991 0 50 GFAA Cc1noc(C)c1CCC(=O)Nc1nn(C)c2cccc(N3CCOC3=O)c12 72410441 CNQHIHWUUXJYDO-UHFFFAOYSA-N 383.408 2.706 0 50 GFAA O=S(=O)(N[C@H](CO)C(C(F)(F)F)C(F)(F)F)c1ccc(Cl)s1 30691750 PSXOKXJMVRSARX-SCSAIBSYSA-N 391.742 2.782 0 50 GFAA investigational O=C(NCc1ccoc1)[C@@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71738808 WTWNMHOPYUPIFA-HXUWFJFHSA-N 382.508 2.667 0 50 GFAA CCOC(=O)c1coc(N2CCC3(CC2)CC(=O)N(Cc2ccccc2)C3)n1 72473503 GXMOBFKDLXYRMP-UHFFFAOYSA-N 383.448 2.870 0 50 GFAA COCc1nc(N2CCc3cc(OC)c(OC)cc3[C@H]2C)c2cnn(C)c2n1 72167411 LMXSCRJPGYQJMA-GFCCVEGCSA-N 383.452 2.651 0 50 GFAA O=C1CN(Cc2ccc(-c3nc(-c4ccccc4Cl)cc(=O)[nH]3)cc2)CCN1 48345590 NSMZIUFGEDUJRB-UHFFFAOYSA-N 394.862 2.689 0 50 GFAA CC(C)[C@H](NC(=O)CN1[C@H](C)CC(O)C[C@H]1C)c1ccc2c(c1)OCCCO2 241644365 PQESKIOZKOMVCP-MCFFVMPBSA-N 390.524 2.895 0 50 GFAA O=C(Cc1nc(CN2CC(=O)N[C@H]3CCCC[C@H]32)cs1)Nc1ccccc1 246405686 BTUAGZXZKQDNFW-DLBZAZTESA-N 384.505 2.567 0 50 GFAA CN(C[C@H](c1cccs1)N1CCOCC1)C(=O)Cc1noc2ccccc12 177965672 QNRVBJMSTWMKCN-QGZVFWFLSA-N 385.489 2.964 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC3(CO)CCCC3)csc2C1 426471314 GHAYQJCVBGVSHS-UHFFFAOYSA-N 389.521 2.946 0 50 GFAA CCc1c2c(nc3ccccc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@@]3(O)CC 22058780 MYQKIWCVEPUPIL-JOCHJYFZSA-N 376.412 2.642 0 50 GFAA biogenic,in-vitro CN(Cc1cnccn1)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1 95359068 PTJLIXWLTGZREU-UHFFFAOYSA-N 382.445 2.550 0 50 GFAA CS(=O)(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1cc3c(s1)CCCCC3)C2 95356067 SMQHVTLPIQIOHI-DZGCQCFKSA-N 382.551 2.513 0 50 GFAA C[C@@H](Cc1cccs1)NC(=O)N1CCN(C(=O)COc2ccccc2)CC1 426706002 ZAEUQEUHTWYXPD-INIZCTEOSA-N 387.505 2.612 0 50 GFAA CCCNS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCCC3)C2)cc1 96135773 IVGSNVDJSOEHNC-OAHLLOKOSA-N 381.498 2.598 0 50 GFAA Cn1cnnc1SCC(=O)N1CCC[C@](C)(Cc2ccc3c(c2)OCO3)C1 91747056 RYCFOJQZICVVLS-LJQANCHMSA-N 388.493 2.507 0 50 GFAA Oc1cccc(CN2CCC(c3nnc(Cn4ccnc4)n3C3CC3)CC2)c1 96136027 FJKYWANYKZECQR-UHFFFAOYSA-N 378.480 2.943 0 50 GFAA C[C@@H](NC(=O)CCc1n[nH]c2c1CCCC2)c1ccc(S(C)(=O)=O)cc1 97619190 DHSZZUUAINEUFY-CYBMUJFWSA-N 375.494 2.502 0 50 GFAA CC[C@H](C)N1C(=O)[C@@H]2[C@@H](C(C)=O)N3c4c(ccc5cccnc45)C=C[C@@H]3[C@@H]2C1=O 245255101 FMMIIWJTGVIPNO-YAACIECUSA-N 389.455 2.808 0 50 GFAA O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)[C@@H]1C[C@@H](O)CN1 299749639 LCSFQADFZPXQBS-AUJRIZCKSA-N 383.879 2.792 0 50 GFAA CC(=O)N[C@H](CC(=O)N1[C@H](C(=O)O)C[C@H]2CCCC[C@@H]21)c1c(F)cccc1F 299753065 WRRCIMHBXJEQAH-VZEFYGNVSA-N 394.418 2.776 0 50 GFAA Cn1ncc(-c2ccccc2)c1NC(=O)N1CCCN(c2ncccn2)CC1 299786669 NYEXMCMYJGWCBP-UHFFFAOYSA-N 377.452 2.621 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccccn2)C(=O)NCCSc2ccccc2)N1 584900935 RWRQPDKCMHKUQT-KRWDZBQOSA-N 384.505 2.664 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)c2cccc(NS(=O)(=O)C3CC3)c2)no1 1875280519 RMPLMROTHRETQE-KRWDZBQOSA-N 375.450 2.864 0 50 GFAA O=C([C@@H]1CCN(C[C@@H]2CCCc3ccccc32)C1)N1CCc2c(O)ncnc2C1 1875261821 KGRBSTPDFGOMMD-ZWKOTPCHSA-N 392.503 2.509 0 50 GFAA CC[C@H](CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2ccc(C)s2)C1)c1ccccc1 1875305444 RETCQSVGQWQGGC-KBAYOESNSA-N 386.517 2.942 0 50 GFAA CS(=O)(=O)C[C@@H]1C[C@H](F)CN1c1nnc(-c2ccco2)cc1C(F)(F)F 1875392662 MQUVVYDDJBKYNE-UWVGGRQHSA-N 393.362 2.717 0 50 GFAA O=C(O)C1CCN(CCNCc2ccc(OC(F)F)cc2OC(F)F)CC1 1875303534 CGVXMEHUGCKQOD-UHFFFAOYSA-N 394.365 2.776 0 50 GFAA CC(C)[C@@H](C(=O)N[C@@H](C)C1CCN(C(=O)c2cc3cnccc3[nH]2)CC1)N(C)C 1875332433 RPCGUHJSKCVRPD-YWZLYKJASA-N 399.539 2.506 0 50 GFAA COc1cc(OC)c(C(=O)Nc2ccc3c(c2)N(C)C(=O)[C@@H](C)O3)cc1OC 952986550 IAZKIJRAUVNOIY-LLVKDONJSA-N 386.404 2.708 0 50 GFAA O=C(NC[C@@H]1CN(Cc2ccccc2)CCCO1)NC1(C2CC2)CCOCC1 1321929441 HXEJIVVUVAIQKZ-HXUWFJFHSA-N 387.524 2.536 0 50 GFAA C[C@H](C(=O)c1c[nH]c2ncccc12)N1CCC(c2nnc3n2CCCC3)CC1 275011765 RNRNLRUNLIGJMB-CQSZACIVSA-N 378.480 2.942 0 50 GFAA O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCO[C@@]2(CCOC2)C1 170082791 IFNDGSBCHLFMHV-KRWDZBQOSA-N 381.354 2.523 0 50 GFAA CC(C)N1C[C@H](C(=O)Nc2ccc(CN(C)C)c(Br)c2)CC1=O 170604615 MJKXDSCWAQWEDX-CYBMUJFWSA-N 382.302 2.706 0 50 GFAA COc1cc(CN2CC[C@](C(N)=O)(c3ccccc3)C2)ccc1OC(F)F 411969760 QWPLUWOAMRTRAZ-HXUWFJFHSA-N 376.403 2.926 0 50 GFAA CC(C)c1cc(C(=O)N[C@@H](C(=O)N2CCOCC2)C(C)C)c2ccccc2n1 193172016 HDDKIGUSFWBPNR-HXUWFJFHSA-N 383.492 2.971 0 50 GFAA Cc1ccc(NC(=O)CN2CCC(CNC(=O)Cc3cccnc3)CC2)cc1C 1506398136 HGKVEBMNUONAKC-UHFFFAOYSA-N 394.519 2.708 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cccc(F)c2F)cc1OC 1529134335 XBIALSFEFFJNPU-UYAOXDASSA-N 379.403 2.916 0 50 GFAA CC(C)Nc1ncc(C(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)cn1 1704337973 ITQYHOSWGVWHQN-UZLBHIALSA-N 391.475 2.833 0 50 GFAA c1ccc(CC[C@@]23CN(Cc4cnc[nH]4)C[C@@H]2CN(c2nncs2)C3)cc1 1772808836 CFLLWDFVRSXYCB-XLIONFOSSA-N 380.521 2.832 0 50 GFAA O=C(N[C@H]1CCCN(CCc2ccccc2)C1)c1cccc(N2CCOCC2)c1 12315268 VZQQSBZGXQJHJT-QFIPXVFZSA-N 393.531 2.960 0 50 GFAA C[C@H](CNC(=O)c1ccncc1)Oc1cccc(CN(C)Cc2cnccn2)c1 12329926 VLPSAQQYZHFTKD-QGZVFWFLSA-N 391.475 2.701 0 50 GFAA C[C@H](Oc1cc(Cl)ccc1Cl)C(=O)N1CCN(c2ncccn2)CC1 12380495 JXQIKHVUYWOHSO-LBPRGKRZSA-N 381.263 2.900 0 50 GFAA O=Cc1ccc(OC(=O)C2CCC(N3C(=O)[C@@H]4CC=CC[C@H]4C3=O)CC2)cc1 13897015 JKJHXBIRNCTKRD-LRMJVLKBSA-N 381.428 2.915 0 50 GFAA CSc1nnc(CN(C)Cc2ccc3c(c2)OCO3)n1C[C@@H]1CCCO1 14983996 VSWSLWJZLIVVGB-AWEZNQCLSA-N 376.482 2.540 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H]3CCCN3C)n1)CCN(C(=O)NC(C)C)C2 19850441 BNHZEBCWQPMXLH-INIZCTEOSA-N 384.484 2.683 0 50 GFAA COc1ccc2cc([C@@H]3CN(c4ccc(C(=O)N(C)C)nn4)CCO3)ccc2c1 1857679604 NZYHBWQGNSLNBG-FQEVSTJZSA-N 392.459 2.918 0 50 GFAA O=C(O)c1cc2c(s1)CCOC21CCN(C(=O)c2cc(O)ccc2F)CC1 1857686240 MXPUZWKNCQRBKT-UHFFFAOYSA-N 391.420 2.995 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)N2CCCCC2)CC[C@@H]1NC(=O)C1CCOCC1 1857691278 CSLLGFNIQYJRJK-FHWLQOOXSA-N 380.529 2.506 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)CCc2ccc(N(C)C)cc2)CC1 1857732974 PHMIQWOAVFEJMG-UHFFFAOYSA-N 394.519 2.996 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4cnccn4)C[C@]34CC[C@H]2O4)c1C 1857733006 QLNOEUIXXSKCEV-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA O=C(c1cn2ccsc2n1)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1875249148 HKVFUGBFJFOEAJ-FQEVSTJZSA-N 395.488 2.889 0 50 GFAA CC(C)(C)OC(=O)N1CCC(NC(=O)OCc2ccccc2)(C(=O)O)CC1 4240742 IHSWVSORYDACRV-UHFFFAOYSA-N 378.425 2.767 0 50 GFAA in-vitro COCc1cc(C(=O)N[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)no1 266283744 GAEVVSLVOCGLEY-NSHDSACASA-N 385.342 2.728 0 50 GFAA O=C(CCc1cncc2ccccc12)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785878 RQNJLVSBISWUTB-JSNMRZPZSA-N 398.894 2.973 0 50 GFAA NC(=O)Nc1cccc(CNC(=O)c2ccc3nnc(-c4ccccc4)n3c2)c1 2325869281 GWQBYYVHMGUNPX-UHFFFAOYSA-N 386.415 2.817 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(C(=O)OC)cc2)nnc1-c1cccnc1 779284 ZDRMMSFLCWYICM-UHFFFAOYSA-N 397.460 2.877 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)NCc2ccc3nc[nH]c3c2)CC[C@@H]1NC(=O)CC 2356136631 CJSIZIKVFNPCHR-IEZWGBDMSA-N 386.496 2.669 0 50 GFAA O=C(NCc1cccc(F)c1F)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356146365 CHSXOMKWYBIDLJ-RQVMVGKASA-N 397.425 2.913 0 50 GFAA COc1ccc(CC(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc1F 2356158525 NNYRMERAJDBGCX-QFIPXVFZSA-N 398.482 2.739 0 50 GFAA Cc1ccc(SCCNC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 2842776 QCFNBMPFTIYYMR-UHFFFAOYSA-N 378.519 2.913 0 50 GFAA CSc1cccc(NC(=O)CN(c2ccc3c(c2)OCO3)S(C)(=O)=O)c1 4384496 WHEOQOCTDBLVMB-UHFFFAOYSA-N 394.474 2.542 0 50 GFAA C[C@H](C(=O)N1CCc2ccccc2C1)N(c1ccc(F)cc1)S(C)(=O)=O 7872002 UWTGQMWMUROXCM-CQSZACIVSA-N 376.453 2.565 0 50 GFAA CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC(=O)c2ccco2)cc1 8830301 ALELAPFILLZPRJ-MRXNPFEDSA-N 386.429 2.855 0 50 GFAA aggregator O=C(O)c1ccc(NCc2cccnc2)c(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 107265587 JNYJLYZTBDSDPA-HOTGVXAUSA-N 377.400 2.848 0 50 GFAA OCC[C@H]1CN(Cc2ccc3c(c2)OCCO3)CCN1Cc1ccc(F)cc1 20205449 FPCZGRYSYVVRKF-FQEVSTJZSA-N 386.467 2.666 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCC[C@@H](Cn3cc(CC4CCCCC4)nn3)C2)c[nH]1 20207862 MOFBJMDYCAXVEU-GOSISDBHSA-N 397.523 2.950 0 50 GFAA CC(=O)N1CCn2nc(C(=O)NCc3nc4cc(C(C)(C)C)ccc4o3)cc2C1 65529163 WPUOSACKGMPFCS-UHFFFAOYSA-N 395.463 2.614 0 50 GFAA O=C([C@@H]1CCNC1)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67675840 VBJJXRQANXNJOE-CYBMUJFWSA-N 395.484 2.999 0 50 GFAA COc1ccc([C@@H](NC(=O)N(C)Cc2cnc(N(C)C)nc2)C(F)F)cc1F 252503890 VHAGOWJIROEFSF-OAHLLOKOSA-N 397.401 2.838 0 50 GFAA CC[C@H](C)N(CCC(=O)O)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1 328590590 CHRQJYHEIMLAPZ-KRWDZBQOSA-N 375.513 2.932 0 50 GFAA CC(=O)NCCC(=O)N1CCC[C@@H](c2nc(C)ncc2-c2cccc(C)c2)C1 12039359 IMZYNRZOVTWBRZ-LJQANCHMSA-N 380.492 2.993 0 50 GFAA Cc1c(C(=O)NCc2ccc3c(c2)CNC3)nnn1-c1ccc2ncccc2c1 444258233 SCIZLNPEIAPOOZ-UHFFFAOYSA-N 384.443 2.657 0 50 GFAA Cc1nc(NCCNC(=O)Nc2cccc(Cl)c2)cc(N2CCOCC2)n1 36708097 CDSGABBGSYLEQO-UHFFFAOYSA-N 390.875 2.509 0 50 GFAA CCOCCn1c(=O)[nH]c2cc(C(=O)NCc3cccc(F)c3F)ccc21 77452220 GBZZOFGWRKFACZ-UHFFFAOYSA-N 375.375 2.574 0 50 GFAA Cc1cc(C)cc(-c2cc(C(=O)O)cc(S(=O)(=O)N3CCN(C)CC3)c2)c1 72146798 FVSHSDSTNMTAPE-UHFFFAOYSA-N 388.489 2.605 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCC(CO)CC1 71754306 BVAUFKHNVCBCHX-JOCHJYFZSA-N 399.579 2.594 0 50 GFAA CCS(=O)(=O)c1cc(F)ccc1NC(=O)NC[C@H](c1ccnn1C)C(C)C 239807497 CSKFMLTVGWKMJS-AWEZNQCLSA-N 396.488 2.914 0 50 GFAA CC(=O)c1ccc(N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)nc1 71763738 KTCTUTLFYSKZEP-IBGZPJMESA-N 384.524 2.587 0 50 GFAA Cc1cc(C(=O)N2CCC(=O)N(Cc3ccc(F)cc3)[C@H](C(C)C)C2)n(C)n1 71754264 BKQPLCVPASJXSJ-IBGZPJMESA-N 386.471 2.767 0 50 GFAA COCC(=O)Nc1cccc(NC(=O)N2CCN(Cc3cccs3)CC2)c1 44109615 ZBYVDQOSCJUSAG-UHFFFAOYSA-N 388.493 2.683 0 50 GFAA Cc1ccc(-c2nc(CC(=O)N(C)CC3CCN(C[C@@H](C)O)CC3)cs2)o1 176868674 ITFGQMXRCCFGHX-CQSZACIVSA-N 391.537 2.805 0 50 GFAA Cc1sc(NC(=O)CSCC(=O)O)c(C(N)=O)c1-c1ccc(F)cc1 17078071 WUQMVQBARQETQC-UHFFFAOYSA-N 382.438 2.718 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@H](Cn4cc(CC(C)C)nn4)C3)cn2c1 48360820 RTYZRXDXIPPFEE-KRWDZBQOSA-N 380.496 2.985 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@@H](Cn4cc(CC(C)C)nn4)C3)cn2c1 48360823 RTYZRXDXIPPFEE-QGZVFWFLSA-N 380.496 2.985 0 50 GFAA Cc1c(C(=O)N[C@H]2CCCc3sc(Cl)cc32)cnn1-c1ccc(=O)[nH]n1 292326440 JLFKBSWDGLJTDU-LBPRGKRZSA-N 389.868 2.786 0 50 GFAA NCCCC(=O)N1CCC[C@@H]1c1nc(Cc2ccc(Br)cc2)no1 237895618 RVRFRMQXTYZEKJ-CQSZACIVSA-N 393.285 2.825 0 50 GFAA O=C(c1ccncc1)N1C[C@@H]2CC[C@H](C1)N(C(=O)NCc1ccccc1F)C2 92064957 BTULTUQVJPFRCP-MAUKXSAKSA-N 382.439 2.667 0 50 GFAA COc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NC(=O)c2cc(O)n[nH]2)cc1 92020118 IGRYUYIBHKYDFP-INIZCTEOSA-N 381.436 2.753 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1CCC(c3cc(=O)[nH]cn3)CC1)c(C)n2C 97743055 OXXIPXSVMTYFDV-UHFFFAOYSA-N 380.448 2.598 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccccc2N2CCCC2)[C@H]2C[C@@H](O)C2)cn1 244795654 RKWKIZXSRFLERQ-LLGFUMIMSA-N 381.476 2.932 0 50 GFAA Cc1c(N)c(I)cc(I)c1F 616568801 YNHOGDMMBDIPPS-UHFFFAOYSA-N 376.938 2.926 0 50 GFAA CCc1ncc(CN2CCC[C@H](CNC(=O)Cc3sc(C)nc3C)C2)cn1 823556152 VGRFKGNZLFVWHS-MRXNPFEDSA-N 387.553 2.683 0 50 GFAA COc1cccc2c1OC[C@@H](NC(=O)CCCc1nc(-c3ccco3)no1)C2 824804891 RJEPBFBAALMQQW-AWEZNQCLSA-N 383.404 2.781 0 50 GFAA Cc1cc(C)n([C@@H]2CCN(C(=O)NCCc3noc(-c4ccccc4)n3)C2)n1 670437281 WHHKWWOFCRYLBF-QGZVFWFLSA-N 380.452 2.749 0 50 GFAA CN(Cc1cnn(-c2ccc(F)cc2)c1)C(=O)NCCc1noc(C2CC2)n1 584900380 CAKNYAFLVCYJRZ-UHFFFAOYSA-N 384.415 2.656 0 50 GFAA O=[S@@](c1ccc(N2CCC[C@@]3(CCS(=O)(=O)C3)C2)cc1)C(F)(F)F 865856711 KJDCECNHQZRUCZ-FATZIPQQSA-N 381.441 2.719 0 50 GFAA C[C@H](CC(=O)N1CC[C@H](C(F)(F)F)[C@@H](CO)C1)NC(=O)Nc1ccccc1 1875256683 RUJYQNFALJJLKP-NFAWXSAZSA-N 387.402 2.606 0 50 GFAA COC(=O)/C=C/C(=O)NCc1ccccc1-c1ccc(CN2CCCC2=O)cc1 1875380357 MJQZWRUIFWGBFQ-OUKQBFOZSA-N 392.455 2.821 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2NS(=O)(=O)c2ccc3c(c2)CCCC3)cn1 275230247 DAHXTHYCIUVKMY-RBUKOAKNSA-N 375.494 2.590 0 50 GFAA COc1ccccc1N1CCC(Nc2cc(N3CCC[C@@H](CO)C3)ncn2)CC1 171884624 UDHUVSJCTRSIRA-QGZVFWFLSA-N 397.523 2.775 0 50 GFAA O=C(CC1(O)CCCCC1)Nc1ccc(NS(=O)(=O)C(F)(F)F)cc1 225555449 XPTDQNUIIDZWJQ-UHFFFAOYSA-N 380.388 2.972 0 50 GFAA NC(=O)CC1CCN(c2cc(Br)cnc2Br)CC1 225817635 GUUNPMPOPHOXQT-UHFFFAOYSA-N 377.080 2.698 0 50 GFAA COc1ccc2[nH]cc(CC(=O)N[C@@H]3CCN(Cc4ccc(C)cc4)C3=O)c2c1 191630605 LZAYVQOIRPEJMM-OAQYLSRUSA-N 391.471 2.945 0 50 GFAA Cc1cccc(Cl)c1C(=O)NC[C@H]1CCCN(CC(=O)N2CCCC2)C1 1506406646 FFJALVXKVDFVHD-MRXNPFEDSA-N 377.916 2.713 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@H]2CCCN(Cc3cccnc3)C2)c1C 1506406709 RGEXBWMQLOAYLE-IBGZPJMESA-N 380.492 2.808 0 50 GFAA COc1ccc(OCc2cc(C(=O)N3CCN4CCC[C@H]4C3)n[nH]2)c(Cl)c1 11818923 BSAKPSDJLYDRBI-AWEZNQCLSA-N 390.871 2.571 0 50 GFAA COc1ncccc1C(=O)NC[C@@H]1Cc2cccc(-c3nc(C)cnc3C)c2O1 11969790 LPDCMWDNIXKLPH-INIZCTEOSA-N 390.443 2.898 0 50 GFAA Cc1cc(C(=O)NC[C@H]2CCC3(CCN(Cc4cccs4)CC3)O2)n(C)n1 12023370 KIWZTKAXXDZQJZ-MRXNPFEDSA-N 388.537 2.734 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)CCN1CCCC1=O 12195106 CYWYYAQINWFVLN-UHFFFAOYSA-N 389.515 2.551 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)Cc3cccc(C)c3)C2)nn1 12245322 WZZYJTJULMPSOI-IBGZPJMESA-N 397.523 2.550 0 50 GFAA Cn1nc(C(=O)NCCc2ccccc2)c2c1CC[C@H](NCc1ccco1)C2 14532679 JQUSYUWOFHKWMI-KRWDZBQOSA-N 378.476 2.633 0 50 GFAA COc1ccc([C@@H](C)NC(=O)CN2C(=O)C(c3ccccc3)=NC2(C)C)cc1 169765559 LAXYZHWBORZLTM-OAHLLOKOSA-N 379.460 2.940 0 50 GFAA Cc1n[nH]c(C)c1-n1ccnc1-c1ccc(OCC(=O)NC[C@H]2CCCO2)cc1 1857691857 ZAQOOPCKGLORED-GOSISDBHSA-N 395.463 2.553 0 50 GFAA Cc1ccc(CNC(=O)N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)cc1 1857701925 ZAMLGZMMJIYXDH-SFTDATJTSA-N 393.487 2.707 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2ccc(-n3ccnc3)cc2)CC1 1857719497 NWXKZVAWHRRDHZ-UHFFFAOYSA-N 389.459 2.797 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NCc2ccccc2OC)CC[C@H]1NC(=O)CC 1875249028 FWIWDRZQIFLDFT-KVSKMBFKSA-N 376.497 2.802 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCOC3(CCC3)C2)cc1Br 133650728 JDGSFKUYVHHFON-UHFFFAOYSA-N 390.299 2.791 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@@H]1c1ccc(OC)cc1OC 1022417 WYDBXTYNCYOSFQ-MRXNPFEDSA-N 376.434 2.527 0 50 GFAA Cc1ccccc1C[C@@H](CNC(=O)C1(C(=O)Nc2ccc(F)cc2)CC1)C(=O)O 2325743674 JGTFQLBVUDSGGQ-INIZCTEOSA-N 398.434 2.913 0 50 GFAA O=C(C[C@H]1CN(CC2CC=CC2)C2(CCC2)CO1)NC[C@H]1CCCc2nccn21 2325785251 MACVGBYORCFCTO-UXHICEINSA-N 398.551 2.857 0 50 GFAA O=C(COc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O 2325785480 ARTXUIRKSNGXKP-ZPMCFJSWSA-N 391.471 2.885 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)NCc2cc(Cl)c3c(c2)OCCCO3)C1 2325888625 LBZDZWIRDUFWCL-AWEZNQCLSA-N 378.856 2.542 0 50 GFAA CCOC(=O)C1CCN(C(=O)C2CCN(Cc3ccc(OC)cc3)CC2)CC1 795512 LNFKESWNXHBNRA-UHFFFAOYSA-N 388.508 2.709 0 50 GFAA CCN1C(=O)[C@@](O)(CC(=O)c2ccccc2O)c2cc(Br)ccc21 1129640 VCTFKZQQSHHTSE-GOSISDBHSA-N 390.233 2.982 0 50 GFAA O=C(c1cccc2ncsc12)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 2356147182 LUTUTBYSWZRPMO-LNNXQNCSSA-N 380.469 2.505 0 50 GFAA Cc1ccc(N2CCC[C@@]3(CCCN3C(=O)c3cnc(C)nc3O)C2=O)cc1 2356166035 UFMFAZQMKFNSSU-OAQYLSRUSA-N 380.448 2.601 0 50 GFAA COc1cc(Cl)c(C)cc1NC(=O)CSc1nc2c(c(=O)[nH]1)CCC2 8587393 OUCRFAZNEIMTLM-UHFFFAOYSA-N 379.869 2.960 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccc(F)cc2)C1)N1CCN(c2ccccc2F)CC1 8782425 GERNWVLBSRCXPN-OAHLLOKOSA-N 385.414 2.667 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(NCc3ccoc3)nc2)CC1 67773872 YYAUXPCOMUKXDN-UHFFFAOYSA-N 382.464 2.761 0 50 GFAA CN(C)c1ccc(C(=O)N2CCc3c(c(C(=O)O)nn3C)C2)c2ccccc12 67974052 HORJZZOESSEPNA-UHFFFAOYSA-N 378.432 2.536 0 50 GFAA Cc1ccccc1C(=O)N[C@@H](N[C@@H]1CCCS1(=O)=O)C(Cl)(Cl)Cl 22205056 CBBHITHUVKGANW-WCQYABFASA-N 399.727 2.545 0 50 GFAA Cc1nn(C)c(C)c1[C@H]1[C@H](CNc2ncnc3cc(Cl)ccc23)CC(=O)N1C 328609465 DJNLOAOIWXVFQE-ORAYPTAESA-N 398.898 3.265 0 50 GFAA CC(C)(O)[C@@H]1CCCN1c1nc(N2CCC[C@@H]2C(C)(C)O)nc2c1SCC2 328852005 ZWKFAEUMRSCVGS-LSDHHAIUSA-N 392.569 2.604 0 50 GFAA CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C(=O)Nc2ccccc2OCC(C)C)C1 284785040 KXJWEIAXGBVDEH-WMZOPIPTSA-N 389.496 2.965 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@H]1CCCN(C(=O)CN2CCOC2=O)C1 11934338 VGERFIPSFOZNNN-INIZCTEOSA-N 397.431 2.576 0 50 GFAA CNC(=O)c1cccc(CNC(=O)c2nn(-c3c(F)cccc3F)cc2C)c1 253395452 ZTLXJWMEEPGEHX-UHFFFAOYSA-N 384.386 2.749 0 50 GFAA O=C(Nc1ccc(F)cc1F)c1ccn(Cn2nnc(-c3ccccc3)n2)n1 2794377 PGSCYTKOCQENNO-UHFFFAOYSA-N 381.346 2.573 0 50 GFAA Nc1nccnc1C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl 124735611 HVDVYJPVWCPNLP-CYBMUJFWSA-N 394.262 2.999 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)N2CCNC[C@@H]2C)cc1 125509490 BKGQWPZWVIVDMF-KRWDZBQOSA-N 390.487 2.911 0 50 GFAA Cc1c(NC(=O)N[C@@H]2c3ccccc3O[C@H]2C)cccc1S(=O)(=O)N(C)C 455968905 QPWZSCMWUOSVQA-UGSOOPFHSA-N 389.477 2.889 0 50 GFAA CSCCC(=O)N1CCC2(CC1)CN(CCOc1ccccc1)C(=O)O2 77521470 DUQKMCGVFOTXTJ-UHFFFAOYSA-N 378.494 2.632 0 50 GFAA O=C(Cc1csc(-c2ccccn2)n1)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 225427861 MUAXFWFUSJTONX-CABCVRRESA-N 392.484 2.555 0 50 GFAA biogenic COc1ccc(-c2ccn(CC(=O)Nc3cc(C4CC4)nn3C)n2)cc1OC 48066942 KGGMOQCUGZEAAV-UHFFFAOYSA-N 381.436 2.817 0 50 GFAA O=C(NCc1cc(F)ccc1Br)N1CCC[C@H](Cn2ccnn2)C1 178987872 CPOQPSVLTLYKOO-LBPRGKRZSA-N 396.264 2.802 0 50 GFAA Cc1nc[nH]c1CNC(=O)c1csc2c1CCN(Cc1c(C)noc1C)C2 426498769 VFSVDUNVNAWVBU-UHFFFAOYSA-N 385.493 2.873 0 50 GFAA CCc1nc(C)c(C(=O)N2CCN(c3nccc(-c4ccccc4)n3)CC2)o1 97480213 NCTKFRXVCAMZRD-UHFFFAOYSA-N 377.448 2.965 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)c2cnc(-c3ccccn3)nc2O)cc1 91974275 USZMYNHNRVFVCC-UHFFFAOYSA-N 386.415 2.668 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)N1CCC[C@H](c2ccccc2)CC1 95520374 UKAKDKZEBSTWGK-IBGZPJMESA-N 380.492 2.640 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)COCC(F)(F)C(F)F)C[C@H]2N(C)C)cc1 95525934 AQHIARQYESVNLU-LSDHHAIUSA-N 376.394 2.768 0 50 GFAA CC[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)O)c2C(N)=O)C1 239439254 ZQMYMMLWEHGEMP-GRYCIOLGSA-N 376.478 2.967 0 50 GFAA O=C(Nc1cccc(-n2cnnc2)c1)N(Cc1ccccn1)C[C@H]1CCCO1 97743205 DFDGOKHNFGYKGJ-LJQANCHMSA-N 378.436 2.875 0 50 GFAA O=C(CCc1nc(-c2cccs2)no1)N[C@H]1CCN(Cc2ccccc2)C1=O 299370108 DQHXIEIMPXECOZ-HNNXBMFYSA-N 396.472 2.648 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@H](c2cccc(Br)c2)N2CCCC2)C1 299742824 KSNHMXBOGXHBJH-ZFWWWQNUSA-N 381.270 2.519 0 50 GFAA COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)Nc2nc3ccccn3n2)C1 184326352 YTMLNFOIHCAWLL-CYBMUJFWSA-N 386.843 2.792 0 50 GFAA CC(C)c1ccc(N2C(=O)[C@@H](CCC(=O)NCCc3ccccn3)N=C2O)cc1 252492589 MPTJLFVGTVGPBZ-LJQANCHMSA-N 394.475 2.973 0 50 GFAA Cc1nnc(SCCNC(=O)CCC(=O)Nc2ccc3c(c2)CCC3)s1 827814670 WYOILDJJJUSQSS-UHFFFAOYSA-N 390.534 2.962 0 50 GFAA O=C(NCCc1nc(C2CC2)no1)N1CCC([C@@H](O)c2cccs2)CC1 584891345 BOTDFLLWNKMYNH-MRXNPFEDSA-N 376.482 2.706 0 50 GFAA O=C(N[C@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3)c1cc(Cl)ccc1F 670472855 LMZXPOORHVQYHN-BGWLNWIQSA-N 399.897 2.777 0 50 GFAA CN(C)c1c[nH]ccc1=NC(=O)c1ccc(N2C(=O)c3ccccc3C2=O)cc1 1875262836 QEERIECPFVDNHM-UHFFFAOYSA-N 386.411 2.622 0 50 GFAA COC(=O)[C@@](C)(CNC(=O)c1c(C)nc2sccn12)c1ccccc1F 1875268637 BHYMEJGILJYDTD-SFHVURJKSA-N 375.425 2.704 0 50 GFAA CCc1cccnc1[C@H](C)N[C@@H]1CCN(c2nc(C(=O)N(C)C)nc(C)c2C)C1 1875397833 PUVVUPPQJWXION-FUHWJXTLSA-N 396.539 2.682 0 50 GFAA CCn1nc2c(c1C(=O)N1Cc3cnn(C)c3CC(C)(C)C1)C[C@H](C)O[C@@H]2C 1875314072 GFPSGFVIHAGVPI-UONOGXRCSA-N 385.512 2.883 0 50 GFAA Cn1cccc1-c1cc(C(=O)NC[C@H]2CCN(Cc3ccccc3F)C2)n[nH]1 952868676 CMIYYWNNERJOIP-OAHLLOKOSA-N 381.455 2.806 0 50 GFAA c1nc(N[C@H]2CC[C@H](N3CCOCC3)CC2)c2c(C3CCOCC3)c[nH]c2n1 1772572705 DJVYXMINSBMUHH-QAQDUYKDSA-N 385.512 2.907 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(Cl)c(Cl)c1 170596462 VEJUXPDCSVLEGA-OLZOCXBDSA-N 380.297 2.975 0 50 GFAA Cc1nccnc1N1C[C@@H]2CN(Cc3coc(C(C)C)n3)C[C@]2(CCC(=O)O)C1 1772804215 JLDSHNRHZBDCBP-HRAATJIYSA-N 399.495 2.700 0 50 GFAA Cc1cc(C)n(-c2nc(Nc3ccc(F)cc3F)nc(N3CCOCC3)n2)n1 5051184 AWMJHYNSFXFXIJ-UHFFFAOYSA-N 387.394 2.533 0 50 GFAA O=C(c1cccnc1)N1CCC(Oc2ccc(C(=O)N3CCCCO3)cc2)CC1 12754420 ZMMOTDVREPOELC-UHFFFAOYSA-N 395.459 2.933 0 50 GFAA Cn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCc1nc3ccccc3s1)C2 14732330 RSXRYTYJFKTDSO-AWEZNQCLSA-N 395.532 2.913 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(CCOc2ccc(Cl)cc2)CC1 19831685 SUTDGPBXZYMYOT-UHFFFAOYSA-N 380.897 2.725 0 50 GFAA O=C(c1ccc(N2CCCC[C@@H]2CO)nc1)N1CCC(CCn2cccn2)CC1 19839798 WTZXHQIMMGJPOI-HXUWFJFHSA-N 397.523 2.572 0 50 GFAA O=C(c1cc2c(s1)C1(CCN(C[C@H]3CCOC3)CC1)OCC2)N1CCCC1 1857690196 FITIEIBKDDSHRB-MRXNPFEDSA-N 390.549 2.884 0 50 GFAA CCn1cnnc1[C@@H]1CCCN(C(=O)c2cc(-c3ccc(OC)cc3)n[nH]2)C1 164800233 KDYHGXUMWYHYDL-OAHLLOKOSA-N 380.452 2.717 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1c1cccc(I)c1 101376633 VFDICGXUUGFPGQ-DUBDDPSESA-N 379.197 2.993 0 50 GFAA COc1ccc2c(c1)CC[C@H](C)N2S(=O)(=O)c1ccc2c(c1)NC(=O)CO2 4690109 HADARXXIPPPJED-LBPRGKRZSA-N 388.445 2.556 0 50 GFAA Cc1csc([C@H](C)N2CCN(c3nnc(-c4ncccc4C)n3C)CC2)n1 2325701373 HWYWQWJLAXFZKW-HNNXBMFYSA-N 383.525 2.834 0 50 GFAA C[C@](O)(Cc1cn(C[C@@H](O)CCOCc2ccccc2)nn1)c1cccs1 2325772819 OXVLHDVAWNXBQU-ICSRJNTNSA-N 387.505 2.758 0 50 GFAA CC[C@@H](SC)C(=O)NC[C@@]1(C)CCN(C(=O)c2ocnc2C(F)(F)F)C1 2325794344 ZAAZDOJDQGXSQK-MEBBXXQBSA-N 393.431 2.803 0 50 GFAA Cn1nc(CS(=O)(=O)Cc2conc2C(F)(F)F)cc1C(F)(F)F 2325798886 HVIXTSACJCOJLU-UHFFFAOYSA-N 377.266 2.561 0 50 GFAA C[C@H](CNC(=O)c1cc2ccc(Br)cc2c(O)n1)c1ncc[nH]1 2325857345 YIFRHEUOSNBQSZ-SECBINFHSA-N 375.226 2.960 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2C[C@@H](O)CCC2(C)C)cc1Br 2325874534 PYDRCFZFDCZYHA-LBPRGKRZSA-N 376.316 2.990 0 50 GFAA CC(C)(C)OC(=O)N1Cc2cccc(C(=O)Nc3n[nH]c4c3COCC4)c2C1 899249778 DGIBSPNMKCYDJJ-UHFFFAOYSA-N 384.436 2.985 0 50 GFAA CN1CCN(c2ncnc3c2cnn3Cc2ccc(Cl)cc2Cl)CC1 759437 BBGLPNHSXQZQIJ-UHFFFAOYSA-N 377.279 2.933 0 50 GFAA COc1ccc(N(CC(=O)Nc2ccc(C)c(C)c2)S(C)(=O)=O)cc1OC 786459 FDALTVKWSKWUNT-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OC)c3ccccc23)CC1 810988 ZQJKGDICRBSGLR-UHFFFAOYSA-N 377.462 2.812 0 50 GFAA CS(=O)(=O)c1ccc2nc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)O)sc2c1 2503179 SUINWZINFPLMBA-GHMZBOCLSA-N 382.463 2.529 0 50 GFAA CCc1ccccc1N(CC(=O)NCCSCc1ccco1)S(C)(=O)=O 2990685 FGGTULBQVZVBCH-UHFFFAOYSA-N 396.534 2.658 0 50 GFAA O=c1nc2sccn2c2ccc(S(=O)(=O)N3CCc4ccccc4C3)cc12 4708986 XWITYONKCZBQTH-UHFFFAOYSA-N 397.481 2.656 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NCCc3cccc(F)c3)CCC2=O)cc1 12075926 BFCWLTJVASKBLO-IBGZPJMESA-N 398.478 2.974 0 50 GFAA COCCC(=O)N[C@H](C)c1nnc2n1CCN(Cc1ccc(C(C)C)cc1)CC2 12245733 AQYNBCMJRNQFBP-QGZVFWFLSA-N 399.539 2.674 0 50 GFAA CN(C(=O)CCCN1CCCC1=O)[C@H]1CCCN(CCCc2ccccc2)C1 12300441 QUHBPLRFIQGTLW-NRFANRHFSA-N 385.552 2.945 0 50 GFAA CCCCn1c(CN2CCC(O)CC2)cnc1S(=O)(=O)CCCC(C)C 12444595 OYUISNQMGWBSOA-UHFFFAOYSA-N 385.574 2.850 0 50 GFAA CN(Cc1ccc2nonc2c1)C(=O)c1cn(Cc2ccccc2Cl)nn1 12705893 XYUMPWNWHUXTCX-UHFFFAOYSA-N 382.811 2.788 0 50 GFAA Cc1nonc1CC(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2)C1 12706524 LTBLRXFWPHMDTK-HXUWFJFHSA-N 390.434 2.713 0 50 GFAA CN1CCN(C(=O)CC[C@H]2CCCN(C(=O)CCCc3ccccc3)C2)CC1 15074290 FZZPIPGKWWAIAF-OAQYLSRUSA-N 385.552 2.802 0 50 GFAA CC(C)Cc1noc([C@@H]2CCCN(C(=O)CN3CC4(CCCC4)CC3=O)C2)n1 20295016 VBCFXPKQZGJJCN-MRXNPFEDSA-N 388.512 2.767 0 50 GFAA C[C@H](C(=O)Nc1ccccc1Br)n1c(=O)[nH]c2ccccc2c1=O 24985014 APZKQWJAIGYMPQ-SNVBAGLBSA-N 388.221 2.652 0 50 GFAA Cc1cc(C)n(-c2ccc(=O)n(CC(=O)Nc3cc(Cl)ccc3Cl)n2)n1 40284866 GOZUWRRSSMHXPS-UHFFFAOYSA-N 392.246 2.991 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)N1CCC[C@@H](OCc2ccccn2)C1 55090808 HYULMUYYFUWTSJ-MRXNPFEDSA-N 387.505 2.859 0 50 GFAA COc1cccc(C[C@@]2(CO)CCCN(c3ccc(-c4nccn4C)nn3)C2)c1 67834319 VVIGCLVXWGXQED-QFIPXVFZSA-N 393.491 2.707 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CCN(C)C3CCCC3)[nH]c2C1 67894583 FCQVTBPLVJAEAI-OAHLLOKOSA-N 382.508 2.905 0 50 GFAA C[C@@H]1CCc2n[nH]c(C(=O)N3CCC4(CC3)C(=O)N(C)c3ccccc34)c2C1 72145003 CLJVAPMPCBODPX-CQSZACIVSA-N 378.476 2.685 0 50 GFAA Cc1ncn(-c2cc(N3CCN(C(=O)c4c(F)cccc4F)CC3)ncn2)c1C 72436957 JLOZGRMKNXGMKM-UHFFFAOYSA-N 398.417 2.520 0 50 GFAA O=C(NCCCCN1CCCC1)[C@@H]1CCC(=O)N(Cc2ccccc2F)C1 91381723 FAHPWUGGMNZGQG-GOSISDBHSA-N 375.488 2.557 0 50 GFAA COCCCN1CC2(CCN(C(=O)CCCc3cccs3)CC2)CC1=O 95388246 SBCJPWNIBMKLAC-UHFFFAOYSA-N 378.538 2.948 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(Cc2ccccc2OC)CC1 96148686 KKRJTVAPWUPOEC-UHFFFAOYSA-N 380.496 2.931 0 50 GFAA CNC(=O)c1ccc(Cl)c(NC(=O)N2CCN(c3cccc(C)n3)CC2)c1 96150378 SSCZDIXUNQZFOX-UHFFFAOYSA-N 387.871 2.757 0 50 GFAA CNS(=O)(=O)c1ccccc1Nc1nc(Cl)ncc1Br 113691589 HCPLJTFWHJREKI-UHFFFAOYSA-N 377.651 2.544 0 50 GFAA CN1CCN(c2ccc(NC(=O)CCc3cccc(OC(C)(C)C)n3)nc2)CC1 124216998 VYEXWVNUBGWVEG-UHFFFAOYSA-N 397.523 2.977 0 50 GFAA CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)CC[C@H]1CCCCO1)CCC2 124260432 GVPJHNLYOWLZJM-MRXNPFEDSA-N 380.510 2.565 0 50 GFAA O=C(CCN1CCC(c2nnc3ccccn23)CC1)Nc1ccc2c(c1)OCO2 126625251 COQOPAQARCKMPG-UHFFFAOYSA-N 393.447 2.666 0 50 GFAA Cn1c(=O)oc2c(C(=O)NCC3CCN(Cc4cccs4)CC3)cccc21 161658852 FYPFMHFYHJZLEB-UHFFFAOYSA-N 385.489 2.835 0 50 GFAA CCn1nccc1C(=O)NCc1nnc2ccc(-c3ccc(C)c(C)c3)nn12 169778673 XZLVXMSIIGLSOH-UHFFFAOYSA-N 375.436 2.555 0 50 GFAA C[C@H](C(=O)N1CCC(n2cc(Cl)cn2)CC1)n1nnc(-c2ccccc2)n1 170593393 IXHSKGYMKXLFCL-CYBMUJFWSA-N 385.859 2.615 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2C[C@@H](N(C)C)Cc3ccccc32)nn1 179500227 BLTMLBKLMFLFDG-KRWDZBQOSA-N 379.439 2.848 0 50 GFAA O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccnc(OCC(F)F)c1 180954328 FRMGSBDMCVUJSC-AWEZNQCLSA-N 375.375 2.540 0 50 GFAA COc1ccccc1N1CCC(NC(=O)N(C)C[C@@H]2CCCC[C@@H]2O)CC1 182533760 JOYYZWQZVQLUFQ-LPHOPBHVSA-N 375.513 2.857 0 50 GFAA COc1ccc(CN2CCC[C@](O)(CO)C2)cc1OCc1ccccc1F 215632911 YKKWWDKIDWPDTM-OAQYLSRUSA-N 375.440 2.733 0 50 GFAA CC(C)(C)OC(=O)N1CC[C@H](NC(=O)CNC(=O)c2ccccc2)C(C)(C)C1 225769937 QQGIQKBTGSRJJR-INIZCTEOSA-N 389.496 2.568 0 50 GFAA O=C(NCCc1ccc2c(c1)OCO2)N(CCO)Cc1ccc(Cl)cc1 252492118 MDFHOLYSGJHVON-UHFFFAOYSA-N 376.840 2.815 0 50 GFAA COc1ccc(CCn2ccn3nc(-c4ccccc4)c(CO)c3c2=O)cc1 263619246 XRHUNXKXFASROA-UHFFFAOYSA-N 375.428 2.907 0 50 GFAA CC(C)(NS(C)(=O)=O)c1noc(-c2cc(-c3ccc(Cl)cc3)on2)n1 273894154 DHWCDMQMMQWDKV-UHFFFAOYSA-N 382.829 2.829 0 50 GFAA O=C(c1c[nH]nc1[C@H]1CCOC1)N1CCN(Cc2ccc(F)cc2Cl)CC1 275273165 JRJMDHGTISDBJM-AWEZNQCLSA-N 392.862 2.664 0 50 GFAA CC(C)CS(=O)(=O)N1CCC(NC(=O)C2(Cc3ccc(F)cc3)CC2)CC1 276205744 KQASOWAFUQAYLJ-UHFFFAOYSA-N 396.528 2.715 0 50 GFAA CC(C)(C)CCOc1cnccc1CNC(=O)C[C@H]1CCCS(=O)(=O)C1 294032608 OIJNUMNFDKOPKC-OAHLLOKOSA-N 382.526 2.728 0 50 GFAA Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N1CCC[C@@H]1C(=O)O 299741082 CPTKLDHZBKLIGU-CQSZACIVSA-N 396.369 2.521 0 50 GFAA CC1(C)CN(C(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 333113362 SPUUJVJIAZRCHJ-OZMCLOMFSA-N 378.513 2.704 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NCC(=O)Nc3ccccc3)C2)c1 363188461 KOQSGJWCGTUQCW-GOSISDBHSA-N 393.487 2.911 0 50 GFAA Cc1cc2cc(C(=O)N[C@@H]3CCN(Cc4c(C)noc4C)C[C@H]3O)ccc2o1 426465415 FWGNUVDOMKNORU-RTBURBONSA-N 383.448 2.711 0 50 GFAA O=C(CCN1CC[C@@]2(CCCN(CCC3CCCCC3)C2=O)C1)NC1CC1 426668506 XBZNEBIAYBVIMA-QFIPXVFZSA-N 375.557 2.940 0 50 GFAA C[C@@H]1CN(C(=O)NCCOc2ccc(F)c(Cl)c2)CC2(CCOCC2)O1 455207899 GRYABDVMLQFZJL-CYBMUJFWSA-N 386.851 2.837 0 50 GFAA Cc1ccc(CN2CCOC3(CCN(C(=O)CCc4cccnc4)CC3)C2)o1 825198053 OMISJOYDLPPBRC-UHFFFAOYSA-N 383.492 2.809 0 50 GFAA CC(C)c1noc([C@]23CCC[C@H]2CN(C(=O)Nc2nc4ccccn4n2)C3)n1 844610245 WYPMGTIHUQRROJ-DJJJIMSYSA-N 381.440 2.821 0 50 GFAA CCN(CCO)C(=O)Nc1ccc(S(=O)(=O)Nc2c(C)cccc2C)cc1 864097579 XATWFWFYYSYIEN-UHFFFAOYSA-N 391.493 2.950 0 50 GFAA O=C1C[C@@]2(CCCN(Cc3csc(C4CC4)n3)C2)N(C(=O)c2ccccc2)N1 888103725 WBWQJYJJRYNHHQ-OAQYLSRUSA-N 396.516 2.932 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N[C@H]4CC[C@H](N)C4)csc3C2)nc1 1565529497 VHQFAQMYGAZMHX-HOTGVXAUSA-N 384.549 2.873 0 50 GFAA CCC[C@@H]1COC[C@@H]2CN(Cc3cnc(-c4ccccc4OC)nc3)CCN21 1616075436 ULWAXFCWQHPIOI-MOPGFXCFSA-N 382.508 2.837 0 50 GFAA CC(C)N1C[C@@H](C(=O)N2CCC3(CC2)OCCc2ccsc23)CCC1=O 1704299719 RFGWZGXGLCZNSN-INIZCTEOSA-N 376.522 2.786 0 50 GFAA Cn1cc(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@@H](O)C2)c2ccccc21 1704302866 DRBALJNBTCMYDA-NZQKXSOJSA-N 392.455 2.699 0 50 GFAA CN1CCC[C@]2(C(=O)O)CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)C[C@@H]12 1704338529 FKHPLMRBKNEPTD-APWZRJJASA-N 375.856 2.832 0 50 GFAA COc1ccnc(CN2CCCN(C(=O)c3cccc4cccnc34)CC2)c1 1772702282 AYYZAXMVNUCXTA-UHFFFAOYSA-N 376.460 2.987 0 50 GFAA O=C(Cc1ccsc1)N1CCCN(C(=O)Cc2cc(F)ccc2F)CC1 1772711963 IKXXZGNCPIHLHY-UHFFFAOYSA-N 378.444 2.872 0 50 GFAA Cc1ccc(F)c(CN2C[C@@H](c3cncn3C)[C@H](CNC(=O)C3(C)CC3)C2)c1 1775962940 YTDWSNHCXQPJLF-QZTJIDSGSA-N 384.499 3.000 0 50 GFAA O=C(N[C@H]1C[C@@H](Cn2cccn2)C[C@@H]1O)c1ncc(C(F)(F)F)cc1Cl 1857531249 WOYSGGODGTXFOB-ICCXJUOJSA-N 388.777 2.520 0 50 GFAA COc1ccc([C@@H](O)C(=O)N2CCc3nn(C)c(-c4ccccc4)c3CC2)cc1 1857697275 NCOYFTPLEGOACJ-JOCHJYFZSA-N 391.471 2.757 0 50 GFAA COc1cc2nc(N3CCc4c(CC(N)=O)cccc4C3)sc2cc1OC 1875310244 KBRQYHTXWDJESX-UHFFFAOYSA-N 383.473 2.904 0 50 GFAA CN1CCc2ccc(C(=O)N3CCN(c4nsc5ccccc45)CC3)nc21 2100557378 QXBIPVQPDAJFLU-UHFFFAOYSA-N 379.489 2.646 0 50 GFAA CC(C)(CN1CCC(=O)N(C[C@]23CCC[C@H]2C3(F)F)C1=O)C(=O)N1CCCC1 2325783672 SPCQTPFDXPCALF-AUUYWEPGSA-N 397.466 2.725 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)[C@@H]3Cc4ccccc4S3(=O)=O)cc2)c1C 2325840838 STHJOUKXWJIWMV-IBGZPJMESA-N 381.457 2.826 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1CCC[C@@]12CCCN(Cc1ccccc1)C2=O 2356152401 HOGFELBNNMWZEQ-XMMPIXPASA-N 392.499 2.905 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2cnn(-c3cccc(Cl)c3)c2)CC[C@H]1O 2356155599 JMNWSXSPCOLASP-IEBWSBKVSA-N 377.872 2.963 0 50 GFAA CCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 1163102 BJCAJRDVAXCWHJ-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA COc1cc(-c2ccc(C(=O)NCCCn3nc(C)nc3C)cc2)c(=N)[nH]c1C 2356135652 NSGSWPRYLIIQAC-UHFFFAOYSA-N 394.479 2.507 0 50 GFAA CCN(CC)c1ccc(C(=O)N2CCC[C@@]3(CCc4c[nH]c(=N)nc43)C2)cc1 2356141422 AJOMOOHSXRNBPV-JOCHJYFZSA-N 379.508 2.856 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)N2CCC3(CC2)OCCc2sccc23)c1 2356151026 NEKIGECJCIYAOR-UHFFFAOYSA-N 391.514 2.856 0 50 GFAA COC(=O)c1sc2cc(NC(=S)NN3CCOCC3)ccc2c1Cl 2858235 SEOZKPSWLMWWHA-UHFFFAOYSA-N 385.898 2.875 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCCC(=O)N2[C@@H]1c1ccc(OC)c(OC)c1 4032057 HYHIGYMSTSNQSY-QGZVFWFLSA-N 390.461 2.917 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1=O 100635675 MBDWPUWOQANSFQ-BHWMQLMCSA-N 376.840 2.708 0 50 GFAA O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)N1CCOC2(CCOCC2)C1 134759881 RBJNSYQTLUNYJE-CQSZACIVSA-N 397.878 2.649 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCC(N(C)C)CC3)C2=O)cc1 67726559 HSSAHJKPKPTEBQ-QHCPKHFHSA-N 387.568 2.690 0 50 GFAA C[C@@H](NC(=O)c1cccnc1S)c1cc(F)ccc1N1CCC(O)CC1 128065229 VKFYUCNCVNBWBO-GFCCVEGCSA-N 375.469 2.962 0 50 GFAA CCOC(=O)COc1cc(NC(=O)CSCC(=O)O)c(Cl)cc1Cl 1397924 IABZKJPTTJZNSP-UHFFFAOYSA-N 396.248 2.692 0 50 GFAA CC(C)(C)NC(=O)CSC1=N[C@@](C)(c2ccc(Br)cc2)C(=O)N1 253400390 BDKNGNYJSHGZOH-INIZCTEOSA-N 398.326 2.798 0 50 GFAA Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1cnn(-c2ccc(O)nn2)c1C 479156029 CRGMQWUOUTUWJP-UHFFFAOYSA-N 394.435 2.832 0 50 GFAA O=C(O)C[C@@H](c1ccc(OC(F)(F)F)cc1)c1c(O)nc2ccccn2c1=O 218252553 JIPNPPZXAAGYGJ-LBPRGKRZSA-N 394.305 2.905 0 50 GFAA CC1(C)CN(C(=O)NCc2ccnc(-n3cccn3)c2)C[C@H](C(F)(F)F)O1 487813887 BWZKASIYYCRASH-CYBMUJFWSA-N 383.374 2.519 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3cccc(F)c3F)CC2)C1 71764164 RHXYMXMWNYHZML-MRXNPFEDSA-N 377.479 2.920 0 50 GFAA Cn1ncc(N2CC[C@H](CNc3ncc(C(F)(F)F)cc3Cl)C2)cc1=O 77406545 CYGNSJWJOAUUHR-SNVBAGLBSA-N 387.793 2.786 0 50 GFAA CCn1cc(C(=O)N2CCc3c(nc(-c4ccccc4)nc3N(C)C)C2)cn1 71416366 OSTQUFNEDKOIDC-UHFFFAOYSA-N 376.464 2.625 0 50 GFAA CCc1ncc(C(=O)N2CCC[C@@H](Cn3cc(-c4ccccc4)nn3)C2)cn1 48284522 XJVHLHYNWKUHMW-MRXNPFEDSA-N 376.464 2.850 0 50 GFAA CC(=O)c1ccc(N2CCN(CC(=O)Nc3cccc4nsnc34)CC2)cc1 19077191 DTWQBSSAVDBTGH-UHFFFAOYSA-N 395.488 2.655 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)NCc1ccc(N2CCCC2=O)cc1 426503422 FMGNNGDXPVJKLU-UHFFFAOYSA-N 381.480 2.757 0 50 GFAA Cn1cnnc1[C@H]1CCCN(C(=O)C2(Cc3cccc(F)c3)CCOCC2)C1 292848153 QYJQSGDRHHIASZ-KRWDZBQOSA-N 386.471 2.700 0 50 GFAA Cc1nncn1CCN1CCC[C@@H](CNC(=O)c2cccc3ccccc23)C1 95524428 CTVMGPSDZVYHMO-SFHVURJKSA-N 377.492 2.882 0 50 GFAA O=C([C@H](O)c1ccccc1)N1CCC(c2nccn2Cc2ccncc2)CC1 95526495 TXPQUPZUPVPMQP-HXUWFJFHSA-N 376.460 2.766 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@H]2CN(C2=NC=N[C@H]3c4cc(Cl)ccc4N[C@H]23)C1 148638425 TYFADLFYBVKNDX-QCQDVHPSSA-N 393.878 2.897 0 50 GFAA Cc1sc2ncnc(N[C@@H]3CCN(Cc4cscn4)C[C@H]3O)c2c1C 426598885 NGEFLUOYUWYQIL-ZIAGYGMSSA-N 375.523 2.812 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2c(C)nn(C)c2C)C3)cc1 95365671 NKKCQLOGNQJEHT-RBUKOAKNSA-N 382.508 2.782 0 50 GFAA CCn1ncc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(-n3cccn3)cc2)c1C 95505356 OEWUTPUSTXPQEP-IBGZPJMESA-N 392.463 2.640 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4csc(C)n4)C3)CCC2=O)cn1 95512145 SGNIWONUQJPRSN-FQEVSTJZSA-N 399.520 2.595 0 50 GFAA CC(C)Nc1cc(N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)ncn1 95372717 UJIKHEJLLLMDFH-QGZVFWFLSA-N 387.528 2.685 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N3CCCN(C4CCCC4)CC3)c(=O)[nH]2)cc1 91808200 PKUCIWKKTROMLF-UHFFFAOYSA-N 380.492 2.836 0 50 GFAA Cn1cccc1-c1cc(C(=O)N[C@H](CCn2cncn2)c2ccccc2)[nH]n1 91678563 GEAXHCUACBEVQD-MRXNPFEDSA-N 375.436 2.568 0 50 GFAA NC(=O)[C@H]1CCCN(CCCNC(=O)c2cccc(-c3ccc(F)cc3)c2)C1 299789383 YXHCVZBVZKBVAX-IBGZPJMESA-N 383.467 2.810 0 50 GFAA Cc1ccccc1[C@H]1CCN(CCNS(=O)(=O)CCOc2ccccc2)C1 670454107 QRAKKHWTWBQFSG-IBGZPJMESA-N 388.533 2.783 0 50 GFAA Cc1ncsc1C(=O)N[C@@H]1CCN(C(=O)c2cnoc2-c2ccccc2)C1 1875333689 HWWQLCLETLCGDX-CQSZACIVSA-N 382.445 2.751 0 50 GFAA COc1cc(C(=O)N[C@@H]2C[C@H](Cn3cccn3)C[C@H]2O)ccc1OC1CCCC1 1875403488 VENXKERMXMUPCA-KFKAGJAMSA-N 399.491 2.783 0 50 GFAA Cc1ccc(Br)c(CC(=O)NCCN2CCc3sccc3C2)n1 170600222 LTOLIYKRYQJMDO-UHFFFAOYSA-N 394.338 2.931 0 50 GFAA CN(C)[C@H](Cc1ccccc1)C(=O)N1CCC(C(=O)N2CCCCCC2)CC1 171606001 AHIVBKXTWQWSDH-OAQYLSRUSA-N 385.552 2.801 0 50 GFAA O=S(=O)(NC1CCCC1)[C@H]1CCCN(c2nc(C(F)(F)F)cs2)C1 302027314 AIKRYUXXXLLNGD-NSHDSACASA-N 383.461 2.993 0 50 GFAA CCCCN1CCOC[C@@H]1C(=O)NCc1cc2c(cc1OCC)C[C@@H](C)O2 225384966 UQGNSAJSJZETIZ-CRAIPNDOSA-N 376.497 2.526 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3ncccc3O)CC1)OCC2 1704301059 IHGHXVJLYHTVPI-UHFFFAOYSA-N 384.432 2.509 0 50 GFAA O=C(O)CC[C@@]12CN(CCOc3ccccc3)C[C@@H]1CN(Cc1ccccn1)C2 1772819201 QGQQDHPCYXJGSP-XXBNENTESA-N 395.503 2.759 0 50 GFAA Cc1cc(N(CC(=O)Nc2cccnc2)S(C)(=O)=O)ccc1Br 5050990 QADSVXDYAQDOFN-UHFFFAOYSA-N 398.282 2.557 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN([C@@H](C)COC)CC2)c(Cl)c1 12028057 JRLCXYZNRKTLQU-AWEZNQCLSA-N 384.904 2.594 0 50 GFAA COC(=O)c1ccc(C(=O)N[C@H]2CCCN(c3nc4ccccc4s3)C2)nc1 12754902 DYFKJIMVHMBCPF-AWEZNQCLSA-N 396.472 2.877 0 50 GFAA c1csc(CCN2CN(CCN3CCOCC3)c3nc4ccccc4n3C2)c1 13637778 FXZPMOGRWSAOER-UHFFFAOYSA-N 397.548 2.710 0 50 GFAA Cc1c(N/C=C2/C(=O)N(C)C(=O)c3ccccc32)c(=O)n(-c2ccccc2)n1C 18246000 OPRUTZFTQOJNMA-QGOAFFKASA-N 388.427 2.550 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857672350 AOXYUMWNNXUJEF-IBGZPJMESA-N 387.871 2.567 0 50 GFAA CCn1ccc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)cc1=O 1857727882 DNJXNNDUODIDON-WOJBJXKFSA-N 396.487 2.756 0 50 GFAA CCn1cc(CNC(=O)C[C@@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)cn1 1857739929 ZSRSTQFSJRPFJB-HNNXBMFYSA-N 397.479 2.976 0 50 GFAA CNC(=O)C1(NC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)CCCC1 751234686 CLZPUENNSRPCRV-UHFFFAOYSA-N 380.370 2.680 0 50 GFAA COc1cc2nc(N3CCN([C@H](C)c4cccnc4)CC3)nc(N)c2cc1OC 265099612 DKVGMFNUYKOJDU-CQSZACIVSA-N 394.479 2.507 0 50 GFAA NC(=O)COc1cccc(NC(=O)[C@@H]2CCCCN2Cc2ccc(F)cc2)c1 266968930 QWUVYJUUXDGXHW-IBGZPJMESA-N 385.439 2.683 0 50 GFAA C[C@@H]1CN(c2cccc3cnccc23)CCN1C(=O)c1ccc(CN(C)C)[nH]1 2325816597 GHDQQTLZAMVLTR-MRXNPFEDSA-N 377.492 2.975 0 50 GFAA O=C(NCc1c(F)ccc2nc[nH]c12)N1CCN(CCc2ccccc2)CC1 2325859766 JTYNRMSWTFTFCG-UHFFFAOYSA-N 381.455 2.772 0 50 GFAA C=CC(=O)Nc1cccc(C(=O)N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 869235289 BRCXNABHGRRADJ-RTWAWAEBSA-N 391.471 2.537 0 50 GFAA O=C(O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@@H]2CCCc3nn[nH]c32)CC1 910030925 ABCBGGYIGHLCBH-IAGOWNOFSA-N 382.464 2.722 0 50 GFAA COc1ccc(NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)c(OC)c1 857879 PPFHDBKSQFEUEY-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA C[C@@H](CC(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 917548 VYHDYKDBNROVOJ-INIZCTEOSA-N 388.489 2.840 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CC(c3ccc(OC)c(OC)c3)=NO2)cc1OC 4078335 YZDJXSFRXSZRSK-IBGZPJMESA-N 386.404 2.853 0 50 GFAA CCc1n[nH]c(SCC(=O)Nc2ccccc2I)n1 6697248 PMUPHWTZFXRGSK-UHFFFAOYSA-N 388.234 2.703 0 50 GFAA Cn1c(=O)n(C)c2cc(NC(=O)CSc3nnc(-c4ccccc4)o3)ccc21 10672579 KENHPVBKDVEGMP-UHFFFAOYSA-N 395.444 2.658 0 50 GFAA O=C(Nc1cccc(-c2ccc3c(c2)CCO3)c1)C(=O)N1CCC(C(=O)O)CC1 422652115 QOGHGYLWDISZEB-UHFFFAOYSA-N 394.427 2.550 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H](N3CCN(c4ccccc4C)CC3)C2)nc(C)n1 55369304 QUZQVYHSTGLIEY-FQEVSTJZSA-N 393.535 2.829 0 50 GFAA CCOC(=O)c1csc(CCNC(=O)CC(=O)Nc2cc(C)cc(C)c2)n1 55368797 VLLZXUICBACHFF-UHFFFAOYSA-N 389.477 2.624 0 50 GFAA COCc1cc(=O)[nH]c(-c2ccc(CN(C)Cc3cc(C4CC4)[nH]n3)cc2)n1 23619410 DPHRTOMXVCFELV-UHFFFAOYSA-N 379.464 2.816 0 50 GFAA CN1CCN(CCCNC(=O)c2cc(F)cc3[nH]cnc23)[C@@H](c2ccccc2)C1 229597264 PDFOFXVBWAHXPQ-HXUWFJFHSA-N 395.482 2.811 0 50 GFAA C[C@@H]1C(=O)[C@@H](C(=O)Nc2nc3ccccc3s2)C(=O)N1Cc1ccccc1 122035871 VTCDJGWJYSNJOQ-WBMJQRKESA-N 379.441 2.851 0 50 GFAA O=S(=O)(CCCOCc1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1 253426730 AQPQRDSCPFOFFW-NRFANRHFSA-N 388.533 2.787 0 50 GFAA Cc1noc([C@]2(O)CCN(S(=O)(=O)c3csc4ccc(Cl)cc34)C2)n1 328613807 UEQDZUVAPVMBQU-HNNXBMFYSA-N 399.881 2.528 0 50 GFAA Cn1cc(Br)c(C(=O)Nc2ccn(Cc3ccccc3F)n2)n1 2765075 LZYBQOSOBIUPMD-UHFFFAOYSA-N 378.205 2.819 0 50 GFAA CCC(CC)CN1CC2(CCN(C(=O)CN3CCC[C@@H](C)C3)CC2)OC1=O 77469774 NROHDOFEWVJKNZ-QGZVFWFLSA-N 379.545 2.968 0 50 GFAA Cc1ccc(F)c(NC(=O)C[C@H]2COCCN2C(=O)CCc2cccnc2)c1 72428521 XUHYYQOEECJNCZ-KRWDZBQOSA-N 385.439 2.718 0 50 GFAA CC(C)c1cc(C(=O)N[C@H]2CCCN(Cc3cccs3)C2)nc2ncnn12 215000480 XATCFFHEHAODQC-AWEZNQCLSA-N 384.509 2.704 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CCC[C@H](Cc2nnc3ccccn23)C1 373355401 VBRWXLHWLFAQFY-OAHLLOKOSA-N 391.475 2.804 0 50 GFAA COc1ccc(OC)c(N2C[C@H](C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@H]43)CC2=O)c1 245225405 UNOBQMYAIVCNDI-WGWJWQQSSA-N 398.503 2.998 0 50 GFAA CCCCN1CCN([C@H](C(=O)NCC2CCCCC2)c2ccccc2)C(=O)C1=O 77553517 ZYEIPVKWKXPGIY-FQEVSTJZSA-N 399.535 2.895 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1 131827328 BYQGFVJJVGMUGW-LJQANCHMSA-N 386.540 2.589 0 50 GFAA Cc1ccc(CN2CCOCC2)cc1NC(=O)c1c[nH]c2ccccc2c1=O 132123040 AAIBBNGSQMJSGA-UHFFFAOYSA-N 377.444 2.921 0 50 GFAA CCNC(=O)c1ccc(-c2cccc(C(=O)N[C@H]3CN4CCC3CC4)c2)s1 426394758 XJFNAJRZKNVEBB-KRWDZBQOSA-N 383.517 2.989 0 50 GFAA COc1ccccc1C1=NO[C@@H](C(=O)Nc2ncn(Cc3ccc(C)cc3)n2)C1 20601977 LOZRUVVSUNNKND-LJQANCHMSA-N 391.431 2.775 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3CCc4c(c(CO)nn4C)C3)c2)c1 220317090 PMAQXXDOOMPCCA-UHFFFAOYSA-N 377.444 2.787 0 50 GFAA O=C(c1cccc(-c2cc(NCCO)ncn2)c1)N1CCC[C@@H]1c1ccccc1 426641466 GRRSQXJCRFLZMQ-OAQYLSRUSA-N 388.471 3.525 0 50 GFAA COc1ccccc1N1CCN(CCc2nnc(S)n2-c2ccccc2)CC1 95307973 WBXZJENZPIWJRB-UHFFFAOYSA-N 395.532 2.929 0 50 GFAA Cc1cc(C)n(-c2cccc(CN(C)C(=O)c3cnc(C4CC4)[nH]c3=O)c2)n1 91858751 WXWXFKFWARPKHT-UHFFFAOYSA-N 377.448 2.722 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc4ccccc4n3)C[C@@H]2CCO)CC1 22913140 HFMKIIAXWUVUBW-QHCPKHFHSA-N 396.579 2.976 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1ccccc1N1CCOCC1)C2 95501622 MINCOWMXZNRYRW-MRXNPFEDSA-N 382.460 2.513 0 50 GFAA CCN(CCS(=O)(=O)c1ccc(C)cc1)C(=O)c1cccc(C(=O)O)c1 97766634 RQEKDLAYGGWAPB-UHFFFAOYSA-N 375.446 2.629 0 50 GFAA Cc1ccc(-c2nnc(CN3CCN(c4ccccc4Cl)C(=O)C3)o2)n1C 91657198 ITBNEBHQVMACMD-UHFFFAOYSA-N 385.855 2.886 0 50 GFAA CN(C)CCN1C[C@@]2(CCCN(C(=O)c3ccc4c(c3)CCC4)C2)CCC1=O 91779200 XBRUZLIRAVFBRP-HSZRJFAPSA-N 383.536 2.582 0 50 GFAA CN1CCN(C(=O)Nc2cn(C)nc2C2CCCCC2)C[C@H]1c1nccn1C 296697287 ANNLNQXBIRNSLC-KRWDZBQOSA-N 385.516 2.722 0 50 GFAA CN1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CC[C@H](c4ccccc4)C[C@@H]32)C1=O 248001728 APUVCZANMBRGLQ-XKDCRVNJSA-N 389.455 2.690 0 50 GFAA COc1ccc([C@@H](NC(=O)c2c(OC)ccc(F)c2F)[C@H]2C[C@H](O)C2)cn1 244716015 LGVUEMRPVLNUPT-SEDUGSJDSA-N 378.375 2.619 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)Cn3cc4ccccc4n3)CC2)cc1 531123139 SYHUBWQVMUNRJR-UHFFFAOYSA-N 376.460 2.766 0 50 GFAA Cc1cccc(CN2CCn3nnc(-c4nc(-c5ccccc5)no4)c3C2=O)c1 263618515 UDRRPZXOLLDERI-UHFFFAOYSA-N 386.415 2.960 0 50 GFAA CC1(C)C[C@H](CN2CCC(CNC(=O)CN3CCCCCC3)CC2)CCO1 827832310 XKBYEJMSNVBKFJ-HXUWFJFHSA-N 379.589 2.896 0 50 GFAA c1cn2c(-c3noc([C@H]4CCc5nnn(C6CCCC6)c5C4)n3)cnc2cn1 952892134 CCIWUVZVESLZNI-LBPRGKRZSA-N 376.424 2.758 0 50 GFAA O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CC[C@@](O)(c2cccc(C(F)(F)F)c2)C1 1875288814 FEEUPQAIISAMFR-QAPCUYQASA-N 394.397 2.589 0 50 GFAA O=C(CN[C@@H](CO)[C@H]1CCc2ccccc21)NCCc1nc2ccccc2s1 1875281509 FEPMONJFHAHUQH-HKUYNNGSSA-N 395.528 2.636 0 50 GFAA O=C(c1ccn2nncc2c1)N1CCC[C@H]1c1nc(Cc2ccc(F)cc2)no1 1875295269 VZLQIIGLIMHSBT-KRWDZBQOSA-N 392.394 2.820 0 50 GFAA O[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1NCc1cnc2cnccn12 1875398840 GUDFXIVWWRCDHB-PWIZWCRZSA-N 388.475 2.522 0 50 GFAA CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)N1CCc2c(O)nc(O)nc2C1 1875304095 ZUYCCYNXXQTQHE-KSSFIOAISA-N 382.464 2.915 0 50 GFAA O=C(Cc1ccccc1OC1CCCC1)N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O 1875400670 IJGXRCBETDZYTH-NSISKUIASA-N 383.492 2.703 0 50 GFAA CN(C)c1ccc(N[C@H]2CCCN(C(=O)[C@@H]3CCCc4n[nH]cc43)CC2)cn1 886055014 GSJWSCNZSLCCMN-DOTOQJQBSA-N 382.512 2.784 0 50 GFAA CN(Cc1nc(C(F)(F)F)cs1)C(=O)c1cccc(N2CCNC2=O)c1 1333784166 FZYNAYBTEUPVEY-UHFFFAOYSA-N 384.383 2.964 0 50 GFAA CCCCc1ccc(CN2CC[C@H](NC(=O)c3cc(C)on3)[C@@H](O)C2)s1 1565506431 IENMOMVZAUXNLR-WMZOPIPTSA-N 377.510 2.752 0 50 GFAA COc1ccc([C@H]2CN(C(=O)Cc3noc4ccccc34)C[C@@H]2N(C)C)cc1 1565531140 FIBVMLYFOZCBRO-QUCCMNQESA-N 379.460 2.935 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)[C@@H]1CC(c2cc(F)ccc2F)=NO1 170625821 PUSHAWHIXHUPPN-IBGZPJMESA-N 399.397 2.553 0 50 GFAA CCOC(=O)[C@](C)(NC(=O)CCc1ccc(OC)c(OC)c1)c1cccnc1 408516979 FAYMBBSISCEPFY-OAQYLSRUSA-N 386.448 2.626 0 50 GFAA CCOC(=O)c1nc(NS(=O)(=O)Cc2ccccc2F)sc1C(C)=O 225529866 NAHPGCYDNXXSMY-UHFFFAOYSA-N 386.426 2.603 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCO[C@H](C3CC3)C2)ccc1F 1704333668 CJUBMTIDEMQJKV-INIZCTEOSA-N 389.427 2.806 0 50 GFAA O=C(c1ccc(Cn2ccnc2)o1)N1C[C@@H]2CNC[C@@]2(CCc2ccccc2)C1 1772703150 GXNFPHPAVGWDRO-CVDCTZTESA-N 390.487 2.819 0 50 GFAA CN1C[C@@H](CN2CCC(C(=O)NCc3ccccc3Cl)CC2)CCC1=O 1772817354 NGLDBFNOGQMTTK-HNNXBMFYSA-N 377.916 2.537 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C2CCN(Cc3nc(-c4ccccc4)no3)CC2)C1 11843284 XWKNQGDMIUKBJS-GOSISDBHSA-N 398.507 2.976 0 50 GFAA CC(C)=CCC[C@H](C)CN1CCC(n2cc(C(=O)N3CCOCC3)nn2)CC1 12338030 DHKDVQRPEUVICI-SFHVURJKSA-N 389.544 2.770 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@H]1c1ccc(F)cc1 12382681 XJTOZJAEUQGOBW-NYUBLWNDSA-N 394.439 2.769 0 50 GFAA COC(=O)c1ccc(C(=O)Nc2ccc(C(=O)NC[C@@H]3CCCO3)cc2)cc1 12406062 VPDOHVOQXXRMLK-SFHVURJKSA-N 382.416 2.634 0 50 GFAA COc1ccc(-n2cc(CNCCNC(C)=O)c(-c3cccc(F)c3)n2)cc1 12594900 JWMKHEJGAPSCPX-UHFFFAOYSA-N 382.439 2.913 0 50 GFAA COc1cc(C[C@@]2(CCC(=O)NCCc3ccncc3)CCC(=O)N2)ccc1F 14982682 ORCVLQLCLDMQBX-JOCHJYFZSA-N 399.466 2.560 0 50 GFAA COc1cc(C(=O)N[C@@H]2CCOC2)ccc1OC1CCN(C2CCCC2)CC1 15074079 XVHXMSUQBQVIQN-QGZVFWFLSA-N 388.508 3.000 0 50 GFAA C[C@H]1CN(C2(C(=O)N(C)CC3CCOCC3)Cc3ccccc3C2)C[C@@H](C)O1 19299879 CIUZKQVFRULACG-HDICACEKSA-N 386.536 2.518 0 50 GFAA COc1cccc(CN2CCN(C(=O)c3cc4cc(OC)ccc4[nH]3)CC2=O)c1 19743499 HBWGMUWPJHFDON-UHFFFAOYSA-N 393.443 2.670 0 50 GFAA CCOc1ccc(CCCC(=O)N2C[C@@H]3CCOC[C@]3(C(=O)O)C2)cc1C 1857669648 FXGSRQMMKCSZBE-LAUBAEHRSA-N 375.465 2.666 0 50 GFAA COCCCCCC(=O)N1C[C@@H](C(=O)O)C2(CCN(CCC(C)C)CC2)C1 1857687419 WYWYEJXZTPBCTP-SFHVURJKSA-N 382.545 2.865 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4cnn(C)c4)C3)nc2c1 1857718836 VNDNSAHGMPPBSH-HNNXBMFYSA-N 397.479 2.535 0 50 GFAA Cc1ccc(Cl)cc1C(=O)N1CCO[C@@H](CN(C)C)[C@@H]1c1cnn(C)c1 1857721749 DLVAWUIOQIVRSR-ROUUACIJSA-N 376.888 2.526 0 50 GFAA Cc1nc2ccc(CC(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3ccccc3)cc2[nH]1 1857723405 FDGZLIHKJPVVGW-GMAHTHKFSA-N 392.503 2.944 0 50 GFAA CC(C)c1nnc(N2C[C@@H](C(=O)N3CCC(C(F)(F)F)CC3)CC2=O)s1 1857734289 OQHGGMRPPASZCS-JTQLQIEISA-N 390.431 2.815 0 50 GFAA O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cnn(Cc2ccccc2Cl)c1 238110266 JMAAQFOKWOEMDM-MRXNPFEDSA-N 391.855 2.681 0 50 GFAA CC(C)(C)C(=O)NC[C@@H]1CCCN(CC(=O)Nc2nnc(C(C)(C)C)s2)C1 137384441 IBPUKZDTZJLWFL-ZDUSSCGKSA-N 395.573 2.648 0 50 GFAA Cc1ccc(C=c2sc3nc([C@H]4COc5ccccc5O4)nn3c2=O)cc1 263630907 IOCWKEQWYWXZBP-MRXNPFEDSA-N 377.425 2.520 0 50 GFAA Cc1cc(C)c(S(=O)(=O)NCCc2scnc2C)c(C)c1CC(=O)O 391033679 AHVJXAVVHYWPGQ-UHFFFAOYSA-N 382.507 2.525 0 50 GFAA O=C([C@H]1CCCc2cc(-c3nn[nH]n3)ccc21)N1CCC([C@@H]2CCOC2)CC1 2325809778 KSFVXGUAOJORPG-MJGOQNOKSA-N 381.480 2.562 0 50 GFAA CC(=O)N[C@@H](CC(=O)N1CCCC[C@H]1c1cnc(=N)[nH]c1)c1ccc(C)cc1 2325879067 GQFQCQXRPBDZFH-OALUTQOASA-N 381.480 2.519 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)CC1 2325888439 SOJKGSYNOQDOLL-KRWDZBQOSA-N 380.847 2.804 0 50 GFAA COc1ccc(N([C@H](C)C(=O)Nc2cc(C)ccc2OC)S(C)(=O)=O)cc1 880175 SEORNKNZYGJHDY-CQSZACIVSA-N 392.477 2.805 0 50 GFAA CCn1ncc(Br)c1C(=O)Nc1sc2c(c1C(N)=O)CCCC2 1142220 QLGXSTGZHTUPBX-UHFFFAOYSA-N 397.298 2.957 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCC2=CCCCC2)C[C@H]1NC(=O)c1cn[nH]c1 2356152006 LXMOMCPKKCSPGX-QXAKKESOSA-N 388.512 2.720 0 50 GFAA CCc1ccc(N2C(=O)C[C@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 4317785 LEDKUPVYELOHHM-FQEVSTJZSA-N 379.460 2.830 0 50 GFAA CC(C)[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)CN1C(=O)NC(=O)C1(C)C 55155023 ZEJZTRYFHBWKQT-GOSISDBHSA-N 382.464 2.580 0 50 GFAA Cc1ccc2oc(-c3ccc(NC(=O)CN4C(=O)CNC4=O)c(C)c3)nc2c1 65373531 XZIVABBIFATADM-UHFFFAOYSA-N 378.388 2.602 0 50 GFAA O=C(CCc1nc(C2CCCC2)no1)N1CCC(c2nncn2C2CC2)CC1 136930629 BUCAEMGBAIMNAU-UHFFFAOYSA-N 384.484 2.992 0 50 GFAA O=C(NCc1ccco1)N1CCC2(CC1)c1ccccc1[C@@H](n1ccnc1)[C@@H]2O 20661180 GOZSSHBUXUFBCW-UXHICEINSA-N 392.459 2.683 0 50 GFAA NC(=O)c1cc(F)cc2c1C(=O)N(C1CCN(C3CCC(F)(F)CC3)CC1)C2 68248918 ARYVAQSYRLZVQD-UHFFFAOYSA-N 395.425 2.923 0 50 GFAA in-vitro O=c1c(Cl)c(NCC2(CO)COC2)cnn1-c1ccc(Cl)cc1Cl 120487435 ZGYVGUUSFDSKED-UHFFFAOYSA-N 390.654 2.614 0 50 GFAA c1ccc2oc(CN3CCC[C@H](c4n[nH]cc4CN4CCOCC4)C3)nc2c1 328656170 ZBOKRHLIPCPPMH-INIZCTEOSA-N 381.480 2.763 0 50 GFAA COc1cc(Cl)c(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)cc1Cl 328626918 MELYMSMRYDTHHJ-JTQLQIEISA-N 390.292 2.739 0 50 GFAA COCc1ccc(C(=O)N[C@@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)o1 12054655 ISJAWASDOFLASC-OAHLLOKOSA-N 376.840 2.653 0 50 GFAA O=C1CC[C@@]2(C(=O)N3CC[C@H](Oc4ccccn4)C3)Sc3ccccc3N12 330013764 AGKVPVWQJXUMKC-XOBRGWDASA-N 381.457 2.690 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)N[C@H]4CCCS(=O)(=O)C4)CC3)oc12 333287782 QVNMQSYEARVUCZ-HNNXBMFYSA-N 391.493 2.602 0 50 GFAA Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cn2C)C1 331853516 QYZBZUCSEZCHAQ-LLVKDONJSA-N 392.403 2.612 0 50 GFAA O=C(CCCn1cccn1)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72133217 MQRZLKGRDBZHOD-KSEOMHKRSA-N 382.483 2.891 0 50 GFAA Cc1ccc(C[C@@H](CO)CNc2ncnc3ccc(S(C)(=O)=O)cc23)cc1 242346811 ZJKFSJRKFHALLS-MRXNPFEDSA-N 385.489 2.605 0 50 GFAA Cn1nc(C(F)(F)F)c2cc(C(=O)NCCc3csc(N)n3)sc21 223823991 QYGJZNKCCYYBRP-UHFFFAOYSA-N 375.401 2.665 0 50 GFAA Cc1onc(-c2ccccc2Cl)c1C(=O)NCC1CCN(CCO)CC1 177835631 XGNLHQCSXXTWIM-UHFFFAOYSA-N 377.872 2.738 0 50 GFAA O=C(NCc1cccc(Cl)c1)[C@H]1[C@@H]2C(=O)N(Cc3ccco3)C[C@@]23C=C[C@H]1O3 226933095 SWPILLKACOCUKW-IKVWTGGYSA-N 398.846 2.531 0 50 GFAA Cc1nc([C@H]2CCCN(C(=O)NCc3cnn(-c4cccc(F)c4)c3)C2)no1 426523341 CSNGEOCNRFCPEI-HNNXBMFYSA-N 384.415 2.792 0 50 GFAA CCCNc1ncc(CN2C[C@H]3CC[C@@H]2CN(Cc2c(C)noc2C)C3)cn1 95379354 UQFJUASRWOGLFX-PKOBYXMFSA-N 384.528 3.000 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N1CC[C@@H](Cc2ccc(CO)cc2)C1 91441054 SEHLNSGPGMKQKO-SFHVURJKSA-N 375.490 2.749 0 50 GFAA O=C(N[C@H](c1ccccc1)c1ccncc1)N1CCC(N2CCOCC2)CC1 426405226 ZFGWJOOEUIIXOH-OAQYLSRUSA-N 380.492 2.677 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)c1cc(C(C)C)no1)CC2 91656665 GURMNGKAFDGTOU-UHFFFAOYSA-N 377.485 2.679 0 50 GFAA Cc1cnn([C@H](C)C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c1 91320432 SJOIQZOXPCHHEF-GOSISDBHSA-N 395.507 2.579 0 50 GFAA Cc1nc(CN2CCCC[C@H]2C(=O)Nc2cccc(-c3nnc(C)s3)c2)n[nH]1 95517354 IXZBVHYAEZYHCC-INIZCTEOSA-N 397.508 2.933 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC[C@@H](c3cccc(C(=O)O)c3)C2)cn1 95357273 FYWHOYCSTYPAKA-MRXNPFEDSA-N 377.466 2.560 0 50 GFAA O=C(CCC1CCN(C(=O)C2CC2)CC1)N[C@H]1CCN(Cc2ccccc2)C1 95513240 FQGWSXDQBPREQK-NRFANRHFSA-N 383.536 2.806 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)NCc4ccccc4F)c3CO2)cc1 263619052 WQNLCAODJWRYDR-GOSISDBHSA-N 382.395 2.627 0 50 GFAA CCOC(=O)N1CCC(NC(=O)[C@H]2C[C@@H](c3ccccc3)N3CCC[C@H]23)CC1 299769473 RRDBRICAQLBMQJ-ZCNNSNEGSA-N 385.508 2.949 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)[C@@H]1C[C@@H]2C=C[C@H]1C2 299763366 UYCLYPZSVYYVGZ-YDZRNGNQSA-N 395.503 2.564 0 50 GFAA COc1ccccc1-n1cc(CN2CCCN(C(=O)c3ccoc3)CC2)cn1 824835228 ZQWVFJRGVLRAIH-UHFFFAOYSA-N 380.448 2.822 0 50 GFAA COc1cc2nc(N3CCC(c4ccccc4CN)CC3)[nH]c(=N)c2cc1OC 1875341189 KDLQXVWEKQQMIK-UHFFFAOYSA-N 393.491 2.902 0 50 GFAA C[C@@H](NC(=O)N1CCC(S(C)(=O)=O)CC1)c1ncc(-c2ccc(F)cc2)o1 1875300526 GRBWUZQAYASLHD-GFCCVEGCSA-N 395.456 2.760 0 50 GFAA Cn1ncc(CN2CC[C@](c3nc(-c4cccc(F)c4)no3)(C(F)(F)F)C2)n1 952891475 DYTJYFUUXBCCQA-INIZCTEOSA-N 396.348 2.710 0 50 GFAA Cn1c([C@H]2CCc3c[nH]nc3C2)nnc1N1CCC(c2ncc(Cl)cn2)CC1 1875277019 WQSIVKJEPVHPRP-ZDUSSCGKSA-N 398.902 2.638 0 50 GFAA CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1csc(Cc2ccccc2)n1 1875263651 JPNJOQMRPFTPBM-KRWDZBQOSA-N 379.485 2.821 0 50 GFAA C[C@@H]1CN(c2nnc(-c3ccc(O)nn3)n2C[C@@H]2CCCO2)[C@H]2CCCC[C@H]12 1344667780 PYCNUCCPLRHEFC-DLTWYDFYSA-N 384.484 2.635 0 50 GFAA Cc1cc(C)c(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccc2)C3)c(O)n1 1565510131 RFKNTOBBJFVMMI-AEFFLSMTSA-N 379.460 2.781 0 50 GFAA C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CSC[C@@H]1C(=O)N(C)C 170620622 NNIVWWNTMOBJFI-NOZJJQNGSA-N 377.293 2.750 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)COc2ccc(Cl)cc2Cl)CC1 186655554 WKNALYLQLXOVJT-ZDUSSCGKSA-N 389.279 2.770 0 50 GFAA C[C@](O)(CNC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1)c1cccs1 172414968 TUEOSSUBMYYGBH-FQEVSTJZSA-N 390.480 2.763 0 50 GFAA COc1ccccc1-n1ncc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c1C 194795370 XMJZSWIVSZQVEB-GOSISDBHSA-N 398.507 2.516 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)[C@H](O)c2ccc3ccccc3c2)N1 1506423299 XMTUHMRFMYEZDV-RBBKRZOGSA-N 389.455 2.576 0 50 GFAA CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)c1[nH]nc(N)c1-c1ccccc1 1506401522 SLWJFJUYCMVDGO-SFHVURJKSA-N 375.476 2.788 0 50 GFAA CN1C(=O)[C@@H](CC(=O)Nc2c(-c3ccccc3)cnn2C(C)(C)C)N(C)C1=O 1529153725 UORIYHYVNXDEPE-OAHLLOKOSA-N 383.452 2.526 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)CCc2ccccc2)cc1OC 1529172435 LZMRHDBFYKTZGR-IFMALSPDSA-N 385.460 2.597 0 50 GFAA CN(C)Cc1ccc([C@H]2CCCN2c2nccc(N3CCC(O)CC3)n2)cc1 1529186106 VSJDVUQNVRGRTP-HXUWFJFHSA-N 381.524 2.841 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2C)CCCN(C(=O)c2cc(C(C)=O)n[nH]2)C1 11663875 UIOPCRVYUYLQBZ-JOCHJYFZSA-N 397.475 2.949 0 50 GFAA NC(=O)c1cncc(-c2cccc3c2O[C@H](CNC(=O)[C@H]2CC=CCC2)C3)c1 11975840 IADRQNVMYYYNGS-KSSFIOAISA-N 377.444 2.624 0 50 GFAA CC[C@@H]1CN(c2ccc(C(=O)NCCCn3ccnc3C(C)C)cn2)CCN1C 15077404 JTPNDLLOAGEEGG-LJQANCHMSA-N 398.555 2.752 0 50 GFAA CCOc1cc(=O)n2c(c1C(=O)NCc1cc(OC)ccc1OC)CCCC2 169752891 CVFVXHAHWUSXIP-UHFFFAOYSA-N 386.448 2.531 0 50 GFAA Cc1ccccc1CN1C[C@@H]2[C@H](CNC(=O)c3cscn3)[C@H]3CC[C@]2(C1)O3 1857710061 GDNRZOWJWYGOCU-GMLUQMLDSA-N 383.517 2.861 0 50 GFAA CC1=C(C(=O)OCC(Cl)(Cl)Cl)[C@@H](c2ccc(O)cc2)NC(=O)N1 1023163 RDZRAUZWYJKICO-LLVKDONJSA-N 379.627 2.934 0 50 GFAA C[C@@H]1C(=O)Nc2cc(C(=O)O[C@@H](Cn3cncn3)c3ccccc3)ccc2N1C 2325745743 UMWLUCHMJYXFIN-KUHUBIRLSA-N 391.431 2.653 0 50 GFAA CC[C@]1(C)C[C@H]1C(=O)N1CCN(CCNC(=O)C23CC(C(C)(C)C)(C2)C3)CC1 2325793794 IAVWTKZLWRQIMZ-BQOHFFKGSA-N 389.584 2.899 0 50 GFAA CCN(C[C@H](C)NC(=O)[C@@H]1C[C@@H]1F)C(=O)Cc1cc(Br)cs1 2325822315 QDEHLJQNYOPESL-BIMULSAOSA-N 391.306 2.764 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)N=[S@@](C)(=O)c2ccc(Br)cc2)C1 2325889350 LTMCCQOWKUGWTC-SPSFWMDKSA-N 399.310 2.857 0 50 GFAA Cc1ccccc1N(CC(=O)NCc1ccncc1)S(=O)(=O)c1ccccc1 875730 OKPUFISSQCTPJF-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA CN(C)S(=O)(=O)c1ccc2nc(NC(=O)COc3ccccc3)sc2c1 1121192 RYUZEVQNXLJFRA-UHFFFAOYSA-N 391.474 2.564 0 50 GFAA COC(=O)[C@H]1CC12CCN(C(=O)CCc1nc(-c3ccccc3C)no1)CC2 2356151261 AIXZTMVJOMKIAJ-MRXNPFEDSA-N 383.448 2.779 0 50 GFAA COc1ccc(-c2onc(N[C@H]3CCCN(C(=O)C4CC4)C3)c2C(=O)O)cc1 2356158857 CBXQPGITQUPRPT-AWEZNQCLSA-N 385.420 2.861 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cccc4cccnc34)C[C@H]2CCO)CC1 104385347 CFKRQYPJZJUFKM-HSZRJFAPSA-N 396.579 2.976 0 50 GFAA O=C(CN1CCC[C@@H](c2nnc[nH]2)C1)Nc1ccccc1C(=O)c1ccccc1 253393787 WGXLQZXDNLUPBH-QGZVFWFLSA-N 389.459 2.854 0 50 GFAA COCc1nc(-c2cccc(NC(=O)CC3(n4cccc4)CCOCC3)c2)n[nH]1 409414086 NKBFFIANZODENT-UHFFFAOYSA-N 395.463 2.954 0 50 GFAA CCCNC(=O)c1c(NC(=O)c2ccc(COCC(F)(F)F)cc2)cnn1C 2799682 AEXYNQZOAWELGW-UHFFFAOYSA-N 398.385 2.891 0 50 GFAA O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@]2(CN=C(O)C2)C1 329886923 WUKKSOFYBMADRS-IWKFTAFYSA-N 399.535 2.773 0 50 GFAA COCc1nc2ncc3c(=O)n(-c4ccc(Cl)c(Cl)c4)ccc3n2n1 71376192 BFLZDAYPKSSNCT-UHFFFAOYSA-N 376.203 2.882 0 50 GFAA CCN(CC)C(=O)SCC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 71787131 MQTJLGUACIHQDM-UHFFFAOYSA-N 376.482 2.618 0 50 GFAA COc1cc(OC)c([C@H](CC(=O)O)c2c(O)ccc(C(C)=O)c2O)cc1OC 217831086 MAKKLEZGSWAREZ-ZDUSSCGKSA-N 390.388 2.933 0 50 GFAA biogenic C[C@@]12CC3CC(C(=O)NCC4(N5CCOCC5)CCOCC4)(C1)C[C@](C)(C3)C2 333774152 SNEWWVCFZFMIFK-IZQOUKSCSA-N 390.568 2.981 0 50 GFAA Clc1ccc(OCc2nc(CNCc3nnc4n3CCOC4)cs2)cc1 372772319 KBVLVSRPEJNDCV-UHFFFAOYSA-N 391.884 2.787 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N[C@@H]3CCOC[C@H]3Oc3ccccn3)c2)n1 219440669 HZXXQQUEXHOEPU-WOJBJXKFSA-N 392.459 2.850 0 50 GFAA CC[C@H]1Oc2cc([C@H](C)NC(=O)N3CCOCC(F)(F)C3)ccc2NC1=O 378109858 FQIUJWHVUXBCBU-SMDDNHRTSA-N 383.395 2.534 0 50 GFAA O=C(c1cc(COc2cncc(Cl)c2)on1)N1CC(N2CCCCC2)C1 71314999 BCEAKWPJJIPDSS-UHFFFAOYSA-N 376.844 2.612 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)c(=O)[nH]1 72144079 KRXPQZDXKRWJGZ-XUVXKRRUSA-N 381.451 2.525 0 50 GFAA CN1C(=O)[C@](CCC(=O)N2CCC(O)CC2)(Cc2ccccc2)c2ccccc21 71745400 IMRGKRBXNVFDIQ-XMMPIXPASA-N 392.499 2.907 0 50 GFAA Cc1cc(C)n(-c2cccc(NC(=O)N3CCN(C4CCOCC4)CC3)c2)n1 175630983 NGWYGQRPBUKLBK-UHFFFAOYSA-N 383.496 2.818 0 50 GFAA CCc1nn2c(nnc3c(=O)n(CCCN(C)C)ccc32)c1-c1ccccc1 40388323 WLRBCSMWSPSNGN-UHFFFAOYSA-N 376.464 2.620 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(C(=O)c3cccnn3)CC2=O)cc1 82121460 ZKVSXYGGBDIRDX-FQEVSTJZSA-N 386.455 2.885 0 50 GFAA CN(Cc1noc2c1CCCC2)C(=O)CCCc1nc(-c2cccnc2)no1 426407552 MVBDPRDSUCXGFA-UHFFFAOYSA-N 381.436 2.980 0 50 GFAA Cc1nc(N)nc(C)c1CC(=O)N[C@H](C)c1cnn(-c2cccc(F)c2)c1C 92036825 PMAVCCHNOBLFPK-CYBMUJFWSA-N 382.443 2.729 0 50 GFAA O=C(NCCSc1cnn[nH]1)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 426595074 RZWZTZNPPVDGJI-ZDUSSCGKSA-N 391.888 2.973 0 50 GFAA NC1CCN(C(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)CC1 95508011 PVYDAHZMQGHDJR-UHFFFAOYSA-N 394.519 2.688 0 50 GFAA O=C1CCC2(CCN(CCn3cnc4ccccc43)CC2)CN1C[C@@H]1CCCO1 95370813 MJUDNDGYVRFUJU-IBGZPJMESA-N 396.535 2.920 0 50 GFAA CCn1ccnc1[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1 95517438 MJFUSRCOWGYSAY-CYBMUJFWSA-N 382.468 2.830 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@@H]3CC[C@@H]1[C@@H]32 248042634 OQPJCJPJPNWQBN-UOEZGSEPSA-N 379.504 2.873 0 50 GFAA Cc1nn(C(C)C)c(C)c1NC(=O)CC[C@H]1N=C(O)N(Cc2ccco2)C1=O 252570441 WTMUEOPPQTVYJM-OAHLLOKOSA-N 387.440 2.718 0 50 GFAA COc1ccccc1Oc1ccc(NC(=O)N2CCCN(C(C)=O)CC2)cn1 299795172 KSAKXJAQOYWDOW-UHFFFAOYSA-N 384.436 2.969 0 50 GFAA O=C(CN1C[C@@H](c2ccccc2)CC1=O)NCCOc1cccc2cccnc12 827831091 SNXMQSZCLIDIPE-IBGZPJMESA-N 389.455 2.746 0 50 GFAA C=CC(=O)N(C)CC(=O)N[C@@H]1CCN(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 860637301 SHXOGTRFXPFREH-APWZRJJASA-N 381.879 2.764 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N1CC[C@@H](C2CC2)[C@@H]1c1nnc(O)n1C 1875401946 WZQNAHCWTHVJPD-YVEFUNNKSA-N 381.436 2.624 0 50 GFAA O=C(OCc1nc2ccc(Cl)cc2n1CCO)c1nnc(O)c2ccccc12 952961799 HDWJCTUSXXTCJS-UHFFFAOYSA-N 398.806 2.688 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cccc4ccoc34)C2)c1C 1875397270 SXMZTEAVXFHLFL-GOSISDBHSA-N 393.491 2.910 0 50 GFAA O=C1NCCCN1CCCN=c1[nH]cncc1-c1ccc(Br)cc1 1875349521 ANUPEGNBENPXBC-UHFFFAOYSA-N 390.285 2.545 0 50 GFAA C[C@@H]1CCn2ncc(C(=O)N3CC[C@@H](Nc4cnc5ccccc5n4)C3)c2C1 1775988363 GZNDVMNBBRLLSL-HUUCEWRRSA-N 376.464 2.735 0 50 GFAA Cn1nnnc1-c1cccc(NC(=O)C2CCC(NC(=O)C(C)(C)C)CC2)c1 278987190 PRINZMNMKCFAHY-UHFFFAOYSA-N 384.484 2.537 0 50 GFAA COc1ccc(NCCc2nccs2)c2[nH]c(Br)nc(=N)c12 170614708 YBNPXBBGBBFHGM-UHFFFAOYSA-N 380.271 2.925 0 50 GFAA COc1cccc2c1OC[C@H](NC(=O)Nc1cc(C)nn1-c1ccccn1)C2 170875268 LYRJKNVKZFPKFT-OAHLLOKOSA-N 379.420 2.710 0 50 GFAA O=C(CCN1C(=O)CCc2ccccc21)Nc1cnn(Cc2ccncc2)c1 172345492 BZEMFWXCAOPIJX-UHFFFAOYSA-N 375.432 2.634 0 50 GFAA O=S1(=O)N=C(NC2CCN(Cc3ccc(F)c(F)c3)CC2)c2ccccc21 301072669 HTJGZMRHDPNJPY-UHFFFAOYSA-N 391.443 2.668 0 50 GFAA COc1ccccc1[C@@H](C)NC(=O)CN1C(=O)O[C@@]2(CCc3ccccc32)C1=O 225826042 DQLRNVXJVLULQW-JLCFBVMHSA-N 394.427 2.693 0 50 GFAA COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CCc2cnccc21 190755492 FCEFMMZPOCWUCT-GFCCVEGCSA-N 382.869 2.900 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC([C@H](O)c4cccs4)CC3)ccc2c1=O 1506426663 ITFFWJQBFNVYNN-SFHVURJKSA-N 383.473 2.581 0 50 GFAA CC(C)N(Cc1cnn(C)c1)C(=O)CCSc1nnc(-c2ccncc2)o1 1506399983 SEJJDZLYHUDQPZ-UHFFFAOYSA-N 386.481 2.785 0 50 GFAA Nc1ncc(C(=O)N(Cc2ccccn2)C[C@H]2CCCO2)c(-c2ccccc2)n1 1506397044 OIOWJQSNSJHMEW-GOSISDBHSA-N 389.459 2.942 0 50 GFAA CNC(=O)Cn1cc(NC(=O)c2ccc(C(F)(F)F)cc2C(F)(F)F)cn1 1529191706 CMBDPPPHMWSOQQ-UHFFFAOYSA-N 394.275 2.919 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)N1C[C@@H]3CC[C@H](C1)[C@@H]3N)C2 1772807846 CJUIYXYVVJIJAM-UYAYXHRUSA-N 386.521 2.716 0 50 GFAA O=C(N[C@@H]1CCCN(CCc2ccccc2)C1)c1cccc(N2CCOCC2)c1 12315267 VZQQSBZGXQJHJT-JOCHJYFZSA-N 393.531 2.960 0 50 GFAA CCOCCOc1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)cc1 12406025 GJFPUZDMYLUYNY-UHFFFAOYSA-N 398.459 2.827 0 50 GFAA CCc1noc(C)c1C(=O)N[C@@H]1CC(=O)N(CCc2cccc(Cl)c2)C1 12576755 MIETUSANTOEBPA-OAHLLOKOSA-N 375.856 2.772 0 50 GFAA COc1ccc(CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1 19789294 MZASUZLPFQXWES-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA Cn1c(CN2CCOCC2)nnc1SCC(=O)Nc1ccc2ccccc2c1 19799064 DLASGWMMMUKUAW-UHFFFAOYSA-N 397.504 2.531 0 50 GFAA COc1cccc(N2CCN(C(=O)c3cn4c5c(cccc5c3=O)CC4)CC2)c1 19851522 PDXFUPPWGSWFAR-UHFFFAOYSA-N 389.455 2.529 0 50 GFAA COc1ccc([C@H]2Cn3nnc(-c4noc(-c5ccncc5)n4)c3CO2)cc1 169780302 YLTQZSNEIWJHAN-MRXNPFEDSA-N 376.376 2.670 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)CC2)O1 1857700924 CGUMHXXMBCNEGC-UXHICEINSA-N 383.492 2.856 0 50 GFAA CN(C)c1ccc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)cc1 1857732017 YEYUZWUCURCOMW-MZKRTTBSSA-N 391.471 2.667 0 50 GFAA NC1(C(=O)N2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)CCOCC1 498234994 PVKZPYFGSWNXQD-MRXNPFEDSA-N 390.528 2.796 0 50 GFAA CCOc1ccc(CN2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)cc1CO 1704326157 YXGANDKZXKDONN-HSZRJFAPSA-N 396.535 2.914 0 50 GFAA O=C1O[C@H](CSc2ncc(Cc3ccccc3)c(O)n2)CC12CCOCC2 2325787964 DQHRLKPTDRXPLZ-INIZCTEOSA-N 386.473 2.977 0 50 GFAA Cn1cc(-c2nc(C(=O)N[C@H]3CN(Cc4ccccc4)C(C)(C)C3)co2)cn1 2325857792 PCAOHYBKJPZWJL-QGZVFWFLSA-N 379.464 2.858 0 50 GFAA O=C(N=c1cc(-c2cccc3c2OCC3)[nH][nH]1)[C@H]1CCN(Cc2ccccc2)C1 2325859604 CVZGWSRCDGBBEO-SFHVURJKSA-N 388.471 2.894 0 50 GFAA NC(=O)[C@H](OC(=O)c1ccc2c(c1)COCC2)c1cccc(Br)c1 2325870668 JSFQKUXXXRXUEQ-MRXNPFEDSA-N 390.233 2.905 0 50 GFAA C[C@@H](Sc1nc(CC(=O)Nc2cc(C(F)(F)F)ccn2)cs1)C(N)=O 879421650 JIRPVAUPHAPIKC-SSDOTTSWSA-N 390.412 2.704 0 50 GFAA Cc1ccc(NC(=O)CCS(=O)(=O)c2cccc3nonc23)c(Cl)c1 3665127 JZRUDWNOJDAWJP-UHFFFAOYSA-N 379.825 2.987 0 50 GFAA O=C(NCc1cccc2ncnn12)[C@H]1CCc2sc(-c3ccncc3)nc2C1 2356160160 GGBTYXCOQJLBAU-AWEZNQCLSA-N 390.472 2.669 0 50 GFAA C[C@@H](c1ccccc1)N1C(=O)C[C@H](Nc2ccc(N3CCOCC3)cc2)C1=O 4317767 GRZHBPUNYRXKMH-JXFKEZNVSA-N 379.460 2.824 0 50 GFAA CCCCOc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)NCCCO)cc1 4755927 FYMLCVSOBUVMPP-XDJHFCHBSA-N 386.448 2.728 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)C1 136111175 HMXIASVYYSIJHR-CYBMUJFWSA-N 382.445 2.933 0 50 GFAA CN(C)CCOc1cc(CNC(=O)Nc2nn(C)cc2-c2ccccc2)ccn1 252487092 HSJZDMKWGGREQV-UHFFFAOYSA-N 394.479 2.744 0 50 GFAA CCn1nc(C)c(C(=O)N2CCc3nnc(CCc4ccccc4)n3CC2)c1C 67790540 FPLPQKZILXTYEP-UHFFFAOYSA-N 392.507 2.595 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)[C@H]2CC(Cc3cccc(F)c3)=NO2)C1 11787861 NZKWDACZBCHERY-VQIMIIECSA-N 389.471 2.620 0 50 GFAA CC(=O)Nc1ccccc1CC(=O)NCCCN1CCN(c2ccccc2)CC1 253433072 RKBKARGLFIFKQT-UHFFFAOYSA-N 394.519 2.516 0 50 GFAA CCn1cc(S(=O)(=O)Nc2ccn(Cc3c(F)cccc3Cl)n2)cn1 2804594 CXMLMOUFWBDNNH-UHFFFAOYSA-N 383.836 2.741 0 50 GFAA CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)[C@@H]1Cc2ccccc2N1C(C)=O 361324483 ATCOSEGLXBGCHK-NRFANRHFSA-N 393.487 2.715 0 50 GFAA CC(=O)N(CC(=O)O)[C@H]1CCCN(C(=O)C[C@@H](C)c2ccccc2F)CC1 328626111 DVCOZJRHDJKEIB-ZBFHGGJFSA-N 378.444 2.634 0 50 GFAA COc1ccc(C(C)(C)C(=O)NCc2ccnc(-n3cccn3)c2)cc1OC 132487441 QKXSDBGARPEPHP-UHFFFAOYSA-N 380.448 2.879 0 50 GFAA Cc1nc(C)n(C[C@H]2CN(C(=O)c3ccc(-c4csc(C)n4)cc3)CCO2)n1 333452536 MDGFNZVOJOCFHD-GOSISDBHSA-N 397.504 2.868 0 50 GFAA COc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 262497175 MVPKIPCCJGWPHB-UHFFFAOYSA-N 382.416 2.884 0 50 GFAA O=C(O)CN(C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1)C1CCOCC1 238113530 LNGFCNPXNKEYPC-UHFFFAOYSA-N 397.353 2.597 0 50 GFAA O=C([C@@H]1CCCN1C(=O)c1ccccc1O)N1CCC(c2ccccn2)CC1 378283937 DNGRKVFQMRRKER-IBGZPJMESA-N 379.460 2.798 0 50 GFAA CC(C)[C@@H](NC(=O)c1cnc(-c2ccccc2F)s1)C(=O)N1CCOCC1 175293129 VDFPGNJDEYCCMQ-MRXNPFEDSA-N 391.468 2.562 0 50 GFAA O=C([C@H]1COc2ccccc2O1)N(CCCn1ccnc1)Cc1ccncc1 216021531 KBTWXQPZEHAYHR-HXUWFJFHSA-N 378.432 2.537 0 50 GFAA Brc1ccc2nc(CN3CCN(C[C@@H]4CCOC4)CC3)oc2c1 241720787 QSHJARWXPJTCLN-ZDUSSCGKSA-N 380.286 2.744 0 50 GFAA Cc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)/C=C/c1cccc(Br)c1 177006132 IIYIYEOBYOIFAT-KGXGESDWSA-N 397.298 2.774 0 50 GFAA NC(=O)C1CCN(c2ncccc2CNc2cncc(-c3cccs3)n2)CC1 292772574 LXSCCMTZEGUVBA-UHFFFAOYSA-N 394.504 2.914 0 50 GFAA CSc1ccccc1NC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@@H]2OC(C)(C)O[C@@H]12 229990567 KUGGZXDTDOYROY-DRXUAVOGSA-N 395.477 2.744 0 50 GFAA COc1ccc(C2(C(=O)N3C[C@H](O)[C@@H](OC(C)C)C3)CCCC2)cc1OC 426422046 VFXCEZYOARLZNH-LPHOPBHVSA-N 377.481 2.512 0 50 GFAA O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CCn2nc(CO)cc2C1 221287742 BBKOTQIVBQVJTQ-UHFFFAOYSA-N 385.427 2.642 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(Cc2ccc(N(C)C)nc2)CC1 82148331 PPWDXCIODDAQJG-UHFFFAOYSA-N 385.464 2.654 0 50 GFAA O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(Cn2ccnc2)CC1 426495556 CMCFJWUUGIEBCE-NRFANRHFSA-N 381.524 2.969 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCc4cnn(C)c4)csc3C2)nc1 426599540 JOEQNOFMGMDEKD-UHFFFAOYSA-N 395.532 2.927 0 50 GFAA O=C([C@@H](O)c1ccccc1)N1CCC(c2nccn2Cc2cccnc2)CC1 91858242 YKHBLHNQNDOAEC-FQEVSTJZSA-N 376.460 2.766 0 50 GFAA Cc1cc(C(=O)N(C)C[C@@H]2CCCN(CCc3ccc(F)cc3)C2)cc(=O)[nH]1 95528547 OEIYBYHZQYRVAI-SFHVURJKSA-N 385.483 2.849 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cccc(N3CCCC3=O)c2)C[C@H]1c1ccccc1 91736352 QJTNACQIHVKZBU-RBUKOAKNSA-N 378.428 2.754 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1CCn2nc(Cc3ccccc3)cc2C1 97657199 AGIMTRNQAZWRGO-UHFFFAOYSA-N 377.492 2.799 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)c1cc(-c2ccccc2O)n[nH]1 91526528 BJLUHEYWVHOCOF-UHFFFAOYSA-N 384.823 2.596 0 50 GFAA CCOc1ccc(C(=O)N2CCC(NC(=O)c3cnn(CC(C)C)c3)CC2)cc1 182646985 OMRFQJHGQMGSAQ-UHFFFAOYSA-N 398.507 2.972 0 50 GFAA C[C@H](O)c1cccc(-c2cccc(C(=O)NCC(C)(C)N3CCOCC3)c2)n1 534649910 CJKOUDMAZLZWRU-INIZCTEOSA-N 383.492 2.643 0 50 GFAA Cc1nc(N)nc(-c2ccc(C(=O)N(C)CCn3ccnc3C)cc2)c1Cl 584891100 UZXULZUYXUROHI-UHFFFAOYSA-N 384.871 2.965 0 50 GFAA COc1ccc(Nc2cc(N3CCC[C@@H](c4nncn4C)C3)ncn2)c(OC)c1 271580609 DOVBTRIGWHVOFE-CQSZACIVSA-N 395.467 2.750 0 50 GFAA CN1C[C@@H]2CN(c3cc(-c4cccnc4)nc4ncnn34)C[C@@H]2[C@@H]1c1ccccc1 1875260717 WUEJVJZOQLWMIV-DXIQSLLYSA-N 397.486 2.925 0 50 GFAA Cc1csc(-c2cccc(S(=O)(=O)Nc3nnc(C4CC4)n3C)c2)n1 1875293198 GKTFOZVMHMHUJQ-UHFFFAOYSA-N 375.479 2.925 0 50 GFAA Cn1cc(C(=O)N2CC(=O)Nc3ccc(Cl)cc3[C@@H]2c2ccccc2F)nn1 1875340017 IGOYJSQRPBFNLV-SFHVURJKSA-N 399.813 2.792 0 50 GFAA CN1C(=O)N(C)C2(CCN(C(=O)C[C@H](c3ccccc3)c3ccco3)CC2)C1=O 952965097 BQSVRFHWUXDASD-QGZVFWFLSA-N 395.459 2.687 0 50 GFAA COc1cccc(OC(F)(F)F)c1CNC(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2 888101337 KWDPNRDYDWXHPX-OBJOEFQTSA-N 388.386 2.896 0 50 GFAA CN1CCN(CCOCCOc2ccc(Br)cc2Cl)CC1 19792512 QAPZAHBJVOOYBD-UHFFFAOYSA-N 377.710 2.745 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565506351 HVQVYMGODCDJKG-QAPCUYQASA-N 376.504 2.602 0 50 GFAA NC(=O)c1cnn2c(C(=O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@H]43)ccnc12 275244770 HIZBMVQIWJIVNY-KBAYOESNSA-N 389.459 2.627 0 50 GFAA O=C(c1ccccc1)N1CCCN([C@@H]2CCN(c3ccccc3F)C2=O)CC1 171821500 ZYRSTWMUAWEPMH-HXUWFJFHSA-N 381.451 2.779 0 50 GFAA C[C@@](CNC(=O)c1cccc(CN2CCCC2=O)c1)(C(=O)O)c1ccccc1 193079088 UOTPHACQQPSKLF-QFIPXVFZSA-N 380.444 2.581 0 50 GFAA CC(C)Sc1nnc(NC(=O)CCn2cnc3ccccc3c2=O)s1 1506399485 NNVVNKPEMGXOFM-UHFFFAOYSA-N 375.479 2.777 0 50 GFAA COc1cccc(F)c1C(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 1704312527 SUYMBKDDXYVLPR-OAQYLSRUSA-N 384.455 2.811 0 50 GFAA Cc1nn(CCO)cc1CN1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704302974 UMFZEOKLXRLXMD-UHFFFAOYSA-N 380.492 2.729 0 50 GFAA O=C(NCc1ccccc1C(F)(F)F)c1cc(CN2CCC[C@H](O)C2)on1 11818705 DWSKDXNMRGGBPH-ZDUSSCGKSA-N 383.370 2.580 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@H]2CCCN(C(=O)CCc3ccccc3)C2)nn1 12160065 ULBDJDAIPRJVLJ-IBGZPJMESA-N 397.523 2.632 0 50 GFAA Cc1cccn2cc(CNC(=O)[C@@H]3CCC(=O)N(Cc4ccccc4F)C3)nc12 12197056 AOUOYGABGILRIM-QGZVFWFLSA-N 394.450 2.837 0 50 GFAA Cc1cc(-c2ccnc(-n3ncc(C(=O)NC[C@H](C)O)c3C3CC3)n2)c(C)s1 12245133 SATSVXMFGUPWIB-NSHDSACASA-N 397.504 2.996 0 50 GFAA O=C(Cn1cccn1)N1CCc2[nH]nc(-c3ccc(C(F)(F)F)cc3)c2C1 12433737 VOIFULMBADASGK-UHFFFAOYSA-N 375.354 2.877 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)C(=O)c3cnc(C)cn3)C2)cc1 12478078 ZNFAEFHPWYGUBV-LJQANCHMSA-N 382.508 2.820 0 50 GFAA Cc1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)c3cnn4cccnc34)C2)o1 12744050 YBVDXEZREJCMGK-INIZCTEOSA-N 395.463 2.580 0 50 GFAA COCCN(Cc1cnn(C)c1)C[C@H]1CCCN(C2Cc3ccccc3C2)C1 12835974 GYCIGSGNSFXLDD-LJQANCHMSA-N 382.552 2.748 0 50 GFAA Cc1c(CN2CCC3(CC2)C(=O)N(C(C)C)C(=O)N3CCC(C)C)cnn1C 14530601 BPEYMCZCFRIUJU-UHFFFAOYSA-N 389.544 2.782 0 50 GFAA Cc1ccccc1C(=O)N1CCCC[C@@H]1CCn1cc(C(=O)NC2CC2)nn1 14994441 KUIGQXWBOUGSDM-QGZVFWFLSA-N 381.480 2.564 0 50 GFAA O=C(Nc1cccnc1)[C@@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860253 KTGXFRCYPBHWRV-OAHLLOKOSA-N 393.896 2.916 0 50 GFAA CC[C@@]1(CO)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1ccc(N2CCCCC2=O)cc1 1857679175 GZTLGSCZACOPCF-HQRMLTQVSA-N 392.521 2.518 0 50 GFAA O=C([C@H]1CC[C@H](c2ccccc2)N1)N1CCN(c2nc3ccccc3o2)CC1 1857710759 OGRIXWNQEFQDFR-IEBWSBKVSA-N 376.460 2.970 0 50 GFAA Cc1cccc(OCC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1857733278 CPUBHHDOUGFGGS-VIZSFHNOSA-N 392.455 2.675 0 50 GFAA Cc1nc(N2CC[C@H](O)[C@@](CO)(Cc3ccc(F)cc3)C2)c2sccc2n1 1857736433 PAAHRQNRQWJFIJ-PXNSSMCTSA-N 387.480 2.931 0 50 GFAA O=C(N[C@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)c1ccc2c[nH]nc2n1 1857738046 PDXOOTSIZSHMNH-XYJFISCASA-N 397.866 2.556 0 50 GFAA CNC[C@H]1CCCN(S(=O)(=O)c2ccc(Br)c(Cl)c2)C1 237318436 WWNSAIQMFCKKGV-SNVBAGLBSA-N 381.723 2.723 0 50 GFAA CCCOc1ccc(CNC(=O)c2cc(S(=O)(=O)NC)oc2C)c(C)c1 252492608 MQKPLDCSOMLBCV-UHFFFAOYSA-N 380.466 2.523 0 50 GFAA CCOc1ccc2nc(N3CCC(NCCc4nnc(C)[nH]4)CC3)nc(C)c2c1 20910623 FKRODPPZHYRSMJ-UHFFFAOYSA-N 395.511 2.565 0 50 GFAA COc1ccc(CC(=O)NCC2CCN(C(=O)c3ccccc3)CC2)cc1OC 152756621 ZOSNCZRVQZEKFJ-UHFFFAOYSA-N 396.487 2.915 0 50 GFAA Cc1cc(C)nc(Nc2ccc(Cl)c(C(=O)N(C)[C@@H]3CCN(C)C3=O)c2)n1 906758819 FKUCCBMSGRBPTQ-MRXNPFEDSA-N 387.871 2.793 0 50 GFAA COc1ccccc1C(=O)NC(C)(C)CNC(=O)[C@H](Cc1ccccc1)OC 2325879399 UCANJVSTSUTOGS-IBGZPJMESA-N 384.476 2.578 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)C3(c4cccc(F)c4)CCC3)ccc2N1 874889299 MHOQLLVDZXQKEL-UHFFFAOYSA-N 388.420 2.612 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1 900126 DQAMMYHOIHQTAH-UHFFFAOYSA-N 378.881 2.795 0 50 GFAA Cc1ccc(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c(C)c1 1128954 MYGVSCXQVPWBOK-LJQANCHMSA-N 379.460 2.884 0 50 GFAA NCc1cc(-c2cnc3c(N4CCOCC4)nccn23)cc(C(F)(F)F)c1 2356144105 JHMLSWZFRPGAOQ-UHFFFAOYSA-N 377.370 2.710 0 50 GFAA O=C(C1Cc2ccccc2C1)N1CCC[C@]12CCCN(Cc1ccccn1)C2=O 2356148980 CIBVMEXWQSCNGX-DEOSSOPVSA-N 389.499 2.980 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC[C@H]1O 2356154939 QKQRZSYBUMNBSI-DENIHFKCSA-N 394.475 2.834 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)N3CCC[C@@]4(CCc5c[nH]c(=N)nc54)C3)c2c1 2356156678 MHWFLIKEZWEQQO-JOCHJYFZSA-N 389.459 2.572 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Nc2ccc(OC)cc2C)C1=O 2356162795 KMIFTUTZPASNDL-FQEVSTJZSA-N 375.469 2.639 0 50 GFAA CSCC[C@H](C(=O)NCc1ccccc1F)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 247523456 MDPUBPNLSOIRQR-BFYDXBDKSA-N 392.496 2.739 0 50 GFAA COc1cccc(Nc2nc(N)nc(CN3CCN(c4ccccc4)CC3)n2)c1 54147157 VCJCYCRHDDQEFL-UHFFFAOYSA-N 391.479 2.528 0 50 GFAA CC(C)n1nnc(-c2ccc(C(=O)NC[C@H]3CCCN4CCCC[C@@H]34)cc2)n1 170613727 STNZFIIMNWEGQU-MOPGFXCFSA-N 382.512 2.915 0 50 GFAA CCCC(=O)Nc1cccc(C(=O)NCCSc2nnc(C)n2CC)c1 55253274 CHWNWOIWYTVOAF-UHFFFAOYSA-N 375.498 2.867 0 50 GFAA CSc1cccc(CN(C(C)C)S(=O)(=O)N2CCC(C(=O)O)CC2)c1 1506411356 QRYSGCCSARMSFG-UHFFFAOYSA-N 386.539 2.660 0 50 GFAA O=C(O)c1nn(CC2CC2)c2c1CN(C(=O)c1cccc3cnccc13)CC2 67757337 GSPSRXYXEBPSFP-UHFFFAOYSA-N 376.416 2.738 0 50 GFAA Cc1ccccc1-c1cn2c(C(=O)NCCc3nnc(N)s3)csc2n1 67773685 NYWZMCLTQPPXCP-UHFFFAOYSA-N 384.490 2.777 0 50 GFAA CN(Cc1ccc(-c2nc(O)cc(C(F)(F)F)n2)cc1)C[C@@H]1COCCO1 20861262 TXFXMGPQODKBEG-CQSZACIVSA-N 383.370 2.715 0 50 GFAA CCN(C[C@@H]1CCCO1)C(=O)CCc1nnc(CCc2ccccc2OC)o1 12596564 SVXNPHOZAGUWAX-KRWDZBQOSA-N 387.480 2.824 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@@H](CNC(=O)[C@H]2CCCCN2C)C3)n1 39461430 ASWPVLVKKWZZPD-DNVCBOLYSA-N 398.482 2.804 0 50 GFAA CN1CC2(CCN(Cc3c(-c4ccccc4)nc4ncccn34)CC2)OC1=O 72418841 BYVQWABXRCPEPC-UHFFFAOYSA-N 377.448 2.813 0 50 GFAA C1CC([C@@H]2COCCN(CC3(CN4CCOC[C@H](C5CCC5)C4)COC3)C2)C1 366499939 ZKGKPNNAAPOANQ-SZPZYZBQSA-N 392.584 2.500 0 50 GFAA NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cccc(C(=O)N2CCCCC2)c1 363526334 ALCVTLOKOJMVCT-NRFANRHFSA-N 377.488 2.725 0 50 GFAA C[C@@H](N)[C@H]1CCCN(C(=O)c2cccc(COc3ccccc3C(N)=O)c2)C1 237370202 LTYMWWLMUQOUNN-QAPCUYQASA-N 381.476 2.564 0 50 GFAA COc1cc(NC(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)ccn1 489825581 MXPCJAAIMZJSQC-OAHLLOKOSA-N 394.353 2.814 0 50 GFAA COc1ccc(-n2ccnc2CN2CCNC(=O)[C@@H]2c2cccc(F)c2)cc1 215157668 RMRPMFLMRUQRPH-FQEVSTJZSA-N 380.423 2.693 0 50 GFAA CC(C)NC(=O)C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72129470 SWDMZCFPIGXXRL-HXUWFJFHSA-N 381.476 2.694 0 50 GFAA COc1ccccc1N1CC[C@H](N(C)C2CCN(CC(F)(F)F)CC2)C1=O 452028031 BGIKICBBNCRXMZ-INIZCTEOSA-N 385.430 2.759 0 50 GFAA Cc1ccc2nc(CN(C)c3ncnc4c3CCN(C(=O)C3CC3)C4)[nH]c2c1 71762330 RJAHACFMRGFZBN-UHFFFAOYSA-N 376.464 2.592 0 50 GFAA C[C@H]1CCc2c(sc3nc(CCC(=O)NCC[C@H]4CCNC4)nc(O)c23)C1 262571222 HIBWUDCNEHCWDG-QWHCGFSZSA-N 388.537 2.570 0 50 GFAA CCOc1cc(CN2CCN(Cc3cccc(C)n3)[C@H](CCO)C2)ccc1OC 39551941 TVGQABIMUORSDG-OAQYLSRUSA-N 399.535 2.866 0 50 GFAA C[C@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCN(c2cnccn2)CC1 159034826 FHKTZEGGNGXLMM-CQSZACIVSA-N 384.871 2.987 0 50 GFAA CCc1nc(N)sc1C(=O)N1CCC(=O)N(Cc2ccccc2)[C@@H](CC)C1 71745434 CWCDSAQHAURKPZ-HNNXBMFYSA-N 386.521 2.941 0 50 GFAA Cc1cccc(C(=O)N2C[C@@H](C(=O)O)C[C@@H](C)C2)c1NC(=O)c1ccncc1 263398178 ZQKNDBZILDACMC-CJNGLKHVSA-N 381.432 2.825 0 50 GFAA O=C(NCCNC(=O)C(c1ccccc1)c1ccccc1)c1nc(C2CC2)no1 20509457 DBSPFZMMZOGNGY-UHFFFAOYSA-N 390.443 2.625 0 50 GFAA COC(=O)C[C@@H]1C(=O)N[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(Cl)cc1 239105240 ICHCNARBKJBGSA-RBSFLKMASA-N 379.844 2.547 0 50 GFAA O=C(c1cnc(-c2ccccn2)nc1O)N1CCCC[C@H]1CCn1cccn1 91706616 GQZRTVVUFNUGFI-HNNXBMFYSA-N 378.436 2.526 0 50 GFAA CC(=O)N[C@H](CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O)c1ccc(C)cc1 236720575 YLPJKYNZZUJIBR-WOJBJXKFSA-N 380.444 2.600 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(S(=O)(=O)N(C)CC)CC2)C1 91964529 FBSYFLOJXYAAHA-IBGZPJMESA-N 379.570 2.775 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3C4)CC2)CC1=O 91846271 JXPIKLCWPLXUCQ-FGTMMUONSA-N 383.492 2.845 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@H]2c2ccc(C(N)=O)s2)cc1N1CCNC1=O 23251770 LBOWDPRSMREYMP-AWEZNQCLSA-N 398.488 2.662 0 50 GFAA CC(C)c1nccn1Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)[nH]n1 23337699 OFUJUJNGMJQZLS-UHFFFAOYSA-N 384.528 2.868 0 50 GFAA COC[C@@]12CC[C@@H](N3CCOCC3)C[C@H]1CCN(CCCc1cccnc1)C2 95378452 YIUVFJJQBUDYGT-ZLNRFVROSA-N 387.568 2.854 0 50 GFAA Cc1cc2c(NC(=O)N3CCN(c4nc(C)cc(C)n4)CC3)cccc2nn1 96136339 RBFOMFQOTYITBK-UHFFFAOYSA-N 377.452 2.699 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1ccc(C(F)(F)F)nc1 181994322 JVBANTJSWWWTIR-CQSZACIVSA-N 399.438 2.995 0 50 GFAA COc1cncc([C@@H](NC(=O)c2cc(O)nc3ccccc23)[C@H]2C[C@H](O)C2)c1 253535176 GLOWASVPCGYIQD-SIFORAMQSA-N 379.416 2.586 0 50 GFAA Cc1cccc(C[C@H](CNC(=O)[C@@H]2CC(=O)N(C)c3ccccc32)C(=O)O)c1 299749077 JDLDXBVQNZDHNO-SJLPKXTDSA-N 380.444 2.505 0 50 GFAA COc1cnc(C(=O)N[C@H](c2cnc3ccccc3c2)[C@H]2C[C@@H](O)C2)cc1O 253535677 LSNBGUDOYGDPLC-AGKSTNPPSA-N 379.416 2.586 0 50 GFAA CN(C)[C@@H](CNC(=O)c1cccc(-c2ccc(=O)n(C)n2)c1)c1cccs1 534592717 NGAHQSKCAOOJOA-KRWDZBQOSA-N 382.489 2.542 0 50 GFAA O=C(N[C@@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3)c1cc(Cl)ccc1F 670472856 LMZXPOORHVQYHN-YOMPXFNTSA-N 399.897 2.777 0 50 GFAA Cc1noc(C)c1COc1ccc(CN[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cc1 1875399574 DBRYHIUMZGHHSM-STZQEDGTSA-N 396.491 2.996 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N3CCOC[C@H]3C)c(Cl)c2)C1 1875371318 WWJRNYHYTOLMBX-HUUCEWRRSA-N 391.899 2.928 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)CCCn1cnc2ccccc21 1875401675 OMDXTOYTQJGULN-HNAYVOBHSA-N 394.479 2.650 0 50 GFAA O=c1cc(CN2CCCN(c3nc4ccc(Cl)cc4o3)CC2)[nH]c2ccnn12 1875281660 OMERANBAYGGPGZ-UHFFFAOYSA-N 398.854 2.530 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)NCCc1noc([C@@H]2CCCO2)n1 952974852 KQPGSUHRMQETTA-HNNXBMFYSA-N 384.461 2.946 0 50 GFAA O=C(O)[C@H]1[C@@H]2C[C@@H](O)[C@@H](C2)N1C(=O)OCC1c2ccccc2-c2ccccc21 1772716923 HGBIJTHKSWFLPI-MTBPISGOSA-N 379.412 2.844 0 50 GFAA Cc1ncc(-c2noc(C3CCN(c4nc5ccccc5o4)CC3)n2)c(N)n1 278124107 JRTWURWJDDUXOF-UHFFFAOYSA-N 377.408 2.942 0 50 GFAA O=C(C1CCC1)N1CC[C@@]2(O)CCN(Cc3cccc(OC(F)F)c3)C[C@H]2C1 1073273816 UWVAZUMRAQPABM-UWJYYQICSA-N 394.462 2.873 0 50 GFAA C[C@@H](Cn1cncn1)NC(=O)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 225454954 RRKSTEYBIQGHCN-ZDUSSCGKSA-N 399.838 2.867 0 50 GFAA CC(C)n1ncc2ccc(NC(=O)c3cccc(CN4C(=O)CNC4=O)c3)cc21 195367117 MBCHLSAAIXDMQG-UHFFFAOYSA-N 391.431 2.921 0 50 GFAA O=C1CC[C@H](N2CCCN(C(=O)C3CCC3)CC2)CCN1Cc1ccccc1 1258586668 GWMRHUHGMFOPPO-NRFANRHFSA-N 383.536 2.902 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC(N3CCc4ccccc4C3)CC2)c1C 1506418492 UEYAGEYWBGFWOE-UHFFFAOYSA-N 394.519 2.752 0 50 GFAA CC(C)C(=O)N1CCC(N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)CC1 1616077704 HTVZKKXTJYJNQZ-AVRDEDQJSA-N 381.520 2.717 0 50 GFAA C[C@H]1C(=O)N2CCC[C@@H]2CN1Cc1ccccc1CS(=O)(=O)c1ccccc1 1772708192 FMBYTKLWNLLHKB-FXAWDEMLSA-N 398.528 2.856 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCN(c3ccc(F)cc3)CC2)nn1 12194244 WWDPEEUZRZLPBP-UHFFFAOYSA-N 379.439 2.736 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(C3CCN(c4ccccc4)CC3)C2)CC1 12307541 QMSOULRWDVPGCR-NRFANRHFSA-N 398.595 2.922 0 50 GFAA CC(C)N(C)Cc1nnnn1CC(=O)N[C@@H](Cc1ccccc1)c1ccccc1 12573414 QCMMDTGHSYLFOI-FQEVSTJZSA-N 392.507 2.614 0 50 GFAA CSc1ccc(CN2CCC[C@H]2C(=O)Nc2cccc(-n3cnnn3)c2)cc1 12588118 AWOYXRGJPJVKAA-IBGZPJMESA-N 394.504 2.987 0 50 GFAA CCOC(=O)c1cnn(-c2cc(=O)n(C)c3ccccc23)c1CN(CC)CC 14977655 LAQJADPZWUWFFU-UHFFFAOYSA-N 382.464 2.743 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2C)CCCN(C(=O)CCCn2cncn2)C1 15070702 RMYWUZIWGWSZAA-QFIPXVFZSA-N 398.507 2.781 0 50 GFAA CCOC(=O)Oc1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)OCC)cc1OC 18094120 ZZLOGCRMHKLKPO-HNNXBMFYSA-N 394.449 2.586 0 50 GFAA CCCN1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)N1CCC(C(N)=O)CC1)C2 1857701837 RAJRKOFAZWNNNC-MIZPHKNDSA-N 383.536 2.586 0 50 GFAA Cc1cc(C(=O)N2CCC(C3CCN(Cc4[nH]cnc4C)CC3)CC2)n(C)n1 1857710375 UKIPEJOEYYZOIH-UHFFFAOYSA-N 384.528 2.524 0 50 GFAA CC(C)(C)[C@H]1CN(C(=O)c2cn3c(n2)CCNCC3)C[C@@H](c2ccccc2)O1 1857716024 SSQYSWJHCOPMSX-RBUKOAKNSA-N 382.508 2.657 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cnc(O)c(Cl)c2)[C@H]1c1ccccc1 1857722791 ODRLCWUQQMXJNE-IRXDYDNUSA-N 375.856 2.585 0 50 GFAA O=S(=O)(C1CC1)N1CCC2(CC1)OCCc1cc(-c3cnccn3)sc12 1857725269 ZGLZVRLZLUUNOE-UHFFFAOYSA-N 391.518 2.561 0 50 GFAA CC(=O)c1ccnc(N2C[C@@H]3[C@H](CNC(=O)CCC(C)C)[C@H]4CC[C@]3(C2)O4)c1 1857738383 FXLVJZAIJKFEHV-JZJXAQOMSA-N 385.508 2.820 0 50 GFAA O=C(CCN1C(=O)COc2ccccc21)NCc1ccnc(N2CCCCC2)c1 126747242 YOXHFIIRIXAHMM-UHFFFAOYSA-N 394.475 2.504 0 50 GFAA COc1ccccc1S(=O)(=O)N1CC[C@](C)(O)[C@H](Cc2ccccc2)C1 247912902 LEUPDWWLKXQZLD-XLIONFOSSA-N 375.490 2.700 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)s1 133876668 JUVSFFPFFNGXSF-LBPRGKRZSA-N 379.432 2.671 0 50 GFAA Cc1cccc(C(=O)N2CCCC[C@H]2CCn2cc(C(=O)NC3CC3)nn2)c1 19144522 SBKRBEMSTQHJAK-SFHVURJKSA-N 381.480 2.564 0 50 GFAA C[C@H]1CN(C(=O)CCC[S@@](=O)c2ccc(Br)cc2)C[C@@H](C)N1 154108074 OWVHGOAAYZVWDP-SASJJMKUSA-N 387.343 2.546 0 50 GFAA C[C@H](Oc1cccc(CO)c1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 162848087 LMXJTXVKSLBWGM-KRWDZBQOSA-N 396.487 2.615 0 50 GFAA O=C(CCN1C(=O)S/C(=C/c2ccc(Cl)cc2)C1=O)N1CCOCC1 1210204 PTGLJTVSQKBWAQ-SDNWHVSQSA-N 380.853 2.625 0 50 GFAA COc1cc([C@H]2N[C@@H](C(=O)O)Cc3c2[nH]c2ccccc32)cc(OC)c1OC 4012200 SAADZRJBOQGELC-CRAIPNDOSA-N 382.416 2.882 0 50 GFAA biogenic,in-vitro O=C(OC[C@@H]1CCCN2CCCC[C@H]12)c1cc2ncc(Br)cn2n1 4689289 JHZKYSMXDNEOKP-SWLSCSKDSA-N 393.285 2.913 0 50 GFAA CC[C@@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 4763997 ITQJMWBMKOWEGP-QFBILLFUSA-N 398.459 2.940 0 50 GFAA CN(C)CCNC(=O)[C@H](NC(=O)c1ccccc1)C12CC3CC(CC(C3)C1)C2 5073628 ACHXVCADWUHXDY-JNCPLXCYSA-N 383.536 2.679 0 50 GFAA COc1ccccc1C1=NO[C@@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)C1 6738333 GPFXTOLNSRMQHU-HXUWFJFHSA-N 383.423 2.676 0 50 GFAA Cc1ccccc1CNC(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12443290 ICHYAHSNUUANJW-FQEVSTJZSA-N 383.536 2.724 0 50 GFAA CNC(=O)c1nn(C)c2c1C[C@@H](NCc1nc(-c3ccccc3)cs1)CC2 14755574 HGBPFUCYWVMZPL-AWEZNQCLSA-N 381.505 2.550 0 50 GFAA Cc1ccccc1C[C@]1(CO)CCCN(C(=O)CN(C)Cc2ccncc2)C1 19812842 SHKCBEUFROCPHN-HSZRJFAPSA-N 381.520 2.666 0 50 GFAA O=C([C@H]1CCN(c2ccccc2)C1=O)N1CCN(C/C=C/c2ccccc2)CC1 20776496 HMBJDONOLCTCMF-HWWNHIDJSA-N 389.499 2.897 0 50 GFAA COc1ccc(-c2c3c(=O)n(Cc4ccccn4)ccc3nc3ncnn23)cc1 38828742 ICKVPLGYFDXLMO-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA Cc1cc(C)n(CCC(=O)N(Cc2ccccc2C)C[C@H]2CCCO2)c(=O)n1 55280784 KKJUVHYNSRPWGP-HXUWFJFHSA-N 383.492 2.766 0 50 GFAA COc1cncc(-c2cnn(CC(=O)Nc3ccn(Cc4ccccc4)n3)c2)c1 63883532 LESSFDQLTZZUGK-UHFFFAOYSA-N 388.431 2.837 0 50 GFAA Cn1nc(-c2ccccn2)c2c1NC(=O)C[C@H]2Cn1c(=O)oc2ccccc21 65383424 VXYTYRXQDFETGR-LBPRGKRZSA-N 375.388 2.516 0 50 GFAA O=C(CCn1cnnn1)N1CCOc2c(O)cc(-c3cccc(Cl)c3)cc2C1 67587316 QZKYHERUQJNMNG-UHFFFAOYSA-N 399.838 2.510 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)c4ccc(Cl)cc4)CC3)ncn2)n1 72119253 AKWQHNBIGKPOGI-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA O=C1CCC2(CCN(C(=O)NCc3ccco3)CC2)CN1Cc1cccnc1 91586036 HOXAMNHVNFDZMK-UHFFFAOYSA-N 382.464 2.789 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1C[C@H]2CC[C@@H]1CN(Cc1ccccc1)C2 95376114 WVKVOFYZVBBGDM-RBUKOAKNSA-N 375.476 2.774 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Cc3cn(C)c4ccccc34)C2)CCC1=O 95521650 LNNLTKOWNRHFLS-QHCPKHFHSA-N 397.519 2.598 0 50 GFAA CN(CC(=O)N1CCC(c2nccn2CC2CCC2)CC1)Cc1ccncc1 95525670 KBYKFJXACUIGKG-UHFFFAOYSA-N 381.524 2.916 0 50 GFAA CN(Cc1ccc2nsnc2c1)C(=O)CCc1nc2ccccc2[nH]c1=O 97698805 LHPUUGHMFVJEPB-UHFFFAOYSA-N 379.445 2.519 0 50 GFAA CCOc1ccccc1CN1CCN(C2CSCCSC2)C[C@H]1CCO 104466615 AWTBZQJRNNHZRM-GOSISDBHSA-N 396.622 2.803 0 50 GFAA CC(=O)N[C@@H]1CCCN(C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 118775742 GJCUQNWDDNNGJC-GFCCVEGCSA-N 392.809 2.683 0 50 GFAA COc1ccc([C@H]2Cn3nnc(-c4nc(-c5ccncc5)no4)c3CO2)cc1 169758342 JQFZMAUFNQYFMM-MRXNPFEDSA-N 376.376 2.670 0 50 GFAA COc1ccnc(N2CCN(C(=O)c3cnc4ccc(C)cc4c3O)CC2)c1 170594492 YJOCKPVSVBFRPE-UHFFFAOYSA-N 378.432 2.615 0 50 GFAA COc1ccc([C@@H](CNCc2cnn3ccccc23)N2CCOCC2)cc1OC 171761996 JPMUWJJVSZJGQZ-HXUWFJFHSA-N 396.491 2.515 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N2CC[C@](O)(C(F)(F)F)C2)CC1 175925147 SENWYYZQSAVFAZ-GOSISDBHSA-N 385.430 2.668 0 50 GFAA Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)NCc1ccc2[nH]c(=O)[nH]c2c1 184498052 HIGGDDDSYRGEKN-LJQANCHMSA-N 394.475 2.626 0 50 GFAA CN(C)S(=O)(=O)c1ccc(C(=O)NC2(c3ccc(F)cc3)CCCC2)cn1 185384126 UWZGVSBYHDJTHW-UHFFFAOYSA-N 391.468 2.670 0 50 GFAA O=C(c1cccc(N2CCCS2(=O)=O)c1)N1CCc2c(F)cc(F)cc21 192605607 RKUIKNITVZOAAF-UHFFFAOYSA-N 378.400 2.708 0 50 GFAA CC(C)[C@@H](NC(=O)Cn1cnc2ccccc2c1=O)c1nc2ccccc2n1C 223233267 SLHPGRWTBWCOIV-HXUWFJFHSA-N 389.459 2.797 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)c1ccc(Cl)cc1Cl 239432738 WGFHSIVDHDSQFC-JRNUYWEUSA-N 377.227 2.691 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)NCc2ccc3cc[nH]c3c2)CC1=O 244734583 NIHNZDKPWLIBKR-SFHVURJKSA-N 377.444 2.841 0 50 GFAA O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)Nc1nc(-c2cccs2)n[nH]1 252540352 PEJYLVLCZLZRIT-GFCCVEGCSA-N 396.432 2.652 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cc3ccccc3n2Cc2ccccc2F)CCO1 299752858 VUAQYFZQKCMZPZ-IBGZPJMESA-N 382.391 2.754 0 50 GFAA CO[C@@H]1C[C@@H](c2nncn2C)N(C(=O)N2CCC(Cc3ccccc3)CC2)C1 328938795 RQJPRHMHBZAQCU-MOPGFXCFSA-N 383.496 2.652 0 50 GFAA O=C1N[C@H]2CN(Cc3ccc(-c4ccccc4F)o3)CC[C@H]2N1C1CCNCC1 415143259 SLNRWKWWNHXFHO-VQTJNVASSA-N 398.482 2.806 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)c2ccc(-c3cc(N(C)C)ncn3)cc2)n1 426596666 WAQLPCDVCOJPMQ-OAHLLOKOSA-N 378.480 2.841 0 50 GFAA O=C(NCc1cc(C2CC2)n[nH]1)N1CCC(n2c(O)nc3ccccc32)CC1 426612592 RHSMUIIZAQICAW-UHFFFAOYSA-N 380.452 2.889 0 50 GFAA CCn1ncnc1CN1CCC[C@@H](CNC(=O)CCc2c[nH]c3ccccc23)C1 823609881 WNNXWAPDVAXHAL-KRWDZBQOSA-N 394.523 2.740 0 50 GFAA Cc1ccc([C@@H](C(=O)NCCn2nc(-c3ccccc3)ccc2=O)N(C)C)cc1 823649039 VDVHLNGQWMDJGR-QFIPXVFZSA-N 390.487 2.638 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)N[C@@H](C)c2ccccc2-n2cccn2)cc1 828157805 VUPITCZAPDEOFP-HNNXBMFYSA-N 387.447 2.707 0 50 GFAA COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](c1cccs1)C1(CO)CCC1)C2 855116481 HCOJKIUQIJKVAP-QSJFSLAZSA-N 392.521 2.935 0 50 GFAA C=CC(=O)N(CC)CC(=O)N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F 907921781 QJZWGWNTQVJQDT-ZDUSSCGKSA-N 378.778 2.543 0 50 GFAA COc1ccc2c(C)c(C(=O)N3C[C@@H]4CC[C@H]3CN(C(=O)N(C)C)C4)oc2c1 1073289981 APXPOHUZOPMAHJ-CABCVRRESA-N 385.464 2.968 0 50 GFAA Cc1cc(OC[C@H](O)CNc2cncc(C(=O)N3CCCC3)n2)ccc1Cl 1704280435 FBJXXIRXOPRCSR-CQSZACIVSA-N 390.871 2.526 0 50 GFAA O=C1CN(C(=O)C2(Nc3ccccc3)CCCC2)C[C@H](Cc2ccccc2)N1 1772706541 STSPFQQGVYXJMT-FQEVSTJZSA-N 377.488 2.981 0 50 GFAA COCC(=O)N1CCCC(=O)N2CCCC[C@H]2CCc2cccc(c2)OCC1 1857696726 NLPNLUNXRXBKLE-IBGZPJMESA-N 388.508 2.648 0 50 GFAA COc1cccc(OCc2nc([C@H]3CCn4ncnc4C3)n(C(C)(C)C)n2)c1 1857709436 XNONEONSPSHEIZ-AWEZNQCLSA-N 382.468 2.942 0 50 GFAA O=C(CCc1cc(O)no1)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857717693 UBKGCLWETTXZOV-SJLPKXTDSA-N 386.448 2.587 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCCCC(C)(C)CO)CC3=O)sc2c1 1857733949 HEFWDBXZVVYBSN-AWEZNQCLSA-N 389.521 2.873 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccccc2SCc2cn3ccccc3n2)CN1 1875252944 MVFTWTZDGKGDPR-AWEZNQCLSA-N 380.473 2.635 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCN(C)C[C@@H]1c1ccnn1C)c1cccc(-n2ccnc2)c1 1875267163 VBZRMHFTGYWFFO-DBVUQKKJSA-N 392.507 2.519 0 50 GFAA O=C1O[C@H](C(=O)NC2CCN(c3ccccn3)CC2)Cc2cc(Cl)ccc21 1875310470 QSACMSJWHOUBOF-KRWDZBQOSA-N 385.851 2.602 0 50 GFAA CC(C)C[C@](C)(CNc1ncnn2cccc12)NC(=O)C[C@H]1CC=CCN1C 1875327952 QUZTZFPEBDBFLI-DYESRHJHSA-N 384.528 2.713 0 50 GFAA COc1ccc(N2CCC[C@@H](NC(=O)[C@H](C)n3ccc(C4CC4)n3)C2=O)cc1 2325791087 RBSBVHUAYDMACT-IFXJQAMLSA-N 382.464 2.642 0 50 GFAA Cc1nc(CCN)sc1C(=O)N=c1ccn(-c2ccccc2C(F)(F)F)[nH]1 2325858149 ATAAHZFKFNTCSR-UHFFFAOYSA-N 395.410 2.831 0 50 GFAA CCN(CC(=O)NC1CCCC1)S(=O)(=O)c1ccc(Br)cc1 1066217 ZUYRPCQWAARGOF-UHFFFAOYSA-N 389.315 2.519 0 50 GFAA COc1ccccc1NC(=S)N[C@H](NC(=O)CF)C(Cl)(Cl)Cl 2905387 LOMQGCFEXKQJFX-JTQLQIEISA-N 388.679 2.764 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN(CC)S(=O)(=O)c2ccccc2)cc1 4867709 DEBSKOCVKQKUBI-UHFFFAOYSA-N 390.461 2.513 0 50 GFAA CC(=O)N1CCC(C(=O)Nc2sc3c(c2C(=O)NC2CC2)CCCC3)CC1 6731604 NSZLNENBXHTWJU-UHFFFAOYSA-N 389.521 2.716 0 50 GFAA O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1ccc(Cl)c(Cl)c1 55562764 SYYOYWPZWQTVKZ-UHFFFAOYSA-N 382.247 2.983 0 50 GFAA CN(c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1)C1CCCCC1 20777926 LPELJZUXZALWBP-UHFFFAOYSA-N 394.523 2.993 0 50 GFAA C[C@H]1CN(CC2CCN(CC(=O)N[C@H](C)[C@H]3C[C@H]4CC[C@H]3C4)CC2)C[C@@H](C)O1 251593507 FUZIDKSXUOOURP-HTCYUXSBSA-N 391.600 2.749 0 50 GFAA Cc1ccc2[nH]c([C@@H]3CCCN(C(=O)COc4ccc(C(N)=O)cc4)C3)nc2c1 120195013 WXVGIUYEPQDWJR-MRXNPFEDSA-N 392.459 2.755 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)CCc4ccccc4)CC3)ncn2)n1 67620607 MQDOWBHWIWRPCT-UHFFFAOYSA-N 390.491 2.561 0 50 GFAA Cc1nc(C(F)(F)F)nc(N2CCc3nnc([C@@H]4CCCO4)n3CC2)c1C 67757268 IBSQITKKWCYASX-LBPRGKRZSA-N 382.390 2.618 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(Cc3noc(C(C)C)n3)[nH]c2C1 67675019 MNDKXTASQTUFLM-GFCCVEGCSA-N 381.436 2.585 0 50 GFAA CO[C@H]1C[C@H](c2nc(C)no2)N(S(=O)(=O)/C=C/c2ccc(Cl)cc2)C1 328629779 PDVRBKSWKLKYQZ-MHKRFPNSSA-N 383.857 2.794 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)c1cnn(C)c1-n1cccc1 409413693 KGSLGCYRLICMDI-AZUAARDMSA-N 399.539 2.564 0 50 GFAA biogenic O=C1[C@@H](N2CCN(CCc3ccc4c(c3)CCO4)CC2)CCN1c1ccccc1 173739963 UARMHKMOYVCGGT-QFIPXVFZSA-N 391.515 2.587 0 50 GFAA O=C(NCc1ccccc1Cn1ccnc1)Nc1cnn(C[C@H]2CCCO2)c1 363435781 XAQVKWKSYTWMPK-LJQANCHMSA-N 380.452 2.629 0 50 GFAA Cc1cc2nc(C)c(CCC(=O)N[C@@H](C[S@@](C)=O)c3ccccc3)c(C)n2n1 174317211 WWCHRWAGILMWDA-HMILPKGGSA-N 398.532 2.823 0 50 GFAA CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2c(c1)nc(C(F)(F)F)n2[C@H](C)CO 452801935 VNJLOGDIQBCCPT-MEBBXXQBSA-N 398.385 2.558 0 50 GFAA C[C@@H](NC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1)[C@]1(C)CCCO1 239636959 BHUSKJQLELFQKN-IQWFGDOHSA-N 396.535 2.998 0 50 GFAA O=C1Nc2cc(F)ccc2[C@H]1CC(=O)N1CCc2nc[nH]c2[C@H]1c1ccncc1 32578184 KQVRREZSIMJBBS-FOIQADDNSA-N 391.406 2.544 0 50 GFAA Cc1cnc(C2CCN(C(=O)N[C@@H]3CCCN(c4cccnc4)C3=O)CC2)s1 372978894 JWYPDHWZJJLXJX-QGZVFWFLSA-N 399.520 2.931 0 50 GFAA O=C(N[C@@H]1CCOC[C@H]1OCc1cscn1)c1ccc(-c2cc[nH]n2)cc1 219710745 QLZLPKUYXCHCSO-QZTJIDSGSA-N 384.461 2.637 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N[C@@H]1CC[C@H](C(=O)NC2CCCCC2)C1 72409362 VYJIWRHLOJGXHT-DOTOQJQBSA-N 386.540 2.955 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2C(=O)[C@H](N)C(C)C 77440065 ITZPEEPPNSTKRZ-HFSMHLIXSA-N 393.487 2.662 0 50 GFAA C[C@H]1CN(Cc2ccccc2NC(=O)N2CCOCC(F)(F)C2)C[C@@H](C)O1 289573890 HEWMUHYZZMJNKK-GASCZTMLSA-N 383.439 2.795 0 50 GFAA O=C(NCCNC(=O)c1ccccc1Cl)N[C@H]1COC2(CCCCC2)C1 426634193 MJTXCUKDITXXEA-CQSZACIVSA-N 379.888 2.861 0 50 GFAA C[C@H](c1ccccc1)N(CCCO)C(=O)Nc1cccc(-c2nnn(C)n2)c1 426641476 VMQAQHJACRGWNP-OAHLLOKOSA-N 380.452 2.855 0 50 GFAA CC(C)(C)c1ccc(C(=O)c2c[nH]c(C(=O)NCCCN3CCOCC3)c2)cc1 20405044 XUIMAAKUCQGVHY-UHFFFAOYSA-N 397.519 2.995 0 50 GFAA Cc1ccnn1-c1ccccc1NC(=O)N1CCN(Cc2ccccn2)CC1 162616349 INMWRRTXBBFLRA-UHFFFAOYSA-N 376.464 2.925 0 50 GFAA CC(C)c1ccc(S(=O)(=O)N2CC[C@H](N(C)C)[C@H](CCC(=O)O)C2)cc1 91452753 VXJCTGHLVLTJPD-AEFFLSMTSA-N 382.526 2.616 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)N2CCCC[C@H]2c2nc(C)no2)n1 426443127 YXTCGHQIARNWDP-LBPRGKRZSA-N 398.389 2.975 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2cc(-c3ccc(O)cc3)n[nH]2)C[C@H]1c1ccccc1 92028931 NTQXAGYKIVHHPF-DLBZAZTESA-N 377.400 2.723 0 50 GFAA Cc1ccc(CN2CC[C@@H](N3CCC(N4CCOCC4)CC3)CCC2=O)cc1 91506395 HQIKDKLIMRXCSX-NRFANRHFSA-N 385.552 2.673 0 50 GFAA COc1ccc(CCN2CCC[C@H](CN(C)Cc3nc4ncccn4n3)C2)cc1 95531595 OTHWOBWSGWSQKV-LJQANCHMSA-N 394.523 2.519 0 50 GFAA O=C(N[C@@H](Cc1ccccn1)[C@H]1C[C@@H](O)C1)c1c[nH]nc1-c1cccc(F)c1 244707768 KHHMIWYMOWOWIO-YJLNNSPDSA-N 380.423 2.723 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@H]3CC[C@H]1[C@H]32 248042632 OQPJCJPJPNWQBN-RANSFOSJSA-N 379.504 2.873 0 50 GFAA COCc1nc(O)cc([C@H]2C[C@H](NC(=O)c3nc(-c4ccccc4)[nH]c3C)C2)n1 253535368 VQTJURRFXGETFT-SHTZXODSSA-N 393.447 2.703 0 50 GFAA CCNC(=O)c1ccc(NC(=O)N2CCC([C@H](O)c3ccccn3)CC2)cc1 299793028 IRWUHXVCOUMBCA-IBGZPJMESA-N 382.464 2.809 0 50 GFAA O=C(NCc1cc2n(n1)CCN(Cc1ccc3ncccc3c1)C2)C1CCC1 299800634 HYIPNUWDAPBACY-UHFFFAOYSA-N 375.476 2.863 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)c2cc(C)c3c(O)n[nH]c3n2)cn1 67447358 MANRCOOMHNLDDY-UHFFFAOYSA-N 390.403 2.793 0 50 GFAA C[C@H](O)c1cnc(CN2CCC(c3nccc(-c4cnn(C)c4)n3)CC2)s1 952891875 JSFXOIYETKUEBZ-ZDUSSCGKSA-N 384.509 2.767 0 50 GFAA c1cnn(Cc2ccc(-c3n[nH]c(-c4csc(N5CCOCC5)n4)n3)cc2)c1 1875279644 IVZKLFKSQGJSSX-UHFFFAOYSA-N 393.476 2.677 0 50 GFAA COc1cc2[nH]c(=NC(C)C)[nH]c(=NC3CCN(C(C)C)CC3)c2cc1OC 1875375626 GKPJHLNVPOUMKW-UHFFFAOYSA-N 387.528 2.596 0 50 GFAA O=C(N[C@@H]1CCCN(c2nc3ccccc3[nH]2)C1)c1ccc(=NCC2CC2)[nH]c1 1875316244 DCFBFTRIWBZVBD-QGZVFWFLSA-N 390.491 2.601 0 50 GFAA NC(=O)c1cn(CC(=O)N[C@H]2C[C@@H](COc3ccccc3)C2)c2ccccc12 1875308814 YVJAGAYNBRIKFB-IYBDPMFKSA-N 377.444 2.714 0 50 GFAA O=C(CCc1nc(-c2ccccn2)no1)Nc1ccc2c(c1)CCCC(=O)N2 171252390 FUTIJCXHMHKUDD-UHFFFAOYSA-N 377.404 2.978 0 50 GFAA Cc1c([C@H](C)NC(=O)CCc2n[nH]c3c2CCCC3)cnn1-c1ccccn1 91587096 VXHSGPNPCTWIEJ-AWEZNQCLSA-N 378.480 2.988 0 50 GFAA CC[C@H](NS(=O)(=O)c1cc(-c2cc(C)[nH]n2)sc1C)c1ccnn1C 1506427253 VQDSBSJZWZNSBM-LBPRGKRZSA-N 379.511 2.918 0 50 GFAA O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)NCCn1cnnn1 1465849002 KRRGSAIBEUYMGW-UHFFFAOYSA-N 396.401 2.849 0 50 GFAA COc1cccc(-n2cc(CNC(=O)c3cn(C4CCCCC4)nn3)cn2)c1 11753805 DXUZAXXLBVHZAO-UHFFFAOYSA-N 380.452 2.908 0 50 GFAA CCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1C[C@@H]1CCCN1CC 12035047 RKIFWXQTMMJXMZ-SFHVURJKSA-N 382.508 2.528 0 50 GFAA C[C@@H](CCN(C)CCn1cc(C(=O)NCc2ccncc2)nn1)c1ccccc1 12243401 CDWQIQYFOXNJDT-SFHVURJKSA-N 392.507 2.729 0 50 GFAA O=C(c1cccnc1)N1CCC(Oc2ccc(C(=O)N3CCCO3)cc2)CC1 12314974 ZHENCAKWNNZLHV-UHFFFAOYSA-N 381.432 2.543 0 50 GFAA O=C(c1cn(CCc2ccccc2)nn1)N1CCCC[C@H]1CCn1cccn1 12457966 UTTUSCQRXLBUTR-IBGZPJMESA-N 378.480 2.802 0 50 GFAA CC(C)CN1C[C@H](OCc2ccccc2F)CN(C(=O)c2ccco2)CC1=O 14531397 HUHMHRTWPNJFNE-KRWDZBQOSA-N 388.439 2.945 0 50 GFAA COc1ccccc1Cc1nc(-c2cccnc2N(C)C)n([C@H]2CCOC2)n1 1857683224 YLWAQRPTIQZVPC-INIZCTEOSA-N 379.464 2.967 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCc4c(C)n[nH]c4C)CC3=O)sc2c1 1857714580 XCBJIDAQGQRDMH-ZDUSSCGKSA-N 383.477 2.614 0 50 GFAA Cc1ccc2nc(CN3CC[C@H](O)[C@@](CO)(Cc4ccc(F)cc4)C3)cn2c1 1857732988 PSJQAHTVPBLCBN-UNMCSNQZSA-N 383.467 2.570 0 50 GFAA CS(=O)(=O)CCn1ccc(NC(=O)C2(c3cccc(Cl)c3)CCC2)n1 130267028 XRVSINPFUXTLHT-UHFFFAOYSA-N 381.885 2.642 0 50 GFAA O=C(c1cnc(O)c(Br)c1)N1C[C@@H]2C[C@H]1CN2Cc1ccccc1 913685419 PRLIJAQIBKHESK-GJZGRUSLSA-N 388.265 2.649 0 50 GFAA CC1=C(C(=O)OCCOc2ccccc2)[C@H](c2ccc3c(c2)OCO3)NC(=O)N1 4066366 HIDYYVSVSAZQJR-IBGZPJMESA-N 396.399 2.665 0 50 GFAA C[C@H](N)c1nc(-c2ccccc2)nn1CC(=O)N1CCCc2ccccc2C1 2100539654 RVXKWCPYDSBMIW-INIZCTEOSA-N 375.476 2.940 0 50 GFAA Cc1c(NC(=O)N2CC[C@](N)(c3ccccc3)C2)nnn1Cc1cccc(F)c1 2325773004 HGVOJAAKUMSXJU-OAQYLSRUSA-N 394.454 2.866 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)Nc2ccccc2OC)ccc1O 862484 WLRHUAJDQRNCDI-SFHVURJKSA-N 383.404 2.676 0 50 GFAA OCc1nc2ccccc2n1C[C@@H](O)COc1ccc(Br)cc1 888821 OHUKUWCSWOJBPX-CYBMUJFWSA-N 377.238 2.731 0 50 GFAA COc1ccc(OC)c(NC(=O)CSc2nnc(-c3ccncc3)n2C)c1 897223 HHOIMZLPDHPAHU-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA CCc1cc2c(=O)c(-c3ccc4c(c3)OCCO4)coc2cc1OCC(N)=O 1130582 NLOMMZFTAJIDOU-UHFFFAOYSA-N 381.384 2.658 0 50 GFAA biogenic O=C(c1cc2ccccc2oc1=O)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 4991366 DUIYTPNGYJSNEK-KRWDZBQOSA-N 397.452 2.623 0 50 GFAA CC[C@@H](CO)NCc1ccc(OCC(=O)N[C@H](C)c2ccccc2)c(OC)c1 5027776 AVRKSDIAESDLTH-APWZRJJASA-N 386.492 2.812 0 50 GFAA CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC(=O)c2ccco2)cc1 8830302 ALELAPFILLZPRJ-INIZCTEOSA-N 386.429 2.855 0 50 GFAA aggregator COc1cc(NC[C@@H](O)COc2ccc3c(C)cc(=O)oc3c2)cc(OC)c1 11866526 WFHQWBYMFWIZFK-OAHLLOKOSA-N 385.416 2.970 0 50 GFAA biogenic CCCN1CCC([C@@]2(C)NC(=O)N(Cc3cccc(OC)c3OC)C2=O)CC1 12003654 HSHYWXPJVNCWEY-OAQYLSRUSA-N 389.496 2.636 0 50 GFAA COc1ccc(CNCCc2cccnc2)cc1OC[C@H](O)CN1CCCCC1 12429767 WQEAWNLEYRYFRD-OAQYLSRUSA-N 399.535 2.648 0 50 GFAA O=C(c1ccco1)N1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)CC1 12444837 ZZWSHNUUZVXDHR-UHFFFAOYSA-N 394.431 2.747 0 50 GFAA Cc1nc2ccc(Cl)cn2c1CN1CCC(n2cc(C[C@@H](C)O)nn2)CC1 20821156 KCQRJDLWBHCAMF-CYBMUJFWSA-N 388.903 2.648 0 50 GFAA CCN(CC)CCN(C)[C@@H]1CCC(=O)N(CCOc2ccc(F)cc2)CC1 22912274 PCSYDQAPGDQVBJ-LJQANCHMSA-N 379.520 2.859 0 50 GFAA O=C(NCc1ccc(-n2cncn2)cc1)c1ccc(NC(=O)C2CCC2)cc1 55036815 LDFOGQYPSPSGRB-UHFFFAOYSA-N 375.432 2.936 0 50 GFAA CSc1ccc(C(=O)[C@@H]2CCCN(CC(=O)Nc3cn(C)nc3C)C2)cc1 71757006 LINSIRQSKQXLLI-MRXNPFEDSA-N 386.521 2.984 0 50 GFAA Cc1[nH][nH]c(=O)c1CC(=O)N[C@H]1CCCN(Cc2ccc(CC(C)C)cc2)C1 72161765 DLUYPLOLIDDLAG-IBGZPJMESA-N 384.524 2.533 0 50 GFAA COc1cccc(Cn2ncnc2-c2ccc(CN3CCN(C)CC3)cc2)c1 91725607 QQZFBXADBBBOCX-UHFFFAOYSA-N 377.492 2.749 0 50 GFAA CN1CCN(c2ncc(Cl)cc2C(F)(F)F)C[C@]12CCNC(=O)CC2 91872317 ZBIWFRFVZJIKCG-HNNXBMFYSA-N 376.810 2.545 0 50 GFAA O=C(Cc1cccc(O)c1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91908451 NDWGYAPBXSWBQY-UHFFFAOYSA-N 393.487 2.761 0 50 GFAA Cn1cc(Cl)cc1C(=O)N1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1 92097429 DZPLNJYCYKOOBF-MRXNPFEDSA-N 393.915 2.702 0 50 GFAA O=C1NC[C@@H](c2ccc(F)cc2)Cc2[nH]c(-c3nnc4n3CCCCC4)nc21 95362600 IKZSQRHIWVOQIX-ZDUSSCGKSA-N 380.427 2.603 0 50 GFAA CCCCn1ccnc1C1CCN(C(=O)C[C@@H]2CN(C(C)C)CCO2)CC1 95499608 AHVABQXDCMJIGM-LJQANCHMSA-N 376.545 2.889 0 50 GFAA Cn1cccc1C(=O)N1CCC(C(=O)Nc2cccc(-c3ccn[nH]3)c2)CC1 95529347 OJOWZOYTJMIZPP-UHFFFAOYSA-N 377.448 2.906 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)NC[C@H](CO)Cc2ccco2)cc1Cl 97553249 IYQLSQUDEKZDBV-GFCCVEGCSA-N 379.844 2.608 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1nc2ccccc2n1C 111098188 XFZGQVGFDCAUKG-FQEVSTJZSA-N 376.460 2.505 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccco1)c1cn(-c2ccccc2)nn1 155677659 UTLKHOUBOBALQZ-MAUKXSAKSA-N 393.447 2.732 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCN(c2cc(C)ccc2C)CC1 158369170 OXMKBLBCHSDZIX-HSZRJFAPSA-N 391.515 2.925 0 50 GFAA O=C([C@@H]1CC(=O)N(c2ccccc2Cl)C1)N1CCC(c2cnccn2)CC1 170607752 GCLOQUHILAZFFM-OAHLLOKOSA-N 384.867 2.889 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@@H](c3nc4cc(C)ccc4[nH]3)C2)cn1 192934151 OOPJMXMPDUTZQQ-CQSZACIVSA-N 386.477 2.843 0 50 GFAA Cc1cc(C(=O)N2CCC(OC3CCCC3)CC2)cc(S(N)(=O)=O)c1C 195407130 HTTNZHGVQGYPPK-UHFFFAOYSA-N 380.510 2.515 0 50 GFAA COC(=O)c1cc(S(N)(=O)=O)ccc1NC[C@@H]1[C@H]2CCc3ccccc3[C@H]21 230231467 FTYWNJYTBOLOBU-SZVBFZGTSA-N 386.473 2.509 0 50 GFAA CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 249131219 SLUKPRKCAOHYLX-QFBILLFUSA-N 379.520 2.879 0 50 GFAA COc1cccc(-c2ccc(C(=O)N[C@H]3C[C@@H](c4nnc(CO)n4C)C3)cc2)c1 252537684 MAKQASWKLMPRBE-HDICACEKSA-N 392.459 2.659 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)N(C)CCC(=O)O)cc2)c1 262904166 QRCQLMJPOLSMMC-UHFFFAOYSA-N 390.461 2.651 0 50 GFAA COc1ccc([C@H](O)Cn2ccn3nc(-c4cccc(OC)c4)cc3c2=O)cc1 263616399 ILRZOOWCBDEYSR-OAQYLSRUSA-N 391.427 2.914 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)NCCc4ccccc4)c3CO2)cc1 263619542 ZDRVKGZZJBXJSQ-IBGZPJMESA-N 378.432 2.531 0 50 GFAA O[C@H](COc1ccccc1F)CN1CCC[C@H](c2nnc3n2CCCCC3)C1 298685349 AWLHCNUZEWBXSA-IRXDYDNUSA-N 388.487 2.763 0 50 GFAA C[C@]1(C(=O)O)CCN(C(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)C1 299745036 QVWGOHJIJMSREM-IBGZPJMESA-N 382.445 2.933 0 50 GFAA Cc1ccc(C(C)C)c(OC(C)(C)C(=O)N2C[C@H](N(C)C)C[C@H]2C(=O)O)c1 299787224 PUTSPVYTOZAWFJ-WBVHZDCISA-N 376.497 2.892 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN([C@@H](C(=N)O)c2ccccc2)CC1 328632914 LOYKXKXXMKEUQS-VQTJNVASSA-N 381.480 2.956 0 50 GFAA Cc1ccc(-c2ncco2)cc1NC(=O)c1cccc(CN2C(=O)CNC2=O)c1 368432355 BMACUMDKYPCKJS-UHFFFAOYSA-N 390.399 2.954 0 50 GFAA COc1ccc2c(c1)CCC[C@@H]2CNS(=O)(=O)c1cccc2c1OCCO2 463863582 FJJUUECMYLVLMX-OAHLLOKOSA-N 389.473 2.865 0 50 GFAA O=C(NCCCc1nc2ccc(Cl)cc2[nH]1)c1ccc2c(c1)ncn2CCO 828777048 VRXBPMONNVCEIZ-UHFFFAOYSA-N 397.866 2.921 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 1506401633 FLGAGLBMWNKXCE-QGZVFWFLSA-N 399.878 2.894 0 50 GFAA CCCNC(=O)c1ccc(C)c(NC(=O)c2cc(C(C)C)n3ncnc3n2)c1 1506431636 SWGBKQJMLPJSIA-UHFFFAOYSA-N 380.452 2.948 0 50 GFAA O=C(c1cc(F)ccc1F)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565512883 YWGZNHKZNHMHGD-RISCZKNCSA-N 377.416 2.685 0 50 GFAA CN(CC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccc1)C2)c1ccccc1 1565526022 RWAGAZFPUGPSFP-NQIIRXRSSA-N 377.488 2.886 0 50 GFAA Cc1nc(N(C)C)nc(N2C[C@H](O)[C@H](Cc3ccnc4ccccc34)C2)c1C 1704299569 QZZQDNIDFDGUDK-XLIONFOSSA-N 377.492 2.747 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)Cc3cc(C)no3)CC1)OCC2 1704331721 UHZYLJMXAQTRHI-UHFFFAOYSA-N 386.448 2.633 0 50 GFAA O=C1CN(C(=O)c2ccc(N3CCCCC3)cc2)C[C@H](Cc2ccccc2)N1 1772708982 DLKFFAFWNXEANN-FQEVSTJZSA-N 377.488 2.860 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NCc3ccc(Br)cn3)nn(C)c21 1857531647 JPKFCJQUMRVAHC-ZJUUUORDSA-N 379.258 2.530 0 50 GFAA Cc1n[nH]c(C)c1-n1ccnc1-c1ccccc1OCC(=O)NC[C@H]1CCCO1 1857690304 GCOLWHMTKHVNIY-MRXNPFEDSA-N 395.463 2.553 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)C)O3)cc1OCCN 1857727818 BAELOAUYUNFXLY-RTBURBONSA-N 390.524 2.503 0 50 GFAA COc1ccc(N2C[C@H](C(=O)N3CC[C@@]4(C)[C@H](C3)C4(F)F)CC2=O)cc1OC 1875255901 FRCQVPQYNDVTSX-GFJSAUFNSA-N 394.418 2.560 0 50 GFAA CN(C[C@@H]1CCCO1)C(=O)c1ccccc1Cn1cc([C@@H](O)C(C)(C)C)nn1 1875316438 RAPXSBRHRWPURS-QFBILLFUSA-N 386.496 2.657 0 50 GFAA C=Cc1ccc(C(=O)N2CCN(C3CN(C(=O)[C@H]4CC[C@H](C)C4)C3)CC2)cc1 1875328548 XTRFBKGHKSVDMU-PXNSSMCTSA-N 381.520 2.734 0 50 GFAA C=CC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)c2snnc2C(C)C)C1 1875383315 OQWPWOWXHSQTAF-GSXCWMCISA-N 384.505 2.794 0 50 GFAA Cc1ccc2c(c1)OCCN2C(=O)c1nc(C)c(C)c(N2CC[C@@H](N(C)C)C2)n1 1875402090 BCEPIDWMLRXKOJ-QGZVFWFLSA-N 395.507 2.581 0 50 GFAA Cc1ccc(F)cc1C(=O)N[C@@H]1C[C@@H](C(=O)N2C[C@H]3CCC[C@H]3C2)CC[C@H]1O 1940196988 JYIIPOMXDITMGN-RHVZCBDQSA-N 388.483 2.652 0 50 GFAA Cc1n[nH]cc1-c1nc(C[C@H]2CCC(=O)N2)n(-c2ccnc3c(C)cccc23)n1 2100541122 WTGRGPZVGOLMDT-CQSZACIVSA-N 387.447 2.644 0 50 GFAA O=C(NCc1cccc(Oc2ccccc2F)c1)N[C@@H]1COC[C@@H]1n1ccnn1 2325769841 VOKOJVOCARDFOU-MSOLQXFVSA-N 397.410 2.649 0 50 GFAA CC(C)=C(C)C(=O)N1C[C@@H]2CN(C(=O)c3cc(-c4ccoc4)[nH]n3)C[C@]2(C)C1 2325873005 VDXMNPLIEHUPIC-IERDGZPVSA-N 382.464 2.947 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N[C@@H]2COc3cc(F)c(Br)cc32)C1 2325888283 CNGQREYGBVSDPP-IINYFYTJSA-N 397.244 2.563 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)c2cc(Cl)c(C)cc2OCC)CC1 644665 HKXQCVWNLXHJDR-UHFFFAOYSA-N 390.889 2.510 0 50 GFAA COc1ccccc1C(=O)C[C@]1(O)C(=O)Nc2ccc(Br)cc21 684549 JXIUVXZVYBQZAB-QGZVFWFLSA-N 376.206 2.870 0 50 GFAA CS(=O)(=O)N(Cc1ccccc1)c1ccccc1C(=O)NCc1ccccn1 839723 SELFRNLZSIHWAJ-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA CC(=O)N[C@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 939608 QBJRNRDKTIWXDN-SNVBAGLBSA-N 384.672 2.504 0 50 GFAA COc1cccc(N2C(=O)N(c3ccccc3Cl)[C@H]3CS(=O)(=O)C[C@@H]32)c1 1019178 QDGMBDNHDQYNFO-IRXDYDNUSA-N 392.864 2.961 0 50 GFAA CC(=O)N1CCN(c2ccccc2NC(=O)COc2cccc(C)c2C)CC1 4933419 JCYOPHKGGBKIOF-UHFFFAOYSA-N 381.476 2.989 0 50 GFAA COc1cccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCC[C@H](C)C2)c1O 55309075 GQXXGDJAUOOXOA-ZDUSSCGKSA-N 383.448 2.988 0 50 GFAA COc1ccc(OC)c(CN(C)Cc2nnc(SC)n2C[C@@H]2CCCO2)c1 55575375 XSKUAMHOOCYHBB-INIZCTEOSA-N 392.525 2.828 0 50 GFAA C[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2OC(F)F)[C@H](C)CO1 120345643 NVNIICVYLSKPBP-NFAWXSAZSA-N 382.407 2.528 0 50 GFAA Cc1cccc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c1 65362759 YNBMMBWPHLOJCN-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CC(=O)N1CCN(Cc2ccc3c(c2)CN(CCCC(F)(F)F)CCO3)CC1 11881137 JAYAKAISFLXXFC-UHFFFAOYSA-N 399.457 2.888 0 50 GFAA C[C@H](c1ccc(F)cc1)N(C)S(=O)(=O)c1cccc(C(=O)NCCF)c1 215856046 YNKYFIAPOJKVAD-CYBMUJFWSA-N 382.432 2.907 0 50 GFAA Cc1nnc(SCCCn2ccnc2-c2cc3n(n2)CCCNC3)s1 72425882 UIMRHYCTTXBFSW-UHFFFAOYSA-N 375.527 2.582 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 236586885 SGPVXEUUHMPDTF-RTWAWAEBSA-N 392.455 2.561 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3ccc(-n4ncc5ccccc54)cc3)C[C@H]21 284779359 LJSDEPXZPZUMTR-NHCUHLMSSA-N 391.475 2.962 0 50 GFAA CCc1nc(NC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)sc1C 174351578 LOOMCYJXQXNUED-LBPRGKRZSA-N 375.498 2.956 0 50 GFAA CCCc1nnc(SCC(=O)N2C[C@@H]3CCCC[C@]32c2ccccc2)n1N 365866092 LEMINWZXOFTFFD-JXFKEZNVSA-N 385.537 2.964 0 50 GFAA COc1cccc(-c2cnc([C@H]3CCCN3C(=O)c3cc4n(n3)CCO4)[nH]2)c1 368229716 UTPGDZBJBPDABT-QGZVFWFLSA-N 379.420 2.652 0 50 GFAA O=C(Nc1ccc2c(c1F)CCNC2)c1ccc(CS(=O)(=O)C(F)F)cc1 261720542 LMGRHUNZXDMFJN-UHFFFAOYSA-N 398.406 2.861 0 50 GFAA C[C@H](Oc1ccccc1)C(=O)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528542 UNCZCFJIIYYLAS-SFHVURJKSA-N 395.507 2.583 0 50 GFAA O=C(CCn1cc(Cl)cn1)N1CCN(c2nc3ccccc3s2)CC1 72409621 UMNXPCLESZULIK-UHFFFAOYSA-N 375.885 2.885 0 50 GFAA O=C(NCCc1csc(-c2cccnc2)n1)c1cn(-c2ccccc2)nn1 72164186 XEDACGRJSXRTCH-UHFFFAOYSA-N 376.445 2.758 0 50 GFAA CN(C)CCCN(C)C(=O)C[C@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71715359 GKWCYEQYQKXALS-DEOSSOPVSA-N 393.531 2.944 0 50 GFAA O=C1NCCN(C(=O)c2ccc3nccn3c2)[C@@H]1c1ccccc1C(F)(F)F 182566905 KEQCZCSDQPRXPW-MRXNPFEDSA-N 388.349 2.666 0 50 GFAA CC(C)c1cc(C(=O)N(C)Cc2cc(-c3cccnc3)no2)nc2ncnn12 91411221 QANZXGJTOXKWAW-UHFFFAOYSA-N 377.408 2.570 0 50 GFAA Cc1nc(-c2ncc(C(=O)N3CC(Oc4ccccc4F)C3)c(O)n2)cs1 96161145 AWXRXIFFZDHTRE-UHFFFAOYSA-N 386.408 2.657 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1cccc3cccnc13)CC2 91871288 QFWLHDCDTQPCLO-UHFFFAOYSA-N 375.476 2.967 0 50 GFAA COc1cc(NC(=O)CC[C@H]2CCCN(C(=O)c3ncc[nH]3)C2)cc(OC)c1 95519188 IEDPBDQOVAIRJU-CQSZACIVSA-N 386.452 2.698 0 50 GFAA CCc1nc(C)ccc1OCC(=O)N1CC[C@@H](Cc2cccc(C(N)=O)c2)C1 91426117 VBFSXFNBGQAYIT-KRWDZBQOSA-N 381.476 2.521 0 50 GFAA NC[C@H]1CCN(C(=O)c2ccc(OC3CCN(Cc4ccccn4)CC3)cc2)C1 95530424 JIGMSOWEUSOIHF-GOSISDBHSA-N 394.519 2.546 0 50 GFAA O=C(c1cccnc1)[C@H]1CCCN(C(=O)c2cc(-c3ccc(O)cc3)n[nH]2)C1 91893676 JHUVBHAQOKWIEV-INIZCTEOSA-N 376.416 2.912 0 50 GFAA C[C@H](CNC(=O)N1CCC(c2nc3ccccc3o2)CC1)CN1CCOCC1 163377809 XHRTVWIOYODLRH-MRXNPFEDSA-N 386.496 2.685 0 50 GFAA O=S(=O)(NC[C@@H]1CCCN(C2Cc3ccccc3C2)C1)c1cccs1 95500759 DHWARMUQMMIYMN-HNNXBMFYSA-N 376.547 2.906 0 50 GFAA COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H]2CCCN2[C@H]3C(=O)c2ccccc2)cc1 245311326 NMGOVUSWQPVCMX-LWYYNNOASA-N 390.439 2.530 0 50 GFAA O=C(Nc1cccnc1N1CCOCC1)N1CC[C@H](Oc2cccc(F)c2)C1 183505640 JJFAOEGPYHPWEU-KRWDZBQOSA-N 386.427 2.743 0 50 GFAA CC(C)C[C@H](C(=O)Nc1ccc(N2CCN(CCO)CC2)cc1)n1cccc1 253399679 DEZCGEZQNPAUQS-OAQYLSRUSA-N 384.524 2.828 0 50 GFAA CN(C)CC1(CNC(=O)N2CCn3c(nnc3-c3ccccc3)C2)CCCC1 185177270 NZLVRTDTXHAYFW-UHFFFAOYSA-N 382.512 2.592 0 50 GFAA CCn1cc(-c2ccc(C(=O)NCCS(=O)(=O)CC(C)C)cc2)c(C)n1 534662008 VAZVEXFLCZRGLU-UHFFFAOYSA-N 377.510 2.679 0 50 GFAA COc1cccc2c1OC[C@H](NS(=O)(=O)c1ccc(-c3cc(C)no3)o1)C2 824804788 MMTVYISJCFIWQI-CYBMUJFWSA-N 390.417 2.534 0 50 GFAA O=C(C1CC1)N1CCC[C@H](CNS(=O)(=O)Cc2ccc(Cl)cc2F)C1 670456197 AYWIDAGNGMAGFP-GFCCVEGCSA-N 388.892 2.547 0 50 GFAA Nc1ccc(C(=O)N2CCC(CNC(=O)c3cc(Cl)ccc3F)CC2)cn1 952974193 ZINZENPUWPBBFH-UHFFFAOYSA-N 390.846 2.739 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2cc(OC)c(OC)cc2OC)cc1C 952975778 ZYYWLXQHUCVQGV-UHFFFAOYSA-N 388.420 2.858 0 50 GFAA O=S(=O)(Cc1ccccc1F)N[C@H]1CCOC[C@@H]1OCc1ccccc1 1565530104 ICVHYSOSEJDOJX-OALUTQOASA-N 379.453 2.619 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2ccc(F)cc2Br)CC1 186663906 SPYIOZMYIUVXFG-LBPRGKRZSA-N 387.249 2.599 0 50 GFAA O=C(Nc1ccc(-n2cnc3ccccc32)nc1)[C@@H]1CC(c2cccnc2)=NO1 188057650 NKAHGXMDKSKMNM-IBGZPJMESA-N 384.399 2.947 0 50 GFAA CC[C@@H]1CCCN(C(C)(C)CNC(=O)Cc2csc(N3CCCC3=O)n2)C1 110974885 SAQVANGKDCHKOD-OAHLLOKOSA-N 392.569 2.829 0 50 GFAA COc1ccc([C@@H]2CC(c3cccc(O)c3OC)=NN2S(C)(=O)=O)cc1 225494640 FLOOAXCAXSYNBQ-INIZCTEOSA-N 376.434 2.520 0 50 GFAA CN(C)Cc1ccc([C@@H]2CCCN2C(=O)CCC(=O)Nc2nncs2)cc1 1506419494 CZBWKMGLZWLBPF-INIZCTEOSA-N 387.509 2.682 0 50 GFAA CCOc1ccccc1-c1nnc(NC(=O)CN2CCOc3ccccc3C2)o1 1529180565 KHNQKRTYOZXGNI-UHFFFAOYSA-N 394.431 2.968 0 50 GFAA CN(C)C(=O)c1ccc(CN2C[C@@H](O)[C@H](Cc3ccnc4ccccc34)C2)o1 1704297410 QPCOHRBCSRDAJW-OXQOHEQNSA-N 379.460 2.565 0 50 GFAA Cc1ccc(N2CN=c3s/c(=C\c4cccs4)c(=O)n3C2)cc1Cl 2237241 NZOHURZLGGLNSH-NVNXTCNLSA-N 375.906 2.817 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)NCc2ccccc2Cl)cc1 11844229 FIJXBRYQSBRNHZ-IBGZPJMESA-N 385.895 2.655 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC(CCC(=O)Nc2ccccc2)CC1 12076637 KNWWALTUSQXVIF-UHFFFAOYSA-N 375.469 2.780 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCCN(C(=O)Nc2ccc3c(c2)OCO3)C1 12308937 LVMUZPASNSLWFL-GOSISDBHSA-N 382.464 2.981 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)COc3ccc(OC)cc3)CC2)cc1 19787397 JYTCYSQDSPDFHH-UHFFFAOYSA-N 384.476 2.817 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)cn1)N1CC[C@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1857531282 DHNDATQPSGVVPZ-GDBMZVCRSA-N 398.854 2.963 0 50 GFAA O=C(c1nnc2n1CCCCC2)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857671286 CRYSTOMXNLDGFR-UHFFFAOYSA-N 376.464 2.636 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1Cl 1857682959 SDDXDUBCJVGHIO-IKDJWVMYSA-N 390.890 2.782 0 50 GFAA O=C(O)[C@@H]1CN(Cc2nccs2)CC12CCN(C(=O)CC1=CCCC1)CC2 1857685681 PJEYDDGOSNXRIN-INIZCTEOSA-N 389.521 2.769 0 50 GFAA COc1ccc([C@@H](NC(=O)Cn2nnc(Cc3ccc(C)cc3)n2)C2CC2)cc1 241942320 ULORQQNXUXIPGP-QFIPXVFZSA-N 391.475 2.848 0 50 GFAA O=S1(=O)CCCN1[C@H]1CCCN(Cc2ccc(OC(F)F)c(Cl)c2)C1 369314389 NCBUNHZVJWTXHW-ZDUSSCGKSA-N 394.871 2.941 0 50 GFAA O=C([C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1)N1CCOc2cc(O)ccc2C1 804572941 FZWNFUJDVPAUHJ-SFHVURJKSA-N 392.455 2.655 0 50 GFAA c1ccc(CN2CNC3=N[C@H](c4ccccn4)n4c(nc5ccccc54)N3C2)nc1 20101457 TXYKFICQMJMONQ-FQEVSTJZSA-N 396.458 2.570 0 50 GFAA Cc1c(C(=O)N[C@@H](C)C2=CCN(C)CC2)nnn1Cc1ccc2ncccc2c1 2325744999 GPWYICYJCRMIHX-HNNXBMFYSA-N 390.491 2.563 0 50 GFAA C[C@@H](CCNC(=O)c1ccc(-c2nc(=O)o[nH]2)s1)N(C)Cc1ccccc1 2325821853 GGPSLYQPNMPBCE-ZDUSSCGKSA-N 386.477 2.732 0 50 GFAA COCCn1c(-c2ccc3c(c2)C(=O)NC3)nnc1N1CC2(CCCC2)C[C@@H]1C 2325886003 FTSFPDNZJHFJAS-HNNXBMFYSA-N 395.507 2.994 0 50 GFAA COC(=O)c1ccc(NC(=O)C2CCN(C(=O)Cc3ccccc3)CC2)cc1 1163796 GSCOJVDCGSTGBC-UHFFFAOYSA-N 380.444 2.893 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(C=O)cc2Br)cc1 2142322 YEYFCBYBNAGGTE-UHFFFAOYSA-N 398.234 2.988 0 50 GFAA COc1ccc(N([C@@H]2C=CS(=O)(=O)C2)S(=O)(=O)c2ccc(C)cc2)cc1 4158651 GZDPKXVLZUMGHP-MRXNPFEDSA-N 393.486 2.510 0 50 GFAA CCC(=O)NC1=NC2=NC(c3ccccc3)=C[C@H](c3ccc(OC)cc3)N2N1 100486283 JCSJMXLBPAWZON-GOSISDBHSA-N 375.432 2.849 0 50 GFAA CC[C@H](C)C(=O)C(=O)NC[C@H]1Cc2c(F)ccc(-c3nc(C)cnc3C)c2O1 20449132 NUICAKHNYJKLNM-SMDDNHRTSA-N 385.439 2.934 0 50 GFAA CCOC(=O)CNc1ccccc1C(=O)NCc1ccc(-c2noc(C)n2)cc1 65463769 WRRCQXUUFACQLA-UHFFFAOYSA-N 394.431 2.950 0 50 GFAA O=C(Cc1c[nH]c2cc(Cl)ccc12)NC1CCN(C[C@@H]2CCOC2)CC1 136833661 VIIZMKBEDFLZSY-AWEZNQCLSA-N 375.900 2.981 0 50 GFAA CN(C[C@H]1CCc2nccn2C1)S(=O)(=O)c1ccc2c(c1)C(C)(C)C(O)=N2 328630675 QDSKQBFSYNDXQU-CYBMUJFWSA-N 388.493 2.645 0 50 GFAA CCc1cnc(N2CCC(n3nccc3NC(=O)c3cccnc3)CC2)nc1 67894827 CWIJMPREOMOZDG-UHFFFAOYSA-N 377.452 2.724 0 50 GFAA C[C@H](C(=O)NC1(c2cccc(F)c2)CCOCC1)n1nnc(-c2ccccc2)n1 173847089 PPIGUFAXWCPTDG-OAHLLOKOSA-N 395.438 2.862 0 50 GFAA CN1CCN(Cc2cccc(OCCCCN3CCOCC3)c2)CC1(C)C 216049800 RNQPVMIHDQNRGP-UHFFFAOYSA-N 375.557 2.704 0 50 GFAA O=C(CCc1nc(C2CCCC2)no1)N1CCC(CCN2CCOCC2)CC1 363871954 JLDNFRDFSBICTG-UHFFFAOYSA-N 390.528 2.621 0 50 GFAA CSc1cccc(NC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)c1 38726755 YIQBEGPXSPOXAB-UHFFFAOYSA-N 384.505 2.871 0 50 GFAA Cn1c(=O)cc(C(=O)N2CC[C@@H](c3ccc(C(=O)O)cc3)C2)c2ccccc21 72169880 AACDDKBNGNMTDA-MRXNPFEDSA-N 376.412 2.866 0 50 GFAA CCOC(=O)[C@@H]1CCCN([C@H]2CC(=O)N(c3ccc(C)c(Cl)c3)C2=O)C1 239284726 BYKXAKUZWOSQOI-CJNGLKHVSA-N 378.856 2.555 0 50 GFAA O=C(O)c1cc(-c2ccc3c(c2)OCCO3)cc(S(=O)(=O)N2CCCC2)c1 71764017 ONMGWAOCDTYXNA-UHFFFAOYSA-N 389.429 2.608 0 50 GFAA CN(C[C@@H]1CCOC1)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 176220673 GFMSVQOPWLSXEH-RDJZCZTQSA-N 385.430 2.958 0 50 GFAA Cn1nc(CNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)c(Cl)c1Cl 20607547 GRCQMCBPIHISKU-UHFFFAOYSA-N 396.200 2.747 0 50 GFAA Cc1ncc2c(c1-c1noc([C@H]3CCCN(c4ccccn4)C3)n1)CCNC2 20534752 YVYIYKOQYQMPEM-HNNXBMFYSA-N 376.464 2.865 0 50 GFAA CN1C[C@]2(CCN(C(=O)Nc3ccc(CCc4ccccn4)cc3)C2)OC1=O 426470509 CPDNYZHPCVXCBQ-NRFANRHFSA-N 380.448 2.925 0 50 GFAA CN(Cc1ccccc1)[C@@H](C(=O)O)c1ccc(NC(=O)N2CCOCC2)cc1 95383629 CZXMGJIPCPEWGI-LJQANCHMSA-N 383.448 2.808 0 50 GFAA Cc1noc(C2CCN(C(=O)c3nn(-c4ccc(F)cc4C)cc3O)CC2)n1 267486092 BSVNIDQFYBILQQ-UHFFFAOYSA-N 385.399 2.737 0 50 GFAA Cc1ccccc1-c1noc([C@@H](C)NC(=O)Cn2cnc3ccccc3c2=O)n1 91411883 JAEGGIAJHGFEJE-CQSZACIVSA-N 389.415 2.632 0 50 GFAA O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(N2CCNC2=O)c1 268950741 SQBGNDLRKANEHL-XFJVYGCCSA-N 391.855 2.728 0 50 GFAA O=C(Nc1cccnc1N1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O 299337539 MLPDTQQKSTWFAB-GOSISDBHSA-N 379.464 2.604 0 50 GFAA CC(=O)N1CCC[C@H](C(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)C1 185196679 GYTRPOOMYPBYPN-LSDHHAIUSA-N 383.414 2.659 0 50 GFAA CCCCNC(=O)c1nnn2c1CO[C@@H](c1ccc(Br)cc1)C2 263615205 BCUGYAKPYJGKOR-CQSZACIVSA-N 379.258 2.842 0 50 GFAA C[C@@H](C(=O)N1CCC(N2CCN(Cc3ccccc3)CC2)CC1)n1cccc1 584884756 CTPMRMYFPRQGOH-FQEVSTJZSA-N 380.536 2.858 0 50 GFAA Cc1c(-c2cccc(C(=O)NC[C@@H]3CNCCO3)c2)c(O)nc2ccccc12 584887762 PHKGXAYEYYYMNN-KRWDZBQOSA-N 377.444 2.634 0 50 GFAA CCN(Cc1cnn(CC)c1)S(=O)(=O)c1cc(-c2ccno2)ccc1OC 823086820 MSOKNSZSORMTJK-UHFFFAOYSA-N 390.465 2.777 0 50 GFAA CCc1cc(C(=O)N2CC[C@](c3nc(C4CC4)no3)(C(F)(F)F)C2)cc(O)n1 952895151 RRLKAEOXSANPIT-KRWDZBQOSA-N 396.369 2.956 0 50 GFAA NC1CCN(c2ccccc2C(=O)NC2CCC(N3CCCCC3=O)CC2)CC1 1875304431 KEGRQZNUCYEQKZ-UHFFFAOYSA-N 398.551 2.668 0 50 GFAA O=C(NCC[C@@H](c1ccccc1)N1CCCC1)c1nnn(-c2ccccc2)n1 1875329290 OVDZJDIWRHHGMA-IBGZPJMESA-N 376.464 2.619 0 50 GFAA O=C(c1ccncc1)N1CCC(N2CCN(c3nc4ccccc4o3)CC2)CC1 952964762 PJHDWBPSEAMDLT-UHFFFAOYSA-N 391.475 2.650 0 50 GFAA O=S(=O)(N1CCCCC1)N1CCCN(Cc2ccc(F)cc2Cl)CC1 952982099 FHEJBUHVVHLDTO-UHFFFAOYSA-N 389.924 2.718 0 50 GFAA CCNc1ncc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(F)cc2)C3)cn1 1565509917 RKYWOOWZAZGYTC-APWZRJJASA-N 383.471 2.784 0 50 GFAA C[C@H](C1CC1)N(C(=O)NCc1cccc(N2CCCS2(=O)=O)c1)C1CC1 185633433 CQGHPWLVDPDFBC-CQSZACIVSA-N 377.510 2.699 0 50 GFAA Cc1cccnc1NC(=O)[C@H]1CCCN(Cc2cc(-c3cnn(C)c3)no2)C1 170597488 LZPJLKCYEQJYAO-HNNXBMFYSA-N 380.452 2.629 0 50 GFAA COC(=O)[C@H](NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1)c1cncn1C 225556356 ILJNQJOVELLWKE-MGPUTAFESA-N 393.443 2.885 0 50 GFAA O=C(NCc1cccc(COC2CCOCC2)c1)N1CCO[C@H](C(F)F)C1 194241093 TUSAIORRKHVDNI-KRWDZBQOSA-N 384.423 2.558 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCN(Cc2ccc(O)c(Cl)c2)C[C@@H]1O 209083677 PPSAQBNSFGFVOS-ICSRJNTNSA-N 375.900 2.550 0 50 GFAA Cc1ncc(CN(CCN(C)C)C(=O)CC2CCN(Cc3ccccc3)CC2)[nH]1 1704337339 QOPPGJMKLGASRE-UHFFFAOYSA-N 397.567 2.911 0 50 GFAA COc1ccc(N2C(=O)N(c3ccc(Cl)cc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 1110141 CESBMHZTHWVGEY-IRXDYDNUSA-N 392.864 2.961 0 50 GFAA CC(C)(C)NS(=O)(=O)c1ccc(NS(=O)(=O)Cc2ccccc2)cc1 1137326 RXIYPNIUFVONJL-UHFFFAOYSA-N 382.507 2.705 0 50 GFAA CCCN1C[C@@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)C[C@@]2(CCC(=O)O)C1 1772819348 KBPSDTRIUGXMRZ-OPAMFIHVSA-N 398.507 2.531 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCc2onc(-c3cccc(F)c3)c2C1 11818378 VDSIWJMLKRUTMC-UHFFFAOYSA-N 376.413 2.568 0 50 GFAA COc1ccc(CCN2C[C@H](NC(=O)c3ccc(SC)cc3)CC2=O)cc1 12373667 ZIYCVHUAFBFCEV-QGZVFWFLSA-N 384.501 2.991 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(OC)c2)C1)C(=O)c1csnn1 12759445 YWJMCZXEGRNPRX-QGZVFWFLSA-N 388.537 2.964 0 50 GFAA CCOC(=O)C1CCN(C(=O)c2cc(COc3ccc(F)cc3F)on2)CC1 15077895 JFSXUVHSILSLLT-UHFFFAOYSA-N 394.374 2.947 0 50 GFAA CCn1nc(C)c(-c2ccnc(N3CCN(CCn4cccc4)CC3)n2)c1C 19112729 KLIZYQXDUDZIIP-UHFFFAOYSA-N 379.512 2.601 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 19214318 YSVPZMVVHTURHK-UHFFFAOYSA-N 388.489 2.539 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 2852576 SFEPHRYCVMGGRY-LBPRGKRZSA-N 382.869 2.963 0 50 GFAA C[C@H](NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O)c1ccccc1 2879116 XPCXGJWGYOPOKA-AWEZNQCLSA-N 380.897 2.979 0 50 GFAA COC(=O)c1ccsc1NC(=O)c1ccsc1NC(=O)[C@H]1CCCO1 4750160 OGKWCIYQXKRCBF-LLVKDONJSA-N 380.447 2.966 0 50 GFAA CCOc1ccc(C(=O)N2C[C@@H]3OCCC(=O)N(Cc4ccccc4)[C@H]3C2)cc1 1857673880 MOQVTHARXZYYBW-SFTDATJTSA-N 394.471 2.727 0 50 GFAA COc1ccc(C(=O)NCCN2CCCC2)cc1Oc1ccc(CN)cc1F 1857692242 VTHNOUYPPHIHCV-UHFFFAOYSA-N 387.455 2.911 0 50 GFAA O=C(c1cccnc1)N1CCC[C@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857711184 MAEMIUQOKOITIS-QFIPXVFZSA-N 387.443 2.759 0 50 GFAA O=C(O)c1cc(S(=O)(=O)NC[C@@H](c2ccco2)N2CCCC2)ccc1Cl 232752916 HXDDXYCWPGNZNB-HNNXBMFYSA-N 398.868 2.747 0 50 GFAA CC[C@H](C)CN1CCc2c(C(=O)OC)c(OCc3cccnc3)cc(=O)n2CC1 11968392 RSHDRCBQFAFJGT-INIZCTEOSA-N 399.491 2.513 0 50 GFAA CCOc1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1OC 363343476 UQZBTSYPLSWBOO-INIZCTEOSA-N 386.448 2.998 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)C1)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 262683397 BMFIPDRGRIEFOC-ONERCXAPSA-N 399.274 2.968 0 50 GFAA O=C(NC[C@@H]1CCCCCN1)Nc1cccc(C(=O)N2CCSCC2)c1 904320019 AWNYSIPBSYTDNZ-KRWDZBQOSA-N 376.526 2.529 0 50 GFAA CCCNC(=O)[C@H]1CC[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)[C@H](OC)C1 2100544683 FHFDIGZSPWSECX-RCCFBDPRSA-N 385.464 2.781 0 50 GFAA Cn1c(C(=O)N2CCO[C@@H](CO)[C@@H]2c2ccccc2)cnc1-c1ccccc1 2100554776 BOGPSDVIRAOICH-PMACEKPBSA-N 377.444 2.662 0 50 GFAA O=C(Cc1ccc(-c2nn[nH]n2)cc1F)N1CCC[C@H]1c1ccc2c(c1)OCO2 2325807959 NSJUYWWMDONPDU-INIZCTEOSA-N 395.394 2.641 0 50 GFAA O=C(NCCS(=O)(=O)c1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 1024901 JFUIMTGOQCQTPF-UHFFFAOYSA-N 392.786 2.958 0 50 GFAA in-vivo CN1C(=O)[C@](O)(CC(=O)c2ccccc2O)c2cc(Br)ccc21 1134926 FAWNAWWXDKDNAS-KRWDZBQOSA-N 376.206 2.592 0 50 GFAA CCc1c(C)sc(NC(=O)Cn2nc(C)c(Br)c2C)c1C(N)=O 2744906 QYIAWJWWEJYTEU-UHFFFAOYSA-N 399.314 2.932 0 50 GFAA O=C1N[C@H](c2ccc(O)cc2)[C@H](C(=O)c2ccc(F)cc2)[C@](O)(C(F)(F)F)N1 4898587 MPEPRMHZBVKOIL-CPUCHLNUSA-N 398.312 2.635 0 50 GFAA O=c1cc(CSc2ccccn2)nc(N2CCN(c3ccccc3)CC2)[nH]1 8578998 UJEVWKMICGXZFT-UHFFFAOYSA-N 379.489 2.784 0 50 GFAA Cc1cc(C)cc(N2CCN(C(=O)[C@H]3CCC(=O)N(C4CCCC4)C3)CC2=O)c1 11703976 UPFNTCPUYWHDAE-SFHVURJKSA-N 397.519 2.660 0 50 GFAA COC(=O)CN(C)C(=O)Cc1c2c(n(CCc3ccccc3)c1C)CCCC2=O 12072461 GCICAHUPUVPXBM-UHFFFAOYSA-N 396.487 2.732 0 50 GFAA Cc1ccccc1Cn1cc(C(=O)N2CCC[C@H](C(=O)c3ccccn3)C2)nn1 12454606 KTILXWHOUWDADD-SFHVURJKSA-N 389.459 2.765 0 50 GFAA Cn1nc(C(=O)N2CCCCC2)c2c1CC[C@H](NCCc1ccc(F)cc1)C2 14732455 WEGCKRMSKASTJM-SFHVURJKSA-N 384.499 2.875 0 50 GFAA O=C1C[C@H](c2ccco2)Cc2nc(N3CCN(c4ccccn4)CC3)ncc21 18172912 YTTVGMMALIOFJZ-OAHLLOKOSA-N 375.432 2.704 0 50 GFAA c1ccc(CN2CCC[C@@H](N3CCN(Cc4ccc5c(c4)OCO5)CC3)C2)nc1 19810694 GYVXTWJGESOZDA-OAQYLSRUSA-N 394.519 2.593 0 50 GFAA Cc1cc(C)c(CN2CCc3nnc(CCNC(=O)C4CCC4)n3CC2)cc1C 19839861 VEDXCILHEKOBJQ-UHFFFAOYSA-N 395.551 2.720 0 50 GFAA CCCc1nc(CN(CC)C(=O)[C@H]2CCCN2C(=O)C2CCCCC2)no1 55325262 UNRWOOJJJTXZFA-MRXNPFEDSA-N 376.501 2.942 0 50 GFAA COc1ccc(-c2nc(CN3CCN(c4cnccn4)CC3)c(C)o2)cc1OC 55340902 BYWFIMZAWNNJBC-UHFFFAOYSA-N 395.463 2.779 0 50 GFAA CC(C)CNC(=O)C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72145691 HTRJABXFMDEEOK-JOCHJYFZSA-N 393.531 2.781 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)[C@H]1CCC(=O)N(CCc2ccccn2)C1 91548715 VKVSUIAZQVFNFB-HJGBXLFDSA-N 381.520 2.948 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC[C@H](C(=O)N3CCOCC3)C2)CC1 91594447 ODICJQYCWSVWIN-NRFANRHFSA-N 385.552 2.530 0 50 GFAA COc1cccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)c1C 91793687 SHXDYYDXSGWDPP-FUHWJXTLSA-N 379.460 2.775 0 50 GFAA CC(C)CN1CCc2[nH]cnc2C12CCN(Cc1ccc(N(C)C)nc1)CC2 91914565 BJBWWJMQVRBFQO-UHFFFAOYSA-N 382.556 2.876 0 50 GFAA Cn1ncc(Cl)c1C(=O)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95513091 OXVTUZSYEIENKR-AWEZNQCLSA-N 384.871 2.733 0 50 GFAA COCCN(C[C@@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)c1ccc[nH]1 95519688 LPJKMFDMMGCCBU-GOSISDBHSA-N 381.520 2.983 0 50 GFAA Cc1ccc(-c2ccnc(N3CCC(NCCn4cccn4)CC3)n2)c(C)n1 95522163 DKWYIWMWIURLKV-UHFFFAOYSA-N 377.496 2.611 0 50 GFAA CC(C)=CCN1CCN(CCSc2ccccc2)[C@H]2CS(=O)(=O)C[C@H]21 95524857 TUYJOJUOUDHWTP-MOPGFXCFSA-N 380.579 2.528 0 50 GFAA CCc1nccn1CC(=O)N1CCC(c2nccn2Cc2cscn2)CC1 95528464 ZUDJQOLSFANYIW-UHFFFAOYSA-N 384.509 2.553 0 50 GFAA O=C(c1ccc(F)cc1Cl)N1C[C@H]2CN(CC3CCC3)C[C@@]2(C(=O)O)C1 96166333 SYPVPDBMUWCMDD-BFUOFWGJSA-N 380.847 2.738 0 50 GFAA CC(C)CNC(=O)N1CCC[C@H](CC(=O)N2CCC[C@H](N3CCCC3)CC2)C1 127385146 RBGVSGVIZLAKOT-UXHICEINSA-N 392.588 2.931 0 50 GFAA CCNC(=O)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1 129555143 BOEHEFJYNKPMRI-HXUWFJFHSA-N 393.487 2.747 0 50 GFAA Cc1nn(C)c2ncc(C(=O)NCC3CCN(C(=O)c4ccccc4)CC3)cc12 152698425 SVHIJWONMNWLTI-UHFFFAOYSA-N 391.475 2.559 0 50 GFAA Cc1nc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3)CC2)cc(C(F)(F)F)n1 169772311 BBQDRDOKHBRRJC-CYBMUJFWSA-N 394.397 2.920 0 50 GFAA C[C@@H]1C[C@@H]1[C@H](NC(=O)Cn1nc2n(c1=O)CCCCC2)c1ccc(Cl)cc1 170640570 AEVLHFKWGHQRGH-ACWOFJMJSA-N 388.899 2.938 0 50 GFAA O=C(CC1CCCC1)NC1CCC(C(=O)N2CC[C@@H](N3CCCC3)C2)CC1 171454791 POUUBLCYIDONKB-SOAGJPPSSA-N 375.557 2.938 0 50 GFAA O=C(Nc1cccc(Oc2ccncc2)c1)C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 177293753 GCIROHRKILVROS-OAHLLOKOSA-N 391.431 2.942 0 50 GFAA CCc1cc(=O)c2cc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)ccc2[nH]1 182502955 GGPBPKCHAAWNEP-UHFFFAOYSA-N 399.472 2.593 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)[C@H]1CCCCN1C(=O)c1cccs1 194989705 DZLYYKXJKMTSLA-MRXNPFEDSA-N 395.488 2.640 0 50 GFAA Cc1oc(CNC(=O)C2CCN(c3nc4ccccc4o3)CC2)cc1C(=O)O 262903781 BTQIZNFUUNNTTA-UHFFFAOYSA-N 383.404 2.960 0 50 GFAA C[C@]1(O)CCCC[C@H]1[C@@H]1CCCN1c1cc(S(=O)(=O)N2CCCC2)ccn1 284512676 DXCDCXKMAIRJNU-BJLQDIEVSA-N 393.553 2.776 0 50 GFAA O=C(c1c(O)cccc1O)N1CC[C@]2(CCCN(Cc3ccccc3F)C2=O)C1 426489536 KLDCCOUKLZSGQZ-JOCHJYFZSA-N 398.434 2.892 0 50 GFAA O=C(NCC1=CCCCC1)c1cccc(-c2nccc(N3CC[C@@H](O)C3)n2)c1 426563416 SBYZBUXZEVGNKB-LJQANCHMSA-N 378.476 2.945 0 50 GFAA CN(C)[C@H](C(=O)NCc1ccccc1-n1cccn1)c1ccc2c(c1)OCO2 426722434 MHVBHPLHWKWIHD-FQEVSTJZSA-N 378.432 2.520 0 50 GFAA COC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H](C)Oc1ccccc1 427027371 BDSHTAXGUXSSEY-BFUOFWGJSA-N 384.407 2.975 0 50 GFAA COCCc1noc([C@@H]2CCCN(Cc3cc(OC)ccc3-n3cccn3)C2)n1 824462365 LSUMEBAKFUKNNV-MRXNPFEDSA-N 397.479 2.832 0 50 GFAA CCCn1cc(S(=O)(=O)N2CCC([C@H](O)CCc3ccccc3)CC2)cn1 952974612 UQPHPEVTMDCKQD-HXUWFJFHSA-N 391.537 2.688 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)NCC2(c3ccccc3)CC2)OCC(=O)N1C 1529120076 SIOLKGCGYNRHPV-RTWAWAEBSA-N 378.472 2.741 0 50 GFAA Cc1ccc2cc(-c3ccc(C(=O)N4C[C@H](CO)[C@@H](CO)C4)cc3)ccc2n1 1565526332 AOXCZSCZFAXXIT-NHCUHLMSSA-N 376.456 2.883 0 50 GFAA COc1cc(-c2onc(N3CCC[C@]4(CCNC4)C3)c2C(=O)O)ccc1F 1772706998 OXFQQHIPKMKVLK-LJQANCHMSA-N 375.400 2.767 0 50 GFAA CCOc1ncccc1C(=O)NC1(C2CCN(C(=O)c3ccncc3)CC2)CC1 1775992620 TUFDLEXZJUKSHG-UHFFFAOYSA-N 394.475 2.690 0 50 GFAA Cn1cc(CCn2ccnc2-c2ccccc2OCC(=O)N2CCCCC2)cn1 1857670442 NQOFEQHZQXVZIF-UHFFFAOYSA-N 393.491 2.918 0 50 GFAA Cc1cc(C)n2ncc(-c3nccn3-c3cc(F)c4c(c3)NC(=O)CO4)c2n1 1857686868 GBXGEFJWYVLUNL-UHFFFAOYSA-N 378.367 2.669 0 50 GFAA Cc1cc(C)n(-c2ccc(F)cc2CN2C[C@@H](C(=O)O)C3(CCOCC3)C2)n1 1857695934 FLJKEQRGJFYWAA-SFHVURJKSA-N 387.455 2.941 0 50 GFAA CC/C(C)=C/CCN1C[C@@H]2[C@H](CNS(=O)(=O)CC3CC3)[C@H]3CC[C@]2(C1)O3 1857717289 PNRCKTAANWRNDD-DPNZVRPISA-N 382.570 2.542 0 50 GFAA COCCn1nc2c(c1C(=O)NCc1ccc(OC)cc1C)C[C@H](C)O[C@@H]2C 1875315981 PLPVHLZKDVGBAU-LSDHHAIUSA-N 387.480 2.799 0 50 GFAA NC(=O)[C@H]1CC[C@H]2OCCN(C(=O)C3(c4ccc(Cl)cc4)CCC3)[C@@H]2C1 2100540250 FXOOSWMGTKOCTH-IAOVAPTHSA-N 376.884 2.643 0 50 GFAA O=C1CC[C@@H](N2CCC3(CCc4c(O)nc(-c5ccccc5)nc43)CC2)CCN1 2100556401 MIPKHFJYLPDDSM-QGZVFWFLSA-N 392.503 2.798 0 50 GFAA CCc1c(C(=O)N(C)CC(C)(C)CNC(=O)[C@@H]2CCC[C@H]3C[C@H]32)nnn1CC 2325794791 RNSIEKNPYGUZNW-ARFHVFGLSA-N 389.544 2.511 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)Nc3cccc(S(C)(=O)=O)c3)ccc21 2325889727 NEIDOGBBCNDOIG-UHFFFAOYSA-N 384.457 2.808 0 50 GFAA CCC(=O)N1CC2(C[C@@H](NC(=O)c3coc(C4CCCCC4)n3)c3nccn32)C1 2332237888 PXNWTBJXEDVTIR-OAHLLOKOSA-N 397.479 2.741 0 50 GFAA COC1(c2ccccc2)CCN(C(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)CC1 2356134959 KGLIMUBSZFOABZ-GOSISDBHSA-N 393.487 2.594 0 50 GFAA COc1ccnc(C(=O)N2CCC[C@@]23CCCN(c2ccc(C)cc2)C3=O)c1O 2356151006 MISMRQZQMMOPNZ-JOCHJYFZSA-N 395.459 2.906 0 50 GFAA COC(=O)N1CCCc2cc(Nc3nccc(N4CCC[C@@H](O)C4)n3)ccc21 2356164947 MZVCJXCIRASFKO-MRXNPFEDSA-N 383.452 2.700 0 50 GFAA CCCN1C[C@H](C(=O)N2CCC3(CC2)OCCc2sccc23)CCC1=O 2356165423 HUMNFYLTHOICSQ-OAHLLOKOSA-N 376.522 2.787 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N[C@H]3C[C@H](OCc4ccccc4)C3)cn12 2356142164 HCBVQLKWMFCQLG-BJLQDIEVSA-N 394.475 2.896 0 50 GFAA CC(C)(C)NC(=O)COc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 2873724 VHSANYRZIXHMBM-UHFFFAOYSA-N 380.441 2.920 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)NCCCOc2ccccc2)[C@H]1c1ccccc1 2356166200 QNVYFFISIQURKK-YADHBBJMSA-N 396.487 2.949 0 50 GFAA CSc1cccc(NC(=O)N2CCN(c3cc(-n4cccn4)ncn3)CC2)c1 65362845 JWCUCDGKIDFIKU-UHFFFAOYSA-N 395.492 2.738 0 50 GFAA COCCN1CCC(CN(C)[C@H](C(=O)O)c2ccc(OC(C)C)cc2)CC1 55386496 UQGAOENYGUQGST-FQEVSTJZSA-N 378.513 2.890 0 50 GFAA COc1cccc(-n2cc(CN(C)Cc3nc(-c4ccccn4)no3)cn2)c1 20914290 JGKSKXBWZJAGOV-UHFFFAOYSA-N 376.420 2.958 0 50 GFAA C[C@H]1CCC[C@@H](NC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)CC1 468092997 BAGAJSHKQJWJRF-JKSUJKDBSA-N 381.542 2.898 0 50 GFAA Cc1ccc(C[C@H](CO)CNc2ncnc3ccc(S(C)(=O)=O)cc23)cc1 252510405 ZJKFSJRKFHALLS-INIZCTEOSA-N 385.489 2.605 0 50 GFAA C[C@@H]1CCCc2nc(S(=O)(=O)N3C[C@H](n4cccn4)Cc4ccccc43)cn21 333172247 NZHBTWWHFBMRAF-NVXWUHKLSA-N 397.504 2.970 0 50 GFAA Cc1ccc2cccc(NC(=O)C(=O)N[C@H]3CCN(C4CCCCC4)C3=O)c2n1 126322206 GTWDMAYAUWCZQB-SFHVURJKSA-N 394.475 2.532 0 50 GFAA CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(=O)OC 33840712 YHZGUPUYNUZFPZ-WQCHIQTISA-N 384.513 2.534 0 50 GFAA Cc1ccc(-c2cn[nH]c2[C@H]2CCCN(C(=O)CCCn3cnnn3)C2)cc1 77376768 CTACDFVBKHWHMS-KRWDZBQOSA-N 379.468 2.558 0 50 GFAA CCc1c(C(=O)N2CCC[C@H](CNC)C2)nnn1-c1ccc(OC(C)C)cc1 159106561 CAEORDRKRDGVOT-MRXNPFEDSA-N 385.512 2.689 0 50 GFAA COc1ccc(CCN(Cc2ccncc2)C(=O)NC[C@@H]2CCN(C)C2)cc1 426546303 YVFYGZAXVWXVKZ-FQEVSTJZSA-N 382.508 2.796 0 50 GFAA Cc1nc([C@@H]2CCCN(C(=O)NCCCN3CCCc4ccccc43)C2)n[nH]1 426566838 FMYWFNFUKVIIOL-GOSISDBHSA-N 382.512 2.845 0 50 GFAA COc1ccc(Cn2c(=O)c3cccnc3n(-c3ccccc3OC)c2=O)cc1 20248856 HPINNXOLYVAWOM-UHFFFAOYSA-N 389.411 2.613 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)NCCSc2nccn2C)cc1Cl 96141642 JKLRVHJCPFRWCC-UHFFFAOYSA-N 381.889 2.689 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Nc2ccc3nc(O)oc3c2)N2CCOCC2)o1 426503538 OYNIWBXWKXJWRV-OAHLLOKOSA-N 386.408 2.630 0 50 GFAA COCCOc1cccc(NC(=O)N[C@@H]2CCCN(Cc3cccnc3)C2)c1 96148925 CPVCZUOGONHBSM-LJQANCHMSA-N 384.480 2.893 0 50 GFAA CN(C)C(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1ccc(N3CCCCC3)cc1)C2 91779301 ZLVMZOOMBKNXGP-FXAWDEMLSA-N 384.524 2.895 0 50 GFAA CO[C@H]1CCCOC12CCN(C(=O)COCc1nc3ccc(C)cc3[nH]1)CC2 97600905 AGZHDYABYDHDFQ-SFHVURJKSA-N 387.480 2.575 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95527037 ZZFJLIGZCNBGAV-INIZCTEOSA-N 384.509 2.840 0 50 GFAA CCn1c(=O)oc2cc(NC(=O)N3CCOc4ccc(CO)cc4C3)ccc21 97604270 BBPAZXOFTYNRQJ-UHFFFAOYSA-N 383.404 2.533 0 50 GFAA COc1ccc(OCCN2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)cc1 91304825 DPHHXZGJOWAUBM-IEBWSBKVSA-N 381.476 2.706 0 50 GFAA Cc1cc(C)c(CNC(=O)Nc2ccc(C(=O)NC[C@H]3CCCO3)cc2)cn1 96139567 LIRIIPAKANIEPT-LJQANCHMSA-N 382.464 2.929 0 50 GFAA O=C1C[C@H](C(=O)Nc2ccc(CC(=O)NC3CC3)cc2)c2cc(F)ccc2N1 827693752 KXDLGZPJRYWBJG-KRWDZBQOSA-N 381.407 2.711 0 50 GFAA Fc1ccc(-c2noc([C@]3(C(F)(F)F)CCN(Cc4cnon4)C3)n2)cc1 952893737 VIKVLGRHWCGEJN-HNNXBMFYSA-N 383.305 2.965 0 50 GFAA Cc1nccn1-c1cc(C(=O)N=[S@@](C)(=O)[C@H]2CCOC2)c2ccccc2n1 1875392318 QQBDUTRQAVXBPA-PWFNWSNSSA-N 384.461 2.756 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1cnccc1Oc1ccccc1 1875403277 RVEOJGNTTLDTCR-KFKAGJAMSA-N 378.432 2.640 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCc3noc([C@H]4CCCO4)n3)cc2)n1 952973375 CLNMFBKIGWWYPX-QGZVFWFLSA-N 381.436 2.713 0 50 GFAA O=C(Nc1cc(Cl)cc2c1OCC2)N1CCC2(CCC2)S(=O)(=O)CC1 888102588 GJWVQAYUKQFNSA-UHFFFAOYSA-N 384.885 2.850 0 50 GFAA CCn1c(S)nnc1CCNc1ccccc1S(=O)(=O)C(F)(F)F 1776005020 XPWRIQAAZXEPGI-UHFFFAOYSA-N 380.417 2.535 0 50 GFAA CCOCCCN1CC[C@H](N2C(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C2=O)[C@H](C)C1 170592591 BLOVERYUVJTGPE-BCYZHJNNSA-N 377.529 2.719 0 50 GFAA C[C@@H]1CCOCCN1C(=O)C(=O)Nc1cc(C2CCC2)nn1-c1ccccc1 170603778 KYXBTVCPFBNTJZ-OAHLLOKOSA-N 382.464 2.716 0 50 GFAA Cn1ncc2c1C[C@H](C(=O)Nc1nc3ccccc3nc1N1CCCC1)CC2 280972323 LAEVWUKIPDIMGM-CQSZACIVSA-N 376.464 2.707 0 50 GFAA O=C(c1ccc(OCc2ccccc2)nc1)N1CCCC[C@@H]1CN1CCOCC1 171865266 WXPBTXCXZUFZRD-OAQYLSRUSA-N 395.503 2.988 0 50 GFAA O=C(c1cccc(NCc2cc3ccccc3nc2O)n1)N1CCC[C@H]1CO 190201157 OKOOSRZUTYCNFZ-INIZCTEOSA-N 378.432 2.544 0 50 GFAA Cc1csc2c(=O)n(CC(=O)Nc3ccc(N4CCCCC4)nc3)cnc12 192449966 KBSXRCILHCUYLY-UHFFFAOYSA-N 383.477 2.790 0 50 GFAA CO[C@@H]1CCC[C@]12CCCN(C(=O)c1ccc(N(C)S(C)(=O)=O)cc1)C2 1704298099 DIJNTAWUVPISSN-IEBWSBKVSA-N 380.510 2.504 0 50 GFAA CCOc1ccc(-c2c(=O)n(OCc3ccccn3)c3ccccc3[n+]2[O-])cc1 1110512 RPFDXCAZIXFJHZ-UHFFFAOYSA-N 389.411 2.724 0 50 GFAA O=C(c1cccc2ccccc12)N1CCN(S(=O)(=O)c2ccccc2)CC1 893131 JUANCXCHHYPBEI-UHFFFAOYSA-N 380.469 2.987 0 50 GFAA COc1cccc(F)c1CN1CCCN(C(=O)[C@H](C)N2CCCCC2)CC1 1775981976 FJGGICWDXGVBLT-KRWDZBQOSA-N 377.504 2.743 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CN1CCC2(CC1)NCC(C)(C)CNC2=O 1772805982 WNLZVCOZFTVWCQ-UHFFFAOYSA-N 395.551 2.569 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@@](Cc2ccccc2)(C(=O)OCC)C1 12581653 WUHIOXYLKFUGIE-NRFANRHFSA-N 390.480 2.537 0 50 GFAA O=C(CSc1nc2[nH]ncc2c(=O)n1-c1ccccc1)N1CCCCCC1 13545121 YZFIABJTXJNAAZ-UHFFFAOYSA-N 383.477 2.604 0 50 GFAA COc1ccc(O[C@@H](C)C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19877550 KUMUSOMORAPHNR-INIZCTEOSA-N 398.459 2.536 0 50 GFAA O=C(/C=C/c1ccco1)NCc1nnc2cc(-c3nc(C4CC4)no3)ccn12 169781040 OSEKSDQFDBUMOH-AATRIKPKSA-N 376.376 2.579 0 50 GFAA COc1ccc(C(=O)NCc2nnc(SCCOc3ccccc3)n2C)cc1 2868500 SICRLDYVNFTPRB-UHFFFAOYSA-N 398.488 2.925 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(c2cnccn2)CC1)N1CCCC1 1857692726 RAZJZVQTUOWTJU-UHFFFAOYSA-N 384.505 2.843 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NCCCNc4cccnc4)CC3)nc2n1 1857698362 NKPBIIRQEGGEJO-UHFFFAOYSA-N 394.479 2.761 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)c4ccc(-c5cnco5)cc4)[C@@H]2CC(=O)N13 1857720373 QXIVSZHVDONBJH-CDXJDZJCSA-N 381.432 2.540 0 50 GFAA COc1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)ccc1F 1857728222 SCFDEBGPESKKKV-KNKQGSTJSA-N 396.418 2.749 0 50 GFAA CCOC(=O)CNC(=O)C[C@@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857730050 XJVGXCQVHGSSSE-LBPRGKRZSA-N 379.844 2.767 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(Cc4ccc5c(c4)OC(F)(F)O5)[C@@H]2CC(=O)N13 1857738208 WUDSOOKKAAEADA-XCRHUMRWSA-N 380.391 2.566 0 50 GFAA O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cc(-c2ccccc2Cl)[nH]n1 238108565 KHASCCADGYAPJG-GFCCVEGCSA-N 377.828 2.826 0 50 GFAA CS(=O)(=O)NC(=O)c1ccc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc1 1875391295 PWVREKHUKJEKAI-UHFFFAOYSA-N 376.478 2.531 0 50 GFAA NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H](Cc2ccccc2)C2CC2)c1 153589434 IHDJFPQZTFSYSZ-INIZCTEOSA-N 396.871 2.878 0 50 GFAA O=C(Nc1cccc(OCC(=O)N2CCC[C@@H]3CNCCC[C@H]32)c1)c1ccco1 373561131 HWAMHQKGQFSEJQ-VQIMIIECSA-N 397.475 2.901 0 50 GFAA Cn1cncc1C(=O)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100537115 JCHDESGUQSYUGT-QFIPXVFZSA-N 390.487 2.998 0 50 GFAA Cc1cc(NC(=O)CCCN2CCOCC2)n(Cc2ccccc2Cl)n1 2100548401 ZYNSASHQNFBCAC-UHFFFAOYSA-N 376.888 2.944 0 50 GFAA Cc1nc(C(=O)N2CCN(c3ccncc3)C[C@H]2C)nn1-c1ccccc1Cl 2325761991 KXBYCHSVGAFHEV-CQSZACIVSA-N 396.882 2.975 0 50 GFAA Cc1c(C(=O)NCc2cccc3ncn(C)c23)cnn1CCO[C@H]1CCCCO1 2325803141 SKMUUPTTXOOOMS-IBGZPJMESA-N 397.479 2.551 0 50 GFAA O=C1CNc2nc(C(=O)N3CCC(Oc4ccc(Cl)cc4)CC3)ccc2N1 2325804728 LZJXPZRJLWDYGV-UHFFFAOYSA-N 386.839 2.783 0 50 GFAA COC(=O)c1[nH]cc(CNCc2cnc3ccc(Br)cn23)c1C 2325806075 RCEGQNYFRKPSQH-UHFFFAOYSA-N 377.242 2.810 0 50 GFAA NC[C@@H](CC(=O)Nc1cnc2[nH]ncc2c1)c1ccc(Br)s1 2325861386 OKOKKPAGVXCVTM-MRVPVSSYSA-N 380.271 2.853 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccccc1Br)Cc1ccccc1 2835458 HGQWDPZWRIBEAY-UHFFFAOYSA-N 397.294 2.849 0 50 GFAA CS(=O)(=O)c1c(F)cccc1NC(=O)[C@@H]1C[C@]12CCOc1ccccc12 416017832 KCDFAPUXRFFRFS-DJJJIMSYSA-N 375.421 2.908 0 50 GFAA O=C(O)c1cc(S(=O)(=O)N2CCC[C@@H]3CCC[C@@H]32)c(Br)o1 115753082 KSUZZVWBRITFSP-IUCAKERBSA-N 378.244 2.694 0 50 GFAA O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 100798674 RTARCSWGSRIDLF-LAQRGFTBSA-N 376.884 2.731 0 50 GFAA Cc1cccc(CNC(=O)c2ccccc2NC(=O)[C@@H](C)N2CCCC2=O)c1 55154968 WKVBFKQUDFFERV-MRXNPFEDSA-N 379.460 2.874 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N3CCC[C@H](c4ccn[nH]4)C3)c2n1 67919952 GBAJJPVSUIJSGB-NSHDSACASA-N 378.358 2.799 0 50 GFAA Cc1ccc2nccc(C(=O)N3CCn4nc(C(=O)N5CCCC5)cc4C3)c2c1 65529329 GYCISSXHIWWXIY-UHFFFAOYSA-N 389.459 2.632 0 50 GFAA O=C1N[C@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cncs1 67982893 PUTXBXFHQMRNGL-HXUWFJFHSA-N 384.505 2.566 0 50 GFAA COc1ccc(C(=O)Nc2ccc3c(c2)nc(CCN2CCOCC2)n3C)cc1 20504053 VELYHKSFVKOWOG-UHFFFAOYSA-N 394.475 2.709 0 50 GFAA O=S(=O)(c1c(F)cccc1F)N1CCC[C@H](c2nnc3n2CCCCC3)C1 119888053 HNPMYCXYRKMFJB-ZDUSSCGKSA-N 396.463 2.851 0 50 GFAA CC(C)Cc1nc([C@H]2CC(=O)N(Cc3ccccn3)C2)n(-c2ccccn2)n1 65371930 XKCLIFFZVMMHPL-INIZCTEOSA-N 376.464 2.772 0 50 GFAA CCc1cc(-c2ccc([C@H](C)N3CCOCC3)cc2)nc(N2CCOCC2)n1 65527585 NTYPDRCRMDFHRP-KRWDZBQOSA-N 382.508 2.936 0 50 GFAA Cc1nn(C)c2ncc(C(=O)N[C@H](C)[C@H]3CCN(Cc4ccccc4)C3)cc12 252535716 GRALOZNBSAJZSJ-QAPCUYQASA-N 377.492 2.917 0 50 GFAA COc1ccc(CN2CCN(C3CCCC3)[C@@H](CCO)C2)c(OC)c1OC 22919428 YNISJVBQUPLRNJ-SFHVURJKSA-N 378.513 2.524 0 50 GFAA CC(C)[C@@H](CNC(=O)Nc1ccccc1CS(C)(=O)=O)c1ccnn1C 252502253 UOPCQYTWBXWMFM-OAHLLOKOSA-N 378.498 2.526 0 50 GFAA O=C1CCCN1CC1CCN(C(=O)c2ccc(-c3ccccc3CO)nc2)CC1 67714454 REMMVIGVEYFZCW-UHFFFAOYSA-N 393.487 2.716 0 50 GFAA Cc1cc(C(=O)NC[C@@]2(O)CCCN(C(=O)c3cccs3)CC2)c(C)o1 72162085 FTTHKPASIBYWMS-LJQANCHMSA-N 376.478 2.745 0 50 GFAA CS(=O)(=O)c1ccc(-c2nccn2Cc2ccccc2-n2cncn2)cc1 72168494 BZJFWUWTADXXIK-UHFFFAOYSA-N 379.445 2.583 0 50 GFAA CC[C@H]1COCCN1C(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1 237040961 VZPVMZIALWPLGX-LBPRGKRZSA-N 397.353 2.840 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2cc(CC(C)C)no2)c2ccccc2C12CCNCC2 72462804 OKTACYNGDLGPKC-UXHICEINSA-N 383.492 2.994 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccccc3F)CC2)cc(-n2cnc(C)c2C)n1 72115457 WSZJJYWUZHXRSM-UHFFFAOYSA-N 394.454 2.689 0 50 GFAA CCOc1ccc(CNC(=O)N2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)cc1F 378365770 XGJPVJMJNOIAEN-FUHWJXTLSA-N 390.459 2.756 0 50 GFAA CC(=O)NCC(=O)N1CCC([C@@H]2CCN(Cc3ccc(Cl)cc3)C2)CC1 15075368 NQRXMBBVGIDZGU-GOSISDBHSA-N 377.916 2.537 0 50 GFAA COc1ccc(-c2ccc(CNC(=O)Cn3c(C)cc(O)cc3=O)cc2)cc1 132562858 YFSHDQZFTXXHDD-UHFFFAOYSA-N 378.428 2.854 0 50 GFAA O=C1CC[C@@]2(CCCN(Cc3ccc(-c4ccccn4)cc3)C2)CN1CCO 77301597 QMWCMXIDNBQTMK-HSZRJFAPSA-N 379.504 2.946 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccn(Cc3ccc(F)cc3)n2)cc1 14225598 ZIDZPTIAHDDDBX-UHFFFAOYSA-N 388.424 2.830 0 50 GFAA Cc1c(C(N)=O)sc(NC(=O)CN2C[C@@H](C)C[C@@H](C)C2)c1C(=O)OC(C)C 17080900 ZMZGZVCARHFOBZ-TXEJJXNPSA-N 395.525 2.637 0 50 GFAA Cn1ccnc1-c1ccc(C(=O)N2CCCN(Cc3ccncc3)CC2)cc1 426549187 QJTTXOIOLSRFLG-UHFFFAOYSA-N 375.476 2.830 0 50 GFAA O=C(C[C@H]1CCCS(=O)(=O)C1)N[C@@H](c1ccccc1)c1ccc2[nH]cnc2c1 292941952 BGHTYEKADXAVDB-VFNWGFHPSA-N 397.500 2.983 0 50 GFAA COCCOc1cccc(NC(=O)N[C@H]2CCCN(Cc3cccnc3)C2)c1 96148926 CPVCZUOGONHBSM-IBGZPJMESA-N 384.480 2.893 0 50 GFAA O=C1NCCN(C(=O)c2c[nH]nc2-c2cccc(F)c2)[C@H]1c1cccc(F)c1 92045585 MKEUHKLGMIRWOS-SFHVURJKSA-N 382.370 2.668 0 50 GFAA CN(C)CCCn1ccnc1[C@H]1CCCN(C(=O)c2cccc(N(C)C)c2)C1 95529224 AWOZWCXESPPPBV-IBGZPJMESA-N 383.540 2.921 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)c2cc(=O)c3ccccc3o2)C1 95496850 HPXPRPRJXUOJER-HNNXBMFYSA-N 381.432 2.656 0 50 GFAA CN(Cc1nc2ccc(F)cc2[nH]1)C(=O)c1cnc(-c2cccnc2)nc1O 91604604 VJKBVGILTQRUSC-UHFFFAOYSA-N 378.367 2.532 0 50 GFAA Cc1cc(C(=O)N2CCC(Oc3ccccc3C(=O)N3CCCC3)CC2)no1 95505582 WHEBRHVWDQDCFD-UHFFFAOYSA-N 383.448 2.903 0 50 GFAA O=C1COc2cc(NC(=O)N3CCC[C@@H](OCc4cccnc4)C3)ccc2N1 97743495 ZTHMMCIANDSWRK-MRXNPFEDSA-N 382.420 2.626 0 50 GFAA O=C(CCc1ccccn1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95383796 UBADUIQXCBFBSR-MDNUFGMLSA-N 377.488 2.809 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@@H](c2nccn2Cc2ccncc2)C1 91462197 VBGWKDVOQSTVEL-GOSISDBHSA-N 386.459 2.994 0 50 GFAA CNCC(=O)N(Cc1cccnc1)CC1CCN(Cc2ccccc2C)CC1 95508819 DZNOVZPKQKSMKE-UHFFFAOYSA-N 380.536 2.850 0 50 GFAA COc1cn(CC(=O)NCc2cccc(-c3nc(C)cs3)c2)c(C)cc1=O 253411231 OJCQOXJYAUCCRH-UHFFFAOYSA-N 383.473 2.914 0 50 GFAA CC(C)Nc1ccc(-c2ccc(C(=O)NCCN3CCCOC3=O)cc2)nn1 534648522 VNNJTPFBOIZOHB-UHFFFAOYSA-N 383.452 2.536 0 50 GFAA Cc1cc(-n2cnnn2)cc(NC(=O)NC[C@H]2OCCc3ccccc32)c1C 299793277 HXWUBNGWZQMPGI-LJQANCHMSA-N 378.436 2.715 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1 828157769 LTWMUGGITPHZLY-FQEVSTJZSA-N 393.447 2.840 0 50 GFAA CN1CCC(N(Cc2ccncc2)C(=O)NCc2ccc3nc[nH]c3c2)CC1 670469373 WIUUBIOKJKDXJT-UHFFFAOYSA-N 378.480 2.764 0 50 GFAA Cc1nnccc1NC(=O)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F 754461376 YRDFTXCKARBCCU-UHFFFAOYSA-N 383.721 2.685 0 50 GFAA Cc1csc(-c2cccc(C(=O)N3C[C@H]4C[C@H]3[C@H]4c3ocnc3C(N)=O)c2)n1 1875394469 JRZMBNIERJVDFC-ILXRZTDVSA-N 394.456 2.834 0 50 GFAA COCCc1noc([C@H]2CCCCN2Cc2cc3c(cc2OC)OCO3)n1 952865841 YFCHWHXJDLMDIZ-CQSZACIVSA-N 375.425 2.723 0 50 GFAA O=C(Nc1cccc(N2C(=O)CCNC2=O)c1)[C@@H]1C[C@]12CCOc1ccccc12 885689770 SLSVQICUBXZESY-JTSKRJEESA-N 391.427 2.812 0 50 GFAA COCCn1cc2c(n1)[C@H](NC(=O)c1ccc3c(c1)nc(O)n3C1CC1)CCC2 888101030 OYTWYOAOYUGZCZ-MRXNPFEDSA-N 395.463 2.727 0 50 GFAA CCn1cc([C@H]2OCC[C@@H]2C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cn1 276011249 PVFYGDKJGWJCOM-ORYQWCPZSA-N 397.523 2.717 0 50 GFAA Cc1cc(S(=O)(=O)Nc2ccc(C(=O)N3CC[C@](C)(O)C3)cc2)ccc1F 170018039 XIZRXIAQLGNAQF-IBGZPJMESA-N 392.452 2.532 0 50 GFAA Cn1cncc1CCC(=O)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 225615026 KFGZNYLMTGTONH-UHFFFAOYSA-N 380.414 2.716 0 50 GFAA Cc1ccc(F)c(-c2cc(NC(=O)c3cccc(CS(N)(=O)=O)c3)[nH]n2)c1 190115360 PKQPQGFDAZNFMK-UHFFFAOYSA-N 388.424 2.565 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NC[C@@H]3CCN(CC(F)(F)F)C3)c2O1 192622159 NZKSFXBSOAFUSL-LBPRGKRZSA-N 392.443 2.563 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2ccc(F)cc2C)cc1OC 1529114096 KRZALKNJXMIRQL-WOJBJXKFSA-N 389.423 2.726 0 50 GFAA CN(C)CCCOc1ccc(CN2CCO[C@H](CO)[C@H]2c2ccccc2)cc1 1704352581 XFWCODAOCUTSPW-DHIUTWEWSA-N 384.520 2.952 0 50 GFAA Cn1cnnc1S[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1 797121 YJSLERVIOOTPTK-KGLIPLIRSA-N 386.930 2.850 0 50 GFAA COc1ccc(CNC(=O)CSc2nnc(-c3cccc(OC)c3)n2C)cc1 1159635 OZBJDMRMKIGZST-UHFFFAOYSA-N 398.488 2.908 0 50 GFAA Cc1cc(=O)c2ccccc2n1CC(=O)N1CCC[C@@]2(CCc3c[nH]nc32)C1 1775982896 UQEFYFKBXCOFHZ-JOCHJYFZSA-N 376.460 2.540 0 50 GFAA O=C([C@H](c1cccnc1)N1CCCC1)N1CCC(Cc2ccc(O)nc2)CC1 1772809405 ALEXQILAEMNDKK-NRFANRHFSA-N 380.492 2.800 0 50 GFAA COc1ccccc1C(=O)Nc1cc(C)c(OCC(=O)N2CCOCC2)c(C)c1 5065688 BRWCWVGLXASOSN-UHFFFAOYSA-N 398.459 2.802 0 50 GFAA C[C@H]1Cc2ccccc2N1C(=O)c1cccc(N2C(=O)[C@@H](C)CS2(=O)=O)c1 12003294 RTLYDQFQCNZRIU-KBPBESRZSA-N 384.457 2.591 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3ccccc3Cl)c2)C1=O 12003865 BGKPQDUFGYHGHG-NSHDSACASA-N 378.837 2.905 0 50 GFAA COc1ccccc1C(=O)Nc1ccc2c(c1)CN(C(=O)c1cnsn1)CC2 12031182 SYMYPLSQEUDEGV-UHFFFAOYSA-N 394.456 2.998 0 50 GFAA COCCN1CCC(CN(Cc2cnc(N(C)C)s2)C[C@H]2CCCO2)CC1 12076348 GMLAJMZNJIIKFU-GOSISDBHSA-N 396.601 2.549 0 50 GFAA Cc1c(C(=O)N(C)CCc2ccccn2)sc2ncnc(N[C@@H]3CCOC3)c12 12080294 DMJKABIXYUSZSC-OAHLLOKOSA-N 397.504 2.910 0 50 GFAA COC(=O)c1ccc(CN2CCC(n3nccc3NC(=O)C3CC3)CC2)cc1 12387065 UELYSIMEPDTBQO-UHFFFAOYSA-N 382.464 2.855 0 50 GFAA CCOC(=O)C[C@H]1CCCCN1C(=O)c1cn(C/C=C/c2ccccc2)nn1 12433061 YXRUELACASYCLG-VEGGFIAOSA-N 382.464 2.939 0 50 GFAA CN1CCCC[C@@H]1CNC(=O)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12574716 OSBTUCQJOAEHGJ-OAHLLOKOSA-N 381.402 2.559 0 50 GFAA COC(=O)C1CCN(C(=O)c2cc(COc3ccc(F)cc3F)on2)CC1 12589493 CMRVBSQFTOGOMA-UHFFFAOYSA-N 380.347 2.557 0 50 GFAA C/C=C(\C)C(=O)N1CCC([C@H](Cc2ccccc2)N(C)C(=O)CN(C)C)CC1 14994642 LPROUQYEMHYWEO-SQDHZICKSA-N 385.552 2.823 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)N1CCCCC1 6743767 CECLJRPGFGPTIU-UHFFFAOYSA-N 388.489 2.800 0 50 GFAA COc1cccc(/C=c2/sc3nc(-c4ccc(C)cc4)nn3c2=O)c1OC 6477829 WSMXYOOMRODXGN-LFIBNONCSA-N 379.441 2.691 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1cnn2cc(Br)cnc12 4866706 HMHSPQLSYGLGCR-UHFFFAOYSA-N 375.182 2.531 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(CCC3=C(C)CCCC3(C)C)C[C@@]2(CO)C1 1857690035 STCNRXQJVUFBSW-GCJKJVERSA-N 378.557 2.692 0 50 GFAA CCCCn1nc(COc2cccc(OC)c2)nc1-c1cn2c(n1)CCNCC2 1857713310 UTQFSJAIHRSLPY-UHFFFAOYSA-N 396.495 2.675 0 50 GFAA O=C(Cc1csc(-c2ccccc2)n1)N1C[C@@H](O)[C@H](Cc2ccccn2)C1 1857739368 PCAADHLNEFQSDV-VQIMIIECSA-N 379.485 2.810 0 50 GFAA CCC(=O)N1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NCc2ccncc2)C1 1875250863 NCLJRNNFBDSISQ-HSZRJFAPSA-N 391.519 2.999 0 50 GFAA COCC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@H]1c1cnc2ccccc2n1 225507377 UVMBEKZLBNIQLJ-SFHVURJKSA-N 390.399 2.683 0 50 GFAA Cc1ccc([C@@H]2COCCN2C(=O)c2ccc(CN3CCN(C)CC3)cc2)o1 116988284 LYZZUBGQSJEPQD-FQEVSTJZSA-N 383.492 2.549 0 50 GFAA CC(=O)c1cccc(NC(=O)CSc2nnc(-c3ccccc3)c(=O)[nH]2)c1 11990561 DGXOLVYUAPCFFQ-UHFFFAOYSA-N 380.429 2.765 0 50 GFAA CS(=O)(=O)CC1(CNC(=O)N2C[C@@H]3CCCC[C@]32c2ccccc2)CC1 361029129 JFEHDUKGIQGAQE-PXNSSMCTSA-N 376.522 2.922 0 50 GFAA COc1c(C)cc(Br)cc1C(=O)Nc1ccc(S(N)(=O)=O)cc1 679723 MICXQJDSUUMDGV-UHFFFAOYSA-N 399.266 2.666 0 50 GFAA O=C(Nc1ccccc1)[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)NCC3)C1 2325843185 YFFDARZZBHODHT-INIZCTEOSA-N 385.489 2.694 0 50 GFAA Cc1oc2nc(O)n(-c3ccccc3)c(=O)c2c1C(=O)NC1(C)CC(F)(F)C1 881466351 TVYPYKUCNOXCDL-UHFFFAOYSA-N 389.358 2.910 0 50 GFAA COc1ccc2c(c1OC)C(=O)N1[C@H](C(=O)O)Cc3c([nH]c4ccccc34)[C@@H]21 754220 NNRWDPOHSYYGEI-KBXCAEBGSA-N 378.384 2.740 0 50 GFAA biogenic,in-vitro O=C(NC[C@@H](O)c1cccc(O)n1)c1cc(-c2cccnc2)nc2ccccc12 2356157912 RUEVNNBLEBBLRF-HXUWFJFHSA-N 386.411 2.861 0 50 GFAA O=C(C1CCCCC1)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 7597052 PQLGZLYSTFHJME-UHFFFAOYSA-N 376.931 2.815 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3ccoc3)n1)CCN(C(=O)[C@H]1CCOC1)C2 20916743 FBZZJLRNDFLTCZ-AWEZNQCLSA-N 380.404 2.621 0 50 GFAA CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(C(C)=O)cn3C)CC2)cc1 119258434 QNASWOLORKYRAZ-UHFFFAOYSA-N 397.475 2.661 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1cccc(Cl)c1 11717677 LJEUVTZBMVYSDD-GOSISDBHSA-N 382.855 2.919 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2Cc2cccc(C(=O)N(C)C)c2)n1C 328624803 COZHWXLQRALJBE-LJQANCHMSA-N 382.508 2.814 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C(=O)COC2CCCCC2)CC1 328631536 KOUYBHVAYFANBK-IBGZPJMESA-N 388.512 2.556 0 50 GFAA C[C@@]1(C(=O)N2CCN(C(=O)[C@]3(C)CC3(Cl)Cl)CC2)CC1(Cl)Cl 2771553 ZLVDTBFMMHRPBA-RYUDHWBXSA-N 388.122 2.825 0 50 GFAA Cc1ccc([C@@H]2CN(C(=O)c3cc4c([nH]c3=O)CCCC4)C[C@H]2N(C)C)cc1 77489467 ZHNHMTKKOQKHRB-PZJWPPBQSA-N 379.504 2.732 0 50 GFAA CCNS(=O)(=O)c1ccc(CNC(=O)N2CCc3ccccc3[C@H]2C)cc1 152538774 KDAIJKHJDXTYJX-OAHLLOKOSA-N 387.505 2.814 0 50 GFAA O=C([C@@H]1CSCN1C(=O)c1c[nH]c2ccccc12)N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 333029407 BKMSTSLOJKMBIE-ADGIFASQSA-N 393.512 2.964 0 50 GFAA COc1ccc(F)cc1CN1CCC(N2CCC[C@H](C(=O)NC3CC3)C2)CC1 71763721 AWARPSYWEMNHOD-INIZCTEOSA-N 389.515 2.789 0 50 GFAA Cc1nccn1-c1ncccc1CNC(=O)N1CC[C@@]2(C1)OCc1ccccc12 372216762 NRDOYTZYPQGYDQ-QFIPXVFZSA-N 389.459 2.917 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1 238154669 PTUGXVVFWKSSJS-SJLPKXTDSA-N 384.407 2.506 0 50 GFAA Cc1cc(C)n(CCCN(C)c2nc(-c3cccnc3)nc3c2cnn3C)n1 72121709 FPYKPWTWENJYJH-UHFFFAOYSA-N 376.468 2.765 0 50 GFAA NC(=O)CC1CCN(C(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)CC1 290948717 MIKNPEHJWKRSPI-FQEVSTJZSA-N 386.540 2.586 0 50 GFAA CN1C[C@@]2(CCCN(C(=O)NCc3cc4cc(Cl)ccc4[nH]3)C2)OC1=O 426597228 NITRHBAIJFKTNF-GOSISDBHSA-N 376.844 2.948 0 50 GFAA CC(=O)C(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@@H]1CCCO1 95528280 MPBXQEBXLTYVDX-IBGZPJMESA-N 376.472 2.634 0 50 GFAA CN(C)C(=O)N1CCCn2nc(CNc3ccc(C(F)(F)F)cn3)cc2C1 91593287 XUGFGSGVQFSOEA-UHFFFAOYSA-N 382.390 2.796 0 50 GFAA CCn1c(Cn2ccnc2)nnc1C1CCN(C(=O)CCC(F)(F)F)CC1 96133771 YIPIPKAJDBIFCG-UHFFFAOYSA-N 384.406 2.591 0 50 GFAA CC(C)(C)c1csc(NC(=O)CN2CCC[C@@H](c3cc(O)ncn3)C2)n1 252484953 GKZPBEKOZQBLKY-GFCCVEGCSA-N 375.498 2.754 0 50 GFAA O=C(Nc1cccc(Cl)c1)N1CCc2nn(Cc3cccnc3)c(=O)cc2C1 263615421 CHKVUKRKROCYBG-UHFFFAOYSA-N 395.850 2.930 0 50 GFAA Cc1ccc(NC(=O)N2CCC[C@@]3(CN(C)C(=O)O3)C2)cc1N1CCCC1=O 299755339 AKHADEJVAIOBLR-HXUWFJFHSA-N 386.452 2.570 0 50 GFAA Cc1ccc(OCC(=O)N2CCC3(CC2)CN(Cc2ccoc2)CCO3)cc1 825178096 BGMLORTXKCLSGJ-UHFFFAOYSA-N 384.476 2.860 0 50 GFAA COc1cccc(CN2CCN(C(=O)[C@H](c3ccc(C)cc3)N(C)C)CC2)c1 824781023 IMDZOSVCGWNNJK-QFIPXVFZSA-N 381.520 2.951 0 50 GFAA COC(=O)C[C@H](c1cccc(Oc2ncccn2)c1)c1c(O)cc(C)n(C)c1=O 824134535 GEAGCFSZYZSMAS-MRXNPFEDSA-N 395.415 2.677 0 50 GFAA COc1cc(-c2nn3c(C4CCN(C)CC4)nnc3s2)cc(OC)c1OC 824585952 GAVQRHBDSVYAAT-UHFFFAOYSA-N 389.481 2.688 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@@H]2Cc3n[nH]cc3[C@H](C(F)(F)F)C2)cc1 1875368899 DOPNHNUHGZEMAM-GXTWGEPZSA-N 378.354 2.925 0 50 GFAA C=CC(=O)N1CCC(C(=O)N[C@@](C)(CO)c2cc(Cl)cc(Cl)c2)CC1 1875366139 SZDIKELUCHVESW-SFHVURJKSA-N 385.291 2.742 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CC2)C1)[C@@H]1CCCO1 1875332834 NLPYGAHBRGCBFK-SJORKVTESA-N 376.884 2.658 0 50 GFAA CCc1ncoc1C(=O)N[C@@H]1C[C@@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403350 UEVRIOMMZUVRLQ-ZTFGCOKTSA-N 380.448 2.670 0 50 GFAA COCCc1nc(CN2CCOC[C@H]2c2c(C)nn(-c3ccccc3)c2C)no1 952887310 OOKLOSBQMHXCLW-SFHVURJKSA-N 397.479 2.635 0 50 GFAA CN(CCC(=O)NC1CC1)C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 1875257487 CJMZCFVMAHNRQM-UHFFFAOYSA-N 391.269 2.580 0 50 GFAA N[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C[C@H]1C1CC1 1875287779 ZHHKTROXYCOEBZ-UONOGXRCSA-N 375.270 2.649 0 50 GFAA Cc1ccccc1[C@@H](CNC(=O)CCC1=NNC(=O)CC1)N1CCC(C)CC1 952983372 KXLDSSYCPBGFCQ-HXUWFJFHSA-N 384.524 2.930 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCc2nc[nH]c2[C@H]1c1ccccn1 952984963 DCFOABFNFPWXLF-OAQYLSRUSA-N 376.464 2.514 0 50 GFAA O=C(Cc1cscn1)Nc1cc(S(=O)(=O)NC2CC2)c(Cl)cc1F 888102306 LFIRUVSGZUEFJH-UHFFFAOYSA-N 389.861 2.558 0 50 GFAA CC[C@H](C)[C@@H](C(=O)N1CC[C@@H](N(C)Cc2nccc(N)n2)C1)c1ccccc1 276621551 WQLKTVJEPOBBHA-YRISNDGFSA-N 381.524 2.921 0 50 GFAA O=S(=O)(CCc1ccc2c(c1)CCO2)N[C@H]1CCOc2c(F)cccc21 277642898 DAYMXVAZIHQBCT-KRWDZBQOSA-N 377.437 2.746 0 50 GFAA O=C(O)C[C@H](NC(=O)c1nn(-c2ccc(F)cc2)cc1Br)C1CC1 767073050 BJXJAGBFDONHCB-ZDUSSCGKSA-N 396.216 2.757 0 50 GFAA Cc1ccccc1-n1cc(CN(C)C(=O)Cc2ccc(S(C)(=O)=O)cc2)cn1 1506424220 ZLTDGMKKFWSSGE-UHFFFAOYSA-N 397.500 2.785 0 50 GFAA O=C1CC[C@@H](NC23C[C@@H]4C[C@H](C2)CC(n2cncn2)(C4)C3)CCN1CC1CC1 1506415730 CAJLIUMMCXIGCE-DHIRWMJTSA-N 383.540 2.707 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC[C@@H]2CCCCN2)ccc1F 1704313169 HKHURBSRZJTSFV-AWEZNQCLSA-N 390.459 2.817 0 50 GFAA O=C(CCN1CCCCCC1=O)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1615963197 BRNMILSAXBNVAU-RXVVDRJESA-N 395.503 2.701 0 50 GFAA COc1cc2c(cc1-c1nccn1-c1ccc3c(c1)ncn3CCO)OCO2 1775982559 XEIRGHABAXUFSK-UHFFFAOYSA-N 378.388 2.619 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cn(C4CCCCC4)nn3)CC2=O)c1 11764146 JWXLQQVGXAOXHH-UHFFFAOYSA-N 381.480 2.576 0 50 GFAA COC(=O)CN(C)C(=O)CCc1nnc(C2(c3ccc(Cl)cc3)CCC2)o1 12053330 GOCLZUZYXSRZJW-UHFFFAOYSA-N 391.855 2.757 0 50 GFAA CCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](N(C)CCc1ccccn1)C2 14534267 XFRVYGTUKCCKGA-LJQANCHMSA-N 395.551 2.956 0 50 GFAA O=C(NCc1ccco1)[C@H]1CCCN(S(=O)(=O)Cc2cccc(Cl)c2)C1 19860230 VQSQYACJQQXRBM-HNNXBMFYSA-N 396.896 2.791 0 50 GFAA COC(=O)c1cc(NC(=S)NC(=O)c2ccc(C)cc2)cc(C(=O)OC)c1 877419 XZYGVXAXRRKGSE-UHFFFAOYSA-N 386.429 2.695 0 50 GFAA NC(=O)C1CCN(CC(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)CC1 893716 RWZRSFXIVZDNDX-UHFFFAOYSA-N 399.878 2.707 0 50 GFAA CCOC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1 4747587 LLWHIXQFMOAXDM-UHFFFAOYSA-N 389.477 2.766 0 50 GFAA CCOC(=O)c1nc(C)n(C)c1NS(=O)(=O)Cc1ccc(F)c(Cl)c1 225693982 WDOSNFNGQVFVCN-UHFFFAOYSA-N 389.836 2.640 0 50 GFAA COc1ccc(C2=NN(C(C)=O)[C@H](c3ccccc3NS(C)(=O)=O)C2)cc1 252509752 YUUPSKYXZPFKQM-IBGZPJMESA-N 387.461 2.764 0 50 GFAA CC(C)Oc1ncc(Cl)cc1NC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 263146326 OWHGIYOSDHUHOW-CQSZACIVSA-N 398.891 2.925 0 50 GFAA CNS(=O)(=O)c1cccc([C@H](C)NC(=O)c2ccc3c(c2)C(C)(C)CO3)c1 810331180 GKATYNPGIDCLQB-ZDUSSCGKSA-N 388.489 2.756 0 50 GFAA CC(C)(C)N1C[C@H](CN2C(=O)CCN(CC[C@@]3(C)CC3(F)F)C2=O)CC1=O 2325779608 RJBUYSQNDOCTHM-UGSOOPFHSA-N 385.455 2.723 0 50 GFAA O=C(N=c1ccn(Cc2ccncc2)[nH]1)c1cnn(CC(F)(F)F)c1C1CC1 2325798459 ORWUSCCNWYGUQE-UHFFFAOYSA-N 390.369 2.637 0 50 GFAA C[C@H]1C[C@@H](CS(=O)(=O)NCCc2cncc(Br)c2)C[C@@H](C)O1 2325803984 NPLKKZIZFRAMHE-IMRBUKKESA-N 391.331 2.510 0 50 GFAA CN(C(=O)[C@H]1CC2(CC2)CO1)[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)cn2)C1 2325827736 OUTGAHMVVKNZOA-FUHWJXTLSA-N 385.508 2.621 0 50 GFAA C[C@@](O)(CNC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccc(F)cc1 131392969 AFUDDJSSJYTPKY-GOSISDBHSA-N 378.835 2.507 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1S(C)(=O)=O 134196810 AUVWQUYXEFCIAK-GOSISDBHSA-N 378.538 2.743 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2cc(Cl)ccc2OC)C1=O 2356134034 UNFLLJGQYXWQGX-IBGZPJMESA-N 380.872 2.592 0 50 GFAA Cn1ccnc1C(=O)[C@@H]1CCCN(c2noc(-c3ccccc3)c2C(=O)O)C1 2356141558 HEJTZLVDVUUNEC-CQSZACIVSA-N 380.404 2.873 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2c[nH]c(=N)nc2-c2ccccc2)C1=O 2356148601 IGQILLYNRPCACR-QFIPXVFZSA-N 393.491 2.562 0 50 GFAA CCC(=O)N[C@H](NC(=S)Nc1ccccc1C(=O)O)C(Cl)(Cl)Cl 3147866 UDNQRDMPKDAWOE-LLVKDONJSA-N 398.699 2.894 0 50 GFAA COC(=O)c1ccc(OC2=C(Cl)C(=O)N(c3ccc(OC)cc3)C2=O)cc1 4043318 SDYVRDGBGHVXRN-UHFFFAOYSA-N 387.775 2.884 0 50 GFAA CCCCn1c(=O)c(C(=O)Nc2ccccc2C(N)=O)c(O)c2ccccc21 100673863 KVLUCCFTMFMQKM-UHFFFAOYSA-N 379.416 2.858 0 50 GFAA CN(C)c1cnc(-c2noc([C@H]3CCC(=O)N(C)[C@@H]3c3ccccc3)n2)cn1 350315038 BKOOHMOXZIBIFM-KBXCAEBGSA-N 378.436 2.670 0 50 GFAA CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(-c2nnc(S)o2)cc1 127727342 PDSACGQHCXUTRE-DZWULXIXSA-N 379.507 2.835 0 50 GFAA CCOC(=O)N1CCC(N2CCN(c3cc(C(C)C)nc(C)n3)CC2)CC1 65526971 VNTUBKBERPTSLK-UHFFFAOYSA-N 375.517 2.651 0 50 GFAA CCn1nc(C(=O)O)c2c1CC[C@H](NCc1ccc(-c3noc(C)n3)cc1)C2 67879957 YKUHQHYTAISICS-HNNXBMFYSA-N 381.436 2.607 0 50 GFAA Cc1cc(F)cc(-n2cc(C(=O)Nc3ccc(Cn4cncn4)cc3)nn2)c1 433533257 KOSLSUUJJYBNRM-UHFFFAOYSA-N 377.383 2.607 0 50 GFAA CCN(CC)C(=O)c1cccc(NC(=O)CN2CCC[C@@H](N3CCCC3)C2)c1 363690534 IPSXAHJKSSGJKR-HXUWFJFHSA-N 386.540 2.667 0 50 GFAA NCC[C@@H]1CCCN(C(=O)[C@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)C1 442620611 SVHCHAVKJSBRHB-GXTWGEPZSA-N 384.307 2.934 0 50 GFAA O=C1COc2cc(NC(=O)[C@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)c(Cl)cc2N1 369036806 RCIIRGCZVXCFMY-DMTCVQMQSA-N 390.745 2.965 0 50 GFAA C[C@H](CN1CC2(CCN(C(=O)c3cccnn3)CC2)OC1=O)c1ccccc1 77538300 KSGHIIHGFLIGCC-MRXNPFEDSA-N 380.448 2.707 0 50 GFAA O=C(Cn1ccc2ccc(F)cc21)N1CCN(Cc2ccc3c(c2)OCO3)CC1 31811759 ZUFGFODXACNLFP-UHFFFAOYSA-N 395.434 2.854 0 50 GFAA COC(=O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)c2ccccc21 159345369 AEKHBDVUQXVMBH-INIZCTEOSA-N 383.379 2.767 0 50 GFAA COc1ccccc1Nc1nc(-c2cnc(N3CCCC3)nc2C)cc(=O)[nH]1 36235591 LPSOGYYFPWMZMD-UHFFFAOYSA-N 378.436 2.888 0 50 GFAA Cc1cc(C)n(C)c(=O)c1C(=O)N(C)[C@@H]1CCCN(CCc2ccccc2)C1 72423186 UNGATPQDGMSZFF-HXUWFJFHSA-N 381.520 2.781 0 50 GFAA CC(C)[C@@H]1CN(CCC(=O)N2CCCC2)CCC(=O)N1Cc1ccc(F)cc1 71551906 LILJLPLNEICGEF-FQEVSTJZSA-N 389.515 2.897 0 50 GFAA O=C(O)[C@H]1CC2(CCN(Cc3ccc(O)c(Cl)c3)CC2)CN1C(=O)C1CC1 72470743 FORWFIRDXDRKDI-MRXNPFEDSA-N 392.883 2.723 0 50 GFAA O=C(c1cc(Cn2cccn2)on1)N1CCC[C@H]1c1cccc2c1OCCO2 292163183 FSJJPPZOBWVQEH-KRWDZBQOSA-N 380.404 2.668 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@@H]2CCC(=O)N(Cc3ccc(OC)cc3)CC2)C1 43135910 NBRMQKUOBROMCV-RBUKOAKNSA-N 388.508 2.851 0 50 GFAA CN(Cc1nc2ccccc2n1C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 426374419 SOFGJKMHMGNSSU-GOSISDBHSA-N 377.492 2.989 0 50 GFAA O=C(C1CC1)N1CCc2[nH]cnc2C12CCN(Cc1ccc(F)c(F)c1)CC2 95504439 SYAQITQPUFMYPZ-UHFFFAOYSA-N 386.446 2.974 0 50 GFAA Cc1ccn(CCC(=O)N2CCC(c3nccn3Cc3cccnc3)CC2)n1 95498557 USMVJQRIICLCSS-UHFFFAOYSA-N 378.480 2.628 0 50 GFAA Cc1nn(C)c(C)c1C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1 95498077 SZKFJOLMCDTXFO-UHFFFAOYSA-N 378.480 2.697 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@H](c2nccn2Cc2ccccn2)C1 95522822 MLSPKJRRMLWTHN-INIZCTEOSA-N 377.448 2.750 0 50 GFAA CN(C)C(=O)CN1CCCN(C(=O)Nc2ccccc2-c2ccccc2)CC1 96148020 RCTJPIHMKUYHGK-UHFFFAOYSA-N 380.492 2.981 0 50 GFAA Cn1ccc2cc(NC(=O)C[C@H]3N=C(O)N(Cc4ccccc4)C3=O)ccc21 252527921 DRMPJRLARNSZAE-QGZVFWFLSA-N 376.416 2.832 0 50 GFAA O=C(Nc1n[nH]c(C2CCC2)n1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 184587699 VXSGWMHUMKGYNL-UHFFFAOYSA-N 389.406 2.841 0 50 GFAA Cc1cnn(-c2ccc(S(=O)(=O)NCC3(c4ccccn4)CC3)cc2F)c1 184910113 LWCRBACUTYTEND-UHFFFAOYSA-N 386.452 2.725 0 50 GFAA O=C(NCCN1CCCC[C@H]1CO)c1ccc(-c2cnn3ccccc23)cc1 534664748 GGRSENPZPTUXEK-IBGZPJMESA-N 378.476 2.578 0 50 GFAA CC(=O)N1CCCn2nc(C(=O)N[C@@H](c3ccccc3)c3ccco3)cc2C1 65387672 NGYAQYLVTRLPSH-FQEVSTJZSA-N 378.432 2.748 0 50 GFAA O=C(NCCc1nc2ccccc2s1)N1CCC[C@H](c2cc(O)ncn2)C1 670469729 FDVLBHQBDBTSPM-ZDUSSCGKSA-N 383.477 2.924 0 50 GFAA O=C(N[C@@H]1C[C@@H]1[C@@H]1CCCNC1)c1nccnc1-c1nc2ccccc2s1 1875293024 ZXSDOVPCDPPVFT-UMVBOHGHSA-N 379.489 2.871 0 50 GFAA CC(=O)N/C(=C/c1cccs1)C(=O)NC[C@H]1CC(=O)N(C)[C@@H]1c1ccccc1 1875268692 IEAWNDKBGIQUBC-VCTZYMJXSA-N 397.500 2.561 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C2CCN(C(=O)c3ccccn3)CC2)C1 952860168 GZVQWPAZXFBFMV-QGZVFWFLSA-N 378.476 2.676 0 50 GFAA CCN1Cc2ccccc2C[C@H]1C(=O)Nc1cccc(C(=O)NCCOC)c1C 952991423 PFLXSHADDHXZAJ-NRFANRHFSA-N 395.503 2.757 0 50 GFAA Cc1cc(C)nc(SCC(=O)Nc2ccc(C)c(NC(=O)CN(C)C)c2)n1 952986621 MKXOFWQDJLRGQS-UHFFFAOYSA-N 387.509 2.633 0 50 GFAA CCc1nnc(N2CC[C@](C)(C(N)=O)C2)n1Cc1oc2ccc(F)cc2c1C 1306124464 PEFRSAHTPVIJNP-FQEVSTJZSA-N 385.443 2.784 0 50 GFAA Cc1sc2ncnc(N[C@H]3CCN(Cc4cscn4)C[C@@H]3O)c2c1C 1565526511 NGEFLUOYUWYQIL-KBPBESRZSA-N 375.523 2.812 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)[C@@H]1Cc3ccccc3O1)CC2 277783911 XUTZYLHUQNBLED-JXFKEZNVSA-N 397.427 2.608 0 50 GFAA COC(=O)[C@@H]1CCN2C(=O)N(c3ccc(OCc4ccccc4)cc3)C(=O)[C@@H]2C1 278227449 YDVWABZWCCVOEK-APWZRJJASA-N 394.427 2.986 0 50 GFAA COc1cc2nc(N3CC[C@@]4(C3)OCc3ccccc34)nc(N)c2cc1OC 302250255 MMBZIXQGYGJWFG-NRFANRHFSA-N 378.432 2.865 0 50 GFAA Nc1ncc2c(n1)[C@@]1(CCCN(Cc3cc(O)c4cccc(F)c4n3)C1)CC2 1704297788 XDYLXORUFHNPHZ-NRFANRHFSA-N 379.439 2.932 0 50 GFAA COCCCNC(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 12449369 DURDZVROJKAKDO-UHFFFAOYSA-N 383.492 2.891 0 50 GFAA Cc1ccc(CN2CCC3(CC2)C(=O)N(Cc2cccnc2)C(=O)N3C)s1 14731464 SPMMPHPQNRFGQM-UHFFFAOYSA-N 384.505 2.880 0 50 GFAA CN(C)C(=O)c1nn(Cc2ccccc2)c2c1C[C@H](N1CCSCC1)CC2 14746467 ZWHBVKCVCVHRJM-QGZVFWFLSA-N 384.549 2.539 0 50 GFAA O=C(NCCSc1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1 18214483 GJUTXLQWDAPYJC-UHFFFAOYSA-N 390.530 2.993 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccc(COC)o3)C[C@@H]2CCO)cc1 19794583 OIWPKDZXTTZZSF-IBGZPJMESA-N 388.508 2.894 0 50 GFAA O=C(Cc1ccccc1)N1CCC(c2n[nH]c(=O)n2Cc2ccc(F)cc2)CC1 169779635 OGALTZUCJBCYSU-UHFFFAOYSA-N 394.450 2.708 0 50 GFAA CC(C)(C)SCCNC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 2990688 FWGNUKQMLGXIFK-UHFFFAOYSA-N 378.947 2.754 0 50 GFAA CC[C@@]1(C(=O)NCc2ccccn2)C[C@@H]2CC[C@H]1N2C(=O)CCc1cccnc1 1857667732 PSJBEVVAZLSPTN-MIZPHKNDSA-N 392.503 2.885 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)no1 1857704672 BFWCADGTENRBFF-NRFANRHFSA-N 391.431 2.661 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3ccc(F)cc3F)C[C@]23CC[C@H]1O3)C1CCC1 1857719378 LBYGYHQAWPEQAD-GMLUQMLDSA-N 376.447 2.861 0 50 GFAA O=C(N[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(OCC(F)F)nc1 123330574 SWWZZFHVSMCWES-LBPRGKRZSA-N 382.798 2.783 0 50 GFAA Cc1nccnc1N1CCN(C(=O)c2csc(Cc3ccccc3)n2)CC1 372997327 DIYQGKQAXBKWQM-UHFFFAOYSA-N 379.489 2.795 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1ncc3ccccn13)CC2 909516366 KROCBYHYLNHZFI-INIZCTEOSA-N 395.415 2.566 0 50 GFAA Cc1ccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC[C@H](C)C3)n2)cc1 1857797831 YZAKWXWHERAHCN-DOTOQJQBSA-N 393.491 2.905 0 50 GFAA CC[C@H](C)N(C)CCNC(=O)C(=O)N1CC[C@@H](c2cc(C)c(Cl)cc2O)C1 2325757206 VENSYVCLVVSEBS-LSDHHAIUSA-N 395.931 2.516 0 50 GFAA C[C@@H](CNC(=O)Cc1ccc2c(n1)NCCC2)Cn1cc(C(F)(F)F)cn1 2325801644 QMEHZKCBXCAOJV-LBPRGKRZSA-N 381.402 2.650 0 50 GFAA CCc1ccccc1NC(=O)CN(c1ccc(OC)cc1OC)S(C)(=O)=O 652233 QVEUICGFFOQGQD-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA COc1ccc(COC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc3c(c2)OCO3)cc1 844302 WUPFNPAVVOETND-LJQANCHMSA-N 396.399 2.795 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)cc1 943614 FXUZAVKZMBMCQL-ZDUSSCGKSA-N 380.400 2.875 0 50 GFAA CC(=O)c1cccc(NS(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)c1 1110056 BVVMKGWJOIWTNE-UHFFFAOYSA-N 396.852 2.516 0 50 GFAA CC(C)Cn1c(CCN2C(=O)c3ccccc3C2=O)nc2ccccc2c1=O 1211891 ARUOCSLXMVUFQM-UHFFFAOYSA-N 375.428 2.891 0 50 GFAA O=C(NCc1ccco1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl 1430091 CCRYXPKYXZAGCD-UHFFFAOYSA-N 389.260 2.957 0 50 GFAA O=C(CSc1nnnn1-c1ccccc1)Nc1ccc(Br)cn1 2869091 IVQNATGWALUBBF-UHFFFAOYSA-N 391.254 2.551 0 50 GFAA O=C(NCc1ccco1)c1ccc2c(c1)N(Cc1ccccc1)C(=O)C[S@]2=O 5058601 PHVAJIVVGPFZCI-NDEPHWFRSA-N 394.452 2.864 0 50 GFAA COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OCC(C)C)cc1 5865137 XDGVFQWJZMLMFW-KRWDZBQOSA-N 378.494 2.704 0 50 GFAA Cc1c(C(=O)N2CC[C@@H](N(C)C)C2)sc2ncnc(NCc3ccco3)c12 12079362 UPGATYPOKCOUCH-CYBMUJFWSA-N 385.493 2.981 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2cc3c(cc2Cl)OCO3)C1)N1CCOCC1 12193927 WTNRFYKOGPSPHN-OAHLLOKOSA-N 394.899 2.920 0 50 GFAA CCN(CC)CC(=O)N(C)C[C@H]1CCCN(CCc2ccccc2OC)C1 14965957 UULNBAZERVSAON-LJQANCHMSA-N 375.557 2.750 0 50 GFAA O=C(/C=C/c1cccc(F)c1)N1CCC(=O)N(CCOc2ccccc2)CC1 20385105 CLEMGZSTTLZNIU-MDZDMXLPSA-N 382.435 2.979 0 50 GFAA O=C1N(CCCc2ccccc2)CCC[C@@]1(O)CN1CCN(C2CCCC2)CC1 23359017 VFKLWSJDAPCXTE-XMMPIXPASA-N 399.579 2.533 0 50 GFAA COc1ccc2cc(CN3CCC([C@H](O)c4ccccn4)CC3)c(=O)[nH]c2c1 67817067 RQVFWQNDDCMXHM-NRFANRHFSA-N 379.460 2.877 0 50 GFAA COc1cccc(C[C@@H]2CN(C(=O)c3c(C)[nH]c4c3C(=O)CCC4)CCO2)c1 71523525 VIHZJARLVCELNI-QGZVFWFLSA-N 382.460 2.934 0 50 GFAA CNc1nc2c(c(C(=O)N3CCCC3)n1)CN(C[C@@H](C)c1ccccc1)CC2 72153144 HOXGIPWLDKIHBK-MRXNPFEDSA-N 379.508 2.916 0 50 GFAA Cn1nc(-c2ccccc2)c2cc(C(=O)NC[C@]3(O)CCCNCC3)sc21 72158448 WQIRTJGYUFDVOQ-FQEVSTJZSA-N 384.505 2.536 0 50 GFAA Cc1ccc(CN2CCN(Cc3ccccc3O[C@@H](C)C(=O)O)CC2=O)cc1 72167112 PPZHIZXAJSHZTH-KRWDZBQOSA-N 382.460 2.691 0 50 GFAA O=C(Cn1c(Cc2ccccc2)nn(-c2ccccc2Cl)c1=O)NC1CC1 77356002 CCNRXYVGZSZXQW-UHFFFAOYSA-N 382.851 2.557 0 50 GFAA O=C(NCCc1ccccn1)c1cnc(C23CC4CC(CC(C4)C2)C3)[nH]c1=O 77503504 IHLHOWRRPRIVKY-UHFFFAOYSA-N 378.476 2.605 0 50 GFAA Cc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NS(=O)(=O)c2cn(C)cn2)cc1 91547920 SMWYTBKGOULYRK-KRWDZBQOSA-N 399.520 2.906 0 50 GFAA O=C(CCc1cc2n(n1)CCN(Cc1ccc3c(c1)OCO3)C2)NC1CCCC1 91586390 FDIOIXAMPYKJOD-UHFFFAOYSA-N 396.491 2.619 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(Cc4c(C)noc4C)C3)CCC2=O)cn1 91779269 MHJUCGJUQGTWSB-OAQYLSRUSA-N 383.496 2.795 0 50 GFAA Cc1oc(-c2cccs2)nc1CN1C[C@H]2CC[C@@H]1CN(S(C)(=O)=O)C2 95364029 SLSILJNLDBCDIP-ZIAGYGMSSA-N 381.523 2.567 0 50 GFAA O=C(CCC1CCN(C(=O)c2cnco2)CC1)N1CCN(c2ccccc2)CC1 95527613 LFMQVURGEQFKEE-UHFFFAOYSA-N 396.491 2.656 0 50 GFAA Cc1ccc(NS(C)(=O)=O)cc1NC(=O)N[C@@H](C)Cc1ncccc1C 96179909 HBZGYYNRQNPQTF-AWEZNQCLSA-N 376.482 2.823 0 50 GFAA OCCOc1ccc(CN2CCN(CCCc3ccccc3)[C@H](CCO)C2)cc1 103650586 XTTAEAKWDTWLLN-HSZRJFAPSA-N 398.547 2.559 0 50 GFAA Cc1ccc2nc(-c3cccnc3)cc(C(=O)NC3CCS(=O)(=O)CC3)c2c1 107346036 CWSPPHKPLSOWTN-UHFFFAOYSA-N 395.484 2.912 0 50 GFAA C[C@@H](c1cn(-c2ccccc2)nn1)S(=O)(=O)Cc1nc(C2CCCC2)no1 154969133 YRBSCOUJEKVASK-ZDUSSCGKSA-N 387.465 2.984 0 50 GFAA CCCC[C@@H](COC)NC(=O)C(=O)Nc1ncc(Cc2ccccc2)s1 170609851 PQMBCJQLVWPZNK-HNNXBMFYSA-N 375.494 2.994 0 50 GFAA CN(C)C(=O)[C@@H]1CCCN1C(=O)CCNc1ncc(C(F)(F)F)cc1Cl 172998329 SGJMIERQDUYUBM-LBPRGKRZSA-N 392.809 2.635 0 50 GFAA Cc1nc(Cl)sc1C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1 177760710 OWFMRCKNZZDFHA-UHFFFAOYSA-N 399.925 2.642 0 50 GFAA CNC(=O)c1cccc(C(=O)N2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)c1 181327746 KTYKGKHOGVLXSQ-SFHVURJKSA-N 389.459 2.851 0 50 GFAA Cc1c(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)cnn1C1CCCC1 183397751 AICSCRGUOYTSLA-FQEVSTJZSA-N 382.508 2.803 0 50 GFAA Cc1nn(-c2ccccc2)cc1NC(=O)N1CCCN(c2cccnn2)CC1 183681162 BVIYTMIETXDYSW-UHFFFAOYSA-N 377.452 2.715 0 50 GFAA O=C1[C@H]2O[C@H]2C(=O)[C@H]2[C@H]1[C@@]1(Cl)C(Cl)=C(Cl)[C@@]2(Cl)C1(Cl)Cl 238856706 WXYXLXQSWBFNEH-PZNYJWNGSA-N 396.868 2.984 0 50 GFAA COc1ccc2c(c1NC(=O)N(C)CC1CCN(C[C@H](C)O)CC1)CCC2 242287988 YKBWWCHAHPNATI-HNNXBMFYSA-N 375.513 2.740 0 50 GFAA Cc1cc(C)n(CCCC(=O)N[C@H]2C[C@@H](c3cc(N4CCCC4)ncn3)C2)n1 243901821 BEIKJCLJRFEGFJ-HDICACEKSA-N 382.512 2.733 0 50 GFAA O=C(NCC1CC1)[C@@H]1CCCN([C@@H]2CCN(c3cccc(Cl)c3)C2=O)C1 246098167 ANVMYRSXBRZAMK-CRAIPNDOSA-N 375.900 2.684 0 50 GFAA CS(=O)(=O)c1ccc2ncnc(NC[C@H](O)c3ccc(Cl)cc3)c2c1 252478521 AOVYXXOQIYAASE-INIZCTEOSA-N 377.853 2.832 0 50 GFAA CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 271596642 TVNLRDCOZNVTLO-MPGHIAIKSA-N 375.448 2.615 0 50 GFAA O=S(=O)(c1ccc2nc(O)nc(O)c2c1)N1CC2(CCC2)[C@H]1c1ccccc1 292660816 JEXPAXWYDGLXNB-QGZVFWFLSA-N 397.456 2.957 0 50 GFAA Cc1cc(C(=O)NCc2nnc3n2CCN(Cc2cccc(F)c2)CC3)c(C)o1 299765584 APJXRAKXQWVKTC-UHFFFAOYSA-N 397.454 2.615 0 50 GFAA O=C(c1cc2ccccc2[nH]1)N1CCO[C@@H](c2ccnc(N3CCCC3)n2)C1 328620367 GYCKSAJJGSTZCK-LJQANCHMSA-N 377.448 2.772 0 50 GFAA Cn1cc([C@@H]2CN(c3cc(N4CCCCC4)ncn3)CC23CCOCC3)cn1 333672700 JFMKRXUTSQNNKC-SFHVURJKSA-N 382.512 2.601 0 50 GFAA O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@H](Cc2ccncc2)C1 363703825 VFASTZSAPBJROH-FGZHOGPDSA-N 379.504 2.764 0 50 GFAA O=C1NCCN1CCN1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 368009530 XBQSSLBENGRFCI-INIZCTEOSA-N 375.517 2.787 0 50 GFAA Cc1cccc(-c2n[nH]cc2CN2CCC(Oc3ccnc(C(N)=O)c3)CC2)c1 368051963 RISBPRLNNJAFPX-UHFFFAOYSA-N 391.475 2.922 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)nc1)[C@H](O)c1cc(Cl)cc(Cl)c1 378315270 OXOKFRDJIBEACG-MRXNPFEDSA-N 377.231 2.924 0 50 GFAA O=C(NCC1(O)CCCCC1)c1ccc(-c2ccc(-c3nn[nH]n3)cc2)cc1 426509799 BFAZEEVBEIAYCB-UHFFFAOYSA-N 377.448 2.959 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1 426623376 WQFGYQMPLBVYKP-ZDUSSCGKSA-N 377.489 2.516 0 50 GFAA CS(=O)(=O)N1CC[C@H](COC(=O)Cc2csc3ccc(Cl)cc23)C1 801293328 KEVMUSVIGDDLQK-NSHDSACASA-N 387.910 2.922 0 50 GFAA CCC(=O)N1CCC2(CC1)CN(C(=O)c1ccc(C(F)(F)F)cc1)CCO2 822529520 IOXQTZKQWMXZIY-UHFFFAOYSA-N 384.398 2.949 0 50 GFAA C[C@H](c1ccccc1)[C@H](O)CNC(=O)C(=O)c1ccc(Br)s1 856288389 GFHLFUKHCZPSEF-ZYHUDNBSSA-N 382.279 2.974 0 50 GFAA COc1ccc2c(c1)c(C(=O)N1CCN(c3ncnc(C)c3C)CC1)c(C)n2C 952966934 LANXLIVPKUPYKT-UHFFFAOYSA-N 393.491 2.865 0 50 GFAA COCCN1C[C@H](C(=O)Nc2ccc(Oc3ccccc3OC)nc2)CCC1=O 952979344 VZWATUBVFLSWTI-OAHLLOKOSA-N 399.447 2.706 0 50 GFAA COc1ccc(Cl)cc1[C@@H](C(=O)O)N1CCOc2ccc(CO)cc2C1 1506424572 KMBNBMYRNTUSFB-SFHVURJKSA-N 377.824 2.861 0 50 GFAA COc1cccc([C@H]2CCN(CC(=O)NCCc3ccc(F)cc3)C2)c1OC 1529159233 QTAMNGKQUATHHG-KRWDZBQOSA-N 386.467 2.991 0 50 GFAA CO[C@H](C)c1nnc(NC(=O)CCSc2nnc(-c3ccncc3)o2)s1 1529174494 WQGCWNZFCYLHSY-SECBINFHSA-N 392.466 2.811 0 50 GFAA COc1ccccc1-c1ncc(CN(CCN(C)C)Cc2cnc(C)[nH]2)cn1 1704307055 RYWGVWSRPZNEHL-UHFFFAOYSA-N 380.496 2.748 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(Cc3nc4ccccc4n3C)C1)CC2 1704330550 XTOOJUWIFHNNSX-QFIPXVFZSA-N 376.508 2.909 0 50 GFAA Cc1ccc2c(C(=O)NC34C[C@@H]5C[C@H](C3)CC(n3cncn3)(C5)C4)cnn2c1 1772711021 VUVJSJKHMZPUEU-XBLGPDGASA-N 376.464 2.712 0 50 GFAA CC1CCN(C(=O)COc2ccccc2CN2C[C@@H]3CCCN3C(=O)[C@H]2C)CC1 1772816173 GSVCYFKREWTXDM-QUCCMNQESA-N 399.535 2.519 0 50 GFAA CCn1cnc2c1CCN(Cc1nnc(-c3cccc(O)c3)o1)C21CCOCC1 1775962895 SVHBZSUMPFTKTD-UHFFFAOYSA-N 395.463 2.723 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4ncc[nH]4)C3)nc2c1 1857725675 IDZHTIDCDPNQIU-AWEZNQCLSA-N 383.452 2.525 0 50 GFAA COc1ccc(CCCC(=O)N[C@H]2CC[C@H](C(=O)NC3CC3)C[C@@H]2OC)cc1 1857735277 AWUBZUSJYUYARQ-VDGAXYAQSA-N 388.508 2.596 0 50 GFAA CC(=O)N1CCC(C2CCN(C(=O)c3[nH]c4c(c3C)C(=O)CCC4)CC2)CC1 1857736089 KCNUJOGFVXMVES-UHFFFAOYSA-N 385.508 2.953 0 50 GFAA CCC(=O)N1CCC[C@@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NCC2CC2)C1 1875250876 NVYIBIJZITWPPV-HSZRJFAPSA-N 391.519 2.999 0 50 GFAA O=C(c1cc(F)c2nc(O)ccc2c1)N1CCC[C@H](C(=O)N2C[C@H]3CC[C@H]2C3)C1 1875307810 LNGINRMEXIJCOE-QRTARXTBSA-N 397.450 2.943 0 50 GFAA O=C(NC[C@@H]1C[C@H]2OCC[C@@H]2O1)c1cc(-c2ccc(Br)cc2)[nH]n1 1875308832 ZZTMNCCTUPPLAO-VBNZEHGJSA-N 392.253 2.515 0 50 GFAA CCc1cc(C)cc(CC)c1-c1c(NC(=O)C(F)F)n2n(c1=O)CCOCC2 1875340294 UZUZYKGCPAGZBM-UHFFFAOYSA-N 393.434 2.984 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)CCn1ccc2ccccc21 1875401269 HPPMPZKWIMTFGP-LPHOPBHVSA-N 379.464 2.865 0 50 GFAA O=C(Nc1nccc(-c2ccccn2)n1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 2100482837 CAZDAFUVJKIHCT-SFHVURJKSA-N 389.415 2.908 0 50 GFAA C[C@@H](NC(=O)c1cccc2ccn(Cc3ccccc3)c12)C1(O)CCNCC1 2325809069 BUOWNISJZZAYIW-QGZVFWFLSA-N 377.488 2.922 0 50 GFAA O=C(Cc1ccc(F)cc1Br)NC1(C(=O)O)Cc2ccccc2C1 2325877072 IHNGBUGJKUZZKZ-UHFFFAOYSA-N 392.224 2.869 0 50 GFAA Cc1ncccc1Oc1ncnc(N2CCc3nc(C4CC4)nn3CC2)c1C 2356149598 LCVMAZJRQXXUPY-UHFFFAOYSA-N 377.452 2.812 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)Nc2ccc(OC)cc2C)C1=O 2356162796 KMIFTUTZPASNDL-HXUWFJFHSA-N 375.469 2.639 0 50 GFAA COC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1ccc(F)cc1 935978 RJPAEGRYYCXKKG-UHFFFAOYSA-N 376.409 2.923 0 50 GFAA COc1ccc(CCNC(=O)C(=O)Nc2cccc(Br)c2)cc1 2864695 MXYZFWMJDSTBMI-UHFFFAOYSA-N 377.238 2.755 0 50 GFAA biogenic O=C(C[C@H]1C(=O)NCCN1Cc1ccc(F)cc1)NC12CC3CC(CC(C3)C1)C2 55089012 DRXXMTAXOKJGSB-JNCPLXCYSA-N 399.510 2.601 0 50 GFAA COc1ccc(OC)c(N2C(=O)[C@@H]3C[C@H]2CN3Cc2nc3ccccc3n2C)c1 55108857 VIQPJCWTKQQVRV-LIRRHRJNSA-N 392.459 2.580 0 50 GFAA CCOc1ccc(CN2CCN(C3CCCCC3)[C@@H](CCO)C2)cc1CO 20455240 XICDBHDLDJWHRB-NRFANRHFSA-N 376.541 2.779 0 50 GFAA O[C@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)cn1 252488153 ILVGFILWSLNOHJ-WMLDXEAASA-N 385.302 2.538 0 50 GFAA CCc1ncc(C(=O)N(C)C[C@@H]2CCCN(CC)[C@H]2c2cnn(C)c2)s1 328623087 IVKVMKWZFLTSLO-KBXCAEBGSA-N 375.542 2.984 0 50 GFAA COCCN1C(=O)CC[C@@H]2CN(C3CCN(CCc4ccccc4)CC3)CC[C@@H]21 12036050 NUSSXPNOQVIWSM-GGAORHGYSA-N 399.579 2.653 0 50 GFAA CN1C(=O)[C@](CC(=O)NCC(C)(C)CO)(Cc2ccccc2)c2ccccc21 71721300 ODDADJOEWKORFP-QHCPKHFHSA-N 380.488 2.668 0 50 GFAA Cc1ccccc1CN1CCNC(=O)[C@H]1CC(=O)NC(C)(C)c1ccccc1 72153131 GUTFPPLKNZFHMM-HXUWFJFHSA-N 379.504 2.737 0 50 GFAA CC(C)(C)c1ccc(C(=O)NCC(=O)N2Cc3ccccc3[C@@H](C(=O)O)C2)cc1 263023856 YNRJBMKTHUIZDT-IBGZPJMESA-N 394.471 2.925 0 50 GFAA COc1ccc(-c2ncc(CN3CCCn4nc([C@H](C)O)cc4C3)cn2)cc1 219497743 OBMNLSCLJHSGJJ-HNNXBMFYSA-N 379.464 2.808 0 50 GFAA CC(C)CN(C)CCCN1CC2(CCN(C(=O)c3ccco3)CC2)OC1=O 72426393 YQWHGIMYSLPSPT-UHFFFAOYSA-N 377.485 2.685 0 50 GFAA COc1ccc2c(ccn2CCC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c1 225424441 ATYNXEAKUCUIIG-AEFFLSMTSA-N 391.471 2.848 0 50 GFAA biogenic COc1ccc(S(=O)(=O)N2CCN(Cc3ccc(C)cc3)CC2)c(OC)c1 17079696 PFGQJAJFMJYOOW-UHFFFAOYSA-N 390.505 2.519 0 50 GFAA CCN(CC)CCCN[C@H](CC(=O)c1ccc(Br)cc1)C(=O)O 20432488 MIIVPDZZUGXBEQ-OAHLLOKOSA-N 385.302 2.797 0 50 GFAA C[C@@H]1CCCN([C@@H]2CCC(=O)N(CCS(=O)(=O)c3ccccc3)CC2)C1 43056878 GXNVZKPVOVQABJ-QZTJIDSGSA-N 378.538 2.573 0 50 GFAA Cc1nc(C2CC(O)C2)cc(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)n1 223617153 SQYNXLSASGNSEF-UHFFFAOYSA-N 379.464 2.508 0 50 GFAA CCSc1nc(CC(=O)N2CCN(c3ccc(C)cc3)C(=O)C2)cs1 82100098 TVPQXJVZVNKOEA-UHFFFAOYSA-N 375.519 2.981 0 50 GFAA O=C(NC1CCNCC1)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1 95531039 LXQNXHFXVWQZHI-UHFFFAOYSA-N 394.519 2.607 0 50 GFAA CCNC(=O)c1cccc(NC(=O)NCCc2nc(C)c3c(n2)CCC3)c1C 96140211 JMXMCPYMCGRDIY-UHFFFAOYSA-N 381.480 2.696 0 50 GFAA Cc1ccc2nc([C@@H](C)NC(=O)Cn3nc(C)c4ccccc4c3=O)[nH]c2c1 91305963 KABFKEDXGLWTGI-CQSZACIVSA-N 375.432 2.767 0 50 GFAA CSc1nc(N)cc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)n1 91770226 TYOWOWVQGDLBTC-OAHLLOKOSA-N 381.509 2.805 0 50 GFAA CC(C)N1CCC2(CC[C@@H](CNC(=O)c3ccccc3-c3nc[nH]n3)O2)CC1 97579003 XCEDMLKLKNVNKL-INIZCTEOSA-N 383.496 2.624 0 50 GFAA O=C(NCc1ccccc1CN1CC[C@@H](O)C1)Nc1ncn(C2CCCCC2)n1 184579303 YYHZTBKDVZWDSE-LJQANCHMSA-N 398.511 2.672 0 50 GFAA CC(=O)NC[C@@H]1CCC2(CCN(c3nccc(-c4ccc(C)nc4C)n3)CC2)O1 71759236 DVEKPWWBHOXLKU-SFHVURJKSA-N 395.507 2.810 0 50 GFAA COc1ccc(-c2noc([C@H](C)NC(=O)N3CCC(F)CC3)n2)cc1OC 584899587 PTDWOFYRQPGTHZ-NSHDSACASA-N 378.404 2.958 0 50 GFAA Cn1cnc2cc(NC(=O)[C@H]3C[C@H]3C(=O)Nc3ccc4c(c3)ncn4C)ccc21 1875263113 PZQOIPNDUHLXCO-GASCZTMLSA-N 388.431 2.673 0 50 GFAA NS(=O)(=O)c1cccc(CCNc2nccn3nc(-c4ccccc4)cc23)c1 1875324427 YIXRFLAIEHPODB-UHFFFAOYSA-N 393.472 2.698 0 50 GFAA Cc1nc([C@@H](C)N(C)S(=O)(=O)c2ccc3oc(=O)n(C)c3c2)c(C)s1 952872189 JTBKDSQYBUAWMQ-SECBINFHSA-N 381.479 2.587 0 50 GFAA CSCC[C@H](C(=O)Nc1ncc(C)s1)n1c(O)nc2ccccc2c1=O 888088977 AINRRGLFURCFEI-CYBMUJFWSA-N 390.490 2.800 0 50 GFAA Cc1noc(-c2ccnc(N3CC[C@H](c4ccc5c(c4)OCO5)[C@@H](O)C3)c2)n1 1565506161 FQLJAYPCKSIDDG-CVEARBPZSA-N 380.404 2.524 0 50 GFAA CCc1nn(C)c(CC)c1CC(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1 188250359 ULOXVTRSKGPSEX-LBPRGKRZSA-N 395.500 2.507 0 50 GFAA O=S(=O)(Nc1cccc2c1OCC[C@H]2O)c1cnn(-c2ccccc2F)c1 225616660 OBSVTRJCMSCRAE-QGZVFWFLSA-N 389.408 2.628 0 50 GFAA COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2S(=O)(=O)c2ccc3ccccc3c2)O1 225832109 XGRRCLPTJQVYEO-XEKGUZQTSA-N 389.473 2.712 0 50 GFAA O=C([C@H]1CCCC[C@H]1C(=O)N(CCO)Cc1ccc(F)cc1)N1CCCC1 1616105509 FIJKXAFKLDORCI-RBUKOAKNSA-N 376.472 2.575 0 50 GFAA CCc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(OC)c(OC)c1 1147003 XCULCNGFKQKRIX-UHFFFAOYSA-N 392.477 2.525 0 50 GFAA C[C@@]1(C2CCN(C(=O)c3ccc(Oc4ccccc4)o3)CC2)NC(=O)NC1=O 12134427 KIHCAPIODVFRSU-FQEVSTJZSA-N 383.404 2.522 0 50 GFAA CC[C@H]1CN(CC(=O)NCCCc2cccnc2)Cc2cc(OC)ccc2O1 14882290 UKIJZMRPQDTQHF-IBGZPJMESA-N 383.492 2.812 0 50 GFAA Cc1nonc1CC(=O)N(C)C[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1 14950132 NLZMZYODLBSGJT-KRWDZBQOSA-N 390.915 2.987 0 50 GFAA CC[C@]1(CCC(=O)N2CCCN(c3nc4ccccc4o3)CC2)CCC(=O)N1 14974110 SUJHBXSQASJTMG-OAQYLSRUSA-N 384.480 2.706 0 50 GFAA Cc1ncsc1CCNC(=O)[C@H]1CCCN(C2CCN(C(C)C)CC2)C1 19229352 DHMCSSWTNFXDHO-KRWDZBQOSA-N 378.586 2.695 0 50 GFAA COc1cccc(C(=O)N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)c1 169779309 GHUHAJHHJIXAGR-UHFFFAOYSA-N 380.370 2.775 0 50 GFAA Cc1nc(-c2cn([C@H]3CCCN(C(=O)c4cc5ccccc5[nH]4)C3)nn2)no1 169780961 BGUHVHCJDNAWDG-AWEZNQCLSA-N 377.408 2.595 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)cc2)c(OC)c1 909847 KITVGDWOZLPHAA-GOSISDBHSA-N 383.404 2.676 0 50 GFAA O=C(CSc1nnnn1-c1ccccc1)Nc1ccccc1OC(F)F 3282181 DVRWYQIBSJGQGK-UHFFFAOYSA-N 377.376 2.995 0 50 GFAA COc1cc2nc(N(C)CCn3cnc4ccccc43)[nH]c(=N)c2cc1OC 1857667817 WKNQVNRJMDUWPQ-UHFFFAOYSA-N 378.436 2.546 0 50 GFAA CCOC(=O)[C@@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3ccccc3-c3nc[nH]n3)C[C@H]21 1857695964 GKTQXKIYLUXDIE-LBTBCDHLSA-N 380.448 2.545 0 50 GFAA O=C(N[C@@H]1CN2CCCC[C@@]2(C(=O)NCCc2ccccc2)C1)c1ccccc1 1857704404 QNOWEACJTOFJHS-URXFXBBRSA-N 391.515 2.772 0 50 GFAA CC[C@@]1(C(=O)NCCc2cnn[nH]2)C[C@@H]2CC[C@H]1N2Cc1ccc(Cl)o1 1857718823 UWGICNZIWLUPFK-JCKWVBRZSA-N 377.876 2.543 0 50 GFAA Cc1cc(S(N)(=O)=O)ccc1CNC(=O)c1ccc2ccc(Cl)cc2n1 225567223 CQJYKZWQNPBIJB-UHFFFAOYSA-N 389.864 2.774 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1CCO[C@H](c2ccnc(N3CCCC3)n2)C1 328627931 NEMIAMITJFZPTJ-IBGZPJMESA-N 377.448 2.772 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1ccc(C(N)=O)c(C)c1 264029889 LTDFTOPPWASYEY-SFHVURJKSA-N 395.459 2.736 0 50 GFAA CC(C)(C(=O)N1CC2(C[C@@H](NC(=O)Cc3ccco3)c3nccn32)C1)C1CCC1 2332237816 MTNGCTWMDXVILE-QGZVFWFLSA-N 396.491 2.644 0 50 GFAA O=c1cc(CN2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)nc2sccn12 2356150293 VJZSEQDYPYQUIH-RRMPHLOHSA-N 381.501 2.876 0 50 GFAA O=C(N[C@H]1COc2ccccc2C1)c1cc2c(s1)C1(CCNCC1)OCC2 2356162946 VASOWSSNMGBIME-MRXNPFEDSA-N 384.501 2.633 0 50 GFAA O=C(c1cccc(-n2cccn2)c1)N1CCc2nc(-c3ccccc3)nn2CC1 2356169748 YHRKOTHPEZOZGJ-UHFFFAOYSA-N 384.443 2.829 0 50 GFAA C[C@H](c1ccccc1)N1C(=O)C[C@H](Nc2ccc(N3CCOCC3)cc2)C1=O 4317768 GRZHBPUNYRXKMH-UZLBHIALSA-N 379.460 2.824 0 50 GFAA O=C(CCS(=O)(=O)Cc1ccccc1)Nc1nnc(C(F)(F)F)s1 4731555 PPCYMYMSRRAXAQ-UHFFFAOYSA-N 379.385 2.501 0 50 GFAA COc1ccc(-c2cc(C(=O)N3C[C@H]4CC[C@H]3C4)cc(-n3cnnn3)c2)cc1 102399972 GTUAQLHRCAIUBS-KSSFIOAISA-N 375.432 2.962 0 50 GFAA OCCOc1ccccc1CN1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 23372911 MFVAXXHAGFZUGI-HSZRJFAPSA-N 395.547 2.844 0 50 GFAA COc1cc2c(cc1[C@@H]1CC(=O)NCc3nc4cc(C)ccn4c31)OCCO2 65395134 CNVSXEUGTGRQND-AWEZNQCLSA-N 379.416 2.574 0 50 GFAA Cc1c(C(=O)NCc2cc(F)cc3c2OCOC3)cnn1CC1CCOCC1 252550009 RZBXVXKVCBBYGM-UHFFFAOYSA-N 389.427 2.554 0 50 GFAA Cc1cn(-c2c(F)cccc2F)nc1C(=O)Nc1ccc(N2CCOCC2)nc1 252535936 HFWBSBDGBRRWIT-UHFFFAOYSA-N 399.401 2.943 0 50 GFAA COc1cc(-c2nc3c([nH]2)C[C@@H](c2ccccc2OC)CNC3=O)ccc1O 65424444 KKLTUPKRWDOJBC-CYBMUJFWSA-N 379.416 2.869 0 50 GFAA C[C@H](NC(=O)N1C[C@@H](C)OC2(CCOCC2)C1)[C@@H]1CCCN(C2CCC2)C1 333223731 SICVDFFILSYWCG-FGTMMUONSA-N 379.545 2.619 0 50 GFAA C[C@@](NC(=O)c1cn(-c2ccc(Br)cc2)cn1)(C(=O)O)C1CC1 237730707 TXLYDNXZACTWHH-INIZCTEOSA-N 378.226 2.618 0 50 GFAA O=C(NCc1ccnc(O[C@H]2CCOC2)c1)N1CCCN(c2ccccc2)CC1 152435543 SDPYTBOSYXTWOI-FQEVSTJZSA-N 396.491 2.671 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)c3cccc(N4CCCC4=O)c3)CC2)C[C@@H](C)O1 72422192 BDRNMFXXNJARPP-CALCHBBNSA-N 385.508 2.527 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccccc3O)C2)CN1Cc1ccccn1 72447865 OZBJEOBKUDOGBJ-JOCHJYFZSA-N 379.460 2.832 0 50 GFAA CC(C)S(=O)(=O)c1ccccc1C(=O)Nc1ccc2c(c1F)CCNC2 261825113 YLNFSJMHJMYRGK-UHFFFAOYSA-N 376.453 2.906 0 50 GFAA CC(C)Oc1ccc(C(=O)O)cc1NC(=O)C1CCN(c2cnccn2)CC1 262109688 INACBIDWJZQBKX-UHFFFAOYSA-N 384.436 2.817 0 50 GFAA CCc1n[nH]c(C(=O)N2CCC3(CC2)CN(CCc2ccccc2)C(=O)O3)c1C 77440382 YTKFXJDIDKEWFL-UHFFFAOYSA-N 396.491 2.950 0 50 GFAA CC(C)CN1CC[C@H](CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)C1 241326111 LZIVSHNPXFMHFQ-OKZBNKHCSA-N 389.544 2.795 0 50 GFAA CN(C)c1nc2c(c(=O)[nH]1)CCN(C(=O)C1c3ccccc3-c3ccccc31)C2 72170312 YTPVPDZKPSBMGG-UHFFFAOYSA-N 386.455 2.533 0 50 GFAA CCOc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@@H](N)C2)cc1OCC 132590319 NXBZXEHYSQJZEI-MRXNPFEDSA-N 382.460 2.888 0 50 GFAA COCc1nc(C)c(C(=O)NS(=O)(=O)Cc2cc(Cl)ccc2F)s1 133595546 HDRDBFVAOQUBTO-UHFFFAOYSA-N 392.861 2.650 0 50 GFAA CCCNC(=O)C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 72153787 PBHPKGKJRNLERY-HXUWFJFHSA-N 381.476 2.696 0 50 GFAA COc1ccc(Cc2noc([C@H](c3cccc(F)c3)N3CCOCC3)n2)cn1 289206703 XYVBGXGBQGGLKG-IBGZPJMESA-N 384.411 2.625 0 50 GFAA Cc1ccc(CN2CCN(C(=O)N[C@H](C)CCCC(C)(C)O)CC2=O)cc1C 426500317 SIQFYGSCCUWOTH-GOSISDBHSA-N 389.540 2.987 0 50 GFAA O=C(NCC1(N2CCOCC2)CCCCCC1)N1CCC[C@@H](c2cc[nH]n2)C1 426510322 YSMJVOJZRVFAJV-GOSISDBHSA-N 389.544 2.724 0 50 GFAA O=C(C1CCN(C[C@H](O)COc2ccccc2F)CC1)N1CCc2ccccc21 194973168 PILUEQGOLLTUGY-IBGZPJMESA-N 398.478 2.867 0 50 GFAA COc1cccc(CCNC(=O)N2CCN(C3Cc4ccccc4C3)CC2)c1 426646995 GPCJIUWPZMHHKW-UHFFFAOYSA-N 379.504 2.732 0 50 GFAA COc1ccccc1-n1cc(C(=O)N2CC[C@]3(OC)CC[C@H](OC)C[C@H]23)cn1 426622941 MFPZORMPWUVIBY-NBHGPNQESA-N 385.464 2.680 0 50 GFAA C/C(=C\c1ccccc1)CN1CC[C@H](N2CCN(C)CC2)[C@H](CCC(=O)O)C1 95502388 AKPHXUGZEMBOGP-KIAWPDGXSA-N 385.552 2.893 0 50 GFAA OCC1CCN(C[C@@H]2CN(Cc3cc(Cl)ccc3Cl)C[C@@H]2CO)CC1 95375913 PWEMXTYRSWGFQF-IAGOWNOFSA-N 387.351 2.738 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2csc(C)n2)CC3)cn1 91255934 VNXFXOFGHDRERM-UHFFFAOYSA-N 399.520 2.595 0 50 GFAA CCc1nnc(CN2CCC[C@H]2C(=O)Nc2ccc(-n3ccnc3C)cc2)o1 95496608 ZMBVYUMTKNARGH-KRWDZBQOSA-N 380.452 2.729 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)N(C(=O)Cc1ccc(F)cc1F)C2 95375203 HRRSGYJZQGRTLZ-WMLDXEAASA-N 385.414 2.666 0 50 GFAA OC[C@H]1CN(CC(c2ccccc2)c2ccccc2)C[C@H]1CN1CCC(O)CC1 95385526 XWDFXQAQACFBFA-DHIUTWEWSA-N 394.559 2.816 0 50 GFAA Cc1ccc2[nH]cc([C@@H](C(=O)O)N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 263585995 ORKNERHMCZSBPF-PZPWOCDFSA-N 377.444 2.883 0 50 GFAA biogenic O=C(NC1CCN(CCc2ccccc2)CC1)N[C@H](CO)Cc1ccc(F)cc1 270879447 DTLSSHJJPFUSJZ-QFIPXVFZSA-N 399.510 2.735 0 50 GFAA Cc1nc(C(=O)N2CCC(c3ccc(F)cc3)CC2)nc(N2CC[C@@H](N)C2)c1C 1875401874 UTOJJHFXQXDYCR-LJQANCHMSA-N 397.498 2.790 0 50 GFAA C[C@@H]1CCS[C@H]1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H]1CCSC1 1875357794 XCIWUBQZFUAAGW-OPTNGKCXSA-N 390.574 2.780 0 50 GFAA Cc1ccccc1N1CCCN(C(=O)Cc2ccc(S(C)(=O)=O)cc2)CC1 952990542 RAZZCYCOEASUTP-UHFFFAOYSA-N 386.517 2.680 0 50 GFAA CC(C)C(=O)N1CC[C@@H]2[C@@H](C1)NC(=O)N2C1CCN(CC2CCCCC2)CC1 888103596 OMEBDLQBMYPZCO-WOJBJXKFSA-N 390.572 2.682 0 50 GFAA Cc1ccc(N2CC[C@@H](N(C)S(=O)(=O)c3cccc4cnccc34)C2=O)cc1 1775997977 WWMIHRIYBNVDKJ-LJQANCHMSA-N 395.484 2.969 0 50 GFAA Cc1nn(C)c(C)c1NC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1 170595744 OUPIWFGLXMKOBO-UHFFFAOYSA-N 391.472 2.521 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)NCc3cn4c(n3)SCC4)c(C)s2)n[nH]1 1506404978 WQRJDHCWDMXQSQ-UHFFFAOYSA-N 395.535 2.536 0 50 GFAA Cc1ccc(O[C@H](C)C(=O)Nc2nnc(SCC(=O)N(C)C)s2)cc1C 1506403630 UUOALWGHNXAUQX-GFCCVEGCSA-N 394.522 2.741 0 50 GFAA CC(C)Sc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1ccccc1Cl 625447 GXIAZCYNAYIJGR-UHFFFAOYSA-N 378.885 2.636 0 50 GFAA Cc1ccccc1-c1cccc(CN2CC[C@H](N3CCN(C)CC3)[C@@H](O)C2)c1 1614377301 VDNGXTFACDOXSE-ZEQRLZLVSA-N 379.548 2.845 0 50 GFAA CCOC(=O)c1c(NC(=S)NN2CCOCC2)sc2c1CCCCC2 1118842 VUIGKXDGOSUROL-UHFFFAOYSA-N 383.539 2.727 0 50 GFAA O=C(Nc1c(C(=O)N2CCOCC2)cnn1-c1ccccc1)c1ccc(F)cc1 1138841 OQBLIJJBMLVYOM-UHFFFAOYSA-N 394.406 2.736 0 50 GFAA Cn1ccc(C2CCN(C(=O)CCc3nc4ccc(F)cc4[nH]3)CC2)cc1=O 1772818575 HGACYVHNURJCLU-UHFFFAOYSA-N 382.439 2.740 0 50 GFAA COc1cc(OC)cc(C(=O)N2CCCN(c3cc(C4CC4)ncn3)CC2)c1 1772813642 LNOGWBAEKNMUJQ-UHFFFAOYSA-N 382.464 2.724 0 50 GFAA COCCc1nc2ccc(C(=O)N3CCN(C(=O)c4cccs4)CC3)cc2o1 11813847 QTELQZLTNNBGRE-UHFFFAOYSA-N 399.472 2.676 0 50 GFAA O=C(NCCN1CCOC1=O)c1ccc2oc(CCc3ccccc3)nc2c1 12000357 XYEOQNQYVNOVRT-UHFFFAOYSA-N 379.416 2.795 0 50 GFAA CC(C)N1CCC2(CC[C@@H](CNC(=O)CCc3ccc4c(c3)OCO4)O2)CC1 12004633 MFQOQDDWMVAFTG-SFHVURJKSA-N 388.508 2.886 0 50 GFAA CCN(CC)C(=O)c1cn(C[C@@H]2CCCN(C(=O)Cc3cccc(C)c3)C2)nn1 12245321 WZZYJTJULMPSOI-LJQANCHMSA-N 397.523 2.550 0 50 GFAA CC1(C)Cc2cc(CNC(=O)[C@H]3CCC(=O)N(Cc4ccccn4)C3)ccc2O1 12448530 GHQDRTMUIBYJOR-KRWDZBQOSA-N 393.487 2.850 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N[C@H]2CCCN(CC3CCCCC3)C2)CC1 12612819 NTASZSHQWBVGBL-IBGZPJMESA-N 378.561 2.541 0 50 GFAA COCCN(Cc1cnn(C)c1)C[C@@H]1CCCN(C2Cc3ccccc3C2)C1 12835972 GYCIGSGNSFXLDD-IBGZPJMESA-N 382.552 2.748 0 50 GFAA Cc1ccccc1N1CCN(CC(=O)Nc2ccc(Br)cn2)CC1 14218362 SPXCTSNELVYIFV-UHFFFAOYSA-N 389.297 2.913 0 50 GFAA CSCCC(=O)N1CC(=O)N(CC(C)C)C[C@H](OCc2ccccc2F)C1 14742770 YNLXKVZIMVCYHS-KRWDZBQOSA-N 396.528 2.791 0 50 GFAA O=C(CCC(=O)N1CCC[C@H]1c1ccc(F)cc1)N1CCC2(CC1)OCCO2 19228889 MZAJRFTZWPKYLZ-SFHVURJKSA-N 390.455 2.635 0 50 GFAA O=C(Cc1cccc(F)c1)NCc1nnc2c(-c3nc(C4CC4)no3)cccn12 169776124 WCYSGDOAMQQWJQ-UHFFFAOYSA-N 392.394 2.655 0 50 GFAA COC(=O)Cn1c(=O)n(CCc2ccccc2)c(=O)c2c3c(sc21)CCCC3 2866603 QQPRPPJQIFADIH-UHFFFAOYSA-N 398.484 2.519 0 50 GFAA CC(=O)Oc1cccc(/C=c2/sc3nc(-c4ccc(Cl)cc4)nn3c2=O)c1 2533707 ZBWKAZSWDPXUKG-MHWRWJLKSA-N 397.843 2.944 0 50 GFAA OCCn1cc(Nc2cc(Oc3ccccc3Br)ncn2)cn1 1857530916 ZMCOXKLSWFRAAU-UHFFFAOYSA-N 376.214 2.964 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)[C@H]1CC(=O)OC13CCCC3)CC2 1857671719 YXNDPKDTPVMJGM-GOSISDBHSA-N 393.487 2.890 0 50 GFAA O=C(N[C@@H]1CN2CCCC[C@]2(C(=O)NCCc2ccccc2)C1)c1ccccc1 1857681933 QNOWEACJTOFJHS-XUZZJYLKSA-N 391.515 2.772 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N1C[C@H](C(=O)O)C2(CCOCC2)C1 1857686679 BRILJMRZIARPQQ-QGZVFWFLSA-N 384.476 2.975 0 50 GFAA CO[C@@H](C)C(=O)N1CCC2(CC1)OCCc1cc(C(=O)NC(C)(C)C)sc12 1857692499 HNQFAMZBBFXDQB-ZDUSSCGKSA-N 394.537 2.702 0 50 GFAA CN(CC(=O)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1)C1CCCC1 1857720797 KUPWOVZKSPPCNG-GMAHTHKFSA-N 385.552 2.925 0 50 GFAA Cc1nc(CN2CCN(C(=O)[C@@H](O)c3ccc(Cl)cc3F)CC2)cs1 813404556 ZEPVLQDZRGIDRQ-INIZCTEOSA-N 383.876 2.622 0 50 GFAA O=C1NC(=O)C(CCc2ccncc2)(Cc2cccc(Cl)c2Cl)C(=O)N1 6276460 JOXKNJKGPKJTJC-UHFFFAOYSA-N 392.242 2.916 0 50 GFAA O=C(CCCn1ccnc1)Nc1ccc(N2CCN(CC(F)(F)F)CC2)cc1 2325786595 FGPVTEHTHPRPPI-UHFFFAOYSA-N 395.429 2.986 0 50 GFAA C[C@]1(CO)COCCN(C(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)C1 2325801059 UAVKMJMGOGHUQR-NRFANRHFSA-N 389.398 2.667 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2ccc(Br)cc2)NC(=O)N1 706380 QKMKMANBZFNUGU-UKRRQHHQSA-N 395.253 2.799 0 50 GFAA biogenic COC(=O)CN1C(=S)N(C)C(=O)/C1=C/c1cc(Cl)cc(Cl)c1OC 1132817 SDOICORQYRFKDI-WZUFQYTHSA-N 389.260 2.575 0 50 GFAA O=C(CSc1nnnn1-c1ccccc1)Nc1cc(Cl)ccc1C(=O)O 5078026 BAQPJVVGISXFEK-UHFFFAOYSA-N 389.824 2.745 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)C4(C)CC4)C3)C2=O)c1OC 12197540 QCJOJUBGOBQLPA-QFIPXVFZSA-N 386.492 2.845 0 50 GFAA COCC(=O)Nc1cnn(-c2ccc(C(=O)NCc3cccc(F)c3)cc2)c1 12209704 ZQCHGGBIXDZXQK-UHFFFAOYSA-N 382.395 2.526 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(N(CC)Cc3nccn3C)nc2)CCN1C(C)C 12313727 QWSXOVXOBYJCOX-LJQANCHMSA-N 398.555 2.786 0 50 GFAA CC(C)OC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC(C)C)[C@@H]1c1cccc(F)c1 12382691 BUIRXUKDPLWXQU-WIRSXHRWSA-N 394.439 2.769 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(C3Cc4ccccc4C3)CC2)C1)N1CCCC1 12577280 SLIWDDHRLAWZQG-OAQYLSRUSA-N 381.564 2.953 0 50 GFAA COC(=O)[C@@H](NC(=O)c1cn(C(c2ccccc2)c2ccccc2)nn1)C(C)C 12591614 WGRTZDIBQNIVFS-IBGZPJMESA-N 392.459 2.843 0 50 GFAA CC(C)CN1C[C@@H](OCc2cccc(F)c2)CN(C(=O)c2ccoc2)CC1=O 14533140 WWABTXLVRAHIEU-LJQANCHMSA-N 388.439 2.945 0 50 GFAA CCOC(=O)c1nn(CCC(F)(F)F)c2c1CN(C(=O)CCSC)CC2 14732584 KUMBARDWHHPKDY-UHFFFAOYSA-N 393.431 2.650 0 50 GFAA COC(=O)CN1C(=S)N(c2ccc(OC)cc2)C(=O)/C1=C/c1ccc(C)o1 15011277 WTOIGVCPDITTCO-YBEGLDIGSA-N 386.429 2.744 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N[C@@H]1CCCN(C2CCCCCC2)C1 15061964 RSRUNYLURWKAPH-GOSISDBHSA-N 398.555 2.977 0 50 GFAA Cc1cccc(N2C(=O)C[C@H](N3CCN(C/C=C/c4ccccc4)CC3)C2=O)c1 19720506 ZQFYUJJDAANAKW-FLVSMNSFSA-N 389.499 2.958 0 50 GFAA Cc1c[nH]c(C(=O)N2CCC[C@@H]2c2ccc(C(=O)N3CCSCC3)s2)n1 19794505 CNEJFTPSVQYGMZ-CYBMUJFWSA-N 390.534 2.946 0 50 GFAA COc1cccc(C2=NO[C@H](C(=O)N3CCN(Cc4ccccc4)CC3)C2)c1 19894438 WQVKGPVLSOMPIP-NRFANRHFSA-N 379.460 2.533 0 50 GFAA Nc1nc(CN2CCN(Cc3ccccc3)CC2)nc(Nc2ccccc2)n1 23093039 BEGXMRKCXODKKY-UHFFFAOYSA-N 375.480 2.515 0 50 GFAA Cc1cccc(C(=O)N2CCC[C@H](N3CCN(c4ccc(F)cc4)CC3)C2)n1 55090651 HRRREPWKNZKEER-FQEVSTJZSA-N 382.483 2.956 0 50 GFAA Cc1cccc(C2=NC(=O)C3(CCN(C(=O)Cc4nc(C)sc4C)CC3)N2)c1 55154212 IISDPEKVSQXTGD-UHFFFAOYSA-N 396.516 2.549 0 50 GFAA CN(C)c1ncc(CN[C@@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)s1 55199070 BBCNFJABOYCINO-OAHLLOKOSA-N 378.929 2.796 0 50 GFAA CCS(=O)(=O)c1ncc(CN(C)C[C@H]2CCCCO2)n1Cc1ccccc1 55226811 TUACVRZOGDRKKM-LJQANCHMSA-N 391.537 2.726 0 50 GFAA O=S(=O)(c1ccccc1)n1cccc1CN1CCC[C@@H](Cn2ccnc2)C1 67649945 WZBJQGDDRRGNMT-GOSISDBHSA-N 384.505 2.834 0 50 GFAA CN1CCc2n[nH]c(C(=O)NCc3cccnc3Oc3ccccc3F)c2C1 67714443 OBNDTKJNOWSVIY-UHFFFAOYSA-N 381.411 2.654 0 50 GFAA Cc1ncc(CC(=O)NCc2cccnc2Oc2c(C)cccc2C)c(=O)[nH]1 67867351 QETQICWZSYZJJS-UHFFFAOYSA-N 378.432 2.741 0 50 GFAA COc1ccccc1N1C[C@H](C(=O)Nc2cc(C)ccc2NC(C)=O)CC1=O 68026787 ILWKBNJPQFTMIA-OAHLLOKOSA-N 381.432 2.954 0 50 GFAA CCN(CC)CC(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71419086 UJYYNXAVHSAGFT-IBGZPJMESA-N 377.504 2.753 0 50 GFAA CC(C)[C@H]1CN(CCC(=O)N2CCCC2)CCC(=O)N1Cc1ccc(F)cc1 71551909 LILJLPLNEICGEF-HXUWFJFHSA-N 389.515 2.897 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)N2CC[C@@H](CN)C2)Cc2ccccc2C1 72157754 CVHZUEXHTLAIEF-FQEVSTJZSA-N 377.532 2.506 0 50 GFAA Cc1ccc2nc(N3CCC[C@@H](O)C3)c(CN3CCc4[nH]ncc4C3)cc2c1 72456722 SWKUASRMEXLMJT-LJQANCHMSA-N 377.492 2.786 0 50 GFAA CCOC(=O)C1(CCOc2ccccc2)CCN(Cc2cnc(N)nc2)CC1 77566299 WEEQLGHBSJNQHU-UHFFFAOYSA-N 384.480 2.673 0 50 GFAA O=C(c1cccc2nccnc12)N1CCC(c2nnc3n2CCCCC3)CC1 82126733 PIOIUOOUYONRMV-UHFFFAOYSA-N 376.464 2.968 0 50 GFAA COc1cccc(N2C[C@H](Cc3ccccc3)N(C(=O)CCC(C)=O)CC2=O)c1 82133565 OQTAHDBGTROHBS-FQEVSTJZSA-N 394.471 2.851 0 50 GFAA CCN(CC)CC(=O)N1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95371655 DMVOWQCVNSKGAB-ZLGUVYLKSA-N 377.479 2.695 0 50 GFAA CCc1nn(C)c(NC(=O)NCCc2csc(-c3ncccn3)n2)c1CC 95505816 ZFHILKVYPGRUER-UHFFFAOYSA-N 385.497 2.823 0 50 GFAA Cc1cc(C)n(Cc2ccc(NC(=O)N[C@@H](c3ncnn3C)C3CC3)cc2)n1 96165807 SJDFSCQESLGKRQ-GOSISDBHSA-N 379.468 2.950 0 50 GFAA COc1ccc([C@H](O)CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1 134125411 WXAKFKOVVWPKJM-WOJBJXKFSA-N 382.460 2.540 0 50 GFAA COCc1nc2n(n1)C[C@H](NC(=O)Cc1csc(-c3cccc(C)c3)n1)CC2 135148617 AXYAOTIUPUXSHN-OAHLLOKOSA-N 397.504 2.530 0 50 GFAA C[C@@H](NC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)c1nc2ccccc2n1C 136507946 DQRKLJLCGIJAQU-OXQOHEQNSA-N 390.487 2.984 0 50 GFAA Cc1nnc(-c2ccc(NC(=O)CCNC(=O)c3[nH]nc4ccccc34)cc2)o1 152966342 PADJFQVTMYLNAQ-UHFFFAOYSA-N 390.403 2.680 0 50 GFAA O=S(=O)(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1c(F)cc(F)cc1F 160887337 UYNDZPCRTJEGRS-CQSZACIVSA-N 399.312 2.832 0 50 GFAA CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NCC[S@@](=O)c1ccccc1 170623602 WJBVRLURHFINMN-JHPRIADQSA-N 386.517 2.755 0 50 GFAA CSc1ccc2c(c1)CCN(C(=O)CC[C@@]1(CCC(=O)O)CCC(=O)N1)C2 219423851 HYHNIWIVKPBCGZ-HXUWFJFHSA-N 390.505 2.587 0 50 GFAA CC(=O)c1ccccc1C(=O)N1CCc2[nH]c(-c3cccc(CO)c3)nc2C1 223622955 SGNPKGHOYKYUMP-UHFFFAOYSA-N 375.428 2.970 0 50 GFAA C[C@H](Sc1ccc(N)cc1)C(=O)OCCCN1C(=O)c2ccccc2C1=O 253428091 IDTPOZRLXPWPAK-ZDUSSCGKSA-N 384.457 2.979 0 50 GFAA NC(=O)N[C@@H](CC(=O)N1CCC[C@H]1C(=O)O)c1cccc(Oc2ccccc2)c1 262718148 TVPOQCDASVAQIS-ROUUACIJSA-N 397.431 2.654 0 50 GFAA O=C(CN1C(=O)N[C@@H](c2ccccc2)C2=C1COC2=O)NCCC1=CCCCC1 263618630 URPKOQGFFFLZLD-FQEVSTJZSA-N 395.459 2.571 0 50 GFAA CC(=O)NC[C@@H]1CCC2(CCN(Cc3cc(CN4CCCC4)cs3)CC2)O1 299767579 LWYYIHGCWHZJDZ-IBGZPJMESA-N 391.581 2.994 0 50 GFAA COc1ccc2c(c1)O[C@@H](C)CN(CCC(=O)NCc1ccc3c(c1)OCO3)C2 299770776 RCXRBYYQNKLHKZ-HNNXBMFYSA-N 398.459 2.713 0 50 GFAA Cc1ncccc1O[C@@H]1CCN(S(=O)(=O)c2c(Cl)nc3ccccn23)C1 328614558 AIZDBCVYZOKFLO-CYBMUJFWSA-N 392.868 2.533 0 50 GFAA O=S(=O)([C@H]1CCCN(c2ccnc3c(Cl)cccc23)C1)N1CCOCC1 329218339 RPGHOGRXTGUYQA-AWEZNQCLSA-N 395.912 2.519 0 50 GFAA Cc1cnc(C2CCN(C(=O)N[C@@H]3CCCN(c4cnn(C)c4)C3)CC2)s1 373032741 CUJZUHSMLVIKHB-MRXNPFEDSA-N 388.541 2.743 0 50 GFAA O=C(NC1CCN(c2cnccn2)CC1)c1cc(-n2cccn2)ccc1Cl 426360074 PWRWICISDXHERS-UHFFFAOYSA-N 382.855 2.715 0 50 GFAA COc1ccccc1CCCNC(=O)N1CCN(C(=O)c2ccccc2)CC1 426647923 MYIMEGJDPGQCNR-UHFFFAOYSA-N 381.476 2.795 0 50 GFAA O=C(NC[C@@H]1CCCN(C2CCCC2)C1)N(CCO)Cc1ccc(F)cc1 584897337 XBVKRAXVPOQZKF-SFHVURJKSA-N 377.504 2.984 0 50 GFAA CC(C)n1ncnc1-c1cccc(C(=O)N[C@H]2CCCN(C(=O)C3CC3)C2)c1 584900564 PSPGLWYZFIATMM-SFHVURJKSA-N 381.480 2.657 0 50 GFAA Cc1ccc(NC(=O)CCNC(=O)c2csc(-c3ncccn3)n2)c(C)c1 670450517 IRLKNSKGNRCGCW-UHFFFAOYSA-N 381.461 2.976 0 50 GFAA O=C(Cn1ccnc1-c1ccccc1)N[C@H]1CCCN(C(=O)c2ccco2)C1 827861435 IWXZPCOJGYYVKN-KRWDZBQOSA-N 378.432 2.564 0 50 GFAA Cn1ccnc1[C@H](NC1CCN(C(=O)c2ccncc2)CC1)c1ccccc1 1506412768 OLNYPZURDHSSIN-HXUWFJFHSA-N 375.476 2.799 0 50 GFAA Cc1ccc(F)c(C(=O)NCC2CCN(C[C@H]3COCCO3)CC2)c1Cl 1506421460 JUZRYRCORUCWHG-HNNXBMFYSA-N 384.879 2.645 0 50 GFAA CCc1ccc(CCC(=O)N2CCCN(C(=O)c3ccc(O)cn3)CC2)cc1 1529168126 VYBNGXSIKTWPEZ-UHFFFAOYSA-N 381.476 2.657 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCc3sc(N4CCOCC4)nc3C2)s1 1772807886 VEOUJIYAFLQPFL-ZDUSSCGKSA-N 377.535 2.771 0 50 GFAA Cc1noc(C)c1CCc1nc(COc2ccccc2)nn1-c1cnn(C)c1 1772814741 QTBWASCRNFQZAU-UHFFFAOYSA-N 378.436 2.970 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@@H](C(=O)O)C4(CCOCC4)C3)cc2c1 1857694452 OTBQVFAGQIEQNX-KRWDZBQOSA-N 386.448 2.652 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)N[C@H]4CC[C@H](O)CC4)C3)nc2c1 1857714006 HKCBXMNZYBFTFI-JYJNAYRXSA-N 387.480 2.863 0 50 GFAA CS(=O)(=O)Cc1ccc(-c2cc3c(s2)C2(CCNCC2)OCC3)nc1 1857718738 QSYWUVBSKBFULE-UHFFFAOYSA-N 378.519 2.506 0 50 GFAA COc1cccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1F 1857726784 CFUZHUHBWKNETE-HMFYCAOWSA-N 396.418 2.749 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1ccccc1-n1cncn1)CC2 1857727566 UPRMZNIXFJTISP-UHFFFAOYSA-N 398.470 2.909 0 50 GFAA Cc1ccc([C@@H](C)C(=O)NC2(CNC(=O)Cn3cc(C)cn3)CCCC2)cc1 1875307095 KBBQMRKEFGWLIB-GOSISDBHSA-N 382.508 2.849 0 50 GFAA Cc1nc(C2CCN(C(=O)c3cc(CC(C)C)[nH]n3)CC2)c2n1CCN(C)C2 1875394632 PVHTYSCZJREKSJ-UHFFFAOYSA-N 384.528 2.578 0 50 GFAA COc1ccc(CN2CCC3(CCc4c(O)nc(C)nc43)CC2)c(OC)c1OC 2100542659 CRNJCMMNZUHSHN-UHFFFAOYSA-N 399.491 2.996 0 50 GFAA CC[C@H]1CC[C@H](C(=O)N2C[C@H]3C[C@H]2CCN3C(=O)[C@H]2C[C@@H](n3cnnc3)C2)CC1 2325872871 QAIPKKIPEUBZLR-UXXOSCIKSA-N 399.539 2.647 0 50 GFAA Cc1nonc1[C@H]1CCCN1C(=O)c1c(OCc2ccccc2)c(=O)ccn1C 2356152001 LNRGEGMLWAKUMW-MRXNPFEDSA-N 394.431 2.633 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1CCc2nc(C3CCOCC3)nn2CC1 2356170882 RMILZDHSAGAXJD-UHFFFAOYSA-N 390.871 2.533 0 50 GFAA O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(OC(=O)c2ccco2)cc1 787339 FPKULVXYAVFRPV-UHFFFAOYSA-N 389.367 2.847 0 50 GFAA O=C(c1cc2c(s1)CCCCCC2)N1CCN(C(=O)[C@H]2CCCO2)CC1 1055708 BROLUEXOYHNVIU-MRXNPFEDSA-N 376.522 2.871 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 2827698 HOBNGDSFJAEAPA-UHFFFAOYSA-N 376.434 2.746 0 50 GFAA CC(C)N1CCC[C@]2(CCCN2C(=O)c2csc(-c3ncccn3)n2)C1=O 2356167933 JKDJRVHISWLYNT-IBGZPJMESA-N 385.493 2.606 0 50 GFAA Cc1nc(O)cc(CN2CCC[C@]23CCCN(CCc2ccccc2)C3=O)n1 2356169629 FLOUUJIWVZRDPL-QFIPXVFZSA-N 380.492 2.690 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)COc1ccc2ccc(=O)oc2c1 248704402 AOWYMTBFBZWPOG-OXQOHEQNSA-N 392.455 2.809 0 50 GFAA Cc1ccc2c(CC(=O)NC3CCN(C(=O)c4cnccn4)CC3)coc2c1C 135570780 XIXAPKKPQSQLMB-UHFFFAOYSA-N 392.459 2.803 0 50 GFAA CCCN1CC[C@H](CNC(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1 252458484 KXLGBVOKFDRBQU-HZPDHXFCSA-N 380.483 2.822 0 50 GFAA Cc1ccsc1C(=O)N1CCc2c(c(C(=O)O)nn2Cc2ccncc2)C1 67650546 VJVAORVPJCMYRV-UHFFFAOYSA-N 382.445 2.593 0 50 GFAA Cc1noc([C@@H]2CCCN(c3nccc(N[C@H]4CCCO[C@@H]4C(C)C)n3)C2)n1 328635080 NDIOLGRBYICMAC-SOLBZPMBSA-N 386.500 3.168 0 50 GFAA CS(=O)(=O)N(CCOc1ccccc1Cl)Cc1cn2c(n1)CCCC2 328643831 YZFXRDFTAHUTAB-UHFFFAOYSA-N 383.901 2.713 0 50 GFAA CCOc1ccccc1NS(=O)(=O)c1ccc(Cc2cc(C)n[nH]c2=O)cc1 33026755 ZPGJVXUUWYNFPV-UHFFFAOYSA-N 399.472 2.869 0 50 GFAA Cc1ccn(Cc2nnc(SCC(=O)Nc3ccc(OC(F)F)cc3)o2)n1 2806613 JALOXZZCPZCDEH-UHFFFAOYSA-N 395.391 2.955 0 50 GFAA C[C@H]1CN(C2CCN(C(=O)Nc3nc(-c4cccnc4)cs3)CC2)CCO1 124363007 NZHMTEYKEAFGPU-AWEZNQCLSA-N 387.509 2.922 0 50 GFAA O=C1CN(C(=O)c2ccc(-c3cc[nH]n3)cc2)CCN1Cc1cccc(F)c1 72476235 FVTOANGNQYPZEQ-UHFFFAOYSA-N 378.407 2.700 0 50 GFAA CC(C)c1cnc(NC(=O)N2CCC[C@@H]2c2nc(C(=O)NC3CC3)no2)s1 365191255 KHLRHLUDARTXIK-LLVKDONJSA-N 390.469 2.911 0 50 GFAA CNC(=O)c1cccnc1N[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1 72439498 GQVPJCWRBKGRNR-ZDUSSCGKSA-N 379.386 2.936 0 50 GFAA Cc1nc(CCC(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)O)C2)n[nH]1 426683730 DSATUIOGBFCMOT-FIKGOQFSSA-N 382.464 2.543 0 50 GFAA CCN(C[C@H](O)COc1ccccc1)C(=O)c1cccc(-c2cnn(C)c2)c1 426526552 YMOJJLYGAVPJDQ-FQEVSTJZSA-N 379.460 2.989 0 50 GFAA CCOC(=O)c1cccnc1-c1ccc(C(=O)N(C)Cc2noc(C)n2)cc1 426412160 FTALSFDSDDDBJM-UHFFFAOYSA-N 380.404 2.889 0 50 GFAA C[C@@H](c1cccnc1)N(C)C(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C 95362133 FEHSIKUTJTXCHQ-HNNXBMFYSA-N 379.464 2.638 0 50 GFAA CCc1nn(-c2ccccc2)c(NC(=O)N2C[C@@H]3CCC[C@H](C2)C(=O)N3)c1C 96180034 UTXMFKUCRUCVNO-CVEARBPZSA-N 381.480 2.876 0 50 GFAA O=C(Nc1ccc2cn[nH]c2c1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 95500956 AGGQRAXLJNPPRU-UHFFFAOYSA-N 379.420 2.641 0 50 GFAA O=C(CSc1ccccc1)N1C[C@@H]2CC[C@H](C1)N(Cc1ccccn1)C2=O 95524268 OAVRYMHGQUYMOG-FUHWJXTLSA-N 381.501 2.823 0 50 GFAA CC(C)Cc1ccc(C(=O)N2C[C@H](CO)[C@H](CN3C[C@H](C)O[C@H](C)C3)C2)cc1 91907185 QVOJDGGWZABLDK-GMQQQROESA-N 388.552 2.675 0 50 GFAA COc1cc(NC(=O)CC[C@@H]2CCCN(C(=O)c3ncc[nH]3)C2)cc(OC)c1 95519187 IEDPBDQOVAIRJU-AWEZNQCLSA-N 386.452 2.698 0 50 GFAA Cc1ccc2cccc(OCCNC(=O)c3ccc4[nH]c(CO)nc4c3)c2n1 97492443 MXYBQRQELBJVTD-UHFFFAOYSA-N 376.416 2.721 0 50 GFAA CCCCn1ccnc1[C@H]1CCCN(C(=O)c2ccc(-n3cnnn3)cc2)C1 95522077 HWDQSIPGRRSKNT-KRWDZBQOSA-N 379.468 2.679 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)C2(S(=O)(=O)c3ccc(Cl)cc3)CCCC2)C1 268957912 ZGRIUKUQQXXNQF-CYBMUJFWSA-N 399.896 2.750 0 50 GFAA O=C(C[C@H]1N=C(O)N(CCc2c[nH]c3ccccc23)C1=O)Nc1ccccc1 252548561 QCTLGECNXOINQV-GOSISDBHSA-N 376.416 2.864 0 50 GFAA O=C(NCCN1CCOCC1)c1cccc(-c2cc3ccccc3nc2O)c1 534659633 IMSUZBDCOSGSTI-UHFFFAOYSA-N 377.444 2.669 0 50 GFAA CC(C)[C@H](NC(=O)N(C)Cc1cnn(-c2ccc(F)cc2)c1)c1ncnn1C 534657524 UVVQLOJBBXEEFX-KRWDZBQOSA-N 385.447 2.679 0 50 GFAA Cn1ccc2c(C(=O)N3CC[C@](Cc4ccccc4)(C(=O)O)[C@H](O)C3)cccc21 1940196150 NVQKSHZRTQVRHN-NFBKMPQASA-N 392.455 2.699 0 50 GFAA CN(C)C(=O)[C@@H]1C[C@@H](Sc2nccn2C)CN1Cc1cc(F)ccc1F 64084021 SHFRQUNZGYGRAN-ZBFHGGJFSA-N 380.464 2.522 0 50 GFAA Cc1cc2cccc(C(=O)NCc3cc4n(n3)CCN(C(=O)C(C)C)C4)c2o1 299784612 OKEJQTBTNWBCNQ-UHFFFAOYSA-N 380.448 2.866 0 50 GFAA COc1ccccc1-n1cc(CNC2CCN(C(=O)c3ccncc3)CC2)cn1 824835057 CIANUYNGJZCHIC-UHFFFAOYSA-N 391.475 2.670 0 50 GFAA O=C(CCCn1cncn1)NC[C@H]1CCCN(Cc2cc3ccccc3o2)C1 828022175 FKCHUGJYNQBGQK-QGZVFWFLSA-N 381.480 2.833 0 50 GFAA Cc1cc(C)n([C@H](C)CNC(=O)N2CCN(c3nc4ccccc4o3)CC2)n1 584891485 ASZPBYSVRDZOIX-MRXNPFEDSA-N 382.468 2.734 0 50 GFAA Cc1cc(C)n(-c2ccccc2CN2CCC(CNC(=O)[C@@H]3CCOC3)CC2)n1 952986828 BEUAKXZHNQJQBZ-OAQYLSRUSA-N 396.535 2.854 0 50 GFAA O=C([C@H]1CCCC[C@H]1C(=O)N1CCCC1)N(CCO)Cc1ccc(F)cc1 952962670 FIJKXAFKLDORCI-MOPGFXCFSA-N 376.472 2.575 0 50 GFAA CCC(CC)(CNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1)C(=O)O 170066861 FJVIJUGSNNCVNH-ZBFHGGJFSA-N 380.872 2.867 0 50 GFAA CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)N(CC)CCCN2CCCC2)cc1 170607650 IXJCPTNWUZTBPS-KRWDZBQOSA-N 395.569 2.711 0 50 GFAA COC(=O)N1CCC[C@@H](C(=O)Nc2cccc(-c3ccc4c(c3)OCCO4)n2)C1 170623163 NMKGFIHJNYLYMW-OAHLLOKOSA-N 397.431 2.937 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N(C)Cc2ncon2)cc1 1704329493 VOAQWWZQGXHBJK-UHFFFAOYSA-N 383.408 2.606 0 50 GFAA COc1cc(C)c(S(=O)(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)c(C)c1C 1704298371 IRUAOOQLELZMTQ-QZTJIDSGSA-N 390.505 2.551 0 50 GFAA O=C(NCC1(O)CCCCC1)c1c(N2CCOCC2)noc1-c1ccccc1 1704312001 WXSYEWYZQAHLJG-UHFFFAOYSA-N 385.464 2.603 0 50 GFAA O=C(CN1Cc2ccccc2C1)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1616071924 PVQBLMBJWZYGTK-REWPJTCUSA-N 387.483 2.924 0 50 GFAA CC(=O)Nc1ccc(OC[C@H](O)Cn2nc(C)c(Br)c2C)cc1 816538 GILZWWFRXVLQSL-CQSZACIVSA-N 382.258 2.661 0 50 GFAA Cc1cc(C)n(CCNC(=O)[C@@H]2CCc3sc(-c4ccncc4)nc3C2)n1 1772808170 HPRLOZFSARZBMW-MRXNPFEDSA-N 381.505 2.940 0 50 GFAA CCCC[C@@H]1CN(CCNC(=O)c2cnn3cccnc23)Cc2ccccc2O1 11783646 GRYSOFUAWHVXFQ-GOSISDBHSA-N 393.491 2.913 0 50 GFAA O=C1CC2(CCN(c3nc(-c4ccccc4)nc4c3CCC4)CC2)OCCN1 1857684650 WPQZMIBRDXFTSF-UHFFFAOYSA-N 378.476 2.508 0 50 GFAA Cc1c(F)cccc1C(=O)NC[C@H]1[C@H]2CN(c3ccccn3)C[C@]23CC[C@H]1O3 1875245353 WENKOHROEOHKNF-ODULNIPZSA-N 381.451 2.943 0 50 GFAA O=S(=O)(Cc1cccc(Cl)c1)NC[C@H](c1ccccc1)N1CCOCC1 225833710 ACNJGLFLJIHVHS-LJQANCHMSA-N 394.924 2.833 0 50 GFAA O=C(N[C@H]1CCCc2occc21)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 229731169 RYOKLFKTRVFXOL-QAPCUYQASA-N 388.489 2.874 0 50 GFAA O=C(C1CCCC1)N1CC[C@@]2(O)CCN(CCn3cnc4ccccc43)C[C@H]2C1 247712541 KVJBIKYZEKVYEI-CVDCTZTESA-N 396.535 2.512 0 50 GFAA O=c1c(=Cc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)sc2ncnn12 252476961 FRZBNSATMZZQEU-UHFFFAOYSA-N 389.415 2.691 0 50 GFAA Cc1nnc([C@@H]2CN(CC(=O)N(C)Cc3cc(Cl)cc(Cl)c3)CCO2)o1 366748248 XGEQJMNKAQSCRT-HNNXBMFYSA-N 399.278 2.717 0 50 GFAA Cc1oc(CN(C)C(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1C(=O)O 372021374 IWBTVTILVRRKAN-HNNXBMFYSA-N 390.823 2.951 0 50 GFAA CCN(CCc1cccs1)C(=O)c1nc(N2CCOCC2)ncc1Cl 2325704570 HMBMLQMXABOVOI-UHFFFAOYSA-N 380.901 2.733 0 50 GFAA CC(C)(C)c1ccc([C@@H]2CNCCN2C(=O)c2cncc(-n3ccnc3)n2)cc1 2325780347 ZSYRAPSIKOFYBM-IBGZPJMESA-N 390.491 2.747 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cncnc1-c1ccccc1 2325786017 YFVLPFLUSJYIES-FSPWUOQZSA-N 397.866 2.563 0 50 GFAA Cc1cc(C(=O)N[C@H](CNC(=O)c2cc3ncccn3n2)C2CCCC2)oc1C 2325787033 XNOVDZBBPCGSNB-QGZVFWFLSA-N 395.463 2.658 0 50 GFAA COC(=O)[C@H]1CN(C2=Nc3ccccc3Oc3ccccc32)CCN1C(C)=O 2325798758 YBDRRNITYNJPCJ-QGZVFWFLSA-N 379.416 2.576 0 50 GFAA COC(=O)c1c(NC(=O)c2ccccc2OC)sc2c1[C@H](C(=O)OC)CC2 622573 ZWFPAOMWXMMADE-LLVKDONJSA-N 389.429 2.998 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NCc3ccco3)CC2)c(C)c1 1109053 LVBZCPFXGXBFLX-UHFFFAOYSA-N 390.505 2.922 0 50 GFAA CC(C)CNC(=O)c1cccc(NC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c1 1110335 FGRDRJSFYCNPAT-UHFFFAOYSA-N 379.416 2.551 0 50 GFAA COC(=O)C1=C(c2ccccc2)NC(=S)N[C@H]1c1ccc(OC)c(OC)c1 2871233 CCCPYSSGHMGNFF-SFHVURJKSA-N 384.457 2.807 0 50 GFAA CCCn1c(C)cn2c3c(=O)n(C/C=C/c4ccccc4)c(=O)n(C)c3nc12 4250958 OFUNXJMOQXUSAI-DHZHZOJOSA-N 377.448 2.581 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(C(=O)c3ccc(Cl)s3)CC2)C1 11753765 UXHPIRULTVQQDA-CYBMUJFWSA-N 395.956 2.997 0 50 GFAA COCCNC(=O)CCC1CCN(Cc2sc(N(C)C)nc2Cl)CC1 12301411 NEPKBGDDVCCAKE-UHFFFAOYSA-N 388.965 2.617 0 50 GFAA O=C(CC[C@@H]1CCCN(Cc2c[nH]cn2)C1)N1CCN(Cc2ccccc2)CC1 12438589 KCCVBEGBDCNBSR-NRFANRHFSA-N 395.551 2.746 0 50 GFAA O=C(CC[C@@]1(Cc2ccco2)CCC(=O)N1)NC[C@H]1CCc2ccccc2O1 14967247 RLQCPMHBQSPBIY-GCJKJVERSA-N 382.460 2.761 0 50 GFAA O=C(NC1CCCC1)C1CCN(S(=O)(=O)Cc2ccc(Cl)cc2)CC1 24608281 DKEAPNDCMMQHLM-UHFFFAOYSA-N 384.929 2.941 0 50 GFAA Cc1cc(C(=O)NC2CCN(C)CC2)ccc1NS(=O)(=O)c1ccccc1 65363002 SDWCTBPGCGNPDS-UHFFFAOYSA-N 387.505 2.620 0 50 GFAA COc1cccc(-c2cn[nH]c2C2CCN(C(=O)CNC(=O)C(C)C)CC2)c1 67673904 UQWDSUPJCGRTLU-UHFFFAOYSA-N 384.480 2.564 0 50 GFAA O=C(O)c1cc(-c2ccccc2C(=O)O)cc(S(=O)(=O)N2CCCC2)c1 71751324 IXMXLJJJTGUZPL-UHFFFAOYSA-N 375.402 2.535 0 50 GFAA Cc1cccnc1CN1CCC(c2nnc(Cn3cccn3)n2C2CC2)CC1 91964875 AKDJCOAWRPYTDM-UHFFFAOYSA-N 377.496 2.941 0 50 GFAA O=C1CCC2(CCN(C(=O)NCc3ccccc3)CC2)CN1C[C@H]1CCCO1 92080360 ACSDOOHNVQRQFD-LJQANCHMSA-N 385.508 2.780 0 50 GFAA CCN(C)CC(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2 95372752 SMWXKZRQODWBOO-FQEVSTJZSA-N 383.536 2.725 0 50 GFAA CC(=O)c1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccn2)C3)s1 95376187 SHWIILJPHMWZIR-LSDHHAIUSA-N 383.473 2.723 0 50 GFAA O=C(c1nc(N2CCCC2)nc2c1CCCC2)N1CCC[C@H](c2ncc[nH]2)C1 95498478 JNRNOVPPKGIBMX-HNNXBMFYSA-N 380.496 2.699 0 50 GFAA CCc1ccc(C(=O)N2CCC[C@@H](CCC(=O)N(C)C3CCN(C)CC3)C2)[nH]1 95526591 NGPGXGGZYPUZDS-KRWDZBQOSA-N 388.556 2.762 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(Cc3coc(C(C)C)n3)CC2)n1C 96141728 ZULXSYJQGDLLJR-UHFFFAOYSA-N 383.500 2.859 0 50 GFAA O=C(c1ccccc1F)N1CCCN(c2cc(N3CCCCC3)ncn2)CC1 110128099 KJUCMQALNCDCTP-UHFFFAOYSA-N 383.471 2.959 0 50 GFAA CCOc1cccc(N2CCN(C(=O)C[C@@H]3OCCc4ccccc43)CC2)n1 115066808 VXCDJEDPMHUINH-IBGZPJMESA-N 381.476 2.833 0 50 GFAA CCc1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(Cl)s4)C3)nn2)n1 169780390 GWVXGOAMPMJIQH-VIFPVBQESA-N 378.845 2.693 0 50 GFAA COC(=O)c1cccc(NC2CCN(C(=O)Cc3ccc4cn[nH]c4c3)CC2)c1 170610354 DCTKRTQRJKZYIH-UHFFFAOYSA-N 392.459 2.995 0 50 GFAA O=C(Nc1ccc(N2CCCC2)nc1)[C@@H](c1ccccc1)N1CCC(O)CC1 170900665 PQLKHMFKJALMBK-OAQYLSRUSA-N 380.492 2.818 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCCN(Cc2ccncc2Cl)CC1 173180815 JIFMDDCOAALQAJ-UHFFFAOYSA-N 383.876 2.771 0 50 GFAA O=C(c1ccc2nccnc2c1)N1C[C@@H]2CC[C@H]1CN(Cc1cscn1)C2 216935144 VCNXMCXCKQCZBF-PBHICJAKSA-N 379.489 2.823 0 50 GFAA CC(=O)c1ccc(C(=O)N[C@@H]2CCOC[C@H]2OCc2c(C)noc2C)s1 219656958 PSJJUCSHLWJOQP-HUUCEWRRSA-N 378.450 2.660 0 50 GFAA O=C(N[C@@H]1CCCc2c1[nH]c1ccccc21)C1CCN(c2ccc(=O)[nH]n2)CC1 253413532 VAKWSYBHVDKZFX-GOSISDBHSA-N 391.475 2.661 0 50 GFAA C=CC(=O)Nc1cc(NC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)ccc1F 268858730 HKRXCUZDJJEGQW-OAHLLOKOSA-N 393.415 2.525 0 50 GFAA FC(F)Cn1cc(CN2CCOC[C@@H]2c2nc(-c3ccccc3)no2)cn1 294808096 WKZVJNBXSAVJIV-OAHLLOKOSA-N 375.379 2.772 0 50 GFAA O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NCCSc1ccccc1 299302098 QXUTWLSSPKFZED-YQQAZPJKSA-N 379.551 2.621 0 50 GFAA Cc1oc(CNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1C(=O)O 299750890 OQHBMPZHQUWRRZ-RDJZCZTQSA-N 390.823 2.775 0 50 GFAA CCC1(CNC(=O)Nc2nccn(C)c2=O)CCN(Cc2ccccc2)CC1 363883224 CQRFHYGTQAHIGA-UHFFFAOYSA-N 383.496 2.594 0 50 GFAA Cc1c(Cl)cc(S(=O)(=O)N2CCC[C@H](c3nc(O)n[nH]3)C2)cc1Cl 407988393 CLXWRNXHVJUTRR-VIFPVBQESA-N 391.280 2.694 0 50 GFAA CCc1ccc(-c2cc(C(=O)N3CCC[C@H](CS(C)(=O)=O)C3)n[nH]2)cc1 426412662 DSVJNRPNCSPXMZ-HNNXBMFYSA-N 375.494 2.536 0 50 GFAA O=C1NCCN(C(=O)NCc2nc3c(s2)CCCC3)[C@@H]1c1ccc(F)cc1 426693711 JXZWBXMZIJICEQ-QGZVFWFLSA-N 388.468 2.544 0 50 GFAA Cc1ccncc1CN(C)C(=O)c1cc2c(cc1Br)NC(=O)CO2 477918853 PZXFWBYBZPPVIA-UHFFFAOYSA-N 390.237 2.756 0 50 GFAA COc1ccc(CN(C[C@@H]2CCCO2)C(=O)NCc2nc(C3CC3)no2)cc1 534669374 PGADRFLBICQSHA-KRWDZBQOSA-N 386.452 2.846 0 50 GFAA O=C(N[C@@H]1C[C@@H]2CCCCN2C1=O)c1cc2ccc(C(F)(F)F)cc2nc1O 822302733 RQGHKQKEKKRFKY-SWLSCSKDSA-N 393.365 2.842 0 50 GFAA CC[C@H](NS(=O)(=O)c1ccc(OC)c(Cl)c1)c1cn2cccnc2n1 1506430929 ZMXXMDMCPWWLSF-ZDUSSCGKSA-N 380.857 2.821 0 50 GFAA C[C@@H]1CCCN(CCOc2ccccc2CN2CCc3[nH]nc(C(=O)O)c3C2)C1 1857675469 YZXRAXJMOXZQLF-MRXNPFEDSA-N 398.507 2.777 0 50 GFAA CCn1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cc1=O 1857721793 GLYJAIMUPKYXLD-UNMCSNQZSA-N 395.503 2.546 0 50 GFAA CC(=O)N1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NCCc2nccs2)C1 1857738156 TWUGTDITVBQVKQ-OAQYLSRUSA-N 397.548 2.713 0 50 GFAA COc1ccc(Nc2cc(N3CCC[C@@H](C(=O)N(C)C)C3)ncn2)c(OC)c1 1875258475 MNNOTMYPXYWISE-CQSZACIVSA-N 385.468 2.542 0 50 GFAA C[C@@H](COC(=O)NS(=O)(=O)NCc1ccc(F)cc1F)c1ccccc1 1875322697 BGCQVCDQOOBTGV-LBPRGKRZSA-N 384.404 2.829 0 50 GFAA COc1ccc([C@@H](NC(=O)[C@@H](C)Oc2ccc3c(c2)CCC3)C(=O)O)cc1O 1875322799 IMFBMTLMOIYNSY-CWTRNNRKSA-N 385.416 2.599 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2cccnc2)cc1 2325785907 TWCQFUYQASQGMX-CWFSZBLJSA-N 378.432 2.640 0 50 GFAA CN1CCN(Cc2ccc(CN(C)C(=O)c3cnc4cc[nH]c4c3)cc2)CC1 2325810779 DLLHGWUVSFMBRJ-UHFFFAOYSA-N 377.492 2.583 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(Cc3nnc(C)s3)CC1)OCC2 2356160420 RAUYIMVWQUSNBH-UHFFFAOYSA-N 375.494 2.928 0 50 GFAA Cc1cc(=O)oc2cc(OC(=O)CCN3C(=O)c4ccccc4C3=O)ccc12 945277 CNXFUCHWWVCFBK-UHFFFAOYSA-N 377.352 2.693 0 50 GFAA biogenic COc1cc([C@H]2C3=C(COC3=O)Oc3cc4c(cc32)OCO4)cc(OC)c1OC 1614054 DWWALFYNQWNXFV-GOSISDBHSA-N 398.367 2.776 0 50 GFAA Cc1ccc(N(CC(=O)NCCc2ccccc2)S(C)(=O)=O)cc1Cl 2072334 KJWPMZLGXGHKSZ-UHFFFAOYSA-N 380.897 2.773 0 50 GFAA CCSc1ccccc1C(=O)Nc1ccc(S(=O)(=O)NC(C)=O)cc1 2858396 SXGPNCHPNUTKSZ-UHFFFAOYSA-N 378.475 2.876 0 50 GFAA Cc1nn(Cc2ccc(C(=O)N3N=CC[C@]3(O)C(F)(F)F)o2)c(C)c1Cl 6526495 VGGRDOAJOHYTEM-AWEZNQCLSA-N 390.749 2.877 0 50 GFAA CC(=O)c1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCC3)cs2)cc1 6680575 SERWUSGQCADOPD-UHFFFAOYSA-N 378.475 2.988 0 50 GFAA CCN1C(=O)C[C@@](CC(=O)N(C)Cc2csc(C)n2)(c2ccccc2C)C1=O 12054716 BGAZZWPYOYLKPF-NRFANRHFSA-N 399.516 2.825 0 50 GFAA O=C1NCCN(Cc2ccc(-c3ccccc3)cc2)[C@@H]1CC(=O)N1CCCCO1 12072749 LSYNWVGBWQEWSD-OAQYLSRUSA-N 393.487 2.598 0 50 GFAA O=C(c1cn(Cc2ccccc2Cl)nn1)N1CCN(c2ccccc2O)CC1 12441937 DOYXJHICCRCZLH-UHFFFAOYSA-N 397.866 2.648 0 50 GFAA COc1ccc2c(c1)C[C@@H](N1CCC(CCC(=O)N3CCOCC3)CC1)CC2 12593861 VCJSVIYLGWCIBO-NRFANRHFSA-N 386.536 2.904 0 50 GFAA Cc1nc2sccn2c1CN1CCC2(CC1)C(=O)N(CC(C)C)C(=O)N2C 14741133 CDJADBLVKMWYLU-UHFFFAOYSA-N 389.525 2.589 0 50 GFAA O=C(CN1CCN(c2ncccn2)CC1)Nc1cc(C(F)(F)F)ccc1Cl 54530868 KTZAKIZIABBBTM-UHFFFAOYSA-N 399.804 2.910 0 50 GFAA COc1cccc([C@@H]2CCN(C(=O)c3cccc(NCC(=O)O)c3)C2)c1OC 55183233 JJZJUVHHVJNVRF-OAHLLOKOSA-N 384.432 2.830 0 50 GFAA COc1ccc(CCCNC(=O)c2ccc(N[C@H]3CCCN(C)C3)nc2)cc1 67727313 XWPBJZZUQLRFOK-IBGZPJMESA-N 382.508 2.959 0 50 GFAA CCN(CC)Cc1cnc2c(C(=O)N3CCC[C@H]3c3ccccn3)cnn2c1 67773217 UVCRQLUNYTWIBX-IBGZPJMESA-N 378.480 2.943 0 50 GFAA O=C(N1CCc2nnc(CCc3ccccc3)n2CC1)C1(C(F)(F)F)CC1 67934590 ZZDLNMBFXDNQAG-UHFFFAOYSA-N 378.398 2.791 0 50 GFAA CCNC(=O)c1ccc(N2CCC(=O)N(Cc3ccccc3)[C@H](CC)C2)nc1 71774410 DSQIDKNFJCVKKA-LJQANCHMSA-N 380.492 2.849 0 50 GFAA C[C@H](CN1CC2(CCN(C(=O)c3cnn(C)c3)CC2)OC1=O)c1ccccc1 77421632 SZDKTWATRCAXOQ-MRXNPFEDSA-N 382.464 2.651 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)CCc1cccc(F)c1)CC2 91746591 OPCWNTNLQBPZPI-UHFFFAOYSA-N 376.472 2.636 0 50 GFAA Cc1nc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cs1 95359083 SULWGIPWLVIIDD-CWFSZBLJSA-N 397.500 2.883 0 50 GFAA COCCCN1CC2(CCN(Cc3noc(C4CCCC4)n3)CC2)CC1=O 95386216 FPUWAUPNMXYEMV-UHFFFAOYSA-N 376.501 2.578 0 50 GFAA COc1ccccc1Cc1nc(-c2cnc(C)cn2)n(C2CCN(C)CC2)n1 95511528 CEGSVNPMXQBKRN-UHFFFAOYSA-N 378.480 2.910 0 50 GFAA O=C(c1cccs1)N1CCN(CCNc2cc(=O)oc3ccccc23)CC1 101660014 WZYBJFBQHMNQHA-UHFFFAOYSA-N 383.473 2.724 0 50 GFAA COc1ccc([C@H](NC(=O)NC2CCC(S(C)(=O)=O)CC2)C2CC2)cc1 174735206 PGHGNMVGEVZNEJ-VMWRSERWSA-N 380.510 2.801 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(N(C)c4ccccc4)cc3)C[C@@H]2O)CC1 208012424 HGQRCIHTMMIJAW-ZEQRLZLVSA-N 394.563 2.637 0 50 GFAA O=C(NCCc1ccccc1)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244741854 NXXQTOOGIHQCRU-IYARVYRRSA-N 379.460 2.778 0 50 GFAA CN(C)Cc1nnc([C@H]2C[C@@H](NC(=O)C3(c4ccccc4)CCCC3)C2)n1C 244787742 QCWKZFZYLWZTAE-MAEOIBBWSA-N 381.524 2.751 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccco2)C1=O)Nc1nc2ccccc2s1 252537975 MMGDQJOPSKCFRS-CYBMUJFWSA-N 384.417 2.933 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@@H](C)[C@@H](C)N)ccc2C)cc1 262549601 XHOCKAHBWNRAMZ-UONOGXRCSA-N 391.493 2.726 0 50 GFAA CC(=O)NCC1CCN(C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1 298664979 PXZDUWGXVUSVDI-UHFFFAOYSA-N 375.366 2.902 0 50 GFAA C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(=O)NCc1ccccc1 299125156 HLUOMMWUMNOPGJ-DOTOQJQBSA-N 399.516 2.564 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@H]2CCC[C@H](C3CC3)C2)[C@@H]1c1cnn(C)c1C 328633698 SUIJNPILKUNEOS-ZVVDCOBXSA-N 388.556 2.823 0 50 GFAA Cc1nnc([C@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc3c(c2)COC3)o1 329184393 OHLUFOJRJWEQDY-LJQANCHMSA-N 397.456 2.897 0 50 GFAA NC(=O)c1cc(OC2CCN(C(=O)Cc3coc4ccccc34)CC2)ccn1 367626562 PCYSLLSAPGVEHF-UHFFFAOYSA-N 379.416 2.539 0 50 GFAA CN1CCC[C@H](CNC(=O)N2CCc3ccnc(O)c3C2)[C@H]1c1cccs1 372813421 FWGMMABANZRRTQ-QAPCUYQASA-N 386.521 3.000 0 50 GFAA COc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2cnc(CC(C)C)nc2)cc1 410013779 WEXGPHFGLMBJBO-SFHVURJKSA-N 382.464 2.927 0 50 GFAA CN1CCC(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)(c2ccccc2)CC1 426599474 CNSDDCFAWUNQPC-HXUWFJFHSA-N 378.472 2.688 0 50 GFAA NS(=O)(=O)c1ccc(CNC(=O)[C@]2(c3ccccc3)CC23CCCC3)cc1 426649826 ZIOGWXZFBGIBQC-OAQYLSRUSA-N 384.501 2.852 0 50 GFAA O=C(NC[C@H](Cc1ccccc1)C(=O)O)c1cccc(Nc2cnccn2)c1 485936749 UQXPGLYONTXURS-KRWDZBQOSA-N 376.416 2.894 0 50 GFAA COCC[C@H]1CCCCN1C(=O)c1cccc(-c2cnn(C)c2C(=O)OC)c1 534585045 XMPVOSVVTBZVRN-QGZVFWFLSA-N 385.464 2.905 0 50 GFAA COc1cc(Cl)ccc1C(=O)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 824557957 DCWBJXYFFPKBKB-NFAYLAGKSA-N 387.871 2.813 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CSCCS1)C2 826753048 KQUYPTCTPUDGOG-YJNKXOJESA-N 386.583 2.987 0 50 GFAA C[C@@H](CC(N)=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1 888928581 WPQLPQHVXBVUPC-ARFHVFGLSA-N 396.491 2.926 0 50 GFAA OCCN1CCN(C2CCN(CC(c3ccccc3)c3ccccc3)CC2)CC1 952873525 YAVWAKJOBJARLB-UHFFFAOYSA-N 393.575 2.893 0 50 GFAA COc1cc(CN(C)CCc2scnc2C)cc(Cl)c1OCC(N)=O 952980732 YCLPXXYHFREYCY-UHFFFAOYSA-N 383.901 2.652 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2cc3c(cc2C)OCCO3)cc1OC 952985915 UBTALYFWFHBSPR-UHFFFAOYSA-N 386.404 2.612 0 50 GFAA Cc1cc(C(=O)N(C)Cc2cc(-c3ccccn3)no2)c2c(C)nn(C)c2n1 952989822 XOMZBYWWYNTJNB-UHFFFAOYSA-N 376.420 2.907 0 50 GFAA COc1ccc(CN2C[C@@H](Cc3cc(C)no3)[C@@H](OC)C2)c(OC)c1OC 1529090937 KTFRLPDJKQUJQA-QAPCUYQASA-N 376.453 2.698 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(S(=O)(=O)CC(C)C)CC1)OCC2 1704343568 KJKPXNJJBGYQQH-UHFFFAOYSA-N 383.510 2.553 0 50 GFAA COCC(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(CCc2ccccc2)C1 1772705148 WYKYZFBFJQXKCI-OFNKIYASSA-N 397.519 2.831 0 50 GFAA O=C(O)[C@]12CCOC[C@H]1CN(Cc1ccccc1OCCCCn1ccnc1)C2 1772705289 QSTPQEMMCCYRQG-KNQAVFIVSA-N 399.491 2.665 0 50 GFAA Cc1cc(C(=O)N2CCO[C@@]3(CCCN(C(=O)CC4CC4)C3)C2)c(F)cc1F 1775998043 YXGJFNBLSUKQRP-OAQYLSRUSA-N 392.446 2.907 0 50 GFAA O=C(O)[C@H]1CN(Cc2ncc[nH]2)CC12CCN(Cc1ccc3[nH]ccc3c1)CC2 1857694632 GRNCNNJERBTDGR-GOSISDBHSA-N 393.491 2.690 0 50 GFAA Cc1cc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)cc(O)n1 1857717368 MSTQRZSMPUOZIO-FGTMMUONSA-N 387.867 2.693 0 50 GFAA O=C([C@@H]1CCOC1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857724172 OMAJGQZBLDXKPR-MRXNPFEDSA-N 379.460 2.692 0 50 GFAA CCc1nc(=N[C@H]2CCN(C(=O)c3cncnc3C(C)C)C[C@@H]2CC)s[nH]1 1875302148 BMSMXQICDKZPIZ-ZFWWWQNUSA-N 388.541 2.789 0 50 GFAA COC(=O)[C@H](CCc1ccc(OC)cc1)NC(=O)c1ccc(C2(CN)CC2)cc1 1875317630 GDJLJTJLAVOGNE-FQEVSTJZSA-N 396.487 2.590 0 50 GFAA O=C1C[C@H]2CCCCN2CCCN(C(=O)Cc2ccc(F)cc2)CCCCN1 2100534024 PWCFMALWPFSMJP-HXUWFJFHSA-N 389.515 2.742 0 50 GFAA C[C@]1(C(=O)N[C@H]2CCN(C(=O)c3ccc4c(c3)NCC4)C[C@H]2F)CCCS1 2325827164 YBLJMJDCXIKAJV-GQIGUUNPSA-N 391.512 2.609 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)Nc1ccc(F)cc1)S(C)(=O)=O 1173329 HHGRYHMPGCRJLF-UHFFFAOYSA-N 386.832 2.892 0 50 GFAA Cc1cc(-c2ccc(C=C3C(=O)N(C)C(=O)N(C)C3=O)o2)cc([N+](=O)[O-])c1C 1209295 JIJXXOXKWHVWDJ-UHFFFAOYSA-N 383.360 2.905 0 50 GFAA COc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)ccc1C 2356140408 HXIMJYCQDYSWPB-JOCHJYFZSA-N 380.492 2.980 0 50 GFAA Cc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)cc(C)c1O 2356142112 FGAKYGGISXBEJD-QFIPXVFZSA-N 380.492 2.985 0 50 GFAA COCCNC(=O)CN(c1cccc(C)c1C)S(=O)(=O)c1ccc(C)cc1 2814447 RFJXTNOVHNJENO-UHFFFAOYSA-N 390.505 2.570 0 50 GFAA COCCNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(C)c2)c1 2869500 GGPVTMYSOSSGIT-UHFFFAOYSA-N 382.869 2.825 0 50 GFAA COc1ccc(N2C(=O)N(c3ccccc3Cl)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4172198 GBNNYSMKJRWEBL-SJORKVTESA-N 392.864 2.961 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)Cc2cccs2)c1 4387611 QVIKTBCAHCWJHN-UHFFFAOYSA-N 382.507 2.968 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)c2cc(Cl)c(Cl)cc2C)CC1 4744790 YIXVQUXEEBPTLJ-UHFFFAOYSA-N 381.281 2.765 0 50 GFAA COc1ccc(F)cc1[C@@H](C(=O)O)N1CC=C(n2c(=O)[nH]c3ccccc32)CC1 55414374 ZCKLDAKUXZLQPO-IBGZPJMESA-N 397.406 2.850 0 50 GFAA CC(C)N1CCC(N2CCN(c3ccnc4ccccc34)C[C@H]2CCO)CC1 106958437 XQDOJYOODDBRNL-HXUWFJFHSA-N 382.552 2.981 0 50 GFAA Cc1cc2cc(CNC(=O)C[C@@H]3C(=O)NCCN3CC3CCCCC3)ccc2[nH]1 20911801 QHWDZGQBRYSWSS-OAQYLSRUSA-N 396.535 2.863 0 50 GFAA O=C(c1ccc(N2CCSCC2)nc1)N1CCC(CCn2cccn2)CC1 20994763 ROKWIXMVBYSTJY-UHFFFAOYSA-N 385.537 2.774 0 50 GFAA Cc1ncc2c(c1-c1noc(-c3cc[nH]n3)n1)CCN(CC1CCOCC1)C2 23250324 BMNLWFWGDHCZPP-UHFFFAOYSA-N 380.452 2.615 0 50 GFAA CC(C)c1nn(C)c(N2CCOCC2)c1CNC[C@H](O)c1ccc(Cl)cc1 236607720 UZWDEWYUDILDRD-SFHVURJKSA-N 392.931 2.857 0 50 GFAA COc1ccc2cc(NC(=O)N3CCC[C@@]4(CCS(=O)(=O)C4)C3)ccc2n1 333205927 IXMFBAPGOHFMIZ-LJQANCHMSA-N 389.477 2.676 0 50 GFAA CN(C)CCN1Cc2c(cccc2C(=O)N2CCC[C@H]2c2cccnc2)C1=O 72432636 UEKUKSHXVFNJAM-FQEVSTJZSA-N 378.476 2.576 0 50 GFAA COc1ccc(C(=O)NC[C@H](O)CN2CCCCC2)c(OCCC(C)C)c1 239637099 BIUVEWSKGKGMAK-KRWDZBQOSA-N 378.513 2.697 0 50 GFAA COCC1(C(=O)N2CCC3(CC2)CN(CCc2ccccc2)C(=O)O3)CCC1 77286367 LYPNSJYCOBXUDC-UHFFFAOYSA-N 386.492 2.859 0 50 GFAA CC(C)Oc1cccc(C(=O)[C@H]2CCCN(CC(=O)Nc3cnn(C)c3)C2)c1 71755076 ZLMSWJQLVICJIZ-KRWDZBQOSA-N 384.480 2.741 0 50 GFAA Cc1ccc2nc([C@@H]3CCCN3Cc3cc(=O)n4cccc(O)c4n3)[nH]c2c1 72134296 SNZHNHYJBBSRQA-KRWDZBQOSA-N 375.432 2.922 0 50 GFAA Nc1nc(C2CC(N)C2)cc(N2CCC(c3nc4cc(F)ccc4[nH]3)CC2)n1 223960471 VRYDAWMHPFVSLD-UHFFFAOYSA-N 381.459 2.663 0 50 GFAA O=C([C@H]1CCCCN1Cc1ccccc1)N1CCN(c2ccccc2)C(=O)C1 82096563 DGYQRGDQGZFUSU-OAQYLSRUSA-N 377.488 2.917 0 50 GFAA CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@@H](OCCO)C1 178310192 JYRVDYRITNMWII-CYBMUJFWSA-N 375.391 2.777 0 50 GFAA O=C(Cn1ccc([C@H]2CCCNC2)n1)NCc1ccccc1OC(F)(F)F 426485624 LYKZNBPHIXXXQC-ZDUSSCGKSA-N 382.386 2.565 0 50 GFAA Cc1cc(C(F)(F)F)c2c(C)nn(CC(=O)N[C@@H](C)c3cn(C)nc3C)c2n1 20602209 UGFYJTINKFRJJO-JTQLQIEISA-N 394.401 2.986 0 50 GFAA COc1ccccc1OC1(C(=O)O)CCN(Cc2cc(C(C)=O)cn2C)CC1 82096343 XJLURRAMCKZJPI-UHFFFAOYSA-N 386.448 2.735 0 50 GFAA CNC(=O)COc1ccccc1-c1ccc(C(=O)N2CCCO[C@H](C)C2)cc1 426544525 VQCLRPSYHIKBTK-MRXNPFEDSA-N 382.460 2.729 0 50 GFAA O=C(c1cccc(S(=O)(=O)NCC[C@H]2CCCCO2)c1)N1CCCCC1 95374897 CJYGWNMMKHLXMQ-QGZVFWFLSA-N 380.510 2.550 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(Cc4csc(C)n4)C3)CCC2=O)cn1 91351040 DZCGNFYBNINZIE-FQEVSTJZSA-N 385.537 2.955 0 50 GFAA O=C1CC[C@]2(CCCN(S(=O)(=O)c3ccccc3Cl)C2)CN1C1CC1 91626091 ZJSBFMSQNGRTQF-SFHVURJKSA-N 382.913 2.896 0 50 GFAA CSCc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccccn2)C3)o1 95387034 FXNIKSJSVZWYHX-LSDHHAIUSA-N 385.489 2.914 0 50 GFAA Cc1ncc(C(=O)N2CCC(CCC(=O)NCc3ccc(F)cc3)CC2)cn1 95523928 SZDGPOXQMGCDIO-UHFFFAOYSA-N 384.455 2.873 0 50 GFAA CCN1CC2(CCC1=O)CCN(C(=O)[C@H](c1ccccc1F)N(C)C)CC2 91951418 DSAMBHRSACXPDD-IBGZPJMESA-N 375.488 2.680 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2cn3ccccc3n2)C1 95497440 QNHIUNLPXZCKBZ-QGZVFWFLSA-N 380.496 2.502 0 50 GFAA CN1C(=O)N[C@]2(CCN(C(=O)NCc3ccc(C4CCCCC4)cc3)C2)C1=O 297937427 JVJZAZYBDXDXOB-NRFANRHFSA-N 384.480 2.570 0 50 GFAA COCC(=O)N[C@@H]1CC[C@@]2(OC)CCN(Cc3ccnc4ccccc34)[C@H]2C1 534592180 LQCBMJMIDKVVRF-PIPMEXSNSA-N 383.492 2.509 0 50 GFAA COc1ccccc1-c1noc(CCCC(=O)N2CCn3nc(C)cc3C2)n1 299792328 DPSOAPWGBWZCHF-UHFFFAOYSA-N 381.436 2.615 0 50 GFAA Cc1cccc(N2CCC(NC(=O)c3cnc4cccc(C)n4c3=O)CC2)c1 670443013 RHTBPTFCDCMGIU-UHFFFAOYSA-N 376.460 2.710 0 50 GFAA Cc1sc2nc(CCNC(=O)c3ccc(Cn4cccn4)o3)nc(O)c2c1C 670440162 OHIVGVFWWGCJFY-UHFFFAOYSA-N 397.460 2.824 0 50 GFAA Cc1nn(C)c2nc(C(=O)N3CCC(Cc4cccc(O)c4)CC3)cc(O)c12 1875302181 CRZBHNKNWIJLIV-UHFFFAOYSA-N 380.448 2.783 0 50 GFAA O=C(c1c(F)ccc2ccncc12)N1CCC(c2ncc3c(n2)CCNC3)CC1 1875311981 FCMPELHNEJSMOR-UHFFFAOYSA-N 391.450 2.829 0 50 GFAA O=C(N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2c1ccccc1)N1CCC[C@]12CCS(=O)(=O)C2 1875405574 JYEACAXWHYKGRM-GQUPQBGVSA-N 388.533 2.931 0 50 GFAA O=C(NC[C@H](O)CCc1ccccc1)N[C@H]1Cc2n[nH]cc2[C@H](C(F)(F)F)C1 1875276633 KHWTVYWLGGZDAI-IIAWOOMASA-N 396.413 2.663 0 50 GFAA O=C(N1CCCCC1)N1CCC(NC(=O)C2(N3CCCC3)CCCCC2)CC1 952868070 XQWAYSDWLOCPRP-UHFFFAOYSA-N 390.572 2.972 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@@H](CCn2cncn2)c2ccccc2)c1 952989173 SYDFNTVVCHYKFD-IBGZPJMESA-N 377.448 2.863 0 50 GFAA Cc1cccnc1C(=O)N1CC2(CCC2)C[C@@H]1CNC(=O)C[C@@H]1CCCCO1 1775997491 LHUHHJJYTPCWKK-MSOLQXFVSA-N 385.508 2.850 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2cnc(C)nc2C)cc1 1565526972 RFVIVVKRWGKORK-MOPGFXCFSA-N 380.492 2.839 0 50 GFAA COc1ccc([C@H]2OCC[C@@H]2NC(=O)Nc2ccncc2Br)cn1 276031500 RBUYCBMZTAXKCO-DZGCQCFKSA-N 393.241 2.899 0 50 GFAA Cc1ccc(-c2nnn(CC(=O)N3CC[C@H](c4c(F)cccc4F)C3)n2)cc1 186190769 SIDLJDBXWHJJKX-HNNXBMFYSA-N 383.402 2.943 0 50 GFAA NC(=O)[C@@H]1CC(C(=O)OC[C@H]2CCCc3ccccc32)=NN1c1ccccc1 170621439 XZSRAIHDFOVYBK-UZLBHIALSA-N 377.444 2.770 0 50 GFAA CCc1c(C(=O)N(C)Cc2nc(CCOC)no2)cnn1-c1ccccc1C 186390389 FCNYTFJVTZMKSE-UHFFFAOYSA-N 383.452 2.587 0 50 GFAA O=C(N[C@H]1CCc2[nH]ncc2C1)c1cccc(-n2nccc2C(F)(F)F)c1 172219187 MPTXSOYOOWBRMR-ZDUSSCGKSA-N 375.354 2.902 0 50 GFAA Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N[C@H]3CCN(C)C(=O)C3)c12 193168877 ILXHYSDVNADFPN-AWEZNQCLSA-N 385.512 2.969 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)Nc3cnn(Cc4ccncc4)c3)c2O1 195504565 BJAOPNIQFNDJEW-UHFFFAOYSA-N 384.461 2.841 0 50 GFAA CC(C)Nc1ncc(C(=O)N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)cn1 1704344067 NLLXECZVYFSEDK-OXQOHEQNSA-N 391.475 2.521 0 50 GFAA O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCC[C@@H]1C1(O)CC1 1772804878 DKBJRTCBTLDYOP-LJQANCHMSA-N 385.485 2.790 0 50 GFAA Cc1ccc(CN2C[C@H]3CN(C4CCOCC4)C[C@]3(CCC(=O)O)C2)s1 1772703324 ZSTCMDBAWGYLOX-JXFKEZNVSA-N 378.538 2.834 0 50 GFAA O=C(c1ccc(Cn2ccnc2)o1)N1C[C@H]2CNC[C@]2(CCc2ccccc2)C1 1772703141 GXNFPHPAVGWDRO-AUSIDOKSSA-N 390.487 2.819 0 50 GFAA O=C([C@@H]1CCC(=O)N(C2CCCCCC2)C1)N1CCN(C2CCCC2)C(=O)C1 11815658 YBFYUYGSXRMYMS-QGZVFWFLSA-N 389.540 2.561 0 50 GFAA CCOC(=O)c1c(NC(=O)CSc2nc(CC)cc(=O)[nH]2)sc(C)c1C 11903407 BNYXKYZJVYBGNH-UHFFFAOYSA-N 395.506 2.918 0 50 GFAA COc1ccc(-n2cccn2)c(CN[C@@H]2CC(=O)N(Cc3cccc(F)c3)C2)c1 12193470 CHPNACQQKSJABO-LJQANCHMSA-N 394.450 2.911 0 50 GFAA COc1ccc(F)cc1C(=O)[C@@H]1CCCN(C(=O)CSc2ncccn2)C1 12432547 XWMVPMVVOHTXIO-CYBMUJFWSA-N 389.452 2.838 0 50 GFAA C[C@@]1(C2CCN(C(=O)c3ccc(-c4ccccc4)cc3)CC2)NC(=O)NC1=O 15068620 VYOOFPGOROAERL-QFIPXVFZSA-N 377.444 2.804 0 50 GFAA CCOc1ccc(OCCSc2nc3ccccc3n2C[C@H](O)CO)cc1 15659819 JJQQUASAUVTLCV-HNNXBMFYSA-N 388.489 2.959 0 50 GFAA Fc1cccc(-c2cnnc(NC[C@@H](c3ccccn3)N3CCOCC3)n2)c1 19223734 NYUKAHFRPLDMEC-IBGZPJMESA-N 380.427 2.558 0 50 GFAA COc1cnc(C)cc1-c1nc(C2CCCC2)nn1[C@@H]1CCS(=O)(=O)C1 1857670626 CFZACPVCIFKGFI-CQSZACIVSA-N 376.482 2.674 0 50 GFAA Cc1ccc(C(=O)O)c(N2CCC3(CC2)OCCc2cc(C(=O)O)sc23)n1 1857682205 GOMGAVWIOBJEOA-UHFFFAOYSA-N 388.445 2.916 0 50 GFAA CO[C@H]1CN(C(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)C[C@H]1OC 424811742 ZPYYJNQYOWQHED-IYBDPMFKSA-N 393.846 2.639 0 50 GFAA Cc1ccc(S(=O)(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)s1 328617431 CTFFYOJBZZFEIA-JTQLQIEISA-N 379.429 2.813 0 50 GFAA Cc1nc2cc(C(=O)N3CCC[C@H](NCCO)C3)ccc2n1-c1ccccc1 1263168679 UICIERMOVBQEMY-SFHVURJKSA-N 378.476 2.520 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3ccc4c(c3)CCCO4)cn12 2100539351 DRFUCGZSIBQDQV-IBGZPJMESA-N 380.448 2.674 0 50 GFAA CCn1c([C@@H]2OCC[C@@H]2C)nn(Cc2cc(Cl)c3c(c2)OCCO3)c1=O 2325870019 GHRHONISAZXVKD-XHDPSFHLSA-N 379.844 2.635 0 50 GFAA Cc1ccc(CN2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)cc1 100790048 DZJRHAAVBYPCFU-HXUWFJFHSA-N 379.460 2.571 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)Cc2ccc(F)cc2)cc1 780812 USDCFPUZEOPVQW-UHFFFAOYSA-N 390.480 2.947 0 50 GFAA O=S(=O)(Nc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cccs1 813084 LAXSHVLQKGTZOC-UHFFFAOYSA-N 386.520 2.724 0 50 GFAA O=C1COc2ccc(CC(=O)N(Cc3ccsc3)C[C@H]3CCCO3)cc2N1 55211118 VHCVFKRMDVQOAU-MRXNPFEDSA-N 386.473 2.829 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2cccnc2)C1)N1CCN(c2ccccn2)CC1 20363446 AJIHVCICRLGSEX-HXUWFJFHSA-N 393.535 2.818 0 50 GFAA O=C(O)C1(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)CC1 118959778 RZYAEOYRYADFMP-LBPRGKRZSA-N 375.812 2.961 0 50 GFAA O=C(CCc1ccccc1Cl)N1CCC(=O)N(CCN2CCCCC2)CC1 20256595 FQOMJLYSTKEGMD-UHFFFAOYSA-N 391.943 2.819 0 50 GFAA COc1cc(-c2ccc(C)s2)cc2c1OCCN(C(=O)C1=NNC(=O)CC1)C2 67884885 IZEDBUBGRHKSHX-UHFFFAOYSA-N 399.472 2.719 0 50 GFAA Cc1nnc(CN(C)Cc2cccc(C(=O)Nc3ccc4c(c3)OCO4)c2)o1 65456274 AZIMEXLZVACMJB-UHFFFAOYSA-N 380.404 2.991 0 50 GFAA CN1CCN(C(=O)c2cnn3c(C(F)(F)F)cc(-c4ccccc4)nc23)CC1 20481857 IDVFIYZGZJNYEJ-UHFFFAOYSA-N 389.381 2.803 0 50 GFAA O=C1CCN(Cc2c[nH]nc2-c2ccccc2)CCN1CCN1CCCCC1 20540175 XBFSDNAGNMAVLT-UHFFFAOYSA-N 381.524 2.597 0 50 GFAA CCc1ccc(NC(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)cc1 65364152 IZRAKWOPUNYTNG-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA OCC[C@H]1CN(Cc2cnc(N3CCCC3)s2)CCN1Cc1cccs1 23375233 VPGLRPVEQSSRCZ-INIZCTEOSA-N 392.594 2.874 0 50 GFAA Cc1[nH]c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)cc2c1C 65109755 YGZIHMSNFJQQNZ-QGZVFWFLSA-N 376.460 2.845 0 50 GFAA CC(C)NC(=O)CNC(=O)c1csc2nc(-c3cccc(Cl)c3)cn12 67490803 OPZILCGLXNYIQP-UHFFFAOYSA-N 376.869 2.971 0 50 GFAA COc1ccc(C2=NO[C@H](C(=O)N3CCN(c4ccc(F)cc4)CC3)C2)cc1 4904137 ZDPLHUXEHCFEAO-FQEVSTJZSA-N 383.423 2.676 0 50 GFAA Cc1cnc(-c2cccc(NC(=O)c3ccc([C@]4(C)NC(=O)NC4=O)cc3)c2)o1 363331112 JODICCNONAPMFH-NRFANRHFSA-N 390.399 2.957 0 50 GFAA c1ccc([C@H]2CCCN(CCn3ccnc3-c3cc4n(n3)CCNC4)C2)cc1 72469532 HQPBKZKUWTZHDY-IBGZPJMESA-N 376.508 2.729 0 50 GFAA CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)c1cccc(C(=O)O)n1 485648330 QGBGVRBHPFGIOJ-IBGZPJMESA-N 381.476 2.983 0 50 GFAA COc1ccc2c(c1)CCN(C(=O)[C@H]1CCS(=O)(=O)c3ccccc31)CC2 367414546 FCHKYCDQSCKNCH-IBGZPJMESA-N 385.485 2.584 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCN(c2nc3ccccc3s2)CC1 72479749 MAYTXOCTXZIRIB-UHFFFAOYSA-N 378.461 2.610 0 50 GFAA CCOc1ccc(-c2nc3s/c(=C/c4ccc(OC)cc4)c(=O)n3n2)cc1 33341929 KIZNRFGHFGQFTP-SFQUDFHCSA-N 379.441 2.773 0 50 GFAA CN1C(=O)[C@](CC(=O)NCc2ccon2)(Cc2ccccc2)c2ccccc21 71419125 MZYHOGCXNJZKJT-QFIPXVFZSA-N 375.428 2.838 0 50 GFAA C[C@H]1CCc2c(sc3nc(CCC(=O)NCC[C@@H]4CCNC4)nc(O)c23)C1 262571224 HIBWUDCNEHCWDG-STQMWFEESA-N 388.537 2.570 0 50 GFAA COCCn1cc2c(n1)[C@H](NC(=O)c1cnn(Cc3ccccc3)c1)CCC2 378546666 QTUIJYUJULWQOX-LJQANCHMSA-N 379.464 2.582 0 50 GFAA CC(C)C[C@H](Nc1nc(-c2ccncc2)nc2c1cnn2C)c1ncnn1C 72133205 JKPXUTNFNDFVNC-HNNXBMFYSA-N 377.456 2.753 0 50 GFAA C[C@H](CN1CCOCC1)NC(=O)c1ccc(-c2cnc3ccccc3n2)cc1 426523259 VTWXRGUPKWECDV-MRXNPFEDSA-N 376.460 2.747 0 50 GFAA CN(C)c1ncc(CN2CCC3(CCN(CC4CC4)CC3)[C@@H](CO)C2)s1 97272415 PQGPUYHNNSLFFO-QGZVFWFLSA-N 378.586 2.516 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NC(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 181107403 JKWUCAPZOTUHJS-LLVKDONJSA-N 391.382 2.895 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)Nc2cc(C)nn2-c2ccccc2)on1 96151447 CXDSTTFTGMXBHF-QAPCUYQASA-N 381.436 2.856 0 50 GFAA CCNc1ncc(CN2CCC3(CCC(=O)N(Cc4ccccn4)C3)CC2)cn1 91452529 LVUYBPGLCWEIHH-UHFFFAOYSA-N 394.523 2.708 0 50 GFAA COc1ccc(CN2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)cc1OC 91907603 KYTXFTHGJJLOAX-IEBWSBKVSA-N 381.476 2.835 0 50 GFAA CCc1ccc(C(=O)N2CCC(CCC(=O)NC[C@H]3CCCN3CC)CC2)[nH]1 95508931 IPPNCAICYNRHFV-LJQANCHMSA-N 388.556 2.810 0 50 GFAA Cc1cc(C)n(Cc2ccc(NC(=O)N[C@H](c3ncnn3C)C3CC3)cc2)n1 96165808 SJDFSCQESLGKRQ-SFHVURJKSA-N 379.468 2.950 0 50 GFAA O=C(NCC1(c2ccccc2)CCOCC1)c1cccc(N2CCNC2=O)c1 244719012 LVADKPBXBUQYSQ-UHFFFAOYSA-N 379.460 2.694 0 50 GFAA Cc1c(CC(=O)Nc2ccc(OCCN(C)C)cc2)c(=O)oc2cc(O)ccc12 253412176 QCKOEWLBXYQOBE-UHFFFAOYSA-N 396.443 2.929 0 50 GFAA biogenic Cc1c(-c2cc(CN[C@H](CN3CCCC3=O)c3ccccc3)on2)cnn1C 184717208 HVZYGRRNWRXRSY-HXUWFJFHSA-N 379.464 2.837 0 50 GFAA Cc1[nH]ncc1CNC(=O)CC[C@@H]1N=C(O)N(c2cccc3ccccc23)C1=O 252499003 RTJUFJDTTZJDJO-KRWDZBQOSA-N 391.431 2.597 0 50 GFAA O=c1cc(N2CCN(CCCc3cccnc3)CC2)c(-c2ccccc2)n[nH]1 252491972 MAMSPGZHSDFRHU-UHFFFAOYSA-N 375.476 2.587 0 50 GFAA C[C@H](CCNC(=O)N(Cc1ccc2[nH]ccc2c1)C1CC1)N1CCN(C)CC1 534661201 ZGFIKDVCBASRSV-QGZVFWFLSA-N 383.540 2.868 0 50 GFAA CC(C)C(=O)N1CCC[C@@H](NS(=O)(=O)c2cc(Cl)ccc2Cl)C1 825527253 CSQVSLYKVMJLIZ-GFCCVEGCSA-N 379.309 2.919 0 50 GFAA Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1cn(C)nc1C1CCOCC1 1875289569 AWFYGZJRQXDZRB-KRWDZBQOSA-N 375.494 2.588 0 50 GFAA COC(=O)c1ccc(NC(=O)[C@@H]2CC[C@H]([C@@H]3CCCO3)O2)cc1Br 1875296720 LEDSGVAUCZSXLK-ZNMIVQPWSA-N 398.253 2.901 0 50 GFAA Cc1cc(C)cc([C@H](N)C(=O)N2CCC[C@@H](n3c(O)nc4cccnc43)C2)c1 1875327199 ORFQDEWLHZDFPO-AEFFLSMTSA-N 379.464 2.617 0 50 GFAA Cn1c(O)nnc1[C@H]1[C@@H](C2CC2)CCN1C(=O)CCCn1cnc2ccccc21 1875401674 OMDXTOYTQJGULN-DNVCBOLYSA-N 394.479 2.650 0 50 GFAA CCN1C[C@@H](CN(C)S(=O)(=O)c2cccc3cccc(Cl)c23)CC1=O 952991245 VOGUHEBTCIBIBH-CYBMUJFWSA-N 380.897 2.982 0 50 GFAA O=C(c1ccccc1)N1CC[C@H]2[C@H](C1)NC(=O)N2C1CCN(CC2CCC2)CC1 888103353 DQALKEGMDOSCTN-SFTDATJTSA-N 396.535 2.559 0 50 GFAA O=c1c(CN2CC[C@H](c3ccc4c(c3)OCO4)[C@@H](O)C2)coc2ccccc12 1565530008 QYESKVVNMNEWJF-AEFFLSMTSA-N 379.412 2.872 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCN(C(=O)c2cc(-c3ccccn3)ccc2Cl)C1 169006319 KUAQASCOIAQQJL-CQSZACIVSA-N 393.896 2.556 0 50 GFAA CCOC(=O)[C@H](OC(=O)c1cc(OC)c(OC)c(OC)c1)c1ncccc1C 225526237 ROOIAZPFMOABQI-GOSISDBHSA-N 389.404 2.877 0 50 GFAA O=C1Nc2ccccc2CC[C@H]1N1CCCN(C(=O)c2ccc(F)cc2)CC1 191917715 MWCFNFHSUOOGQK-HXUWFJFHSA-N 381.451 2.927 0 50 GFAA O=C(CCc1ccccc1Cl)N1CCCN([C@H]2CN3CCC2CC3)CC1 1772805953 RXMIXBWURGGHIN-FQEVSTJZSA-N 375.944 2.901 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@H]3C(=O)NCCCc2ccccc2)n(C)n1 11964437 TZRNEONTWFYFBC-IBGZPJMESA-N 394.519 2.720 0 50 GFAA CCC(CC)CN1CCc2nnc(CCNC(=O)c3ccc(OC)cc3)n2CC1 11974524 FKIRBTCWUJUTLO-UHFFFAOYSA-N 399.539 2.554 0 50 GFAA O=C(CC[C@]1(Cc2ccco2)CCC(=O)N1)NCc1nc(-c2ccccc2)no1 12193479 ABXWTHKRNSGOSU-OAQYLSRUSA-N 394.431 2.618 0 50 GFAA Cc1nc(CN(C)[C@@H]2CCc3c(c(C(=O)N(C)C)nn3CC(C)C)C2)cs1 14537103 KASNMLAKYBUXCC-MRXNPFEDSA-N 389.569 2.995 0 50 GFAA CCOCCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccccc3)nn2C)C1 14539229 BJRMZLCRAKDJIQ-GOSISDBHSA-N 384.524 2.566 0 50 GFAA CC(C)CN1C[C@@H](C(=O)NC2CC2)C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C1 14543508 KHCKHJGFKHOLFA-RBUKOAKNSA-N 383.536 2.987 0 50 GFAA COc1cccc(CNC(=O)CC[C@H]2CCCN(c3ncccc3C(N)=O)C2)c1 19225802 JHCNTFHHEREBKR-MRXNPFEDSA-N 396.491 2.502 0 50 GFAA CCNC(=O)c1ccc([C@H]2CCCN2C(=O)CN(C)Cc2cccnc2)s1 19781548 KRKKOPRRVULJPJ-MRXNPFEDSA-N 386.521 2.688 0 50 GFAA Cn1cc(Cl)c(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)n1 1857672352 AOXYUMWNNXUJEF-LJQANCHMSA-N 387.871 2.567 0 50 GFAA COc1ncccc1C(=O)N1CCC2(CC1)C[C@H](O)C[C@H](c1ccccc1)O2 1857672358 TVVGPPPTEGINOY-IEBWSBKVSA-N 382.460 2.978 0 50 GFAA O=C1C[C@H](C(=O)N2CCc3[nH]nc(-c4ccccc4)c3CC2)C2(CCCC2)O1 1857674918 CVZAWFJESCUWFA-QGZVFWFLSA-N 379.460 2.880 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)c1c3c(nn1C)CCCC3)CC2 1857677755 BZNFDJQFUUUGLD-UHFFFAOYSA-N 389.503 2.940 0 50 GFAA CC(=O)Nc1ccc(C(=O)N[C@H]2C[C@H]3CO[C@H](C(C)C)CN3C2)c(Cl)c1 1857728953 GVNAAXHTEXQGCO-MPGHIAIKSA-N 379.888 2.526 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857732052 ZYSGZRYEMSUYKN-OAQYLSRUSA-N 379.464 2.587 0 50 GFAA CC(C)n1cc(Br)cc1C(=O)N(CCC(=O)O)C[C@H]1CCCO1 236686564 ORQBBWISBGMVGT-CYBMUJFWSA-N 387.274 2.927 0 50 GFAA Cc1ncsc1CCn1nc(C(=O)NC2CC2)c2c1CCN(CC1CC1)C2 14541303 QFEDLBDFESVQPU-UHFFFAOYSA-N 385.537 2.551 0 50 GFAA C[C@H](Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1)C(=O)O 262797353 NXECUWGFKPVBDI-WBVHZDCISA-N 387.480 2.816 0 50 GFAA CCOCCOc1ccccc1C(=O)N1CCC2(CC1)C[C@@](C)(O)CCO2 1704299420 PFTXWNHCAUUEBD-FQEVSTJZSA-N 377.481 2.638 0 50 GFAA O=C(C[C@@H]1Cc2ccccc2O1)NCCS(=O)(=O)c1ccc(Cl)cc1 1265339219 AZZABZWIRVOMOZ-HNNXBMFYSA-N 379.865 2.624 0 50 GFAA Oc1nc(N2CCOCC2)nc2c1CCC21CCN(CC2CCCCC2)CC1 2100545447 VRSDHDGYFXUMGU-UHFFFAOYSA-N 386.540 2.879 0 50 GFAA Oc1cc([C@H]2CCCN(Cc3cn4cccc(Br)c4n3)C2)[nH]n1 2325803845 GEQYBSKFAXOVSV-NSHDSACASA-N 376.258 2.905 0 50 GFAA O=C(NCCN1CCOCC1)c1cn(C2CCCCC2)c2ccccc2c1=O 2325809454 NTPITZUTKBKSLL-UHFFFAOYSA-N 383.492 2.569 0 50 GFAA CC(C)(C)OC(=O)[C@H]1C[C@@H](NC(=O)c2ccc(NCCn3ccnc3)cc2)C1 913751362 ALTKDAIRLUGNRA-MAEOIBBWSA-N 384.480 2.845 0 50 GFAA Cc1ccc(-c2nc(N[C@H]3CCC(=O)NC3=O)cc(N3CCC[C@H](C)C3)n2)cc1 1857797833 YZAKWXWHERAHCN-RDJZCZTQSA-N 393.491 2.905 0 50 GFAA COc1ccc(N(CC(=O)Nc2cccc(C)c2C)S(C)(=O)=O)c(OC)c1 1152818 CBMKYYBFLCSHSB-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA CCc1ccc(-c2nn(-c3ccccc3)cc2C=C2C(=O)NC(=O)NC2=O)cc1 1190245 PMPVBERGOBHKEO-UHFFFAOYSA-N 386.411 2.851 0 50 GFAA O=C(N[C@@H](Cc1c[nH]cn1)C(=O)O)OCC1c2ccccc2-c2ccccc21 2556588 SIRPVCUJLVXZPW-IBGZPJMESA-N 377.400 2.944 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CCC[C@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356162961 NEIUHLBEJRMSRZ-QYWGDWMGSA-N 392.446 2.866 0 50 GFAA Cc1cc(C)c(S(=O)(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C)c1 2852491 JSIDNFHSYLKLRG-UHFFFAOYSA-N 386.517 2.687 0 50 GFAA CCC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2OC)CC1 10323853 PVEVVVKOCFCJGG-CYBMUJFWSA-N 386.489 2.540 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)c3ccc(CSC)o3)C2)CC1 55042696 CAVLMUARXWRKDJ-OAHLLOKOSA-N 395.525 2.521 0 50 GFAA Cc1nnc(CN(C)C(=O)c2coc(COc3ccc4ncccc4c3)n2)o1 67725885 GVXWDTVMBOESOO-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA O=C(c1ccc[n+]([O-])c1)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2)C1 11661773 DTGYUAURJVGJGM-HSZRJFAPSA-N 379.504 2.881 0 50 GFAA CCOc1ncccc1C(=O)N1CCc2[nH]nc(-c3ccc4c(c3)OCO4)c2C1 67788450 OCUHJHRTAGBSLF-UHFFFAOYSA-N 392.415 2.798 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(c3ncnc4ccsc34)CC2)cc(O)n1 121549888 UHNQNAWRKFTIPK-UHFFFAOYSA-N 383.477 2.878 0 50 GFAA CC(C)Cc1cn(C[C@@H]2CCCN(C(=O)c3cccc4nccnc34)C2)nn1 67673439 LIXXAYUEUFNEDO-MRXNPFEDSA-N 378.480 2.972 0 50 GFAA CC(C)(C)n1cc(CN2CCC[C@H](c3n[nH]cc3CN3CCOCC3)C2)cn1 328636968 OJXLFQXYSFOJID-SFHVURJKSA-N 386.544 2.573 0 50 GFAA CC(C)Cn1nc(C(=O)O)c2c1CCN(C(=O)C1(N3CCCC3)CCCC1)C2 67490661 MOPSDFKEYLQDTL-UHFFFAOYSA-N 388.512 2.531 0 50 GFAA CCOC(=O)c1nc2ccc(I)cn2c1Br 4003127 YSYZPUGFDPVCEJ-UHFFFAOYSA-N 394.994 2.878 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CCN1CC[C@H](Cc2cnn(C)c2)C1 363589733 PDZFGMMOKMURQN-CQSZACIVSA-N 376.888 2.975 0 50 GFAA CC[C@H](NC(=O)N1CCC12CCOCC2)c1ccccc1OCC(=O)N(C)C 365591066 YGAHXQZJXUYTGI-KRWDZBQOSA-N 389.496 2.569 0 50 GFAA O=C([C@@H]1CCc2[nH]nnc2C1)N1CCN(C2c3ccccc3-c3ccccc32)CC1 284886833 SGLIDVLOSNWTQM-MRXNPFEDSA-N 399.498 2.824 0 50 GFAA Cc1nnc([C@H]2CN(C(=O)c3csc(Cc4ccccc4F)n3)CCO2)o1 376911134 LSIYOVYWCBSUHF-OAHLLOKOSA-N 388.424 2.778 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)N[C@](C)(CO)C(C)C)CC2)cs1 378123203 ONXDADWYMKEMNF-LJQANCHMSA-N 382.574 2.624 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2scc3c2OCCO3)CCC(=O)N1CC1CC1 71388806 OIJPFPPLJNZTQJ-AWEZNQCLSA-N 378.494 2.628 0 50 GFAA O=C(c1ccc2nc(-c3ccccc3)cn2c1)N1CCC(N2CCOCC2)CC1 82114733 WVDBECAVVOCTRX-UHFFFAOYSA-N 390.487 2.938 0 50 GFAA Cn1cc(CN2CCC3(CC2)c2ccccc2[C@@H](N2CC=CCC2)[C@@H]3O)cn1 19222626 GEVGQDHJIZHFTE-YADHBBJMSA-N 378.520 2.631 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3C[C@H](C)Oc4cc(C)ccc43)CC2)n1 178226212 KVYVGCYRIDEZET-HNNXBMFYSA-N 382.464 2.824 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(C(=O)c3ccnn3C)CC2=O)cc1 82120482 MKGHMDMIUSTYSZ-FQEVSTJZSA-N 388.471 2.829 0 50 GFAA Cc1cc(C)c(N2C[C@H](C(=O)NCc3nnc4n3CCCCC4)CC2=O)c(C)c1 193158857 YPEYPILMAYBMDP-QGZVFWFLSA-N 395.507 2.599 0 50 GFAA O=C(O)[C@@H]1[C@H]2C=C[C@@H](CC2)[C@H]1C(=O)N1CCN(Cc2ccccc2Cl)CC1 239046319 FNLIBPLMOWCQBZ-ILRDRHFLSA-N 388.895 2.897 0 50 GFAA CC(=O)N[C@@H]1CN(C(=O)c2cc(-c3ccccc3)on2)C[C@H]1c1ccc(C)o1 91594975 HSIQBPMSPSOKBH-SJLPKXTDSA-N 379.416 2.987 0 50 GFAA COC(=O)c1cccc(CN2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N3)n1 426620316 YUBNOCWLHAOXHG-GOSISDBHSA-N 379.460 2.507 0 50 GFAA CC(=O)N1CCCN(C(=O)Nc2ccc(C(=O)N3CCC[C@H](C)C3)cc2)CC1 96164382 DGKSCWUHTRPRQW-INIZCTEOSA-N 386.496 2.645 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc(OC)o3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95392117 ZWTASFLTDSPYRE-IOMROCGXSA-N 382.460 2.999 0 50 GFAA C[C@H]1CCCN(c2ccc(S(=O)(=O)N3CCC[C@H](C)C3)c3nonc23)C1 35913017 AUBNAXODWVFDHF-KBPBESRZSA-N 378.498 2.880 0 50 GFAA COc1cc(-c2noc([C@H]3CCc4nnn(C5CCOCC5)c4C3)n2)ccc1O 952894477 NJGCUEICJVAUMO-ZDUSSCGKSA-N 397.435 2.666 0 50 GFAA CC(=O)N1CCN(C(=O)[C@H](C)Nc2ccc(Oc3ccccn3)cc2C)CC1 1875279198 BNMAYOAUCPANAQ-INIZCTEOSA-N 382.464 2.673 0 50 GFAA Cc1[nH]nc2c1C[C@H](C(=O)N1CC(Oc3ccc(Br)cc3)C1)CC2 1875302131 AZOCZZOXPSLRFJ-GFCCVEGCSA-N 390.281 2.875 0 50 GFAA Cc1ccc2c(c1)C[C@H](C(=O)Nc1cccc([C@@H]3CCCC(=O)N3)c1)S2(=O)=O 1875392626 KWFSIZJFBGNZMF-PKOBYXMFSA-N 398.484 2.673 0 50 GFAA C=CC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c(C)nn(C)c2s1 1875383053 DWNVXNBTYSUYFS-CRAIPNDOSA-N 380.473 2.641 0 50 GFAA Cc1cncc(C(=O)N2CC[C@@]3(CCCCN(C(=O)c4n[nH]c(C)c4C)C3)C2)c1 1875322012 FOYRONNERWYSGV-JOCHJYFZSA-N 395.507 2.889 0 50 GFAA CCNS(=O)(=O)[C@@H]1CCN(C(=O)Nc2cc(C(F)F)ccc2Cl)C1 271330779 LWQPOTGFGIIJPP-SNVBAGLBSA-N 381.832 2.823 0 50 GFAA O=C1CC[C@@H](C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCCC4)n2cccc21 886040542 FSEFTZZKGXRLFQ-KRWDZBQOSA-N 376.416 2.691 0 50 GFAA CO[C@@H](CS(=O)(=O)Nc1nc(-c2ncccc2Cl)ns1)C(C)C 888097053 XCECHOUGTZJPFX-JTQLQIEISA-N 376.891 2.666 0 50 GFAA C[C@H]1Cc2cc(-c3nnc(N(C)Cc4cccc(C(N)=O)c4)n3C)ccc2O1 1339735030 IVTFAJFUDBMHCR-ZDUSSCGKSA-N 377.448 2.541 0 50 GFAA CCN1CCC[C@H]1CN(CCN(C)C)C(=O)c1ccc(-c2cncnc2)cc1F 185828768 HAFQOLXDKGKVSU-IBGZPJMESA-N 399.514 2.771 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)N(C)c3ccccc3C(=O)O)cc2C[C@H]1C 274962618 VEOTWDBNCVDAOF-GFCCVEGCSA-N 388.445 2.507 0 50 GFAA CCc1nnc([C@@H]2CN(S(=O)(=O)/C=C/c3ccccc3Cl)CCO2)o1 275387699 ZGHAFCYDUWBAEV-RNVIBTMRSA-N 383.857 2.659 0 50 GFAA Cc1cc(N2CCC[C@H](NC(=O)Nc3ccncc3Br)C2)n(C)n1 278094371 IOYLPWGEMCYIDP-LBPRGKRZSA-N 393.289 2.677 0 50 GFAA C[C@H](NS(=O)(=O)CC1CCS(=O)(=O)CC1)c1ccc2ccccc2c1 225832752 HMMJUUFJJXHASQ-AWEZNQCLSA-N 381.519 2.645 0 50 GFAA CCc1noc([C@@H](C)N2CCN(c3cc(C)nc(-c4ccncc4)n3)CC2)n1 112080492 NBUGRSFZTZOFRQ-OAHLLOKOSA-N 379.468 2.676 0 50 GFAA COc1cccc2c1CCN(C(=O)N[C@H]1CCc3nnc(C(C)C)n3C1)CC2 194557072 ASTUZFMDKVHUTD-INIZCTEOSA-N 383.496 2.535 0 50 GFAA O=C(Cc1cccc(F)c1)NS(=O)(=O)c1sccc1Br 195305639 CJMLJFKCZPHSCW-UHFFFAOYSA-N 378.244 2.697 0 50 GFAA CN(C)C(=O)c1ccc(CN2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)o1 1704342132 IERDORRXZURCTC-OXQOHEQNSA-N 379.460 2.565 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)C[C@H]3CCCOC3)CC1)OCC2 1704299251 PEGPMOJPWOQNEX-MRXNPFEDSA-N 389.492 2.911 0 50 GFAA O=C(c1ccc(OCc2ccccc2F)cc1)N1CC[C@@]2(CO)CCCN[C@@H]2C1 1704340760 LWUITMNAMRZUEG-FYYLOGMGSA-N 398.478 2.981 0 50 GFAA COc1ccc(-c2ccc(=O)n(CC(=O)Nc3ccc(NC(C)=O)cc3)n2)cc1 5388855 WVBWEORXDKQMBH-UHFFFAOYSA-N 392.415 2.516 0 50 GFAA CN(C[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1)C(=O)CN1CCCC1=O 12196573 YSNSCYHVBNYFEM-SFHVURJKSA-N 391.943 2.675 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12836604 QJXZZCDSDAOTFK-GOSISDBHSA-N 387.499 2.555 0 50 GFAA O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CCCN1Cc1cc(F)cc(F)c1 15063953 BIZHVZXHDYKHRN-GOSISDBHSA-N 384.390 2.544 0 50 GFAA COc1ccc(Br)cc1CN1CCN(C(=O)c2ccncc2)CC1 19559183 JLHURFAGWWAGBZ-UHFFFAOYSA-N 390.281 2.811 0 50 GFAA Cc1cccc(NC(=O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c1C 19928552 AXFWAMWNKWTDDI-UHFFFAOYSA-N 381.476 2.788 0 50 GFAA O=C(c1cccc(Cn2cccn2)c1)N1CCO[C@@H](CO)[C@@H]1c1ccccc1 1875249846 FKZMNQSOMWQMRE-SFTDATJTSA-N 377.444 2.506 0 50 GFAA O=S(=O)(C[C@H]1CCCCO1)Nc1cccc(-c2nnc3n2CCCCC3)c1 110096595 YTWUEYAWJPYZKP-QGZVFWFLSA-N 390.509 2.982 0 50 GFAA C[C@@H](NC(=O)CN1CCN([C@@H]2CCCN(C)C2)CC1)c1cccc2ccccc12 112638173 KXQZFKUNNGCZMB-TZIWHRDSSA-N 394.563 2.729 0 50 GFAA CNS(=O)(=O)c1cccc(NC(=O)c2cnn(C3CCCC3)c2C)c1C 122444389 JZHOEXMOJUCITF-UHFFFAOYSA-N 376.482 2.775 0 50 GFAA CC(C)CCC(=O)N1CCC([C@@]2(Cc3ccccc3F)NC(=O)NC2=O)CC1 11787736 JVOPUDCZILTMLM-OAQYLSRUSA-N 389.471 2.621 0 50 GFAA CCc1n[nH]c(=O)c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c1CC 133346230 HDJBDDDZSFTFEC-UHFFFAOYSA-N 388.899 2.506 0 50 GFAA COc1ccccc1O[C@@H](C)CNC(=O)Nc1ccc(S(C)(=O)=O)cc1 266374342 MDOZWJDCLVAAEY-ZDUSSCGKSA-N 378.450 2.688 0 50 GFAA Cc1cccc2nc(C(=O)N3CCC[C@@]4(CCc5cnc(N(C)C)nc54)C3)cn12 1704325819 SLYQXQCUVFPRDI-JOCHJYFZSA-N 390.491 2.619 0 50 GFAA CC[C@@H](C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 917476 AJPCSRPWKHUIQF-LJQANCHMSA-N 388.489 2.840 0 50 GFAA COc1ccc(Cl)cc1NC(=O)CN(c1ccccc1)S(=O)(=O)N(C)C 4197025 NYWDDKADFABFJX-UHFFFAOYSA-N 397.884 2.600 0 50 GFAA Cc1cccc(Nc2ccc(N3CCN(C(=O)c4cccs4)CC3)nn2)n1 11697215 QUOWTDLLRXJSKW-UHFFFAOYSA-N 380.477 2.948 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1cccc(Oc2ccccn2)c1 2325785800 NZURURSIRCRMTD-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA CC[C@H](C)OCC(=O)NCC1(NC(=O)c2cnn3cccc(Cl)c23)CCC1 2325793437 UTNRIHKZFIEXLT-ZDUSSCGKSA-N 392.887 2.572 0 50 GFAA C[C@H](CNC(=O)C(C)(C)c1cccnc1)N(C)C(=O)C[C@@H]1CCC(C)(C)CO1 2325794018 ODZSWIKBKWKTKV-AEFFLSMTSA-N 389.540 2.918 0 50 GFAA COc1ccc2c(c1)[C@H](C)CN(C(=O)c1ccc3c(c1)CC[C@H](N)C(=O)N3)CC2 2325795566 NECJFKIMBDQQSO-VLIAUNLRSA-N 393.487 2.709 0 50 GFAA Cc1cn2c(n1)CC[C@@H](CN(C)C(=O)c1ccc(=O)n(-c3ccccc3)c1)C2 2325798657 MUWTWNYMTAWVTL-KRWDZBQOSA-N 376.460 2.677 0 50 GFAA CC[C@H](C)n1ncc2cc(C(=O)NCc3nnc(O)c4ccccc34)cnc21 2325806358 KJPBITIHXMWWKZ-LBPRGKRZSA-N 376.420 2.981 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)NCc3cc(Br)no3)ccc21 2325889717 LSRLWQLIUQWEES-UHFFFAOYSA-N 390.237 2.832 0 50 GFAA Cc1ccc(C)c(N(CC(=O)NCCSc2ccccc2)S(C)(=O)=O)c1 2982173 WKNFGTQIOJYKJW-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA Cc1nc(O)cc(CN2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)n1 2356169628 FLOUUJIWVZRDPL-JOCHJYFZSA-N 380.492 2.690 0 50 GFAA CO[C@](C(=O)Nc1c(C)nn(CC(=O)O)c1C)(c1ccccc1)C(F)(F)F 55072086 DTQZVQZXOXHWSZ-INIZCTEOSA-N 385.342 2.627 0 50 GFAA COCCN1CC[C@@H](C(=O)Nc2cccc(NC(=O)Cc3ccccc3)c2)C1 55359009 ONFJMJAEQDXAKH-GOSISDBHSA-N 381.476 2.775 0 50 GFAA COc1cccc(CN(C)[C@@H](C)c2ccon2)c1OCCN1CCOCC1 55393497 XABHSLDLTOAEMU-INIZCTEOSA-N 375.469 2.587 0 50 GFAA CS(=O)(=O)N(CC(=O)N[C@@H]1C[C@H]2CC[C@H]1C2)c1cccc(C(F)(F)F)c1 101531056 DCYFPVDEBRJURE-SLEUVZQESA-N 390.427 2.776 0 50 GFAA C=CC(=O)Nc1cc(NC(=O)CCNC(=O)c2[nH]nc3ccccc23)ccc1F 136617934 QVORNEHCQJWTKY-UHFFFAOYSA-N 395.394 2.585 0 50 GFAA Cc1c(F)cccc1S(=O)(=O)N1CCN(c2ncnc3ccsc23)CC1 173298226 QNZGHKOQPHTATJ-UHFFFAOYSA-N 392.481 2.650 0 50 GFAA Cc1nn(C)c(C)c1CN(C)C(=O)c1cn(Cc2ccc(F)cc2Cl)nn1 72151587 PFLKFUIESGKNIM-UHFFFAOYSA-N 390.850 2.741 0 50 GFAA CNS(=O)(=O)c1cccc2c1CCN(Cc1c[nH]c(-c3ccccc3)n1)C2 284884904 FEVRTPBUMAPFDK-UHFFFAOYSA-N 382.489 2.543 0 50 GFAA O=C(NCc1n[nH]c2c1CCCCC2)c1cn(CCCc2ccccc2)nn1 72134309 WTLMSYVKMNBBAM-UHFFFAOYSA-N 378.480 2.833 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](C(=O)O)N(C(=O)C2CC2)C3)cc1C 72474430 SDMLWXALLOHPAU-SFHVURJKSA-N 384.476 2.621 0 50 GFAA O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CCCN2c3ccccc3C[C@@H]2C1 291808645 HQMYROAWIAOIMB-UYAOXDASSA-N 393.487 2.938 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C)C3)nc(C)n1 95362095 MGIJNBUHEHOVRQ-LJQANCHMSA-N 392.503 2.962 0 50 GFAA CNc1snc(C)c1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 181422257 CMMQJSLBXAOIBG-GFCCVEGCSA-N 382.848 2.821 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(CCn1cnc3ccccc31)CC2 91943298 RYQVRLVRGQKEMZ-UHFFFAOYSA-N 384.524 2.777 0 50 GFAA COc1cc(C(=O)N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)ccn1 91746148 CRNWUNMQEGWWTM-GOSISDBHSA-N 377.448 2.750 0 50 GFAA Cc1cc(N2CCC(NC(=O)N[C@H]3CC(C)(C)OC3(C)C)CC2)nc(C)n1 181860302 ZWKAEUBPCLXOMN-INIZCTEOSA-N 375.517 2.708 0 50 GFAA CNS(=O)(=O)c1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1OC 96142094 OPQMXSOQIOVFNB-MRXNPFEDSA-N 389.477 2.972 0 50 GFAA C[C@H]1CN(C(=O)c2cccc(NC(=O)CCCc3cccs3)c2)CC(=O)N1 296298252 RUJXENJOKYNNPJ-AWEZNQCLSA-N 385.489 2.670 0 50 GFAA O=C(c1ccccc1OC1CCN(Cc2ccccn2)CC1)N1CCCOCC1 95506723 JRMXVWKTLABMBH-UHFFFAOYSA-N 395.503 2.988 0 50 GFAA CN(C)[C@@H](C(=O)NCCc1csc(-c2cnccn2)n1)c1ccc(F)cc1 95356460 FGKVVVQIIGTLSC-QGZVFWFLSA-N 385.468 2.701 0 50 GFAA O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)N1CCC(c2ncc[nH]2)CC1 95509035 RRLCVXQBVOILSW-UHFFFAOYSA-N 388.777 2.650 0 50 GFAA COCCn1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)n1 299671740 NGGMFSVZROSEGZ-KRWDZBQOSA-N 384.480 2.637 0 50 GFAA Cc1cccc(C[C@H](CNC(=O)[C@H]2CC(=O)N(C)c3ccccc32)C(=O)O)c1 299749075 JDLDXBVQNZDHNO-AEFFLSMTSA-N 380.444 2.505 0 50 GFAA CCN1CCC(CNC(=O)N(C)[C@@H](C)c2ccc(OC)cc2)(N(C)C)CC1 534576239 UWUKNJRGAXMELT-KRWDZBQOSA-N 376.545 2.814 0 50 GFAA CCc1nccn1CCNC(=O)N1CCC[C@H](Cc2nc3ccccc3[nH]2)C1 534584215 BBNDNHZRRSWKEM-MRXNPFEDSA-N 380.496 2.986 0 50 GFAA CS(=O)(=O)N1CCCC[C@@H]1CCNC(=O)Nc1ccc2ncsc2c1 299759886 OLVNNMMTXSAAPY-CYBMUJFWSA-N 382.511 2.622 0 50 GFAA Cc1cnc(-c2cccc(C(=O)N3CC[C@@H]4CC[C@H](C3)N4C)c2)nc1N(C)C 299772761 AXPINUPBENUIBG-RBUKOAKNSA-N 379.508 2.827 0 50 GFAA Cc1ccc2nc(C)c(C)c(C(=O)N3CCC[C@@H](C(=O)N4CCOCC4)C3)c2c1 825206782 FJZXUUNHGGWGKF-GOSISDBHSA-N 395.503 2.871 0 50 GFAA COc1ccc(-c2csc3ncn(Cc4cnn(C)c4)c(=O)c23)c(OC)c1 670473394 VGCBXXSCXXDPQU-UHFFFAOYSA-N 382.445 2.924 0 50 GFAA O=C(NC[C@@H]1C[C@H]2OCC[C@H]2O1)c1cc(-c2ccc(Br)cc2)[nH]n1 1875308829 ZZTMNCCTUPPLAO-APHBMKBZSA-N 392.253 2.515 0 50 GFAA Cn1cc(C[N@@]2C[C@@H]2COc2cccc(C(=O)NCc3ccccc3)c2)cn1 1875385191 OBKSQORBDSQECO-IBVKSMDESA-N 376.460 2.613 0 50 GFAA O[C@@H]1C[C@H](Cn2cccn2)C[C@H]1NCc1ccccc1OCc1ccncc1 1875400298 WDHZXPNNPDXUTG-HMXCVIKNSA-N 378.476 2.786 0 50 GFAA COc1ccc(CCN(Cc2ccncc2)C(=O)C2(N)CCCC2)cc1OC 952976029 QUXPBRQPIFJAKD-UHFFFAOYSA-N 383.492 2.942 0 50 GFAA C[C@@H]1CN(C[C@H]2CCCN2C(=O)Nc2cncc(Br)c2)C[C@@H](C)O1 221982862 SJLGABRHPKOWJI-XJKCOSOUSA-N 397.317 2.950 0 50 GFAA C[C@@](O)(CNC(=O)NC1CCN(CCc2ccccc2)CC1)c1ccccc1 172025172 VZGZSOUQKFTMRG-HSZRJFAPSA-N 381.520 2.900 0 50 GFAA COc1ccc2cc([C@@H]3CN(CC(=O)Nc4cnn(C)c4C)CCO3)ccc2c1 1506421673 KQYIOOSTKUBAPO-NRFANRHFSA-N 394.475 2.902 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529105540 FWHZUGDNOVTPES-FOIQADDNSA-N 376.460 2.512 0 50 GFAA CSCCCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 11661361 GMJFXURSILSQSF-UHFFFAOYSA-N 376.522 2.949 0 50 GFAA COc1ccccc1/C=C/CN1CCC(n2cc(C(=O)NC(C)C)nn2)CC1 12150489 YIMWNGWCFXSLDB-SOFGYWHQSA-N 383.496 2.775 0 50 GFAA CC(=O)c1ccccc1-c1ccc2c(c1)C[C@@H](CNC(=O)CCC(=O)N(C)C)O2 12184156 FJDMNGZCBYMKFO-SFHVURJKSA-N 394.471 2.844 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2F)CCCN(C(=O)Cn2cccn2)C1 12299492 WOUPVIBYPFNSBB-HXUWFJFHSA-N 391.418 2.576 0 50 GFAA O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cn(Cc2ccccc2Cl)nn1 12314475 VZLQUVWDEHUYCI-GOSISDBHSA-N 395.894 2.984 0 50 GFAA O=C(c1ccco1)N1CCCN(Cc2nc(CCc3ccccc3)no2)CC1 12710966 XIRUJPLHHHAYBX-UHFFFAOYSA-N 380.448 2.796 0 50 GFAA CCOc1cc(/C=c2/sc3nc4ccccc4n3c2=O)ccc1OC(C)=O 12916199 MSXXSGFJMFSFIR-WOJGMQOQSA-N 380.425 2.781 0 50 GFAA COc1ccc(CN2C(=O)N(C)C3(CCN(Cc4ccccn4)CC3)C2=O)cc1 14746735 RQYMNBGGYWNFHW-UHFFFAOYSA-N 394.475 2.519 0 50 GFAA CCS(=O)(=O)N1CC[C@@]2(CCCN(Cc3ccc(C(C)C)cc3)C2=O)C1 15076235 MZGGTZPFUYVAAL-FQEVSTJZSA-N 378.538 2.974 0 50 GFAA CC(C)CC(=O)N1CCC[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C1 19223876 AHLZMPBDTCQSSO-LJQANCHMSA-N 387.524 2.570 0 50 GFAA CNC(=O)Cc1nc(-c2cccc(N3CCCC3=O)c2)n(-c2ccccc2C)n1 1857666008 CPKNLLIUCNQEBF-UHFFFAOYSA-N 389.459 2.658 0 50 GFAA COc1ccc(C(=O)N[C@H]2CCC[C@@H](NC(=O)CCCn3cccn3)C2)cc1C 1857684091 YVNAFFXXWFMZTM-MOPGFXCFSA-N 398.507 2.838 0 50 GFAA COC(=O)[C@H]1C[C@H](NC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)C1 1857719842 VRPKWLMMIIEXCN-OBJOEFQTSA-N 391.855 2.765 0 50 GFAA Cc1ncsc1CCNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857726854 GGSZXLDOOPTTNB-AWEZNQCLSA-N 385.493 2.953 0 50 GFAA CC(=O)c1cc(C(=O)N2CC[C@@]34O[C@H](c5ccccc5)CN3C(=O)C[C@@H]24)cs1 1857729257 BRAGSWBVWMGWRT-CDXJDZJCSA-N 396.468 2.865 0 50 GFAA CN1C[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)nc3ccccc13)C2 1857739641 YOBRTXTWUFSDGT-AEFFLSMTSA-N 388.471 2.699 0 50 GFAA COc1cc(-c2noc(C3=NN(Cc4ccc(F)cc4)C(=O)CC3)n2)ccn1 114057140 WXRZAHVOXIBSBB-UHFFFAOYSA-N 381.367 2.806 0 50 GFAA Cc1cc([C@H]2CCCN(C(=O)CCn3cnc4sc(C)c(C)c4c3=O)C2)n[nH]1 328748083 QGKQAMRGOOTUOC-HNNXBMFYSA-N 399.520 2.903 0 50 GFAA CS(=O)(=O)N1C[C@H]2CC[C@@H](C1)N(C(=O)c1cc3c(s1)CCCCC3)C2 247542203 SMQHVTLPIQIOHI-HIFRSBDPSA-N 382.551 2.513 0 50 GFAA COc1ccc(CC2CCN(C(=O)c3ccc(S(C)(=O)=O)o3)CC2)cc1 498165826 ZKEBGRCENJMFFZ-UHFFFAOYSA-N 377.462 2.787 0 50 GFAA CC(C)Oc1cc(CNC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)ccn1 162858818 LLIROYCIGQNAJH-OAQYLSRUSA-N 383.492 2.683 0 50 GFAA O=C(CCC(F)F)N1CCN(c2ccc(I)cc2)CC1 2325766595 AWTHGMXUGMYIAV-UHFFFAOYSA-N 394.203 2.985 0 50 GFAA COc1cc([C@@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccc2OC)ccc1O 1201459 LIMHVRQJQMKQBL-SFHVURJKSA-N 399.472 2.841 0 50 GFAA O=C(c1cccc2ccccc12)[C@@H]1CCCN(C(=O)CCN2CCOCC2)C1 23366527 PFXMWZDJYDPSGB-LJQANCHMSA-N 380.488 2.983 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NCCc2ccc(Cl)nc2)cc1Cl 151286191 KVSCUYSWIHTUSC-UHFFFAOYSA-N 389.260 2.696 0 50 GFAA CC(C)(C)NC(=O)C[C@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1 72130800 MLKUKEXEQNPDIZ-NRFANRHFSA-N 393.531 2.924 0 50 GFAA O=S1(=O)CCN(Cc2nc3cc(Br)ccc3o2)[C@@H](C2CC2)C1 333140738 YRKGPHBVRBZJSG-CYBMUJFWSA-N 385.283 2.599 0 50 GFAA CCn1c(N)nc2cc(C(=O)N3CCC4(CC3)CNc3ccccc34)cnc21 77406516 DGDZYUDKZAZLQL-UHFFFAOYSA-N 376.464 2.633 0 50 GFAA NC[C@H]1CCCN1C(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1 238046464 FIZUNCZYRGLJKX-RQWLHQTBSA-N 387.487 2.956 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O 130053849 XOXPGJGUAOYWSW-CQSZACIVSA-N 375.519 2.590 0 50 GFAA C[C@H]1C[C@@H](N2CCOCC2)CN1C(=O)NCc1cccc(-c2cccnc2)c1 376492228 QXLJHQXHGUNHBR-LAUBAEHRSA-N 380.492 2.753 0 50 GFAA Cc1ccccc1C(=O)N[C@@H](C(=O)NCc1cccc(OCC(=O)O)c1)C(C)C 262871894 XVKAEHRTQHMYCE-HXUWFJFHSA-N 398.459 2.529 0 50 GFAA O=C(NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1cnc(OCC2CC2)c(Cl)c1 242263441 XZEXWJRVTHPPNJ-PBHICJAKSA-N 394.899 2.821 0 50 GFAA O=C(O)c1ccc(C[C@@H]2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)cc1 72433079 HIVRKAAZLLXKSV-HNNXBMFYSA-N 376.412 2.931 0 50 GFAA O=C(Cc1csc(-c2ccccn2)n1)N1CCC(OC[C@@H]2CCCO2)CC1 175517294 QVZWOFXKHAVJIT-KRWDZBQOSA-N 387.505 2.934 0 50 GFAA COc1cc(C)c(Cl)cc1S(=O)(=O)N1CCN(c2ccccn2)CC1 41107867 ISSNSWFFYLAAOD-UHFFFAOYSA-N 381.885 2.563 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)C(=O)Cn1sc2ccccc2c1=O 95503900 UVCBJKUEKDPYOI-UHFFFAOYSA-N 378.457 2.907 0 50 GFAA O=C1CC[C@@]2(CCCN(C(=O)c3ccccc3F)C2)CN1CCc1c[nH]cn1 91794573 ZFHCQYPETCXABO-NRFANRHFSA-N 384.455 2.636 0 50 GFAA O=C(Nc1ccc(Oc2ccccc2F)cc1)C1CCN(C(CO)CO)CC1 95528284 IPUYTMNAEWYAOR-UHFFFAOYSA-N 388.439 2.622 0 50 GFAA Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1c2ccccc2C[C@@H]1O 182348349 IBZGSTYRPJNNLQ-QXKQMHMISA-N 381.398 2.940 0 50 GFAA Nc1nc(NCC2CCN(CCc3ccccc3)CC2)cc([C@H]2C[C@@H](N)C2)n1 244811671 SIYMYTBNSXOJJB-KDURUIRLSA-N 380.540 2.630 0 50 GFAA Cc1nn(C)c(C)c1CNC(=O)[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1 252506837 WIBIYJFLYMYZOR-WKILWMFISA-N 378.517 2.984 0 50 GFAA Cc1nn(-c2ccc(C(=O)N3CCO[C@H]4CCC[C@@H]43)cc2)c(C)c1CCC(=O)O 299746645 YVXKKGSKINHTRP-PMACEKPBSA-N 397.475 2.900 0 50 GFAA COCCCN1CC[C@@H](CNC(=O)N(C)Cc2cc3cc(F)ccc3[nH]2)C1 534588933 CGVAPXDZZGCIPN-HNNXBMFYSA-N 376.476 2.807 0 50 GFAA NC(=O)Cc1ccc(-c2cccc(C(=O)N3CCN(CC4CC4)CC3)c2)cc1 534579674 XISRQAFQFPLOEL-UHFFFAOYSA-N 377.488 2.549 0 50 GFAA O=C(NCc1ccc2sccc2c1)N1CCCN(C(=O)[C@@H]2CCCO2)CC1 366107441 TYHZTGWEAXGQEE-KRWDZBQOSA-N 387.505 2.824 0 50 GFAA COc1ccc(C)nc1-c1cccc(C(=O)NCCSc2nncn2C)c1 299762503 MHOFTBGOHBUYQK-UHFFFAOYSA-N 383.477 2.716 0 50 GFAA CC1(C)C[C@@H](CN2CCC(CNC(=O)CN3CCCCCC3)CC2)CCO1 827832309 XKBYEJMSNVBKFJ-FQEVSTJZSA-N 379.589 2.896 0 50 GFAA CN(Cc1noc(C2CC2)n1)C(=O)N[C@H]1CCCN(Cc2ccccc2F)C1 584886932 WNUMDPSBZNERNW-INIZCTEOSA-N 387.459 2.892 0 50 GFAA Cc1cccc(-c2ccccc2C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1 670445209 MGNOAUUSUAKVOV-LJQANCHMSA-N 379.504 2.979 0 50 GFAA O=C(c1cncc(NCC[C@H]2CCCCN2C2CCCC2)n1)N1CCOCC1 670435311 UOTXYYDUGWNIMB-GOSISDBHSA-N 387.528 2.548 0 50 GFAA Cc1nc2c(c(N3CCN(C(=O)Cc4nc(C)sc4C)CC3)n1)CCCC2 1875279321 QDMOKNQGEWYGCD-UHFFFAOYSA-N 385.537 2.628 0 50 GFAA COC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1 1875266961 IXAPQWBPEILXII-SVFBPWRDSA-N 393.487 2.549 0 50 GFAA CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(c3nccc(-n4ccnc4)n3)C[C@@H]21 1875273616 UFQPIGVJJRMTMR-TWMKSMIVSA-N 396.495 2.744 0 50 GFAA O[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1NCc1cc(Cl)c2c(c1)OCCCO2 1875399918 MCUIDSVVOPUNOV-DJIMGWMZSA-N 377.872 2.627 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC4(CC3)Cc3ccccc3NC4=O)n[nH]c21 1875396500 JTLOCBFAUFIZEJ-KGLIPLIRSA-N 394.475 2.849 0 50 GFAA Cc1cc(C)c(C(=O)NC[C@H]2CCN(C(=O)Cn3c(C)nc4ccccc43)C2)[nH]1 1875310451 PSAPTWDSJCJTEX-QGZVFWFLSA-N 393.491 2.568 0 50 GFAA Cc1cccnc1C(=O)N1CC2(CCC2)C[C@@H]1CNC(=O)C[C@H]1CCCCO1 1775997492 LHUHHJJYTPCWKK-QZTJIDSGSA-N 385.508 2.850 0 50 GFAA CN(C(=O)c1cc(O)nc2ccccc12)[C@@H]1CCN(Cc2ccccc2)C1=O 189772404 RDZZFVABOYYFTO-LJQANCHMSA-N 375.428 2.814 0 50 GFAA Cc1ccc(C)c(OCC(=O)N(Cc2ccncc2)C[C@@H]2CCC(=O)N2)c1C 1506400193 JACXQVFWDUYUAI-IBGZPJMESA-N 381.476 2.693 0 50 GFAA Cc1cc(C)n(-c2ccc(F)cc2CN2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)n1 1529195303 IKLQTVDUGDOKCV-DYESRHJHSA-N 383.471 2.695 0 50 GFAA COc1cc(-c2onc(N3CCC(CNC(C)=O)CC3)c2C(=O)O)ccc1F 1704324595 BAVUYQJHQPYYGG-UHFFFAOYSA-N 391.399 2.540 0 50 GFAA Cc1cc(OC[C@@H](O)CNc2cncc(C(=O)N3CCCC3)n2)ccc1Cl 1704280434 FBJXXIRXOPRCSR-AWEZNQCLSA-N 390.871 2.526 0 50 GFAA OCCN1C[C@H]2CN(Cc3nc4ccccc4[nH]3)C[C@]2(CCc2ccccc2)C1 1772804949 FGNIRRQXFMYWGJ-RDPSFJRHSA-N 390.531 2.922 0 50 GFAA COc1ccc(CN2CCC(N3C[C@H](C)O[C@H](C)C3)CC2)c(OC)c1OC 12363248 XSGXJXLAXIQGNN-IYBDPMFKSA-N 378.513 2.786 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)NC(C)C)C3)C2=O)c1OC 14968729 VRLGLWWXLSOJST-OAQYLSRUSA-N 389.496 2.636 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCCCc3cccnc3)CCC2=O)cc1 15076144 MAIOBEIUHAQWDM-HXUWFJFHSA-N 395.503 2.620 0 50 GFAA CCC(=O)Nc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19913815 NMMHNTYRAXAOOM-UHFFFAOYSA-N 395.459 2.722 0 50 GFAA O=C(NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O)c1ccsc1 169775634 PJRKYZCYGOWZFM-UHFFFAOYSA-N 382.420 2.794 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)Cc4cccc(F)c4)CC3)nn2)n1 169777381 QTPRSJDACBYSMD-UHFFFAOYSA-N 398.442 2.826 0 50 GFAA COCC1(C(=O)N2CCC[C@@]3(CN(Cc4ccccc4)CC[C@H]3O)C2)CCC1 1857693157 KRCQEBHANFWLSP-NFBKMPQASA-N 386.536 2.679 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCCn4ccnc4)C3)nc2c1 1857698460 SKBRRAXJKNKTCC-INIZCTEOSA-N 397.479 2.846 0 50 GFAA Cc1nc(C[C@H]2CCCN(c3nc4ncccc4o3)C2)n(-c2ccncc2)n1 1857708259 YLHGQUBUJGFUHC-OAHLLOKOSA-N 375.436 2.966 0 50 GFAA O=C([C@H]1CCc2ncnn2C1)N1CCC(c2cc(Cc3ccccc3)[nH]n2)CC1 1857735558 RRIDZNGXQYJNSE-SFHVURJKSA-N 390.491 2.561 0 50 GFAA COC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2572681 RULINAWEYRMHHQ-SFHVURJKSA-N 383.400 2.932 0 50 GFAA in-vitro CCC(=O)N1CC[C@H](NC(=O)N(Cc2ccccc2)C[C@@H](O)c2ccccc2)C1 806972697 HMCQDHMZXRYDMW-LEWJYISDSA-N 395.503 2.943 0 50 GFAA COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](c1cccs1)C1(CO)CCC1)C2 855116480 HCOJKIUQIJKVAP-QBYUYEEZSA-N 392.521 2.935 0 50 GFAA CC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)Nc1ccc(NC(C)=O)cc1 2841213 UXUMNVCNJJPMJF-SFHVURJKSA-N 389.477 2.649 0 50 GFAA COc1cc(C(=O)N2CCc3cc(O)cc(Br)c3C2)ccc1CN 2325780307 XEOBIZWJLVUFEG-UHFFFAOYSA-N 391.265 2.821 0 50 GFAA COC(=O)C1=CN(C)C=C(C(=O)OC)C1c1ccc(F)c(Br)c1 1170893 KODQPZMBIYYUCG-UHFFFAOYSA-N 384.201 2.731 0 50 GFAA Cc1cc(C)n(NC(=O)[C@H](C)n2nc(C(F)(F)F)c(Cl)c2C)c(=O)c1 2786258 AGTCSWBFXINFPM-JTQLQIEISA-N 376.766 2.974 0 50 GFAA COc1ccc(S(=O)(=O)NCc2ccccn2)cc1NC(=O)c1ccccc1 4935298 QKEVNLSJLBHESE-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA Cc1nc(SCC(=O)Nc2ccc(Cl)cc2Cl)[nH]c(=O)c1CCO 11905731 LMXUUKHASRRXPO-UHFFFAOYSA-N 388.276 2.651 0 50 GFAA C[C@H](CCn1cccn1)NC(=O)c1cc(COc2ccc(F)cc2F)on1 12226977 WMOHHZDTARPRNL-GFCCVEGCSA-N 376.363 2.937 0 50 GFAA CC[C@H](C)[C@H](NC(=O)c1cc(COc2ccc(F)c(F)c2)on1)C(=O)OC 12228578 DLNGFQBUIXRRPJ-QFYYESIMSA-N 382.363 2.849 0 50 GFAA COC[C@@H]1CCN(c2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)C1 15064012 DTBJSHNNBOEDIF-LJQANCHMSA-N 397.523 2.693 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)NC23CC4CC(CC(C4)C2)C3)cc1 15066811 IVXPELKOYYRRQW-PQCJFMQRSA-N 395.547 2.771 0 50 GFAA Cc1cccc(CNC(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)c1 15077258 HTSYGHSQSJHRAE-FQEVSTJZSA-N 383.536 2.724 0 50 GFAA O=C(CSc1nc(=O)c2c(-c3ccccc3)csc2[nH]1)N1CCOCC1 16393281 RHQFMXUIKVEHFK-UHFFFAOYSA-N 387.486 2.603 0 50 GFAA COc1cc(C(=O)N2CCN(Cc3ccc(C)cc3)CC2)cc(OC)c1OC 19210251 CSYPADHIEKNFER-UHFFFAOYSA-N 384.476 2.979 0 50 GFAA CCN(CC)CCN(C)Cc1cc(I)c(O)c(OC)c1 19632604 MBLLBCYBGZULOK-UHFFFAOYSA-N 392.281 2.779 0 50 GFAA O=S(=O)(c1ccccc1)N1CCN(Cc2ccccc2Br)CC1 19787810 REMPLOCBXFPXPO-UHFFFAOYSA-N 395.322 2.956 0 50 GFAA CCNC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cccnc3NC)n2)C1 20535608 QAJASYVJIQXPIH-UHFFFAOYSA-N 393.451 2.631 0 50 GFAA COc1cc(CN2CCC[C@@H](N(C)CCCN(C)C)C2)cc(OC)c1OC 23374955 DQMPLFFARQDGPG-GOSISDBHSA-N 379.545 2.560 0 50 GFAA COc1cccc(CC(=O)N2CC[C@H]3[C@@H](CCCN3C(=O)c3ccco3)C2)c1 43641872 XQHKUWKCQPXBPN-HKUYNNGSSA-N 382.460 2.984 0 50 GFAA Cc1nc(NCCNC(=O)c2ccc3ccccc3c2)cc(N2CCOCC2)n1 65363170 BHSIKPGPKUXRDZ-UHFFFAOYSA-N 391.475 2.617 0 50 GFAA COc1ccccc1C(=O)N1CCN(c2nccc(CCC(F)(F)F)n2)CC1 71707911 CAFWPMWSYGKLFZ-UHFFFAOYSA-N 394.397 2.943 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(NC2CCN(C)CC2)nc1 71750268 WQQSQGFDYREPSU-UHFFFAOYSA-N 384.528 2.728 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)c4ccccc4Cl)CC3)ncn2)n1 72119282 ILYQLYWKRGREHN-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA Cc1noc(C)c1CC(=O)N[C@H]1CC[C@H](Nc2nccc(-c3ccccn3)n2)C1 72138797 HMJSYKDRYJGWHU-HOTGVXAUSA-N 392.463 2.835 0 50 GFAA CC(=O)NCC[C@H]1CCCCN1S(=O)(=O)c1ccc2nc(C)sc2c1 77537388 LXUMNMLCZFNBKF-CQSZACIVSA-N 381.523 2.674 0 50 GFAA Cc1nc(N(C)C)nc(N2CCC[C@@H](c3nccn3CCCN(C)C)C2)c1C 95500649 FFNYCUBDGZJXRC-GOSISDBHSA-N 385.560 2.692 0 50 GFAA CC(=O)N[C@@H]1CN(Cc2nccn2Cc2ccccc2)C[C@H]1c1ccc(C)o1 95502102 DJUGKKDLRGDVEV-WOJBJXKFSA-N 378.476 2.937 0 50 GFAA CN(C)C(=O)CCc1ccc(NC(=O)N(C)Cc2ccc3nonc3c2)cc1 97785625 COUCICHUHDYJGS-UHFFFAOYSA-N 381.436 2.908 0 50 GFAA CNC(=O)c1cccc(NC(=O)c2nnn(-c3ccc(Cl)cc3F)c2C)c1 152574805 SWOAOTRVURMPHO-UHFFFAOYSA-N 387.802 2.980 0 50 GFAA O=S1(=O)CC[C@@H](n2cc(CNc3ccccc3OC(F)(F)F)cn2)C1 170679455 LGDRISZMHATADM-GFCCVEGCSA-N 375.372 2.753 0 50 GFAA CC1(C)CN(CCNC(=O)N2CC[C@@H](Oc3ccccc3Cl)C2)CCO1 179253760 QCKKFMOCEATGNQ-OAHLLOKOSA-N 381.904 2.614 0 50 GFAA Cc1ccccc1SCC(=O)N1CCC(N2CCC[C@@H](C(=O)O)C2)CC1 219860147 BKZZDZSHIBQBNH-MRXNPFEDSA-N 376.522 2.875 0 50 GFAA C[C@H]1CN(C[C@H]2CCCN2C(=O)Nc2cncc(Br)c2)C[C@@H](C)O1 221982917 SJLGABRHPKOWJI-DVOMOZLQSA-N 397.317 2.950 0 50 GFAA O=C(c1cccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1)N1CCCCC1 239322006 JAYJDNGAUOGCSR-IPJCAIGPSA-N 376.456 2.870 0 50 GFAA O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)[C@@H]1CSc2ccccc2O1 252494016 NIJJEEIXGAIMFK-KXBFYZLASA-N 396.468 2.784 0 50 GFAA CC1=C[C@@H]2[C@@H]3C(=O)NC(=O)[C@@H]3[C@H](C(=O)c3cccs3)N2c2ccc(C)cc21 253387465 NJXWMPDQQFJXCZ-LAVFITLUSA-N 378.453 2.802 0 50 GFAA CCOCCCNC(=O)c1cn(C)nc1[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 253392640 RWIBCXAABRILPQ-OAHLLOKOSA-N 394.516 2.691 0 50 GFAA O=C(COc1ccc(Cl)c2ccccc12)NCC1(C(=O)O)CCOCC1 262656826 ACSWTABROUEERN-UHFFFAOYSA-N 377.824 2.870 0 50 GFAA CC(C)Oc1ccc(-c2nc(C(=O)N3CCO[C@H](CC(=O)O)C3)cs2)cc1 269037087 PAKAHVHUYSZRNP-OAHLLOKOSA-N 390.461 2.913 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)c3ccnc(NC(=O)C4CC4)c3)cn2)n1 285258269 SGGXFACEZMAYND-UHFFFAOYSA-N 376.420 2.880 0 50 GFAA Cc1cnccc1OC1CCN([C@H](C)C(=O)N2CC(=O)Nc3ccccc32)CC1 289355289 HWWPOGRTYKXTMF-MRXNPFEDSA-N 394.475 2.607 0 50 GFAA Cc1n[nH]c(C)c1NC(=O)CN1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1 292645062 JRYOJNZFBGDNDT-IYBDPMFKSA-N 391.516 2.544 0 50 GFAA C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)CC[S@@]1=O 297345415 SSOLJNUPEXOXAZ-XGZNKIABSA-N 383.945 2.861 0 50 GFAA O=C(Nc1nc2c(s1)C(=O)C[C@H](C(=O)N1CCCCCC1)C2)c1ccncc1 299790435 BBCSMNHSGXQWIB-CQSZACIVSA-N 398.488 2.938 0 50 GFAA c1ccc(-c2nnc(N3CCN(c4ncnc5ccsc45)CC3)s2)nc1 302108193 AXHLISUNTFCHII-UHFFFAOYSA-N 381.490 2.931 0 50 GFAA Cc1nn(C)c(C)c1C[C@H](C)NC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1 363128468 QTHQYFHSRPYXFR-YWZLYKJASA-N 382.508 2.779 0 50 GFAA COC(=O)c1cccc(OCCN2CCC3(CC2)C[C@H]3C(=O)N2CCCC2)c1 374479857 HUWBVKKZEDJBAJ-IBGZPJMESA-N 386.492 2.577 0 50 GFAA CNC(=O)COc1ccccc1-c1ccc(C(=O)N2CCCO[C@@H](C)C2)cc1 426544524 VQCLRPSYHIKBTK-INIZCTEOSA-N 382.460 2.729 0 50 GFAA COc1cc2nc(N3CCC(Oc4ncccc4F)CC3)nc(N)c2cc1OC 447689784 SXZIAWDIVNVRMS-UHFFFAOYSA-N 399.426 2.811 0 50 GFAA O=C1Cc2cc(S(=O)(=O)Nc3cc(-c4ccccc4)[nH]n3)cc3c2N1CCC3 462381895 SMPZFGNBNDQSIJ-UHFFFAOYSA-N 394.456 2.713 0 50 GFAA CCC(=O)Nc1ccc(C)c(NC(=O)c2cnn(-c3ccc(O)nn3)c2C)c1 481918782 JNYQSVWLNNPPGM-UHFFFAOYSA-N 380.408 2.586 0 50 GFAA Cc1ccc2nc(CNC(=O)CCCc3nc(-c4ccncc4)no3)[nH]c2c1 828031962 ATWHDWVHVAJNJF-UHFFFAOYSA-N 376.420 2.955 0 50 GFAA COc1ccc(-c2ccnc(C3CCN(C[C@@H](O)CN(C)C4CC4)CC3)n2)cc1 952892564 OQBARBIFFKTGIE-FQEVSTJZSA-N 396.535 2.787 0 50 GFAA CCCC(=O)c1cn(CC(=O)N2C[C@@H]3CCCN3C(=O)[C@@H]2C)c2ccccc12 1772709271 JDHAESULEVQKKU-HOTGVXAUSA-N 381.476 2.846 0 50 GFAA O=C(c1cc(N2CCOCC2)no1)N1CCC[C@H](COc2ccccc2F)C1 1772804929 FDAUBOAICYAAQL-HNNXBMFYSA-N 389.427 2.582 0 50 GFAA COc1ccc2cc(-c3nccn3CC(C)(C)N3CCN(C)CC3)c(O)nc2c1 1857681935 QNVDPRGNHNSGIV-UHFFFAOYSA-N 395.507 2.839 0 50 GFAA COCCn1cncc1Cn1ccnc1-c1cc2ccc(OC)cc2nc1O 1857703205 MTQMYDMIWAVUKA-UHFFFAOYSA-N 379.420 2.704 0 50 GFAA Cn1cc([C@H]2[C@H](CN3CCCCC3)OCCN2C(=O)c2cccc(F)c2)cn1 1857716516 BXPUGIQAXRQOIE-PMACEKPBSA-N 386.471 2.627 0 50 GFAA Cc1c(O)ccc2c(Cn3c(Cc4ccc(F)cc4)noc3=O)cc(=O)oc12 1875391579 DOJGCNWDVSVYAA-UHFFFAOYSA-N 382.347 2.735 0 50 GFAA Cc1cc(C(F)(F)F)nc(C(=O)N2CCC[C@]23CCC[S@@](=N)(=O)C3)n1 1875396230 ZMXDZFUHWPTZQP-DLUDVSRJSA-N 376.404 2.619 0 50 GFAA Cc1nnc(CN2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)s1 2100477909 JAMYUEXERLOUQP-QFBILLFUSA-N 375.494 2.507 0 50 GFAA Cn1nc([C@@H]2CCCN2)cc1C(=O)Nc1cnc(Cc2ccc(F)cc2)nc1 2325799451 ZNGCVNKJGWJEFU-INIZCTEOSA-N 380.427 2.617 0 50 GFAA OCC[C@@H](NCc1cccc(-c2nn[nH]n2)c1)c1ccc(Br)cc1 2325829681 PQDVLOYORRREHL-MRXNPFEDSA-N 388.269 2.843 0 50 GFAA NCc1ccc2c(c1)CC[C@H]2NC(=O)c1ccn2ncc(Br)c2c1 2325856924 ILHVADYLBCFBKZ-MRXNPFEDSA-N 385.265 2.973 0 50 GFAA C[C@@H](O)c1cn(-c2ccc(CNC(=O)c3n[nH]cc3-c3ccccc3)cc2)nn1 2325869528 RTTNOKTWHFIQDQ-CQSZACIVSA-N 388.431 2.641 0 50 GFAA O=C(O)c1ccc(S(=O)(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cc1 904083 BYSQXYQCIQKQSU-AWEZNQCLSA-N 381.475 2.816 0 50 GFAA CCOC(=O)c1ccc(NC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1 1203390 LXLWSCRKGNASLU-UHFFFAOYSA-N 390.461 2.576 0 50 GFAA Cc1ccccc1-n1ncc([C@@H](C)NC(=O)c2ccc3c(c2)no[n+]3[O-])c1C 11816988 HJAKAVYZWSMLDT-CYBMUJFWSA-N 377.404 2.755 0 50 GFAA COCc1ccc(C(=O)NCc2nnc(SC)n2-c2ccc(F)cc2)o1 12157431 WIDYECJPPOJJBL-UHFFFAOYSA-N 376.413 2.798 0 50 GFAA COCCN(C(=O)c1ccc(OC2CCN(C(C)=O)CC2)c(OC)c1)C(C)C 12228301 VLCUFWAYIZXDOO-UHFFFAOYSA-N 392.496 2.582 0 50 GFAA CCn1nc(C)c(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)c1C 12474545 ATBMLPRFENIMAH-QGZVFWFLSA-N 386.471 2.714 0 50 GFAA O=C(NCc1cccnc1N1CCN(c2ccccn2)CC1)[C@@H]1CC=CCC1 12717259 RRZPVSRSCVYURK-GOSISDBHSA-N 377.492 2.776 0 50 GFAA COC(=O)CCCNC(=O)c1cc(COc2cccc(C(F)(F)F)c2)on1 15065467 YSFQZENNGCDMMH-UHFFFAOYSA-N 386.326 2.955 0 50 GFAA Cc1cccc(CN2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)c1 15066654 BKGAKOYAZSXPKV-DHIUTWEWSA-N 383.511 2.892 0 50 GFAA COc1cccc(OCc2nc(C(=O)NCc3ccc4c(c3)OCO4)co2)c1 15077987 DNYAUYPPEVLADZ-UHFFFAOYSA-N 382.372 2.921 0 50 GFAA Cc1ccc(NC(=O)[C@H]2CC(=O)NC(Nc3nc4ccccc4s3)=N2)cc1 17028428 DQPCZSXYKYYNGR-CQSZACIVSA-N 379.445 2.900 0 50 GFAA CC(C)CS(=O)(=O)c1ncc(CN(C)[C@H]2CCOC2)n1Cc1ccccc1 20208390 YSALJNSJELJZHG-SFHVURJKSA-N 391.537 2.582 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H]3CCCN(c4ccccn4)C3)n1)CCNC2 20534750 YVYIYKOQYQMPEM-OAHLLOKOSA-N 376.464 2.865 0 50 GFAA CC(C)N(C[C@@H]1COc2ccccc2O1)C(=O)c1cccc(NCC(=O)O)c1 55227177 WAWHUBWJTCMGNQ-QGZVFWFLSA-N 384.432 2.874 0 50 GFAA COc1cccc([C@H]2CNC(=O)c3nc(CCn4nccc4C4CC4)[nH]c3C2)c1 65372953 ANFFBACBLAWVKX-MRXNPFEDSA-N 391.475 2.805 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 65411711 HSTPZONBAXXQTK-SFHVURJKSA-N 384.480 2.788 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCC[C@@H](c3n[nH]c(=O)n3-c3ccccc3)C2)c1 67896232 YCIKCYRSIBAYBL-OAHLLOKOSA-N 378.432 2.594 0 50 GFAA CC(C)(C)NC(=O)CN1CCC(CNC(=O)c2cc(F)cc(Cl)c2)CC1 68151606 JOCLITFYIMJMNK-UHFFFAOYSA-N 383.895 2.836 0 50 GFAA in-vitro CN(Cc1cc(C2CC2)on1)Cc1cc2n(n1)CCN(C(=O)c1ccco1)C2 72463109 KWYUWLNNSLSAJW-UHFFFAOYSA-N 381.436 2.630 0 50 GFAA Cc1cnn([C@H](C)C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)c1 82126153 YXLJOUKWSAATCQ-QGZVFWFLSA-N 384.528 2.804 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)cc1 91321777 FNKSQRSQOBKMNY-QFIPXVFZSA-N 380.492 2.806 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC(OCc3cccnc3)CC2)c2cc(F)ccc2N1 92045797 BRQFYAKMSFODEK-GOSISDBHSA-N 383.423 2.854 0 50 GFAA O=C(C1CCN(Cc2ccco2)CC1)N1CCCN(Cc2ccncc2)CC1 95360253 URSYLTKKFKULRJ-UHFFFAOYSA-N 382.508 2.621 0 50 GFAA CCCc1nc(C(=O)N2CCC3(CC2)CC(=O)N(CCCOC)C3)cs1 95383819 VSUKVDGTJIJYDQ-UHFFFAOYSA-N 379.526 2.587 0 50 GFAA CSC[C@H]1CCCN(C(=O)Nc2cc(S(N)(=O)=O)ccc2Cl)C1 95498940 FBVFHRQKRGVMRZ-JTQLQIEISA-N 377.919 2.594 0 50 GFAA CCNc1ncc(CN2CCC3(CC2)c2[nH]cnc2CCN3CC(C)C)cn1 95504888 HDNZYMZMIWPRGL-UHFFFAOYSA-N 383.544 2.637 0 50 GFAA COc1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc3ccnn3c2C)cc1 97527918 CYRGOXURRMNMPS-GOSISDBHSA-N 380.448 2.868 0 50 GFAA O=C(Nc1ccccc1Oc1cccc(F)c1)C(=O)N[C@H]1CCc2[nH]ncc2C1 167576585 XYHPCPNWGKSAAK-HNNXBMFYSA-N 394.406 2.953 0 50 GFAA CN(C[C@H]1Cc2ccccc2CN1C)C(=O)CCc1nc(-c2ccco2)no1 218886799 YCYLLLSCDNIIDU-QGZVFWFLSA-N 380.448 2.777 0 50 GFAA COc1ccc(C(=O)Nc2cc(-n3cnnn3)ccc2C)c(OC(F)F)c1 241588094 OZNVULVINCPSIA-UHFFFAOYSA-N 375.335 2.833 0 50 GFAA COc1ccc(NC(=O)Cn2c(C)ccc2C)cc1N1CCCCS1(=O)=O 253412306 QOOSQPPSHHOBPG-UHFFFAOYSA-N 391.493 2.682 0 50 GFAA CC[C@H](Cc1ccccc1Br)C(=O)N1CCO[C@H](CC(=O)O)C1 271920581 UTPWMNXUGZXPQE-TZMCWYRMSA-N 384.270 2.720 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C[C@@H]21 284157171 QRGPMMVJCMCWCJ-DLBZAZTESA-N 395.290 2.724 0 50 GFAA Cn1cncc1CNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 291247391 OSHFINYKSQITLI-HNNXBMFYSA-N 381.263 2.648 0 50 GFAA Cc1ncsc1CCS(=O)(=O)N1CCC[C@@H](c2ncc3n2CCCC3)C1 295820729 CEMXUBADNORHRR-OAHLLOKOSA-N 394.566 2.736 0 50 GFAA C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)c1ccc(S(C)(=O)=O)cc1 363347790 BCQOJPOSLOEJFS-KRWDZBQOSA-N 386.517 2.827 0 50 GFAA O=C(C[C@H]1CN(Cc2ccccc2)CCO1)N1CC[C@@H](Cc2ccncc2)C1 363703826 VFASTZSAPBJROH-VXKWHMMOSA-N 379.504 2.764 0 50 GFAA CCOCCC1(C(=O)N2CCC[C@H](N(C)Cc3noc(C)n3)CC2)CCC1 369586128 MYNXRJJDXWPBGN-KRWDZBQOSA-N 378.517 2.788 0 50 GFAA Cc1n[nH]cc1C1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)CC1 375965958 UQPKXWSCSASTNV-AWEZNQCLSA-N 388.418 2.755 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC[C@@H]4CCCNC4)csc3C2)nc1 426373548 AAESTIMHCJBDPT-QGZVFWFLSA-N 398.576 2.993 0 50 GFAA Cc1nn(C)c(C)c1CN(C(=O)NCc1cc(-c2cccnc2)no1)C1CC1 426419744 JZWJCNAXNXELLV-UHFFFAOYSA-N 380.452 2.961 0 50 GFAA CN1C(=O)CC[C@@H]1C(=O)N1CC(C)(C)[C@H]1C1CCN(Cc2ccccc2)CC1 452451655 MGHZHUUPJKOLPG-TZIWHRDSSA-N 383.536 2.756 0 50 GFAA C[C@H](C(=O)N1CCC(N2CCN(Cc3ccccc3)CC2)CC1)n1cccc1 584884757 CTPMRMYFPRQGOH-HXUWFJFHSA-N 380.536 2.858 0 50 GFAA COc1ccccc1CN(C(=O)NC[C@@H](C)N1CCOCC1)C1CCCC1 584889456 VIKZDQWUUPNQIH-QGZVFWFLSA-N 375.513 2.870 0 50 GFAA CN(C(=O)NCCCSc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 584901940 DFQKVINBJVGLGO-CYBMUJFWSA-N 376.931 2.651 0 50 GFAA CCN1CCN(c2ccc(NC(=O)Nc3cnc4ccnn4c3)c(C)c2)CC1 823116952 CBDUMYJUHMPJCK-UHFFFAOYSA-N 379.468 2.824 0 50 GFAA CCCc1c(C(=O)N2CC(Cc3cnn(C)c3)C2)nnn1-c1cccc(Cl)c1 899012935 OHNMCUOJZMRJSI-UHFFFAOYSA-N 398.898 2.921 0 50 GFAA O=C(O)C1CCN(S(=O)(=O)N2CCCC[C@H]2CCc2cccs2)CC1 1506400812 YEUHAZBGCKIYCJ-HNNXBMFYSA-N 386.539 2.577 0 50 GFAA CCCc1nc(C)cc(N2C[C@H]3c4cccc(OC)c4OC[C@@]3(C(=O)O)C2)n1 1565508580 BKQQGQSNKNLVAL-BTYIYWSLSA-N 383.448 2.813 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)NCCc3ccccc3)C1)CC2 1704316336 MSORHRHVQMTNRC-JOCHJYFZSA-N 379.508 2.775 0 50 GFAA Cc1ncc(C(=O)N[C@H]2CCC[C@@H](CNC(=O)CCCOc3ccccc3)C2)[nH]1 1857683054 AGIOIZHOEIQFKP-MSOLQXFVSA-N 398.507 2.982 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@@]1(CCCN(C(=O)Cc3cccnc3)C1)CC2 1857683562 JOCGHGCBBZQBAW-QFIPXVFZSA-N 380.492 2.924 0 50 GFAA CN(C)C[C@@H]1OCCN(Cc2ccc(-c3ccccn3)cc2)[C@H]1c1cnn(C)c1 1857693505 ZTJJXSVZHINBFE-GOTSBHOMSA-N 391.519 2.986 0 50 GFAA O=C(C1CC=CC1)N1CCC[C@]2(C1)CN(c1ncccc1Cl)CC[C@H]2O 1857707300 MOHZNIBERABJCA-YLJYHZDGSA-N 375.900 2.881 0 50 GFAA N=c1nc(O)c2c([nH]1)C1(CC2)CCN(C(=O)c2scc3c2CCCC3)CC1 1857722531 XKPHWJDVHMKQIR-UHFFFAOYSA-N 384.505 2.655 0 50 GFAA CCn1ccc(C(=O)N2CC[C@](C)(NC(=O)c3cccc(N4CCCC4)c3)C2)n1 1875310136 GARHFPXRTWQONR-QFIPXVFZSA-N 395.507 2.538 0 50 GFAA Cc1ccc(C)c(CN[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c1 1875397391 YIEIZEMKEWZUHN-LJQANCHMSA-N 381.524 2.781 0 50 GFAA C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCc2ccccc2C1 810305 AHKQYLPZQYLCCC-ZDUSSCGKSA-N 378.881 2.592 0 50 GFAA O=C(Nc1ccccc1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)c1ccco1 1211408 ZGYADKBYZJTQPG-KRWDZBQOSA-N 394.383 2.663 0 50 GFAA biogenic CC(C)(CNC(=O)C(Cl)(Cl)Cl)CNC(=O)C(Cl)(Cl)Cl 2100317 SVSDLUAFGLOLIS-UHFFFAOYSA-N 392.925 2.985 0 50 GFAA CC(C)c1ccc(CN2CC[C@@H](N3CCN(c4ccccn4)CC3)[C@H](O)C2)cc1 11873658 NZKQYVLLSCMYSS-DHIUTWEWSA-N 394.563 2.962 0 50 GFAA COc1ccc(C(C)C)cc1S(=O)(=O)N1CCN(C(=O)c2ccco2)CC1 12382902 XZDUWGLXRFRJKN-UHFFFAOYSA-N 392.477 2.558 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)c3cccs3)C2)cc1 12592641 IXLUYJIRMALTHB-AWEZNQCLSA-N 394.518 2.587 0 50 GFAA O=C(CCC1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1)NC1CC1 15068374 SXRNJHPTPCFVCN-UHFFFAOYSA-N 376.931 2.861 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(C(=O)c2cnc3sccn3c2=O)CC1 15724724 WHQKDTMPYZOGDB-UHFFFAOYSA-N 388.880 2.680 0 50 GFAA COc1ccc(OC)c([C@H]2CCN(c3ncc(C)c(-c4ncnn4C)n3)C2)c1 20206269 LIKVSLVRYRPWGU-AWEZNQCLSA-N 380.452 2.592 0 50 GFAA Cc1cnc(N2CCN(c3nc4ccccc4o3)CC2)nc1-c1ccnn1C 20543057 UJGJFVVBZAUTSJ-UHFFFAOYSA-N 375.436 2.653 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(F)cc2)CN1Cc1ccc(C)s1 39356513 CWKIHBQGSVEWSU-WBVHZDCISA-N 376.453 2.742 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)Nc2cccc(NC(=O)c3cccnc3)c2)CC1 49676119 DPZRZMTYISAVBV-UHFFFAOYSA-N 395.463 2.666 0 50 GFAA CCc1ncc(CN[C@H]2CC(=O)N(Cc3ccccc3C(F)(F)F)C2)cn1 59436850 MXCFLZNTTOJELZ-HNNXBMFYSA-N 378.398 2.949 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCc3ccsc3)C2=O)c1 67472665 OWWPGILGJJFSBL-IBGZPJMESA-N 378.469 2.539 0 50 GFAA O=C(c1cccc2ccccc12)N1CCN(c2cc(-n3cccn3)ncn2)CC1 67613812 RQFMUXGTTSFHHI-UHFFFAOYSA-N 384.443 2.778 0 50 GFAA COCCNS(=O)(=O)c1cc(C(=O)O)cc(-c2cccc3ncccc23)c1 71753546 CWEYGKBZNKVELU-UHFFFAOYSA-N 386.429 2.525 0 50 GFAA Cc1cc(C)c2nccc(N3CCN(C4CCN(C)CC4)[C@H](CCO)C3)c2c1 72463276 MAHUNNGYNADBDL-HXUWFJFHSA-N 382.552 2.819 0 50 GFAA CC(C)c1ccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)N3CCSCC3)[C@H]4C2=O)cc1 77301463 VNMCLCOYUKYELV-OZIGNCPNSA-N 398.528 2.672 0 50 GFAA CCc1ccccc1C(=O)NCc1cc2n(n1)CCCN(C(=O)C1CCC1)C2 82137212 JTZHLUKMBVUIRC-UHFFFAOYSA-N 380.492 2.908 0 50 GFAA O=C1CCC2(CCN(C(=O)[C@H](O)c3ccccc3)CC2)CN1Cc1ccccn1 92004196 UXNVKCDPWTYOES-OAQYLSRUSA-N 393.487 2.546 0 50 GFAA Cc1cccc(OCC(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)O)C2)c1 95366471 JXWOBDQGNUBLJF-HTAPYJJXSA-N 381.428 2.538 0 50 GFAA O=C(CN1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccc1)C2)NCc1ccccc1 95378288 GPTLFXHCSMRIET-TZIWHRDSSA-N 377.488 2.539 0 50 GFAA CCn1c(CN2CCCC2)nnc1C1CCN(C(=O)c2cccc(O)c2)CC1 96139477 CAUFLXXATAACMZ-UHFFFAOYSA-N 383.496 2.619 0 50 GFAA CCN(C(=O)Nc1ccc(Oc2ccccc2)nc1)[C@@H]1CCS(=O)(=O)C1 96165458 HEXQEGIDDNDZDF-OAHLLOKOSA-N 375.450 2.915 0 50 GFAA CC(C)c1nnsc1CN1CCN(Cc2ccc(F)cc2)[C@@H](CCO)C1 106976061 JJIGCRDSKKNKGZ-KRWDZBQOSA-N 378.517 2.869 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCO[C@H](c2nccs2)C1)c1c(F)cccc1F 110883357 WCSAWRGXZAMTJR-CABCVRRESA-N 395.431 2.589 0 50 GFAA C[C@](O)(CNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(F)cc1 131044489 WZAFTGQCPCSTHK-MBSDFSHPSA-N 398.478 2.631 0 50 GFAA COC(=O)c1ccc(-c2nc(CN3CCO[C@H]([C@@H]4CCCO4)C3)cs2)cc1 152289782 UKHFRUPNCNPJJH-ROUUACIJSA-N 388.489 2.977 0 50 GFAA C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)Cc3ccccc3)cc2)[C@H]1CN 156813796 HMBYRNYOSSYKBC-JXFKEZNVSA-N 386.517 2.860 0 50 GFAA O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1CC(O)(c2ccc(F)cc2)C1 170083932 SYSFGISMNSMHFV-UHFFFAOYSA-N 393.333 2.876 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@@H](C)Oc4ccc(C)cc43)ccc21 177596283 ROTXVRWMEBTCIC-CQSZACIVSA-N 386.473 2.880 0 50 GFAA CCS(=O)(=O)c1cc(F)ccc1NC(=O)N1CCC[C@@H](n2cc(C)cn2)C1 184279111 GVKUQJXRRLPTMG-OAHLLOKOSA-N 394.472 2.993 0 50 GFAA CC[C@@H](O)c1cc2n(n1)CCCN(Cc1cnn(-c3ccccc3OC)c1)C2 220222069 LXGYAIDFOYJNHG-HXUWFJFHSA-N 381.480 2.927 0 50 GFAA O=C(CCc1ccccc1)N1CCN(c2nccn3nc4c(c23)CCCC4)CC1 263618337 SLDIYNMYFPKLJT-UHFFFAOYSA-N 389.503 2.890 0 50 GFAA CN(Cc1ccon1)C(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 265869753 VCVGMXVMRJXZTR-CQSZACIVSA-N 398.341 2.520 0 50 GFAA O=C(NCCNC(=O)c1ccc(Cl)cc1)NC1CCN(C2CCCC2)CC1 267352113 RIEQSJQZVFYRTL-UHFFFAOYSA-N 392.931 2.776 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)CCO1 299749069 JCLFXQKIXNXNRS-CQSZACIVSA-N 396.321 2.818 0 50 GFAA Cc1cc2c(N3CCN(CC(=O)N4C[C@@H](C)C[C@@H](C)C4)CC3)ncnc2s1 301868687 ISTXWTYFFUGHTP-GASCZTMLSA-N 387.553 2.626 0 50 GFAA COCCc1cc(NC(=O)[C@@]23CCC[C@@H]2CN(Cc2ccccc2)C3)n(C)n1 328608570 ZRDCKTRKJDCMSK-XMSQKQJNSA-N 382.508 2.850 0 50 GFAA CC(C)[C@H](C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)N1CCCC1=O 363375188 QDNCUINBEVQTSK-HXUWFJFHSA-N 375.488 2.553 0 50 GFAA O=C1COc2cc(NC(=O)[C@@H]3[C@H](C(F)(F)F)[C@H]4CC[C@H]3O4)c(Cl)cc2N1 369036825 RCIIRGCZVXCFMY-XYHOJCAOSA-N 390.745 2.965 0 50 GFAA Cc1c(C(=O)N2CCC(Oc3cnccn3)CC2)cnn1-c1ccccc1F 373304866 DGHNOWPHFZQUFE-UHFFFAOYSA-N 381.411 2.793 0 50 GFAA CCS(=O)(=O)c1ccc(-c2cccc(C(=O)N3CCNC[C@@H]3C)c2)s1 426443044 RXLDNQPHLKQIOO-ZDUSSCGKSA-N 378.519 2.643 0 50 GFAA Cc1ccc2nc([C@H](C)NC(=O)N3CCN(Cc4ccccn4)CC3)[nH]c2c1 426618036 AJMCPIIJKABGFG-INIZCTEOSA-N 378.480 2.855 0 50 GFAA Cc1cnc(CNC(=O)c2cccc(-c3cc(OC(C)C)nc(N)n3)c2)cn1 534637802 JULBAQFTMKALKX-UHFFFAOYSA-N 378.436 2.541 0 50 GFAA O=C(N[C@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3)c1ccc2ncccc2c1 670450643 XYMQRRCPRXFXBT-KOXWRSSLSA-N 398.510 2.532 0 50 GFAA COC(=O)/C=C/c1ccc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)o1 821416177 XFKPCJPCMUDJAI-SOGBHIHOSA-N 384.388 2.836 0 50 GFAA Cn1c(=O)c(C(=O)N[C@H]2CCCN(Cc3cccc(O)c3)C2)cc2ccccc21 828924910 FEPYGDUJBRLTOK-SFHVURJKSA-N 391.471 2.639 0 50 GFAA CCc1nc2cc(NC(=O)c3cn([C@H]4CC[C@@H](N)CC4)nn3)ccc2n1CC 952968302 BOQFATXGBUUMIP-OTVXOJSOSA-N 381.484 2.905 0 50 GFAA O=C1C[C@@H](C(=O)N2CCN(c3nsc4ccccc34)CC2)C2(CCCC2)O1 952981834 KRHMJXPRDVXOPZ-HNNXBMFYSA-N 385.489 2.821 0 50 GFAA CN(C)CCN(Cc1c(-c2ccccc2)nc2ncccn12)C[C@H]1CCCO1 952989010 GLHSNHBCKOBZEH-LJQANCHMSA-N 379.508 2.939 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC([C@@H](O)c3ccccn3)CC2)cc1Cl 1506400736 WQWZGJKHYISITF-GOSISDBHSA-N 396.896 2.878 0 50 GFAA O=C(c1ccccn1)[C@@H]1CCCN(C(=O)c2csc(-c3ncccn3)n2)C1 1506417541 NLPDBZCXPSUDDN-CYBMUJFWSA-N 379.445 2.730 0 50 GFAA O[C@@H]1CCCN(c2ccnc(N3CCC4(CC3)OCCc3ccsc34)n2)C1 1704308755 JKNVBGHGUSPTGB-MRXNPFEDSA-N 386.521 2.568 0 50 GFAA CC(=O)NCCC(=O)N[C@@H]1CCCC12CCN(C(=O)/C=C/c1ccccc1)CC2 1857668302 DGACRHMTUIUHTJ-SQUSKLHYSA-N 397.519 2.504 0 50 GFAA CC(C)Cn1cncc1CNC(=O)C[C@@H]1CCCN(c2nc3ncccc3o2)C1 1857695387 HWDIZLKOAYYGDY-INIZCTEOSA-N 396.495 2.998 0 50 GFAA COc1cccc(OC)c1CN1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857729675 HBIKJRBALZFTOB-XPNTWCBSSA-N 394.471 2.978 0 50 GFAA O=C(O)C[C@H](NC(=O)C[C@H]1CCN(CC(F)(F)F)C1)c1ccc(F)cc1F 1875304806 VRYOIEUIMDPDCR-YGRLFVJLSA-N 394.340 2.871 0 50 GFAA C[C@H](O)C[C@H](NC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)C(=O)O 1875313905 XJTOVGNOFFREGG-GWCFXTLKSA-N 380.441 2.567 0 50 GFAA CN(C)C(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)c1cccc(C(F)F)c1)C2 1875394386 HKMQBBPFDISVAU-BFHYXJOUSA-N 375.375 2.942 0 50 GFAA Cc1ccccc1-c1ccccc1CNC[C@H]1C[C@@H](O)CN1c1cc(N)ncn1 1875397775 NLXAPVGAPJUUIA-RTBURBONSA-N 389.503 2.764 0 50 GFAA c1ccc2c(c1)N=C(N1CCN(C[C@H]3COCCO3)CC1)c1ccccc1O2 2325760110 WHFUFUIBTMBZTI-KRWDZBQOSA-N 379.460 2.904 0 50 GFAA CC(C)(C)c1ncc(CNC(=O)c2cc3cc(Br)cn3c(O)n2)[nH]1 2325813085 JZHYLQZKTLNLHA-UHFFFAOYSA-N 392.257 2.753 0 50 GFAA CN1CCN(C(=O)NCc2ccc3cn(C)nc3c2)C[C@@H]1Cc1ccccc1 2325857284 WBGRHCWXMVOHPO-FQEVSTJZSA-N 377.492 2.642 0 50 GFAA COC(=O)C1(CNC(=O)c2cc3c(Br)ccnc3[nH]2)CCCC1 2325864931 FZCLWCAWIHDTIC-UHFFFAOYSA-N 380.242 2.789 0 50 GFAA COC(=O)c1cc(OC)cc(C(=O)N2CCC[C@]3(CCc4cnc(C)nc43)C2)c1 2356154740 HYVCUBIUMABJMW-QFIPXVFZSA-N 395.459 2.700 0 50 GFAA Cn1cncc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1[C@H]2Cc1ccccc1 2356157410 JUMVFXBYDFZRIK-HBFSDRIKSA-N 388.471 2.625 0 50 GFAA O=C(O)c1c(N2CCC(N3CCOCC3)CC2)noc1-c1ccc(Cl)cc1 2356159133 NHNCZFRUTYZITE-UHFFFAOYSA-N 391.855 2.994 0 50 GFAA CC1=C(C(=O)OCc2ccc3c(c2)OCO3)[C@@H](c2ccccc2F)NC(=O)N1 706468 PMZDQUMBHKRUPR-GOSISDBHSA-N 384.363 2.926 0 50 GFAA CCOC(=O)N1CCN(S(=O)(=O)c2ccc(OCC)c3ccccc23)CC1 1073013 UGBDKDBCNPSRKB-UHFFFAOYSA-N 392.477 2.701 0 50 GFAA CCOC(=O)c1sc(NC(=O)c2cc(OC)cc(OC)c2)c(C(N)=O)c1C 1199807 HXVHGBAIKYPNSS-UHFFFAOYSA-N 392.433 2.602 0 50 GFAA Cc1ccc(-c2nnc(-c3cccc(S(=O)(=O)N4CCOCC4)c3)o2)cc1 4402330 ZRSVZSURALARNX-UHFFFAOYSA-N 385.445 2.733 0 50 GFAA CCOC(=O)N1CCN(C(=O)C2CCN(Cc3ccc(Cl)cc3)CC2)CC1 4603658 XRAYVOQINXYDKU-UHFFFAOYSA-N 393.915 2.853 0 50 GFAA Cc1nnc(NC(=O)CSc2nnc(-c3ccncc3)n2CC(C)C)s1 9304467 GMMMXFYEXICNTI-UHFFFAOYSA-N 389.510 2.887 0 50 GFAA CN1CCC[C@H](COc2cccc(CN(C(=O)Cn3ccnc3)C3CC3)c2)C1 11785112 XLZVKXBKGNOHAP-IBGZPJMESA-N 382.508 2.795 0 50 GFAA Cc1ccc2c(c1)CN(CCNC(=O)[C@@H]1COc3ccccc3C1)C[C@H](C)O2 11964064 LMDATTPZGPLQJT-PXNSSMCTSA-N 380.488 2.945 0 50 GFAA O=C(NC[C@@H]1CCC2(CCN(Cc3ccccc3F)CC2)O1)[C@H]1CCCO1 11966096 VLRDVESDIFMCFM-PKOBYXMFSA-N 376.472 2.635 0 50 GFAA C[C@@H](NC(=O)c1cc(N2C(=O)CCS2(=O)=O)ccc1Cl)c1ccccc1 12003402 SBSNPNPYLKGMGI-GFCCVEGCSA-N 392.864 2.898 0 50 GFAA CN(C(=O)c1ccc(OC2CCN(Cc3ccccn3)CC2)cc1)[C@@H]1CCOC1 12200442 VKTPBYRGLDDGJN-HXUWFJFHSA-N 395.503 2.986 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CN1CCC[C@@H](O)C1 12446513 LLDVQTJVLMRIDZ-GOSISDBHSA-N 378.476 2.563 0 50 GFAA COc1ccc(CCc2nnc(CCC(=O)NCCc3ncccc3C)o2)cc1 12448539 MHGCOVCPUZTDSR-UHFFFAOYSA-N 394.475 2.858 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCCc1ccc(OC)cc1)C2 14752813 WILRWBHHKOLEJZ-SFHVURJKSA-N 396.535 2.837 0 50 GFAA O=C(CCc1ccco1)N1CCC[C@H](CNS(=O)(=O)Cc2ccccc2)C1 14949171 XYMURVNORNWZIS-GOSISDBHSA-N 390.505 2.570 0 50 GFAA Cc1nc(CNC[C@]2(O)CCCN(Cc3ccccc3F)C2=O)sc1C 20202708 NPFISTPKZMISNT-LJQANCHMSA-N 377.485 2.542 0 50 GFAA CCc1oc(C(=O)NCc2n[nH]c(=O)c3ccccc23)cc1CN(CC)CC 55042027 WRNNVCATCIIPHX-UHFFFAOYSA-N 382.464 2.850 0 50 GFAA CC(=O)N1CCn2nc(C(=O)N(Cc3ccc4[nH]ccc4c3)C3CC3)cc2C1 67694556 YCHRUYCSBXSGEC-UHFFFAOYSA-N 377.448 2.531 0 50 GFAA CNC1CCN(c2ccc(C(=O)NCCCc3ccc(OC)cc3)cn2)CC1 67819050 MAVNIKOQIDUPMG-UHFFFAOYSA-N 382.508 2.641 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc(C)cc(F)c3)CC2)C1 67854894 DGEVNJXOGOVICY-IBGZPJMESA-N 391.531 2.573 0 50 GFAA O=C(c1ccc(N2CCO[C@H](c3ccc(Cl)cc3)C2)nc1)N1CCOCC1 71748461 LXFLXUZLZGQKQG-SFHVURJKSA-N 387.867 2.785 0 50 GFAA CCCc1cc(C(=O)N[C@H]2CC[C@H](Nc3nccc(-c4ccncc4)n3)C2)[nH]n1 72162868 FTXIKYJHERIFOY-HOTGVXAUSA-N 391.479 2.977 0 50 GFAA O=C(CSCC1CC1)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 92065024 KFLCPTQESDUMRH-UHFFFAOYSA-N 387.549 2.956 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)c1cc(CC(C)C)no1)CC2 96135987 HSFBSRAXKWVGIY-UHFFFAOYSA-N 385.512 2.996 0 50 GFAA CNC(=O)c1ccc(Cl)c(NC(=O)N(C)Cc2noc(CC(C)C)n2)c1 96152095 IDCZEAQYGFYNDR-UHFFFAOYSA-N 379.848 2.945 0 50 GFAA O=S(=O)(N1CCCCCC1)N1CCc2[nH]c(-c3cccc(F)c3)nc2C1 97514178 NHJAHYILLPTNRL-UHFFFAOYSA-N 378.473 2.695 0 50 GFAA CCn1ccc(C(=O)N2CCCN(c3cc(-c4ccc(OC)cc4)n[nH]3)CC2)n1 169753090 AWWXMHMLKSTBFY-UHFFFAOYSA-N 394.479 2.654 0 50 GFAA CC(C)CCO[C@H]1CCN(C(=O)[C@H]2CCc3nnc(-c4ccc(O)cc4)n3C2)C1 170614664 SNJVWCBRYUCAEF-HKUYNNGSSA-N 398.507 2.877 0 50 GFAA O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC(n2ccnc2)CC1 170887227 QSWAMFYYTFGEFG-UHFFFAOYSA-N 381.480 2.534 0 50 GFAA CN1CCC(CNC(=O)Nc2ccc3c(c2)N(C)CC3)(N2CCCCC2)CC1 180233121 UGMZJWYSOQTKHN-UHFFFAOYSA-N 385.556 2.751 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)CCc3cccc(F)c3)CC[C@@H]21 216927125 OCOVOBKLXRFAAY-MJGOQNOKSA-N 376.472 2.634 0 50 GFAA CSCC[C@@H](NC(=O)c1nn(C)c2ccccc12)c1nnc2ccccn12 223226513 HZIFECREYAOULT-CQSZACIVSA-N 380.477 2.840 0 50 GFAA CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N[C@H](CC(=O)O)c1ccc(F)cc1 236589522 BOGARULPOPTJRJ-WOJBJXKFSA-N 398.434 2.994 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)NCc2ccc3cc[nH]c3c2)CC1=O 244734582 NIHNZDKPWLIBKR-GOSISDBHSA-N 377.444 2.841 0 50 GFAA Cc1nc2ccccc2c(=O)n1CCC(=O)N1CCC[C@H](N2[C@H](C)CC[C@H]2C)C1 247964469 PVISSQJNJCAWGS-LMMKCTJWSA-N 396.535 2.959 0 50 GFAA CN1CCN([C@H](c2ccc(F)c(Cl)c2)c2sc3ncnn3c2O)CC1 252510011 ZACGPQOXINEQDK-CYBMUJFWSA-N 381.864 2.626 0 50 GFAA CC1=C[C@@H]2[C@@H]3C(=O)NC(=O)[C@H]3[C@@H](C(=O)c3cccs3)N2c2ccc(C)cc21 253387466 NJXWMPDQQFJXCZ-SPUZQDLCSA-N 378.453 2.802 0 50 GFAA COc1ccc2[nH]cc([C@H](C(=O)O)N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 263585331 HMCCVEHKZOPNBK-ZMOMAAQPSA-N 393.443 2.583 0 50 GFAA biogenic COc1ccc([C@@H]2Cn3nnc(C(=O)NCc4ccccc4C)c3CO2)cc1 263619569 ZIBGEMJOCPNGHK-IBGZPJMESA-N 378.432 2.797 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)N1CC[C@H](n2cc(C)cn2)C1 290927714 KIYYIMCVSYYIBT-HKUYNNGSSA-N 396.491 2.668 0 50 GFAA CS(=O)(=O)C[C@@H]1CCN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C1 292225061 ZUDATLAOVOIJPJ-LLVKDONJSA-N 384.910 2.970 0 50 GFAA C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(N)=O)c1ncc(-c2ccccc2)o1 363152393 VPOULRRWIVREHP-RHSMWYFYSA-N 378.432 2.798 0 50 GFAA O=C(NCc1nc(C2CC2)cs1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 363759671 POJGQJSNSMNSHD-HNNXBMFYSA-N 399.472 2.670 0 50 GFAA CN(C[C@@H]1CC12CCN(C(=O)Cn1cc(-c3ccccc3)nn1)CC2)C1CC1 367354625 YHBUNAHXAVLNMD-SFHVURJKSA-N 379.508 2.668 0 50 GFAA Cc1nccn1-c1ccccc1CNC(=O)N1CCC[C@@H](Cn2ccnc2)C1 426387353 XFTMFQJBDYFDMI-SFHVURJKSA-N 378.480 2.999 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N[C@@H](CO)C(C)C)csc2C1 426690205 AUMIWJIKRCVQRD-KRWDZBQOSA-N 377.510 2.658 0 50 GFAA O=C([C@@H](c1ccc(F)cc1)N1CCCCC1)N1CCCN(c2ncccn2)CC1 826583373 USVSPCKHQKPDCY-HXUWFJFHSA-N 397.498 2.882 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CC[C@H](O)CC(C)(C)C2)(c2ccccc2)CC1 848199321 LUZKKKXEAOUHGA-IBGZPJMESA-N 384.520 2.742 0 50 GFAA Brc1cnc2n1C[C@@H](NCc1cnn(Cc3ccccc3)c1)CC2 898726769 MQHNJJHBKHALEI-INIZCTEOSA-N 386.297 2.995 0 50 GFAA O=C(Nc1ccc(OC[C@H]2CCCCO2)cc1)c1ccnc(-n2cnnc2)c1 952966910 KTROFNIMLULNOS-GOSISDBHSA-N 379.420 2.863 0 50 GFAA CC[C@H](C)c1ccccc1OCC(=O)N1CCC(c2nnc(CO)n2C)CC1 952981685 UHFSVHZZHDUKNV-HNNXBMFYSA-N 386.496 2.606 0 50 GFAA Cn1cc(Cl)c(C(=O)NC[C@@H]2CCCN(c3cnc4ccccc4n3)C2)n1 1506416580 WWQDVTTXEHPIAV-ZDUSSCGKSA-N 384.871 2.663 0 50 GFAA O=C(CCc1cccs1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565510091 BZSFJHFOZAKPHK-HIFRSBDPSA-N 375.519 2.787 0 50 GFAA CC(C)Cn1cncc1CN1CC[C@]2(O)CCN(C(=O)C3CCCC3)C[C@@H]2C1 1565515816 MHPIUADSOVIBEN-UGKGYDQZSA-N 388.556 2.515 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)N(CCN(C)C)Cc3[nH]cnc3C)cc2)n1 1704337140 WMGBQJOAGRHQRZ-UHFFFAOYSA-N 394.523 2.784 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2ccnc2)C[C@@H]1O)c1occc1COc1ccccc1 1857527351 PSPIDIODXNRRDF-SNRMKQJTSA-N 381.432 2.625 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)CC1 1857528420 CSIJBCZSUVNFRR-KGLIPLIRSA-N 384.480 2.839 0 50 GFAA Cc1ccc2ncnc(N3CCN(c4nnc(C(F)(F)F)s4)CC3)c2n1 1857676204 LKUYCLMZZIASFQ-UHFFFAOYSA-N 381.387 2.530 0 50 GFAA Cc1ccc2nc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)c(F)n2c1 1857731996 XJJVTGPUEZPFPF-FGTMMUONSA-N 394.450 2.726 0 50 GFAA N[C@H]1[C@H]2CC[C@@H]1CN(C(=O)C1CCN(c3nc4ccc(Cl)cc4o3)CC1)C2 1857735349 DPJWESMIVQCBCU-ZSBFGKGUSA-N 388.899 2.893 0 50 GFAA CN1[C@@](C)(CNc2nc(-c3ccccn3)nc3sccc23)CCS1(=O)=O 1875295415 XKUCDFOLKDBGPF-QGZVFWFLSA-N 389.506 2.589 0 50 GFAA CC(C)c1nccc(N2C[C@H](NC(=O)C3(c4ccccc4)CCCC3)[C@H](O)C2)n1 1875306376 CKFZHTDCLCJACD-RBUKOAKNSA-N 394.519 2.778 0 50 GFAA CN1CCc2nc3ccccc3c(C(=O)N[C@H]3[C@H]4CC[C@@H]3C[C@H](CO)C4)c2C1 1875321617 OLNVQEKMGXTQEH-YUZJZSIESA-N 379.504 2.750 0 50 GFAA Cc1nccn1-c1cc(C(=O)N=[S@](C)(=O)[C@@H]2CCOC2)c2ccccc2n1 1875392316 QQBDUTRQAVXBPA-LOKFHWFJSA-N 384.461 2.756 0 50 GFAA CNc1c(C(=O)N(C)C2CCN(c3ccncc3)CC2)sc2nccnc12 2325784787 JGMVVCXSKNOIRA-UHFFFAOYSA-N 382.493 2.869 0 50 GFAA Cc1cc2c(CC(=O)N3CCC(n4ccc(O)nc4=O)CC3)csc2s1 2325792659 APTHFNLKHJXSSP-UHFFFAOYSA-N 389.502 2.940 0 50 GFAA O=C(N[C@@H](CNC(=O)[C@@H]1CCCC12CC2)C1CCCC1)c1cnn2ncccc12 2325794432 BJFJBHMBBPWFBE-ROUUACIJSA-N 395.507 2.714 0 50 GFAA O=C(C[C@@H]1Cc2ccccc2CN1)NCCn1c(O)nc2cc(Cl)ccc21 2325857487 DFBVEPYZDXUYIU-INIZCTEOSA-N 384.867 2.616 0 50 GFAA CN(Cc1nc(O)c2sccc2n1)C(=O)c1ccc(-c2cncc(N)n2)cc1 2356162848 MNJXSKXLVQBEMR-UHFFFAOYSA-N 392.444 2.708 0 50 GFAA CCOC(=O)c1cccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)c1 846628 YUBFJWRDCKMTOS-UHFFFAOYSA-N 380.400 2.878 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1Cl 854190 ZFCDSZWPWPMTQW-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA CC(C)Nc1nc(NC(C)C)nc(Oc2ccc(=O)n(-c3ccccc3)n2)n1 1149535 IOJLPIOXMJXVCD-UHFFFAOYSA-N 381.440 2.850 0 50 GFAA CN(C1CC(C)(C)NC(C)(C)C1)S(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C 5464868 HMYSJHGTAMQUGE-XOBRGWDASA-N 384.586 2.953 0 50 GFAA CC1=NN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)[C@@](O)(C(F)(F)F)C1 7260634 PUSPVHLNSLYEGQ-ZDUSSCGKSA-N 376.722 2.651 0 50 GFAA CCN(CC)CCC(=O)NC[C@@H]1Cc2cc(Cl)cc(-c3ncccn3)c2O1 11838673 YVZGQXXDSMRERY-INIZCTEOSA-N 388.899 2.949 0 50 GFAA COc1ccc(C(=O)NC2CC2)c(OC2CCN(CCCn3cccn3)CC2)c1 12430384 QOSCXCWCTVJRBE-UHFFFAOYSA-N 398.507 2.717 0 50 GFAA Cc1cc(S(=O)(=O)N2CCC[C@H](CNC(=O)c3ccco3)C2)c(C)s1 12437699 UNBFMQQSBCGCFQ-CQSZACIVSA-N 382.507 2.789 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@H](C)C2)sc2c1CCCC2 12625284 SDXBQENMOLIGQT-BETUJISGSA-N 380.510 2.851 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccccc2)CN(C(=O)c2cncs2)CC1=O 14531320 PBAGAGFLRIIPJI-QGZVFWFLSA-N 387.505 2.669 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)N3CCC[C@@H](O)C3)CC2)CC1 14959947 YRFSGOZUBHWLPQ-HSZRJFAPSA-N 399.579 2.655 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@]2(CCCN(CCc3ccccc3)C2=O)C1 15063268 SBKXNUYROXIHSW-QHCPKHFHSA-N 377.488 2.708 0 50 GFAA O=C(NC1CC1)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)sc2c1CCC2 17076988 WKSIYLJMSIUWGQ-VXGBXAGGSA-N 376.478 2.959 0 50 GFAA Cc1c(C)n(CCN2CCOCC2)c2ncn3nc(Cc4ccccc4)nc3c12 20573766 UQAQKANGZXLWHI-UHFFFAOYSA-N 390.491 2.619 0 50 GFAA CCn1c2ccccc2c2cc(CN3CCN(CCOCCO)CC3)ccc21 23115041 NCDFKFYYVJMOSP-UHFFFAOYSA-N 381.520 2.941 0 50 GFAA Cc1nn2c(nnc3c(=O)n(Cc4ccccn4)ccc32)c1-c1ccc(F)cc1 40392058 INPLXAKDNMRZCJ-UHFFFAOYSA-N 386.390 2.997 0 50 GFAA CC(C)(CO)N(Cc1ccco1)C(=O)[C@H]1CCCN1C(=O)C1CCCCC1 55054540 STHYOPLSEMOKHA-GOSISDBHSA-N 376.497 2.950 0 50 GFAA CNS(=O)(=O)c1ccc(CN2CCC[C@H](C(=O)c3cccs3)C2)cc1 71759576 QMPYOAQLCOITNJ-HNNXBMFYSA-N 378.519 2.751 0 50 GFAA CCN(CC)C(=O)C[C@H]1C(=O)NCCN1Cc1ccc(-c2ccccc2)cc1 72143636 HOCRAURYVMHLIG-NRFANRHFSA-N 379.504 2.913 0 50 GFAA C[C@@H](CN1CC2(CCN(C(=O)c3ccnn3C)CC2)OC1=O)c1ccccc1 77487975 JDDWESRFKXOMCF-INIZCTEOSA-N 382.464 2.651 0 50 GFAA CCc1cc(C(=O)N2CCC[C@@]3(CCC(=O)N(Cc4ccncc4)C3)C2)no1 82127268 ZDRMMOZFGUXBOW-OAQYLSRUSA-N 382.464 2.677 0 50 GFAA Cc1ccnn1CCC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 95359217 MXVHOMHGWOTDRB-KSEOMHKRSA-N 382.483 2.810 0 50 GFAA CN1C[C@H](c2ccccc2)CC2(CCN(C(=O)Cn3ccccc3=O)CC2)C1 95378703 AEAUIYLDTDEZGF-HXUWFJFHSA-N 379.504 2.576 0 50 GFAA CN(C)CCN(C[C@H]1CCCN(Cc2ccccc2F)C1)C(=O)c1ccnnc1 95526483 YTSYTOOZNFDFIZ-SFHVURJKSA-N 399.514 2.532 0 50 GFAA O=C(Nc1cc(F)c(C(F)(F)F)c(F)c1)N1Cc2cnn(CCO)c2C1 97743113 IFWBXPXJMVAGEY-UHFFFAOYSA-N 376.285 2.720 0 50 GFAA CCN1CCC[C@H]1CNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@@H](C)CC3 100663180 IZCPPOVZLXYGBM-WFASDCNBSA-N 387.455 2.568 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1C(F)(F)F 101751601 DDYHBIRITVNHTG-DPDCMNJDSA-N 378.350 2.841 0 50 GFAA CN(C(=O)c1cc(F)c(Cl)cc1Cl)C1CCN(S(C)(=O)=O)CC1 122452004 VPYDRYILEDOQBO-UHFFFAOYSA-N 383.272 2.629 0 50 GFAA CCc1ncc(NC(=O)[C@@H]2CC(=O)N(CCOc3ccccc3Cl)C2)cn1 152455657 AIOGALSKGUBPFW-CYBMUJFWSA-N 388.855 2.558 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)c2ncn(-c3ccccc3)n2)C1 154047154 OGJNGXHTXXYHBP-MRXNPFEDSA-N 377.448 2.532 0 50 GFAA O=C(NCCN1CCc2sccc2C1)N1CCO[C@@H](c2cccc(O)c2)C1 163981933 HLBQSMFVUSOTGJ-GOSISDBHSA-N 387.505 2.595 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(-c4noc(-c5ccncc5)n4)c3CO2)cc1 169780301 YLTQZSNEIWJHAN-INIZCTEOSA-N 376.376 2.670 0 50 GFAA C[C@H](C(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O)n1nnc(-c2ccccc2)n1 170611710 YVQCGMVZYSTTEC-DRSNIGMVSA-N 393.491 2.647 0 50 GFAA CCNC(=O)c1cc(Cl)ccc1NC(=O)[C@H](C)n1nnc(-c2ccccc2)n1 173272521 LQSKWRJRKCIFMI-LBPRGKRZSA-N 398.854 2.943 0 50 GFAA Cn1cc(N2CCN(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)CC2)cn1 175774027 SZODHQSTSWLVSV-GOSISDBHSA-N 399.495 2.722 0 50 GFAA COCCOc1c(Cl)cc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1Cl 263060561 OLOHCETVTLAKRF-SECBINFHSA-N 377.224 2.957 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)cc1OC 263616163 HLOZUMTXSQBRAN-SFHVURJKSA-N 398.394 2.958 0 50 GFAA Cc1cc(CNC(=O)[C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)n(C)n1 284001801 IJYNXPBNBBRSRR-INIZCTEOSA-N 395.290 2.956 0 50 GFAA O=S(=O)(NCc1ccncc1OC[C@H]1CCOC1)c1ccc(Cl)s1 288673578 SZNITIOZWARYNY-NSHDSACASA-N 388.898 2.690 0 50 GFAA C[C@H](NC(=O)N1CC[C@H](N2CCCC2)[C@H]1C)C(=O)N1c2ccccc2C[C@H]1C 334095077 QZKQXNHZZGAMMC-NTDBWNAOSA-N 384.524 2.621 0 50 GFAA C[C@H](NC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1)[C@@H]1CCOC1 363421146 BHOZEGXCNZDOBV-GOEBONIOSA-N 379.888 2.623 0 50 GFAA C[C@@H](c1nc(-c2ccccc2)no1)N1CCC(S(=O)(=O)N2CCCC2)CC1 367074079 WLWCYPFRURXUKS-HNNXBMFYSA-N 390.509 2.688 0 50 GFAA O=C(c1cnn(Cc2ccccc2Cl)c1)N1CCOC[C@@H]1[C@@H]1CCCO1 376170664 GOQMBSLSTPUUQE-MSOLQXFVSA-N 375.856 2.605 0 50 GFAA O=C(Cn1c(C2CC2)nc2ccccc21)NCCc1noc(C(F)(F)F)n1 426527724 HXMYSERBWPCPEN-UHFFFAOYSA-N 379.342 2.674 0 50 GFAA CC[C@@H]1CN(C(=O)C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C[C@@H]1O 774489948 HWDICYJTWIHTSD-KUHUBIRLSA-N 391.487 2.762 0 50 GFAA CC(C)C[C@H](NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)c1cccnc1 821004153 RORUMRCARUZJHD-SFHVURJKSA-N 375.494 2.995 0 50 GFAA CC1([C@@H]2CCCN(C(=O)N[C@H](C[C@H]3CCCO3)C(F)(F)F)C2)OCCO1 847244360 CCHZZQJMBSHQKD-MGPQQGTHSA-N 380.407 2.671 0 50 GFAA O=C1CC[C@@H](NCC2(N3CCOCC3)CCCCCC2)CCN1CC1CC1 952976111 YRRCJORQFHXOAS-HXUWFJFHSA-N 377.573 2.792 0 50 GFAA Cc1ncsc1C(=O)NC[C@H]1CCCN(C(=O)c2ccc(Cl)cn2)C1 952977288 VBEZBPKQCMKPSC-GFCCVEGCSA-N 378.885 2.782 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)NCc2cccc3[nH]ccc23)OCC(=O)N1C 1529124905 AAINRCXHEQQSQU-RTWAWAEBSA-N 377.444 2.691 0 50 GFAA O=C(Cc1c(F)cccc1Cl)N[C@H]1CCOC[C@@H]1OCc1ccccn1 1565516407 ZFKQWOBDAVWEDN-ROUUACIJSA-N 378.831 2.907 0 50 GFAA CCOc1ccc2[nH]c(=O)c(-c3nccn3C[C@@H]3Cc4nnc(C)n4C3)cc2c1 1857703321 YZIMTOGNFZINOX-AWEZNQCLSA-N 390.447 2.563 0 50 GFAA NC(=O)CCCC(=O)N1C[C@H](c2ccc3c(c2)OCO3)O[C@H](c2ccccc2)C1 1857722487 JSZVYULSIXXGHI-VQTJNVASSA-N 396.443 2.712 0 50 GFAA CC1(NC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)CCNCC1 1857727482 UBZKBVPRWSBHHV-ZDUSSCGKSA-N 376.888 2.956 0 50 GFAA Cc1cc(C)cc(C(=O)NCC(=O)N(C)Cc2ccc(Cn3ccnc3)cc2)c1 1875297533 VKSYTAAUDUIAJS-UHFFFAOYSA-N 390.487 2.937 0 50 GFAA O=C(N[C@H]1C(=O)NCc2ccccc21)c1ccc(Cl)cc1N1CCCC1=O 1875321010 QTRRGVFLGLCPRX-GOSISDBHSA-N 383.835 2.568 0 50 GFAA O=C1NC(=O)[C@]2(CCCC[C@@H]2NC(=O)c2ccc(OC3CCC3)cc2Cl)N1 1875328621 CCKWLHZWMKDTFP-HNAYVOBHSA-N 391.855 2.522 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2ccc(N3CCOC[C@@H]3C)c(Cl)c2)C1 1875371317 WWJRNYHYTOLMBX-GJZGRUSLSA-N 391.899 2.928 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc(SC(C)(C)C)cc2)nn1C 2325758833 YEXYGLDSQNCHDE-UHFFFAOYSA-N 383.495 2.898 0 50 GFAA CN(Cc1cnn2c1CNCC2)C(=O)CCc1nc2cc(Cl)ccc2s1 2325759881 LBPGQVKSOFMBQO-UHFFFAOYSA-N 389.912 2.841 0 50 GFAA O=C(O)[C@H](C[C@@H]1CCSC1)NCc1nc(C(F)(F)F)n2c1CCCC2 2325789690 GBPRJVGUWJFHQO-QWRGUYRKSA-N 377.432 2.924 0 50 GFAA CO[C@]1(C(F)(F)F)C[C@H](CN(C)C[C@@H]2C[C@H](F)CN2Cc2cnn(C)c2)C1 2325797397 OKMPSJIIMAAHRT-QSPRXWTASA-N 392.441 2.622 0 50 GFAA NCc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccn2ncc(Br)c2c1 2325856923 ILHVADYLBCFBKZ-INIZCTEOSA-N 385.265 2.973 0 50 GFAA N[C@@H]1CCc2cc(C(=O)NCc3ccccc3-c3ccncc3)ccc2NC1=O 2325857236 UQOIAJWNRBSNPF-HXUWFJFHSA-N 386.455 2.891 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N2CCn3c(nnc3C(F)(F)F)[C@H]2C)cc1 2325887875 QYQPEQYIBRHWGU-SNVBAGLBSA-N 379.342 2.638 0 50 GFAA COCc1ccccc1/C=C(\C)CN[C@@H]1C[C@@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 2332239208 OFHMTSGNQCOOQI-YNMXXGQGSA-N 399.491 2.560 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(c2ccc(CN3CCCC3)cn2)CC[C@H]1O 2356141229 YTVBAALIWATGFU-WIYYLYMNSA-N 375.513 2.756 0 50 GFAA CN(C[C@@H]1Cc2ccccc2O1)C(=O)c1cc2c(s1)CCOC21CCNCC1 2356159813 RGPJHWOXHFMREA-INIZCTEOSA-N 398.528 2.975 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)cn1 2356167466 PMMKQRRFTFPQTM-JOCHJYFZSA-N 378.476 2.625 0 50 GFAA CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(CN3CCCC3)cc2)cc1 778705 GPEAABITICTPKB-UHFFFAOYSA-N 387.505 2.785 0 50 GFAA CCN(CC)S(=O)(=O)c1cc(C(=O)Oc2ccccc2OC)ccc1OC 792997 ZQBMLUUWOYTGMD-UHFFFAOYSA-N 393.461 2.954 0 50 GFAA CCOC(=O)c1sc2ncn(CC(=O)OCc3ccccc3)c(=O)c2c1C 921160 VYVAMEJIORNDOB-UHFFFAOYSA-N 386.429 2.687 0 50 GFAA COc1ccc([C@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3ncnn32)cc1O 955876 FALJBSTUCBLZKU-SFHVURJKSA-N 377.404 2.920 0 50 GFAA O=C(NCc1ccccc1)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 1077802 AZKDFFBDOIGHEQ-INIZCTEOSA-N 376.453 2.543 0 50 GFAA O=C(NCc1cccnc1)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)cc1 1110182 UMIUPTYUPYTYTA-MSOLQXFVSA-N 381.432 2.841 0 50 GFAA CC(=O)Nc1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 1133618 DPLIEACDQYWZIC-UHFFFAOYSA-N 389.477 2.974 0 50 GFAA COC(=O)C1=C(c2ccccc2)NC(=S)N[C@@H]1c1ccc(OC)c(OC)c1 2871234 CCCPYSSGHMGNFF-GOSISDBHSA-N 384.457 2.807 0 50 GFAA CCCCOc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCCO)cc1 2917969 HRLDUEDAIAFECS-CAPFRKAQSA-N 382.460 2.745 0 50 GFAA CCOC(=O)C1=C(C)N=C2SCC(=O)N2[C@@H]1c1cc(Cl)c(O)c(OC)c1 4949328 UIWCYFRHVIRNJY-CQSZACIVSA-N 396.852 2.877 0 50 GFAA CN(C(=O)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1)c1ccccc1 12003476 WVBKOUHJWLYOMH-UHFFFAOYSA-N 378.837 2.683 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(CCCSC)CC1 12050276 UOLBDNQMPYITKH-UHFFFAOYSA-N 396.553 2.668 0 50 GFAA CN(Cc1ccccc1)C[C@H](O)COc1ccc(CNCCn2cccn2)cc1 12054360 AQOPSECYUKYRBY-QFIPXVFZSA-N 394.519 2.545 0 50 GFAA CN(C(=O)CCN1CCCCCC1=O)[C@H]1CCCN(C2Cc3ccccc3C2)C1 12432118 XLOMYWFHHCLBBM-NRFANRHFSA-N 397.563 2.869 0 50 GFAA COC(=O)CCCC(=O)N(C)C[C@@H]1CCCN(CCc2ccc(OC)cc2)C1 12709754 HOBXBGMXCJVZNX-IBGZPJMESA-N 390.524 2.751 0 50 GFAA O=C1O[C@@H]2CN(Cc3c(F)cccc3Cl)C[C@@H]2N1CCN1CCCCC1 12747966 ANCGFPBLWXHZGE-ZWKOTPCHSA-N 381.879 2.970 0 50 GFAA CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@H](N(C)Cc1ccon1)C2 14542542 GYWJOBCQYAFYFG-KRWDZBQOSA-N 385.512 2.897 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(-n3cccn3)c2)cn1 14976587 UXXPGFUYVVZFRN-LJQANCHMSA-N 375.432 2.819 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CCCN(C(=O)c3c(C)noc3C)C2)CC1 15075032 LGHDJYADYFWBIW-GOSISDBHSA-N 398.507 2.727 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c2nsnc12 20109809 RHGGPNFMOVWBJP-UHFFFAOYSA-N 388.518 2.506 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CC[C@@H](N(C)C)C4)nc3)n2)c1OC 39379323 WNNDUDPRENCZDZ-OAHLLOKOSA-N 395.463 2.956 0 50 GFAA CCCn1ncnc1[C@@H](C)NC(=O)CCCc1nc(-c2cccc(OC)c2)no1 55060956 HHFQDHJGBFQVSY-CQSZACIVSA-N 398.467 2.947 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3cc4ccccc4n3C)C2)CC1 55133433 HMKSDAAVBZVNAA-SFHVURJKSA-N 398.507 2.557 0 50 GFAA O=C(c1cccc2cnccc12)N1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1 71758827 UCVMWPKOCZSASC-UHFFFAOYSA-N 383.411 2.579 0 50 GFAA CN(C)C(=O)c1nc2ccc(Cl)cn2c1CN1CC(Oc2ccccc2)C1 71774547 NELLAMNLGSUYOT-UHFFFAOYSA-N 384.867 2.953 0 50 GFAA CO[C@H](C(=O)N1CCc2c(nc(-c3ccccc3)[nH]c2=O)C1)c1ccccc1 72166715 LYHASDYDWYTOMS-IBGZPJMESA-N 375.428 2.709 0 50 GFAA COc1cccc(OC[C@H]2CCCN(C(=O)Cc3c(C)nc(N)nc3C)C2)c1 72433127 ZVFMTFSKYOAWIT-INIZCTEOSA-N 384.480 2.544 0 50 GFAA COCCCN1C[C@@]2(CCCN(Cc3c(C)nc4ccccn34)C2)CCC1=O 77520856 IMHCGBBCVPOETE-QFIPXVFZSA-N 384.524 2.884 0 50 GFAA CCc1nc(C)ccc1OCC(=O)N1CCN(Cc2ccc(C)cc2)C(=O)C1 77524744 DSBOGQWZGRRFJK-UHFFFAOYSA-N 381.476 2.511 0 50 GFAA O=C(C[C@@H]1C=CS(=O)(=O)C1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 82114903 LSFQZGVSMQHUDC-LBPRGKRZSA-N 389.304 2.590 0 50 GFAA COc1ccc2c(c1)[C@@H](C(=O)N(C)Cc1cnc3ccccc3n1)CC(=O)N2 91621321 AGTVKUQBEMYWBP-INIZCTEOSA-N 376.416 2.723 0 50 GFAA O=C(c1cnc(-c2ccncc2)nc1)N1CCC[C@H](OCc2ccccn2)C1 95358325 PJQCJSYUSDMAFO-IBGZPJMESA-N 375.432 2.755 0 50 GFAA COC(=O)N1CCN(C(=O)Nc2ccc(OC[C@H]3CCCCO3)cc2)CC1 95526298 YZRRBGUSRDGTTM-QGZVFWFLSA-N 377.441 2.550 0 50 GFAA Cc1ccc(I)c(C(=O)O)c1I 95910966 YTDFDLUUKSMVQU-UHFFFAOYSA-N 387.942 2.902 0 50 GFAA COc1ccccc1N1CCN([C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)CC1 100313965 RLHHFQYPQCJASJ-SFHVURJKSA-N 399.878 2.803 0 50 GFAA COC(=O)c1ccc(NC(=O)CSc2nnnn2[C@H]2C[C@H]3CC[C@H]2C3)cc1 101549725 ZXNNAMQLLOBIED-WHOFXGATSA-N 387.465 2.552 0 50 GFAA COc1ccc(CN2CCN(c3noc(C(C)C)n3)C[C@H]2CCO)c(C)c1C 107015799 UBTZSEVITBSTTQ-GOSISDBHSA-N 388.512 2.892 0 50 GFAA O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC[C@@H](c2nccs2)C1 114741472 VYVUWOSTKHEOFS-CYBMUJFWSA-N 380.491 2.873 0 50 GFAA CC(C)n1nnnc1-c1ccccc1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 124409774 FFJORJDDFHKVFX-ZWKOTPCHSA-N 378.436 2.701 0 50 GFAA CC[C@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)CCN1CC(F)F 125214515 IMNBGDLEGDSRHE-ZDUSSCGKSA-N 383.414 2.754 0 50 GFAA Cn1cc(CNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)c(C(F)(F)F)n1 154045905 PDYMLWMJGPOOOW-UHFFFAOYSA-N 383.370 2.804 0 50 GFAA CN(C)C(=O)c1cccc(NC(=O)CN2CCO[C@]3(CCc4ccccc43)C2)c1 158711022 KPYGXWWCCCQGEC-HSZRJFAPSA-N 393.487 2.501 0 50 GFAA O=C(c1ccc(OCc2ccccc2)nc1)N1CCC(Cn2ccnn2)CC1 179188871 XARIRWADWXNDKJ-UHFFFAOYSA-N 377.448 2.805 0 50 GFAA O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CCC(c2ccncc2)CC1 190587238 OLMHBNYTXHVNLZ-RTWAWAEBSA-N 386.540 2.739 0 50 GFAA Cc1cc(OC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H]([C@H]5C[C@H]54)[C@H]3C2=O)cc(C)c1Cl 239339148 LTDXGLOQYGSKQK-RIMFYDMWSA-N 385.847 2.915 0 50 GFAA Cc1ccc(N2CCN(Cc3nnc([C@H]4C[C@@H](N)C4)n3C3CC3)CC2)cc1C 244719000 LUULSEAYKRGQCZ-HDICACEKSA-N 380.540 2.757 0 50 GFAA COc1cncc([C@H](NC(=O)c2cccc(-n3cccn3)c2)[C@H]2C[C@@H](O)C2)c1 244773757 PFWZVUAKETZGSZ-MOXGXCLJSA-N 378.432 2.518 0 50 GFAA CCN1C(=O)[C@H]2[C@@H](C1=O)[C@H](C(=O)c1ccc(C)cc1)N1N=Cc3ccccc3[C@@H]21 248136139 CRRARLBQFDLNJC-ZGXWSNOMSA-N 387.439 2.572 0 50 GFAA O[C@@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)cn1 252488151 ILVGFILWSLNOHJ-PBHICJAKSA-N 385.302 2.538 0 50 GFAA Cc1c(C(=O)Nc2ccc3c(c2F)CCNC3)sc2nc3n(c(=O)c12)CCC3 261834393 ZIFVZQIAYFZRMI-UHFFFAOYSA-N 398.463 2.750 0 50 GFAA C[C@H]1CCN(C(=O)c2ccn([C@H]3CCCNC3)n2)CCN1Cc1ccccc1 262871936 XWAXWNFFNOEKMJ-ICSRJNTNSA-N 381.524 2.544 0 50 GFAA CC(C)c1ccc(CCC(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)cc1 276462944 NDCKFPZDGFWUGE-IBGZPJMESA-N 381.524 2.848 0 50 GFAA COc1cc(OC)cc(-c2cccc(NC(=O)[C@@H]3CCc4nnn(C)c4C3)n2)c1 291000477 BXLXTDHYTSVUPJ-CYBMUJFWSA-N 393.447 2.638 0 50 GFAA Cn1nnc2c1C[C@H](C(=O)Nc1nc(-c3ccc(F)c(F)c3)cs1)CC2 291073087 FMJQCZJTEAFYDJ-SNVBAGLBSA-N 375.404 2.960 0 50 GFAA COc1ccc(CCNC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cc1OC 298974524 OSOMJNXKDXYMFG-INIZCTEOSA-N 386.448 2.650 0 50 GFAA Cn1cccc1CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 363285967 XPHXLKAWNDZEJF-CQSZACIVSA-N 391.418 2.795 0 50 GFAA CN(C)C(=O)c1ccc(CNC(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)cc1 363293530 AELUTZDAQPQGBV-NRFANRHFSA-N 394.519 2.804 0 50 GFAA COc1ccccc1[C@@H]1CCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)C1 363418239 FITLSTYEKRRPKA-RTBURBONSA-N 393.487 2.959 0 50 GFAA CCn1cc([C@H]2CN(C(=O)Nc3cc4c(cc3F)CCC(=O)N4)CCO2)cn1 365235880 ZURDIOKQCIJVAV-QGZVFWFLSA-N 387.415 2.532 0 50 GFAA C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)NC1CCC2(CC1)NC(=O)NC2=O 376888449 PWHRRCZSGIUDSW-WTWLNQHXSA-N 384.480 2.520 0 50 GFAA Cn1cnnc1[C@@H]1CCCN(C(=O)C[C@@](C)(C(=O)O)c2ccc(Cl)cc2)C1 414070990 CQKWIGWGSRHTBX-BFUOFWGJSA-N 390.871 2.607 0 50 GFAA Cc1cc2c(cc1NC(=O)NC1CCN(C[C@H]3CCCO3)CC1)OCCO2 426574811 SJWIKXKIQCKJKL-MRXNPFEDSA-N 375.469 2.531 0 50 GFAA COc1cc(C(=O)O)cc(-c2ccc(C(=O)N3CCC[C@@H](N(C)C)C3)cc2)n1 584894776 NDCFBABJVRDMGJ-QGZVFWFLSA-N 383.448 2.622 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N[C@@H]1CCCN(C(=O)c2ccco2)C1 586079812 LAPZZGWVAQXWHK-CYBMUJFWSA-N 398.868 2.525 0 50 GFAA Cc1cccc(N2CCC(NC(=O)[C@H](c3cccnc3)N3CCOCC3)CC2)c1 670463606 NGTAKTUOSNTPOR-QFIPXVFZSA-N 394.519 2.549 0 50 GFAA COc1cc2c(cc1F)CC[C@@H]2NC(=O)Cn1c(S)nc2ccccc2c1=O 801555027 XEPULKPEJCLEOV-INIZCTEOSA-N 399.447 2.637 0 50 GFAA O=C(c1ccnc(OCC(F)F)c1)N1CC[C@H](c2ccccc2)S1(=O)=O 814085235 SXYQCJIMUOJLSL-CQSZACIVSA-N 382.388 2.643 0 50 GFAA O=C([C@H]1CCCc2cccnc21)N1CC(O)(c2ccc(Br)cc2)C1 857337520 MGCVXFFXMUIATM-INIZCTEOSA-N 387.277 2.994 0 50 GFAA Cc1cc(OC[C@@H](O)CNC(=O)/C=C/c2cc(CO)cs2)ccc1Cl 952966901 HIWMFWKTBJEGEW-KQIUPUNMSA-N 381.881 2.772 0 50 GFAA Cc1nc(C)c(C(=O)N2CCC[C@@H](CNC(=O)Cc3c[nH]c4ccccc34)C2)o1 952978699 BWUZYJYVHQKPAG-INIZCTEOSA-N 394.475 2.984 0 50 GFAA CC[C@@]1(O)CCC[C@@H]2CN(C(=O)CCCc3nc(-c4ccncc4)no3)C[C@@H]21 1704327135 AIKHOAAFZPOTGH-LLGFUMIMSA-N 384.480 2.854 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCc4cn(C)nc4C)C3)nc2c1 1857671806 QVGNQUOJYCWQKK-OAHLLOKOSA-N 397.479 2.801 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1c[nH]nc1C(=O)O 1857674945 DXCMFFDOIJLJIN-CSODHUTKSA-N 383.448 2.637 0 50 GFAA O=C(c1onc2ncccc12)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857716912 GSSVVSJJVBZLKZ-OALUTQOASA-N 392.459 2.901 0 50 GFAA COCC1(CNC(=O)[C@@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)CCC1 1857719938 ZGWMSMUFVFCDFO-CQSZACIVSA-N 387.505 2.891 0 50 GFAA C[C@@H](Cn1ccc2ccccc21)C(=O)N1CCC(C(=O)N=c2cc[nH]cc2)CC1 1875255231 GTWJWVXCXCOLAV-KRWDZBQOSA-N 390.487 2.972 0 50 GFAA C[C@H](NC(=O)[C@H]1CCN(C)C[C@@H]1c1ccnn1C)c1cccc(-n2ccnc2)c1 1875267166 VBZRMHFTGYWFFO-VDGAXYAQSA-N 392.507 2.519 0 50 GFAA COc1ccc(C2=NO[C@H](CNC(=O)Cc3cnc4c(C)cccn34)C2)cc1F 1875272149 NSRHVPORKZYHJG-INIZCTEOSA-N 396.422 2.642 0 50 GFAA Cc1cc(CN2C(=O)CCN(CCCc3nnc4ccccn34)C2=O)cc(C)n1 1875293666 YQJORSJEURYSID-UHFFFAOYSA-N 392.463 2.528 0 50 GFAA COc1ccc2c(c1OC)CC[C@@H]2NC(=O)Cn1cnc2c(C)cccc2c1=O 1875308258 WPHFJFJQSBQSIM-KRWDZBQOSA-N 393.443 2.526 0 50 GFAA O=C(N[C@H]1CC[C@@H](C(=O)O)CC1)C(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 1875336308 CHIWWEZDZCRDII-BHYGNILZSA-N 397.475 2.634 0 50 GFAA O=C(CN1CCOC1=O)Nc1nnc(Cc2ccc(Cl)cc2Cl)s1 1940196303 ADIKPZVNLLVMTJ-UHFFFAOYSA-N 387.248 2.826 0 50 GFAA COc1ccccc1CCNC(=O)[C@H]1OCC(=O)N(C(C)C)[C@@H]1c1ccccc1 2100482987 KMBCLMRFXDNXHO-YADHBBJMSA-N 396.487 2.731 0 50 GFAA Cn1cccc1-c1nnc2ccc(C(=O)N3CC4(COc5ccccc5C4)C3)cn12 2100555591 YAVAZOOAFDKDJV-UHFFFAOYSA-N 399.454 2.812 0 50 GFAA Cc1cccc2c(C(=O)NC(C)(C)CN3CCN(c4ccccc4)CC3)cnn12 2325858999 JWPQMNNYBXSCMB-UHFFFAOYSA-N 391.519 2.973 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC(O)(Cc4ccccc4)CC3)cc2)n1 2356166979 FOUXNHXLCVIQCW-UHFFFAOYSA-N 388.471 2.936 0 50 GFAA CCOC(=O)c1cnc(SCC(=O)Nc2cc(Cl)ccc2OC)nc1N 2876455 XSTVZIVTXCNMBT-UHFFFAOYSA-N 396.856 2.628 0 50 GFAA COC(=O)c1ccccc1S(=O)(=O)Oc1c(F)c(F)c(F)c(F)c1F 4100506 DJNFRUSKGQGIHM-UHFFFAOYSA-N 382.262 2.936 0 50 GFAA CCOC(=O)c1c(NC(=O)C(F)(F)F)sc2c1CCN(C(=O)OCC)C2 4535592 KIDCYRRNCPFGGF-UHFFFAOYSA-N 394.371 2.940 0 50 GFAA CCc1nnc(NC(=O)CSc2nnc(-c3ccncc3)n2CC)s1 5046019 IZHPQLUQPASYFO-UHFFFAOYSA-N 375.483 2.505 0 50 GFAA COc1ccccc1C(=O)N(Cc1sccc1C)[C@@H]1CCS(=O)(=O)C1 6810204 XQXMKLKRHCAJOK-CQSZACIVSA-N 379.503 2.895 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)CC(F)(F)F)CC1 11844417 APHXMARTBQKJNF-HNNXBMFYSA-N 377.451 2.558 0 50 GFAA Cc1nc2cc(OCc3cc(C(=O)N4CC[C@H](N(C)C)C4)no3)ccc2s1 11873414 WRUXLMQTRJSOSC-ZDUSSCGKSA-N 386.477 2.948 0 50 GFAA C[C@H](C(=O)N(C)CC1CCN(CCc2cccc(F)c2)CC1)N1CCCC1=O 12057625 MKQHSSUOUCKVDV-QGZVFWFLSA-N 389.515 2.550 0 50 GFAA Cc1ccccc1[C@@]1(CC(=O)N(C)C(C)C)CC(=O)N(Cc2cccnc2)C1=O 12213339 YTLRNPQJXXGRKM-HSZRJFAPSA-N 393.487 2.844 0 50 GFAA CCN(Cc1cnn(C)c1)C(=O)c1cc(Cn2c(C)nc3ccccc32)on1 12304663 AVGKBWXYNCQPDQ-UHFFFAOYSA-N 378.436 2.777 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CNCCn1cccn1 12317889 SQOTWXATIMQLTI-UHFFFAOYSA-N 388.475 2.593 0 50 GFAA O=C(CCc1ccc2c(c1)OCO2)N1CC[C@@]2(CCCN(CC3CC3)C2=O)C1 12457271 LJLKEIXPMVEWMZ-QFIPXVFZSA-N 384.476 2.599 0 50 GFAA COCCN1C(=O)N(Cc2ccccc2)C2(CCN(Cc3ccoc3)CC2)C1=O 14742749 PKNPKWBMXAQLJQ-UHFFFAOYSA-N 397.475 2.725 0 50 GFAA COc1ccc(-c2ncc(CN[C@H]3CCCN(c4ncccn4)C3)cn2)cc1 15080230 XPAUEWGNKIOFHW-SFHVURJKSA-N 376.464 2.701 0 50 GFAA Cc1ccccc1NC(=O)[C@@H](C)N(c1ccc2c(c1)OCCO2)S(C)(=O)=O 16577099 RCAAUAQAIVPTLW-CQSZACIVSA-N 390.461 2.559 0 50 GFAA CC1CCN(C(=O)C2CCN(S(=O)(=O)CCCc3ccccc3)CC2)CC1 16625638 QDTMUGBWPBLZBR-UHFFFAOYSA-N 392.565 2.920 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CCN(Cc3ccc(F)cc3)CC2)cc1 20176935 HCFSMOFXEFXZQB-UHFFFAOYSA-N 378.469 2.731 0 50 GFAA CC(C)(O)c1cn(C[C@@H]2CCCN(C(=O)c3cnc4ccccc4c3)C2)nn1 48428200 FLNRHZZFUHGLER-OAHLLOKOSA-N 379.464 2.606 0 50 GFAA Cc1ccc([C@@H](NC(=O)CCn2c(C)cc(C)nc2=O)c2ccncc2)cc1 55089349 FMTPFDSEBHAKNY-OAQYLSRUSA-N 376.460 2.859 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCC(C)(CO)CC3)C2=O)cc1 67654414 QXGIZIAJJKZPNI-QHCPKHFHSA-N 388.552 2.758 0 50 GFAA O=C(N1CCCC1)N1CCCn2nc(CN3CCc4sccc4C3)cc2C1 72480753 PIRWSKPSDGONLN-UHFFFAOYSA-N 385.537 2.924 0 50 GFAA Cc1n[nH]c(C)c1CCC(=O)NCc1cc2n(n1)CCN(C1CCCCC1)C2 91914858 TXKIPABGCBEVQJ-UHFFFAOYSA-N 384.528 2.620 0 50 GFAA COc1ccc(F)cc1[C@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95385393 VROFXJAHQAUSLB-QGZVFWFLSA-N 379.457 2.543 0 50 GFAA Cc1cc(C)n(C(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CCCC[C@@H]3C2=O)n1 100115692 ZUPWIBSQWPGFOD-FHWLQOOXSA-N 379.460 2.927 0 50 GFAA CCOc1ccc(CN2CCN(C(=O)N[C@H]3CCO[C@@H](C4CC4)C3)CC2)cc1 128983900 MJDBBESFAUKUEE-PZJWPPBQSA-N 387.524 2.870 0 50 GFAA CCc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cccnc1OCC(F)F 153397436 ZWFPWCFCAMCNRE-UHFFFAOYSA-N 384.404 2.944 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O)c1cnn(C)c1 164169393 POERQIHEEDXADC-LIRRHRJNSA-N 392.459 2.761 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4ccc(C)c(C)c4)nnc3c2)n1 169776186 POVVOXOCUISQKU-UHFFFAOYSA-N 376.420 2.889 0 50 GFAA CCc1noc(-c2cn([C@@H]3CCN(C(=O)c4ccc(Cl)s4)C3)nn2)n1 169780389 GWVXGOAMPMJIQH-SECBINFHSA-N 378.845 2.693 0 50 GFAA CCOC(=O)C[C@](C)(NC(=O)CCN1CCN(c2ccccc2)CC1)C(C)C 170599910 ZPAZAHOALJYEBN-QFIPXVFZSA-N 389.540 2.683 0 50 GFAA CC1(C)CC[C@H](CNC(=O)[C@@H]2CC(=O)N(c3ccccc3Br)C2)O1 170601111 AYLPSYWXTNUJLI-CHWSQXEVSA-N 395.297 2.876 0 50 GFAA O=C(Nc1ccn(Cc2ccccc2)n1)[C@H]1CCCN1C(=O)c1ccccc1O 171113768 CAZBQHOBOQRYIM-GOSISDBHSA-N 390.443 2.880 0 50 GFAA O=C(NC[C@H]1CCN(CCc2ccccc2)C1)Nc1ccc(-n2cccn2)nc1 171511313 SMXRYOZAWLJSES-LJQANCHMSA-N 390.491 2.953 0 50 GFAA Cn1cc(N2CC[C@@H](N3CCO[C@H](c4ccccc4C(F)(F)F)C3)C2=O)cn1 184024198 CCWDEVSRABLSKR-SJORKVTESA-N 394.397 2.618 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)CCc2cccc(Br)c2)CC1 186656481 NIPCNELMDRLUGT-INIZCTEOSA-N 397.313 2.779 0 50 GFAA CCOC(=O)COCCN1CCN(C(c2ccccc2)c2ccccc2)CC1 253428392 JOIWGHXZMNTXJF-UHFFFAOYSA-N 382.504 2.973 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCN(C(=O)c3ccco3)CC2)ncn1 275561079 FSXKPDLTMGLVNZ-OXQOHEQNSA-N 399.495 2.648 0 50 GFAA CCOc1ccccc1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)[C@H]1c1cnn(C)c1 277611972 UFFTXACWMMRCIK-MGPUTAFESA-N 398.507 2.937 0 50 GFAA CCc1nc(NC[C@@H]2CC(=O)N(C)[C@H]2c2cnn(C)c2C)c2ccsc2n1 328614607 WHFGVEGDOCDBPL-YVEFUNNKSA-N 384.509 2.927 0 50 GFAA O=C(N[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1CCS(=O)(=O)c2ccccc21 332752577 GKYINYWZWLYEFG-NVXWUHKLSA-N 377.506 2.946 0 50 GFAA Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)NCc2cccc(C(N)=O)c2)c1 378407616 YGKDTTPBAMOCFN-HXUWFJFHSA-N 393.487 2.713 0 50 GFAA C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)c1ccc(S(N)(=O)=O)cc1 421928491 WTGDIEZILOMYOK-LJQANCHMSA-N 376.453 2.711 0 50 GFAA COC[C@@H](c1ccccn1)N(C)C(=O)Nc1cc(-n2cnnn2)cc(C)c1C 426407692 SGOSUKGCTKWWGO-SFHVURJKSA-N 381.440 2.526 0 50 GFAA CCCN1CC[C@@H](CNC(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)C1 534651125 CNSFOVNVWGOHNB-INIZCTEOSA-N 380.483 2.524 0 50 GFAA Cc1ccc(N2CCC(C(=O)N(C)[C@H](Cc3ccccc3)C(=O)O)CC2)nc1 738280775 SPEQROGMVLKECJ-LJQANCHMSA-N 381.476 2.761 0 50 GFAA OCc1cn(CCCN[C@@H](Cc2ccc(Br)cc2)C2CCC2)nn1 888096820 NELKPTZDSXTQMI-SFHVURJKSA-N 393.329 2.924 0 50 GFAA Cc1ccccc1O[C@@H]1CCCC[C@@H]1NC(=O)c1nnn([C@H]2CCNC2)c1C 888102052 WPVCVIOKQSGQAK-JENIJYKNSA-N 383.496 2.549 0 50 GFAA Cn1nc(C(F)(F)F)cc1C(=O)N1CCC(c2ncc(C(=O)O)s2)CC1 910215151 MMMYOBIQCKFSID-UHFFFAOYSA-N 388.371 2.613 0 50 GFAA COCCN1C[C@@H](C(=O)Nc2ccc(-c3cccc(F)c3F)cn2)CCC1=O 1506397742 XDPTVUSWUPFFRF-AWEZNQCLSA-N 389.402 2.850 0 50 GFAA CC(C)c1cc(C(=O)N(CCOc2ccccc2)C[C@@H]2CCCO2)nc(N)n1 1506405542 AEQWNBXBNQBJQO-KRWDZBQOSA-N 384.480 2.882 0 50 GFAA C[C@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(C(F)(F)F)cc3)CC2)C1 1704297971 BDEISTGPKUJTPM-HNNXBMFYSA-N 393.427 2.790 0 50 GFAA Cc1nc(N(C)C)nc(N2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)c1C 1704343588 JUQYDLGBLFSVTI-YLJYHZDGSA-N 377.492 2.747 0 50 GFAA O=C(Nc1ccc2c(c1)COB2O)c1cccc(Oc2ccc(Cl)cc2)n1 1776003238 YGMQGMJHUYIGIP-UHFFFAOYSA-N 380.596 2.997 0 50 GFAA COc1cc(Oc2cc(C(=O)N3CCCC[C@H]3CN)ccc2OC)ccc1CN 1857692674 OSHKWXYBMPBLFT-KRWDZBQOSA-N 399.491 2.908 0 50 GFAA O=C(CCc1ccccc1F)N1C[C@@H]2OCCC(=O)N(Cc3ccccc3)[C@H]2C1 1857700334 TZCDQRNMUWFDBG-SFTDATJTSA-N 396.462 2.787 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)no1 1857704673 BFWCADGTENRBFF-OAQYLSRUSA-N 391.431 2.661 0 50 GFAA CO[C@@H]1C[C@@H](C(=O)NCc2cc(C3CC3)on2)CC[C@H]1NC1CCSCC1 1857716681 DNOVQWYGADIYKZ-POZUXBRTSA-N 393.553 2.837 0 50 GFAA COc1nc(N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)ncc1F 1857718877 XUBLTBCINQQPJM-IJEWVQPXSA-N 378.835 2.904 0 50 GFAA CCC[C@@H]1CCCN(C(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)CC1 1875252850 CVAYMOQQWLUUCG-QVKFZJNVSA-N 386.496 2.853 0 50 GFAA O=C(N[C@H]1CCCN(Cc2c(F)cccc2F)C1)C1CC2(C1)C[C@H]2C(=O)O 1875277555 QLTQYTTVYNVJOV-PQNMFCCASA-N 378.419 2.546 0 50 GFAA COC(=O)C1=NO[C@]2(CCCN(C(=O)N[C@H](C3CCCC3)C(F)(F)F)C2)C1 1875296462 YGJNGHIGGOVQSQ-CZUORRHYSA-N 391.390 2.601 0 50 GFAA O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N1CCC(c2ccno2)CC1 1875298291 VYYUWDWCWGRBKV-UHFFFAOYSA-N 380.448 2.797 0 50 GFAA COC(=O)N1CCC[C@H]([C@H](C)NC(=O)c2cc(C(F)(F)F)nn2C2CC2)C1 1875311006 JDJYEWCRMHXJIP-QWRGUYRKSA-N 388.390 2.834 0 50 GFAA CN(C[C@H]1CCCN(C(=O)c2cnc3cc[nH]c3c2)C1)C(=O)CC[C@@H]1CCOC1 1875338637 FKOFLHLJZYCYJB-IAGOWNOFSA-N 398.507 2.690 0 50 GFAA NC(=O)c1ncn2c(-c3ccccc3)cc(C(=O)N3CCc4ccccc43)nc12 1875350160 CWCREBXQZYEJJG-UHFFFAOYSA-N 383.411 2.698 0 50 GFAA O=C1CC[C@H](N2Cc3c(cccc3-c3ccc(F)c4[nH]ccc34)C2=O)C(=O)N1 1875357144 ZWUAVDHZFDDGRC-KRWDZBQOSA-N 377.375 2.735 0 50 GFAA CCN1CCN(C(=O)c2cc(Cl)ccc2OC[C@@H]2C[N@]2CC2CC2)CC1 1875383833 BJUHJPFUZVQMCY-XDHUDOTRSA-N 377.916 2.591 0 50 GFAA COc1cccc(F)c1N1CCN(C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875394039 SHDHAPHXDRADMO-QWHCGFSZSA-N 388.443 2.542 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2nc3c(s2)CCCC3)CC1 1940195718 HUDDOXWOHQIXSJ-UHFFFAOYSA-N 384.505 2.946 0 50 GFAA C[C@@H](CO)N1CCCN(c2nc3ccccc3c(=NCc3ccccc3)[nH]2)CC1 2325756822 DNGLIVYAKYGJPM-SFHVURJKSA-N 391.519 2.557 0 50 GFAA CO[C@]1(C(F)(F)F)C[C@H](CN2CCCC[C@H]2c2n[nH]cc2C(=O)N(C)C)C1 2325797343 DITMSGLBIYWPSF-RVSPLBMKSA-N 388.434 2.996 0 50 GFAA Cc1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc(N4CCOCC4)cc3)C1)CC2 2356137740 XMHNHBWWSSWSGV-HSZRJFAPSA-N 392.503 2.742 0 50 GFAA c1ccc(-c2n[nH]cc2CN2CCc3nc(C4CCOCC4)nn3CC2)cc1 2356139230 OJIALUKBHMGUNV-UHFFFAOYSA-N 378.480 2.621 0 50 GFAA CCc1csc(CNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)n1 2356146436 GGEXALDRYUYIDC-ZJTDPSCFSA-N 396.516 2.654 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccc(Br)cc1)C1CCCCC1 1109260 YOOLMQCVPGHJMV-UHFFFAOYSA-N 389.315 2.982 0 50 GFAA CCc1ccc(NC(=O)CN(c2ccc(OC)c(OC)c2)S(C)(=O)=O)cc1 1133476 ADTAVCHPKQSCHZ-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA CCc1cc(S(=O)(=O)N2CCC[C@]23CCCN(C2CC2)C3=O)ccc1OC 2356156860 UJVBONBKZZDATN-FQEVSTJZSA-N 392.521 2.566 0 50 GFAA COc1ccc(-n2ccnc2CN2CCN(C(=O)c3ccccc3)CC2)cc1 55253871 MWVMXAOYXMCLHJ-UHFFFAOYSA-N 376.460 2.839 0 50 GFAA NC(=O)CCn1cc(CN2CCCC[C@@H]2CCN2CCCC2=O)c2ccccc21 55119378 AMCJYPXLBJRHPD-LJQANCHMSA-N 396.535 2.884 0 50 GFAA Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@H](N2CCNC2=O)C1 139374400 PLRDSMLKXREYOA-LBPRGKRZSA-N 376.507 2.810 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCCc1[nH]nc2c1CCCC2 67872812 RNPGHRJNNXNRFB-UHFFFAOYSA-N 377.492 2.992 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN(C)Cc3cnccn3)C2=O)cc1 67921984 MJZRNQZAUMTODN-QFIPXVFZSA-N 382.508 2.586 0 50 GFAA CC(C)CC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CCCN(C)CC3)nc2)C1 67850409 KSLXZZRNAYBSOS-IBGZPJMESA-N 386.540 2.691 0 50 GFAA COc1ccccc1/C=C/CNC[C@@H]1CC(=O)N(C)[C@H]1c1c(C)nn(C)c1C 328617934 DFUGEUJEHASBCH-VACYZGCOSA-N 382.508 2.868 0 50 GFAA Cn1cc([C@@H]2[C@@H](C(=O)N[C@H]3CCCc4occc43)CC(=O)N2C(C)(C)C)cn1 252571518 YCFFBLJUZJIMJZ-TXPKVOOTSA-N 384.480 2.895 0 50 GFAA CC(C)[C@@H](C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)N1CCCC1=O 363375187 QDNCUINBEVQTSK-FQEVSTJZSA-N 375.488 2.553 0 50 GFAA Cc1cc(C)cc(-c2nnc(NC(=O)N3CC[C@H]4OCCN(C)[C@H]4C3)s2)c1 285168695 MBBLOIASXWALJZ-JKSUJKDBSA-N 387.509 2.759 0 50 GFAA CCOc1cccc(-c2cccc(NC(=O)[C@@H]3CC(=O)N(c4cn[nH]c4)C3)n2)c1 489557497 YTFSBIWJYMRQTJ-OAHLLOKOSA-N 391.431 2.862 0 50 GFAA C[C@]1(c2ccc3c(c2)OCCO3)NC(=O)N(CN2CCC[C@H]3CCCC[C@H]32)C1=O 239432832 WOYYFQKPYWYZKQ-ZDPZECHZSA-N 399.491 2.837 0 50 GFAA CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1cnn2ccccc12 376217548 DYYJASRJDGLGDU-NRFANRHFSA-N 390.487 2.950 0 50 GFAA COc1ccnc(N2CCC(C(=O)N3C[C@H](C)Oc4ccc(C)cc43)CC2)n1 175060186 KSGFWBUQDZIDDZ-HNNXBMFYSA-N 382.464 2.824 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCc3c(nc(-c4ccncc4)nc3N(C)C)C2)c1 71753569 HZANIVZVZRKVNC-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA CNC(=O)c1ccc(NC(=O)C(=O)c2cnn(-c3ccccc3)c2)c(Cl)c1 135691988 WXHQTUGAWNWSPA-UHFFFAOYSA-N 382.807 2.707 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)N1CCN(c2cccnc2)CC1 426722740 YWPNPLAKPDGRPD-UHFFFAOYSA-N 379.508 2.578 0 50 GFAA O=C(c1cc(C2CC2)[nH]n1)N1CCC(n2cc(Cc3ccccc3)nn2)CC1 19111825 FYHHVFYMDYHVJG-UHFFFAOYSA-N 376.464 2.947 0 50 GFAA COc1ccc(-c2nc(C(=O)N3CC[C@@H](N4CCOCC4)[C@H]3C)cs2)cc1 291219383 GNCXUTSNWYSFBR-RDTXWAMCSA-N 387.505 2.754 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)N2CCC(Cc3nccn3C)CC2)[C@H]1c1ccccc1 178621444 ZQPYSVKSYUJQOO-DENIHFKCSA-N 394.519 2.811 0 50 GFAA O=C(CN1CCCS1(=O)=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 194104080 IPAXJXMEMWLJPO-AWEZNQCLSA-N 377.293 2.692 0 50 GFAA CN1CCOC[C@@H](CNC(=O)c2cccc(-c3cnc4ccccc4n3)c2)C1 426376381 NWMOBBSJTKEKNQ-INIZCTEOSA-N 376.460 2.605 0 50 GFAA CC(C)n1cccc1C(=O)N1CCC2(CC1)c1nc[nH]c1CCN2C(=O)C1CC1 95496627 KTZNDKNQIPJQJE-UHFFFAOYSA-N 395.507 2.718 0 50 GFAA CN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3ccc(=O)n(C)c3)CC2)C1 95367201 FXGKSQNYTVNTIT-FQEVSTJZSA-N 379.504 2.727 0 50 GFAA O=C([C@@H]1COc2ccccc2C1)N1CCC(c2nnc3n2CCCCC3)CC1 95504281 CUEIAQIDNBWZBV-SFHVURJKSA-N 380.492 2.962 0 50 GFAA Cc1cccc(CN2CCN(CC(=O)Nc3cccc4nsnc34)CC2)c1 22752069 GDGADIIXKJJLEX-UHFFFAOYSA-N 381.505 2.756 0 50 GFAA CCCN(Cc1cccc(OC)c1)C(=O)[C@H](c1cccnc1)N1CCOCC1 95385999 GZZKSGQRAFRJJN-NRFANRHFSA-N 383.492 2.902 0 50 GFAA COCCCN(Cc1ccc(C)cc1)C(=O)[C@@H]1CCCN(C(=O)N(C)C)C1 95382159 RRQUMRCTTAPWIE-LJQANCHMSA-N 375.513 2.754 0 50 GFAA O=C([C@H]1CCS(=O)(=O)C1)N(CCc1ccc(Cl)cc1)Cc1cccnc1 97474995 WNOUVBYOLOHWEC-KRWDZBQOSA-N 392.908 2.741 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(Cc4csc(C)n4)C3)CCC2=O)cn1 91351041 DZCGNFYBNINZIE-HXUWFJFHSA-N 385.537 2.955 0 50 GFAA COCC(=O)N(CC1CCN(Cc2ccccc2F)CC1)C[C@@H]1CCCO1 95511174 XHOYGCURVJJWHA-IBGZPJMESA-N 378.488 2.692 0 50 GFAA CCN(CC)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)c2ccco2)cn1 299059711 QBFHYYGNAFMWQV-QGZVFWFLSA-N 384.480 2.832 0 50 GFAA C[C@](CO)(c1ccc(Br)cc1)N1CCN(C(=O)C2CC=CC2)CC1 1456780032 KMPFWILEPZLQMX-IBGZPJMESA-N 393.325 2.767 0 50 GFAA O=C(NC[C@@H]1CCCc2cccnc21)N1CCc2c(nnn2-c2ccccc2)C1 1875295181 SKNAQVYREUDSAR-KRWDZBQOSA-N 388.475 2.850 0 50 GFAA CNC(=O)c1nc(C)c(C)c(N2CC[C@@H](NC3CCC(C(F)(F)F)CC3)C2)n1 1875398064 ZIZQYEVVGWWMQP-YMAMQOFZSA-N 399.461 2.742 0 50 GFAA CCn1nc(C(=O)NCc2ccc(-n3ccnc3C)nc2)c2c1[C@H](C)O[C@H](C)C2 1875401632 NGNVUYKYQPRZGE-KGLIPLIRSA-N 394.479 2.744 0 50 GFAA CCOc1ccc(OCC(=O)Nc2cc(C)ccc2NC(=O)CN(C)C)cc1 952968927 GGPKPRWNATULCD-UHFFFAOYSA-N 385.464 2.911 0 50 GFAA COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3ccc4c(c3)C[C@@H](C)O4)C2)c1 1439137791 BGBSBMMDRGJXBA-ASSNKEHSSA-N 396.443 2.837 0 50 GFAA CN1C(=O)C[C@H](C(=O)N2CCN(C3CC3)c3ccc(F)cc32)[C@@H]1c1cccnc1 187368097 KAPRVDZFGKGFNN-UWJYYQICSA-N 394.450 2.756 0 50 GFAA Cc1ccc(F)c(-c2cc(NS(=O)(=O)c3ccc4c(c3)CC(=O)N4)[nH]n2)c1 188533151 LTIDYFZXNHXWCQ-UHFFFAOYSA-N 386.408 2.820 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)NC[C@@](C)(O)c3ccc(F)cc3)c2O1 192646530 YITQTRWGUGLLTQ-LJQANCHMSA-N 379.453 2.725 0 50 GFAA O=C(CCc1cccnc1)NCC1CCN(CCn2cnc3ccccc32)CC1 1506416619 HMYRVOLBAFJZRN-UHFFFAOYSA-N 391.519 2.892 0 50 GFAA Cc1ncn(CCNCc2cc(-c3ccccn3)ccc2OCC(=O)O)c1C 1506419944 NCZRRWJLUWLFLP-UHFFFAOYSA-N 380.448 2.815 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3ccc4nn[nH]c4c3)CC1)OCC2 1704343793 YXXCTVBTLPBFTL-UHFFFAOYSA-N 378.432 2.671 0 50 GFAA C[C@@H](c1ccon1)N(C)C(=O)Cn1cc(NC(=O)CSc2ccccc2)cn1 12054016 NHTYPENXABZYMJ-AWEZNQCLSA-N 399.476 2.822 0 50 GFAA CC(=O)N1CCN(c2ncccc2CNC(=O)CCCCc2ccccc2)CC1 12303779 IAUQAHXBCYKORU-UHFFFAOYSA-N 394.519 2.779 0 50 GFAA Cc1cnnn1-c1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1 13689908 WNWHNHVFQUCLPZ-UHFFFAOYSA-N 376.464 2.580 0 50 GFAA CC[C@@H](C)c1nn2c(=O)c(NC(=O)c3ccc(OC)c(OC)c3)cnc2s1 14291554 VICVMWDESMOFHR-SNVBAGLBSA-N 388.449 2.934 0 50 GFAA CC(=O)Cc1nsc(NC(=O)c2nnn(-c3ccc(C)cc3)c2C(C)C)n1 16651825 CHRTYXKHUWRPKU-UHFFFAOYSA-N 384.465 2.934 0 50 GFAA O=C(CSc1nc(=O)c2c3c(sc2[nH]1)CCCC3)NCc1ccccn1 18090262 RKOQUMFHIXFPSY-UHFFFAOYSA-N 386.502 2.667 0 50 GFAA CCN1CCN(C2(C(=O)NCc3ccccc3C)Cc3ccccc3C2)CC1 19731413 LDWNHCXLBATJKS-UHFFFAOYSA-N 377.532 2.786 0 50 GFAA O=C1C[C@H](N2CCN(c3ccc(Cl)cc3)CC2)C(=O)N1c1ccccc1F 19770816 FOWPICIYAXCKBB-SFHVURJKSA-N 387.842 2.933 0 50 GFAA Oc1nc(N2CCOCC2)nc2c1CC[C@]21CCCN(Cc2ccccc2F)C1 1857708649 FQKMFGQOEHZOFW-QFIPXVFZSA-N 398.482 2.638 0 50 GFAA Cc1ccc(C)c(N2C(=O)C[C@@H](Nc3ccc(N4CCOCC4)cc3)C2=O)c1 101130882 QAJJQBNEYVCHCQ-LJQANCHMSA-N 379.460 2.884 0 50 GFAA CCN1[C@H](c2ccc(Cl)cc2)[C@H](CNCc2cnn(C)c2)C[C@]1(C)CO 248160498 XJBHIZIWSSDBAP-DFQSSKMNSA-N 376.932 2.997 0 50 GFAA O=C(O)C[C@H](NC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1nccs1 2325784592 XTPQMLGTBHMVNI-CMPLNLGQSA-N 397.250 2.541 0 50 GFAA Cc1nc(C(C)(C)C)sc1C(=O)NC[C@H](C)NC(=O)[C@@H](O)c1ccccc1 2325873482 ISYQHJDOOAKPJF-WFASDCNBSA-N 389.521 2.717 0 50 GFAA COc1ccc(OC)c(NC(=O)CSc2nnc(-c3cccnc3)n2C)c1 891515 KPBSBVRFCWZKJY-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA COc1c(Cl)cc(C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1Cl 4507003 WYRJUFMTHANQMT-UHFFFAOYSA-N 375.233 2.902 0 50 GFAA Cc1nc(C)c(C(=O)NS(=O)(=O)c2cc(Cl)c3c(c2)C[C@H](C)O3)s1 115921321 XYWAEALJJFZSAO-ZETCQYMHSA-N 386.882 2.855 0 50 GFAA Cc1csc(CN(C)C[C@@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)n1 55342813 YODWDWJOMITSHE-IBGZPJMESA-N 377.485 2.576 0 50 GFAA COCCc1noc([C@@H]2CCCN2CC(=O)N2CCCc3cc(C)ccc32)n1 65409128 YAZQWQWTRSJBLK-SFHVURJKSA-N 384.480 2.683 0 50 GFAA CCCn1nc(C)c2c1NC(=O)C[C@@H]2c1ccc(OC)c(Cn2cncn2)c1 65404439 RUBASNUFSVXZOF-MRXNPFEDSA-N 380.452 2.724 0 50 GFAA O=C(Cn1cc(-c2ccc(F)cn2)cn1)Nc1ccn(Cc2ccccc2)n1 63869433 WLCAFKCPMWTKES-UHFFFAOYSA-N 376.395 2.968 0 50 GFAA COc1ccc(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)cc1C 20535158 KIDOOOMKUCVUAM-QFIPXVFZSA-N 389.584 2.745 0 50 GFAA COc1ccc(NC(=O)CN2CCN(Cc3ccc(F)cc3)CC2)c(OC)c1 20247449 ZHHFETXGTWIRAR-UHFFFAOYSA-N 387.455 2.599 0 50 GFAA Cc1nc(NCCNC(=O)Nc2cc(F)cc(F)c2)cc(N2CCCC2)n1 65364404 JDDRTSKLQLCNCB-UHFFFAOYSA-N 376.411 2.897 0 50 GFAA C[C@@H](NC(=O)N1CCC(c2nncn2C)CC1)c1ccc(-n2cccn2)cc1 174338147 OIDAUGIEDKKJSY-OAHLLOKOSA-N 379.468 2.651 0 50 GFAA CCCC(=O)N1CCC2(CC1)CN(Cc1ccc(F)c(OC)c1)CCN2C 67919904 CYHSBIXVZXEDNH-UHFFFAOYSA-N 377.504 2.743 0 50 GFAA Cc1nn(Cc2cccc(Cl)c2)c(C)c1NS(=O)(=O)c1cnn(C)c1 2805059 AAFZHXDCQHUJDW-UHFFFAOYSA-N 379.873 2.736 0 50 GFAA Cc1cc(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c(C)cc1Cl 6527735 VFURTKKQYGDIKJ-UHFFFAOYSA-N 382.869 2.697 0 50 GFAA Cc1cc(Cc2ccc(S(=O)(=O)NC3CCCCCC3)cc2)c(=O)[nH]n1 33026666 GGXCNJHIGQUPRQ-UHFFFAOYSA-N 375.494 2.670 0 50 GFAA Cn1cncc1[C@H]1C[C@@H](NS(=O)(=O)/C=C/c2ccccc2Cl)CCO1 328625924 LDJKOPWESWEDBH-NMIVOGFZSA-N 381.885 2.884 0 50 GFAA O=C(Cc1cn2ccccc2n1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 364661016 IMRIWUFMCCCBBY-SFHVURJKSA-N 391.475 2.552 0 50 GFAA Cc1cnc2c(S(=O)(=O)Nc3nccc(-c4cnn(C)c4)n3)cccc2c1 486570188 DDBNPDBFPISIBW-UHFFFAOYSA-N 380.433 2.535 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1CC(c1ccccc1)c1ccccc1)NCC1CC1 72124203 HXNNNPJYHGTOHY-JOCHJYFZSA-N 391.515 2.535 0 50 GFAA Cc1cccc(C(=O)N2CCN(c3cc(-n4cnc(C)c4C)ncn3)CC2)c1 72441636 VUQHDPHZQCNDNE-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA O=S(=O)(Cc1cccc(F)c1)Nc1nnc([C@@H]2COc3ccccc3O2)o1 446765966 CBZOLAPYCWQMAI-HNNXBMFYSA-N 391.380 2.663 0 50 GFAA CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(CCC(=O)O)cc1 262169694 NTFFIFLDZAWBKV-OAHLLOKOSA-N 378.494 2.980 0 50 GFAA COCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cc(Cl)sc1Cl 129439685 BGISAMVESSIQET-SSDOTTSWSA-N 397.309 2.606 0 50 GFAA COc1ccc(NS(=O)(=O)c2cc(NC(=O)[C@H](C)[C@H](C)N)ccc2C)cc1 262549599 XHOCKAHBWNRAMZ-KGLIPLIRSA-N 391.493 2.726 0 50 GFAA CCOc1ccc(CNC(=O)N2CCC[C@H]2C[C@H](O)c2cnn(C)c2)cc1F 378365772 XGJPVJMJNOIAEN-WMZOPIPTSA-N 390.459 2.756 0 50 GFAA CC(C)n1ncc2cc(C(=O)N[C@H](C(=O)O)c3ccc4c(c3)CCO4)cnc21 263209349 ZKSGURGGGPTJGE-KRWDZBQOSA-N 380.404 2.503 0 50 GFAA CNS(=O)(=O)c1cccc(CNC(=O)[C@H](C)Cc2cncc3ccccc23)c1 239782455 CORWXWWFNSDERG-OAHLLOKOSA-N 397.500 2.638 0 50 GFAA Cc1c(NC(=O)[C@H]2CCO[C@@H](c3ccccc3)O2)c(=O)n(-c2ccccc2)n1C 240333208 FCHAZXJKNFRNAS-XMSQKQJNSA-N 393.443 2.927 0 50 GFAA CCc1n[nH]c(SCC(=O)N(C)CC2CCN(Cc3ccccc3)CC2)n1 77408105 DNBGOIUTRYVLIS-UHFFFAOYSA-N 387.553 2.830 0 50 GFAA COCC(=O)N1CCCN(C(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 223795854 WPQXNMLQEDNQEX-UHFFFAOYSA-N 378.778 2.680 0 50 GFAA Cn1c(CN2CCOCC2)nnc1[C@H]1CCCN(Cc2cc3ccccc3[nH]2)C1 426500300 OUZWUHKCEMBUNE-SFHVURJKSA-N 394.523 2.508 0 50 GFAA COCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(-c3cccs3)nc21 20605702 VOWQXQLBPPZHIQ-UHFFFAOYSA-N 377.447 2.616 0 50 GFAA COCCN1CCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1 45809364 DIWCWGVAGRVOQV-UHFFFAOYSA-N 383.492 2.739 0 50 GFAA COCCNC(=O)N1CCC[C@H](CNC(=O)C2(c3ccc(Cl)cc3)CC2)C1 95525291 NJCACRDGOVYIEU-OAHLLOKOSA-N 393.915 2.556 0 50 GFAA O=C(c1cnn(CCC(F)(F)F)c1)N1CCC(c2nncn2C2CC2)CC1 182655988 RACWKVSUQJMWKT-UHFFFAOYSA-N 382.390 2.782 0 50 GFAA CN(Cc1nc2ccccc2s1)C(=O)[C@H]1CC(=O)N(Cc2cccnc2)C1 95391886 KSPKVGINIFKKOL-HNNXBMFYSA-N 380.473 2.698 0 50 GFAA O=C(NCc1cccc2[nH]ccc12)c1ccc(S(=O)(=O)N2CCCC2)cc1 91974284 XJKNHHIDKMHTAC-UHFFFAOYSA-N 383.473 2.882 0 50 GFAA Cc1cc(C(=O)N2C[C@H]3[C@H](N)CC[C@H]3C2)cc(C)c1OCC(=O)N1CCCCC1 185178182 ZNUWJMMLNNYPGR-DFQSSKMNSA-N 399.535 2.504 0 50 GFAA Cc1cc(=O)c2cccc(-c3cccc(C(=O)N4CCC[C@H](C(N)=O)C4)c3)c2[nH]1 534646732 HUANOVCFPXZZEL-KRWDZBQOSA-N 389.455 2.841 0 50 GFAA O=C(c1cccc(O)n1)N1CCC2(CC1)CN(C/C=C/c1ccccc1)CCO2 828928332 GVWGZWGSOIKBGM-VMPITWQZSA-N 393.487 2.808 0 50 GFAA Cc1ccc(F)cc1C(=O)N1CCOC2(CCN(C(=O)C3CC=CC3)CC2)C1 826564288 FPABNEGBJLWNED-UHFFFAOYSA-N 386.467 2.934 0 50 GFAA CC(C)(C)N1CC[C@H](NC(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)C1 670437982 ZAILENZDWLBALL-SFHVURJKSA-N 380.483 2.665 0 50 GFAA CCOc1cccnc1S(=O)(=O)N(C)C[C@H]1CCCc2sc(C)nc21 1875298950 TULSUQJDLNOYIJ-CYBMUJFWSA-N 381.523 2.986 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc(F)cc2OC2CCOCC2)CC1 1875365005 CMVNJJDZYHACEO-UHFFFAOYSA-N 376.428 2.747 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)c1nc3ccccc3cc1C)CCO2 1875395889 OQPBOYUTQVNGFV-UHFFFAOYSA-N 387.505 2.646 0 50 GFAA O=C(NCc1ccnn1CCc1ccccc1)c1ccc2[nH]nc(C(=O)O)c2c1 1875300167 OPPWIQNYUXUZDC-UHFFFAOYSA-N 389.415 2.630 0 50 GFAA CCc1cc(C(=O)Nc2ccc(OC[C@@H](O)CN(C)C)cc2)cc2c[nH]nc12 1875349791 MXQAQWCSPVETMN-SFHVURJKSA-N 382.464 2.679 0 50 GFAA COc1ccc(-n2cccn2)cc1S(=O)(=O)N(Cc1ccncc1)C1CC1 952990168 VAASQYNQXRIZQF-UHFFFAOYSA-N 384.461 2.629 0 50 GFAA COc1ccc([C@H](NC(=O)N2CCO[C@@](C)(C(F)F)C2)c2nccn2C)cc1 888102069 XTHHXRXHZAJOBH-HNAYVOBHSA-N 394.422 2.584 0 50 GFAA CCC1(N2CCOCC2)CCN(C(=O)Nc2ccc3c(C)n(C)nc3c2)CC1 888100323 UEEHTUFQMVBVCN-UHFFFAOYSA-N 385.512 2.990 0 50 GFAA Cc1ccc(C(=O)NCC(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)s1 1323967750 HDLSJBJHBAFECR-QFIPXVFZSA-N 397.544 2.911 0 50 GFAA Cn1ccnc1CN1CCC(C(=O)N2CCN(C3CC3)c3ccccc32)CC1 186796158 HXEVPJYYPHGWOA-UHFFFAOYSA-N 379.508 2.648 0 50 GFAA Cc1cccc(S(=O)(=O)CCCn2nc(C)c([C@H]3COCCN3C)c2C)c1 1327943792 BZUIPICCQVXSME-LJQANCHMSA-N 391.537 2.675 0 50 GFAA CN(Cc1nccc(N)n1)[C@@H]1CCN(C(=O)CCCc2c[nH]c3ccccc23)C1 276549166 RXLUSGKKMFZUQW-QGZVFWFLSA-N 392.507 2.596 0 50 GFAA Cc1ccc(-c2nc(CC(=O)NCC3(S(C)(=O)=O)CCC3)cs2)cc1 225428837 XIZTVXCGDFVBIZ-UHFFFAOYSA-N 378.519 2.745 0 50 GFAA COc1ccnc(CS(=O)(=O)c2nnc(-c3ccc(Cl)cc3)[nH]2)c1OC 170617134 PXPTVHPAYYBPTE-UHFFFAOYSA-N 394.840 2.511 0 50 GFAA C[C@@H]1CCS(=O)(=O)CCN1C(=O)c1cc(-c2ccncc2)nc2ccccc12 191792690 NYQJVYBGAIPQBB-OAHLLOKOSA-N 395.484 2.946 0 50 GFAA CC(=O)CCc1ccc(O[C@@H](C)C(=O)NCc2ccnc(-n3ccnc3)c2)cc1 194473560 GTKNQIORJCWRCL-KRWDZBQOSA-N 392.459 2.873 0 50 GFAA C[C@@H](C(=O)NCc1cccc(CN2CCOCC2)c1)N1CCc2ccccc21 195082579 SDNCYOBLHJPXSV-SFHVURJKSA-N 379.504 2.586 0 50 GFAA CCOc1ccc2nc(O)c(CN3C[C@@H](O)[C@H](Cc4cc(C)no4)C3)cc2c1 1529179262 WOLDHEBKUUOAMG-FOIQADDNSA-N 383.448 2.671 0 50 GFAA O=C(c1ccccc1OCCc1ccccc1)N1C[C@@H]2COCC[C@]2(CO)C1 1772710930 QFBVFZXUBWUKAX-AUSIDOKSSA-N 381.472 2.779 0 50 GFAA C[C@H](C(=O)N1CCCN(c2noc(C3CC3)n2)CC1)n1cnc2ccccc21 1772817206 MCGNTCJPPALPKJ-CQSZACIVSA-N 380.452 2.597 0 50 GFAA O=C(N[C@@H]1CCCc2ccccc21)c1ccc(CN2CCSCC2)[nH]c1=O 11964227 BTADRUFHGHBEHR-LJQANCHMSA-N 383.517 2.731 0 50 GFAA COCCN1CCC(CN(Cc2ccc(COC)o2)C[C@H]2CCCO2)CC1 12386200 PHGXJXLXNWWIJV-LJQANCHMSA-N 380.529 2.765 0 50 GFAA CC(C)OCCCN[C@@H]1CCc2c(c(C(=O)N(C)Cc3ccco3)nn2C)C1 14538552 QJQAPHHMMDYPRY-MRXNPFEDSA-N 388.512 2.547 0 50 GFAA O=C([C@@H]1C[C@@H](n2cnnn2)CN1Cc1ccccc1Cl)N1CCCCCC1 14980878 SSUDTXZGKOYCQA-AEFFLSMTSA-N 388.903 2.545 0 50 GFAA Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N3CCc4ccccc43)cc2)no1 16580167 FKLNFCJRCIBQSU-UHFFFAOYSA-N 383.429 2.987 0 50 GFAA CN(C)c1ccc(C(=O)N[C@H]2CCC[C@@H](CNC(=O)CCc3cn[nH]c3)C2)cc1 1857679053 DYHAUCROGGNRPT-APWZRJJASA-N 397.523 2.513 0 50 GFAA Cc1cc([C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3n(n2)CCN(C)C3=O)ccc1F 1857681055 WGGPBHLSIPDIQE-BJWYYQGGSA-N 396.466 2.967 0 50 GFAA CCCN1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NCc1cc(O)ncn1)C2 1857708056 RSXSASHSHLSWTJ-NNMXDRDESA-N 380.492 2.674 0 50 GFAA COc1ccnc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)c1 1857719851 XCYHEHTZAQGFNU-SFTDATJTSA-N 381.476 2.768 0 50 GFAA CS(=O)(=O)Cc1ccc(C(=O)N2CCC[C@](O)(c3ccc(Cl)cc3)C2)o1 846355638 VTBPMGYNIBOVPU-GOSISDBHSA-N 397.880 2.601 0 50 GFAA Cc1ccc(S(=O)(=O)n2nc(OC(=O)c3cccc(C)c3C)cc2N)cc1 253433567 YOLYOGMVCRLCRV-UHFFFAOYSA-N 385.445 2.847 0 50 GFAA C[C@@H](Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1)C(=O)O 262797347 NXECUWGFKPVBDI-DOTOQJQBSA-N 387.480 2.816 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC[C@H]2CN2CCOCC2)c1)c1cccs1 266356912 OVJSQFWFXLRCAY-SFHVURJKSA-N 399.516 2.937 0 50 GFAA NCc1ccc2c(c1)CC[C@@H]2NC(=O)c1nc(C(F)(F)F)n2ccncc12 2325795228 RDMMFTJCNNABQW-ZDUSSCGKSA-N 375.354 2.624 0 50 GFAA COc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2cc(OC)ccc2OC)cc1 862814 PILONWHQAHVIST-IBGZPJMESA-N 397.431 2.979 0 50 GFAA O=C(CCN1C(=O)c2ccccc2C1=O)NC(=S)Nc1ccccc1Cl 941017 ZVFZBQWIASFAJR-UHFFFAOYSA-N 387.848 2.839 0 50 GFAA CC(C)Cc1cc(C(=O)N2CCC[C@@]3(CCc4cnc(N(C)C)nc43)C2)no1 2356137331 KKLQGWMIMNQDEB-OAQYLSRUSA-N 383.496 2.849 0 50 GFAA Cc1nc(CN2CCN(C(=O)N[C@H](C)c3ccc4c(c3)OCO4)CC2)oc1C 114919717 UMIYFVAMEKZZOG-CQSZACIVSA-N 386.452 2.609 0 50 GFAA Cc1ccccc1CNC(=O)Cn1cc(NC(=O)CCOc2ccccc2)cn1 20271301 KMIYPHNVMHUTOR-UHFFFAOYSA-N 392.459 2.916 0 50 GFAA COC[C@H]1CCCN(C(=O)c2ccc(N(C)CCC3CCOCC3)nc2)C1 20920784 OXUSAQJTUDQCSG-SFHVURJKSA-N 375.513 2.833 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)NCC2(c3ccc(OC)cc3)CCCC2)C1 1506414579 GERUNWMMBHBFIM-KRWDZBQOSA-N 396.553 2.700 0 50 GFAA O=C(O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc2c(c1)CCC(=O)N2 140246354 UMXPKWDBDQIKKK-UHFFFAOYSA-N 388.370 2.967 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)N1CCCC2(CCNCC2)CC1 67869131 HQVWYKSUZBTGHS-UHFFFAOYSA-N 382.508 2.559 0 50 GFAA O=C(Cc1cnc2ccccc2c1)N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O 252498492 RDEATQRGKXDQNG-HXUWFJFHSA-N 377.419 2.834 0 50 GFAA O=S(=O)(Nc1cc(-c2cccnc2)n[nH]1)c1cnn(Cc2ccccc2)c1 151434748 HZJQAFKIKNDVFV-UHFFFAOYSA-N 380.433 2.517 0 50 GFAA O=C([C@H]1C[C@H]2CC[C@H]1N2C(=O)C1CCC(F)(F)CC1)N1CC[C@]2(CCOC2)C1 253418940 FTLLIGJJQXZSGM-YZLZLFLDSA-N 396.478 2.830 0 50 GFAA O=C(c1ccnc(N2CCO[C@H](c3ccc(Cl)cc3)C2)c1)N1CCOCC1 71749607 IGPKFPNJGGYFBT-SFHVURJKSA-N 387.867 2.785 0 50 GFAA Cc1cn2cc(C(=O)N(C)CCO)cc(N[C@@H]3CCOc4cccc(C)c43)c2n1 34893072 YBHKBMJREUZHOV-QGZVFWFLSA-N 394.475 2.951 0 50 GFAA in-vitro COc1ccccc1CN1CCN(C(=O)c2cccc(OCC(F)F)n2)CC1 126333395 XJHBUEVAKLWISX-UHFFFAOYSA-N 391.418 2.692 0 50 GFAA Cn1cc(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c(-c2ccoc2)n1 363754402 UCLYSYNPIACKAI-GOSISDBHSA-N 378.476 2.975 0 50 GFAA CC[C@H](NC(=O)c1ccc2c(c1)nc(N1CCOCC1)n2C)c1ccncc1 219014539 WBSGEDJFCGTSHE-KRWDZBQOSA-N 379.464 2.686 0 50 GFAA Cc1ccc(-c2ccno2)cc1S(=O)(=O)N1CCO[C@@H](C(F)(F)F)C1 71639606 DUJLCWGHWOWWNK-CQSZACIVSA-N 376.356 2.602 0 50 GFAA C[C@@H]1[C@H](C(=O)O)CCCN1C(=O)c1ccc(S(=O)(=O)c2ccccc2)s1 263350077 PODFPOQHUYZQBF-TZMCWYRMSA-N 393.486 2.906 0 50 GFAA Cc1ccc(N2CCCN(C[C@@H](O)Cc3ccccc3C(F)(F)F)CC2)nn1 246228222 WOYDTAYKJHWCAK-KRWDZBQOSA-N 394.441 2.920 0 50 GFAA O=C(NCCCN1CCC(O)CC1)N1CCC(Cc2ccc(F)cc2)CC1 426519037 XSXNQQHLQLURFK-UHFFFAOYSA-N 377.504 2.637 0 50 GFAA Cn1nccc1[C@@H](O)c1cc2n(n1)CCCN(c1nc3ccccc3s1)C2 223397346 DBOHMODPQLHAFD-SFHVURJKSA-N 380.477 2.718 0 50 GFAA CN1CCO[C@@H]2CCN(C(=O)Nc3nnc(-c4cccc(Cl)c4)s3)C[C@@H]21 499180360 OZQQHCKLJLXJPA-UONOGXRCSA-N 393.900 2.795 0 50 GFAA CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CC(=O)N(C)c3ccccc32)cc1 178199408 NAKYDVRFHVIBHM-MRXNPFEDSA-N 380.444 2.985 0 50 GFAA COCCn1cnnc1[C@H](C)NC(=O)c1ccc(-c2cccc(CO)c2)cc1 426379716 LJELTCMQCYEEIR-HNNXBMFYSA-N 380.448 2.575 0 50 GFAA Cc1nc(N(C)C)ncc1C(=O)N1CCC(c2nc3ccccc3n2C)CC1 95357467 AJAKYNQVCHRNOM-UHFFFAOYSA-N 378.480 2.758 0 50 GFAA CN(Cc1nc(O)c2ccccc2n1)C(=O)N[C@@H](Cn1ccnc1)C(C)(C)C 426527092 WRZNCSPFRJVOQY-INIZCTEOSA-N 382.468 2.788 0 50 GFAA O=C(c1cccc(OC2CCN(Cc3ccncc3)CC2)c1)N1CCCNCC1 95505376 KGXDAPGFTGYFBM-UHFFFAOYSA-N 394.519 2.561 0 50 GFAA CCC[C@H](NC(=O)c1cnc(COc2ccccc2)nc1O)c1nccn1C 91493545 BIPKTLVWALUNKY-INIZCTEOSA-N 381.436 2.766 0 50 GFAA CCn1c(=O)oc2cc(NC(=O)NC3CCN(Cc4ccco4)CC3)ccc21 97155616 AALDMUHHRBTXHI-UHFFFAOYSA-N 384.436 2.994 0 50 GFAA COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC(O)(c3ccc(F)cc3)CC1)C2 95508579 SXCROQATPVAWGG-INIZCTEOSA-N 385.435 2.896 0 50 GFAA CCc1cc(N2CCC(NCc3cnn(C)c3)CC2)nc(N2CCCCC2)n1 95512118 ZROYXEBQZZKBJG-UHFFFAOYSA-N 383.544 2.521 0 50 GFAA COCCN(Cc1cccc(OC)c1)C(=O)[C@@H]1CCC(=O)N(C2CCCC2)C1 91793042 KVKGVMHVZNXIDB-GOSISDBHSA-N 388.508 2.851 0 50 GFAA Cc1cc(C(=O)NCCn2c(C)cc3ccccc32)cc(S(N)(=O)=O)c1C 97759301 XDQOHCOACGEWSC-UHFFFAOYSA-N 385.489 2.644 0 50 GFAA Cn1ccnc1[C@@H](NC(=O)Nc1cc(Cl)c2c(c1)NC(=O)CO2)C1CC1 95508043 GNVFNDOFALGPAV-AWEZNQCLSA-N 375.816 2.677 0 50 GFAA COCCCN1CC2(CCN(Cc3noc(-c4ccccc4)n3)CC2)CC1=O 95363642 LYEOPINAUDCKLT-UHFFFAOYSA-N 384.480 2.588 0 50 GFAA COc1ccc(-c2csc3ncn([C@@H]4CCN(C)C4=O)c(=O)c23)c(OC)c1 584901809 AWVPMZFPPIYTDN-CQSZACIVSA-N 385.445 2.545 0 50 GFAA NCC1(c2ccc(C(=O)N3CCOC[C@@H]3c3cc(F)cc(F)c3)cn2)CCC1 1875276670 OCGCNTHVGCRNDU-GOSISDBHSA-N 387.430 2.954 0 50 GFAA COc1cc2c(cc1OC)[C@H](C)N(S(=O)(=O)c1ccn(C(C)C)n1)CC2 1875290586 RCYJZVZZGQDRFO-ZDUSSCGKSA-N 379.482 2.789 0 50 GFAA O=C(NCc1nc(C(F)(F)F)no1)[C@@H]1[C@H]2CC[C@@]1(c1ccnn1C1CCC1)C2 1875393738 RGEJAWBWTFUDOZ-NCHVAJSOSA-N 395.385 2.994 0 50 GFAA Cc1cc(Br)ccc1NCC(=O)NC[C@@H](CCO)c1ccncc1 1875320362 AFRBYXPYBZAYQB-OAHLLOKOSA-N 392.297 2.847 0 50 GFAA Cc1noc(C)c1C(=O)NCC1CCN(C(=O)Cc2nc3ccccc3o2)CC1 952979471 PYWZEVGQZOBQQU-UHFFFAOYSA-N 396.447 2.644 0 50 GFAA Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)OCc1cnoc1C1CC1 170591587 ITDROEJZZZHPLV-UHFFFAOYSA-N 376.434 2.658 0 50 GFAA CCOc1ccc(S(=O)(=O)N2CC[C@H](OCc3csc(C)n3)C2)cc1 170619737 CRRWJCNIZRRGLK-INIZCTEOSA-N 382.507 2.830 0 50 GFAA Cc1nn(Cc2ccccc2)c2sc(C(=O)N3CCC[C@H]4C(=O)NC[C@@H]43)cc12 170609921 YIXOMQOITNMJMP-WBVHZDCISA-N 394.500 2.805 0 50 GFAA CC[C@H](C(=O)N1C[C@H](OC)C[C@@H]1c1nc(-c2cccnc2)c[nH]1)N(CC)CC 170682991 SAISANLBZVYLDZ-BHIYHBOVSA-N 385.512 2.881 0 50 GFAA CC(C)Oc1cccc([C@H](O)CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c1 172083932 WBGKYIJJBXDWMQ-NHCUHLMSSA-N 396.487 2.928 0 50 GFAA C[C@@H](C(=O)N1CCCC1)N1CCN(Cc2cccc(CN3CCCCC3)c2)CC1 411319879 ATSDQXLVSZJAFT-NRFANRHFSA-N 398.595 2.801 0 50 GFAA O=C1C[C@]2(CCN(C(=O)NCCc3ccc4c[nH]nc4c3)C2)Oc2ccccc21 413533056 OFLLKIRHCUTJKO-QFIPXVFZSA-N 390.443 2.925 0 50 GFAA O=C1C[C@H](c2ccccc2)N(C(=O)CCCc2ccc3c(c2)CC(=O)N3)CCN1 225547911 MLIWDBVDYZSHJG-HXUWFJFHSA-N 391.471 2.594 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)s1 189491928 IVJPLIUBYGKZII-CYBMUJFWSA-N 394.522 2.522 0 50 GFAA CS(=O)(=O)c1ccc(CC(=O)N2CCC([C@H](O)c3cccs3)CC2)cc1 1506424173 ZHSXRPBFDISKJB-IBGZPJMESA-N 393.530 2.666 0 50 GFAA O=S(=O)(c1ccc(-c2cc(C(F)(F)F)n[nH]2)o1)N1CC(c2ccncc2)C1 1506409625 JAYDTAUWTJIFOZ-UHFFFAOYSA-N 398.366 2.872 0 50 GFAA COc1ccc(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)c(C)c1 1529190709 MVZWOMVKDVJELO-FGZHOGPDSA-N 387.476 2.955 0 50 GFAA Cc1cnc(C)c(-c2ccc(F)c3c2O[C@H](CNC(=O)[C@H]2CCCCN2C)C3)n1 12048829 ASWPVLVKKWZZPD-HNAYVOBHSA-N 398.482 2.804 0 50 GFAA COc1ccc2cc(C(=O)[C@H]3CCCN(S(=O)(=O)N(C)C)C3)ccc2c1 12437370 AWRIJRJNRKRHNO-KRWDZBQOSA-N 376.478 2.550 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cs2)no1 16649302 UGHGJNDRVDQJPX-QWRGUYRKSA-N 383.495 2.963 0 50 GFAA COCCc1cc(NC(=O)N[C@H](c2ccc(OC)c(F)c2)C(F)F)n(C)n1 252499085 RVHDDBAVHBAXPL-OAHLLOKOSA-N 386.374 2.885 0 50 GFAA CCn1nc(C)c(S(=O)(=O)N2c3ccc(C)cc3[C@H]3CN(C)CC[C@H]32)c1C 266228512 RGDDEOYQJPEDAD-IEBWSBKVSA-N 388.537 2.825 0 50 GFAA COCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(Br)cc1 2755581 SMOCIIIXVSVKPS-CQSZACIVSA-N 383.242 2.609 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 12317317 ILMUJQAEJSBEIA-MRXNPFEDSA-N 393.447 2.526 0 50 GFAA Cn1nc(-c2ccccn2)cc1NC(=O)c1ccc(CSc2nc[nH]n2)o1 2100540345 IMPWEVMVSZXSBT-UHFFFAOYSA-N 381.421 2.738 0 50 GFAA Cc1ccccc1N1C(=O)CN(C(=O)c2ccc(N3CCOCC3)cc2)C[C@@H]1C 11791470 JYJRVSNZSGCFFU-SFHVURJKSA-N 393.487 2.709 0 50 GFAA NCc1cccc(-c2cccc(C(=O)N3CCC[C@@H](Cn4ccnn4)C3)c2)c1 2325778684 JXTGKNSDQWNINC-GOSISDBHSA-N 375.476 2.956 0 50 GFAA O=C1CS(=O)(=O)c2cc(NC(=O)C3CC(c4ccc(F)cc4)C3)ccc2N1 874889008 IVJQGBDXIRZFSV-UHFFFAOYSA-N 388.420 2.684 0 50 GFAA O=S(=O)(c1c[nH]c2nccc(Cl)c12)N1CCC(CO)(C(F)(F)F)CC1 921780065 BNGWJJRPSNHRNX-UHFFFAOYSA-N 397.806 2.542 0 50 GFAA COc1ccc(OC)c(NC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c1 940057 CEIRNSGDIHQOSL-SFHVURJKSA-N 382.416 2.963 0 50 GFAA CCN(CC(=O)NCc1ccccc1OC)S(=O)(=O)c1ccc(Cl)cc1 1061479 JREUPACEEOLJLU-UHFFFAOYSA-N 396.896 2.676 0 50 GFAA COc1ccc(C(=O)Nc2ccccc2C(=O)NCCCn2ccnc2)cc1 1836151 RAVKTZMJCZOEMO-UHFFFAOYSA-N 378.432 2.964 0 50 GFAA COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC3(CC2)OCCc2cccc(OC)c23)C1 2356138213 IHFLDNTZFZJKIS-DLBZAZTESA-N 387.476 2.675 0 50 GFAA CCOc1ccc([C@@H](C)NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1 2851076 FWWQSISCVPFVDH-GFCCVEGCSA-N 379.507 2.780 0 50 GFAA Cc1ccc(NC(=O)CC(=O)NCCc2nc(C)cc(C(F)(F)F)n2)cc1 55119960 PCWIOWITEFAXFT-UHFFFAOYSA-N 380.370 2.800 0 50 GFAA COc1ccc(C(=O)N[C@@H](NC[C@@H]2CCCO2)C(Cl)(Cl)Cl)cc1 24302612 UTFWYWCXRCOFDK-GXTWGEPZSA-N 381.687 2.890 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)C12CCC2 152497102 VWOMVCPSBZHZLN-ZWKOTPCHSA-N 385.439 2.758 0 50 GFAA NC(=O)c1cccnc1N1CCN(c2nc(-c3ccc(F)cc3)cs2)CC1 301611714 RRUSCDGCOYQJEG-UHFFFAOYSA-N 383.452 2.770 0 50 GFAA C[C@@H](CN(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 253420428 WDTIMRQOOAMQAZ-PXNSSMCTSA-N 383.492 2.590 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCCN(C3CCN(Cc4ccccc4)CC3)C2)on1 71388541 LOAQTZBRMKOBNL-FQEVSTJZSA-N 396.535 2.976 0 50 GFAA O=C(NO)c1ccc(Cn2cc(-c3ccc(CN4CCCC4)cc3)nn2)cc1 68250154 MTAWGBVDXCFYOF-UHFFFAOYSA-N 377.448 2.708 0 50 GFAA NC(=O)C1CCN(C(=O)Cn2ccc3ccc(OCc4ccccc4)cc32)CC1 36359024 JAAQGZGVEUSERP-UHFFFAOYSA-N 391.471 2.944 0 50 GFAA O=C(c1cn(C2CCNCC2)nn1)N1CCC(c2nc3ccccc3s2)CC1 237917193 GOZPMDBUKCTJAS-UHFFFAOYSA-N 396.520 2.832 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCO[C@H](C2CC2)C1 157030116 XTNREYIMKPIGFL-CABCVRRESA-N 392.912 2.961 0 50 GFAA CCS(=O)(=O)c1ccccc1N1CCC[C@@H](CNC(=O)c2ccco2)C1 374539472 WYMGQCXOBKBROX-HNNXBMFYSA-N 376.478 2.720 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)c3ccccc3O)C2)CN1Cc1ccccn1 72447864 OZBJEOBKUDOGBJ-QFIPXVFZSA-N 379.460 2.832 0 50 GFAA CCOC(=O)[C@]12CCCN[C@@H]1CCN(C(=O)C1=Cc3ccccc3OC=C1)C2 72143185 JXYMFWZGABSGNZ-KNQAVFIVSA-N 382.460 2.510 0 50 GFAA O=C(O)C[C@H](c1ccc(OC(F)(F)F)cc1)c1c(O)nc2ccccn2c1=O 218252496 JIPNPPZXAAGYGJ-GFCCVEGCSA-N 394.305 2.905 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(NC[C@@H]3CC=CCC3)cc12 14536677 YFDFUWKITVMKBP-CYBMUJFWSA-N 386.452 2.713 0 50 GFAA O=C(c1c(O)cccc1O)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2=O)C1 426489537 KLDCCOUKLZSGQZ-QFIPXVFZSA-N 398.434 2.892 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3C[C@@H](NS(C)(=O)=O)[C@H](C(C)C)C3)oc2c1 82126200 KRHAMKOEQDEPKJ-JKSUJKDBSA-N 378.494 2.695 0 50 GFAA Cc1cnccc1N1CCCN(C(=O)N[C@H]2CC(=O)Nc3ccccc32)CC1 426701696 UJGREKQDLYACEC-SFHVURJKSA-N 379.464 2.695 0 50 GFAA CNC(=O)Cc1ccc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)cc2)cc1 426684027 ZRBFLEJUXLYFQA-OAQYLSRUSA-N 377.488 2.562 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)c2ccc(O)cc2)CC3)cn1 91985942 UMMMMCOKXSXZKD-UHFFFAOYSA-N 394.475 2.536 0 50 GFAA CC(=O)N1CCO[C@H](CNC(=O)Nc2ccc(Oc3ccccc3F)cc2)C1 97574909 KRLPJCXIJHEYLF-QGZVFWFLSA-N 387.411 2.987 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@H]1CCNC1)CC2 95530882 ROLYVRAPGIHVKI-KRWDZBQOSA-N 381.451 2.501 0 50 GFAA Cc1ncsc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3ccccn3)C2)C1 95506399 ZYZLDRYELUWEBF-NRFANRHFSA-N 398.532 2.934 0 50 GFAA COc1ccccc1Oc1ccc(NC(=O)NCCN2CCCOC2=O)cn1 96161718 BYPHVCFDOGCHOY-UHFFFAOYSA-N 386.408 2.846 0 50 GFAA COc1ccc(CCN(CC2CCN(C)CC2)C(=O)c2cnc(C)nc2)cc1 95520350 KBLJMVFHXMKGLP-UHFFFAOYSA-N 382.508 2.820 0 50 GFAA O=C(Nc1ccc(-n2cncn2)cc1)N(Cc1ccncc1)C[C@H]1CCCO1 95497489 TUUXFDPRAXFRNF-LJQANCHMSA-N 378.436 2.875 0 50 GFAA CCOc1c(Cl)cccc1NC(=O)N1CCC[C@H]1C(=O)N1CCOCC1 97514303 OVOXFKPYJLARDW-HNNXBMFYSA-N 381.860 2.594 0 50 GFAA COc1ccc([C@@H](O)Cn2ccn3nc(-c4cccc(OC)c4)cc3c2=O)cc1 263616398 ILRZOOWCBDEYSR-NRFANRHFSA-N 391.427 2.914 0 50 GFAA O=C1C[C@@H](C(=O)NC[C@@H]2Cc3cccc(-c4cncnc4)c3O2)c2ccccc21 299759955 REAUDBHKDYAPCM-OXJNMPFZSA-N 385.423 2.934 0 50 GFAA CC(C)c1noc([C@H](C)NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)n1 670457263 RDTUEIRRTOAVEU-QMMMGPOBSA-N 392.765 2.904 0 50 GFAA CCc1ccc([C@@H](NC(=O)C[C@H](NC(C)=O)C(=O)O)c2cccc(F)c2)cc1 1875306034 QIWMXKJZNHUYFC-AZUAARDMSA-N 386.423 2.573 0 50 GFAA CC1(C)[C@@H](CN)CC[S@@]1(=O)=NC(=O)c1csc(Nc2ccccn2)n1 1875358853 LRUBWIHNUYHBJF-NDHGSNPTSA-N 379.511 2.647 0 50 GFAA C=CC(=O)N(CC)CC(=O)N[C@H](Cc1nccn1C(F)F)c1ccccc1 1875367206 NVVQRZKICRSJJQ-OAHLLOKOSA-N 376.407 2.713 0 50 GFAA COc1c(C(=O)N2CC[C@@H](c3cc(O)nc(O)n3)C2)sc(Cl)c1Cl 1875274433 PRZYZNFPKUWBBR-ZCFIWIBFSA-N 390.248 2.894 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)Nc2ccc3oc(C)cc3c2)o1 952973959 POBLNIWIMPDSKP-SFHVURJKSA-N 381.432 2.972 0 50 GFAA O=C(NC[C@H]1CCCN(C(=O)c2cccc3c2OCCO3)C1)c1ccsc1 952982040 VWZXZHGAYKEBCV-CQSZACIVSA-N 386.473 2.802 0 50 GFAA Cc1ccc(C2(C(=O)N[C@H]3CCN(Cc4csc(C)n4)C[C@@H]3O)CC2)cc1 1565508980 XHGJSLXFOPWXPK-OALUTQOASA-N 385.533 2.543 0 50 GFAA COc1cccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)c1C 1565525756 SHXDYYDXSGWDPP-AEFFLSMTSA-N 379.460 2.775 0 50 GFAA CS(=O)(=O)N[C@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1C(F)(F)F 170596464 GQHKJTJZRFWSQH-STQMWFEESA-N 379.404 2.687 0 50 GFAA CC(C)OC(=O)N1CCC(OC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)CC1 170626311 IDEUKOOLPRWQRM-OAHLLOKOSA-N 378.400 2.804 0 50 GFAA CC1(C)CCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CCS1(=O)=O 194810483 GLPAKWAJVAXLMJ-AWEZNQCLSA-N 392.443 2.769 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12 1529186892 MILHXUBEJUZUKO-XLIONFOSSA-N 390.439 2.880 0 50 GFAA CCCC(=O)N1CCC(N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)CC1 1616077290 OCLCQCOWQOEXRL-AVRDEDQJSA-N 381.520 2.861 0 50 GFAA CN1CCC[C@@H](c2nc(-c3cn(C)c4ccccc34)n(-c3cnn(C)c3)n2)C1 1772815960 AUGXRRGTSAKJOB-OAHLLOKOSA-N 375.480 2.969 0 50 GFAA CC[C@H](CO)NCc1ccc(OCC(=O)N[C@@H](C)c2ccccc2)c(OC)c1 5027775 AVRKSDIAESDLTH-QFBILLFUSA-N 386.492 2.812 0 50 GFAA COCCCNCc1ccc(OC)cc1OC[C@@H](O)CN1CCCCCCC1 11878505 KSKMPTQHXJNEGP-FQEVSTJZSA-N 394.556 2.827 0 50 GFAA Cc1ccn(CCC(=O)NC[C@@H]2Cc3cc(-c4cnccn4)cc(Cl)c3O2)n1 11995793 FVAUTZPRSPCHDD-INIZCTEOSA-N 397.866 2.812 0 50 GFAA COc1ccc2c(=O)c(Oc3ccc(C(=O)N4CCN(C)CC4)cc3)coc2c1 12391551 BHPVAPDLBIRJLN-UHFFFAOYSA-N 394.427 2.982 0 50 GFAA biogenic COC(=O)c1ccc(-c2nc(CN(C[C@@H]3CCC(=O)N3)C(C)C)c(C)o2)cc1 12439924 SEDLFLZTZAXWDH-KRWDZBQOSA-N 385.464 2.926 0 50 GFAA O=C(c1cn(CCC2CCCCC2)nn1)N1CCC(N2CCSCC2)CC1 12441520 XQOFWJZLDYVWTG-UHFFFAOYSA-N 391.585 2.902 0 50 GFAA O=C(NCc1nc2ccccc2s1)[C@@H]1CCC(=O)N(Cc2ccccn2)C1 12447942 ZUEFYJXZHIVMDV-CQSZACIVSA-N 380.473 2.746 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)N(C)Cc3ccccn3)CCC2=O)cc1 12449504 KZPSWCSZZABLCS-GOSISDBHSA-N 381.476 2.530 0 50 GFAA COc1cc(CNCCc2cccc(C)n2)ccc1OC[C@@H](O)CN1CCCC1 15068094 CCMWEUZJBFTFHN-NRFANRHFSA-N 399.535 2.566 0 50 GFAA COc1ccc(CN2CCN(c3ccc(F)cn3)[C@H](C)C2)cc1Cn1cncn1 1857674324 DEZLVJWVGQPWRW-MRXNPFEDSA-N 396.470 2.580 0 50 GFAA CCCC(=O)N1CC[C@]2(C1)Cn1c(nnc1Cc1c[nH]c3ccccc13)CO2 1857684373 LNLHMCDYLMGHQB-NRFANRHFSA-N 379.464 2.652 0 50 GFAA Cc1nc2c(c(=NC[C@@H]3CCOC3)[nH]1)CCC21CCN(c2ncccc2F)CC1 1857685221 DUZWTEIPTYMHRD-INIZCTEOSA-N 397.498 2.674 0 50 GFAA Cc1cccc(CC(=O)N2CC[C@@H](O)[C@]3(CCCN(C(=O)c4ccco4)C3)C2)c1 1857689788 XZYBLEAADQHRHE-NFBKMPQASA-N 396.487 2.646 0 50 GFAA O=C1OC[C@@]2(Cc3ccccc3)CN(c3ccc(Cn4ccnc4)cn3)CCN12 1857698072 VPVNFXRVPMOMJX-JOCHJYFZSA-N 389.459 2.580 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCCn3cccn3)C1)CC2 1857698318 LKYXDQHUNIYNDI-JOCHJYFZSA-N 397.523 2.963 0 50 GFAA Cc1nc(N2CCOCC2)sc1C(=O)N[C@H](Cn1cccn1)c1ccccc1 1857719533 NXYNGLLYYYLGFG-QGZVFWFLSA-N 397.504 2.656 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@]23CC[C@H]1O3)c1cscn1 1857720521 YBQSOTFMWFNUSK-IXIUHKBRSA-N 387.480 2.692 0 50 GFAA CCc1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCc3cnc[nH]3)C2)cs1 213461097 JSEPJGVJIKYIAX-KDOFPFPSSA-N 386.521 2.729 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N2CC[C@H](N)C[C@@H]2C)cc1Cl 237199578 OHLPVXQOQYASSV-IUCAKERBSA-N 397.722 2.611 0 50 GFAA CCc1cc(=O)[nH]c(-c2ccc(CN3CCC(c4nncn4C)CC3)cc2)n1 23429884 DJBBVVCRABCQSP-UHFFFAOYSA-N 378.480 2.507 0 50 GFAA N[C@@H]1CC[C@H](C(=O)Nc2cc3c(cc2NC(=O)c2cccs2)OCCO3)C1 262610154 ARPLZXSENRSXJO-NWDGAFQWSA-N 387.461 2.838 0 50 GFAA CCCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)N[C@@H](C)CC(=O)N3)c1 906231228 QKPGNGVRNQSJMY-AWEZNQCLSA-N 394.475 2.899 0 50 GFAA COc1ccc(NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1OC 840100 LWMSMDUIHGKIMW-UHFFFAOYSA-N 398.868 2.762 0 50 GFAA CCN1C(=O)[C@@H](CC(=O)Nc2ccc(OC)cc2)N(Cc2ccco2)C1=S 1112397 NHWOYRRCLXNRCZ-MRXNPFEDSA-N 387.461 2.635 0 50 GFAA COc1ccc(OCC(=O)NC(=S)Nc2ccc(C(=O)O)c(Cl)c2)cc1 1159237 OFJYKJXAPZKDGH-UHFFFAOYSA-N 394.836 2.939 0 50 GFAA CN1CCC(Oc2ccc(Nc3nccc(N4CCC[C@H](O)C4)n3)cc2)CC1 2356134058 VYSWAPOASYWRII-KRWDZBQOSA-N 383.496 2.654 0 50 GFAA Cc1cc(Cl)ccc1OCC(=O)N1CCC[C@@]2(CCc3c[nH]c(=N)nc32)C1 2356136140 IBNIPJXTGAECSX-HXUWFJFHSA-N 386.883 2.736 0 50 GFAA CC(=O)c1cccc(N(CC(=O)NCCC2=CCCCC2)S(C)(=O)=O)c1 2877594 LVHJJSZOGWMKCD-UHFFFAOYSA-N 378.494 2.662 0 50 GFAA O=C(N[C@H]1CCN(c2ccccc2)C1)c1cc2c(s1)CCOC21CCNCC1 2356159660 LYFIEIVZOXFACD-INIZCTEOSA-N 397.544 2.908 0 50 GFAA Cc1cc(C)n(-c2cc(N3CCN(C(=O)c4ccccc4)CC3)nc(C)n2)n1 67602081 CXRPJZRHFCZTQM-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA CSCC(=O)N1CCC[C@@H]1c1ccc(C(=O)NCCCn2cccn2)s1 20917016 CVGGDMXZBGZWCQ-CQSZACIVSA-N 392.550 2.791 0 50 GFAA O=C(O)CCC/C=C\C[C@H]1[C@@H](O)C[C@@H](O)[C@@H]1/C=C/[C@H](O)COc1ccsc1 4214444 FYBFDIIAPRHIQS-XQJFFQQESA-N 396.505 2.603 0 50 GFAA in-man CN(C[C@@H]1CCCCO1)C(=O)c1cc2n(n1)CCCN(Cc1ccccc1)C2 65433458 LIHYLWAZJJJSDS-FQEVSTJZSA-N 382.508 2.930 0 50 GFAA CN1CCN(c2ccc(NC(=O)c3ccc(CN4CCOCC4)cc3)cc2)CC1 65362880 VOYRZMCEEUUMGR-UHFFFAOYSA-N 394.519 2.523 0 50 GFAA CN1CCC[C@@H]1CCN1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1 120172159 OMAHFYCIQGGIRO-CQSZACIVSA-N 391.990 2.582 0 50 GFAA CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)C1CCN(c2cnccn2)CC1 121183118 HDGNEJGJFUJRKA-UHFFFAOYSA-N 376.464 2.742 0 50 GFAA Cc1nn(CCCNC(=O)c2ccc3c(c2)OCO3)c(C)c1Br 2800112 DBWPCMDUMGKDKJ-UHFFFAOYSA-N 380.242 2.811 0 50 GFAA O=C1C[C@@H](NCc2ccccc2Cn2cccn2)CN1Cc1ccc(F)cc1 12581309 AXFXAIFQPMCKMO-OAQYLSRUSA-N 378.451 2.961 0 50 GFAA COCc1noc(CN[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)n1 366426215 YJDOHVGNLPHONC-APWZRJJASA-N 399.422 2.896 0 50 GFAA Cc1cc([C@H]2CN(C(=O)C3CCN(c4ncccn4)CC3)CCO2)ccc1F 128592760 GJAIBYPBDWQRBL-LJQANCHMSA-N 384.455 2.741 0 50 GFAA COCc1nc(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2Cl)n(C)n1 864097098 KJEJMFRGUVNZFA-ZETCQYMHSA-N 377.754 2.520 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCCC(=O)O)(Cc2ccccc2)c2ccccc21 71758870 XJQCRUQJYODUDT-JOCHJYFZSA-N 380.444 2.515 0 50 GFAA NC(=O)c1noc(CN2CCC[C@@H](C(=O)c3ccc4c5c(cccc35)CC4)C2)n1 71614150 DAYGDSORTJULCX-OAHLLOKOSA-N 390.443 2.515 0 50 GFAA O=C(CCN1CCC[C@]2(CCC(=O)N(Cc3ccccc3)C2)C1)N1CCCC1 72458236 FJEKJRLESIZVDD-QHCPKHFHSA-N 383.536 2.904 0 50 GFAA Cc1nc(NCCNC(=O)Nc2ccccc2F)cc(-n2cnc(C)c2C)n1 72119328 JLRPSENGGIHQTF-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA NC[C@H]1CCN(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)C1 178525502 BIHIUUDIBJKSHN-CSHXORCISA-N 387.487 2.814 0 50 GFAA Cc1nc(CCN(C)C(=O)N[C@H](CCn2ccnc2C)c2ccccc2)no1 426398032 JBTIVULLOOJAFO-GOSISDBHSA-N 382.468 2.898 0 50 GFAA Cc1nc(CSc2nnc(C3CCNCC3)n2C[C@@H]2CCCO2)cs1 426521139 BYPUQOXROPYHIJ-HNNXBMFYSA-N 379.555 2.981 0 50 GFAA O=C(NC[C@H]1CCCS1(=O)=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 179638295 CDEIYTVZPGPKMU-GOSISDBHSA-N 386.473 2.987 0 50 GFAA O=C(Nc1ccccc1F)N1CC[C@@]2(CCCN(C3CCOCC3)C2=O)C1 91620738 GZHOVLIEVPBLMH-FQEVSTJZSA-N 375.444 2.851 0 50 GFAA COc1c[nH]c(C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCCC2)cc1=O 97515109 PTFWNADPEKYZQW-MRXNPFEDSA-N 375.856 2.604 0 50 GFAA O=C(CN1C[C@H](Cc2ccccc2)CC1=O)N1CC(OCc2ccccc2)C1 95522442 PUTBHYUUBSAOPC-HXUWFJFHSA-N 378.472 2.505 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC[C@@H](c2nccn2Cc2cscn2)C1 95527036 ZZFJLIGZCNBGAV-MRXNPFEDSA-N 384.509 2.840 0 50 GFAA O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)CCc1nc(-c2cccs2)no1 268953536 SDDYLLYJGXNAOI-AWEZNQCLSA-N 383.429 2.769 0 50 GFAA COc1ccc([C@@H](CC(=O)O)NC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)cc1OC 268948294 RDTDHBPDGSFUHU-OXQOHEQNSA-N 399.443 2.956 0 50 GFAA CC(=O)N1CCO[C@@H](CNC(=O)Nc2ccc(Oc3ccccc3F)cc2)C1 97574910 KRLPJCXIJHEYLF-KRWDZBQOSA-N 387.411 2.987 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2n[nH]c(N)n2)cc1 91780039 KQQVKRYHCOVVGF-HNNXBMFYSA-N 379.468 2.678 0 50 GFAA CCCSCC(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91725245 IFGXPMFJGCYRKF-UHFFFAOYSA-N 389.565 2.999 0 50 GFAA CCCCc1nc(C)cc(NCCNC(=O)N2C[C@@H]3CC[C@H](C2)[C@@H]3OC)n1 534676079 PFOFFMVWPUBHGI-MNZLEMJZSA-N 375.517 2.606 0 50 GFAA CCOc1cccc(CN[C@@H]2CNC(=O)c3cc(-c4ccc(OC)cc4)nn32)c1 263617966 QRKKWMVEHUANKN-NRFANRHFSA-N 392.459 2.989 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)c2ccc(O)nc2)CC1 1940197330 IEALHWWOUALUJV-UHFFFAOYSA-N 382.464 2.701 0 50 GFAA C[C@@H](Oc1ccccc1CN1CCN(c2ccc(Cl)cn2)CC1)C(=O)O 825563764 BGYANFFBYGINNL-CQSZACIVSA-N 375.856 2.909 0 50 GFAA CCc1nn(C)c(Cl)c1CN1CCC[C@@H](CNC(=O)c2cc(C)on2)C1 823560253 FYJARWCOKPNJOI-ZDUSSCGKSA-N 379.892 2.574 0 50 GFAA Cc1ccc(CN(C(=O)Cn2nc(C)c([C@@H]3COCCN3C)c2C)C2CC2)o1 952892669 FXUNZXCXLIGKDS-IBGZPJMESA-N 386.496 2.596 0 50 GFAA Cn1cc(NC(=O)c2nc(C(F)(F)F)n3c2CCCC3)c(-c2cnccn2)n1 1875397042 IYTIRZWSLJYEJW-UHFFFAOYSA-N 391.357 2.681 0 50 GFAA N=c1nc(N2CCC[C@@H]2Cc2cccc(F)c2F)[nH]c(=Nc2ccccc2)[nH]1 1875332216 MVJQMVBYNVJDRB-OAHLLOKOSA-N 382.418 2.939 0 50 GFAA CN(Cc1ccc([S@@](C)=O)cc1)C(=O)N[C@@H]1COc2c(F)cc(F)cc2C1 1351563581 KONMKHPIFOBNHN-KUNJGFBQSA-N 394.443 2.847 0 50 GFAA CC[C@@H]1CCCN(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC1 185633082 XDTWQHPROSYAEW-MRXNPFEDSA-N 379.526 2.948 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2c2ncc[nH]2)cc1Cl 277567458 XLLQGNMTLKXWHH-CQSZACIVSA-N 396.900 2.903 0 50 GFAA COc1cc(CNc2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1OC 170624751 HSLJFDCCOASYLA-UHFFFAOYSA-N 380.466 2.575 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@H](CC(=O)O)C1 306213537 LOZVGXQVQVQQAX-HNNXBMFYSA-N 378.425 2.719 0 50 GFAA CNC(=O)c1c(NC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)n[nH]c1C 410285502 LGTIGCJGHOQALX-UHFFFAOYSA-N 383.477 3.577 0 50 GFAA NS(=O)(=O)c1cc(F)cc(NC(=O)Nc2cc(CC3CCCCC3)n[nH]2)c1 192260267 XZXWLOYSLPQZKE-UHFFFAOYSA-N 395.460 2.963 0 50 GFAA Cc1cccc(N(CC(=O)Nc2ccnn2C2CCCC2)S(C)(=O)=O)c1 1506398688 WRBNGKMTXFABSA-UHFFFAOYSA-N 376.482 2.711 0 50 GFAA O=C(c1cc(=O)n(-c2ccccc2)[nH]1)N1CCC([C@@H](O)c2cccs2)CC1 1506425594 BOGKGDNXFAVSIZ-LJQANCHMSA-N 383.473 2.813 0 50 GFAA O=C(c1c(N2CCOCC2)noc1-c1ccccc1)N1CCC[C@H](CCCO)C1 1704307764 DQYJJRHRUQNERG-QGZVFWFLSA-N 399.491 2.803 0 50 GFAA CC[C@@H](C)Cc1nc(CCNC(=O)c2ccc(F)cc2)n(-c2ccnn2C)n1 1772816428 QHIKGEGLAKPKFP-CQSZACIVSA-N 384.459 2.701 0 50 GFAA COc1ccc(-c2cc3c(=O)[nH]nc(-c4cc5ccccc5oc4=O)n3n2)cc1 1775972939 DYNJVOZSGQCHDC-UHFFFAOYSA-N 386.367 2.867 0 50 GFAA COc1cccc2c(C)cc(N3CCCN(C(=O)c4cn(C)nc4C)CC3)nc12 1775981749 OBMVBNQUBJGDMX-UHFFFAOYSA-N 393.491 2.946 0 50 GFAA COc1ccc(CNCCc2ccccn2)cc1OC[C@@H](O)CN(C)C(C)C 12205134 LFLRHDMDSCZPAH-FQEVSTJZSA-N 387.524 2.502 0 50 GFAA O=C1CN(Cc2cc[nH]n2)C[C@H](OCc2ccccc2)CN1C1CCCCC1 14741179 DHHHKDCVKDDIGB-NRFANRHFSA-N 382.508 2.972 0 50 GFAA CSCCNC(=O)c1cn(CC(C)C)cc(C(=O)NC2CCCCC2)c1=O 15071050 KEYDJSARRNBXGY-UHFFFAOYSA-N 393.553 2.660 0 50 GFAA Cc1ccc(CNC(=O)C[C@H]2C(=O)NCCN2CCCc2ccccc2)cc1F 19770155 DKWTXLITMDVOAL-NRFANRHFSA-N 397.494 2.574 0 50 GFAA COc1ccc2[nH]ccc2c1C(=O)N[C@H]1C[C@H](Cn2cc(Cl)cn2)C[C@@H]1O 1857531287 DPFAJUZSWZJXIK-UVBJJODRSA-N 388.855 2.596 0 50 GFAA O=C(O)CN1C[C@@H]2CC[C@H](C1)[C@H]2NC(=O)C1(c2ccc(Cl)cc2)CCC1 1857684035 WQERAINBXFYBKD-ZSBFGKGUSA-N 376.884 2.673 0 50 GFAA O=C(O)Cc1ccc(CN2CCN3C(=O)OC[C@@]3(Cc3ccccc3)C2)cc1 1857689523 RQZFCTAXQMYDPU-JOCHJYFZSA-N 380.444 2.563 0 50 GFAA COCCn1cnnc1Cn1ccnc1-c1cc2ccc(Cl)cc2nc1O 1857694097 AJEKFHRMUDKBCC-UHFFFAOYSA-N 384.827 2.744 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCc4c(O)nc(C5CC5)nc43)C2)cn1 1857713779 NOBRCYQTAOMCCC-NRFANRHFSA-N 380.448 2.583 0 50 GFAA CCn1cc(CN(C)C(=O)[C@H]2CC(=O)N(c3nc4ccc(C)cc4s3)C2)cn1 1857727263 OGQXNKGKBOTSQL-HNNXBMFYSA-N 397.504 2.833 0 50 GFAA Cc1c(C(=O)N2CCC([C@@H](O)CN(C)CC(C)C)CC2)[nH]c2c1C(=O)CCC2 1857730143 KGEPRJDUPBPHOJ-IBGZPJMESA-N 389.540 2.643 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3cccc(O)c3O)C[C@@H]2NC(=O)C2CC2)cc1 220064746 XQVJANXJWPNTLO-MSOLQXFVSA-N 380.444 2.541 0 50 GFAA O=S(=O)(c1ccc(OC[C@@H]2CCOC2)c(F)c1)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 328868116 XGCZOEWCDMTCPX-WBOSRHFRSA-N 395.496 2.908 0 50 GFAA CCC[C@@H]1C(=O)NCCN1C(=O)c1sc(Cc2ccc(F)cc2)nc1C 123141806 OBNFQOQUFVZYRM-OAHLLOKOSA-N 375.469 2.922 0 50 GFAA COc1cccc(N2C(=O)C[C@H](N3CCN(c4ccccc4Cl)CC3)C2=O)c1 19565750 BNQNHZYYGZUXNN-IBGZPJMESA-N 399.878 2.803 0 50 GFAA CCn1cc(Cl)cc1C(=O)N(C)C[C@@H](C)Nc1cc(OC)nc(COC)n1 2325794797 RQJCLSAMTJPBJC-GFCCVEGCSA-N 395.891 2.679 0 50 GFAA COc1ccc2c(c1)[C@H](C)CN(C(=O)c1ccc3c(c1)CC[C@@H](N)C(=O)N3)CC2 2325795564 NECJFKIMBDQQSO-JLTOFOAXSA-N 393.487 2.709 0 50 GFAA O=C(C[C@@H]1Cn2nc3ccccc3c2NC1=O)Nc1ccc2c(c1)CNCCC2 2325857123 QBRPKVVYJJXRSX-MRXNPFEDSA-N 389.459 2.669 0 50 GFAA CCCc1ccccc1S(=O)(=O)N1CCN(C(=O)c2ccc(F)cc2)CC1 1462806694 MOQDQROQIDYJMN-UHFFFAOYSA-N 390.480 2.925 0 50 GFAA COc1ccc(OC)c(NC(=O)C2=C(C)NC(=O)N[C@@H]2c2ccc(O)cc2)c1 909923 FLXKHQXAGCBRDL-GOSISDBHSA-N 383.404 2.676 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)c1ccccc1I 1205677 OHYQHXRJGIZUQG-UHFFFAOYSA-N 381.169 2.950 0 50 GFAA CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCNCCO)c1ccccc1CC2 2963811 NBANXQQLBHBHEY-UHFFFAOYSA-N 397.475 2.990 0 50 GFAA CCOc1ccc([C@@H](CC(=O)O)NS(=O)(=O)c2ccc(C)cc2)cc1OC 4111092 QLRQXDZZOUKNCI-MRXNPFEDSA-N 393.461 2.897 0 50 GFAA Cc1ccc(S(=O)(=O)Cc2nnnn2-c2ccc(Br)cc2)cc1 6759181 AWUBNRHLNKFMCJ-UHFFFAOYSA-N 393.266 2.707 0 50 GFAA CCc1ccc(CN2CCC3(CC[C@@H](CNC(=O)[C@H]4CCCO4)O3)CC2)o1 11966631 QECGDOWTEFFQFL-PKOBYXMFSA-N 376.497 2.651 0 50 GFAA O=C(NCCn1ccnc1)[C@H]1CC12CCN(Cc1cc3ccccc3[nH]1)CC2 12148835 OSRNWDDFTQGDQJ-LJQANCHMSA-N 377.492 2.783 0 50 GFAA O=C(Nc1ccc2c(c1)CN(C(=O)c1[nH]nc3c1CCCC3)CC2)[C@H]1CCCO1 12317792 QJDSJOILTOPICB-LJQANCHMSA-N 394.475 2.605 0 50 GFAA COc1ccc(OCc2cc(C(=O)N[C@@H](C)c3ccncn3)n[nH]2)c(Cl)c1 12434348 CJPSYRROLRZENW-NSHDSACASA-N 387.827 2.932 0 50 GFAA Cc1cc(CNC(=O)CCc2nnc(CCCCc3ccccc3)o2)nn1C 12437654 KEGYZPUCGGYCSP-UHFFFAOYSA-N 381.480 2.926 0 50 GFAA COc1cc(CNC2CCCCCC2)ccc1OC[C@@H](O)CN1CCOCC1 15069513 CKKZUHJILSPZKK-FQEVSTJZSA-N 392.540 2.580 0 50 GFAA COc1ccc2[nH]c3c(c2c1)CN(C(=O)CCC(=O)NCc1cccnc1)CC3 20762468 GTVROHKRGKQIEN-UHFFFAOYSA-N 392.459 2.553 0 50 GFAA biogenic O=S(=O)(/C=C/c1ccccc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 22107261 WIGLVPMFKHTYBS-MDWZMJQESA-N 386.473 2.534 0 50 GFAA CNc1ncc(-c2cc(C(=O)N3CCOCC3)c3cc(Cl)ccc3n2)cn1 23192578 VQRYFHCPQKPEJI-UHFFFAOYSA-N 383.839 2.859 0 50 GFAA O=C(Nc1ccc(F)cc1F)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528323 UQOPTNHIFNZBFA-UHFFFAOYSA-N 388.422 2.709 0 50 GFAA COC(=O)C[C@@H]1CC(=O)[C@@H]2C(=O)c3c(OC)ccc(Br)c3[C@H]2C1 55529250 KIBDKRPJUGKECL-IQMYEBEASA-N 381.222 2.896 0 50 GFAA O=C(NC[C@H](O)c1ccccc1Cl)c1ccc(CSc2ncn[nH]2)o1 55569083 CIQQNLVIQPKYMR-ZDUSSCGKSA-N 378.841 2.807 0 50 GFAA CCNC(=O)[C@H](C)N1CCC(n2nccc2NC(=O)c2ccccc2C)CC1 67770184 ANTNIORPDNASBI-INIZCTEOSA-N 383.496 2.605 0 50 GFAA Cc1ccccc1C(=O)N1CCC(C(=O)NCc2cnn3ccccc23)CC1 72150993 RLIRBXUEGWUBKC-UHFFFAOYSA-N 376.460 2.811 0 50 GFAA Cc1cc(C[C@H](C)NC(=O)C2(Oc3ccc(Cl)cc3)CCNCC2)[nH]n1 77505141 JZKDXYACLJNVIZ-ZDUSSCGKSA-N 376.888 2.620 0 50 GFAA CCc1noc(CN(CC)C(=O)[C@H]2CCC(=O)N(Cc3ccccc3F)C2)n1 91441211 VOSGDPGLSDPGOA-HNNXBMFYSA-N 388.443 2.558 0 50 GFAA O=c1oc2ccccc2n1Cc1cn(Cc2c[nH]nc2-c2cccs2)nn1 91794196 XWQFXKMGVHDZHO-UHFFFAOYSA-N 378.417 2.734 0 50 GFAA Cc1[nH]cnc1CN1C[C@@H]2CC[C@H](C1)N(C(=O)CCC(=O)c1ccccc1)C2 95358995 FQLVRZLAKZYQNB-PKOBYXMFSA-N 380.492 2.804 0 50 GFAA COc1ccc(CN2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)cc1C 95364153 MXWHDLLFQYKFGA-SFHVURJKSA-N 380.496 2.757 0 50 GFAA CCN(C)CCC(=O)N1C[C@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1 95385035 PZLALTYIVQCEGF-MAODMQOUSA-N 377.479 2.695 0 50 GFAA CN[C@@H](C(=O)N1CCC(c2nccn2Cc2ccncc2)CC1)c1ccccc1 95510807 MXRRDHHHXQGXEU-OAQYLSRUSA-N 389.503 2.993 0 50 GFAA O=C(NS(=O)(=O)Cc1c(F)cccc1F)c1csc([C@H]2CCCO2)n1 119114422 PNLBPWGGCTWDDU-CYBMUJFWSA-N 388.417 2.533 0 50 GFAA C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)Nc2cccc(C(N)=O)n2)CC1 127465099 NXYRTGRRBCQBGF-CYBMUJFWSA-N 387.871 2.745 0 50 GFAA Cc1cc2c(=O)n(CC(=O)N3CCN([C@H](C)c4ccccc4)CC3)cnc2s1 134284782 QPBVLVFUOFVNFO-MRXNPFEDSA-N 396.516 2.672 0 50 GFAA C[C@@](O)(CC(=O)N1CCc2c(cccc2N2CCOC2=O)C1)c1ccccc1 182521818 PJWXSAPWMNIDJK-JOCHJYFZSA-N 380.444 2.826 0 50 GFAA Cc1cc(F)ccc1-n1cc(C(=O)N2CCN([C@H](C)c3ccccn3)CC2)nn1 183828605 LRZQHGFCAOTLTF-MRXNPFEDSA-N 394.454 2.629 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)c3c[nH]nc3-c3ccccc3)CC2)n1 186048766 GORNZHRCDSHATR-UHFFFAOYSA-N 376.464 2.953 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@H](C)N3CCc4ccccc43)CC2)ncn1 186209441 ZLHJBSIRZHZMRQ-INIZCTEOSA-N 395.507 2.729 0 50 GFAA CN(CC1(O)CCOCC1)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21 188105790 WRCKXJPXZAEZHU-INIZCTEOSA-N 384.423 2.848 0 50 GFAA CCCc1c(NC(=O)NC[C@@]2(CCO)CCOC2)cnn1-c1ccc(F)cc1 191955394 VVUKQGRIBPBYHW-HXUWFJFHSA-N 390.459 2.875 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@H](Cc1ccccc1)n1cnnn1 220322540 INECYNYEVKIXPC-IBGZPJMESA-N 378.411 2.736 0 50 GFAA C[C@@H]1CN(C[C@H]2CCCN2C(=O)c2cccc(Nc3ncccn3)c2)C[C@@H](C)O1 229653509 RVUYQVBEEYAATM-MBOZVWFJSA-N 395.507 2.934 0 50 GFAA Cc1nn(-c2ccc(C(=O)N(CC(=O)O)C3CCOCC3)cc2)c(C)c1Cl 237656442 XGDGJZPMLOJUOU-UHFFFAOYSA-N 391.855 2.848 0 50 GFAA O=C(Cc1cccc2ccccc12)N[C@@H]1CCN(Cc2cccnc2)C[C@H]1O 244875108 XMSABZZYZSVQMQ-FGZHOGPDSA-N 375.472 2.529 0 50 GFAA COCCCONC(=O)N1CCC2(CC1)C[C@H]2N(Cc1ccsc1)C(C)=O 287781302 AMVNUVXTDARXIQ-QGZVFWFLSA-N 395.525 2.629 0 50 GFAA COc1ccc(CNC(=O)[C@@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)cc1C(=O)O 299748715 HYGYHYWPPUBTTB-WMLDXEAASA-N 396.443 2.619 0 50 GFAA Cc1cc(N2CCN(Cc3cn(C)nc3C)CC2)nc(-c2ccccc2O)n1 299761266 UDHNZNZISDPYHS-UHFFFAOYSA-N 378.480 2.522 0 50 GFAA C1CC[C@H](c2nnc(N3CCOC[C@@H](C4CCC4)C3)n2C[C@@H]2CCCO2)OC1 428192471 QYINATAYQHFNOK-GBESFXJTSA-N 390.528 2.952 0 50 GFAA Cc1sc2nc(CCNC(=O)[C@H]3COc4ccccc4O3)nc(O)c2c1C 670460162 FHVJUSBOTVORPK-CQSZACIVSA-N 385.445 2.512 0 50 GFAA COC(=O)[C@@H]1CC[C@H]2C(=O)N(c3ccc4cc(OC)c(OC)cc4c3)C(=O)N2C1 864565930 OPIZESBZVRJASQ-CJNGLKHVSA-N 398.415 2.577 0 50 GFAA COC1(C(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)CCC(C(F)F)CC1 888092805 GKBFDFCLOZRNQW-HZEYSBKDSA-N 387.448 2.862 0 50 GFAA CC(C)C(=O)N1CC[C@H]2[C@H](C1)NC(=O)N2C1CCN(CC2CCCCC2)CC1 888103593 OMEBDLQBMYPZCO-PMACEKPBSA-N 390.572 2.682 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2c(C)cccc2F)cc1OC 1529106914 TZCSEWURFZFOKJ-UYAOXDASSA-N 389.423 2.726 0 50 GFAA O[C@H]1CN(Cc2cccc(OCc3ccccc3)c2)CC[C@@H]1N1CCOCC1 1565509134 QDDXMHSJPNJRGA-GOTSBHOMSA-N 382.504 2.533 0 50 GFAA COc1cccc(-c2cc(CNc3ccc(C(=O)N4CCOCC4)cn3)no2)c1 1704298140 FUPUKUDDDZSCEH-UHFFFAOYSA-N 394.431 2.830 0 50 GFAA C[C@@H]1C(=O)N2CCC[C@@H]2CN1Cc1ccccc1CS(=O)(=O)c1ccccc1 1772703826 FMBYTKLWNLLHKB-YLJYHZDGSA-N 398.528 2.856 0 50 GFAA CCCn1cc(C(=O)N2CC[C@H]3[C@@H]2CC(=O)N3C2Cc3ccccc3C2)c(C)n1 1800413393 FOXNIXXQJREZRG-SFTDATJTSA-N 392.503 2.584 0 50 GFAA COc1ccnc(C(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)c1 1857710079 GXGGHWUQEWITRE-JTDSTZFVSA-N 387.867 2.688 0 50 GFAA CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=O)N[C@H]2C[C@H](C)c3ccccc32)C1 1875255019 JFDPGHJAVZLCOZ-DACLVMHWSA-N 392.463 2.844 0 50 GFAA N[C@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)n(-c3ccccc3)n2)C12CCOCC2 1875277852 KASREXQFQYTVFE-GJZGRUSLSA-N 394.397 2.517 0 50 GFAA COC(=O)/C=C/CCNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1875311639 IFVUJQSOVWYDAZ-DUXPYHPUSA-N 385.386 2.552 0 50 GFAA CC[C@H]1CN(C(=O)CC2(OC)CCC2)CC[C@H]1NC(=O)c1cc(C(F)F)[nH]n1 1875333884 OUKHVZYRQYNBRW-QWHCGFSZSA-N 398.454 2.663 0 50 GFAA O=C(O)[C@]1(Cc2ccccc2)CN(Cc2ccccc2-n2cccn2)CC[C@H]1O 2100483730 KIXQRWIVKLNWJJ-FYYLOGMGSA-N 391.471 2.753 0 50 GFAA CCN(C(=O)c1ccc(Cl)c2occc12)[C@H]1CCN(CC(=O)N2CCC2)C1 2325793453 VGFMRZKIOOVHGP-AWEZNQCLSA-N 389.883 2.855 0 50 GFAA Cc1cc(Br)c(O)c(NC(=O)c2csc(-c3nn[nH]n3)c2)c1 2325869685 YAHAHPOTUAFQJU-UHFFFAOYSA-N 380.227 2.957 0 50 GFAA COCCN1CCC[C@@]2(CCCN2Cc2ccc3c(c2)OC(F)(F)O3)C1=O 2356162706 IXMAAMUOUHCTCM-GOSISDBHSA-N 382.407 2.612 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)cc(Br)c1O 1189088 WPCQNIVROPBAHX-ZDUSSCGKSA-N 399.241 2.743 0 50 GFAA CCC(=O)Nc1cc(-c2nn(C)c(=O)c3ccccc23)ccc1N1CCOCC1 2221454 AXPKODGCFZNZEB-UHFFFAOYSA-N 392.459 2.786 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N[C@H]3CCCN(Cc4cccnc4)C3)cc2)n1 2356135348 ADJNJTAEOAVXOT-IBGZPJMESA-N 388.475 2.515 0 50 GFAA O=C(NCc1ccc(F)cc1)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 2467693 DXPLWZCWPXXTOS-CQSZACIVSA-N 382.482 2.604 0 50 GFAA Cc1ccc(C(=O)NCc2ccncc2)cc1S(=O)(=O)N1CCCCCC1 6697873 CWXIOSVMSIVTGQ-UHFFFAOYSA-N 387.505 2.885 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2)CC1 6702016 NCDDRAFMFSXOFI-QZTJIDSGSA-N 382.460 2.592 0 50 GFAA O=C(CCN1C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)Nc1ccc(Br)cc1 101751496 WEAKHMUNEQPWFR-DPDCMNJDSA-N 391.265 2.809 0 50 GFAA COc1ccc(CCN2C[C@@H](C(=O)NC3Cc4ccccc4C3)CCC2=O)cc1 23312065 KMWVULZKBUDYCH-FQEVSTJZSA-N 392.499 2.760 0 50 GFAA CNC(=O)c1ccc(CN2CC=C(c3cnn(-c4ncccc4C)c3)CC2)o1 67871902 GGGCBOXBNSLKIV-UHFFFAOYSA-N 377.448 2.818 0 50 GFAA O=C(NCc1nc(-c2ccncc2)cs1)C1CCN(c2cnccn2)CC1 472002170 LKTIBBZRNQNPSJ-UHFFFAOYSA-N 380.477 2.528 0 50 GFAA COc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)c(OC(F)F)c1 252487044 HRBSYEOVJKFQBF-UHFFFAOYSA-N 392.406 2.696 0 50 GFAA Cc1ccc2nc(CNC[C@@]3(O)CCCN(CC4CCCCC4)C3=O)[nH]c2c1 67743078 WGDCGJPRXXDHDM-QFIPXVFZSA-N 384.524 2.895 0 50 GFAA O=C(NCc1cc2cc(Cl)ccc2[nH]1)c1cc(CN2CCC(O)CC2)on1 67872401 VCFZYWKXBRHEGC-UHFFFAOYSA-N 388.855 2.696 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cnn(Cc3ccccc3Cl)c2)c(C)n1 2793275 SQYALCLCOXYJHJ-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(c4cc(C)nc(N)n4)C3)C2)c1OC 72143126 YQZQCLNUFALWCM-JOCHJYFZSA-N 397.523 2.877 0 50 GFAA Cn1cc(C(N)=O)cc1C(=O)Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1 153522269 OCHYYDMXKSRVER-UHFFFAOYSA-N 396.426 2.500 0 50 GFAA CCN(CC)C(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H]2CCCN2C)cc1 363520188 OMZWPNSNXJFFDR-WOJBJXKFSA-N 386.540 2.937 0 50 GFAA CN(C)c1nc(-c2ccccn2)nc2c1CCN(C(=O)CCC(F)(F)F)C2 71589704 MKKQXWMLBGTYTF-UHFFFAOYSA-N 379.386 2.832 0 50 GFAA Cc1ccccc1S(=O)(=O)Cc1csc(-c2c(C)c(C)nn(C)c2=O)n1 864097241 NRPYRDCEHWHEHQ-UHFFFAOYSA-N 389.502 2.803 0 50 GFAA CN(C)c1ccc(CC(=O)N2CCOC[C@H]2CC(=O)NCC2=CCCCC2)cc1 72145190 FTTKKOIGJHNDCD-OAQYLSRUSA-N 399.535 2.529 0 50 GFAA Cc1noc(C)c1CNC(=O)NCc1nc2cccc(Br)c2[nH]1 457990848 YZUKNVPTICDBRU-UHFFFAOYSA-N 378.230 2.930 0 50 GFAA C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cnn(-c2ncccn2)c1 174892962 ZMHCOTRXJCVWQD-KRWDZBQOSA-N 391.479 2.791 0 50 GFAA OCC[C@H]1CN(c2noc(-c3ccccc3)n2)CCN1CCc1ccccc1 72438754 IIVDXYGLLGMMQZ-FQEVSTJZSA-N 378.476 2.852 0 50 GFAA C[C@@H](Cc1ccsc1)N(C)C(=O)c1ccc(N2CCCS2(=O)=O)cc1 175101108 OTRBNJQAZCZSOV-AWEZNQCLSA-N 378.519 2.991 0 50 GFAA CN(CCC(N)=O)C(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2 286179615 IYGWMLVKNFZHJZ-UHFFFAOYSA-N 381.263 2.615 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)N[C@@H](CCC(=O)O)Cc2ccccc2)c1 263456444 CFLTYMOOKCYTLN-KRWDZBQOSA-N 394.435 2.568 0 50 GFAA COc1ccc(C(=O)[C@H](O)[C@@H](c2ccc(C)cc2)N2CCOCC2)cc1OC 20390211 ZTYFVEASKFFIJK-IFMALSPDSA-N 385.460 2.629 0 50 GFAA CCCN1CCCn2nc(CNC3CCN(Cc4ccccn4)CC3)cc2C1 82106635 QSIMIAQHKGEWIN-UHFFFAOYSA-N 382.556 2.648 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCc4nccn4C)csc3C2)nc1 426488487 YNBFQUFJGRDCTC-UHFFFAOYSA-N 395.532 2.927 0 50 GFAA COc1ccc(S(=O)(=O)CCN/C(O)=C2/C=C(c3cccnc3)N=N2)cc1 334159394 WKVDFZSWGUPZMJ-ISLYRVAYSA-N 386.433 2.688 0 50 GFAA O=C(c1cccc(-c2cccc(O)n2)c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 426525773 BCYROIAIMLQPHQ-GOSISDBHSA-N 379.460 2.929 0 50 GFAA O=C([C@@H]1COc2ccccc2C1)N(CCCn1ccnc1)Cc1ccncc1 95529125 PPQJJEIYTVPATO-FQEVSTJZSA-N 376.460 2.948 0 50 GFAA Cc1ccc(-c2cc(CN3C[C@H]4CC[C@@H]3CN(S(C)(=O)=O)C4)on2)cc1 95368739 PJAPKJNKPXAFOV-NVXWUHKLSA-N 375.494 2.506 0 50 GFAA Cc1cc(=N/C(O)=C2\N=NC3=C2CCCCC3)n([C@@H]2CCS(=O)(=O)C2)[nH]1 334159378 NCFOPCPPQGSQNZ-JUPVBTILSA-N 377.470 2.796 0 50 GFAA Cc1cc(N2CCC(NCCCc3ccccn3)CC2)nc(N2CCCC2)n1 95520823 WTMWJXOKUSUZOZ-UHFFFAOYSA-N 380.540 2.971 0 50 GFAA NCCCOc1ccc(F)cc1C(=O)N1CCN(Cc2cccs2)CC1 426647333 RNZUJIGWWFYYMM-UHFFFAOYSA-N 377.485 2.573 0 50 GFAA C[C@H](NC(=O)CCc1n[nH]c2c1CCCC2)c1ccc(S(C)(=O)=O)cc1 97619188 DHSZZUUAINEUFY-ZDUSSCGKSA-N 375.494 2.502 0 50 GFAA COc1ccc(NC(=O)N(C)C[C@@H]2CCN(c3ccccc3)C2)cc1C(N)=O 97546464 MCIUUNJQJAWFLD-HNNXBMFYSA-N 382.464 2.784 0 50 GFAA CC(C)c1nc(CN2C[C@H](c3ccccc3)CC2=O)n(CCc2cnc[nH]2)n1 92099612 RXHDMGNJNAPQEF-QGZVFWFLSA-N 378.480 2.883 0 50 GFAA CC(=O)N1CCO[C@@H](CNC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 95522984 PMQDEBKONMNTGF-NSHDSACASA-N 379.766 2.728 0 50 GFAA NC(=O)c1ccc(-c2nc(C[C@H]3CCOC3)n(CCc3ccccc3)n2)cc1 96130406 KOIBJMZWHPBTRI-QGZVFWFLSA-N 376.460 2.866 0 50 GFAA Cc1ncsc1CCS(=O)(=O)N1CCC[C@H](c2ncc3n2CCCC3)C1 295820725 CEMXUBADNORHRR-HNNXBMFYSA-N 394.566 2.736 0 50 GFAA CN1C(=O)COc2cc(NC(=O)N3CCCC[C@@H]3CCn3cccn3)ccc21 534587366 HFALLHJMAWNEOW-MRXNPFEDSA-N 383.452 2.715 0 50 GFAA COc1ccc(NC(=O)c2nnn3c2CO[C@H](c2ccc(F)cc2)C3)c(OC)c1 263617577 ONLPTEBSJWBQAA-SFHVURJKSA-N 398.394 2.958 0 50 GFAA CC1CCN(C(=O)CCNC(=O)N2CC(Oc3cccc(Cl)c3)C2)CC1 822421665 JBMAAOAHBPZSGN-UHFFFAOYSA-N 379.888 2.761 0 50 GFAA COc1cccc(-c2cc(CNC(=O)N(C)Cc3nncn3C(C)C)no2)c1 584888825 WLCIJTNPLBUJMH-UHFFFAOYSA-N 384.440 2.864 0 50 GFAA COC1CCN(S(=O)(=O)NC[C@H](c2ccccc2)N2CCCCCC2)CC1 670439124 MGNZJCLEWKLTPB-HXUWFJFHSA-N 395.569 2.549 0 50 GFAA Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)[C@@]3(C(=O)O)CCNC3)cc2)cc1 1875267006 PJHGDMSRTFHOBH-UZUQRXQVSA-N 396.487 2.686 0 50 GFAA C[C@@H](NC(=O)[C@@H](C)N1CCc2c(O)nc(O)nc2C1)c1ccc2ccccc2c1 1875308073 RPFSDZSUXHAAKU-ZIAGYGMSSA-N 392.459 2.665 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCN(c4ccnc5ccccc45)CC3)n[nH]c21 1875394967 DINBKURLKWFGFX-CABCVRRESA-N 391.475 2.943 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)ccc21 1875372021 UEAMADYCIGTOGK-ZDUSSCGKSA-N 381.354 2.589 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ncc(C(F)(F)F)cc1Cl 1875401383 WOYSGGODGTXFOB-OASPWFOLSA-N 388.777 2.520 0 50 GFAA COCCN(CCOc1ccccc1F)C(=O)[C@@H]1CC(=O)OC12CCCC2 952868092 BLCSOGNSURONFG-HNNXBMFYSA-N 379.428 2.555 0 50 GFAA CC(C)C[C@H](NC(=O)N1CC(=O)Nc2ccccc21)C(=O)Nc1nccs1 888088681 LKJFISNABNWRAL-ZDUSSCGKSA-N 387.465 2.665 0 50 GFAA CC[C@@H](C)n1nc(C(=O)N2C[C@H]3CC[C@H]2CN3C(=O)CCCCOC)cc1C 1775991641 LVDRMUBVVZQNQO-NXHRZFHOSA-N 390.528 2.795 0 50 GFAA C[C@@H]1C[C@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCO1 271477104 CVTMKIRMQLKVCC-YFVAEKQCSA-N 389.540 2.546 0 50 GFAA CCOc1ccnc(N2CCN(Cc3nc4ccc(OC)cc4s3)CC2)n1 186981861 SETBOLLWQTWORD-UHFFFAOYSA-N 385.493 2.816 0 50 GFAA C[C@H](C(=O)NCc1cccs1)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 225388566 IFIPBOZDTYRYGE-CYBMUJFWSA-N 398.454 2.989 0 50 GFAA C[C@@H](NC(=O)c1n[nH]c2ccccc2c1=O)c1cccc(N2CCCC2=O)c1 111582817 XVWFRLCPXRJQHV-CYBMUJFWSA-N 376.416 2.541 0 50 GFAA CCN1C(=O)C[C@H](Sc2ccccc2C(=O)Nc2cnn(C(C)C)c2)C1=O 1529151249 IXHBMIJLEHPABX-INIZCTEOSA-N 386.477 2.956 0 50 GFAA O=C1CO[C@H](C(=O)NCC2(c3ccccc3)CCCC2)[C@@H](c2ccccc2)N1 1529168407 BTDBXLUCWHGWSA-RTWAWAEBSA-N 378.472 2.871 0 50 GFAA COCCC(=O)N1C[C@H]2CN(Cc3ccccc3-c3ccccc3)C[C@@]2(CO)C1 1772701593 LNADRGGQIWHUAR-QPPBQGQZSA-N 394.515 2.643 0 50 GFAA COc1cc(Cl)cc2cc(C(=O)N3CCC4(CC3)CN(C)C(=O)CO4)oc12 1772807123 JEXFSMGHLMFUEL-UHFFFAOYSA-N 392.839 2.558 0 50 GFAA O=C(CCCc1nc(-c2ccncc2)no1)N1CCC[C@]2(CCc3c[nH]nc32)C1 1775978415 SOFNQORRLOTSQY-NRFANRHFSA-N 392.463 2.684 0 50 GFAA CN(CC(=O)N[C@H]1CCCN(CCCc2ccccc2)C1)Cc1ccncc1 11820689 ZOLCHBVKWRICFM-QFIPXVFZSA-N 380.536 2.727 0 50 GFAA CCn1cc(CN2CC[C@@]3(CCCN(Cc4cccc(OC)c4)C3=O)C2)cn1 11839102 ZFIKICLXNWVUOM-QFIPXVFZSA-N 382.508 2.926 0 50 GFAA O=C(C1CCOCC1)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 11952709 UHSNQQNLKDVAQB-NRFANRHFSA-N 392.446 2.733 0 50 GFAA O=C1N(Cc2cccnc2)C[C@@H]2C[C@@H](c3cccc4c3OCO4)N3CCC[C@@]123 12304945 QAIZAHZQKNWMRP-ZJBJCVSYSA-N 377.444 2.748 0 50 GFAA COc1ccc(O[C@H](C)C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1 12380909 BIFBBJRUACACOW-OAHLLOKOSA-N 384.432 2.574 0 50 GFAA C[C@]1(CCC(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)CCC(=O)N1 12508474 SLKFVGQCPBUBKE-GOSISDBHSA-N 383.414 2.803 0 50 GFAA Cc1nc(C(=O)NC[C@@H]2CCC3(CCN(Cc4ccoc4)CC3)O2)cs1 14882480 ZDVPMIKZHHZDRG-INIZCTEOSA-N 375.494 2.988 0 50 GFAA COc1cccc(N2C(=O)C[C@@H](N3CCN(c4ccc(Cl)cc4)CC3)C2=O)c1 19720929 SGLQGOVQKOROSI-LJQANCHMSA-N 399.878 2.803 0 50 GFAA CCN1CCC2(CC1)OCCc1cc(C(=O)N(C)Cc3ccon3)sc12 1857691086 UJKDJFDKSNRMJP-UHFFFAOYSA-N 375.494 2.892 0 50 GFAA COCCn1nc(C)nc1C[C@@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857682514 RIEWOJXNWYQBQI-HNNXBMFYSA-N 385.468 2.842 0 50 GFAA CCOc1ccc(CCCC(=O)N2CC[C@@]34OCCCN3C(=O)C[C@@H]24)cc1C 1857711431 ZGEZKYVNUVFSRH-KNQAVFIVSA-N 386.492 2.666 0 50 GFAA O=C(Cc1ccsc1)NC[C@H]1[C@H]2CN(Cc3nccs3)C[C@]23CC[C@H]1O3 1857715979 QGSZOLWGNYFRRH-WFXMFSGNSA-N 389.546 2.543 0 50 GFAA COc1ccc(CC(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)cc1F 1857731519 UCDZZLPGKDWPTD-BBTUJRGHSA-N 384.451 2.707 0 50 GFAA O=C(c1cc(F)cc(F)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857739816 UHJJSZGGFXZGFH-OPYAIIAOSA-N 384.382 2.879 0 50 GFAA COc1cc(C(=O)N2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)ccn1 1857740545 JBEVIPBQBHBBRJ-RBUKOAKNSA-N 382.460 2.978 0 50 GFAA C[C@@H](C(=O)N(CC(=O)O)C1CCOCC1)c1ccc(Br)s1 237447827 NBFSHYADPUUEGN-SECBINFHSA-N 376.272 2.706 0 50 GFAA O=S(=O)(NCc1ccccc1)c1cccc(-c2nc(Cc3ccno3)no2)c1 2325735932 AYOUHLIXOMSZCS-UHFFFAOYSA-N 396.428 2.794 0 50 GFAA C[C@H]1NCC[C@@H]1C(=O)N(Cc1ccccc1)Cc1nc(O)c2sccc2n1 2325738419 SYOXXLVYTSYLQH-HIFRSBDPSA-N 382.489 2.924 0 50 GFAA COC(=O)c1cc(=NC(=O)N2CCCC[C@H]2c2nc3ccccc3s2)[nH]n1C 2325761838 ZZBGYVWVDIFFAG-ZDUSSCGKSA-N 399.476 2.997 0 50 GFAA Cc1cc(-c2nn[nH]n2)cnc1C(=O)N1CCC[C@H](c2cc(F)ccc2F)C1 2325808034 WHXCPMBCXRWECH-LBPRGKRZSA-N 384.390 2.868 0 50 GFAA COCCCNC(=O)CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccccc1 2966006 FZDSVVUBXUMSTB-UHFFFAOYSA-N 396.896 2.688 0 50 GFAA CC(C)[C@H](NC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccccc1)C(=O)O 4769916 IGLVFZBSZQBERJ-WQJNHMDYSA-N 384.407 2.822 0 50 GFAA Cc1cccn2cc(CNC(=O)c3cn(Cc4ccccc4Cl)nn3)nc12 11663689 BALMARZOYYIVHH-UHFFFAOYSA-N 380.839 2.866 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]1(O)CNCc1cccc(F)c1 11878629 CIFHMLAETXRYAA-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA Cc1c(CC(=O)N2CC[C@H](O)C2)c2c(n1CCc1ccccc1)CCCC2=O 12004810 BQUFWWDUULOKTG-SFHVURJKSA-N 380.488 2.694 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@H](C(=O)c2ccc(OC)cc2C)C1 12204932 OEMXRMMJJZNKEK-HNNXBMFYSA-N 376.453 2.561 0 50 GFAA COC(=O)c1ccc([C@@H]2C[C@H]3CN(Cc4cccnc4)C(=O)[C@]34CCCN24)cc1 12308253 MJOMBSJAEKJEFA-JTAQYXEDSA-N 391.471 2.806 0 50 GFAA CCCO[C@H]1CCCN(C(=O)CCc2nnc(-c3ccc4c(c3)OCO4)o2)C1 12387633 XLBNPJCHWOWZEU-HNNXBMFYSA-N 387.436 2.816 0 50 GFAA Cn1cc(CNC(=O)c2coc(COc3cccc(C(F)(F)F)c3)n2)cn1 12596725 XWBZSDFZQYTLDX-UHFFFAOYSA-N 380.326 2.936 0 50 GFAA COc1ccccc1CCN1CCC(CN(C)C(=O)Cn2ccc(C)n2)CC1 12835620 VIHGFZSBPWEYMF-UHFFFAOYSA-N 384.524 2.613 0 50 GFAA Cc1cc(-c2ccnc(-n3ncc(C(=O)N[C@@H](C)CO)c3C3CC3)n2)c(C)s1 14887813 VHVDUDYKUFQBSI-NSHDSACASA-N 397.504 2.996 0 50 GFAA CCN1CC[C@H](CN(C)C(=O)c2cc(Cn3c(C)nc4ccccc43)[nH]n2)C1 15065361 PZYTXWQACPLFBU-MRXNPFEDSA-N 380.496 2.530 0 50 GFAA CN1CCN(S(=O)(=O)c2ccc(NC(=O)c3ccc(Cl)s3)cc2)CC1 16605730 YPHGOEPUKCTOQE-UHFFFAOYSA-N 399.925 2.590 0 50 GFAA O=c1c(CN2CCN(CCc3ccccc3)[C@H](CCO)C2)coc2ccccc12 20777610 XXRYJRJXQPKROL-OAQYLSRUSA-N 392.499 2.904 0 50 GFAA CC(C)NC(=O)Cn1cc(CN(C)Cc2nncn2C(C)C)c2ccccc21 55042626 XQPAUZCQLPLDBJ-UHFFFAOYSA-N 382.512 2.970 0 50 GFAA COc1ccccc1CN(C(=O)[C@H](Cc1ccccc1)n1cnnn1)C1CC1 55386491 FSVQFYFUGNKXAX-IBGZPJMESA-N 377.448 2.657 0 50 GFAA O=C(NC1CC1)[C@@H]1CCCN(C2CCN(Cc3cc(F)cc(F)c3)CC2)C1 71415801 DJHVSUKCSGLGDO-MRXNPFEDSA-N 377.479 2.920 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(c3noc(-c4ccccc4)n3)CC2)C1 71745334 PFNNEGXKPKZWKP-KRWDZBQOSA-N 395.507 2.696 0 50 GFAA COCCn1cncc1CN1C[C@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 72148116 NIFWOXBIBXKIAQ-YPAWHYETSA-N 384.499 2.731 0 50 GFAA CCc1n[nH]c(SCC(=O)N[C@H](C)c2cnn(-c3cccc(F)c3)c2C)n1 91526599 HKISNMXNZISEMS-LLVKDONJSA-N 388.472 2.970 0 50 GFAA CN(CC(=O)N1CCC[C@@]2(CCC(=O)N(C3CC3)C2)C1)Cc1ccc(F)cc1 91594295 HSYYQQNZMCEEMR-JOCHJYFZSA-N 387.499 2.651 0 50 GFAA O=C(c1cc(C2CC2)[nH]n1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 95369848 KIQHCVKKUNNLRI-HNAYVOBHSA-N 376.504 2.991 0 50 GFAA COc1ccc([C@@H](C(=O)O)N2CCC(C(=O)N3CCCCC3)CC2)cc1F 95371850 IRNVBZMFYFTFOG-SFHVURJKSA-N 378.444 2.685 0 50 GFAA COc1cc(CN2CCC3(CCO3)CC2)ccc1OC[C@H](O)CN(C)C(C)C 95509647 KMZFSWLLLFSRCJ-LJQANCHMSA-N 392.540 2.530 0 50 GFAA COc1ccc(C(=O)NC2CC2)c(OC2CCN(c3cc(C)ncn3)CC2)c1 95528373 LXVYJQKGXHHJBW-UHFFFAOYSA-N 382.464 2.734 0 50 GFAA C[C@@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)c2n[nH]c3c2CCC3)CC1 112678514 ZHIARVGEQPYDKV-LBPRGKRZSA-N 398.492 2.529 0 50 GFAA CCc1c(C(=O)NCc2cccnc2OC)nnn1-c1ccc(OC(C)C)cc1 124687978 UEBSBQKZHPBIPM-UHFFFAOYSA-N 395.463 2.951 0 50 GFAA C[C@@H](NC(=O)c1cnc2c(cnn2C)c1O)c1ccc(NC(=O)C2CC2)cc1 132561301 LYHUFSDWTPXKHE-LLVKDONJSA-N 379.420 2.513 0 50 GFAA CC(C)c1noc(-c2cccn3c(CNC(=O)c4ccccc4F)nnc23)n1 169776115 HWBVPPVPZGLTLB-UHFFFAOYSA-N 380.383 2.972 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N(C)[C@H]2CCc3ccccc3C2)CC1 170626787 MPMGRMJWKVAFDW-PPSBMQLTSA-N 378.538 2.500 0 50 GFAA Cc1noc(-c2ccccc2C(=O)N2CCN(Cc3cccc(F)c3)C(=O)C2)n1 173913574 TYFNNIHHEXVWBL-UHFFFAOYSA-N 394.406 2.669 0 50 GFAA CC(C)(C)c1cc(NC(=O)CN2CCC[C@H](CC(N)=O)C2)n(-c2ccccc2)n1 175254748 AHYRUAWSBHCPQC-MRXNPFEDSA-N 397.523 2.696 0 50 GFAA CC1(C)Cc2cccc(CN[C@@H](Cc3ccccc3)C(=O)N3CCOCC3)c2O1 185168738 SJKNTNHNCPAYMZ-NRFANRHFSA-N 394.515 2.960 0 50 GFAA O=S(=O)(Cc1noc2ccccc12)N1CCN(CC2CCCCC2)CC1 185713791 DIGTZCVDUSOCHK-UHFFFAOYSA-N 377.510 2.856 0 50 GFAA CC[C@@H](C)c1ccccc1OCC(=O)N1CCC[C@@H](N(C)CC(=O)O)CC1 186647192 YBYIHXVYPNEJGI-IAGOWNOFSA-N 376.497 2.976 0 50 GFAA COc1ccccc1[C@H]1CN(C(=O)CCc2cc(Cl)no2)C[C@@H]1C(=O)O 213151214 KFXOEGXIQAZECS-KGLIPLIRSA-N 378.812 2.596 0 50 GFAA CCc1nc(-c2c3n(c(=O)n(Cc4ccccc4F)c2=O)CCCCC3)no1 221642200 CWXADQGJYGVMBI-UHFFFAOYSA-N 384.411 2.536 0 50 GFAA C[C@@H]1CN(Cc2ccc(C(=O)N[C@H](Cc3ccccc3)C(=O)O)cc2)C[C@@H](C)O1 237416615 SBLKRDVGJWVIPQ-CBGDNZLLSA-N 396.487 2.722 0 50 GFAA O=C(CN1C(=O)[C@H]2[C@@H]3C[C@H](C[C@@H]3c3ccccc3)[C@H]2C1=O)Nc1nccs1 239305922 GESMQKMAAZFFAQ-SZVRAQGESA-N 381.457 2.506 0 50 GFAA C[S@](=O)CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1 239352451 ACFXYGRIOXBXJW-GSRQOQJUSA-N 396.940 2.608 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(N2CCC(Cn3ccnn3)CC2)ncn1 275709869 NZCPMOLXIXNEHX-YLJYHZDGSA-N 385.516 2.600 0 50 GFAA Cc1nc2cc(NC(=O)N3CCN(C)[C@@H](c4nc(C5CC5)no4)C3)ccc2o1 286069751 UAAWCJTYWFALCW-OAHLLOKOSA-N 382.424 2.917 0 50 GFAA O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)c1cnc2ccccn2c1=O 328586521 DCDSEEHTQFXPCG-UHFFFAOYSA-N 383.314 2.934 0 50 GFAA C[C@H](NC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1)[C@H]1CCOC1 363421147 BHOZEGXCNZDOBV-HOCLYGCPSA-N 379.888 2.623 0 50 GFAA CCc1nc(CN2CCOC[C@@H]2c2c(C)nn(-c3ccccc3F)c2C)n[nH]1 364283459 ZNZNWCYZAROEFJ-QGZVFWFLSA-N 384.459 2.882 0 50 GFAA CCN(Cc1cccs1)C(=O)[C@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C 366348642 NIVOEDRZBLDIAH-QFBILLFUSA-N 386.521 2.972 0 50 GFAA O=C(NC1CCN(c2ccccn2)CC1)N[C@H]1CCN(c2ccccc2F)C1 487815000 DATZVUCOEGNUGU-KRWDZBQOSA-N 383.471 2.768 0 50 GFAA COc1ccccc1OC1CN(C(=O)NC[C@H]2CCN(c3ccccc3)C2)C1 534673867 HLWHRMWDXBMYFE-QGZVFWFLSA-N 381.476 2.994 0 50 GFAA Cc1cncc(C(=O)N2CCC3(CC2)CN(C(=O)Nc2ccccc2)CCO3)c1 825249905 QXCDDLSYWRLVRL-UHFFFAOYSA-N 394.475 2.929 0 50 GFAA C[C@@H]1CN(c2ccc(C(=O)Nc3ccc(CC(=O)O)c(F)c3)cn2)C[C@@H](C)O1 909847115 PRLSEWASUHYHHF-CHWSQXEVSA-N 387.411 2.714 0 50 GFAA CN(C)c1ccc(Cl)cc1NC(=O)c1cn(CC[C@H]2CCCCN2)nn1 952982402 WXIFCEGGCMJPAH-CQSZACIVSA-N 376.892 2.782 0 50 GFAA Cc1ccccc1OC[C@H](O)C(=O)N1CCN(c2nc3ccccc3s2)CC1 952983036 RGGQQLQNNALQGZ-KRWDZBQOSA-N 397.500 2.693 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529093955 CEJXFFYHZJJZPM-DYESRHJHSA-N 379.460 2.834 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)Cc2ccc(C)cc2)cc1OC 1529094431 GMYMBGLDJYQETI-IFMALSPDSA-N 385.460 2.516 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@@H](C)CN2CCCC2)ccc1F 1704315524 ILZWIKKLYLHVNS-ZDUSSCGKSA-N 390.459 2.769 0 50 GFAA CCn1nc(C)c(CN2CCCN(C(=O)[C@H](OC)c3ccccc3)CC2)c1C 1775979093 XOEYJWRLMQAECC-OAQYLSRUSA-N 384.524 2.942 0 50 GFAA O=C(CCc1cccnc1)N1CC[C@@H]2CN(c3ncnc4c(F)cccc34)C[C@@H]21 1857532334 BSUUECKZCDQDHW-APWZRJJASA-N 391.450 2.834 0 50 GFAA Cn1ccnc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncccc2c1 1857694516 CUTYUAOXDFGOLS-WGMWDUQUSA-N 375.476 2.609 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)CCc3ccc4c(c3)OCO4)CC2)O1 1857701496 LQXGJYYGKQDTJJ-SJORKVTESA-N 375.465 2.659 0 50 GFAA O=C(NCCO)[C@]1(Cc2ccccc2)C[C@@H]2CC[C@H]1N2Cc1ccccc1F 1857713028 AAGGRSSOAGAMMY-XKCSPQBFSA-N 382.479 2.900 0 50 GFAA COc1ccccc1NC(=O)[C@@H]1CCCN(S(=O)(=O)c2sccc2F)C1 1875271115 YSDSQFDHEMZOSS-GFCCVEGCSA-N 398.481 2.935 0 50 GFAA NCC1(c2ccccc2)CCN(S(=O)(=O)c2ccc(-n3cccn3)cc2)CC1 1875305837 JRJJVFKTFVGBIG-UHFFFAOYSA-N 396.516 2.554 0 50 GFAA C[C@@H](Oc1ccccc1)c1csc(NC(=O)c2cc3n(n2)CCN(C)C3=O)n1 1940196061 HQSDROMJDGALKX-GFCCVEGCSA-N 397.460 2.818 0 50 GFAA COc1ccc(Nc2nc(C(=O)N3CCc4ncnc(OC)c4C3)cs2)cc1 2325748495 KEYOJLLUFVIKPF-UHFFFAOYSA-N 397.460 2.892 0 50 GFAA Oc1ccc2c(c1)[C@@H](Nc1ncnc3nc(N4CCOCC4)sc13)CCO2 2325789246 GVQIZJOEEZBAMU-ZDUSSCGKSA-N 385.449 2.564 0 50 GFAA COc1cccc(Cl)c1[C@@H]1CN(C(=O)c2cncc(-n3ccnn3)c2)CCO1 2325791439 ZMPISQPSSRHPSF-KRWDZBQOSA-N 399.838 2.538 0 50 GFAA O=C(N[C@@H](CO)c1ccccc1)c1ccccc1Cn1cc(-c2cccnc2)nn1 2325862234 NOWRJJCWLUSNNN-QFIPXVFZSA-N 399.454 2.852 0 50 GFAA C[C@H](C1CCN(c2noc(-c3ccccc3)c2C(=O)O)CC1)N1CCOCC1 2356148727 OYNOYABNEOSZIT-OAHLLOKOSA-N 385.464 2.977 0 50 GFAA COc1ccc(-c2onc(N3CCN(c4nccs4)CC3)c2C(=O)O)cc1 2356152809 BEMBRPZKRVSTFS-UHFFFAOYSA-N 386.433 2.832 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1cccc(I)c1)C(=O)O 2385540 MPTBEGFNTNOLNZ-LLVKDONJSA-N 391.205 2.812 0 50 GFAA in-vitro Cc1cc(C)c(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)c(C)c1 2879533 WRJYFCFFSZGBDD-UHFFFAOYSA-N 375.494 2.863 0 50 GFAA CCOc1ccc(N2C(=S)N(c3ccccc3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 5027899 TUBWQPMBYMSHSZ-QZTJIDSGSA-N 388.514 2.862 0 50 GFAA O=C(CCCn1cnc2ccccc2c1=O)N1CCN(c2ccccc2)CC1 5271975 HVVAQCDJQRTYIF-UHFFFAOYSA-N 376.460 2.526 0 50 GFAA O=C(NCCc1ccccc1)c1cnc2sc(N3CCCCCC3)nn2c1=O 8603584 WJFFUOQETZUSIP-UHFFFAOYSA-N 397.504 2.504 0 50 GFAA CCn1c(SCC(=O)Nc2nnc(C3CC3)s2)nnc1-c1cccnc1 9304339 UTUSVPJFQOKWIY-UHFFFAOYSA-N 387.494 2.820 0 50 GFAA CCCCN1C[C@@H](C(=O)Nc2ccc(C(=O)Nc3ccncc3)cc2)CC1=O 10343587 XNBOZFHPXUGZDV-INIZCTEOSA-N 380.448 2.921 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(C(=O)c3ccccn3)CC2)O1)c1cccc(F)c1 11839434 LJXUWWZAORVGMK-GOSISDBHSA-N 397.450 2.805 0 50 GFAA CN1CCC(N2CCC[C@H](NC(=O)CC3CC(C)(C)NC(C)(C)C3)C2)CC1 12432378 WYFWVDHCNSSSHE-SFHVURJKSA-N 378.605 2.608 0 50 GFAA CCc1noc(CN(C)C(=O)c2cc(-c3cnn(C)c3)nc3ccccc23)n1 63871057 CLGXHRLNNXVKRK-UHFFFAOYSA-N 376.420 2.853 0 50 GFAA Cc1ccc(-c2ncc(C(=O)N3CC[C@@H](n4nc(C)cc4C)C3)c(=O)[nH]2)cc1 91410178 AOOAMXLSEHJRHS-QGZVFWFLSA-N 377.448 2.646 0 50 GFAA CCCc1n[nH]cc1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91859469 NXDJJHMYXQSBHD-UHFFFAOYSA-N 395.507 2.802 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2ccc(-c3ccc(C)o3)cc2)C[C@@H]1CO 95390653 XNJJVWDTSORIRZ-WOJBJXKFSA-N 386.492 2.514 0 50 GFAA COc1c(C)cc(NC(=O)NC[C@H](c2ccncc2)N2CCOCC2)cc1C 95502312 MKAIPJGDALJMGN-LJQANCHMSA-N 384.480 2.902 0 50 GFAA COc1cccc(Oc2ccc(NC(=O)N3CCC[C@](O)(CO)CC3)cn2)c1 96151568 JOPCEYFUPHXJKB-HXUWFJFHSA-N 387.436 2.624 0 50 GFAA C[C@@H]1CCC(=O)N1c1cccc(NC(=O)NCCCOC2CCN(C)CC2)c1 97243702 GAPNQDNEKGCTHO-MRXNPFEDSA-N 388.512 2.824 0 50 GFAA Cc1cc(OC[C@H](O)CNC(=O)c2cc(C(F)(F)F)n[nH]2)ccc1Cl 97637893 PAXDALGVHNPNQT-SECBINFHSA-N 377.750 2.560 0 50 GFAA Cc1cc(CC(=O)N[C@@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)n[nH]1 127372273 CCQKZTBBCJQSGD-QGZVFWFLSA-N 390.443 2.975 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)Nc1ccc(C(=O)O)c(C(F)(F)F)c1 133621611 ZCRCLLANJPRYAD-UHFFFAOYSA-N 377.344 2.555 0 50 GFAA CC1(C)CC[C@@H](CNC(=O)[C@H]2CC(=O)N(c3ccccc3Br)C2)O1 170601114 AYLPSYWXTNUJLI-STQMWFEESA-N 395.297 2.876 0 50 GFAA Cc1nsc(N2CCCN(C(=O)N[C@H]3CCCOc4ccccc43)CC2)n1 176171918 HVBCWTLAQZDMFN-INIZCTEOSA-N 387.509 2.982 0 50 GFAA Cc1ccccc1CCC(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 180295452 MWOPWBYPFFABQX-LJQANCHMSA-N 378.538 2.781 0 50 GFAA C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCC(N(C)CC(=O)O)CC1 186625970 CZPGBTFHCVKSTG-NSHDSACASA-N 389.279 2.768 0 50 GFAA O=C(Nc1ccc2c(c1)CCO2)N1CCN(c2nnc(C(F)(F)F)s2)CC1 187036137 BOFBJPCEKZDAFG-UHFFFAOYSA-N 399.398 2.846 0 50 GFAA O=C(O)[C@H]1[C@@H](C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)[C@H]2C=C[C@H]1CC2 225785113 KHYKJAGXWMEGEX-PBWTXFEYSA-N 388.895 2.897 0 50 GFAA CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 236825726 SZJPSLQMJNLSKZ-PMACEKPBSA-N 378.428 2.763 0 50 GFAA CCCC[C@]12[C@@H]3[C@H]4[C@H]([C@@H]5[C@@H]1[C@H]3[C@@]4(Br)C51OCCO1)C21OCCO1 252428369 ZTNRQRIGEAIPNV-MRWDRYJQSA-N 383.282 2.548 0 50 GFAA O=C(Nc1cc(F)ccc1Oc1ccccc1)C(=O)N[C@@H]1CCc2cn[nH]c2C1 252538019 MNRZNQHIYYFCGT-OAHLLOKOSA-N 394.406 2.953 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCc1ccccn1 252538798 NIGDWPNNWQJSIS-UHFFFAOYSA-N 379.395 2.680 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc(N3CCNC3=O)ccc2Cl)Cc2ccccc21 262173749 LRVZBZKLMRFONY-INIZCTEOSA-N 399.834 2.694 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)CCO1 262705418 DBVARTZRJQUXEJ-ZDUSSCGKSA-N 389.429 2.502 0 50 GFAA C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N1C(=O)[C@@H]2COCCN2C1=O 271999459 ACOGILRBPSAINY-KSSFIOAISA-N 379.416 2.663 0 50 GFAA CC(F)(F)c1cccc(NC(=O)N2CCC[C@H](N3CCCS3(=O)=O)C2)c1 278868208 ROYKBCJIUYJOLL-HNNXBMFYSA-N 387.452 2.830 0 50 GFAA COc1cccc2c(N3CCC(CC(=O)N4CCN(C)CC4)CC3)ccnc12 302561183 UKOWDLNHHCIGBT-UHFFFAOYSA-N 382.508 2.624 0 50 GFAA CN1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)C[C@@H]1c1ncc[nH]1 328616783 CAGQCOWMECTBFO-CQSZACIVSA-N 389.308 2.535 0 50 GFAA O=C(c1cnc(C2CC2)nc1O)N1CCN(c2nsc3ccccc23)CC1 426566880 LCEQFEWJMOKTGZ-UHFFFAOYSA-N 381.461 2.632 0 50 GFAA CC1(C)Oc2ccsc2[C@@H](NC(=O)c2cc(=O)c3ccc(F)cc3o2)[C@@H]1O 837972369 KWSPHVXIVWGHLN-WBVHZDCISA-N 389.404 2.997 0 50 GFAA CN1C[C@H](O)C[C@H]1CNC(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 887602966 NYKUSZPNLGSTIA-NLWGTHIKSA-N 392.503 2.664 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2ccc(F)cc2F)cc1OC 1529119078 BBZAIALRNBUMAK-WOJBJXKFSA-N 379.403 2.916 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC[C@@H](CCN)C2)ccc1F 1704336405 NITPOANSTGPFCF-ZDUSSCGKSA-N 390.459 2.756 0 50 GFAA Cc1ccccc1CN1CC[C@H](CNc2cncc(C(=O)N3CCCC3)n2)C1 1704356236 FBOMFKFCHUXZBY-GOSISDBHSA-N 379.508 2.955 0 50 GFAA CN1CCC[C@@H](c2nc(Cc3cn(C)c4ccccc34)n(-c3cnn(C)c3)n2)C1 1772813101 VUMVNALKWXKOAZ-MRXNPFEDSA-N 389.507 2.893 0 50 GFAA CCOc1ccc2[nH]c(=O)c(-c3nccn3CCc3nncn3CC)cc2c1 1857689159 HJJDCVCTPPQNGS-UHFFFAOYSA-N 378.436 2.644 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)N1CCN(c2ccccn2)CC1 1857708600 BYAKQJGVDFBJLW-UHFFFAOYSA-N 380.477 2.520 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)[C@]1(CCCN(C(=O)c3cncc(O)c3)C1)CC2 1857708655 FWULJELRRPFTSL-OAQYLSRUSA-N 382.464 2.701 0 50 GFAA Cc1nc(CNC(=O)C[C@H]2CCCN(c3nc4ccc(Cl)cc4o3)C2)n[nH]1 1857714274 OMTNYSAGRZJQFW-GFCCVEGCSA-N 388.859 2.831 0 50 GFAA O=C(c1cn2ccccc2n1)N1CCC[C@@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857720527 YFPKOBUIMMPJBP-JOCHJYFZSA-N 389.459 2.828 0 50 GFAA CCc1cnc(N2C[C@@H]3[C@H](CNC(=O)C4CCCCC4)[C@H]4CC[C@]3(C2)O4)nc1 1857732433 QJAGMHMJHCRPLO-JZJXAQOMSA-N 384.524 2.719 0 50 GFAA COc1ccc(C(=O)N2CC[C@](Cc3ccccc3)(C(=O)O)[C@H](O)C2)c(C)c1 1875243858 BLDTUUMRRHFYBI-DENIHFKCSA-N 383.444 2.524 0 50 GFAA COc1ccc(CN2CCCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)cc1 1875289817 RECOBPZYHJJAQF-JKSUJKDBSA-N 398.507 2.789 0 50 GFAA C=CC(=O)N1CCC[C@@H](C(=O)Nc2cc(F)cc(N3C[C@H](C)O[C@H](C)C3)c2)C1 1875371207 SUWHHWOAHOFIGT-OWCLPIDISA-N 389.471 2.802 0 50 GFAA C=CC(=O)N[C@H]1CN(C(=O)C2(C)Cc3ccccc3C2)CC[C@@H]1C(F)(F)F 1875386253 LVYGPKPWQXJXED-HOTGVXAUSA-N 380.410 2.873 0 50 GFAA O=C(NCCn1cc(Br)ccc1=O)c1cncc2ccsc12 2325879375 SGLMIHFXPAPGLL-UHFFFAOYSA-N 378.251 2.651 0 50 GFAA COc1ccc(-c2onc(NCc3cnc4c(c3)CNCC4)c2C(=O)O)cc1 2356157093 DQMHDMDLEXMZIL-UHFFFAOYSA-N 380.404 2.701 0 50 GFAA Cc1ccc(-c2cn3c4c(=O)n(C)c(=O)n(C)c4nc3n2Cc2ccccc2)cc1 12461989 QEUHHQQQTACJJZ-UHFFFAOYSA-N 399.454 2.710 0 50 GFAA COc1cccc(OC)c1C(=O)NC(=S)Nc1ccc(Br)cn1 1112936 DNSWTQJSCRXPLW-UHFFFAOYSA-N 396.266 2.988 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)Cc2ccc(F)cc2Cl)C1=O 2356139383 WVZOKDBZHNKFMZ-IBGZPJMESA-N 382.863 2.652 0 50 GFAA O=C(O)CN1CCC[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1=O 2577894 WGBORFZFCVWACO-LJQANCHMSA-N 394.427 2.601 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(C(=O)c2conc2-c2ccccc2)C1 2356159399 YSLUWXINLTVWPN-OAQYLSRUSA-N 375.432 2.664 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)C2(c3ccccc3F)CC2)CC[C@@H]1O 2356160432 RQTCOOJUJPQCPU-LAUBAEHRSA-N 377.456 2.958 0 50 GFAA CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)c2ccccc2OC)c1 4671175 SEKUBWZLDKDPJW-UHFFFAOYSA-N 392.477 2.987 0 50 GFAA CCS(=O)(=O)N(C)c1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1 6697944 LACKLPHIPCWYKA-UHFFFAOYSA-N 378.450 2.742 0 50 GFAA CCc1cc(N2CCC[C@H](NC(=O)NCc3ccc(OC)c(F)c3)C2)ncn1 112506875 JAUGBSSSKJQMMU-INIZCTEOSA-N 387.459 2.655 0 50 GFAA C[C@@H](c1nc(-c2ccccc2)no1)N1CCC(CC(=O)N2CCN(C)CC2)CC1 114721726 RSQIEEWYISDVAA-KRWDZBQOSA-N 397.523 2.674 0 50 GFAA CNS(=O)(=O)c1ccc(CN(CCN(C)C)Cc2ccc(C)s2)cc1 55100517 XYULRERBNGJMQQ-UHFFFAOYSA-N 381.567 2.528 0 50 GFAA Cc1ccc(-c2cc(O)c3c(c2)CN(C(=O)CCCn2cnnn2)CCO3)cc1 67805764 XLDFRPMJVOSMQZ-UHFFFAOYSA-N 393.447 2.556 0 50 GFAA Cn1ccnc1[C@@H](O)C1CCN(Cc2ccn(-c3ccc(F)cc3F)n2)CC1 252499164 RWJQQKXSJPGMFV-IBGZPJMESA-N 387.434 2.830 0 50 GFAA CC1(C)[C@H](O)C[C@H]1NC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 426075617 HCKDGCRSYCVAEM-HUUCEWRRSA-N 386.477 2.976 0 50 GFAA CN(Cc1ccccc1)C1(CNC(=O)CCN2CCCO2)Cc2ccccc2C1 20203445 IHPJJIQTMCBBAG-UHFFFAOYSA-N 393.531 2.800 0 50 GFAA Cc1c(Cl)c(C(F)(F)F)nn1[C@H](C)c1nc2c3cnn(C)c3ncn2n1 2802437 CZROLDQJYCIOAV-SSDOTTSWSA-N 384.753 2.797 0 50 GFAA CCn1cc(NC(=O)/C=C/c2cc(Br)ccc2F)c(C(N)=O)n1 253421753 ONEYNUAOFNYCLI-ZZXKWVIFSA-N 381.205 2.555 0 50 GFAA Cc1ccc2c(c1)C(=O)N(CC(=O)N1CCC[C@@H]1CC(=O)c1ccccc1)C2=O 123966530 WFXHIYZOGHFEOY-QGZVFWFLSA-N 390.439 2.855 0 50 GFAA CN(C(=O)NCc1nnc2n1CCCCC2)[C@H]1CCCN(Cc2ccccc2)C1 174122448 AMEZKHWRIREREB-IBGZPJMESA-N 396.539 2.811 0 50 GFAA Cc1cc(=O)[nH]c(S[C@H](C)C(=O)N[C@H](C)c2cnn(-c3ccccc3)c2)n1 32577728 YPPYAZAUKPMANF-ZIAGYGMSSA-N 383.477 2.622 0 50 GFAA O=C(c1ccco1)N1CCN(C(=O)c2cnc3cc(Cl)ccc3c2O)CC1 218386247 CBIZKGQYRFPNFW-UHFFFAOYSA-N 385.807 2.785 0 50 GFAA O=C(O)[C@@H]1CCCCN1C(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 262646846 IPNYQLWGAVICDL-SFHVURJKSA-N 387.457 2.740 0 50 GFAA Cc1nc(C2CC2)ncc1C(=O)N1CCOC[C@@H]1CC(=O)Nc1ccccc1F 72428865 QITUAUIXMUZZPU-HNNXBMFYSA-N 398.438 2.671 0 50 GFAA CCCC[C@H]1CN(c2ccccc2OC)C(=O)CN1C(=O)C1CCN(C)CC1 82166643 QSKKKWNDDAXUNA-SFHVURJKSA-N 387.524 2.771 0 50 GFAA Cc1cccc(SC2CCN(C(=O)NC3(C(=O)O)CCOCC3)CC2)c1 426477460 WNJCNZDDWSJAEM-UHFFFAOYSA-N 378.494 2.895 0 50 GFAA O=C(CCS(=O)(=O)c1ccccc1)N[C@H]1[C@@H]2CCO[C@@H]2[C@@H]1C1CCCC1 223208886 MPDPICISURZQAJ-RNQOJCNYSA-N 377.506 2.560 0 50 GFAA COc1ccc(-c2[nH]ncc2CN2CCN(Cc3cccnc3)CC2)c(F)c1 199309761 STPJCOBOQLLUOJ-UHFFFAOYSA-N 381.455 2.937 0 50 GFAA CCCc1nnc(N2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)s1 91645033 MBEVCDHUFPBLNO-HNNXBMFYSA-N 378.542 2.879 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)[C@H](O)c2cccc(Cl)c2)CC1 95507721 BVERKGZOSRPQOE-QGZVFWFLSA-N 377.872 2.623 0 50 GFAA O=C([C@@H]1CCCCn2nnnc21)N(CCc1ccc(F)cc1)Cc1cccnc1 97370260 JLBCLRDEMOXPTL-LJQANCHMSA-N 394.454 2.746 0 50 GFAA O=C(Nc1cccc(-n2cncn2)c1)N1CCC([C@H](O)c2ccccn2)CC1 95508913 YMVSJTFUMYRDOA-IBGZPJMESA-N 378.436 2.640 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(C(=O)c2ccc(O)c(Cl)c2)C1 95498905 VBMFAIJWEIQKKR-OAHLLOKOSA-N 376.888 2.824 0 50 GFAA COCCOc1ccc([C@H](C(=O)O)N2CCN(c3ccc(C)cc3)CC2)cc1 95392450 GWFMCGWLBZWMOT-OAQYLSRUSA-N 384.476 2.968 0 50 GFAA NC[C@H]1CCCCN1C(=O)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91416685 UISJHLGYXQPSMM-LLVKDONJSA-N 395.290 2.621 0 50 GFAA COc1cccc(Cl)c1[C@H](C(=O)O)N1CCC(O)(c2cccnc2)CC1 95354755 DKGACSOTXAZAGP-QGZVFWFLSA-N 376.840 2.853 0 50 GFAA Cc1ccncc1C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91876418 UKVNTPJZKDUKAQ-UHFFFAOYSA-N 378.476 2.830 0 50 GFAA CC(C)c1nc(CN2CCC3(CCN(Cc4ncc[nH]4)CC3)[C@H](CO)C2)co1 97514445 SRRCNEBDZVXFDQ-KRWDZBQOSA-N 387.528 2.618 0 50 GFAA O=C(C[C@@H](c1ccccc1)c1ccc2c(c1)OCO2)NCCN1CCCOC1=O 95499968 DURLJYJVNNUEMY-SFHVURJKSA-N 396.443 2.896 0 50 GFAA CCc1noc(-c2cccc(NC(=O)NCc3nnc4n3CCCCC4)c2)n1 96131652 GEHMJQVVEWYCCH-UHFFFAOYSA-N 381.440 2.939 0 50 GFAA CN(C[C@H](O)CO)C(=O)c1ccc2oc(-c3ccc(C(F)(F)F)cc3)nc2c1 95522812 PRWZGFJDUZKJIG-AWEZNQCLSA-N 394.349 2.939 0 50 GFAA CCn1nc(COc2cccc(OC)c2)nc1-c1ccc(-n2cnnc2)nc1 96162934 JRLFXBVEXNLOSU-UHFFFAOYSA-N 377.408 2.528 0 50 GFAA Cc1nc(-c2ccccc2NC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cs1 333407276 GISWTNGYYXCAKK-CYBMUJFWSA-N 394.522 2.522 0 50 GFAA O=C(O)C[C@@H](NC(=O)c1ccc(Cl)c(N2CCNC2=O)c1)c1ccccc1 299749064 JARRPEAIUUUXSB-OAHLLOKOSA-N 387.823 2.815 0 50 GFAA Cn1nc(C(F)(F)F)c(C[S@@](=O)C2=NOC(C)(C)C2)c1OC(F)F 141006864 GXLGHGJWHZVKAD-DEOSSOPVSA-N 375.319 2.801 0 50 GFAA O=C(CN1C[C@H](c2ccccc2)CC1=O)NCc1coc(-c2ccccc2)n1 827831139 YECCMZUARIXJPQ-GOSISDBHSA-N 375.428 2.974 0 50 GFAA CCOc1cc(S(=O)(=O)N[C@H]2CCCN(C(=O)C(C)C)C2)ccc1Cl 823366084 CLHATOQVLCYFMA-ZDUSSCGKSA-N 388.917 2.664 0 50 GFAA Cc1nc(S(=O)(=O)NC[C@H](c2ccccc2)N2CCCCCC2)cn1C 670473706 YJZWCDKYIAIILC-GOSISDBHSA-N 376.526 2.624 0 50 GFAA COc1ccc2nc(CNC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)[nH]c2c1 670437794 IBPDWJDADUIUQR-IBGZPJMESA-N 392.459 2.883 0 50 GFAA O=C(CN1CCC[C@@H](c2cc[nH]n2)C1)NCCc1ccccc1OC(F)F 1875253016 JDICBZLSJMYCOH-OAHLLOKOSA-N 378.423 2.549 0 50 GFAA CN(C)c1nc2sc(C(=O)N[C@H](CC(=O)O)c3ccccn3)cc2s1 1875291656 HPQIOVLYMUBJEO-SNVBAGLBSA-N 376.463 2.765 0 50 GFAA CS(=O)(=O)Nc1cccc(OCCNC(=O)c2ccc3c(c2)CCC=C3)c1 1875255667 JUEIAKNXQLJIIF-UHFFFAOYSA-N 386.473 2.826 0 50 GFAA C[C@@H]1C[C@H](O)CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1 1875312025 GFLHHBILDTWDDO-VXGBXAGGSA-N 383.370 2.830 0 50 GFAA NC1CCN(c2cc(C(=O)N3CCC[C@H]3COc3ccc(F)cc3)ccn2)CC1 1875301833 SBOXNVDAAHXVCN-IBGZPJMESA-N 398.482 2.832 0 50 GFAA CNC(=O)c1cccc(O[C@@H]2CCN(C(=O)COc3ccccc3Cl)C2)c1 1875390479 OJUSCGMRLWFGNE-MRXNPFEDSA-N 388.851 2.758 0 50 GFAA Cc1nc([C@@H](C)N(C)S(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c(C)s1 952978416 ZLTSLTTZRUISAH-SECBINFHSA-N 381.479 2.587 0 50 GFAA Cc1nc(C(=O)N2CCC3(CC[C@H](CNC(=O)c4ccco4)O3)CC2)cs1 952978152 KEOVKVNZNRUAKN-CQSZACIVSA-N 389.477 2.628 0 50 GFAA CC(C)(NC(=O)[C@@H]1CCS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 885850866 ODRGDKHWWYFCAM-OAHLLOKOSA-N 387.457 2.728 0 50 GFAA c1cc2c(cc1CCN1CCC[C@H](c3[nH]ncc3CN3CCOCC3)C1)CCO2 275884423 HCVKBSHAVPIZON-FQEVSTJZSA-N 396.535 2.599 0 50 GFAA COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1cccc(C(=O)O)c1 170591075 JZSUGCDAOTVTDH-UHFFFAOYSA-N 390.417 2.543 0 50 GFAA C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cn(Cc2ccccc2)nn1 170609560 PXQNPBGOKLNHQK-QGZVFWFLSA-N 378.480 2.968 0 50 GFAA CCC[C@H](C)c1cc(NS(=O)(=O)c2ccc(OC)cc2CC(=O)OC)n[nH]1 414375766 SFVAJZNHWMWNES-LBPRGKRZSA-N 395.481 2.838 0 50 GFAA C[C@H]1CN(S(=O)(=O)CCc2ccc3c(c2)CCO3)c2ccc(F)cc2O1 193469287 ZWJIQFLFDMBVFM-ZDUSSCGKSA-N 377.437 2.920 0 50 GFAA CC(C)c1cc(C(=O)N2CCN(c3nsc4ccccc34)CC2)nc(N)n1 1506398432 BKWPCYGXDHLFBM-UHFFFAOYSA-N 382.493 2.754 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)Cc1cnc(NC[C@H]2CCCO2)nc1 1506401512 SHOUMAOEXZOJNW-HXUWFJFHSA-N 378.480 2.885 0 50 GFAA COc1cccc([C@@H]2CCN(CCS(=O)(=O)c3ccccc3)C2)c1OC 1529104316 NODMKPYPXBNNHO-MRXNPFEDSA-N 375.490 2.967 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@H](C)Cn2cccn2)ccc1F 1704315430 DGSFVJNGWWFUGM-GFCCVEGCSA-N 387.415 2.570 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCCN(c2nccc(C(F)(F)F)n2)CC1 1772814535 FIIJKMNXQWFWLK-UHFFFAOYSA-N 385.777 2.896 0 50 GFAA Cc1ccoc1C(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCC(O)CC3)ncc21 12053971 YYKUKTPYXMBXTJ-INIZCTEOSA-N 384.480 2.783 0 50 GFAA O=C(CCc1nnc(CCC2CCCCC2)o1)NCCc1cn2cccnc2n1 12299452 ZHPPFFIICLITCM-UHFFFAOYSA-N 396.495 2.917 0 50 GFAA CSCCNC(=O)C1CCN(C2CCN(Cc3cccc(C)n3)CC2)CC1 12308175 RNVHQZXOLNURLV-UHFFFAOYSA-N 390.597 2.546 0 50 GFAA Cc1cccc(CCNCc2ccc(OC[C@@H](O)CN3CCCCC3)cc2)n1 15063410 ZGCXSCPNPNMXED-QFIPXVFZSA-N 383.536 2.948 0 50 GFAA COc1ccc(N2C(=O)[C@@H]3[C@H](c4ccccc4)N4CCCN4[C@@]3(C)C2=O)cc1 19169290 HADLUEXZIMKMLH-CNNODRBYSA-N 377.444 2.621 0 50 GFAA COc1ccccc1N1CCN([C@H]2CCCN(CCCn3cccn3)C2)CC1 19217646 ZPLMXGIPUWWQJG-FQEVSTJZSA-N 383.540 2.568 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)N2CCN(c3ccc(F)cn3)[C@H](C)C2)c1C 1857670357 JGQATJKKLXKESV-GFCCVEGCSA-N 388.443 2.693 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(S(=O)(=O)c3cc(F)ccc3C)C1)CC2 1857673092 GIOTWEMBRXFFOZ-LJQANCHMSA-N 391.468 2.607 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857674389 GCABUMHKVKPEOF-WGGBDISSSA-N 392.455 2.579 0 50 GFAA CCCC[C@@H]1CN(C(=O)c2ccc(N3CCOCC3)nc2)C[C@H](C(C)C)O1 1857714847 OOQKIQHCVZXMSD-RTBURBONSA-N 375.513 2.974 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NC[C@@H]1Cc2ccccc2CN1C 1857729374 YCAOKSXSDIXEJK-INIZCTEOSA-N 393.516 2.949 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)s1 133876446 JUVSFFPFFNGXSF-GFCCVEGCSA-N 379.432 2.671 0 50 GFAA CC1(C)CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2ccccc2O1 135499867 VBDWYRYSFBHJIX-UHFFFAOYSA-N 393.487 2.873 0 50 GFAA O=C1O[C@H](C(=O)N2C[C@H](CO)c3ccccc32)Cc2cc(C(F)(F)F)ccc21 2325784843 NTTJORSLOZDBCH-PXAZEXFGSA-N 391.345 2.910 0 50 GFAA O=C1O[C@H](C(=O)N2C[C@@H](CO)c3ccccc32)Cc2cc(C(F)(F)F)ccc21 2325784844 NTTJORSLOZDBCH-SJCJKPOMSA-N 391.345 2.910 0 50 GFAA COc1cc(C)nc(N(C)CCN(C)C(=O)c2ncc(Cl)cc2Cl)n1 2325793819 IQUUOSAUXAFKFA-UHFFFAOYSA-N 384.267 2.704 0 50 GFAA N[C@@H]1CC2(CCN(C(=O)c3ccc4nc(Cl)nn4c3)CC2)Oc2ccccc21 2325795074 BEVZLPQNPHIJBN-OAHLLOKOSA-N 397.866 2.840 0 50 GFAA Cc1ccc2c(C[C@@H](C)NC(=O)c3ccnc(N4CCN(C)CC4)c3)c[nH]c2c1 2325859644 FEPYKAUHMTXXDD-QGZVFWFLSA-N 391.519 2.984 0 50 GFAA CCc1ccccc1N(CC(=O)Nc1ccc(OC)cc1OC)S(C)(=O)=O 652955 AYIZBUNEXBHLCY-UHFFFAOYSA-N 392.477 2.671 0 50 GFAA CCN(CC)S(=O)(=O)c1csc(C(=O)Nc2cccc(C(=O)O)c2)c1 1159111 RGDZFOZKTJFEOF-UHFFFAOYSA-N 382.463 2.729 0 50 GFAA CCC(=O)N[C@@H](NC(=S)Nc1cccc(C(=O)O)c1)C(Cl)(Cl)Cl 1787033 NIZVQHHNPBJKLL-NSHDSACASA-N 398.699 2.894 0 50 GFAA Cc1cc2c(cn1)CN(C(=O)[C@@H]1C[C@H]3CCCN3[C@]13C(=O)Nc1ccccc13)C2 2356147400 UNGDCWAQNBEXFC-FHJLPGHOSA-N 388.471 2.564 0 50 GFAA O=C(CSc1nnc(CCCO)n1-c1ccccc1)NCCc1ccccc1 2839719 SLHQUPXRFXVQTQ-UHFFFAOYSA-N 396.516 2.643 0 50 GFAA CN(C)c1ccc(C(=O)N2CCC[C@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)cc1 2356167186 USBHYDIDSRJWJB-JTAQYXEDSA-N 399.535 2.653 0 50 GFAA CCN1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)CC1 4809486 RTFYJBZAFMNWSY-UHFFFAOYSA-N 387.505 2.574 0 50 GFAA CCOC(=O)c1ccc(NC(=O)c2ccccc2N(C)S(C)(=O)=O)c(C)c1 10447022 UCAPGLRDZHWVBG-UHFFFAOYSA-N 390.461 2.820 0 50 GFAA O=C(NCc1ccco1)c1ccc([C@H]2CCCN2C(=O)Cn2cccn2)s1 20536842 IWTBFOSSIXJTFB-OAHLLOKOSA-N 384.461 2.831 0 50 GFAA OCCOc1ccc(CN2CCN(CC3CCCCC3)[C@@H](CCO)C2)cc1 23145020 WAYQOFFVIPWJNQ-NRFANRHFSA-N 376.541 2.507 0 50 GFAA CC[C@H](C)C(=O)N1CCc2c(c(C(=O)O)nn2CCc2ccc(OC)cc2)C1 67588295 ZFJQKBRXBNHIFS-AWEZNQCLSA-N 385.464 2.763 0 50 GFAA CCN(CC)C(=O)[C@@H]1C[C@H](N)CN1C(=O)c1cc(C)nc2c(C)cc(C)cc12 67851470 XCSKILIONZJZPC-LPHOPBHVSA-N 382.508 2.570 0 50 GFAA Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N(C)Cc1cn2c(n1)CCCC2 328628781 OCQUGGYNYZAZCD-UHFFFAOYSA-N 379.530 2.509 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)Nc1ccnn1C)CC2 328639901 PUDYGPHJARVKCC-MRXNPFEDSA-N 387.509 2.917 0 50 GFAA CC1=C[C@@]23C(=O)[C@@H](C=C4COC(C)(C)O[C@@H]4[C@]2(O)[C@@H]1O)[C@@H]1[C@@H](C[C@H]3C)C1(C)C 504185764 ONMDPPVVEFWDOD-LLUADHBQSA-N 388.504 2.614 0 50 GFAA biogenic O=C(O)COCCOCCNC(=O)OCC1c2ccccc2-c2ccccc21 2379491 XQPYRJIMPDBGRW-UHFFFAOYSA-N 385.416 2.643 0 50 GFAA biogenic C[C@@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)[C@H]1CCOC1 237348464 RMMZKZLMLQWLII-PWSUYJOCSA-N 397.353 2.744 0 50 GFAA Cc1nsc(N2CCCN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CC2)n1 173878542 WHQIFFBNHFLNBQ-UHFFFAOYSA-N 394.566 2.981 0 50 GFAA O=C(NCc1nccs1)[C@@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71758930 NHNBJGZCLUFTDV-GOSISDBHSA-N 399.564 2.531 0 50 GFAA Cc1cccc2nc(CN3CCC[C@H]3c3nc4c(n3C)CCCC4)cc(=O)n12 493676437 DHOUSVSDEYXCJK-IBGZPJMESA-N 377.492 2.952 0 50 GFAA CC(=O)c1c(C)nn([C@H](C)CC(=O)N2CCCN(Cc3cccnc3)CC2)c1C 426545508 XCOCLPREYZYBSQ-MRXNPFEDSA-N 397.523 2.783 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CCC(=O)N(CCc4c[nH]cn4)C3)CC2)c(O)c1 92098228 GMFQXAFKAOIERT-UHFFFAOYSA-N 396.491 2.511 0 50 GFAA CCN1CC[C@@]2(CCC1=O)CN(C(=O)Nc1cc(F)ccc1C)CCN2C 91896764 MSAQWGCLEQJLQT-FQEVSTJZSA-N 376.476 2.685 0 50 GFAA Cc1ccc(CNC(=O)CCN2C[C@H]3CC[C@@H]2CN(C(=O)C2CCC2)C3)cc1 95362774 KALLIRIHUSSUNR-TZIWHRDSSA-N 383.536 2.724 0 50 GFAA Cc1c(C(=O)N2CCNC(=O)[C@@H]2c2ccc(F)cc2)c2cc(O)ccc2n1C 97259316 RRLIRZLALWWAIZ-IBGZPJMESA-N 381.407 2.645 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCc1noc(Cc3cccs3)n1)C2 91973802 PNAFOFIWKHMPQK-CYBMUJFWSA-N 385.445 2.598 0 50 GFAA CSC[C@H]1CCCN(C(=O)Nc2cccc(N3C(=O)CN(C)C3=O)c2)C1 97492617 AUFICQQCVHSRCL-ZDUSSCGKSA-N 376.482 2.692 0 50 GFAA COc1ncccc1C(=O)N1CCC[C@@H](c2nccn2Cc2cccnc2)C1 95392391 NUOXNRQPCCJGPU-QGZVFWFLSA-N 377.448 2.750 0 50 GFAA OC[C@H]1CN(Cc2cccnc2)CCC12CCN(Cc1cccc(O)c1)CC2 97413400 AXAQYMQFULSKDU-OAQYLSRUSA-N 381.520 2.884 0 50 GFAA Cc1ccc(CN2CCC(c3nnc(CN4CCOCC4)n3C)CC2)c(C)c1 96164334 GPOXKENNUPSNOL-UHFFFAOYSA-N 383.540 2.644 0 50 GFAA COc1ccc([C@@H](NC(=O)c2cc(-c3ccccc3)on2)[C@H]2C[C@@H](O)C2)cn1 244742237 OEHPMCUIGFGYBS-GQIGUUNPSA-N 379.416 2.987 0 50 GFAA O=C(/C=C/c1cccs1)N[C@H]1CC[C@@H](n2cc(C(=O)N3CCCC3)nn2)CC1 252448858 BSHPGMNHFCXBLV-WTBPUQPLSA-N 399.520 2.889 0 50 GFAA CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@H]1c1ccc(OC)cc1 55228007 IKNVYAPBJGMVBC-IBGZPJMESA-N 387.480 2.742 0 50 GFAA C[C@@H](c1ccc(C(=O)NCc2cccnc2-n2cncn2)o1)N1CCCCC1 299782364 VOHJUDXUNRXHRK-HNNXBMFYSA-N 380.452 2.732 0 50 GFAA Cc1ccc2oc(=O)n(CCC(=O)NCc3noc(-c4cccs4)n3)c2c1 827823091 XBRSDBCTJMMVQK-UHFFFAOYSA-N 384.417 2.721 0 50 GFAA Cc1nn(CC(=O)N(C)Cc2ccc(Cl)s2)c(C)c1[C@H]1COCCN1C 952893316 INXFZPOOEBVLGR-OAHLLOKOSA-N 396.944 2.877 0 50 GFAA CN(Cc1cccc(C(F)(F)F)c1)C(=O)CS[C@H]1CCCS(=O)(=O)C1 1875282039 KLSYCSKTJMKUOZ-AWEZNQCLSA-N 395.468 2.974 0 50 GFAA CN=S1(=O)CCC2(CC1)CN(C(=O)[C@H](C)c1ccc(F)c(F)c1)CCO2 1875395547 DJKCQZRKZPYURX-NLAHEXIUSA-N 386.464 2.558 0 50 GFAA COc1ccccc1C(=O)N1CC[C@H](C)[C@H](CNC(=O)C23CCC(CC2)O3)C1 1875315186 KOQYWIAJXCSCOY-WMJQDKMCSA-N 386.492 2.621 0 50 GFAA Cc1cc(C(F)(F)F)nc(CCNC(=O)CCc2n[nH]c3c2CCCC3)n1 952971464 DONDGJLTCFINLI-UHFFFAOYSA-N 381.402 2.697 0 50 GFAA O=C(CC[C@@H]1C(=O)Nc2ccccc21)NC1CCN(C(=O)c2ccccc2)CC1 952963627 CNUJYLNLVIVFDV-IBGZPJMESA-N 391.471 2.924 0 50 GFAA Cc1nc(C)c(CCC(=O)N2CC(C)(C)[C@H]2c2nccn2CC2CC2)c(O)n1 888100652 ABOJXHUBRQVEPM-GOSISDBHSA-N 383.496 2.948 0 50 GFAA CC(=O)N1CCC2(CC1)C[C@@H]2N(Cc1nccn1C)C(=O)c1cccc(C)c1F 1775989533 ORKRPGQWEQNVGT-SFHVURJKSA-N 398.482 2.911 0 50 GFAA Cc1cc(C(=O)N2CCO[C@]3(CCCN(C(=O)CC4CC4)C3)C2)c(F)cc1F 1775998037 YXGJFNBLSUKQRP-NRFANRHFSA-N 392.446 2.907 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2nn(C)cc2Cl)cc1 1565508973 MOGHDASUSIGBJY-CVEARBPZSA-N 388.899 2.819 0 50 GFAA Cc1c(CNC(=O)N2CCO[C@H](c3ccnc(N(C)C)n3)C2)oc2ccccc12 275711546 VDCBVUAJCHSJGL-IBGZPJMESA-N 395.463 2.880 0 50 GFAA O=C(NC[C@H](O)c1c(F)cccc1Cl)[C@H]1CCN(c2ccc(F)cc2)C1=O 741290845 JZAHLDCCQSJFJJ-CJNGLKHVSA-N 394.805 2.821 0 50 GFAA CNC(=O)[C@H]1CCCN(CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)C1 111265477 XWYJYUYGGIKVRF-INIZCTEOSA-N 397.523 2.566 0 50 GFAA O=C([C@@H]1CCCN1Cc1ccccc1)N1CCN(c2cc(C3CC3)n[nH]2)CC1 189964084 HLUKHMDCNSZWGL-FQEVSTJZSA-N 379.508 2.600 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 192145979 SQTZCPPILLKJOR-ZDUSSCGKSA-N 375.856 2.899 0 50 GFAA CCCc1c(N[C@@H]2CCN(c3cnn(C)c3)C2=O)cnn1-c1ccc(F)cc1 192766961 MPCYRHGFVBPJLW-QGZVFWFLSA-N 382.443 2.915 0 50 GFAA CCCC[C@@H]1CN(c2cc(C(=O)N3CCN(C)CC3)ccn2)C[C@H](C(C)C)O1 1529146042 VLCPIYAVUZASMA-WOJBJXKFSA-N 388.556 2.889 0 50 GFAA O=C(CCc1ccncc1)N1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1772704017 HXPQGWSBXHHRTC-LEWJYISDSA-N 377.488 2.879 0 50 GFAA Cc1cc(CNC(=O)CCN2Cc3cc(Cl)ccc3O[C@H](C)C2)nn1C 11868176 KGSSKESZMAYEHV-CQSZACIVSA-N 376.888 2.671 0 50 GFAA CCN(CC)C(=O)C1CCN(C(=O)c2cn(C3CCCCCC3)nn2)CC1 12111866 FCDBJYCHCIFENF-UHFFFAOYSA-N 375.517 2.894 0 50 GFAA CSc1ccc(S(=O)(=O)NCc2cccnc2)cc1C(=O)N1CCCC1 16652316 WYVFPJMPNWXQRY-UHFFFAOYSA-N 391.518 2.518 0 50 GFAA Cc1cc(C(=O)NC[C@H]2[C@H]3CN(C(=O)CCCC(C)C)C[C@]34CC[C@H]2O4)on1 1857711609 ALDDRFUCURCUAC-BIZBXSGISA-N 389.496 2.545 0 50 GFAA Cc1nc(C)c(CN2C[C@@H]3[C@H](CNC(=O)CC(C)C)[C@H]4CC[C@]3(C2)O4)s1 1857713773 NEXVIOITJMARCK-TVKQPGBESA-N 377.554 2.902 0 50 GFAA COCc1ccc(C(=O)NC[C@H]2[C@H]3CN(c4ncccc4C)C[C@]34CC[C@H]2O4)o1 1875250176 DIJIGDAGZZKOKL-KCXPTXFHSA-N 397.475 2.543 0 50 GFAA Cc1cccnc1C(=O)NC[C@H]1[C@H]2CN(c3ncccc3C)C[C@]23CC[C@H]1O3 1875251358 AVWHUYLTTBUPRI-KCXPTXFHSA-N 378.476 2.507 0 50 GFAA CC1=C(C(N)=O)[C@H](c2ccccc2OCc2ccc(C)cc2)N2NC=NC2=N1 4368723 TTYCIDMCOBWKEO-IBGZPJMESA-N 375.432 2.593 0 50 GFAA C[C@H]1CN(C(=O)NCCOc2ccc(F)c(Cl)c2)CC2(CCOCC2)O1 455207900 GRYABDVMLQFZJL-ZDUSSCGKSA-N 386.851 2.837 0 50 GFAA O=C(NCc1ccnc(N2CCCC2)c1)c1cc(N2CCCC2=O)ccc1F 133123285 HKBJLYKRJIQRHK-UHFFFAOYSA-N 382.439 2.878 0 50 GFAA N[C@@H]1CCc2ncc(NC(=O)c3n[nH]c4cc(OC(F)(F)F)ccc34)cc2C1 2325727108 SBIHVWKBLLZZDN-SNVBAGLBSA-N 391.353 2.925 0 50 GFAA O=S(=O)(c1ncccc1C(F)(F)F)N1CC(O)(c2ccc(Cl)cc2)C1 2325754656 HDPAQMJBARBWDI-UHFFFAOYSA-N 392.786 2.646 0 50 GFAA COc1cc(C(=O)N[C@@H](C)C(=O)Nc2csc(C)c2)cc(OC)c1OC 2325760401 GPMFPWUHOZTAOJ-NSHDSACASA-N 378.450 2.839 0 50 GFAA COc1cc2nc(N3CCC(c4nnc(C)s4)CC3)[nH]c(=N)c2cc1OC 2325767423 OSCQKRSRBYXFFN-UHFFFAOYSA-N 386.481 2.603 0 50 GFAA Cc1ccc2[nH]c(C(=O)N3CCN[C@@H](Cc4ccc(F)cc4)C3)cc(=O)c2c1 2325773943 DZQLKYRBQNKVBV-KRWDZBQOSA-N 379.435 2.632 0 50 GFAA Cc1ccc(-c2n[nH]c(C)n2)c(NC(=O)CN2CCCc3c(CN)cccc32)c1 2325774236 TYXBKGANFKFWCW-UHFFFAOYSA-N 390.491 2.939 0 50 GFAA C[C@@H](C(N)=O)N1CCC2(CC1)C[C@H](C)N(C(=O)CC(C)(C)CC(F)(F)F)C2 2325793999 NUQYGEWUVMCNMQ-KBPBESRZSA-N 391.478 2.932 0 50 GFAA O=C(NCc1cnn(-c2ccc(Br)cc2)c1)[C@@H]1CCCNCC1 2325795622 PVHKNQTUDZOPDP-CQSZACIVSA-N 377.286 2.641 0 50 GFAA CN(C)c1ncnc2cc(C(=O)N3CC[C@@](N)(c4cccc(F)c4)C3)ccc12 2325796365 LDIHXJJHKRANFH-NRFANRHFSA-N 379.439 2.535 0 50 GFAA Cc1cnc2n1CCC[C@H]2C(=O)NCc1cnc2ccc(Br)cn12 2325806400 QNTRHAZPIFXKKZ-CQSZACIVSA-N 388.269 2.796 0 50 GFAA O=C(N[C@H]1CNCc2nccn2C1)c1ccc(Oc2ccc(Cl)cc2)cn1 2325856891 HHRVHYCAFSRYMG-AWEZNQCLSA-N 383.839 2.626 0 50 GFAA CCc1noc(C)c1C(=O)Nc1sc(C(=O)N(C)C)c(C)c1C(=O)OC 1052030 GJJOPPNQBRHJJM-UHFFFAOYSA-N 379.438 2.656 0 50 GFAA CCOC(=O)CN1C(=O)[C@](O)(CC(=O)c2ccccc2Cl)c2ccccc21 4841295 GLNDCUROYUQKGP-FQEVSTJZSA-N 387.819 2.710 0 50 GFAA COc1ccc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cc1OC 9016126 LCRJZLVGBQHPMD-UHFFFAOYSA-N 392.458 2.969 0 50 GFAA CO[C@@H]1CCCN(Cc2cnc(S(C)(=O)=O)n2CCCc2ccccc2)C1 55153978 QZEVAYNPRRFERK-LJQANCHMSA-N 391.537 2.530 0 50 GFAA COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)N1CCCC1 10449380 GXRWPWZVARIRFN-UHFFFAOYSA-N 386.473 2.683 0 50 GFAA Cc1ccc(OC(F)F)c(CNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1 128696881 CWCJOTZOMQRGSG-NSHDSACASA-N 380.313 2.623 0 50 GFAA CC(C)n1cc(C[C@H]2N=C(O)N(Cc3csc(Br)c3)C2=O)nn1 328610682 ITLLUMSWSIOTTJ-LLVKDONJSA-N 398.286 2.551 0 50 GFAA CN(c1cccnn1)C1CCN(C(=O)[C@@H]2C[C@]23CCOc2ccccc23)CC1 328602099 ADWVLGZVXOEEST-AVRDEDQJSA-N 378.476 2.644 0 50 GFAA C[C@@H](C(=O)Nc1ccccc1N1CCC(O)CC1)n1nnc(-c2ccccc2)n1 173674673 UAWBMILSSRRBHK-HNNXBMFYSA-N 392.463 2.501 0 50 GFAA Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1c(F)cccc1Cl)CC(=O)N2 33088113 GIEXNVGVTWXDOH-JTQLQIEISA-N 397.801 2.885 0 50 GFAA CNC(=O)c1cc(C)ccc1NCc1noc([C@@H]2COc3ccccc3O2)n1 153990127 GDCXXIZBAUDDRI-KRWDZBQOSA-N 380.404 2.862 0 50 GFAA COc1ccc2c(c1)CN(C(=O)c1ccc(=O)n(C)n1)[C@@H](C1CCCCC1)C2 364026582 WKELOKAOUMGMFK-HXUWFJFHSA-N 381.476 2.936 0 50 GFAA CC(C)[C@@H]1CN(C(=O)C2CCOCC2)CCC(=O)N1Cc1ccc(F)cc1 71748010 PXKSZWVRURTXRQ-IBGZPJMESA-N 376.472 2.838 0 50 GFAA CCCc1cc(=O)oc2cc(OCc3nnnn3CC3CCOCC3)ccc12 373046526 AWILQVIIWHNNFB-UHFFFAOYSA-N 384.436 2.738 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)CCC(=O)O)c2ccccc2)cc1 262630011 GTVNEWPCRMIWRU-IBGZPJMESA-N 390.505 2.811 0 50 GFAA COC[C@@H](C)n1c(CCCC(=O)N2CCCn3cncc3C2)nc2cccnc21 77319712 ZWWLNDQAHKTHMU-MRXNPFEDSA-N 396.495 2.590 0 50 GFAA C[C@H](C1CCN(C(=O)COc2ccc(F)c(Cl)c2)CC1)N1CCOCC1 72420043 BUNWOXKBCXGRSZ-CQSZACIVSA-N 384.879 2.817 0 50 GFAA COc1ccc(CN2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)cc1 71711972 LEJBYDGIGJKMMI-FQEVSTJZSA-N 385.552 2.994 0 50 GFAA Cc1cnccc1OC1CCN([C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)CC1 289355287 HWWPOGRTYKXTMF-INIZCTEOSA-N 394.475 2.607 0 50 GFAA CCn1c(CCNC(=O)c2ccccc2N2CCOCC2)nc2ccccc21 194604685 UKEURNKEDDAJME-UHFFFAOYSA-N 378.476 2.865 0 50 GFAA Cc1ccc(CNC(=O)C2CCN(c3cc([C@@H]4CCOC4)ncn3)CC2)cc1 426409300 KAAQFHDHMDZHFE-LJQANCHMSA-N 380.492 2.822 0 50 GFAA O=C(NCCSc1cnn[nH]1)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 426595073 RZWZTZNPPVDGJI-CYBMUJFWSA-N 391.888 2.973 0 50 GFAA COCc1nc([C@@H]2CCOC2)cc(N(C)Cc2ccc(-n3cccn3)cc2)n1 426420807 RATGKKNKTCYLGL-QGZVFWFLSA-N 379.464 2.949 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@H](c3nccn3CC3CC3)C2)c(=O)[nH]c1C 95520185 OCVNXILBMXMASX-INIZCTEOSA-N 382.464 2.512 0 50 GFAA Cc1cc(=N/C(O)=C2/C=C(c3ccccc3)N=N2)n([C@@H]2CCS(=O)(=O)C2)[nH]1 334159292 VGEYAFDIBLNVPJ-VCXPUZJPSA-N 385.449 2.619 0 50 GFAA Cc1cccc(C(=O)N2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)c1O 91782411 PKVKEBNPBNAHHE-QGZVFWFLSA-N 386.492 2.724 0 50 GFAA COc1cc(C(=O)N2CC[C@@](O)(C3CCOCC3)[C@H](C)C2)c2ccccc2n1 91663253 YXUICYLIVYLWLO-QRQCRPRQSA-N 384.476 2.883 0 50 GFAA O=C1CCc2cc(NC(=O)N3CCN(Cc4ccccc4)C[C@@H]3CO)ccc21 95527858 WQNZTIOFKCFALK-LJQANCHMSA-N 379.460 2.526 0 50 GFAA CN(C)CCCn1ccnc1C1CCN(C(=O)c2cccc(N(C)C)c2)CC1 95357040 GGIKQCOOFCTBPJ-UHFFFAOYSA-N 383.540 2.921 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)C2(c3ccccc3)CCCCC2)C[C@@H]1CO 91391245 QRETXXOVFCVGDK-WOJBJXKFSA-N 388.552 2.534 0 50 GFAA O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCO[C@@H](c2cccnc2)C1 297077177 OTKIIHFVMWTVSP-QHAWAJNXSA-N 380.492 2.875 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@H](CNC(=O)OCc2ccccc2)C[C@H]1C(=O)O 256028210 YTANOHUVAIRCTL-CABCVRRESA-N 378.425 2.623 0 50 GFAA Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)c1ccc2ncccc2c1 266310379 GJMDJAKENYQVGX-INIZCTEOSA-N 384.461 2.660 0 50 GFAA CN(Cc1nc2ccccc2[nH]1)C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O 53523490 AHNFIYQBLVGSBW-JOCHJYFZSA-N 396.466 2.688 0 50 GFAA CC(C)[C@H](C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)CC1CCN(C)CC1)c1ccccc1 1875336834 NUYQOUHRZXGXFH-FUDKSRODSA-N 397.563 2.970 0 50 GFAA Cc1cc([C@@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)c(C)o1 1875398059 ZEUAMQSSPGVXTP-NVXWUHKLSA-N 385.512 2.935 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3cc(F)c4ncccc4c3)CC1)O2 1875394573 NQTSZZHUMPXBFZ-MRXNPFEDSA-N 396.422 2.598 0 50 GFAA COc1cccc([C@@H]2CCN(C3CCN(C(=O)c4cnccn4)CC3)C2)c1OC 952977732 KVCOIPFSAWGOPM-MRXNPFEDSA-N 396.491 2.588 0 50 GFAA CCc1cc(N2CCN(C(=O)c3ccccc3NC(=O)[C@@H](C)CC)CC2)ncn1 952978583 DFBSRFPMPCHGLQ-INIZCTEOSA-N 395.507 2.986 0 50 GFAA Cc1nc(O)nc(O)c1CC(=O)NCCOC12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 952965378 GWJXLFIQCVHRHN-DELCKGKKSA-N 389.496 2.621 0 50 GFAA CC(=O)NCc1cc(O[C@@H]2CCN(CCO[C@@H]3CCCC[C@H]3C)C2)ccn1 886072081 NTPADHSHVRPWRP-MAODMQOUSA-N 375.513 2.766 0 50 GFAA CC(C)c1ocnc1C(=O)N(C)CC[C@H](NC(=O)[C@H]1CCCCO1)C(C)C 1775997220 YDSNNSNKGKVZCS-JKSUJKDBSA-N 379.501 2.970 0 50 GFAA CO[C@H]1C[C@H](c2nc(C)no2)N(S(=O)(=O)c2cc(Cl)sc2Cl)C1 275348372 SWRQYPWXHDOAMV-JGVFFNPUSA-N 398.293 2.897 0 50 GFAA CC[C@H](Oc1ccccc1C)C(=O)Nc1ccc(N2CCC[C@@H](C(N)=O)C2)nc1 221831168 DGHZJOSQPQDFLE-AEFFLSMTSA-N 396.491 2.888 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1 195434478 JAAJPWUQRKSFCP-SFHVURJKSA-N 375.490 2.965 0 50 GFAA COCCC(=O)N1C[C@@H]2CN(Cc3ccccc3-c3ccccc3)C[C@@]2(CO)C1 1772701606 LNADRGGQIWHUAR-URXFXBBRSA-N 394.515 2.643 0 50 GFAA COc1ccccc1-n1cc([C@H](C)NC(=O)c2cc(O)cc(C(=O)O)c2)cn1 1772709834 NTRCOANYDYLXMI-LBPRGKRZSA-N 381.388 2.776 0 50 GFAA C/C(=C\c1ccccc1)CN(C)CCn1cc(C(=O)NCc2ccncc2)nn1 12212568 NFKZXZJBVGWFFF-NBVRZTHBSA-N 390.491 2.638 0 50 GFAA COCc1ccc(CNCc2cccnc2N2CCN(c3ccccn3)CC2)o1 12464972 GHNUZGQCZYCDLT-UHFFFAOYSA-N 393.491 2.832 0 50 GFAA CC(C)Cn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCCc1ccccn1)C2 14755540 ZZLOACGJSDSPKO-IBGZPJMESA-N 395.551 2.860 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN([C@@H](C)CSC)CC1 14950973 LJVABRPDKDOMFF-HNNXBMFYSA-N 396.553 2.666 0 50 GFAA COc1ccccc1[C@H]([C@H](O)C(=O)c1c[nH]c2ccccc12)N1CCOCC1 15017551 RBTFANDLWWTNGH-IRLDBZIGSA-N 380.444 2.794 0 50 GFAA Cc1ccc2cc(-c3nccn3[C@@H]3CC(=O)N(C)C3)c(N3CCOCC3)nc2c1 1857672859 IOYJJXSPMWBDEP-QGZVFWFLSA-N 391.475 2.647 0 50 GFAA O=C(O)[C@H]1CN(Cc2ncc[nH]2)CC12CCN(C(=O)CC1CCCCC1)CC2 1857687721 BAIKFFLIUOGJKO-QGZVFWFLSA-N 388.512 2.505 0 50 GFAA Cc1[nH]c2ccc(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3cnn(C)c3)cc2c1C 1857726404 PFXHBJWXDXTPCD-SFTDATJTSA-N 395.507 2.662 0 50 GFAA Fc1ccc([C@@H]2CN(c3nccc(N[C@H]4CCCOC4)n3)CCO2)c(Cl)c1 333189737 VMALJHYSFBIERA-YOEHRIQHSA-N 392.862 3.438 0 50 GFAA Cc1nc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)nn1-c1ccccc1Cl 237681311 MHQRHQCJQIORRH-KRWDZBQOSA-N 396.834 2.881 0 50 GFAA O=C(O)CC[C@H]1CCCN(C(=O)[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)C1 238013152 BTDFASSEYOFPND-CJNGLKHVSA-N 378.856 2.796 0 50 GFAA C[C@H](CCc1ccccc1)CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1 242389620 ZYVGZRSBFPSYKF-QGZVFWFLSA-N 389.517 2.728 0 50 GFAA C[C@@H]1COCC[C@@H]1C(=O)N1CCC(n2nnc(-c3ccc(Cl)cc3)n2)CC1 2325810754 BNCZTSRBHSAREG-DYVFJYSZSA-N 389.887 2.830 0 50 GFAA Cc1c(NC(=O)c2ccnc(CN)c2)nnn1Cc1ccc(C(F)(F)F)cc1 2325858046 ZUMBJYGRUBOTBO-UHFFFAOYSA-N 390.369 2.760 0 50 GFAA COc1ccc(/C=c2\sc3nnc(-c4ccc(C)cc4)n3c2=O)c(OC)c1 1061470 BZTZDUOCWDAWBZ-YVLHZVERSA-N 379.441 2.691 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)NCc2ccc(C)cc2)cc1Cl 1076819 NZKGLNMGNGZIEO-UHFFFAOYSA-N 396.896 2.594 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1 1141825 YIIHTDZTSSMWHG-UHFFFAOYSA-N 389.477 2.667 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2cccc(Br)c2)NC(=O)N1 1189898 AWIYWWFBNRXJEF-HIFRSBDPSA-N 395.253 2.799 0 50 GFAA COC(=O)c1ccc(NC(=O)CSC2=N[C@H](c3ccccc3)CC(=O)N2)cc1 2869442 WSAXXZXIDFAORK-INIZCTEOSA-N 397.456 2.762 0 50 GFAA CC(C)C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)O 4700925 AYQHQTALHLLYTN-RTBURBONSA-N 382.460 2.643 0 50 GFAA COc1c(C)cccc1C(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1C 4842002 IOUSXRWYNGIGCL-UHFFFAOYSA-N 398.459 2.802 0 50 GFAA O=C(NCCc1ccc(Cl)cc1)c1cc(S(=O)(=O)N2CCCCC2)c[nH]1 6893570 KCUHUWADZUHHJK-UHFFFAOYSA-N 395.912 2.815 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCCC[C@H]2CCNC(C)=O)c(OC)c1 11664811 WUAYRCCYALLVTC-KRWDZBQOSA-N 386.496 2.975 0 50 GFAA c1ccc2sc(N3CCCN(Cc4nc(-c5cnccn5)no4)CC3)nc2c1 12027403 NKFODRDTMFFANQ-UHFFFAOYSA-N 393.476 2.849 0 50 GFAA C[C@H]1CN(C(=O)c2ccc(OC3CCN(C(=O)C4CC4)CC3)cc2)C[C@@H](C)O1 12205151 YUOIEQIRMBJCRE-IYBDPMFKSA-N 386.492 2.716 0 50 GFAA CCN(CC)C(=O)c1cc(-c2cccc(OC)c2OC)cc(-n2cnnn2)c1 12328791 DYUASFPBCWGQCZ-UHFFFAOYSA-N 381.436 2.829 0 50 GFAA Cc1cccc(NC(=O)CCC2CCN(C(=O)CCN3CCCC3=O)CC2)c1 12387399 YIFYGCFZYZNDOG-UHFFFAOYSA-N 385.508 2.965 0 50 GFAA COc1ccc(C(=O)N[C@H](NC[C@H]2CCCO2)C(Cl)(Cl)Cl)cc1 24302629 UTFWYWCXRCOFDK-OCCSQVGLSA-N 381.687 2.890 0 50 GFAA O=C(c1ccc(CS(=O)(=O)N2CCCC2)cc1)N1CCc2ccccc2C1 33359623 PDOMMLTZLHRVRW-UHFFFAOYSA-N 384.501 2.811 0 50 GFAA O=C(O)c1cnc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)s1 45254195 PHZDRQUKVAZUCA-UHFFFAOYSA-N 385.367 2.823 0 50 GFAA COCCCN1CC[C@H](Cn2cc(Oc3ccccc3)c(=O)c(C(=O)O)c2)C1 55308075 JZOIPHFAYBAFHB-INIZCTEOSA-N 386.448 2.697 0 50 GFAA O=C(NCCc1ccccc1)[C@@H]1CCCN(C2CCN(CC(F)F)CC2)C1 71753968 DGEAYEMAPSIMFA-GOSISDBHSA-N 379.495 2.787 0 50 GFAA COc1nc2c(cc1CNC(=O)CCc1ccncc1)C(=O)N(C1CCCC1)C2 71759858 PLSZXJHLPYFCLA-UHFFFAOYSA-N 394.475 2.633 0 50 GFAA Cc1nn(C)cc1C(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 72121617 RSQAGBRXVAERES-IBGZPJMESA-N 386.471 2.767 0 50 GFAA CN(Cc1ccc(CN2CCC[C@H](C(=O)c3ccccc3)C2)o1)S(C)(=O)=O 72430341 PVDADBNMNOQAMO-KRWDZBQOSA-N 390.505 2.766 0 50 GFAA CN(Cc1ccccc1)c1ncc2c(n1)CC(C)(C)C[C@H]2NC(=O)C(C)(C)N 91305959 UODZZNJOVITTJC-QGZVFWFLSA-N 381.524 2.980 0 50 GFAA Cc1ccc(C(=O)NCc2ccccc2-n2ccnc2)cc1N1CCNC1=O 91435286 ALMFQUOCPUUERH-UHFFFAOYSA-N 375.432 2.640 0 50 GFAA O=C(c1cnc(C2CC2)[nH]c1=O)N1CCC[C@H](Cc2nc3ccccc3[nH]2)C1 92046812 QMRGUUDFKSATDB-CYBMUJFWSA-N 377.448 2.619 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CC1)c1[nH]cnc1CCN2CC(C)C)n1cccn1 95504831 RLDALYMQBFLTIM-SFHVURJKSA-N 384.528 2.589 0 50 GFAA COc1ccc(C(=O)NC2CC2)cc1OC1CCN(Cc2cc(C)no2)CC1 95506634 ZARFHJWTEYSWHU-UHFFFAOYSA-N 385.464 2.927 0 50 GFAA O=C(CCC1CCN(Cc2c[nH]cn2)CC1)N[C@H]1CCN(Cc2ccccc2)C1 95526102 PMZQXVBVCLBLJB-NRFANRHFSA-N 395.551 2.793 0 50 GFAA COc1ccc(NC(=O)N(C)[C@@H](C)c2nccs2)cc1NS(C)(=O)=O 96130377 MFXDNCRYIYVCRO-JTQLQIEISA-N 384.483 2.748 0 50 GFAA Cc1nccn1Cc1nnc(C2CCN(CCc3cccc(F)c3)CC2)n1C 96148605 WYIVFEHLDMZXJL-UHFFFAOYSA-N 382.487 2.930 0 50 GFAA CCn1cnnc1CCNC(=O)Nc1cc(C)nn1Cc1ccccc1Cl 96163359 PNTLLSVNIMNKBN-UHFFFAOYSA-N 387.875 2.869 0 50 GFAA COc1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc3ccnn3c2C)cc1 97527917 CYRGOXURRMNMPS-SFHVURJKSA-N 380.448 2.868 0 50 GFAA CNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 115354646 MIVUKPRRNKCQSF-AWEZNQCLSA-N 382.386 2.987 0 50 GFAA COc1cc(F)ccc1N1CCN([C@@H](C)C(=O)N2CCc3ccccc3C2)CC1 115739451 VXUNIMZPBCGPKF-KRWDZBQOSA-N 397.494 2.930 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1c(Cl)nc2ccccn12 157150769 PSLSXLXBMPVQDX-LLVKDONJSA-N 394.888 2.516 0 50 GFAA CC(C)(CNC(=O)Nc1ccnn1C[C@@H]1CCOC1)N1CCc2ccccc2C1 159266394 JRLLJZMBAZICLS-KRWDZBQOSA-N 397.523 2.878 0 50 GFAA COc1ccccc1N1CC[C@H](N2CCC(C(=O)N3CCC(C)CC3)CC2)C1=O 177088614 OPLKWMOHDFCARO-FQEVSTJZSA-N 399.535 2.771 0 50 GFAA CC(C)c1ccnc(N2CCN(C(=O)C[C@@H]3OCCc4ccccc43)CC2)n1 186487894 LIGOSQHHEXBAFY-FQEVSTJZSA-N 380.492 2.953 0 50 GFAA Cc1ccc2c(CCNC(=O)C3CCN(c4cnccn4)CC3)cn(C)c2c1 186546546 PWJPRXZUESHMKJ-UHFFFAOYSA-N 377.492 2.852 0 50 GFAA COc1ccc(C)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 195434484 JAAJPWUQRKSFCP-GOSISDBHSA-N 375.490 2.965 0 50 GFAA CCOC(=O)C1([C@@H](C)NCCCCOC)CCN(C(=O)OC(C)(C)C)CC1 225406229 WMZSMBYQJKCEGT-MRXNPFEDSA-N 386.533 2.972 0 50 GFAA CC(=O)[C@H]1CC(C(=O)NCCCCN2CCC[C@@H](C)C2)=NN1c1ccccc1 229773163 LRRWRQSKOUHGAF-DYESRHJHSA-N 384.524 2.839 0 50 GFAA CN1C(=O)C2(CCN(Cc3nnc(-c4cccnc4)o3)CC2)c2ccccc21 244884351 YKWAJNRPJQEPJT-UHFFFAOYSA-N 375.432 2.642 0 50 GFAA CNc1cc([C@H]2C[C@@H](NC(=O)COc3ccc(Cl)cc3C)C2)nc(N)n1 244899636 ZNDAJSNNJRVFLX-BJHJDKERSA-N 375.860 2.504 0 50 GFAA C[C@H](CNC(=O)[C@@H](C)N1CCn2c(Br)cnc2C1)c1ccccc1 252536250 HZFAVYYJFAYRIW-ZIAGYGMSSA-N 391.313 2.770 0 50 GFAA CNC(=O)C1CCC(NC(=O)N2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)CC1 287168319 JHDYFGUNLWOJBB-WKXIVMOISA-N 385.508 2.505 0 50 GFAA O=C(N1CCC[C@H](c2nc(O)n[nH]2)C1)[C@@]12CCC[C@@H]1CN(Cc1ccccc1)C2 329062296 JZXXUKNEUYSSIN-NJNPRVFISA-N 395.507 2.519 0 50 GFAA O=C(NCCc1cn2ccccc2n1)N1CCCN2c3ccccc3C[C@H]2C1 377978417 RXMMSFLFAJETBO-IBGZPJMESA-N 375.476 2.723 0 50 GFAA O=C(N[C@@H]1CCCN(C(=O)C2CC2)C1)c1cccc(-c2ccccc2CO)c1 426701707 ULWCVFAGMASCKD-HXUWFJFHSA-N 378.472 2.977 0 50 GFAA Cc1nc(C)n(CCCNC(=O)c2ccc(-c3cnn(CC4CC4)c3)cc2)n1 534663960 DOENSODLKLMIHO-UHFFFAOYSA-N 378.480 2.989 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccc(Cl)s1 825566730 OOPVUEBYKHPWSY-UHFFFAOYSA-N 380.853 2.891 0 50 GFAA O=C(CNc1nc(C(F)(F)F)nc2ccccc12)N1CCCc2n[nH]cc21 888092702 GWNIKJVQNAYPBM-UHFFFAOYSA-N 376.342 2.763 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N1CCN(C2CCOCC2)CC1 952965057 CWDFEYITSGWHFG-UHFFFAOYSA-N 379.888 2.625 0 50 GFAA C[C@@H]1CCC(=O)N1c1ccc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)cc1 952980120 CMQSZERVKGGLIM-CQSZACIVSA-N 386.473 2.787 0 50 GFAA O=C(C[C@H]1NC(=O)c2ccccc21)Nc1cc2nc(O)[nH]c2cc1N1CCCC1 952984488 WNCZRQGRMOIYDZ-CQSZACIVSA-N 391.431 2.682 0 50 GFAA Cc1cc(C)n(-c2ccccc2CN2CCC(CNC(=O)[C@H]3CCOC3)CC2)n1 952986815 BEUAKXZHNQJQBZ-NRFANRHFSA-N 396.535 2.854 0 50 GFAA Cc1ccccc1-c1noc(CCC(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)n1 1704353348 SUIXDHGHZRUNMI-IEBWSBKVSA-N 392.459 2.747 0 50 GFAA Cc1ocnc1C(=O)N1CC[C@H]2[C@@H]1CC(=O)N2CCc1c[nH]c2ccccc12 1857682411 KEVMCFKLNHRHCR-ROUUACIJSA-N 378.432 2.522 0 50 GFAA Cc1ncnc(C)c1C(=O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857732051 ZYSGZRYEMSUYKN-NRFANRHFSA-N 379.464 2.587 0 50 GFAA Cc1cn2cccc(C(=O)N3CCO[C@@H](CO)[C@@H]3c3ccccc3Cl)c2n1 1875243630 PRGNLOIDKWJBJS-ROUUACIJSA-N 385.851 2.871 0 50 GFAA COC(=O)[C@H]1N(C(=O)[C@@H]2C[C@H]2c2ccnc3ccccc23)CC12CCOCC2 1875295800 QUSSETPRYFDHPL-YQVWRLOYSA-N 380.444 2.519 0 50 GFAA O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC[C@H](c2cnn[nH]2)C1 1875296449 XRKTWLLTYBJXJE-NSHDSACASA-N 387.241 2.587 0 50 GFAA O=C(CCc1ccccc1C(=O)O)N[C@H]1C[C@H](n2cc(-c3cncs3)nn2)C1 1875326137 BRGMIMFFMBCLQX-HDJSIYSDSA-N 397.460 2.552 0 50 GFAA Cc1ccc(-c2nc(-c3cnn(CCO)c3)nn2C2C[C@@H](C)O[C@H](C)C2)cn1 1875340541 HEVZRVSPBACQJP-HUUCEWRRSA-N 382.468 2.633 0 50 GFAA COc1cc(Cl)ccc1C[C@H](NC(=O)[C@@H](CC(C)C)n1ccnc1)C(=O)O 2325876113 KVTPOULOIRCMFR-JKSUJKDBSA-N 393.871 2.944 0 50 GFAA c1ccc(Cc2nc3n(n2)CCN(c2cc(N4CCCCC4)ncn2)CC3)cc1 2356152235 UXLSJNSCFAFEKX-UHFFFAOYSA-N 389.507 2.712 0 50 GFAA CCN(CC)C(=O)COc1cc2oc(=O)c(CC(=O)OC)c(C)c2cc1Cl 1121477 NGXSVXXWJLZKOP-UHFFFAOYSA-N 395.839 2.718 0 50 GFAA CC12CN(C(=O)c3ccccc3)CC(C)(CN(C(=O)c3ccccc3)C1)C2=O 4154655 BMRSTVMJISWHIP-UHFFFAOYSA-N 376.456 2.880 0 50 GFAA Cc1cc(Cl)ccc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O 6189067 BQJYFDOXKOUOAJ-UHFFFAOYSA-N 380.897 2.773 0 50 GFAA CCOC(=O)c1nn(C)c2c1CN(C(=O)c1cc(-c3ccc(C)s3)n[nH]1)CC2 14542215 UAXUUGXRILRSLX-UHFFFAOYSA-N 399.476 2.555 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)C3=CCCCC3)C2)cc1 14961790 QASMMRIIKKBMBD-MRXNPFEDSA-N 392.521 2.713 0 50 GFAA C[C@@H](C(=O)O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 34927255 KRPGETIDKNWVIE-MRVPVSSYSA-N 382.301 2.632 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3cc(-n4ccnc4)nc(C)n3)CC2)cc1 65361828 UEQRBDNWTOSTNY-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA NCCc1nc(N2CCC[C@H]2c2nc(-c3ccncc3)no2)c2ccccc2n1 65380860 KWWWYZVNNVACJX-KRWDZBQOSA-N 387.447 2.918 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(Cc4cnc5ccccn45)[nH]c3C2)c1 65436326 HEYSYFWWFBUAOJ-HNNXBMFYSA-N 387.443 2.727 0 50 GFAA Cc1ccc(CCNC[C@]2(O)CCCN(Cc3ccc(F)c(F)c3)C2=O)o1 67540398 WHEXGHKSJRPRBC-HXUWFJFHSA-N 378.419 2.552 0 50 GFAA O=C(NCc1cccnc1N1CCc2ccccc2C1)c1cc(Cl)c[nH]c1=O 67726033 JKURMCTVNHRUJQ-UHFFFAOYSA-N 394.862 2.916 0 50 GFAA CC1=C(C(=O)NCCCc2scnc2C)[C@H](c2ccsc2)NC(=O)N1 67967571 CBXKATDCIPPXGV-HNNXBMFYSA-N 376.507 2.890 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc3[nH]c(=O)[nH]c3c2)CCC(=O)N1Cc1ccccc1 71614709 HFFMRRFQUPQZBY-QGZVFWFLSA-N 392.459 2.510 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2[nH]c3ccc(Cl)cc3c2-c2ccccc2)CCN1 71754431 BFNCPXKDCJTJEK-INIZCTEOSA-N 383.835 2.987 0 50 GFAA Cc1noc([C@H](C)NC(=O)c2cccc(OC3CCN(C(=O)C4CC4)CC3)c2)n1 95529595 PKBYEDXLTDATPD-ZDUSSCGKSA-N 398.463 2.649 0 50 GFAA COc1ccc(CN(C[C@@H]2CCCO2)C(=O)Nc2cccn3cnnc23)cc1 96133806 XAYYEDISFPZIST-KRWDZBQOSA-N 381.436 2.951 0 50 GFAA C[C@H](CCN1CCN(C)CC1)NC(=O)C1(c2ccc(Br)cc2)CC1 170598023 GIXNPQJZPCEZLB-OAHLLOKOSA-N 394.357 2.623 0 50 GFAA CN([C@H]1CCN(c2ccccc2F)C1=O)S(=O)(=O)c1cccc2cnccc12 171836750 SCOJROFMPUCYJM-SFHVURJKSA-N 399.447 2.800 0 50 GFAA CCn1cc([C@@H]2CN(S(=O)(=O)c3cccc4cc(C)cnc34)CCO2)cn1 189228810 QSKMFYKEFGMUGX-KRWDZBQOSA-N 386.477 2.522 0 50 GFAA COc1ccc(-c2nc(C)c(C(=O)N[C@@H](C(=O)O)C(C)C)s2)cc1OC 206410869 DIMLWSAXSMBOHD-CQSZACIVSA-N 378.450 2.975 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)CCO1 238193941 HOSRNZYYOXIVJT-YFBAIUBQSA-N 377.746 2.988 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CC(=O)N(c3ccc(C)c(Cl)c3)C2=O)C1 239284725 BYKXAKUZWOSQOI-BBRMVZONSA-N 378.856 2.555 0 50 GFAA C[C@H]1CCO[C@@H]1C(=O)N[C@@H]1CC(C)(C)C[C@](C)(CNC(=O)[C@H]2OCC[C@H]2C)C1 241644385 PQHRHACFUFRSPA-ORHUHTHUSA-N 394.556 2.654 0 50 GFAA O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1cnc(O)c2ccccc12 241897384 TYGKIFLMPORFKQ-HXUWFJFHSA-N 377.444 2.744 0 50 GFAA O=C1[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1ccc(I)cc1 243915064 BMJVLFNSTCZFLG-PKCACUDHSA-N 391.208 2.849 0 50 GFAA Cc1ccc2[nH]c(C(=O)N[C@@H]3CCN(Cc4cccnc4)C[C@H]3O)c(C)c2c1 244763783 OVMCSGZHBOFNGY-WOJBJXKFSA-N 378.476 2.545 0 50 GFAA CN(Cc1c(F)cccc1Cl)S(=O)(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C 246758188 GFQIIPWDTGTLMN-VCTAVGKDSA-N 376.881 2.559 0 50 GFAA C[C@H](C(=O)N1CCC2(CC1)COC(=O)O2)N1C(=O)c2cccc3cccc1c23 252495869 PDIRKLFLIZTDFR-CYBMUJFWSA-N 380.400 2.717 0 50 GFAA O=C(NC1CC1)[C@H](O)C1CCN(CCOc2ccc(Cl)cc2Cl)CC1 253433195 TUGWBQFNDKSGGJ-QGZVFWFLSA-N 387.307 2.724 0 50 GFAA COc1nnc(N2C(=O)CN([C@H](C)c3cccc(Br)c3)C2=O)s1 328595483 WFLKLCQAIOIXMO-MRVPVSSYSA-N 397.254 2.839 0 50 GFAA CC(C)C1(c2ccccc2)CN(C(=O)CN2CCN(c3ccccn3)CC2)C1 412794724 NRKYXJVQIVHAIB-UHFFFAOYSA-N 378.520 2.640 0 50 GFAA O=C1NC[C@@]2(CCCN(C(=O)NCc3csc(-c4ccccc4)n3)CC2)O1 426444912 KDVLNWVRKMTXIX-IBGZPJMESA-N 386.477 2.984 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3cnn(C)c3)csc2C1 426492999 RKSNTRPUQBSXSI-UHFFFAOYSA-N 399.520 2.617 0 50 GFAA CC(=O)N1CCc2c(ncn(CCCOc3cccc4ccccc34)c2=O)C1 433979417 CJGIPGGEEFTQQE-UHFFFAOYSA-N 377.444 2.770 0 50 GFAA NS(=O)(=O)c1cccc2c(-c3nc(-c4ncsc4Cl)no3)nccc12 463184202 ZMILOWNYIJAEMK-UHFFFAOYSA-N 393.837 2.709 0 50 GFAA Cn1nc(-c2cccc(C(=O)N(CC3CCC3)C[C@@H]3CCCO3)c2)ccc1=O 534648579 LAHGSDKPPKNRQL-IBGZPJMESA-N 381.476 2.869 0 50 GFAA CNC(=O)c1cccc(CNC(=O)N(CCN(C)C)Cc2ccc(C)cc2)c1 584894746 NXVAEZZXVIAZTD-UHFFFAOYSA-N 382.508 2.628 0 50 GFAA Cn1ccnc1-c1ccccc1C(=O)NCc1csc(-c2cnccn2)n1 828184148 HOQNPDBADXKHHM-UHFFFAOYSA-N 376.445 2.931 0 50 GFAA CO[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1 888093167 HCGUNWQVWXBSLS-KRWDZBQOSA-N 396.553 2.968 0 50 GFAA CC(=O)Nc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(C)C3)C2)c(Cl)c1 952984159 LPRDYHANMUDHFQ-LJQANCHMSA-N 377.872 2.773 0 50 GFAA CCCNS(=O)(=O)c1ccc(C(=O)Nc2c(C)cnn2CC(C)C)cc1 1506425436 PABOXGCWYXEOTF-UHFFFAOYSA-N 378.498 2.788 0 50 GFAA Cc1cccc2nc(C3CCN(C(=O)CSc4nnc(N)s4)CC3)[nH]c12 1506427335 LKJFGJNYFYUGEX-UHFFFAOYSA-N 388.522 2.803 0 50 GFAA CCc1cnc(C)nc1N1CC[C@@H]2C[C@H](N3CCOCC3)CC[C@@]2(COC)C1 1704298210 HHOBZSOMEQWRPC-SJBKTWHCSA-N 388.556 2.691 0 50 GFAA C[C@H]1C[C@@H]1C(=O)N1CC2(CCN(C(=O)c3cnc4ccccn34)CC2)C[C@@H]1C 1775997028 QVOIAZAVSXDKPD-ULQDDVLXSA-N 380.492 2.834 0 50 GFAA COc1ccc(CN2C[C@@H]3CNC(=O)C[C@@H]3C2)cc1OCc1ccc(F)cc1 1800414327 NFXBWEYJXOVCAS-MSOLQXFVSA-N 384.451 2.981 0 50 GFAA Cn1nc2c(c1-c1ccccc1)CCN(C(=O)[C@@H]1CC(=O)OC13CCCC3)CC2 1857667674 LVSZADIBPKFMPF-SFHVURJKSA-N 393.487 2.890 0 50 GFAA COC(=O)c1cnc(N2CCC3(CC2)C[C@@H](O)C[C@H](c2ccccc2)O3)cn1 1857695233 AMRMIUGKQLZGCY-FUHWJXTLSA-N 383.448 2.515 0 50 GFAA O=C([C@H]1CCn2nccc2C1)N1CCCN(c2nc3ccccc3s2)CC1 1857700259 PRDIMDIXYBPREG-HNNXBMFYSA-N 381.505 2.794 0 50 GFAA O=C(Cc1ccc(-c2ccccc2)cc1)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857709837 UNUFUXWCZPPKGM-OFNKIYASSA-N 376.456 2.846 0 50 GFAA CC(C)[C@@H]1CO[C@@]23CCN(C(=O)COc4ccc5ccccc5c4)[C@@H]2CC(=O)N13 1857728564 HPLVLORBZFIYKY-MZKRTTBSSA-N 394.471 2.803 0 50 GFAA O=C(c1ccccc1OCc1ccccc1)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857732324 LVBZJLZDFVCLEV-OFNKIYASSA-N 392.455 2.829 0 50 GFAA CCN1CCCN(c2cc(N3CCCN(CC)CC3)nc(C(C)(C)C)n2)CC1 1875256715 ZCUTWZHQCIYSLE-UHFFFAOYSA-N 388.604 2.838 0 50 GFAA Cc1ccc(-c2nc(CN=c3cc(C4CC4)nc(S(C)(=O)=O)[nH]3)co2)cc1 1875275437 URPLVFYCHXGXOZ-UHFFFAOYSA-N 384.461 2.755 0 50 GFAA CC(C)C[C@H](CNC(=O)N(C)C[C@@H]1CCS(=O)(=O)C1)Cc1ccccc1 1875295043 CLLGIXQJNHMXON-OALUTQOASA-N 380.554 2.968 0 50 GFAA O=C(CN1CC[C@@H](c2ccccc2)NC1=O)N[C@H]1c2ccccc2CC[C@H]1CO 1875321783 VEIZLNBPKHOIIB-RCZSKKKRSA-N 393.487 2.555 0 50 GFAA O=C(Nc1cccc(-c2cnn[nH]2)c1)c1cccc(NS(=O)(=O)C2CC2)c1 1875328497 VLNBDKJFKLQPJM-UHFFFAOYSA-N 383.433 2.628 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@@H](n3cccn3)C2)(c2ccccc2)CC1 1875365936 SFPYMIXUJRMKCG-HXUWFJFHSA-N 392.503 2.793 0 50 GFAA CSC(C)(C)[C@H](N)C(=O)N1CCN(CCOc2ccc(Cl)cc2C)CC1 2100483019 MMXSVNLJNRLGKU-QGZVFWFLSA-N 399.988 2.640 0 50 GFAA C[C@@H]1c2sccc2CCN1C(=O)c1nc(N2CCOCC2)ncc1Cl 2325761479 UWSZGPPLOXYGKR-LLVKDONJSA-N 378.885 2.788 0 50 GFAA Cc1c(C(=O)N[C@@]2(CF)CCNC2)sc2nc(Cc3ccccc3)nc(N)c12 2325795178 MBVSXSLLTUAKPY-HXUWFJFHSA-N 399.495 2.604 0 50 GFAA Cc1nnc([C@@H](C)N2CCC[C@@](C)(CNC(=O)c3nccc4[nH]ccc34)C2)o1 2325812131 VJMZPIMTRFQTDW-XCLFUZPHSA-N 382.468 2.847 0 50 GFAA O=C(O)c1c(NCCCN2CCC[C@@H](O)C2)noc1-c1ccc(Cl)cc1 2356157505 NVEYAKDKNRLFGT-CQSZACIVSA-N 379.844 2.952 0 50 GFAA O=C(Nc1ccc(N2CCOCC2)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 665983 XISHVTWCFYEHKI-OAHLLOKOSA-N 383.423 2.654 0 50 GFAA COc1ccc(CN2CCC[C@]23CCCN(C(C)C)C3=O)cc1OCC(=O)O 2356133867 IWHQXIBJUKZIAW-OAQYLSRUSA-N 390.480 2.524 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc(N(CC)Cc3cnn(C)c3)nc2)CCN1C(C)C 20203648 HNEZDHVOFIFHMZ-FQEVSTJZSA-N 398.555 2.786 0 50 GFAA COCCCN(C(=O)CCC(=O)NC1CCCCCC1)C1CCN(C)CC1 55212098 YTIRVOSHJHEPEX-UHFFFAOYSA-N 381.561 2.565 0 50 GFAA Nc1ncccc1CNC(=O)c1coc(COc2cccc3cnccc23)n1 67856449 CDWBFOQLPIGRSR-UHFFFAOYSA-N 375.388 2.709 0 50 GFAA CN(C[C@@H]1CCCCO1)c1ccc(C(=O)N2CCC(Cn3cccn3)CC2)cn1 20991981 DCCFNXQBZNNPTI-FQEVSTJZSA-N 397.523 2.836 0 50 GFAA COc1ccc(C(=O)NC(=O)CN2CCC(c3nc4ccccc4o3)CC2)cc1 252536513 IUEPFSOJEBSKNB-UHFFFAOYSA-N 393.443 2.972 0 50 GFAA Cc1c(C)n(Cc2ccncc2)c2ncnc(NCCCN3CCOCC3)c12 20648684 LPWMENPZPLQMLZ-UHFFFAOYSA-N 380.496 2.626 0 50 GFAA O=C1NCCN(CC2CCCCC2)[C@@H]1CC(=O)N1CCC(c2ccncc2)CC1 12303516 ZYUOZHJOQGHQMT-OAQYLSRUSA-N 398.551 2.558 0 50 GFAA Cc1nc(CN(C)C(=O)c2coc(COc3cccc4cnccc34)n2)no1 67982540 XWBPUWBOTUFSRY-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)NCc2ccc3c(O)ccnc3c2)c1 253630230 WOAOMQMQCXAILM-UHFFFAOYSA-N 380.404 2.630 0 50 GFAA CN1CCO[C@H]2CCN(C(=O)Nc3cc(C(C)(C)C)nn3-c3ccccn3)C[C@@H]21 329058095 TXWTWOPBOZIBOG-HOTGVXAUSA-N 398.511 2.502 0 50 GFAA O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)c1cc(Cl)cc(C(F)(F)F)c1 363766083 GNAWDYUHIVRTNL-CQSZACIVSA-N 390.789 2.869 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)Cc4ccccn4)C3)C2=O)c1 11821723 HJNVLDHSDNZIAP-HSZRJFAPSA-N 393.487 2.674 0 50 GFAA OC(CN1CCC([C@@H]2CCCOC2)CC1)CN1CCC([C@@H]2CCCOC2)CC1 373183583 RKKGQTDBZWKYCG-FGZHOGPDSA-N 394.600 2.625 0 50 GFAA CCc1ncc(CN2C[C@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cn1 864097222 MZRKIPGNFZLWRP-MNOVXSKESA-N 384.324 2.613 0 50 GFAA COc1nc2c(cc1CN[C@@H](C)C1CCC1)C(=O)N(CCc1ccccn1)C2 71750425 LBTAHGDBZZSTMW-HNNXBMFYSA-N 380.492 2.962 0 50 GFAA O=C([C@H]1CCCN(C2CCN(c3cc(C4CC4)ncn3)CC2)C1)N1CCCC1 71750626 NJOAQNRETXTJDK-SFHVURJKSA-N 383.540 2.657 0 50 GFAA COc1ccc(CN(C[C@@H]2CCCO2)C(=O)NCc2n[nH]c3c2CCC3)cc1 426711233 GFRIDFULULYCEK-KRWDZBQOSA-N 384.480 2.798 0 50 GFAA CN(CC(=O)N[C@@H]1CCCc2sc(Cl)cc21)c1ncnc2nc[nH]c12 293777910 VTPHCNNXGROYKH-SNVBAGLBSA-N 376.873 2.698 0 50 GFAA CCCc1cc(N2C[C@@H]3CC[C@H](C2)N(Cc2c(C)noc2C)C3=O)nc(C)n1 95525228 YHHFDHSSAWKPDW-FUHWJXTLSA-N 383.496 2.970 0 50 GFAA O=C(Cn1c(=O)ccc2ccccc21)N1CCCN(c2ccc(F)cc2)CC1 95516466 AEWCCONFHQKEEG-UHFFFAOYSA-N 379.435 2.880 0 50 GFAA O=C1CC[C@H](CN2CCCN(C[C@H]3CCNC(=O)CC3)c3ccccc32)CCN1 294837860 AWSXVBMATXSTMF-KDURUIRLSA-N 398.551 2.536 0 50 GFAA COC(=O)c1cccc(NC(=O)N2CCC(N3C[C@H](C)O[C@H](C)C3)CC2)c1 95511068 TYJPLGDFQCEOOO-GASCZTMLSA-N 375.469 2.579 0 50 GFAA Cc1ccccc1CN1CCN(C(=O)CN(Cc2ccccn2)C2CC2)CC1 181368406 NTRQFOOMBRUJBV-UHFFFAOYSA-N 378.520 2.699 0 50 GFAA Cn1cc(-c2ccnc(NC(=O)[C@H]3CCN(c4ccccc4Cl)C3)n2)cn1 297735266 KQWOJNWNBNTBSN-ZDUSSCGKSA-N 382.855 2.996 0 50 GFAA CS(=O)(=O)N1CC[C@H](C(=O)N[C@H]2C[C@H]3CC[C@H]2C3)Oc2ccc(Cl)cc21 245279145 FIHZKTAGBXEHIW-MYLCLEHYSA-N 398.912 2.562 0 50 GFAA COc1cccc([C@H]2CN(C(=O)[C@H]3CC[C@@H](O)CC3)[C@@H]3C4CCN(CC4)[C@H]23)c1 252497893 HBSOGEVIQDQDLJ-IXXBJLTKSA-N 384.520 2.635 0 50 GFAA CC(=O)Nc1ccc(NC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)cc1 263618432 SYSMVXFBMWZRHD-GOSISDBHSA-N 395.394 2.899 0 50 GFAA Cc1nnnn1Cc1ccc(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1 828157770 LTWMUGGITPHZLY-HXUWFJFHSA-N 393.447 2.840 0 50 GFAA O=C(Cn1ccc(C(F)(F)F)n1)NCc1nnc(C2CC2)n1-c1ccccc1 1875296132 GVVOUFGWMPZOOR-UHFFFAOYSA-N 390.369 2.676 0 50 GFAA O=C1NCC[C@@H](NC(=O)N2CCC[C@@H](c3cccc(O)c3F)C2)c2cc[nH]c21 1875301161 BRPWBEUNVQMHIE-IUODEOHRSA-N 386.427 2.623 0 50 GFAA CNC(=O)CCNC(=O)c1cc(C)n(CCOc2ccccc2Cl)c1C 1875390350 LTGKQICBBNNPEU-UHFFFAOYSA-N 377.872 2.703 0 50 GFAA Cc1nc([C@H]2CN(C)CC23CN(c2nnc(C(C)C)cc2C(F)(F)F)C3)n[nH]1 1875392020 RUYALUNOUBFLAS-CYBMUJFWSA-N 395.433 2.581 0 50 GFAA COc1ccc(NC(=O)c2cnc(-c3ccccn3)nc2)cc1C(=O)N(C)C 952962635 HKLUVKWFGFFFIR-UHFFFAOYSA-N 377.404 2.501 0 50 GFAA O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)[C@H]1CCc2ccccc21 952981077 SKGPFBYJVFXCJS-FQEVSTJZSA-N 380.444 2.593 0 50 GFAA CN1CCN(C(=O)c2cccc3[nH]c(-c4cccs4)nc23)C[C@@]12CCOC2 1775960949 BUKSMXVJDNUYHC-HXUWFJFHSA-N 382.489 2.838 0 50 GFAA COCCN1CCC(CN(Cc2ccncc2)C(=O)[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 1565508413 ZXIBCKJAHMTAFP-BDTNDASRSA-N 383.536 2.981 0 50 GFAA CCO[C@@H]1C[C@](NC(=O)/C=C/c2ccc(NC(C)=O)cc2)(C(=O)OC)C1(C)C 170602670 KJXCXIJMWIZGQE-VTYRTOMDSA-N 388.464 2.521 0 50 GFAA Cc1cc(C(=O)N[C@@H](C)c2nnnn2C2CC2)nc(-c2ccc(Cl)cc2)n1 190292349 HKJOKHDQHHNJOR-NSHDSACASA-N 383.843 2.918 0 50 GFAA CCN(C[C@H]1COc2ccccc2O1)C(=O)CCc1nc(-c2ccccn2)no1 192509793 OPEKLJILLJNVBC-HNNXBMFYSA-N 394.431 2.753 0 50 GFAA O[C@H](CN1CCN(Cc2nc(-c3cccs3)no2)CC1)c1ccccc1F 193781009 LNESNDKHSXQLDC-MRXNPFEDSA-N 388.468 2.788 0 50 GFAA CC1CCN([C@H](CNC(=O)Cn2c(=O)[nH]c3ccccc32)c2cccs2)CC1 195628457 RMKJAKCJGROXMB-GOSISDBHSA-N 398.532 2.981 0 50 GFAA COc1ccc(CN2CCO[C@H](CO)[C@H]2c2ccc(OC)c(OC)c2)cc1F 1529158841 NYVRBQWHPKZJEJ-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA CC(=O)Nc1ccc(CN2CCC(CCC(=O)NC[C@H]3CCCO3)CC2)cc1 12594413 WINVKXZYWFOFDL-OAQYLSRUSA-N 387.524 2.932 0 50 GFAA COC[C@H]1CCCN(C(=O)c2ccc(OC3CCN(C)CC3)c(OC)c2)C1 12596317 WBZZUWWCKOGMQW-INIZCTEOSA-N 376.497 2.667 0 50 GFAA CSCCC(=O)N1CC(=O)N(CC(C)C)C[C@@H](OCc2ccccc2F)C1 14742771 YNLXKVZIMVCYHS-QGZVFWFLSA-N 396.528 2.791 0 50 GFAA O=C(NCCCOc1cccnc1)[C@@H]1CCC(=O)N(CCCc2ccccc2)C1 15063922 GWKIKXJSQMKGRQ-HXUWFJFHSA-N 395.503 2.838 0 50 GFAA COc1ccc(CN[C@H]2CNC(=O)c3cc(-c4cccs4)nn32)cc1OC 169754500 KZLVBLOSLWQJCB-GOSISDBHSA-N 384.461 2.661 0 50 GFAA N[C@@H]1C[C@@H](c2nc(Cc3cccc(Cl)c3)nn2-c2ccccn2)CC[C@H]1O 1857720013 AABRGTPPHQZQCO-USXIJHARSA-N 383.883 2.862 0 50 GFAA CC(C)(C)c1nc(O)c2c(n1)C1(CC2)CCN(C(=O)[C@@H]2CCC[C@H](N)C2)CC1 1857722358 JIHZXDINRGTGKY-CABCVRRESA-N 386.540 2.804 0 50 GFAA Cn1cnnc1[C@@H]1CCCN(C(=O)C[C@](C)(C(=O)O)c2ccc(Cl)cc2)C1 414071000 CQKWIGWGSRHTBX-YJYMSZOUSA-N 390.871 2.607 0 50 GFAA CCc1oc(C(=O)N2CCC[C@H](N(Cc3cncnc3)C(C)=O)CC2)cc1C 328629839 IRTNJLBICOFJCV-SFHVURJKSA-N 384.480 2.984 0 50 GFAA NCc1nc(C(=O)N2CCC[C@@]3(CCc4cnc(-c5ccccc5)nc43)C2)co1 1704315585 LFNMABUDKLYLQG-JOCHJYFZSA-N 389.459 2.711 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3cc(C)ccc3C)CC2)cc1OC 3621065 SXKKSGXDOJFHSI-UHFFFAOYSA-N 390.505 2.832 0 50 GFAA CCc1onc(C)c1CN1C[C@H](NC(=O)c2cc3cccn3cn2)C(C)(C)C1 2325793590 AETJHAVAPMNQSZ-IBGZPJMESA-N 381.480 2.834 0 50 GFAA Cc1ccc(-c2nn(CC(=O)NC[C@@H]3CCCO3)c(=O)c3ccccc23)cc1 1133449 CIIUBGOMDLKOOC-KRWDZBQOSA-N 377.444 2.667 0 50 GFAA CC(=O)N1C[C@@H]2CC[C@H](C1)N(C(=O)c1ccc(-c3cncc4nc[nH]c34)cc1)C2 2356135336 ZPQYSPRWVJGSQO-MAUKXSAKSA-N 389.459 2.708 0 50 GFAA O=C(NCc1cccc2ncnn12)[C@@H]1CCc2sc(-c3ccncc3)nc2C1 2356160161 GGBTYXCOQJLBAU-CQSZACIVSA-N 390.472 2.669 0 50 GFAA Cn1ccc2ccc(C(=O)N[C@@H]3C[C@H]4CO[C@@H](c5ccccc5)CN4C3)nc21 2356167031 RPCFQAJVWHAKNK-WSTZPKSXSA-N 376.460 2.518 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2ccccc2NC(=O)CC(C)(C)C)CC1 4731630 QGPHTNVWYCJEFH-UHFFFAOYSA-N 375.469 2.976 0 50 GFAA Cc1ccc(C2=NN=C(NC(=O)CSc3nnc(C)s3)SC2)cc1 4813551 KKTDGNHUDAGMAL-UHFFFAOYSA-N 377.520 2.870 0 50 GFAA CCN1C(=O)C[C@H](N2CCN(C(c3ccccc3)c3ccccc3)CC2)C1=O 22875866 XYFQLQZHLUZOJJ-FQEVSTJZSA-N 377.488 2.541 0 50 GFAA COc1ccc(NC(=O)CCc2nnc3ccc(-n4nc(C)cc4C)nn23)cc1 67640788 AUASBLFVADXLHL-UHFFFAOYSA-N 391.435 2.507 0 50 GFAA O=C(NN1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1ccc(Cl)cc1Cl 101127885 JTZFHKVDVOTUHR-OXHZDVMGSA-N 377.227 2.835 0 50 GFAA COc1ccccc1N1CCC(NC(=O)[C@@H](C)NC(=O)c2cccs2)CC1 138718143 CSOXZSCCJUKWNH-CQSZACIVSA-N 387.505 2.660 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Nc3ccc(OCC)cc3)CC2)n1 64800020 IGRQHKDHFLGCSR-UHFFFAOYSA-N 384.484 2.970 0 50 GFAA CN1CCN(Cc2ccccc2Oc2ccc(C(=O)N3CCCC3)cn2)CC1 67869092 KOGSONGFPHTERB-UHFFFAOYSA-N 380.492 2.857 0 50 GFAA O=C(Nc1ccc(Sc2ccncc2)cc1)C(=O)N[C@@H]1CCc2[nH]ncc2C1 119529362 VFABRZRLAAGMHN-OAHLLOKOSA-N 393.472 2.568 0 50 GFAA CNC(=O)c1ccc([C@@H]2CCCCN2Cc2cnc3nc(C)cc(C)n23)n1C 328621431 ALHCDLMWXIXDLO-SFHVURJKSA-N 380.496 2.771 0 50 GFAA CCN1CCN(c2ccc(C(=O)N3CCC[C@H](C(=O)CC(C)C)C3)cn2)CC1 67920867 SOTKJDWHJAKCHR-IBGZPJMESA-N 386.540 2.691 0 50 GFAA CNC(=O)[C@H](NC(=O)COc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 432330437 BAIOGYQRTYGTQV-OAQYLSRUSA-N 393.443 2.941 0 50 GFAA O=S(=O)(c1ccc(F)cc1)N1CCC[C@H](c2nnc3n2CCCCC3)C1 124003041 HYJNONUZZHPWDR-AWEZNQCLSA-N 378.473 2.712 0 50 GFAA Cc1cccc(NC(=S)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1 6334851 BOLLKYHJVPKZOI-UHFFFAOYSA-N 393.509 2.837 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)nnn1C1CCNCC1 237740885 LZJUGJNCVAOSGW-OAHLLOKOSA-N 394.479 2.672 0 50 GFAA Cc1cc(=O)[nH]c(S[C@H](C)C(=O)N[C@@H](C)c2cnn(-c3ccccc3)c2)n1 32577729 YPPYAZAUKPMANF-UONOGXRCSA-N 383.477 2.622 0 50 GFAA CC1=NN(c2ccc(C(=O)N3CCN(C4C[C@@H]5CC[C@H](C4)N5C)CC3)cc2)CC1 154611520 WHAPHOYZAVCRPD-CBQGHPETSA-N 395.551 2.656 0 50 GFAA CCn1c(CC2CCNCC2)nn(Cc2csc(-c3ccccc3)n2)c1=O 71757123 LFDSFUSIZHVKFC-UHFFFAOYSA-N 383.521 2.779 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3ccnc(N4CCCC4)n3)CC2)c1 72117602 NNXUITJIFBEAHB-UHFFFAOYSA-N 380.496 2.993 0 50 GFAA O=C(NC1CC1)c1noc([C@H]2CCCN2Cc2ccn(-c3ccc(F)cc3)n2)n1 375277062 WXOXFHPWJPWRGE-QGZVFWFLSA-N 396.426 2.624 0 50 GFAA CCCS(=O)(=O)N1CC[C@]2(CCCN(Cc3cccc(OC)c3OC)C2)C1 72149732 SIQMJPRWZDGXAF-FQEVSTJZSA-N 396.553 2.732 0 50 GFAA COc1cc(CCC(=O)N[C@@H]2CC(=O)N(Cc3ccc(F)cc3)C2)ccc1C 72154486 HHFPXXIDWGJOPG-LJQANCHMSA-N 384.451 2.993 0 50 GFAA COc1ccc2cc(NC(=O)N3CCCN(c4cccnn4)CC3)ccc2n1 158961070 GTBGNAJWQMGMNS-UHFFFAOYSA-N 378.436 2.778 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)Cc2ccccc2C(F)(F)F)CC1 378309128 DHOAYLHTINIMBJ-UHFFFAOYSA-N 382.386 2.971 0 50 GFAA O=C(NCCNC(=O)N1CCC(Cc2cccnc2)CC1)c1ccc(F)cc1 378421018 IGLSLDRLYOUAIB-UHFFFAOYSA-N 384.455 2.615 0 50 GFAA Cc1ccn(-c2ccc(NCCNC(=O)Nc3ccc(F)c(Cl)c3)nn2)n1 72437941 SKJBOGLYIXBYKJ-UHFFFAOYSA-N 389.822 2.997 0 50 GFAA COc1ccc([C@H](NC(=O)CSc2nnc(N)s2)c2ccncc2)cc1 216007595 KWCXFEHEZBMDNW-HNNXBMFYSA-N 387.490 2.522 0 50 GFAA Oc1cc(CN2CCN(c3cc(C4CC4)[nH]n3)CC2)nc(-c2ccccc2)n1 459429255 PCQFTMGILVUWJM-UHFFFAOYSA-N 376.464 2.772 0 50 GFAA O=C(CCCc1ccc2[nH]c(=O)[nH]c2c1)Nc1cccc(OCC(F)F)n1 133316036 OGGDEIWXJFHUIY-UHFFFAOYSA-N 376.363 2.857 0 50 GFAA O=C(N[C@@H]1CC(=O)N(Cc2cccc(F)c2)C1)c1ccccc1-n1cccn1 72172699 OYIVWJIEVCIXLU-QGZVFWFLSA-N 378.407 2.542 0 50 GFAA CS(=O)(=O)Nc1cccc(NC(=O)c2ccn(-c3c(F)cccc3F)n2)c1 175906028 KUMUEODNZBIGMP-UHFFFAOYSA-N 392.387 2.774 0 50 GFAA O=C([C@@H](O)c1ccccc1Cl)N1CCN(c2ccccc2Cl)C(=O)C1 82116183 XRYFCMHLEPSHIH-KRWDZBQOSA-N 379.243 2.902 0 50 GFAA CC(=O)N[C@@H]1CCN(c2nccc(-c3cnn(-c4ccccc4Cl)c3)n2)C1 19229219 XQAXMYDSNSICJV-OAHLLOKOSA-N 382.855 2.698 0 50 GFAA Cc1c(CNC(=O)N2CC[C@@H](c3ccc4ccccc4c3)[C@H](O)C2)cnn1C 426369155 IFFHOXOTPBLJJN-LEWJYISDSA-N 378.476 2.942 0 50 GFAA CCCCc1nc(CN2CCC3(CC2)c2[nH]cnc2CCN3C(=O)CC)c[nH]1 95500666 TZYKCPHZXJGQON-UHFFFAOYSA-N 384.528 2.761 0 50 GFAA COc1cccc(N2C[C@@H](Cc3ccccc3)N(Cc3c[nH]cn3)CC2=O)c1 82114577 OWTSQSROCQFPDY-HXUWFJFHSA-N 376.460 2.878 0 50 GFAA O=C(NCC1CCOCC1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]c1=O 91858775 SCOCRKBAWSSGJE-UHFFFAOYSA-N 396.274 2.824 0 50 GFAA CC[C@H](C(=O)OC)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 95366594 XZVKASUFGZYQLA-QGZVFWFLSA-N 380.435 2.731 0 50 GFAA CN(C)CCn1ccnc1[C@@H]1CCCN(c2ccc(Cl)c(C(=O)O)n2)C1 95530837 OGOYKKHELPNWEU-CYBMUJFWSA-N 377.876 2.575 0 50 GFAA O=C(CN1CCC2(CCC(=O)N(C[C@H]3CCCO3)C2)CC1)Nc1ccccc1 91951286 SQSXBOUONJHMQQ-LJQANCHMSA-N 385.508 2.509 0 50 GFAA COc1cc(NC(=O)CCN2CCN(c3ncccc3C)CC2)cc(OC)c1 244678851 ILJKCUMIZJNFTL-UHFFFAOYSA-N 384.480 2.558 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(NC(=O)[C@H]3C[C@@H]3C)c2)c1 298467543 YOXFJKBQUWGPIT-SGTLLEGYSA-N 376.420 2.818 0 50 GFAA Cc1cc2ncn(C[C@@H](O)CN3CCCN(c4ccccn4)CC3)c2cc1C 183827309 OTLUOAUMLKXYNA-IBGZPJMESA-N 379.508 2.621 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@H]3OCCc4ccccc43)CC2)ncn1 183969893 WGISMWJMFJFGPQ-FQEVSTJZSA-N 382.464 2.592 0 50 GFAA CCCCNC(=O)NC(=O)CN1CCO[C@H](c2ccccc2C(F)(F)F)C1 184015540 WDZHVBMNOIWSTK-HNNXBMFYSA-N 387.402 2.705 0 50 GFAA Cc1c(-c2ccc(C(=O)NCCCN3CCCC3=O)cc2)cnn1C(F)F 534655964 YESYKISUSCYZIM-UHFFFAOYSA-N 376.407 2.996 0 50 GFAA CN1C[C@]2(CCN(C(=O)Nc3ccccc3OCc3ccccn3)C2)OC1=O 299767664 IPARPLCQYYICRF-FQEVSTJZSA-N 382.420 2.719 0 50 GFAA Cc1nc(C)c(CNC(=O)Nc2ccc(C(=O)NC[C@H]3CCCO3)cc2)s1 299774898 JVJIBDKDEGQNSB-MRXNPFEDSA-N 388.493 2.990 0 50 GFAA O=C(N[C@@H]1C[C@H]1[C@H]1CCCNC1)c1nccnc1-c1nc2ccccc2s1 1875293023 ZXSDOVPCDPPVFT-KCQAQPDRSA-N 379.489 2.871 0 50 GFAA Cn1nc(CNC(=O)c2ccccc2N2CCOCC2)c2c(Cl)cccc21 952976292 FEKCJQDHARWORM-UHFFFAOYSA-N 384.867 2.993 0 50 GFAA Cc1ccc2oc(=O)n(CCC(=O)N3CCCN(c4ccncc4C)CC3)c2c1 952965846 ATUPGKPSXLQDTA-UHFFFAOYSA-N 394.475 2.735 0 50 GFAA O=C(Nc1ccccc1C(F)F)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@@H]3C2)C1 886093360 CWSQMMMAWLRORA-QLFBSQMISA-N 392.450 2.973 0 50 GFAA CC(C(=O)NCCN(C(=O)c1cccnc1N1CCCC1)C1CC1)=C1CCC1 1775997192 XRQUGVLKSNANFU-UHFFFAOYSA-N 382.508 2.903 0 50 GFAA CC(C)c1ccc(/C=C/C(=O)N[C@@H]2CCO[C@@]3(CCS(=O)(=O)C3)C2)cc1 170591865 RKKOTKLEDHZQIX-GYAHQXATSA-N 377.506 2.676 0 50 GFAA CS(=O)(=O)c1ccc(C2(C(=O)N[C@@H]3C[C@H]4OCC[C@@H]34)CCCCC2)cc1 1074566010 QTEZFFXUUAGBEL-RCCFBDPRSA-N 377.506 2.586 0 50 GFAA COc1c(C)cc(C)cc1S(=O)(=O)Nc1ccc2c(c1F)CCNC2=O 790073167 FEPJBADMQGSWMD-UHFFFAOYSA-N 378.425 2.538 0 50 GFAA CC(C)c1cc(C(=O)N(CCOc2ccccc2)C[C@H]2CCCO2)nc(N)n1 1506405553 AEQWNBXBNQBJQO-QGZVFWFLSA-N 384.480 2.882 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)c1ccc(CN2CCC(C)CC2)o1 1704312457 CBFBJWIGNPIONA-UHFFFAOYSA-N 387.528 2.747 0 50 GFAA O=C(C1CCC1)N1CCC(N2C[C@H](Cc3ccc4ccccc4n3)[C@@H](O)C2)CC1 1615958790 ZXWSTYABYIEJEA-CVDCTZTESA-N 393.531 2.861 0 50 GFAA O=C(O)COc1ccc(Cl)cc1-c1nccn1-c1ccc2c(c1)C(=O)NCC2 1772807972 XGUHVLGGDAQKKX-UHFFFAOYSA-N 397.818 2.942 0 50 GFAA CO[C@@H](C(=O)NC[C@@H]1Cc2cccc(-c3cncnc3)c2O1)c1ccccc1 12122827 GAIMSRDWOMKUTL-GHTZIAJQSA-N 375.428 2.951 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N1CCN(C(=O)COc2ccccc2)CC1 12409441 OZYZUHUBOPGPMW-UHFFFAOYSA-N 391.471 2.850 0 50 GFAA O=C(CC[C@]1(Cc2ccco2)CCC(=O)N1)NCc1ccc2nsnc2c1 12452878 CNGBQESEFORAJD-LJQANCHMSA-N 384.461 2.572 0 50 GFAA NC(=O)C1(C(=O)N2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)CC1 12475851 COFAQRJGNOPEFI-IBGZPJMESA-N 378.472 2.702 0 50 GFAA O=C(c1cn(C[C@H]2CCCO2)nn1)N1CCC(c2nc3ccccc3o2)CC1 12596909 SDMULEAQBAGYSI-OAHLLOKOSA-N 381.436 2.618 0 50 GFAA CCc1cc(=O)n(CC(=O)NCc2ccc(OC)cc2)c(-c2cccc(F)c2)n1 169752750 UFLNJJNEBJRLMO-UHFFFAOYSA-N 395.434 2.937 0 50 GFAA CCN1CCN(CCOc2ccccc2-c2nccn2-c2c[nH]nc2C)CC1 1857692953 AYTAUFCKRZLSIX-UHFFFAOYSA-N 380.496 2.587 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3cccc(-n4cccn4)c3)C[C@H]12 1857695981 GZCHLACASGYBRF-UHMOLFJZSA-N 379.460 2.946 0 50 GFAA c1ccc(-c2nccn2C[C@@H]2CC3(CCNCC3)CO2)c(Cn2cccn2)c1 1857713644 AJECZLYSCLUENS-IBGZPJMESA-N 377.492 2.954 0 50 GFAA CC(C)Cc1cc(C(=O)N2CC[C@@]34OC[C@@H](c5ccccc5)N3C(=O)C[C@@H]24)no1 1857726943 GCSZXVRDNUTNJF-JQVVWYNYSA-N 395.459 2.788 0 50 GFAA Cc1oc2c(c1C(=O)N1CC[C@@H](O)[C@@](CO)(Cc3ccccc3)C1)C(=O)CCC2 1857736318 OXZNVPUOGRYFAV-XXBNENTESA-N 397.471 2.535 0 50 GFAA O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N1CC[C@@]2(CCOC2)C1 120769849 OWOIUPYDNWBWAK-GOSISDBHSA-N 376.844 2.755 0 50 GFAA O=C(O)C[C@@H]1CN(C(=O)CCc2nc3ccccc3n2-c2ccccc2)CCO1 238200049 WGEZMGZPYJHSPW-QGZVFWFLSA-N 393.443 2.660 0 50 GFAA O=C(c1ccccn1)N1C[C@@H]2CC[C@H](C1)CN2C(=O)Cc1ccc(F)cc1F 253615516 HRRSGYJZQGRTLZ-PBHICJAKSA-N 385.414 2.666 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccnc(Oc2ccccc2F)c1 2325797088 IFJLMTKSXFDUHB-BMGDILEWSA-N 396.422 2.779 0 50 GFAA COC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Cl)cc(Br)c1OC 1158917 UZSJJHGMEFRFDH-LLVKDONJSA-N 389.633 2.912 0 50 GFAA COc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCC[C@@]12CCCN(C)C2=O 2356134872 GLDHPIXENYOAQQ-HXUWFJFHSA-N 394.537 2.903 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 2833522 KEKHDYOTOHWLDJ-UHFFFAOYSA-N 386.470 2.705 0 50 GFAA COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccc(OC)c(Cl)c2)cc1 4867662 QNJMFZIOCQWQCN-NSHDSACASA-N 398.868 2.663 0 50 GFAA C[C@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(-c2noc(CCC3CCCC3)n2)cc1 58598863 GDJANRNMFHNVOW-DCPHZVHLSA-N 398.507 2.759 0 50 GFAA O=C1N[C@@H]2CN(CCc3ccc4ccccc4c3)CC[C@H]2N1C1CCNCC1 420396364 DCDCNHCVWJUADE-FGZHOGPDSA-N 378.520 2.602 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc(F)ccc3F)C[C@@H]2CCO)CC1 20451065 SJPKLAUFTLLOCJ-FQEVSTJZSA-N 381.511 2.706 0 50 GFAA CS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Oc2ccccc2)nc1 67680383 XZRMHKCRCBIRAJ-MRXNPFEDSA-N 375.450 2.627 0 50 GFAA Cc1nc(N2CCN(C(=O)CCC3CCCCC3)CC2)cc(-n2cccn2)n1 67613584 FZXBZUCAXKILNF-UHFFFAOYSA-N 382.512 2.980 0 50 GFAA Cc1nc(CN(C)C(=O)c2coc(COc3cccc4cccnc34)n2)no1 67975768 OPIGZTXKIQYTKJ-UHFFFAOYSA-N 379.376 2.765 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(NCCc3ncc[nH]3)nc2)C1 67771398 VRJBCOLYJSVDFH-QGZVFWFLSA-N 383.496 2.927 0 50 GFAA COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)c1cc[nH]c1C1CC1 283906481 KWUHTGPXVXPCFS-UHFFFAOYSA-N 382.464 2.541 0 50 GFAA CC(C)[C@H](C(=O)N[C@H]1CCN([C@H](C(=O)O)C(C)C)C1=O)c1cccc(Cl)c1 478981529 IFVRFUWKNGBWSM-ULQDDVLXSA-N 394.899 2.906 0 50 GFAA Cc1cc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)c2ccccc2n1 124771123 RCQZOFZFQXCRRO-UHFFFAOYSA-N 380.536 2.919 0 50 GFAA O=C(c1ccccc1F)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71748507 FUVUCOYOLDPXIF-KRWDZBQOSA-N 387.499 2.765 0 50 GFAA CNS(=O)(=O)c1cc(C(=O)N2CC3(CCCC3)c3c(F)cccc32)co1 125862015 TWSRXSPHFNPWBW-UHFFFAOYSA-N 378.425 2.799 0 50 GFAA O=C1CC[C@@]2(CCCN(CCn3c(=O)oc4ccccc43)C2)CN1CC1CC1 77436907 VQZXJAWSVDILPD-JOCHJYFZSA-N 383.492 2.709 0 50 GFAA F[C@H]1CCN(Cc2cc3n(n2)CCN(Cc2ccc(-c4cc[nH]n4)s2)C3)C1 72169358 BWXDAGFJMDEUNQ-AWEZNQCLSA-N 386.500 2.894 0 50 GFAA Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)Nc1ccc(C(=O)N(C)C)cn1 292178881 GFKVCYIIRFMXAI-UHFFFAOYSA-N 389.765 2.599 0 50 GFAA Cc1c(C(=O)NC[C@@H]2CCOc3ccccc3C2)sc2ncn(C)c(=O)c12 95385329 WCCCHRJRHRGGPW-CYBMUJFWSA-N 383.473 2.675 0 50 GFAA CN(C)C(=O)Cc1ccccc1NC(=O)N(C)Cc1n[nH]c2c1CCCCC2 97076455 RKZHXARPGYHMQM-UHFFFAOYSA-N 383.496 2.973 0 50 GFAA O=C(CCc1ccc2[nH]ccc2c1)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1 180903212 GATVYGDVGKVWCD-LJQANCHMSA-N 397.500 2.711 0 50 GFAA CN(CC1(CO)CCC1)C(=O)[C@@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 91691729 XSQYBNDFAXPAKE-QGZVFWFLSA-N 392.927 2.742 0 50 GFAA Cc1[nH]nc2ncc(C(=O)N3CCc4c(ncn4CCc4ccccc4)C3)cc12 181758841 OHORUJRXIVNOOX-UHFFFAOYSA-N 386.459 2.904 0 50 GFAA COc1ccc(C)cc1[C@@H](C(=O)O)N1CCN(Cc2csc(C)n2)CC1 95386067 VQNFINQGHIGZKY-SFHVURJKSA-N 375.494 2.712 0 50 GFAA COCCn1ccnc1C1CCN(C(=O)c2cnn(Cc3ccccc3)c2)CC1 95507634 RSCRYLVNMMSPJZ-UHFFFAOYSA-N 393.491 2.794 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2ccc(-c3ncn(C)n3)cc2)CC1 183648428 VLAUHBXJWOWPDH-UHFFFAOYSA-N 391.475 2.890 0 50 GFAA COc1cc2c(cc1OC)[C@@H](C)N(S(=O)(=O)c1ccn(C(C)C)n1)CC2 1875290585 RCYJZVZZGQDRFO-CYBMUJFWSA-N 379.482 2.789 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@@H](C2CC2)CCN1C(=O)NCC1(c2ccccn2)CCC1 1875400653 HYBKEJPRBDPFBS-WBVHZDCISA-N 396.495 2.520 0 50 GFAA CCc1noc(C)c1C(=O)NC1(CN2CCN(c3ccc(F)cc3)CC2)CC1 888100909 YYMBQCKQIDMZHT-UHFFFAOYSA-N 386.471 2.769 0 50 GFAA CCn1cc([C@H]2CN(S(=O)(=O)c3c(C)c(C)cc(C)c3C)CCO2)cn1 189224654 ALRKURJJKLHHNG-GOSISDBHSA-N 377.510 2.899 0 50 GFAA Cc1cc(CNC(=O)c2ccc(SC(F)F)cc2)ccc1S(N)(=O)=O 225567965 YMMIBAAGENEFDR-UHFFFAOYSA-N 386.445 2.887 0 50 GFAA Cc1cccc(OCC(=O)N2CCN(Cc3cnc([C@H](C)O)s3)CC2)c1C 225638056 OMNAJEJXYXPNCT-INIZCTEOSA-N 389.521 2.536 0 50 GFAA Cc1cc(C)cc(OC[C@@H](O)CN2C(=O)O[C@@]3(CCc4ccccc43)C2=O)c1 225835912 PPDZXALOIAMBNK-HTAPYJJXSA-N 381.428 2.864 0 50 GFAA Cc1cc(C[C@@H]2CN(C3CCN(c4ccc(F)c(F)c4)CC3)C[C@H]2O)n[nH]1 1529181411 OBPTYOWKAFJURU-JLTOFOAXSA-N 376.451 2.501 0 50 GFAA COc1ccc(/C=C/C(=O)Nc2nc(C)c(C(=O)N(C)C)s2)cc1OC 998607 KMXSIRADIPEIHY-VQHVLOKHSA-N 375.450 2.822 0 50 GFAA CN(C)C(=O)N1CCC(C(=O)N2CCC[C@H](Nc3ccc(F)cc3)C2)CC1 12589205 MIYNQECKERZJSD-SFHVURJKSA-N 376.476 2.622 0 50 GFAA CC1CCN(C(=O)C[C@@H]2C(=O)NCCN2Cc2ccc3ccccc3c2)CC1 12707638 QTRPKFCFEYRFOE-OAQYLSRUSA-N 379.504 2.789 0 50 GFAA O=C(Cc1cccs1)NCCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O 169775665 LEITXTJUROAPCS-UHFFFAOYSA-N 396.447 2.723 0 50 GFAA COc1ccc(C(=O)N2CC[C@H](n3cc(-c4nc(C(C)C)no4)nn3)C2)cc1 169778167 VJPHRVVHYHWKSS-AWEZNQCLSA-N 382.424 2.547 0 50 GFAA O=C(CCC(F)(F)F)N1CCC2(CC1)CC(=O)N(CC1CCC1)CCO2 1857681174 BDVGFDYDUGJIRV-UHFFFAOYSA-N 376.419 2.739 0 50 GFAA Cc1cnc(CN2CCOC3(CCN(Cc4ccsc4)CC3)CC2=O)cn1 1857686830 DUHABPBGCWHCFT-UHFFFAOYSA-N 386.521 2.630 0 50 GFAA COc1ccc(CC(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1857728351 XZGMXULFJWFWMN-VIZSFHNOSA-N 392.455 2.539 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3ccccc3F)CC(=O)N2[C@H]1c1ccccc1 1857729513 DAZMUBSLYCLDSF-WFXMLNOXSA-N 382.435 2.773 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3[C@H](CN(C)C)[C@H]4CC[C@]3(C2)O4)c2ccc(F)cc2n1 1857730509 VDJMMIBKWDOPRE-XHYAQGIWSA-N 383.467 2.864 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@H]1CCCN(C(=O)c2ccc(F)cc2C)CC1 328648392 UKXIKGCVELPDPR-IBGZPJMESA-N 384.455 2.968 0 50 GFAA CCCOc1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)c(C)c1 252507484 WMVAWTUPBPBLIS-UHFFFAOYSA-N 394.493 2.866 0 50 GFAA CC(C)N1CCN(CCC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1 912696009 YMNQQJDSUARGRI-KRWDZBQOSA-N 388.339 2.559 0 50 GFAA CCOC(=O)c1[nH]c(C)c(CN(Cc2ccco2)C(=O)CCC(=O)O)c1C 3889515 PDWGSEIOSVMLSC-UHFFFAOYSA-N 376.409 2.795 0 50 GFAA Cn1ccc2ccc(C(=O)N3CCC(c4nnc5n4CCCCC5)CC3)nc21 2100543065 LAKGLXPLVAKCEA-UHFFFAOYSA-N 378.480 2.911 0 50 GFAA Cc1csc([C@H](C)CNC(=O)C[C@H]2CN(C(=O)C3CC3)C3(CCC3)CO2)n1 2325785419 XMAFDTWPVOYGNU-CJNGLKHVSA-N 391.537 2.621 0 50 GFAA CCCN1C[C@@H](c2nc(-c3ccc(N(C)C)cc3)nn2[C@@H]2CCOC2)CC1=O 2325839646 AASIBVVJPGEZER-FUHWJXTLSA-N 383.496 2.698 0 50 GFAA Cc1nc(C(C)(C)C)sc1C(=O)NCc1ccccc1CNC(=O)[C@@H](C)O 2325873520 KDIGTGSCAJIUIC-CYBMUJFWSA-N 389.521 2.676 0 50 GFAA CCOC(=O)c1cnc(SC)nc1N1CCN(c2ccccc2F)CC1 1398548 HBJRUISCHBUSJU-UHFFFAOYSA-N 376.457 2.841 0 50 GFAA CNC(=O)c1cc(S(=O)(=O)Nc2cccc(Br)c2)cs1 6681535 HGQJNZMJCXRFJD-UHFFFAOYSA-N 375.269 2.671 0 50 GFAA O=C1N[C@H](c2cccc(Cl)c2)[C@H](C(=O)c2cccnc2)[C@@](O)(C(F)(F)F)N1 11667633 JMWAGBGINOXEHS-XJKCOSOUSA-N 399.756 2.839 0 50 GFAA C[C@@H]1CN(CC(=O)NCc2ccc3c(c2)OCO3)Cc2cc(Cl)ccc2O1 11964133 SIOUCCGPXJLUGT-CYBMUJFWSA-N 388.851 2.968 0 50 GFAA Cc1ccsc1C(=O)N[C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21 12314243 PXXYZKATHUPCTE-INIZCTEOSA-N 386.521 2.863 0 50 GFAA Cc1c(NC(=O)CCc2ccc3c(c2)OCO3)c(=O)n(-c2ccccc2)n1C 12934618 ZYPCRPMSLKAGEA-UHFFFAOYSA-N 379.416 2.784 0 50 GFAA CCn1nc(C(=O)N2CCOCC2)c2c1CC[C@H](NCCC1=CCCCC1)C2 14753813 KCVHTCAEAGDBFH-SFHVURJKSA-N 386.540 2.713 0 50 GFAA COC(=O)c1cccc(CN2CCN(C(=O)/C=C/c3cccs3)CCC2=O)c1 14887546 OLUBMCLFUWYHCC-BQYQJAHWSA-N 398.484 2.809 0 50 GFAA CCc1csc(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3OC)C2)n1 19798957 IVWKZNFWTBCSPZ-OAHLLOKOSA-N 387.505 2.769 0 50 GFAA CCOc1ccc(CN2CCN(Cc3ccsc3)[C@@H](CCO)C2)cc1CO 20388982 LNYFGPHXFSRLLQ-FQEVSTJZSA-N 390.549 2.708 0 50 GFAA CN(C)C(=O)N1CCC[C@H](C(=O)Nc2nnc(CCc3ccccc3)s2)C1 59745321 XFGIKAJGLKMQSU-HNNXBMFYSA-N 387.509 2.655 0 50 GFAA CCS(=O)(=O)N1CCC(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)CC1 67601818 QNHIKUXPKGBWNP-MRXNPFEDSA-N 380.554 2.921 0 50 GFAA CC1=C(C(=O)NCCCc2scnc2C)[C@@H](c2ccsc2)NC(=O)N1 67967569 CBXKATDCIPPXGV-OAHLLOKOSA-N 376.507 2.890 0 50 GFAA COc1ccc2[nH]c(C(=O)N[C@@H]3CC(=O)N(Cc4ccc(F)cc4)C3)cc2c1 72120790 PUAZIFOPKVYDKK-MRXNPFEDSA-N 381.407 2.847 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)c3cnc(SC)nc3)CC2)OC1=O 77541361 CCSGYPHRJDYWLR-CYBMUJFWSA-N 378.498 2.814 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(c2nc(C)cnc2C)CC3)cn1 95352842 UWIBACGGLDQVFA-UHFFFAOYSA-N 380.496 2.601 0 50 GFAA OCc1csc(N2C[C@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)n1 95363773 NCXIZWJAMALGGE-KZNAEPCWSA-N 377.460 2.980 0 50 GFAA COCc1ncc(CN2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)cn1 95377195 OQLXFDHHFVTLHC-DYESRHJHSA-N 378.520 2.687 0 50 GFAA Cc1ccc(C(N)=O)cc1NC(=O)NCC1(c2ccccc2)CCN(C)CC1 95503588 GWWBUPHAZZFDLX-UHFFFAOYSA-N 380.492 2.879 0 50 GFAA O=C(Cn1ncc(N2CCCC2)cc1=O)N1CCC[C@@H](c2ccccc2)CC1 95520373 UKAKDKZEBSTWGK-LJQANCHMSA-N 380.492 2.640 0 50 GFAA CSCCC(=O)N1CCC2(CCN(Cc3ccccc3)CC2)[C@@H](CO)C1 97717071 NOCBDPOGYIRJSZ-LJQANCHMSA-N 376.566 2.863 0 50 GFAA CCn1c(=O)c(C(=O)Nc2c(O)c3ccccc3[nH]c2=O)c(O)c2ccccc21 100709262 UEIHKCOBJNCKBG-UHFFFAOYSA-N 391.383 2.526 0 50 GFAA C[C@@H](OC1CCCCCC1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 126908683 MBHGQUUPNKYRHC-MRXNPFEDSA-N 394.537 2.988 0 50 GFAA CCNc1nc(C(=O)N2CCC(NC(=O)c3ccc(C)s3)CC2)cs1 128570020 ODYOJINTOBBNSD-UHFFFAOYSA-N 378.523 2.979 0 50 GFAA Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N[C@@](C)(CO)C1CCCCC1 157852837 SRVHMHVSKBMGID-QFIPXVFZSA-N 398.507 2.520 0 50 GFAA Cc1ccc(N2CCC(C(=O)N3CC[C@@H](OCc4ccncc4)C3)CC2)nc1 172250801 KRTYVNVGLWMKFR-HXUWFJFHSA-N 380.492 2.819 0 50 GFAA O=C(O)CCN(C(=O)c1cc(-c2ccc(Cl)cc2)n[nH]1)C1CCOCC1 238076768 UAPAMFRIZOEDRE-UHFFFAOYSA-N 377.828 2.826 0 50 GFAA Cc1nccn1CC1CCN(CCC(=O)Nc2ccsc2C(=O)O)CC1 244700844 JVCLRSZXAORPEG-UHFFFAOYSA-N 376.482 2.692 0 50 GFAA CCC[C@H](NC(=O)[C@@H](C)Sc1nnnn1C[C@H]1CCCO1)c1ccccc1 252444198 PMUMEMRGPZLPCF-OIISXLGYSA-N 389.525 2.990 0 50 GFAA CC[C@@H](C)[C@H](CO)NC(=O)C1CCC(Cn2cnc3ccccc3c2=O)CC1 252484087 FOFNAKDSIJPAQC-ILCXRZRJSA-N 385.508 2.726 0 50 GFAA O=C(NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)[C@H]1CSc2ccccc2O1 252494015 NIJJEEIXGAIMFK-HNAYVOBHSA-N 396.468 2.784 0 50 GFAA COc1ccc([C@@H](NC(=O)CC2CCOCC2)C(=O)O)cc1Br 262978227 KKXBKPJKYZBROH-OAHLLOKOSA-N 386.242 2.516 0 50 GFAA Cc1c(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)sc2nccn12 270865304 IRXXMFUKRALGMM-SFHVURJKSA-N 398.532 2.880 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCN(C(=O)c3ccco3)CC2)ncn1 275561069 FSXKPDLTMGLVNZ-JXFKEZNVSA-N 399.495 2.648 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@@H]2CCC[C@@H](C3CC3)C2)[C@@H]1c1cnn(C)c1C 328633697 SUIJNPILKUNEOS-VQQMMKBISA-N 388.556 2.823 0 50 GFAA CC(C)(C)c1csc([C@@H]2CN(C(=O)c3ccc4nccnc4n3)CCO2)n1 333662646 HGNWMXPPXUVOMB-AWEZNQCLSA-N 383.477 2.993 0 50 GFAA C[C@@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cccc(C(=O)N(C)C)c1 362453549 SBNUTAVCZQDUPN-AWEZNQCLSA-N 378.432 2.799 0 50 GFAA O=C(NCc1csc(-c2ccccc2)n1)[C@@H]1CC(=O)N(c2nccs2)C1 362850030 FZGVGTYSLGWFLP-CYBMUJFWSA-N 384.486 2.936 0 50 GFAA NS(=O)(=O)c1cccc(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1 375688876 LLBDJWFYYXNLLO-ZCNNSNEGSA-N 399.516 2.541 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(c1cncc3nncn13)CC2 377151988 QQIKQKUJJIRVDC-INIZCTEOSA-N 382.493 2.593 0 50 GFAA O=C(c1ccccc1-n1cnnc1)N1CCN([C@@H]2CCc3ccccc3C2)CC1 426658515 RAFSEULOZPBQLV-HXUWFJFHSA-N 387.487 2.583 0 50 GFAA O=c1cccc2n1C[C@H]1C[C@@H]2CN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1 451230679 UNQKNPGWECWRBP-LZLYRXPVSA-N 392.421 2.890 0 50 GFAA CCc1cc(N2CCN(C(=O)NC3(c4cc(F)ccc4F)CC3)CC2)ncn1 584900828 HUVZGGBUMBHMQY-UHFFFAOYSA-N 387.434 2.838 0 50 GFAA COc1cc(OC)cc([C@H](O)CNC2CCN(C(=O)OCC(C)C)CC2)c1 796770531 CSWVNFZMOZKPQO-LJQANCHMSA-N 380.485 2.584 0 50 GFAA O=C(Nc1cccc(CN2CCCC2)c1)[C@@H](c1cccnc1)N1CCOCC1 827654409 BYBBBDKVXJYLQA-OAQYLSRUSA-N 380.492 2.689 0 50 GFAA CN(C)CCn1nnc2c1C[C@H](c1nc(C34CC5CC(CC(C5)C3)C4)no1)CC2 952895574 WUNHCMBMMVWVJB-GOWZHPGHSA-N 396.539 2.963 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC(C(=O)NCCc4ccccc4)CC3)ccc21 952969913 KUHFGHJZEMGINE-UHFFFAOYSA-N 390.487 2.784 0 50 GFAA COc1cc(-c2onc(N3CCC[C@](C)(C(=O)O)C3)c2C(=O)O)ccc1F 1704331229 PSJWKDCBSGUDEC-SFHVURJKSA-N 378.356 2.879 0 50 GFAA COc1cc2c(cc1-c1nccn1-c1ccc3c(c1)C(=O)NCC3)OCCO2 1772804392 OASZQVXMNKXWPT-UHFFFAOYSA-N 377.400 2.605 0 50 GFAA COc1cc(CCC(=O)N[C@H]2CC[C@H](CN3Cc4ccccc4C3=O)CC2)on1 1775942485 RTXMPJIAIWOVFI-JCNLHEQBSA-N 397.475 2.947 0 50 GFAA CC[C@]12COC(=O)N1CCN(C(=O)c1ccccc1OC(F)(F)C(F)F)C2 1857679055 FBMRUFACOLMRMD-INIZCTEOSA-N 390.333 2.980 0 50 GFAA O=C(NCCc1c[nH]c2ccccc12)[C@]12COC[C@H]1CN(Cc1ccco1)C2 1857694530 QVNLTPDBJVMPMB-VGOFRKELSA-N 379.460 2.568 0 50 GFAA CCCCN1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NCCn2cncn2)C1 1875244425 JQRGXMBJLBYOET-QFIPXVFZSA-N 395.555 2.559 0 50 GFAA N[C@@H]1C[C@@H](c2nc(-c3c[nH]c4ccccc34)nn2CC(F)(F)F)CC[C@H]1O 1875245635 JIFQTNAXULZZMB-PSOPSSQASA-N 379.386 2.944 0 50 GFAA COc1cc(Cl)cc(CN2CC[C@@]34OC[C@@H](C(C)C)N3C(=O)C[C@@H]24)c1OC 1875246545 BACQDDKRUWFOHF-VPWXQRGCSA-N 394.899 2.915 0 50 GFAA OC1CCN(c2cc(N3C[C@H](C4CC4)O[C@H](c4ccccc4)C3)ncn2)CC1 1875250448 ZKGBCGVRCKMXJN-VQTJNVASSA-N 380.492 2.794 0 50 GFAA COc1ccc(-n2[nH]c(=NC(=O)N3CC[C@H](Oc4ccncc4)C3)cc2C)cc1 1875256358 VFIWPMFSEJHROF-IBGZPJMESA-N 393.447 2.691 0 50 GFAA O=C(Nc1nc2cc3c(cc2s1)OCO3)[C@H]1CCCN1C1CCOCC1 1875297184 FSOOZISOZTVSKF-CYBMUJFWSA-N 375.450 2.607 0 50 GFAA CCc1cc(OC)cc(OC)c1C(=O)N1CC[C@](C(=O)O)(C2CCOCC2)C1 1875319331 XPLXKLHMSXUHSU-OAQYLSRUSA-N 391.464 2.610 0 50 GFAA O=C(c1csc(=NC[C@H]2C[C@H]2CO)[nH]1)N1CCC[C@H]1c1cccc(F)c1F 1875360531 CUZOAPXUXKAXAE-WQGACYEGSA-N 393.459 2.861 0 50 GFAA Cn1ccc(=O)c(OCc2ccccc2)c1C(=O)N1CCOc2ccccc2C1 1940198393 MVEOSONDTCQGNQ-UHFFFAOYSA-N 390.439 2.999 0 50 GFAA CC(C)(C)NS(=O)(=O)C1(CNC(=O)c2ccc(-c3ccncc3)cc2)CC1 2325791723 YAFCSWSKHAJUOU-UHFFFAOYSA-N 387.505 2.729 0 50 GFAA CC(C)S(=O)(=O)CC[C@H]1N=C([C@@H]2CCOC2)c2ccc(Cl)cc2NC1=O 2325796283 GLGOCGALWNVTFC-IUODEOHRSA-N 398.912 2.700 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1occc1-c1ccc(F)c(F)c1 2325804963 FSMAHRWTAFOBHM-JBBXEZCESA-N 387.386 2.991 0 50 GFAA O[C@@]1(Cn2cnc3c(N4CCC=C(c5ccccc5)C4)ncnc32)CCSC1 2325815508 UAULOZDRBDSZKT-OAQYLSRUSA-N 393.516 2.988 0 50 GFAA Cn1cc(S(=O)(=O)Nc2cccc3cc(C(=O)O)ncc23)c(C2CCC2)n1 2325828422 GONGJXOKAZFSAR-UHFFFAOYSA-N 386.433 2.735 0 50 GFAA COc1cnc(N2C[C@@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2[C@H]3Cc2ccccc2)nc1 2356142015 ZZTSSGUBIUSCLJ-ZFMNYDKASA-N 392.503 2.934 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2c(C)cc(C)cc2C)cc(C(=O)OC)c1 728418 MABLBLXCAOYROQ-UHFFFAOYSA-N 391.445 2.986 0 50 GFAA Cc1ccc(N(CC(=O)NCc2cccnc2)S(=O)(=O)c2ccccc2)cc1 876941 JEGOMESXBUYNST-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA COc1cccc(N2CCN([C@@H]3CC(=O)N(c4cccc(Cl)c4)C3=O)CC2)c1 1073385 HNXONMIMRURIJN-LJQANCHMSA-N 399.878 2.803 0 50 GFAA COc1ccc(C2=NN(C(=O)COc3ccccc3)[C@@](O)(C(F)(F)F)C2)cc1 1151757 IMWZJCWKGQCPMW-SFHVURJKSA-N 394.349 2.962 0 50 GFAA COc1ccc(NC(=O)CN2C(=O)OC3(CCCCC3)[C@]2(C)O)cc1OC 4727297 SHWBMYCBDJXYCD-SFHVURJKSA-N 378.425 2.506 0 50 GFAA CCOC(=O)c1sc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)nc1C 4731572 LARWMAJWJVLZQJ-CYBMUJFWSA-N 387.461 2.928 0 50 GFAA O=C(c1ccc(Cl)s1)N1CCN(S(=O)(=O)c2cccs2)CC1 8380396 HEIPGEATDUORTE-UHFFFAOYSA-N 376.912 2.610 0 50 GFAA CCOC(=O)C[C@@H]1CCCCN1C(=O)c1cn(CCCc2ccccc2)nn1 11843007 AZZFTSUVVYUOHY-SFHVURJKSA-N 384.480 2.859 0 50 GFAA CCN(CC1CCN(C2CCN(C)CC2)CC1)C(=O)[C@@H]1CCCCN1CC 11944569 IARSYPJIOGVURM-NRFANRHFSA-N 378.605 2.516 0 50 GFAA COc1ccc(C(=O)NC(C)(C)C)cc1S(=O)(=O)NCCc1ccccc1 12381468 PFMNPRDMLHIUHV-UHFFFAOYSA-N 390.505 2.745 0 50 GFAA COc1cc(C)c(NS(=O)(=O)c2cc3c(cc2C)OCC(=O)N3)c(C)c1 12445775 FMVKZIZQBCKGOT-UHFFFAOYSA-N 376.434 2.752 0 50 GFAA COc1ccc2c(c1)C[C@H](N1CCC(CCC(=O)N3CCOCC3)CC1)CC2 12593856 VCJSVIYLGWCIBO-OAQYLSRUSA-N 386.536 2.904 0 50 GFAA C[C@@H]1CCCN(C(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)C1 13669178 RUIAOHCYNAZHHD-GFCCVEGCSA-N 378.416 2.730 0 50 GFAA O=C1N[C@@H](CC2CCCCC2)C(=O)N2CCN(Cc3ccc(Cl)s3)C[C@H]12 14538547 XVOMSQLGCJIHII-JKSUJKDBSA-N 395.956 2.883 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCC[C@H](Nc2ccc(OC)c(OC)c2)C1 15068532 GLTJUMAXILRZGH-INIZCTEOSA-N 388.468 2.680 0 50 GFAA COc1cc(CN2CCN(C(=O)Cc3ccccc3)CC2)cc(OC)c1OC 19549816 XYZNWSMBZJDQBG-UHFFFAOYSA-N 384.476 2.599 0 50 GFAA COC1CCN(c2ccc(C(=O)NCC[C@@H]3COc4ccccc4O3)cn2)CC1 20994040 DXWWBDZAXOLZRR-GOSISDBHSA-N 397.475 2.657 0 50 GFAA Cc1oc2cc3oc(=O)c(CCC(=O)N4CCC[C@H]4C(N)=O)c(C)c3cc2c1C 35686237 NRQIKEHHMWGULM-KRWDZBQOSA-N 396.443 2.873 0 50 GFAA biogenic COc1cccc(Cn2ncc3c4sc([S@@](C)=O)cc4n(C)c3c2=O)c1 38143010 MORBXZMIXGYQDB-SANMLTNESA-N 387.486 2.744 0 50 GFAA in-vitro C[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(Br)cc2)C1 58178593 AZCIKTOYIYCDQP-CYBMUJFWSA-N 375.332 2.849 0 50 GFAA COc1cccc(Cn2nc(C3CCNCC3)n(Cc3ccccc3)c2=O)c1 71404140 PSQXZDMISGRKAA-UHFFFAOYSA-N 378.476 2.617 0 50 GFAA CC(C)(C)c1ccc(C(=O)[C@@H]2CCCN(C(=O)CCCn3cnnn3)C2)cc1 72169706 PCXZEMPOOPKCGF-QGZVFWFLSA-N 383.496 2.872 0 50 GFAA C[C@H]1CCCN1Cc1ccc(C(=O)NCc2cnc3ccccc3c2)c(=O)[nH]1 77358254 UHHWNYKMCFKMOF-HNNXBMFYSA-N 376.460 2.837 0 50 GFAA CC(C)NC(=O)CCN1CCC[C@@]2(CCC(=O)N(CCc3ccccc3)C2)C1 77516333 HHFGPYLLPDMTKC-HSZRJFAPSA-N 385.552 2.848 0 50 GFAA CSc1nnc(CC2CCN(C(=O)c3ccc(C(C)=O)s3)CC2)n1C 82099662 FSPYGXKAWLMMJI-UHFFFAOYSA-N 378.523 2.896 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(c1nc(-c3ccccc3)no1)CC2 91434314 HQVAAITVEBGYCF-UHFFFAOYSA-N 384.480 2.982 0 50 GFAA NC(=O)c1csc(N2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)n1 92046057 SPIYCCXVEQXPJD-UHFFFAOYSA-N 384.505 2.651 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)[C@@H](c1cccnc1)N1CCCC1 95384739 VTPDJRZTOHHPEY-OAQYLSRUSA-N 375.476 2.780 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3ccncc3)[C@@H]3C4CCN(CC4)[C@H]23)cc1 95387201 LISZMZPXWYTXNR-MDNUFGMLSA-N 377.488 2.722 0 50 GFAA Cc1nc(Cl)ccc1NC(=O)NC[C@@H](c1ccncc1)N1CCOCC1 96163444 RCTRMOSNKDQHEY-INIZCTEOSA-N 375.860 2.633 0 50 GFAA CCc1cccc2c(CC(=O)Nc3ccc(OC)c(S(N)(=O)=O)c3)c[nH]c12 109246944 SGABIAHSQQUYIE-UHFFFAOYSA-N 387.461 2.568 0 50 GFAA COC[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1 113599127 GYILKEQQJNVOSK-INIZCTEOSA-N 381.467 2.997 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H](O)c2cccc(C)c2)C1 119226792 HURYVJHBZFYOCF-PXNSSMCTSA-N 383.492 2.863 0 50 GFAA CCC(CC)N1C[C@@H](C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1=O 152780936 GZANEFWGTGZHIU-IBGZPJMESA-N 399.535 2.692 0 50 GFAA C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC1 171954891 BXOVFAUDVZAPOV-SFHVURJKSA-N 394.519 2.841 0 50 GFAA COc1ccc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1N1CCNC1=O 173051847 XKXRXHDJHNNIFE-UHFFFAOYSA-N 377.404 2.867 0 50 GFAA COCCC[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCC2)c1 215843950 ZIJROSHZMXVIRW-QGZVFWFLSA-N 380.510 2.502 0 50 GFAA CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NC[C@@H](Cc1ccccc1)C(=O)O 236583528 WOGXYBGPCYOVSG-CTNGQTDRSA-N 394.471 2.582 0 50 GFAA O=C(O)CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)C1CCOCC1 238114211 SOIUXBMCVCPMSA-UHFFFAOYSA-N 398.246 2.885 0 50 GFAA CCN1CCN(c2ccc(CNC(=O)Nc3ccc(COC)cc3)cn2)CC1 252505985 VUQYNTDWHPFXAX-UHFFFAOYSA-N 383.496 2.692 0 50 GFAA Cc1csc(NC(=O)[C@@H]2CCCN(C(=O)N[C@@H]3[C@@H]4CCO[C@H]4C3(C)C)C2)n1 252513915 AVINFTYNRVNRDH-LXTVHRRPSA-N 392.525 2.625 0 50 GFAA COCCn1ccc2c(OCC(=O)Nc3ccc4[nH]c(CO)nc4c3)cccc21 263587626 JFITWHFVSJHABX-UHFFFAOYSA-N 394.431 2.674 0 50 GFAA O=C(NCCc1cccnc1)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1 276784032 DQRWXSSBHOMCOF-FXAWDEMLSA-N 380.423 2.843 0 50 GFAA COc1cccc(-c2ccc(C(=O)N3CC[C@@H](N4CCN(C)CC4)C3)cc2)c1 299770993 UFHVSGHJKZVWJR-OAQYLSRUSA-N 379.504 2.824 0 50 GFAA Cc1ccc(O[C@H]2CCN(S(=O)(=O)Cc3cccc4cccnc34)C2)cn1 328625794 LBYBLQGDSMZWAT-IBGZPJMESA-N 383.473 2.921 0 50 GFAA Cc1c(NC(=O)N2CC[C@@H]3OCCN(C)[C@@H]3C2)cccc1OCC(F)(F)F 332614769 QNRNFUGFCJAXSO-ZBFHGGJFSA-N 387.402 2.873 0 50 GFAA O=C(NCCC1(O)CCOCC1)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 376533087 SPEKYRUYUPQHER-HNNXBMFYSA-N 393.553 2.843 0 50 GFAA O=C(CN1CC=C(c2ccc(Cl)nc2)CC1)NCc1ccc2c(c1)OCO2 378392759 GBSDAKCMAJHYII-UHFFFAOYSA-N 385.851 2.869 0 50 GFAA Cc1nc(-c2cccc(C(=O)N3CCN(C)C(=O)[C@@H]3C)c2)c2ccsc2n1 534585867 QYFFGABZBHVSJR-LBPRGKRZSA-N 380.473 2.969 0 50 GFAA O=C1NC[C@]2(CCCN(C(=O)NCCCSCc3ccccc3)CC2)O1 584888412 FRYIGORHANVQQS-LJQANCHMSA-N 377.510 2.984 0 50 GFAA CC(C)(C)c1ccc(OCc2nc(CN3CCCCC3=O)n(CCO)n2)cc1 828777093 XSNRMKTWWZAWJD-UHFFFAOYSA-N 386.496 2.659 0 50 GFAA COC[C@H]1CCCN1S(=O)(=O)N(Cc1ccccc1)Cc1scnc1C 952980015 BUCWQNKYYQNRGL-QGZVFWFLSA-N 395.550 2.809 0 50 GFAA CN(C[C@H]1CC(=O)N(C2CCCC2)C1)C(=O)c1ccccc1-c1nccn1C 952980874 AWZXFNMAXSOKGD-MRXNPFEDSA-N 380.492 2.950 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N(C)CCc3nccc(C(F)(F)F)n3)n[nH]c21 1857529607 LNUUJJGYRKAFGS-ZJUUUORDSA-N 383.374 2.555 0 50 GFAA CCc1nnc(N2C[C@@H](C(=O)N3CCc4c(Cl)cccc4C3)CC2=O)s1 1857682878 PQSYMLNVRQSNKG-LBPRGKRZSA-N 390.896 2.692 0 50 GFAA CC(C)C[C@@H](O)C(=O)N[C@H]1[C@H]2CC[C@@H]1CN(C(=O)c1cc3ccccc3o1)C2 1857686080 GYLPUGAWJWHVAM-AXVVYFOYSA-N 384.476 2.807 0 50 GFAA COc1ccc2oc(N3CCC[C@@H](CC(=O)NCCc4cn[nH]c4)C3)nc2c1 1857696840 FISFBWHDEXLTGK-AWEZNQCLSA-N 383.452 2.525 0 50 GFAA COc1cc(-c2cc(=NC(=O)c3ccc4c(c3)OCO4)[nH][nH]2)cc(OC)c1OC 1875244914 AGUKOKVUKFKDJE-UHFFFAOYSA-N 397.387 2.505 0 50 GFAA COc1cccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c1 1875250905 ACTRITYODNHHOU-KNKQGSTJSA-N 378.428 2.610 0 50 GFAA Cc1c([C@H]2CCCN2C(=O)c2cc(-c3ccc4c(c3)OCCO4)[nH]n2)cnn1C 1875283597 XHSKGDMDIGQLEC-GOSISDBHSA-N 393.447 2.867 0 50 GFAA Cc1cc(-c2ccccc2)nc(NC(=O)C2CCN(C(=O)[C@H]3CCCO3)CC2)n1 2100542981 KRHCEEMNFSMVGC-LJQANCHMSA-N 394.475 2.808 0 50 GFAA COc1cccc(Oc2ccc(NC(=O)Cn3c(C)cc(C)nc3=O)cn2)c1 2100545155 QTLGROXWSLMYKP-UHFFFAOYSA-N 380.404 2.695 0 50 GFAA Cn1ccnc1CNc1ccc(C(=O)N2CCNC[C@@H]2c2ccc(F)cc2)cc1 2325813185 UMQFXYVNLVELCG-HXUWFJFHSA-N 393.466 2.958 0 50 GFAA COC(=O)c1c(C)[nH]c(C(=O)O[C@H](C(=O)N2CCC(C)CC2)C(C)C)c1C 2325883447 NLJZXOJYMSLPSM-KRWDZBQOSA-N 378.469 2.858 0 50 GFAA Cc1nn2c(=O)c3c4c(sc3nc2n(-c2ccccc2)c1=O)COC(C)(C)C4 756428 QNXWTJGVAPAVAQ-UHFFFAOYSA-N 394.456 2.615 0 50 GFAA COc1ccc(C(=O)NCc2nnc(SCC(=O)c3ccccc3)n2C)cc1 1074999 YPONJEFMQDLADB-UHFFFAOYSA-N 396.472 2.729 0 50 GFAA CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1088614 JPRZBXFYNJXDLY-UHFFFAOYSA-N 397.250 2.526 0 50 GFAA CCN(CC)c1ccc(NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1 2852925 CZZDIEKOIXZCBO-UHFFFAOYSA-N 378.523 2.989 0 50 GFAA CCCCNS(=O)(=O)c1ccc(OCC(=O)Nc2ccccc2OC)cc1 4858244 ZAWIIMCSZTXHNQ-UHFFFAOYSA-N 392.477 2.791 0 50 GFAA COc1cc(NC(=O)Cn2nc(-c3cccc(OC)c3)ccc2=O)cc(OC)c1 5400336 PDPYRKFYPQLTIQ-UHFFFAOYSA-N 395.415 2.575 0 50 GFAA Cc1occc1C(=O)N[C@@H]1CC(C)(C)Cc2nc(N3CCC(O)CC3)ncc21 11933984 BIKWVPDARXAPBD-QGZVFWFLSA-N 384.480 2.783 0 50 GFAA CCc1c(C(=O)NCc2ccccn2)c(=O)cc(C)n1C[C@H]1CCCN1CC 12035044 RKIFWXQTMMJXMZ-GOSISDBHSA-N 382.508 2.528 0 50 GFAA Cc1ccc(Oc2ncccc2CNC(=O)C[C@H]2CCC(=O)N2)c(F)c1F 12434466 WXJXDCXMHSRKCZ-CYBMUJFWSA-N 375.375 2.745 0 50 GFAA CCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@H](NCCOC(C)C)C2 14754363 KQSLRVZEULYSHE-KRWDZBQOSA-N 376.545 2.791 0 50 GFAA O=C(Cn1cccn1)N1CC[C@H](C2CCN(Cc3cccc(F)c3F)CC2)C1 14977267 XLIVCHMDDSXAGX-KRWDZBQOSA-N 388.462 2.922 0 50 GFAA COc1ccccc1-n1cc(-c2nc(-c3c(C)ncc4c3CCNC4)no2)cn1 20543117 LWZAJAIQQQRWBS-UHFFFAOYSA-N 388.431 2.947 0 50 GFAA O=C(Cn1ccc2ccc(F)cc21)Nc1ccccc1C(=O)N1CCOCC1 20735647 IDVYNXNCWDEWLZ-UHFFFAOYSA-N 381.407 2.892 0 50 GFAA CNC(=O)[C@@H]1C[C@@H](NC2C3CC4CC(C3)CC2C4)CN1C1Cc2ccccc2C1 23158315 DRDCAZBCYKNDES-SNLKWHCQSA-N 393.575 2.757 0 50 GFAA O=C(Cn1nc(-c2cccs2)ccc1=O)N1CCO[C@H](c2ccccc2)C1 49549258 GZCCXZQRTNTNDH-KRWDZBQOSA-N 381.457 2.572 0 50 GFAA O=C(CCC(=O)NC1CCCC1)NCC1(c2cccc(F)c2)CCOCC1 55088684 QVLNESHEYKVSOX-UHFFFAOYSA-N 376.472 2.829 0 50 GFAA O=c1c2c3c(sc2ncn1C1CCN(Cc2ccccc2)CC1)CNCC3 65403851 UQFURRNDXOBBSF-UHFFFAOYSA-N 380.517 2.941 0 50 GFAA Cc1nc2cc(OCc3nc(C(=O)NC[C@H]4CCN(C)C4)co3)ccc2s1 67966114 ROBZGZXYQZLFEI-CYBMUJFWSA-N 386.477 2.853 0 50 GFAA Cc1cc(C)cc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c1 72115960 JYAQLLRREPFLJR-UHFFFAOYSA-N 391.479 2.942 0 50 GFAA O=C(c1ccccn1)N1C[C@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 72131799 XADGJFGXZVULIG-MAODMQOUSA-N 377.444 2.513 0 50 GFAA CCc1cc(=O)oc2cc(O[C@H](C)C(=O)N3CCCn4cncc4C3)ccc12 72132925 ZMFJSGXTGPYJAK-CQSZACIVSA-N 381.432 2.752 0 50 GFAA CC(C)Oc1ccc2c(NC(=O)C3(C(N)=O)CC3)nn(CC(F)(F)F)c2c1 72463051 HKWFGHZJTDSSCT-UHFFFAOYSA-N 384.358 2.590 0 50 GFAA Cc1ccccc1OC1CCN(C(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)CC1 91625325 HMADVMLQJJOZML-GOSISDBHSA-N 393.487 2.809 0 50 GFAA COc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)o1 91693904 PUDLPXNMEHHMRJ-UHFFFAOYSA-N 383.448 2.728 0 50 GFAA CN1CCc2[nH]cnc2C12CCN(C(=O)c1cnoc1-c1ccccc1)CC2 92066529 IPJGOSMABYETFQ-UHFFFAOYSA-N 377.448 2.684 0 50 GFAA COCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)/C=C/c1ccc(Cl)cc1 129417325 DJIRBVCLDVYWCE-PLWJUESGSA-N 382.873 2.503 0 50 GFAA COc1cc(OC)cc(C2=NN(S(C)(=O)=O)[C@H](c3ccc(F)cc3)C2)c1 170615279 DZOLLZUJSGSSID-SFHVURJKSA-N 378.425 2.954 0 50 GFAA O=C(Nc1cccnc1N1CCOCC1)N1CC(Cc2ccc(F)cc2F)C1 170656791 RTUVOTYYRWKIAL-UHFFFAOYSA-N 388.418 2.903 0 50 GFAA Cc1cccc(C2(NC(=O)c3ccc(S(=O)(=O)N(C)C)nc3)CCCC2)c1 185585631 AIHSKVAXTHNKLD-UHFFFAOYSA-N 387.505 2.840 0 50 GFAA O=C(O)c1ccc(CNC(=O)[C@@H]2CCN(c3cc(Cl)ccc3Cl)C2=O)o1 238118545 UZYNNZNINRGNAV-NSHDSACASA-N 397.214 2.954 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCNC[C@H]1c1cccc(Cl)c1 261740567 DJLCPYFBEAEKSU-SFHVURJKSA-N 392.908 2.839 0 50 GFAA CC1(C2CCN(C(=O)[C@H]3CCCCN3C(=O)c3cccs3)CC2)OCCO1 268058233 ZCHFTSNIGXIFMB-MRXNPFEDSA-N 392.521 2.744 0 50 GFAA C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N1C(=O)[C@@H]2COCCN2C1=O 271999458 ACOGILRBPSAINY-KDOFPFPSSA-N 379.416 2.663 0 50 GFAA O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCC([C@@H]2CCOC2)CC1 363754769 OREDMMFYRSCGDE-CQSZACIVSA-N 391.411 2.869 0 50 GFAA Cc1nc(-c2cccc(NC(=O)CN[C@@H]3CCC(=O)NC34CCC4)c2)cs1 367259299 VLOMTUWMEDWLMP-QGZVFWFLSA-N 384.505 2.848 0 50 GFAA Cc1cc2c(cc1NC(=O)NC1CCN(C[C@@H]3CCCO3)CC1)OCCO2 426574809 SJWIKXKIQCKJKL-INIZCTEOSA-N 375.469 2.531 0 50 GFAA CN(C[C@@H]1COCCO1)C(=O)c1cccc(-c2ccc3nccc(N)c3c2)c1 534634713 CMSTUCPVIFKARJ-GOSISDBHSA-N 377.444 2.971 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)c2ccc3scnc3c2)cc1 825176854 LXTZCKIPXUNLKS-UHFFFAOYSA-N 389.502 2.703 0 50 GFAA Cc1c([C@@H](C)NCc2cn(C)cn2)nnn1-c1cccc(Br)c1 903350863 FLVIQBZQYDWPSR-LLVKDONJSA-N 375.274 2.923 0 50 GFAA COCCc1noc([C@H]2CCCCN2C(=O)c2cc(C)nc3onc(C)c23)n1 952870260 VAALPPLHTRSAPY-CQSZACIVSA-N 385.424 2.779 0 50 GFAA Cn1ncc2c(N)nc(N3CCC[C@]4(CCCN(Cc5ccccc5)C4)C3)nc21 1506396404 FOYLTGIFORGLJW-QFIPXVFZSA-N 391.523 2.828 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)N1CCN(Cc2ccco2)CC1 1506406760 GAWKCCXBIIHVGT-UHFFFAOYSA-N 375.856 2.914 0 50 GFAA OC[C@@]1(Cc2ccccc2)CN(Cc2ccc(Cn3cccn3)cc2)CC[C@@H]1O 1529113025 AZYZTNXULQDQNZ-BJKOFHAPSA-N 391.515 2.719 0 50 GFAA Cc1ccc2nc(CN3CC[C@]4(O)CCN(C(=O)C5CCCC5)C[C@@H]4C3)[nH]c2c1 1565530392 UBUVSXAWUZXICK-MBSDFSHPSA-N 396.535 2.847 0 50 GFAA Cc1oc(-c2ccccc2F)nc1CN1CCC2(CC1)OCC[C@@](C)(O)[C@@H]2O 1704340806 MRRRQQBNRIFYJF-VQTJNVASSA-N 390.455 2.656 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1 1704347127 FMFXKCQEWZCDAA-DENIHFKCSA-N 390.487 2.801 0 50 GFAA CCc1c(C)nn(CC(=O)N[C@H]2COC[C@H]2Cc2ccnc3ccccc23)c1C 1704354311 BAOKPDXRCQMXHW-GCJKJVERSA-N 392.503 2.984 0 50 GFAA COc1cc(CN2C[C@@H]3CNC[C@@]3(CO)C2)ccc1OCc1cccc(C)c1 1772711367 BMXPNSUHIDDAOK-REWPJTCUSA-N 382.504 2.596 0 50 GFAA O=C(CCc1ccccc1C(F)(F)F)N[C@H]1C[C@H](Cn2ccnc2)C[C@@H]1O 1857527202 DVGPWHCQGXNXRI-JQFCIGGWSA-N 381.398 2.790 0 50 GFAA CCN1CCN(CCOc2ccc(-c3nccn3-c3cnn(C)c3C)cc2)CC1 1857692440 DUCGRGXNRVNJRN-UHFFFAOYSA-N 394.523 2.598 0 50 GFAA CCCc1cc(CNC(=O)c2c(OCc3ccccc3)c(=O)ccn2C)on1 1940195714 HMIJFSGPDWKGOC-UHFFFAOYSA-N 381.432 2.835 0 50 GFAA COCCn1c([C@H](O)c2cccc(C)c2C)nnc1N(C)C1CC(F)(F)C1 2325768838 VZRDFJOMJZTNJE-MRXNPFEDSA-N 380.439 2.857 0 50 GFAA O=C(Cc1c[nH]c2nccc(Cl)c12)NCc1nc(-c2cccc(O)c2)no1 2325869666 XNEQJOGVMKTORJ-UHFFFAOYSA-N 383.795 2.831 0 50 GFAA CC[C@@]1(NC(=O)c2cc3c(C)cc(Br)cc3[nH]2)CCC(=O)NC1=O 2325898890 BWLYJURGSRTNCW-QGZVFWFLSA-N 392.253 2.554 0 50 GFAA CNC(=O)c1cccc(CN=c2[nH]oc(-c3ccc(F)c(OC)c3)c2C(=O)O)c1 2356159528 FSKKLPHQMPUJPR-UHFFFAOYSA-N 399.378 2.581 0 50 GFAA COC(=O)c1ccccc1NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 827554 MRCSVBRQRMJGKB-UHFFFAOYSA-N 396.852 2.531 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(OCC)c(O)cc1Br 1124193 JXKPELVSQRSHES-AWEZNQCLSA-N 399.241 2.744 0 50 GFAA Cc1ncc2c(n1)[C@@]1(CCCN(C(=O)c3ccc(N4CCOCC4)cc3)C1)CC2 2356137741 XMHNHBWWSSWSGV-QHCPKHFHSA-N 392.503 2.742 0 50 GFAA COc1cc(C(=O)Nc2ccccc2N2CCN(C)CC2)cc(OC)c1OC 4385385 QTJVUOOSCQXYBK-UHFFFAOYSA-N 385.464 2.717 0 50 GFAA CCn1c(SCC(=O)Nc2nnc(C)s2)nnc1-c1cccc(F)c1 4736296 AFUVIHXWMZRXPZ-UHFFFAOYSA-N 378.458 2.995 0 50 GFAA CCOc1cc(CNCCCO)cc(I)c1OC(C)C 4867700 JFDYNXYEBBRVBM-UHFFFAOYSA-N 393.265 2.949 0 50 GFAA CCOc1cccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCN(C)CC2)c1 6700742 LRMVEWOGELALPM-UHFFFAOYSA-N 397.475 2.876 0 50 GFAA CCCn1cnnc1[C@H](C)NC(=O)CCSc1ccc2c(c1)OCCO2 55152781 LDOHNOAOWPUTQG-ZDUSSCGKSA-N 376.482 2.819 0 50 GFAA COC[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1 113599124 GYILKEQQJNVOSK-MRXNPFEDSA-N 381.467 2.997 0 50 GFAA CC(=O)Nc1ccc(C(=O)N(CCc2ccccc2)C2CCN(C)CC2)cn1 63882619 POSHWZKVSQUQRL-UHFFFAOYSA-N 380.492 2.819 0 50 GFAA CCNc1nc(C)cc(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)n1 67603886 COTISQSCCJBRFK-UHFFFAOYSA-N 378.480 2.589 0 50 GFAA CCn1ccc(CN(C)C(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccnc2)c1 252492262 MGVOKHFVBUWWBC-OAQYLSRUSA-N 390.487 2.903 0 50 GFAA CN(Cc1ccccc1)c1ncccc1CNC(=O)c1c[nH]c(=O)c(Cl)c1 67689335 NYMGMIDVAWKVGB-UHFFFAOYSA-N 382.851 2.990 0 50 GFAA O=C(c1ccc(Cn2cc(Cl)cn2)o1)N1N=C(C(F)F)C[C@@]1(O)C(F)F 655454 YLOOYXKTHAVQGA-CQSZACIVSA-N 394.712 2.599 0 50 GFAA Cn1nccc1CNC(=O)c1cc(Br)c(Br)s1 2778549 KQENSMZDTYKODH-UHFFFAOYSA-N 379.077 2.937 0 50 GFAA COc1ccccc1N1CCC(NC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)CC1 363344428 CXLASUKNHDPMMQ-AWEZNQCLSA-N 395.459 2.813 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)c3cnccc3N(C)C)CC2)cs1 183598987 NBYGJHODQCVQOR-UHFFFAOYSA-N 387.553 2.809 0 50 GFAA O=C1N(Cc2ccccc2F)CCC[C@]1(O)CNCc1c(F)cccc1F 12836263 BBWFBRHMXUUCNV-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA O=C(c1ccc(-n2cnnc2)cc1)N1CCC([C@@H](O)Cc2ccccc2)CC1 77517921 SQTFFQVECCGFAM-NRFANRHFSA-N 376.460 2.723 0 50 GFAA COc1ccc(CC(=O)Nn2c(=S)[nH]c3sc4c(c3c2=O)CCC4)cc1 17079118 AXRMCDPBXFYIMW-UHFFFAOYSA-N 387.486 2.931 0 50 GFAA COc1ccccc1C1=NO[C@H](C(=O)Nc2ncn(Cc3ccc(C)cc3)n2)C1 20601978 LOZRUVVSUNNKND-IBGZPJMESA-N 391.431 2.775 0 50 GFAA C[C@@H](CNC(=O)N(Cc1ccncc1)C1CCN(C)CC1)Oc1cccnc1 426431393 SPLTWLPJAOXSLN-KRWDZBQOSA-N 383.496 2.550 0 50 GFAA Cc1ccc(OCc2nc(CS(=O)(=O)CC[C@H]3CCOC3=O)cs2)cc1 267892242 XHKHADDBGPIZEM-CQSZACIVSA-N 395.502 2.899 0 50 GFAA Cc1cc(=O)c(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@@H]3[C@H]2C2CCN3CC2)c[nH]1 95366279 UBSGVOANXWUIGW-CEWLAPEOSA-N 381.451 2.525 0 50 GFAA Cc1ccccc1[C@H](CNC(=O)c1cnc(-c2ccccn2)nc1O)N(C)C 91746045 NVSXLRYGJFULBO-SFHVURJKSA-N 377.448 2.585 0 50 GFAA CNC(=O)c1cccc(C(=O)N2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)c1 181327763 KTYKGKHOGVLXSQ-GOSISDBHSA-N 389.459 2.851 0 50 GFAA Cc1cc(OC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@H]([C@H]3C2=O)[C@@H]2C[C@@H]42)cc(C)c1Cl 239339146 LTDXGLOQYGSKQK-OZINRZGZSA-N 385.847 2.915 0 50 GFAA CCc1cc(N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N3)nc(N(C)C)n1 95363189 UCQAAAMLZUYIJS-GOSISDBHSA-N 379.508 2.748 0 50 GFAA O=C(CCC(F)(F)F)N1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91965842 HRGAKFZMLIXBGI-KRWDZBQOSA-N 386.418 2.526 0 50 GFAA CCn1ncnc1[C@H](NC(=O)Nc1cnn(Cc2ccccc2F)c1)C1CC1 97729611 CEMGFOFMSJNOLK-QGZVFWFLSA-N 383.431 2.955 0 50 GFAA O=C(c1ccc(N[C@H]2CC[C@H](O)CC2)nc1)N1CCC(CCn2cccn2)CC1 244715736 LBFPUSBMVRXMCV-MXVIHJGJSA-N 397.523 2.936 0 50 GFAA CC(=O)N[C@H](CC(=O)N1CCC[C@H]([C@@H](C)N)C1)c1ccc(Br)cc1 299739272 MRTYWIVCKURNLK-ISTRZQFTSA-N 396.329 2.602 0 50 GFAA COC(=O)c1cn([C@H](c2ccccc2)c2nc3ccccc3[nH]2)cc2c(=O)[nH]nc1-2 263587426 GUFKPOBGGJDDKM-LJQANCHMSA-N 399.410 2.977 0 50 GFAA Cc1nn(C)cc1CN(C)[C@@H](Cc1ccccc1F)C1CCN(CCO)CC1 299801574 ZKTFVSBVRANEBT-QFIPXVFZSA-N 388.531 2.615 0 50 GFAA Cc1cc(C)n(CCNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)c(=O)n1 825132043 PDHNOYQRYLVDNK-UHFFFAOYSA-N 395.429 2.533 0 50 GFAA Ic1cc(-c2noc([C@H]3CCCc4nn[nH]c43)n2)cs1 952895952 YLUKBLDFNHYDPH-ZETCQYMHSA-N 399.217 2.989 0 50 GFAA C[C@H]1CCN(c2cc(C(=O)NC3CCSCC3)c(Cl)cn2)C[C@@H]1CO 1875360729 HXRKYGZKVNRSPS-QWHCGFSZSA-N 383.945 2.815 0 50 GFAA CCOc1ccccc1N1CCN(C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875392505 GAONUBYRVAVWGJ-LSDHHAIUSA-N 384.480 2.793 0 50 GFAA CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCc2c(O)nc(O)nc2C1 1875304093 ZUYCCYNXXQTQHE-KBXCAEBGSA-N 382.464 2.915 0 50 GFAA Cc1ccc(N2CC[C@H](N(C)S(=O)(=O)c3cccc4cnccc34)C2=O)cc1 1775997976 WWMIHRIYBNVDKJ-IBGZPJMESA-N 395.484 2.969 0 50 GFAA CC(C)(C)OC(=O)NCCN(CCO)C(=O)Cc1cc(Cl)ccc1Cl 170596862 XEEJSTMQRIXNOD-UHFFFAOYSA-N 391.295 2.882 0 50 GFAA O=C(CCOc1cccc(Br)c1)NCc1nc2cccnc2[nH]1 170606179 COYVZZWDLILZGK-UHFFFAOYSA-N 375.226 2.806 0 50 GFAA CC(C)CC(=O)N[C@H](C(=O)NCc1cccnc1-n1ccnc1)c1ccccc1 171367566 MAASRVWMRPZTEL-FQEVSTJZSA-N 391.475 2.787 0 50 GFAA CC(=O)N1CCN(Cc2ccccc2NCc2nnc(C3CC3)n2C2CC2)CC1 187534463 XIYJKBHKHLXSIF-UHFFFAOYSA-N 394.523 2.767 0 50 GFAA C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(c3ncc(C(F)(F)F)s3)CC2)C1 302766517 LTHCBVLATWZZER-STQMWFEESA-N 390.475 2.788 0 50 GFAA O=C(CN1CCN(c2ncc(C(F)(F)F)s2)CC1)N1CCc2ccccc21 302776505 OXCRJSPVEZNICL-UHFFFAOYSA-N 396.438 2.873 0 50 GFAA Cc1cnc2c(c1)N(C(=O)c1nnn(Cc3ccc(F)cc3F)c1C)CCO2 191937070 BLEXJBVTHVOQOU-UHFFFAOYSA-N 385.374 2.656 0 50 GFAA Cc1ccc(NC(=O)Cn2c(=O)[nH]c3ccccc32)cc1C(=O)N(C)C(C)C 192545292 KSSQMGQOMMPRHZ-UHFFFAOYSA-N 380.448 2.757 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1S(=O)(=O)N(Cc1cnn(C)c1)C(C)C 1506429563 UREBHQCAGBDKNF-UHFFFAOYSA-N 387.509 2.822 0 50 GFAA COc1cc(-c2onc(N3CCC[C@H](CN(C)C)C3)c2C(=O)O)ccc1F 1704316420 ZYUBTDMFBFWJGF-GFCCVEGCSA-N 377.416 2.966 0 50 GFAA COc1ccc(/C=C(/NC(=O)/C=C/c2ccccc2)C(=O)N2CCOCC2)cc1 1158209 YAHFJRYNASGFJP-LCLOIPLNSA-N 392.455 2.725 0 50 GFAA O=C(N1C[C@H](c2ccccc2)O[C@H](c2ccc3c(c2)OCO3)C1)C1(CO)CC1 1616077680 GEMFENSUTOMWAG-UXHICEINSA-N 381.428 2.829 0 50 GFAA COCC1CCN(C(=O)[C@H]2CCC(=O)N(Cc3ccc(Cl)cc3)C2)CC1 12386278 GOYSSPCLTGNKPM-KRWDZBQOSA-N 378.900 2.964 0 50 GFAA CC(C)CN1CCNC(=O)[C@H]1CC(=O)N(C)Cc1cccc(C(F)(F)F)c1 12597762 IGDSROCESIKNOQ-MRXNPFEDSA-N 385.430 2.510 0 50 GFAA COCC(=O)Nc1c(C(=O)OC)n(C)c2ncc(N[C@@H](C)CC(C)C)cc12 14539087 DNYSINHFWWHKHK-LBPRGKRZSA-N 376.457 2.791 0 50 GFAA O=S(=O)(N[C@H]1c2cccc3cccc(c23)[C@H]1N1CCNCC1)c1ccccc1 19810995 DFHHBGRWPZJXGB-FCHUYYIVSA-N 393.512 2.819 0 50 GFAA Cc1cn2nc(C(=O)N3CCN(c4ccccc4)CC3)cc2c(N2CCCC2)n1 169768777 YIAZRFCPXKOORH-UHFFFAOYSA-N 390.491 2.600 0 50 GFAA Cc1cccc(OCC(=O)NC2CCN(c3cc(C(F)(F)F)ncn3)CC2)c1 169780980 PICADRCWLIUCMI-UHFFFAOYSA-N 394.397 2.968 0 50 GFAA Cc1ccc2ncccc2c1-c1nccn1CCCN1CCC[C@H](C(N)=O)C1 1857692929 AHROWSMNHSZMGP-KRWDZBQOSA-N 377.492 2.994 0 50 GFAA O=C(c1csc(-c2ccc(C(F)(F)F)cc2)n1)N1CC[C@H](CO)[C@@H](O)C1 1857712576 RDCBXIAKZAMAPR-RISCZKNCSA-N 386.395 2.644 0 50 GFAA CCC(=O)N1CCC[C@]2(CCc3c2nc(-c2cccnc2)[nH]c3=NCC2CC2)C1 1875250877 NVYIBIJZITWPPV-QHCPKHFHSA-N 391.519 2.999 0 50 GFAA NC(=O)c1ccc(-c2nc3c(c(N[C@H]4C[C@@H]4c4ccccc4)n2)CCNC3)cc1 216748327 BSOKIMSTTYOIRT-MOPGFXCFSA-N 385.471 2.856 0 50 GFAA O=C(NC1CC1)c1ccnc(N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccc2)c1 219354175 IBQBSVYBTCGFTR-QUCCMNQESA-N 390.487 2.601 0 50 GFAA CCOC(=O)N1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 19958001 PVCMZLRVCMUBGZ-CYBMUJFWSA-N 377.268 2.507 0 50 GFAA O=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCN(c2ccccn2)C1 162755803 CUPZKCMECNLJKO-HXUWFJFHSA-N 379.508 2.624 0 50 GFAA Cc1cc2c(c(=O)[nH]1)C(=O)O/C2=C\c1cc2c(cc1Br)OCO2 12446939 PMVFVASLICEYAD-JYOAFUTRSA-N 376.162 2.843 0 50 GFAA COCCN(C)C[C@@H]1CCCN1c1ncnc2c1cnn2-c1ccccc1F 2325825255 JVUIVXUEQIUNMY-HNNXBMFYSA-N 384.459 2.502 0 50 GFAA CC(C)c1ccc(N(CC(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)cc1 877014 OQHPHRBZEUPWQM-UHFFFAOYSA-N 390.461 2.943 0 50 GFAA CCOc1ccccc1N(CC(=O)Nc1cc(C)ccc1OC)S(C)(=O)=O 877240 AZYGQJAUGGBOJT-UHFFFAOYSA-N 392.477 2.807 0 50 GFAA COCCN1C(=O)N(c2ccc(C)cc2)C(=O)[C@H]1CC(=O)Nc1ccccc1 2887393 KOCKOLMXAOHLFH-GOSISDBHSA-N 381.432 2.807 0 50 GFAA COc1ccc(NC(=O)CN(Cc2ccccc2)S(C)(=O)=O)cc1Cl 4664513 SRKAKHHHOBJXTD-UHFFFAOYSA-N 382.869 2.749 0 50 GFAA CCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(C)ccc2OC)cc1 4856584 WAQWZLSJUPLWET-UHFFFAOYSA-N 392.477 2.662 0 50 GFAA Cc1ccc(C(=O)NCCCn2ccnc2)cc1S(=O)(=O)Nc1ccccc1 9668789 YPAOGFQEWCVVDO-UHFFFAOYSA-N 398.488 2.812 0 50 GFAA O=C1N(Cc2ccc(F)c(F)c2)CCC[C@@]1(O)CNCc1cccc(F)c1 11878628 CIFHMLAETXRYAA-HXUWFJFHSA-N 378.394 2.747 0 50 GFAA CCOC(=O)[C@]1(Cc2cccc(OC)c2)CCCN(C(=O)CCc2cn[nH]c2)C1 11933653 WJDIIBPEHZDZFA-QFIPXVFZSA-N 399.491 2.766 0 50 GFAA CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(C1CCSCC1)CC2 14733333 OLUVBRLTRQQPTE-UHFFFAOYSA-N 388.537 2.596 0 50 GFAA Cc1ccccc1CC(=O)N1CCC(=O)N(CCOc2ccc(F)cc2)CC1 14964445 ASQJVJRZWKJEJT-UHFFFAOYSA-N 384.451 2.817 0 50 GFAA COc1ccc(C(=O)NCCCSC)cc1OC1CCN(C(C)=O)CC1 14971381 DIWONSFLGHTBBA-UHFFFAOYSA-N 380.510 2.568 0 50 GFAA O=C(NC1CCCCCC1)[C@@H]1C[C@@H](n2cnnn2)CN1C/C=C/c1ccccc1 15068567 GIGBNVFRKGTQAI-WTUWHVHBSA-N 394.523 2.841 0 50 GFAA O=C(CCC(F)(F)F)NCc1cccnc1N1CCN(c2ccccn2)CC1 19111265 ZRMFTQKUSVOAHC-UHFFFAOYSA-N 393.413 2.762 0 50 GFAA Cc1nn(C)c(C(=O)Nc2cccc(CN3CCOCC3)c2)c1Br 20602248 SBAZCPOCLGKSJQ-UHFFFAOYSA-N 393.285 2.576 0 50 GFAA O=C(Nc1ccccc1Cl)N1CCC[C@H](Cn2cc(CCCO)nn2)C1 23398256 JMLFVDKCEAHRGU-AWEZNQCLSA-N 377.876 2.801 0 50 GFAA COc1ccc(-c2c3c(=O)n(Cc4cccnc4)ccc3nc3nc(C)nn23)cc1 36353912 CCWUGCNQWDLDOX-UHFFFAOYSA-N 398.426 2.867 0 50 GFAA C[C@H](C(=O)Nc1ccccn1)n1c(=O)n(CC2CC2)c2ccc(C(=O)O)cc21 55575768 SIPDXWDYSGPKDB-GFCCVEGCSA-N 380.404 2.506 0 50 GFAA CCN(CC)C(=O)N1CCC(C(=O)Nc2cc(OC)c(OC)c(OC)c2)CC1 59759566 VOESSGAHYHURTM-UHFFFAOYSA-N 393.484 2.825 0 50 GFAA O=C(NCc1cccnc1)[C@@H]1CCCN(C2CCN(Cc3nccs3)CC2)C1 71760149 ONNMRQKTFHFIFJ-GOSISDBHSA-N 399.564 2.531 0 50 GFAA CC(=O)c1cc(CN2CCOC[C@H]2CC(=O)Nc2cccc(F)c2C)n(C)c1 72423468 KSRYLEZNUOEHLM-GOSISDBHSA-N 387.455 2.905 0 50 GFAA O=C(c1ccc2nccnc2c1)N1CC[C@]2(CCCN(CC3CCC3)C2=O)C1 91781842 HIJXDAASWZMMHE-JOCHJYFZSA-N 378.476 2.885 0 50 GFAA Cc1cc(C)c2[nH]c(C)c(CC(=O)N3CCN(CC4CC4)[C@H](CCO)C3)c2c1 91985968 GBYMQZLBIPTGSD-LJQANCHMSA-N 383.536 2.941 0 50 GFAA Cn1cccc1C(=O)C(=O)N1C[C@H](c2cc(F)cc(F)c2)[C@@H]2[C@H]1C1CCN2CC1 95355106 FBXKKZGKLFJIMB-MISYRCLQSA-N 399.441 2.575 0 50 GFAA Cc1oc(-c2ccccc2F)nc1CN1CCN(C)[C@@]2(CCNC(=O)CC2)C1 95382530 LSYZAJKGVAXEEN-NRFANRHFSA-N 386.471 2.575 0 50 GFAA COc1cccc2c1OC[C@@H](C(=O)NCCCSc1nnc(C)s1)C2 95382768 NEFWTJHVVXGPEX-ZDUSSCGKSA-N 379.507 2.705 0 50 GFAA COc1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)cc1Cl 151325614 KESKFKJDTWUQSA-INIZCTEOSA-N 388.851 2.975 0 50 GFAA CC(C)(C(=O)N1CC[C@H](NS(C)(=O)=O)C1)c1ccc(-c2ccccc2)cc1 152199998 SLXLEKCNFZTLBC-IBGZPJMESA-N 386.517 2.781 0 50 GFAA CCN(C(=O)[C@H](C)N(C)C1CCN(CCn2cccn2)CC1)C1CCCCC1 155114827 XYGKTYKRFKUPHO-IBGZPJMESA-N 389.588 2.849 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)/C=C/c4ccco4)nnc23)n1 169776324 XNNOQSBZYAJMKN-CMDGGOBGSA-N 378.392 2.654 0 50 GFAA CNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1nc(-c3ccccc3)cs1)CC2 170618719 PVDBZKGPRAOUOD-UHFFFAOYSA-N 399.497 2.921 0 50 GFAA COc1cccc(-c2noc([C@H](C)NC(=O)N[C@H]3c4ccccc4C[C@H]3O)n2)c1 173520764 SLAXRUIEVXQROQ-RZAIGCCYSA-N 394.431 2.764 0 50 GFAA O=C(NC[C@@H]1CCCS1(=O)=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 179638283 CDEIYTVZPGPKMU-SFHVURJKSA-N 386.473 2.987 0 50 GFAA COCC(=O)N1CCc2c(N[C@H](C(=O)NC3CC3)c3ccc(F)cc3)cccc21 184470970 HZGVUTRHHWCWFC-NRFANRHFSA-N 397.450 2.793 0 50 GFAA COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@H](N(C)CC(=O)O)CC1 186661800 XDFXSZUCKWCJET-WMZOPIPTSA-N 376.497 2.661 0 50 GFAA O=C(Nc1ccc(-n2cnc3ccccc32)nc1)[C@H]1CC(c2cccnc2)=NO1 188057674 NKAHGXMDKSKMNM-LJQANCHMSA-N 384.399 2.947 0 50 GFAA CN(CCOc1cccc(CNC(=O)C[C@@H]2CCCOC2)c1)C1CCOCC1 193132786 SYJRJGMREUVAAC-IBGZPJMESA-N 390.524 2.609 0 50 GFAA CCOc1ccc2[nH]c(=O)c(CN3CCN(c4cc(CC)ncn4)CC3)cc2c1 216124135 DHCWNBAOTXYDCB-UHFFFAOYSA-N 393.491 2.601 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)CN3C(=O)c2ccc(CO)cc2)cc1 247918046 WPDSADKGINLCGU-CTNGQTDRSA-N 380.488 2.924 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@H]1[C@H]2C(=O)C[C@@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 254418791 BIEADAHRODWPEW-VRRZBTPDSA-N 388.504 2.783 0 50 GFAA O=C(CCc1nccs1)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1 262439757 NCOPDLJOPXUEKW-HNNXBMFYSA-N 387.461 2.794 0 50 GFAA COc1cccc(-c2cc3n(n2)[C@@H](NCc2cc(F)cc(F)c2)CNC3=O)c1 263616001 GLCARDLFUFWDPQ-LJQANCHMSA-N 384.386 2.869 0 50 GFAA O=C(c1ccc(CN2CCCC2)cc1)N1CCS(=O)(=O)c2ccccc2C1 274904003 HSOYPMROPJNQFA-UHFFFAOYSA-N 384.501 2.712 0 50 GFAA O=C(N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1)N1CCOC2(CCOCC2)C1 287220013 GRAKWJWHEBIDIM-ZWKOTPCHSA-N 396.434 2.856 0 50 GFAA CCn1nc(C)c(CC(=O)N2CCOC[C@@H]2c2nc(-c3ccccc3)no2)c1C 294832681 YOACWNTWBVAEFP-GOSISDBHSA-N 395.463 2.712 0 50 GFAA COc1cc(Br)c(S(=O)(=O)N2CC[C@H](N)C[C@H]2C)cc1Cl 299739433 OHLPVXQOQYASSV-BDAKNGLRSA-N 397.722 2.611 0 50 GFAA CN(C)c1nc(-c2cccc(C(=O)N3CCN(c4ccccc4)CC3)c2)n[nH]1 299785637 MTIIVIOYZCLYFH-UHFFFAOYSA-N 376.464 2.500 0 50 GFAA O=S(=O)(Nc1ccc(-n2cncn2)c(F)c1)c1ccc(Br)cc1 320305542 BUDSEUKIUTZRAK-UHFFFAOYSA-N 397.229 2.970 0 50 GFAA NC(=O)[C@H](NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(F)cc1 363830090 WZEWTTJUHHVKKS-YLJYHZDGSA-N 398.482 2.564 0 50 GFAA Cc1cc(CNC(=O)[C@H]2CCC(=O)N(C3CC3)[C@H]2c2ccnn2C)ccc1F 366367181 XGHZFVNDUUZKRR-OXJNMPFZSA-N 384.455 2.626 0 50 GFAA Cc1ccc(-c2nnc(-c3ccc(C(=O)N4CCO[C@@H](C(=O)O)C4)cc3)o2)cc1 408513438 FOLLHTUAYVJHHL-QGZVFWFLSA-N 393.399 2.638 0 50 GFAA O=C(c1ccc2c(c1)CCCO2)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 426473725 XHCVMMGUXQOGFP-ZWKOTPCHSA-N 381.428 2.731 0 50 GFAA CCN(C(=O)c1cccc(-c2cc(F)c(OC)c(F)c2)c1)[C@H]1COC[C@@H]1O 426550672 SCPOFBSLUUNYBC-ROUUACIJSA-N 377.387 2.862 0 50 GFAA CN1CCC(CNC(=O)N(CCOc2ccccc2)C[C@H]2CCCO2)CC1 426739062 NOTMUAJBYFVLRN-HXUWFJFHSA-N 375.513 2.598 0 50 GFAA CCCCc1nc(CN2CCC(CNC(=O)[C@@H]3CCOC3)CC2)c(Cl)[nH]1 822886080 BYSUKLBFEMHRLQ-OAHLLOKOSA-N 382.936 2.770 0 50 GFAA O=C1CCN(c2ccccc2C(=O)NCCCn2ccc3ccccc32)C(=O)N1 828269751 JJZCCUGYHHHCML-UHFFFAOYSA-N 390.443 2.908 0 50 GFAA O=C(c1ccc(Nc2ncccn2)cc1)N1C[C@@H]2C[C@@H](C1)[C@@H]1CCCC(=O)N1C2 888088891 WFCFIOQUJLRSGT-IEZWGBDMSA-N 391.475 2.693 0 50 GFAA COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1cccc2nc(O)oc12 921891841 WNDJDQOLSILEIA-UHFFFAOYSA-N 396.447 2.542 0 50 GFAA Oc1nc2ccc(-c3noc([C@@H]4CCc5nnn(C6CCC6)c5C4)n3)cc2[nH]1 952895933 YFLCSHFMPJSDSK-LLVKDONJSA-N 377.408 2.908 0 50 GFAA O=C(Cc1ccccc1Cl)NC[C@@H]1CCCN(C(=O)Cc2ccncc2)C1 952985694 IVUDGHUDGWYOKJ-KRWDZBQOSA-N 385.895 2.875 0 50 GFAA Cc1ccccc1-c1ncc(CN2CCC3(CC2)N=C(N(C)C)NC3=O)s1 1506395756 FYRQXWSZKPVQLK-UHFFFAOYSA-N 383.521 2.501 0 50 GFAA Cc1ccc(NC(C)(C)C(=O)NCCS(=O)(=O)c2ccc(F)cc2)cc1 1506406817 JPDLNULDICHGPJ-UHFFFAOYSA-N 378.469 2.915 0 50 GFAA COc1ccc(F)cc1[C@H](C(=O)O)N1CCC2(CC1)Nc1ccccc1NC2=O 1529089950 DDKPKDFKWRIQPU-GOSISDBHSA-N 399.422 2.859 0 50 GFAA O=C(O)CCNC(=O)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 1704313325 LCQRZIYIHKTBLO-NRFANRHFSA-N 380.448 2.608 0 50 GFAA COCCNc1noc(-c2ccc(Cl)cc2)c1C(=O)N[C@@H]1CC[C@@H](N)C1 1704329671 XSLXOYFKJVRODS-ZIAGYGMSSA-N 378.860 2.663 0 50 GFAA Cc1cc(C[C@@H]2CN(C(=O)c3ccc(N4CCCC4)c(Cl)c3)C[C@@H]2O)on1 1704349502 IHAOOWAYEXXFFQ-BEFAXECRSA-N 389.883 2.912 0 50 GFAA CC(C)(C)CC(=O)N1CC[C@H](Oc2ccnc(CNC(=O)c3cccnc3)c2)C1 1775997127 WTLTVJGBZJKFJD-IBGZPJMESA-N 396.491 2.823 0 50 GFAA Cc1ccc2oc(CN3CCOC[C@H]3CCNC(=O)c3cnccn3)c(C)c2c1 1857707698 GXQOSRMTZKZXQG-QGZVFWFLSA-N 394.475 2.861 0 50 GFAA CCOc1ccc(C(=O)N2CC[C@@H](O)[C@](CC3CC3)(C(=O)O)C2)cc1Cl 1875245514 CSRCCYWBMORSIN-VQIMIIECSA-N 381.856 2.817 0 50 GFAA Cc1cccc(C(=O)NC[C@H]2[C@H]3CN(c4nccnc4C)C[C@]34CC[C@H]2O4)c1C 1875248099 XZPPJPVXEMCKPR-DZCCDHAISA-N 392.503 2.816 0 50 GFAA Cc1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1cn(C)nc1C1CCOCC1 1875289570 AWFYGZJRQXDZRB-QGZVFWFLSA-N 375.494 2.588 0 50 GFAA COCCN(C(=O)[C@H](O)CN1CCCC1)[C@H](C)c1cccc(C(F)(F)F)c1 1875308801 YHCPLVVCHKRMMN-RHSMWYFYSA-N 388.430 2.698 0 50 GFAA N=c1nncc(-c2cccc(C(=O)N3CC4(CCC4)C[C@H]3C(F)(F)F)c2)[nH]1 1875318005 ABAPVNYZPOAKOE-AWEZNQCLSA-N 377.370 2.898 0 50 GFAA C[C@H]1CN(C(=O)COCc2ccccc2)CC[C@@H]1NC(=O)Cc1ccccc1F 1875324786 BANUMZSTFGPSMR-UWJYYQICSA-N 398.478 2.938 0 50 GFAA C[C@H]1CCN(c2cc(C(=O)NC3CCSCC3)c(Cl)cn2)C[C@H]1CO 1875360730 HXRKYGZKVNRSPS-STQMWFEESA-N 383.945 2.815 0 50 GFAA C=CC(=O)N1CCc2c(CNC(=O)Cc3ccc4c(cnn4C)c3)cccc2C1 1875389170 FDAFAHLZQYAOEH-UHFFFAOYSA-N 388.471 2.503 0 50 GFAA C[C@@H](Cn1cccn1)OC(=O)[C@@H]1CC(=O)Nc2ccc(Br)cc21 2325750151 ZFANNUDTFCZNTL-GXFFZTMASA-N 378.226 2.703 0 50 GFAA O=C(NCCCCn1cc(-c2cnccn2)nn1)C(F)(F)/C=C/c1ccccc1 2325870937 VQMUQIZZRWHLPC-CMDGGOBGSA-N 398.417 2.980 0 50 GFAA O=C(Cc1c[nH]nc1O)N1CCC[C@@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356155830 OGHBSSBPLCPALL-JOCHJYFZSA-N 389.459 2.621 0 50 GFAA O=C(NCc1ccc2nc[nH]c2c1)c1cc2c(s1)C1(CCNCC1)OCC2 2356160524 WJWGFHZKPIYPSR-UHFFFAOYSA-N 382.489 2.706 0 50 GFAA CS(=O)(=O)N(CC(=O)Nc1ccccc1)c1ccc(Br)cc1 653093 NNWPBTIRTZDOMV-UHFFFAOYSA-N 383.267 2.854 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)NCc1ccccc1C)S(C)(=O)=O 971879 ITYFFYPXBBIBSZ-UHFFFAOYSA-N 396.896 2.739 0 50 GFAA COc1ccc(CNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cs2)cc1 6680502 HAJYIRCXCPFSMY-UHFFFAOYSA-N 394.518 2.861 0 50 GFAA COc1ccc(CCN2C[C@H](C(=O)NCCc3ccc(F)cc3)CCC2=O)cc1 11662984 TUJJYMIVGCKHEL-LJQANCHMSA-N 398.478 2.974 0 50 GFAA COc1ccccc1CN1C[C@H](C(=O)NCCCc2cccnc2)CCC1=O 11821150 AICQBYXYUVDYMG-LJQANCHMSA-N 381.476 2.578 0 50 GFAA COc1ccc(OC)c(C(=O)NC[C@@H]2Cc3cccc(-c4cncnc4)c3O2)c1 11974094 KZHSEBDTZNSGSS-KRWDZBQOSA-N 391.427 2.894 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cc(COc3ccc(C)c(C)c3)on2)CC1 12030701 SHNFCCCCMMXATE-UHFFFAOYSA-N 387.436 2.785 0 50 GFAA COc1cccc(OC)c1-c1cnnc(N(C)C[C@@H]2Cc3ccccc3O2)n1 12074547 SCJWSYZHXZIGQJ-HNNXBMFYSA-N 378.432 2.996 0 50 GFAA COC(=O)c1ccc(CNC(=O)c2cn(Cc3cccc(Cl)c3)nn2)cc1 12093890 QZDBJPBTNQESRK-UHFFFAOYSA-N 384.823 2.696 0 50 GFAA CCCCn1c(-c2ccc(Cl)cc2)cn2c3c(=O)n(C)c(=O)n(C)c3nc12 12411011 HKBUVIUVXOQVIV-UHFFFAOYSA-N 385.855 2.807 0 50 GFAA CC(C)N(C)Cc1nnnn1CC(=O)N[C@H](Cc1ccccc1)c1ccccc1 12573422 QCMMDTGHSYLFOI-HXUWFJFHSA-N 392.507 2.614 0 50 GFAA COCCN1C(=O)N(Cc2ccccc2)C2(CCN(Cc3ccco3)CC2)C1=O 14530758 VYWAWXSHIHYFRY-UHFFFAOYSA-N 397.475 2.725 0 50 GFAA CN(CCc1ccccn1)C(=O)CC[C@@H]1CCCN(C(=O)Cc2cccnc2)C1 15062818 MLWFFCFTDFQOSO-IBGZPJMESA-N 394.519 2.739 0 50 GFAA Cc1csc(CN(C)C[C@]2(O)CCCN(Cc3ccc(F)cc3)C2=O)n1 55342810 YODWDWJOMITSHE-LJQANCHMSA-N 377.485 2.576 0 50 GFAA COC(C)(C)C(=O)N1CCC(n2nccc2NC(=O)c2cccc(F)c2)CC1 67724455 SVMNQCGTBLZJTF-UHFFFAOYSA-N 388.443 2.863 0 50 GFAA CCN1CCN(Cc2cc(C(=O)N(C)Cc3cccc(Cl)c3)no2)CC1 67841984 JDDIDHIVDTWJTL-UHFFFAOYSA-N 376.888 2.738 0 50 GFAA CC[C@H]1CN(C(=O)c2ccc3[nH]nnc3c2)CCC(=O)N1Cc1ccccc1 71755032 CSELFQZWRXSPPS-KRWDZBQOSA-N 377.448 2.611 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2ccc(-c3nc[nH]n3)cc2)CCC(=O)N1CC1CC1 71764537 GFZNSBCSWADECZ-SFHVURJKSA-N 381.480 2.581 0 50 GFAA CN(Cc1nc(-c2ccccc2)no1)C(=O)[C@H]1CC(=O)N(C)c2ccccc21 72454813 JCYLNVSRXQPIOT-INIZCTEOSA-N 376.416 2.845 0 50 GFAA CC(C)(C)c1ccn(C2(C(=O)O)CCN(C(=O)c3cncc(Cl)c3)CC2)n1 72477055 KRDSESBKZHGQHS-UHFFFAOYSA-N 390.871 2.945 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4ccncc4)CC3)CC2=O)c1 77437274 LIUOYKKKNRCMNF-UHFFFAOYSA-N 379.460 2.745 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CCN(C)C(C)(C)C2)nc2cccnc21 77485534 YBMLEUMJAPZXDE-INIZCTEOSA-N 387.528 2.514 0 50 GFAA OCCO[C@H]1C[C@@H](O)C12CCN(Cc1ccc(C(F)(F)F)cc1F)CC2 91779578 FIKKLKWINONWNB-CVEARBPZSA-N 377.378 2.569 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)CN2CCC(c3ccccc3)CC2)on1 95356416 YOUBIOQWCFQAAI-CTNGQTDRSA-N 383.492 2.536 0 50 GFAA Cc1cc(N2CCC(N[C@@H](Cn3ccnc3)c3ccccc3)CC2)nc(N)n1 95365511 NHRGVJIUUTWBOF-IBGZPJMESA-N 377.496 2.564 0 50 GFAA O=C(C1CCC1)N1C[C@@H]2CC[C@H](C1)N(C(=O)CCc1ccc3c(c1)OCO3)C2 95372996 QNHVOKYYXLKVRG-FUHWJXTLSA-N 384.476 2.597 0 50 GFAA O=C1CNc2ccc(C(=O)N3CCC[C@@H](c4ccc(C(=O)O)cc4)C3)cc2N1 95382911 JGWRWQZYDNVTFA-MRXNPFEDSA-N 379.416 2.769 0 50 GFAA O=C(Nc1cccc(-n2cccn2)c1)[C@@H]1CCCN1C(=O)NCc1ccco1 95500470 IQBSZPHEEFFJKL-SFHVURJKSA-N 379.420 2.778 0 50 GFAA COCCNC(=O)c1ccc(OC2CCN(C[C@@H]3CCCO3)CC2)c(Cl)c1 95501887 KDAAMLICAGRNEA-KRWDZBQOSA-N 396.915 2.738 0 50 GFAA O=C(CCC1CCN(Cc2cccc3nonc23)CC1)NCc1cccnc1 95523277 IPWUTSKSTSYJLS-UHFFFAOYSA-N 379.464 2.926 0 50 GFAA CC1(C)SC[C@@H](C(=O)N(Cc2ccccc2)Cc2nccs2)NC1=O 97776237 CNSOWFNDTICTGX-AWEZNQCLSA-N 375.519 2.682 0 50 GFAA Cn1cc(N2CC[C@@H](NCC3(c4ccccc4Cl)CCOCC3)C2=O)cn1 111374029 YMLANHRQYUEHQP-GOSISDBHSA-N 388.899 2.517 0 50 GFAA CC(C)(O)[C@@H]1CCCN1Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 119067749 SLIZJQXTWKTTLJ-INIZCTEOSA-N 380.535 2.949 0 50 GFAA O=C(NCc1ccccc1CN1CCC[C@H]1CO)C1=Cc2cc(F)ccc2OC1 125126345 KQPVONJUYWCQQX-NRFANRHFSA-N 396.462 2.875 0 50 GFAA O=S(=O)(N1CCCCCC1)N1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 155264071 BFEBWZWIPOBUFE-JKSUJKDBSA-N 392.443 2.934 0 50 GFAA O=C(CCc1cnn(-c2ccccc2)c1)NCc1ccnc(O[C@H]2CCOC2)c1 162916586 MMENAXLPCHTIFV-FQEVSTJZSA-N 392.459 2.684 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(F)c(F)c4)C3)nn2)n1 169778175 BXDYFBNDNMRPGQ-LBPRGKRZSA-N 388.378 2.817 0 50 GFAA Cc1cc(Sc2ncccn2)ccc1NC(=O)N1CCNC(=O)[C@H]1C(C)C 170632109 PRHYFPONXNVRSC-MRXNPFEDSA-N 385.493 2.925 0 50 GFAA CC(C)c1nc([C@H]2CCCN2C(=O)CCn2cnc3sccc3c2=O)no1 173079762 OSCPVRFLCXVFIT-CYBMUJFWSA-N 387.465 2.718 0 50 GFAA CCn1ncc2c(C(=O)N[C@@H]3CCCC[C@H]3C(N)=O)cc(-c3ccccc3)nc21 177705818 CJXAOZXXPBTMBU-CRAIPNDOSA-N 391.475 2.892 0 50 GFAA Cc1n[nH]c2cc(NC(=O)c3sccc3S(=O)(=O)N3CCCC3)ccc12 180343784 FIWAOMDIWRNFLK-UHFFFAOYSA-N 390.490 2.970 0 50 GFAA O=C(c1ccn(-c2ccccc2Cl)n1)N1CCOCC2(CCOCC2)C1 185115767 AZKFDXBTHSKUSV-UHFFFAOYSA-N 375.856 2.795 0 50 GFAA CN(Cc1cccnc1)C[C@@H]1CCN(S(=O)(=O)c2cccc3ncccc23)C1 192935195 UEDIHPOBKLMXTA-SFHVURJKSA-N 396.516 2.772 0 50 GFAA CCCN(C)C(=O)c1cccc(S(=O)(=O)N(C)Cc2c(C)noc2C)c1 216000426 MLEBDFTTXGJIIG-UHFFFAOYSA-N 379.482 2.594 0 50 GFAA CCSc1nc(CC(=O)N2CCCn3nc([C@@H](O)CC)cc3C2)cs1 221412023 NCWIHEUGCJGBBD-HNNXBMFYSA-N 380.539 2.870 0 50 GFAA O=C(O)C[C@H]1CN(C(=O)CCc2ncc(-c3ccccc3Cl)o2)CCO1 238052159 HQYWCSSVYSQOCK-LBPRGKRZSA-N 378.812 2.630 0 50 GFAA CCS(=O)(=O)c1cc(F)ccc1NC(=O)NC[C@@H](c1ccnn1C)C(C)C 239807499 CSKFMLTVGWKMJS-CQSZACIVSA-N 396.488 2.914 0 50 GFAA CC1(C)[C@H](NC(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)[C@H]2CCO[C@H]21 246734756 FAFKKKSKWFCBIM-GUDVDZBRSA-N 394.475 2.947 0 50 GFAA CC1(C)COc2c(C(=O)Nc3cnn(Cc4nnc5n4CCCC5)c3)cccc21 280221604 WSLRPNXCBBPZSA-UHFFFAOYSA-N 392.463 2.782 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1c1nc(-c2cc(C(N)=O)c[nH]2)no1 288975140 BPLBHRZJBDEZKN-HNNXBMFYSA-N 395.419 2.540 0 50 GFAA CCNC(=O)c1cc(NC(=O)NCCCn2nc(C)nc2C)ccc1Cl 299787404 WSMYFFRXUUPFSL-UHFFFAOYSA-N 378.864 2.510 0 50 GFAA O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)[C@H]1C[C@@H](c2ccccc2)N2CCC[C@H]12 299798510 SRGLQWXBLPETNX-DBVUQKKJSA-N 376.460 2.698 0 50 GFAA COc1cccc(CC(=O)N2CCC[C@@H](n3ncc(N(C)C(C)C)cc3=O)C2)c1 328605735 OYHBYFXMGFLIFM-GOSISDBHSA-N 398.507 2.503 0 50 GFAA COc1ccc(-c2cc(C(=O)N3CCN4C(=O)N=C(O)[C@H]4C3)sc2C)cc1 328936793 JPPJXBAKDPVQIJ-OAHLLOKOSA-N 385.445 2.949 0 50 GFAA O=S(=O)(c1ccc2c(c1)CCCO2)N1CC[C@@H](n2ncc3ccccc32)C1 329715210 URECMIYBXLCPIL-QGZVFWFLSA-N 383.473 2.997 0 50 GFAA O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2c2ncc(C(F)(F)F)cc2Cl)C1 373031809 YNVHVWJXJCWVCM-JOYOIKCWSA-N 391.777 2.656 0 50 GFAA COCCc1nsc(N2CCC3(CC2)C[C@H]3N(C)Cc2nccs2)n1 373098543 JRVCXQDWCVDVJF-CYBMUJFWSA-N 379.555 2.674 0 50 GFAA CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cncc(C(F)(F)F)c1 425165241 UKNVUCGXIXTJFS-MRXNPFEDSA-N 377.366 2.804 0 50 GFAA COc1ccc([C@@H](NC(=O)NC2(C(N)=O)CCCCC2)c2ccncc2)cc1 426653002 RYIAPDXBWHSWBG-GOSISDBHSA-N 382.464 2.667 0 50 GFAA Cc1ccc(C(=O)N2CCC(NC(=O)N(C)CCCn3cccn3)CC2)cc1 534589469 BMEZTXSXWBEDQW-UHFFFAOYSA-N 383.496 2.528 0 50 GFAA COc1ccc2c(c1)[C@@H](C)N(C(=O)NCCCc1nnc3ccccn13)CC2 584903647 IUVRCUCJSDTMQI-OAHLLOKOSA-N 379.464 2.999 0 50 GFAA O=C(NCCCn1ccc2ccccc21)c1nccnc1C(=O)N1CCCCC1 670451690 YHKIXZYSQPYWPT-UHFFFAOYSA-N 391.475 2.878 0 50 GFAA CC1=C(C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@H](C)n2nnnc2N1C 847563580 LCQYJJSGZXMUHU-NSHDSACASA-N 392.423 2.524 0 50 GFAA CC1(C)CN(C(=O)C(C)(C)N2CCNCC2)[C@H]1c1nccn1-c1ccc(F)cc1 952892626 BCDORNMTGOCJBK-SFHVURJKSA-N 399.514 2.605 0 50 GFAA O=C(c1n[nH]c2c1CCCC2)N1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1 1529138587 FWHZUGDNOVTPES-QRWLVFNGSA-N 376.460 2.512 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)c1cc(N2CCOCC2)no1)c1ccncc1 1772807939 WLBDFHFTGFYVSX-FQEVSTJZSA-N 378.432 2.734 0 50 GFAA Cc1cnc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)c3ccn(C(C)(C)C)c3)C2)cn1 1857684938 KRWRAGLPVDQIEI-IAGOWNOFSA-N 383.496 2.813 0 50 GFAA CCc1ccccc1CN1C[C@@H](C(=O)O)C2(CCN(Cc3cnc[nH]3)CC2)C1 1857685146 PIWAZPAMINZPFT-FQEVSTJZSA-N 382.508 2.771 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCN(Cc2cc[nH]n2)CC1)N1CCCC1 1857686740 FUZGFQWAHJDXKK-UHFFFAOYSA-N 386.521 2.771 0 50 GFAA Cc1cc(C[C@@H]2CN(c3nc(-c4ccc(C)s4)ccc3C(=O)O)C[C@@H]2O)n[nH]1 1857716265 FBSNMRZIJSPTFV-DYVFJYSZSA-N 398.488 2.888 0 50 GFAA Cc1cc2cc(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3cnn(C)c3)ccc2o1 1857726332 MBXJLILWNPUNIE-PMACEKPBSA-N 382.464 2.619 0 50 GFAA Cc1nnc(N2C[C@@H](C(=O)NCC3(c4ccccc4)CCCC3)CC2=O)s1 1857733695 VAKPRPSQEJWADF-HNNXBMFYSA-N 384.505 2.828 0 50 GFAA C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 1875260387 LSQPEEAFZFSDQN-RHSMWYFYSA-N 378.428 2.742 0 50 GFAA Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)c1nnc2ncccn12 1875264737 IBIFFOSGXGXXEO-CYBMUJFWSA-N 392.419 2.799 0 50 GFAA COc1cn(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1C[C@@H](C)CNC[C@@H]1C 1875301578 MZQLVJAIJXCIRN-STQMWFEESA-N 396.413 2.970 0 50 GFAA O=C(Cc1cc(O)nc(O)n1)N1CCC(c2ccccc2C(F)(F)F)CC1 1875314415 WWDHGRWRHGMAMN-UHFFFAOYSA-N 381.354 2.855 0 50 GFAA O=C(CC1=CCOCC1)N[C@@H]1C[C@H](Cn2ccnc2-c2ccccc2)C[C@H]1O 1875403209 RXFGWYJXRXDWJR-DFQSSKMNSA-N 381.476 2.543 0 50 GFAA Cc1c(NC(=O)[C@H]2CCCO2)cccc1C(=O)N(C)[C@H]1C[C@H]2C[C@@H](O)C[C@H]2C1 2100483273 IINFYGXCPZCTNV-QOSLBHJFSA-N 386.492 2.734 0 50 GFAA CCc1nc2ccccc2c(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)c1C 2325785699 JKAVMXKMBCSOCX-CDHQVMDDSA-N 378.476 2.872 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2C[C@@H]3CNC(=O)[C@@H]3C2)cc1 2356145220 GYTZACLJFGIPFC-PKOBYXMFSA-N 386.455 2.666 0 50 GFAA Cc1ccc(-c2noc(CCCC(=O)N3CCC[C@@]34CCCN(C)C4=O)n2)cc1 2356167685 XZCIFECJPIZRSJ-JOCHJYFZSA-N 396.491 2.981 0 50 GFAA CC(=O)c1cccc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1 1062296 YOMNXMSOTCCXCA-QGZVFWFLSA-N 386.473 2.929 0 50 GFAA Cn1nnc2cc(C(=O)Nc3ccc(I)cc3)ccc21 1109714 WYAPCCZVIXCPID-UHFFFAOYSA-N 378.173 2.825 0 50 GFAA CN=c1[nH]c(C(=O)N2CCC[C@@]23CCCN(c2ccc(C)cc2)C3=O)cs1 2356139312 VWTJFIRZMNEMIN-HXUWFJFHSA-N 384.505 2.717 0 50 GFAA Cc1nn(C)c(C(=O)N2CCC[C@@]23CCCN(CCc2ccccc2)C3=O)c1C 2356145663 HIGAMCOJXNGTOZ-HSZRJFAPSA-N 394.519 2.877 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)NCCC2=CCCCC2)cc1C 2862354 JEFUSMKYNNQLPP-UHFFFAOYSA-N 380.510 2.631 0 50 GFAA aggregator CN1CCC(N2CCN(Cc3c[nH]nc3-c3ccc(F)cc3F)CC2)CC1 22914108 JKLYBLRDULMBAL-UHFFFAOYSA-N 375.467 2.567 0 50 GFAA Cc1nnc(SCCNC(=O)[C@H]2CCCN2C(=O)C2CCCCC2)s1 55310014 OLZJDPVPQVMMSR-CQSZACIVSA-N 382.555 2.626 0 50 GFAA O=C(c1ccc(NC[C@H]2CCCOC2)nc1)N1CCC(Cn2cccn2)CC1 20912409 USCQENCKLZQIMR-GOSISDBHSA-N 383.496 2.669 0 50 GFAA CN1Cc2ccccc2C[C@H]1CNC(=O)CCc1nnc(-c2ccsc2)o1 20254827 CKSJPRYONOCPHC-KRWDZBQOSA-N 382.489 2.904 0 50 GFAA Cc1nn(C)c2sc(C(=O)N[C@@H](C)CN3CCN(c4ccccc4)CC3)cc12 119671905 VJMVFBLXIMATQN-HNNXBMFYSA-N 397.548 2.884 0 50 GFAA Cc1ccc(C(=O)N[C@@H](C)c2nnnn2C2CC2)cc1NC(=O)c1ccco1 252510167 ZCTGSTLXTGXAKZ-LBPRGKRZSA-N 380.408 2.653 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(O)cc3)C2)cc1 12573940 AQFSJUDELQBBEP-KRWDZBQOSA-N 390.505 2.591 0 50 GFAA Cc1n[nH]c([C@@H]2CN(C(=O)c3cc4ccc(OC(F)(F)F)cc4[nH]3)CCO2)n1 173085880 QWRHBFPPCVVENS-AWEZNQCLSA-N 395.341 2.707 0 50 GFAA Cc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1ccc(OC2CCCC2)cc1 328611816 MSSOQLAPFHXBHP-KRWDZBQOSA-N 376.482 2.721 0 50 GFAA CC(C)C[C@@H](O)C(=O)N1CCC(n2nccc2NC(=O)c2ccccc2)CC1 67805285 MQQXRXFCMRZMHM-GOSISDBHSA-N 384.480 2.706 0 50 GFAA Cn1cnc2c(c1=O)CCN(C(=O)c1ccc(COc3ccccc3)cc1)C2 477900384 WFYGAFHFQZXVBQ-UHFFFAOYSA-N 375.428 2.558 0 50 GFAA C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)N1Cc1cn(C[C@H]2CCOC2)nn1 864097313 OYYKVDDDBVHWBN-MWDXBVQZSA-N 393.532 2.533 0 50 GFAA C[C@H](O)C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 155878745 ILCQCVGMEDDINB-DZKIICNBSA-N 396.434 2.655 0 50 GFAA CS(=O)(=O)N[C@@H]1CCCC[C@H]1CN[C@@H]1CCc2cc(F)c(F)c(F)c21 449322253 OPWZFLBCMQXKBL-IACUBPJLSA-N 376.444 2.789 0 50 GFAA CC(=O)NCc1ccc(NC(=O)[C@H]2CCc3nnc(-c4ccccc4)n3C2)cc1 449854786 HMGCCFOEYZRTIC-SFHVURJKSA-N 389.459 2.782 0 50 GFAA Cc1c(-c2ccc(F)cc2)[nH]c2ccc(CNC(=O)Cn3nnnc3C)cc12 71745539 NRMQLTZONOULOM-UHFFFAOYSA-N 378.411 2.894 0 50 GFAA C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)C2=O 242191307 XENLBVNYQMIUMU-XREXNNHRSA-N 389.418 2.724 0 50 GFAA O=C(O)c1cc(-c2ccc(CO)cc2)cc(S(=O)(=O)NC2CCCC2)c1 71763760 DCKJSUFXJHYWPJ-UHFFFAOYSA-N 375.446 2.765 0 50 GFAA Cc1cc(C)n(CCC(=O)N2CCC[C@H](c3nc4ccccc4[nH]3)C2)c(=O)n1 426550364 FONGBLBRXXCAMV-INIZCTEOSA-N 379.464 2.533 0 50 GFAA Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)N(C)[C@@H]1CCNC1 179084098 GYPPTPVHZOVFLN-MRXNPFEDSA-N 391.313 2.745 0 50 GFAA CNc1cc(C)nc(N2CCC[C@@]3(CCC(=O)N(Cc4cccnc4)C3)C2)n1 91595571 RLVHFMMOSGFHGQ-OAQYLSRUSA-N 380.496 2.631 0 50 GFAA CCCNC(=O)c1cccc(S(=O)(=O)N(CC)[C@H]2CCOC(C)(C)C2)c1 97657212 CSBTVPQCPSHITH-INIZCTEOSA-N 382.526 2.795 0 50 GFAA O=C1N(CC2CCC2)CCC[C@]12CCN(Cc1nnc(-c3cccnc3)o1)C2 91859894 MONKRQRIRFZLPP-OAQYLSRUSA-N 381.480 2.746 0 50 GFAA COc1ccc(Cc2nc3ccc(C(=O)NCCc4nncn4C)cc3o2)cc1 95512722 ANXUBEPAXHFGAO-UHFFFAOYSA-N 391.431 2.528 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(Cc1snnc1C(C)C)CC2 91849274 YKVRALYHUVGPCM-UHFFFAOYSA-N 380.558 2.903 0 50 GFAA COCCN(Cc1ccccn1)C(=O)[C@H]1CCC(=O)N(CC2CCCCC2)C1 91289351 MFQZIXYFSUMBAZ-IBGZPJMESA-N 387.524 2.876 0 50 GFAA Cc1nc(C(=O)N2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)cs1 91780913 SVMMXYPOLAZSHP-UHFFFAOYSA-N 398.532 2.934 0 50 GFAA COCCNc1nc2cc(-c3ncnn3-c3ccc(OC)cc3)ccc2n1C 91708006 CJGFXLVIXUSZCS-UHFFFAOYSA-N 378.436 2.888 0 50 GFAA CN(C)c1ccc(CC(=O)N[C@H](c2ccc3c(c2)CCO3)[C@H]2C[C@@H](O)C2)cc1 244734876 NNHUYRGDBHLMMV-QMHWCDLVSA-N 380.488 2.858 0 50 GFAA Cc1cc(=O)c(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)nn1-c1ccccc1F 299379254 VMACGRPJWUFOTK-LXZKKBNFSA-N 399.422 2.538 0 50 GFAA CCn1nc(-c2cccc(C(=O)N[C@@H](C)c3c(C)n[nH]c3C)c2)nc1N(C)C 534645474 WQOVIBJGAQPPFC-LBPRGKRZSA-N 381.484 2.862 0 50 GFAA CCc1nc(C)c(CNC(=O)N2CCCN(C(=O)c3ccoc3)CC2)s1 534582452 CGEHDJPEJXCQIC-UHFFFAOYSA-N 376.482 2.665 0 50 GFAA COc1cc(C(=O)O)ccc1-c1ccc(C(=O)NCCNC(=O)C(C)C)cc1 584893746 RKELTKPUHDRKQO-UHFFFAOYSA-N 384.432 2.562 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1)c1c(Cl)n[nH]c1C1CC1 867242400 HXZQHNFPKUBYNH-AWEZNQCLSA-N 388.855 2.790 0 50 GFAA CCc1nc(C)c(C(=O)N2CCC3(CC2)C[C@@H](O)c2nn(C(C)C)cc2O3)o1 1875394758 VWSDDJNIZJJDJE-CQSZACIVSA-N 388.468 2.814 0 50 GFAA COC(=O)C1(CNCc2nc(-c3cccc(C(F)(F)F)c3)oc2C)COC1 1875312718 RKSNGFYYSMKARW-UHFFFAOYSA-N 384.354 2.948 0 50 GFAA CC(=O)N/C(=C/c1ccccc1)C(=O)N1CC[C@H](CO)[C@H](c2ccccc2)C1 1875312489 FBBIQKHFCBBSCJ-WHOFGVDJSA-N 378.472 2.788 0 50 GFAA CCC(=O)Nc1cc(Cl)ccc1C(=O)N[C@@H]1CCCN(c2ncccn2)C1 952970243 UDQZERRATURLPB-CQSZACIVSA-N 387.871 2.877 0 50 GFAA COc1c(F)ccc(C(=O)Nc2ccccc2N2C(=O)N[C@H](C)C2=O)c1F 952980542 XHMZHUQYCFGQSD-SECBINFHSA-N 375.331 2.670 0 50 GFAA Nc1c(I)cnc(Cl)c1I 40566606 ADBYPUPWCVKWCP-UHFFFAOYSA-N 380.354 2.526 0 50 GFAA in-vitro CC[C@@H]1CCN(CC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)[C@@H]1C 170599725 ABAQACVEQNENAL-CHWSQXEVSA-N 387.933 2.649 0 50 GFAA C[C@@H](NC(=O)c1ccoc1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1 170614968 GOXYNQATWDTYDL-CJNGLKHVSA-N 393.484 2.598 0 50 GFAA Cc1cc(CNC(=O)N2CC[C@@H](C)[C@H](O)C2)ccc1I 408236122 NFFFYKJGXACQTH-QMTHXVAHSA-N 388.249 2.512 0 50 GFAA O=C(CCc1ccccc1)N1CCC(C(=O)N2CCC[C@H]2c2ccn[nH]2)CC1 225701886 GXONEWMRFYTQCZ-FQEVSTJZSA-N 380.492 2.945 0 50 GFAA COc1ccc2c(c1)CCC[C@H]2CNC(=O)c1c(C)nn(C)c1-n1cccn1 189120610 BERZHHTXCCJOPN-INIZCTEOSA-N 379.464 2.773 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC[C@@H](OCc2ccccn2)C1 1506408092 VGUYACQGHCUMSJ-LJQANCHMSA-N 381.476 2.740 0 50 GFAA CC(C)c1ccc(-n2cc(CN3C[C@@H](O)[C@H](Cc4cnccn4)C3)cn2)cc1 1529185368 LQZBNHFFVBAZPT-DENIHFKCSA-N 377.492 2.821 0 50 GFAA Cc1[nH]c2ccc(C(=O)N3CCCN(C(=O)c4cc(C)n(C)n4)CC3)cc2c1C 1772711198 GAUACDDXLJZZGE-UHFFFAOYSA-N 393.491 2.815 0 50 GFAA Cn1ccnc1SCCNC(=O)c1cc(COc2ccc(F)cc2F)on1 11664153 XHXADEFTWBJTIE-UHFFFAOYSA-N 394.403 2.787 0 50 GFAA CCOC(=O)c1ccc(CNC(=O)[C@@H]2CCC(=O)N(CCc3ccccc3)C2)o1 11998010 DIVWHLURIOLEGP-QGZVFWFLSA-N 398.459 2.554 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@@H](NCc1cccc(OC)c1)C2 14745761 TUHIPWBKCBIUDF-QGZVFWFLSA-N 382.508 2.795 0 50 GFAA CC(C)=CC(=O)N1CCC(n2nccc2NC(=O)c2ccc3c(c2)OCO3)CC1 14976312 LGLINIFHOMIURI-UHFFFAOYSA-N 396.447 2.994 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3cc(F)cc(F)c3)C[C@@H]2CCO)CC1 19228557 NEJYZWOJSPXBTE-NRFANRHFSA-N 381.511 2.706 0 50 GFAA O=C(NCC1CC1)c1ccc(Cn2ccn3nc4c(c3c2=O)CCCC4)cc1 169760248 IFOVQABNRBVVRZ-UHFFFAOYSA-N 376.460 2.563 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)cn1)N1CC[C@@H](C2CC2)[C@H]1c1nc(O)n[nH]1 1857531284 DHNDATQPSGVVPZ-HOCLYGCPSA-N 398.854 2.963 0 50 GFAA CCc1ccc([C@H]2COCCN2C(=O)CN(CCc2ccccc2)C(C)=O)o1 152810707 DSMMJFRZFSFYLT-HXUWFJFHSA-N 384.476 2.833 0 50 GFAA CS(=O)(=O)C1CCC(C(=O)N2CCC(c3ccccc3C(=O)O)CC2)CC1 901553069 RHBWTOQACYSMAD-UHFFFAOYSA-N 393.505 2.694 0 50 GFAA Cn1cc([C@H]2CSCCCN2S(=O)(=O)c2cccc3c2OCCC3)cn1 907776092 VNZZUHBWWOYUQZ-MRXNPFEDSA-N 393.534 2.614 0 50 GFAA Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)N[C@@H]1CCC(=O)NC1=O 1857797800 UDPCOPADDKOCEO-OAHLLOKOSA-N 392.242 2.899 0 50 GFAA O=C(/C=C/c1c(Cl)nc2sccn12)Nc1cnn(C[C@@H]2CCCN2)c1 2325779154 JUDHKAUXBFZXNT-UFFNRZRYSA-N 376.873 2.650 0 50 GFAA Cc1ccc(-c2nc(O)n[nH]2)cc1NC(=O)c1sc([C@H]2CCCNC2)nc1C 2325817817 BULQHYCPWRPORX-ZDUSSCGKSA-N 398.492 2.970 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1C(=O)NCCc1nc(-c2ccccc2)oc1C 116417868 PIQKBBBYYAMGPE-UHFFFAOYSA-N 399.472 2.578 0 50 GFAA CCOC(=O)c1c(NC(=O)c2nc3ncccn3n2)sc2c1CC[C@@H](C)C2 924009 GDBZLWCTSUTWQX-SNVBAGLBSA-N 385.449 2.740 0 50 GFAA COC(=O)c1c(NC(=O)CN2C(=O)c3ccccc3C2=O)sc2c1CCCC2 952949 ZUDGBMKSYWKDPU-UHFFFAOYSA-N 398.440 2.648 0 50 GFAA O=C(N[C@]1(C(F)(F)F)N=C(O)N(c2ccc(Cl)cc2)C1=O)c1cccnc1 2863488 WATNJNBNMWNSQR-HNNXBMFYSA-N 398.728 2.684 0 50 GFAA CC(=O)O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@@H]21 4029793 BNYMWYFDNNGEAG-AVEIZBFRSA-N 382.453 2.795 0 50 GFAA biogenic CCc1csc(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(OC)c3)C2)n1 11718567 CGWXVXDBRDMHTO-OAHLLOKOSA-N 387.505 2.769 0 50 GFAA CSc1nnc(CNC(=O)CCn2nc(C)cc2C)n1-c1ccccc1C 12247795 GEDXSXJLCKLIHQ-UHFFFAOYSA-N 384.509 2.817 0 50 GFAA Cc1nc2ncnn2c(C)c1CCC(=O)N1CCC[C@@H](Nc2ccccc2)C1 12435760 TYDIDYBICLVXMA-GOSISDBHSA-N 378.480 2.777 0 50 GFAA O=C(CCc1nnc(Cc2ccc3c(c2)OCO3)o1)NC1Cc2ccccc2C1 12438610 HXHZORLLOAPRAY-UHFFFAOYSA-N 391.427 2.605 0 50 GFAA Cc1csc([C@@H](C)NC(=O)c2cc(COc3ccc4c(c3)OCO4)[nH]n2)n1 12447098 OEEQYLWPWYYGNU-LLVKDONJSA-N 386.433 2.973 0 50 GFAA O=C(NC[C@@H]1OCCc2ccccc21)c1nc(N2CCCC2)nc2c1CCCC2 12581428 UNZUBPCONJSIMD-FQEVSTJZSA-N 392.503 2.999 0 50 GFAA C[C@H](CCn1cccn1)NC(=O)c1cn(Cc2ccc(F)cc2Cl)nn1 12583555 RCKOAMHLDSYGKQ-GFCCVEGCSA-N 376.823 2.524 0 50 GFAA CCN1CCC[C@H]1CNC(=O)CCC1CCN(C(=O)c2[nH]c(C)cc2C)CC1 12587354 NFEYABBVTPEKET-IBGZPJMESA-N 388.556 2.864 0 50 GFAA O=C1N(Cc2cccnc2)C[C@@H]2C[C@@H](c3cccc4nonc34)N3CCC[C@@]123 55310094 OUAVFYQPPJKOMI-XERREHJYSA-N 375.432 2.556 0 50 GFAA CCNc1ncc([C@H]2CC(=O)Nc3c2c(C)nn3-c2ccc(OC)cc2)cn1 65373548 NFALUFOWOBNUBS-MRXNPFEDSA-N 378.436 2.885 0 50 GFAA O=C(c1cc(COc2ccccc2F)[nH]n1)N1CCN[C@H](c2ccccc2)C1 67855435 LXZZBAVCAFTCDL-IBGZPJMESA-N 380.423 2.915 0 50 GFAA CN(Cc1ccccc1Cl)c1ncc(S(C)(=O)=O)c([C@H]2CCCNC2)n1 71388618 PCDJAMMWEXCJPT-ZDUSSCGKSA-N 394.928 2.637 0 50 GFAA CN(Cc1ccccc1)C(=O)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 71761951 CBNFVAQWRYDILN-FQEVSTJZSA-N 383.536 2.758 0 50 GFAA Cc1ccc(NC(=O)NCCNc2cc(-n3cnc(C)c3C)ncn2)cc1F 72116016 PGLOULJFETXROJ-UHFFFAOYSA-N 383.431 2.960 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)CCCc4ccccc4)CC3)nn2)n1 72437699 RJJGDBRDFZFHPC-UHFFFAOYSA-N 390.491 2.642 0 50 GFAA O=C1CC[C@]2(CCCN(S(=O)(=O)Cc3ccc(F)cc3)C2)CN1C1CC1 91964950 JYKGTGGVNUDRPE-IBGZPJMESA-N 380.485 2.523 0 50 GFAA CCN(Cc1ccccn1)C(=O)c1cnc(COc2ccc(F)cc2)nc1O 91988519 ZBKZOVUTZNXWGA-UHFFFAOYSA-N 382.395 2.958 0 50 GFAA CCN1CCN(C[C@@H](O)COc2cccc(CN3CCCCC34CC4)c2)CC1 95506896 AMQCANIKDRLHRQ-OAQYLSRUSA-N 387.568 2.582 0 50 GFAA COc1cc(OC)nc(N2CCC(c3nccn3Cc3ccccn3)CC2)n1 95508677 VTXIIAJMWYDTCT-UHFFFAOYSA-N 380.452 2.518 0 50 GFAA O=C(CCCc1cn[nH]c1)N1CCC(c2nccn2Cc2cccnc2)CC1 95510935 VBMGGILUUHYUNF-UHFFFAOYSA-N 378.480 2.778 0 50 GFAA COc1cc(C(=O)N[C@@H]2CCNC2)ccc1OC1CCN(C2CCCC2)CC1 95521053 LBWREEQSGNUHOD-QGZVFWFLSA-N 387.524 2.573 0 50 GFAA COCCNC(=O)N1CCC[C@@H](CNC(=O)C2(c3ccc(Cl)cc3)CC2)C1 95525292 NJCACRDGOVYIEU-HNNXBMFYSA-N 393.915 2.556 0 50 GFAA COCCN(Cc1nnc(C)o1)C[C@H]1CCCN(C2Cc3ccccc3C2)C1 95526493 ASPCHXQHRPYZHY-GOSISDBHSA-N 384.524 2.706 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@H](C)CNC(=O)Nc2cccn3cnnc23)n1 96166503 ABQWVJCJFXXFIP-SNVBAGLBSA-N 381.362 2.711 0 50 GFAA CCOc1ccccc1CN1CCN(Cc2cnn(C(C)C)c2)C[C@H]1CCO 104466199 ZKHCSQOVJPXPRV-OAQYLSRUSA-N 386.540 2.932 0 50 GFAA COc1ccccc1C(=O)N[C@@H](C(=O)N1CCC(c2ccn[nH]2)CC1)C(C)C 125052316 XEXQIPHMRCFORD-LJQANCHMSA-N 384.480 2.579 0 50 GFAA O=C(CCCc1csc2ccccc12)N1CCN(CC(=O)N2CCCC2)CC1 151450737 XGJVWVJXAAVEOZ-UHFFFAOYSA-N 399.560 2.991 0 50 GFAA Cc1cccc(N2CCN(C(=O)c3cc(N4CCNC4=O)ccc3F)CC2)c1C 154747620 CUWIVGKUFSUDAM-UHFFFAOYSA-N 396.466 2.935 0 50 GFAA CC(C)c1noc(-c2cn([C@H]3CCN(C(=O)[C@H](C)Oc4ccccc4)C3)nn2)n1 169778143 WBPXIDCNIUKTFL-GJZGRUSLSA-N 396.451 2.692 0 50 GFAA Cc1ccc(N2C(=O)[C@@H]3[C@H](C(C)C)N[C@@]4(C(=O)Nc5ccccc54)[C@@H]3C2=O)cc1 170621908 GDTICDSXSBRLJS-KEXUJGGDSA-N 389.455 2.576 0 50 GFAA CC(=O)NCCNC(=O)Nc1ncc(Cc2cccc(Br)c2)s1 174412941 BKXGZFNXVQSHTJ-UHFFFAOYSA-N 397.298 2.754 0 50 GFAA Cc1ccc(NC(=O)N2CCN(C[C@@H]3CCOC3)CC2)cc1OCC(F)F 176955584 KAOVBXVSTCZRGE-HNNXBMFYSA-N 383.439 2.825 0 50 GFAA COCCCN1C(=O)CC[C@@H]2CN(C(=O)c3cccc4cnccc34)CC[C@@H]21 220227768 GNWLPFQUJGKJIM-XLIONFOSSA-N 381.476 2.724 0 50 GFAA Cn1nc(-c2cccs2)cc1C(=O)N[C@@H]1CCCN(Cc2cccnc2)C1 220318287 XPZLMRLXLGDIJP-MRXNPFEDSA-N 381.505 2.938 0 50 GFAA CC(C)Oc1ccccc1N1CCN(CC(=O)NCCOc2ccccc2)CC1 242100098 WEIQRIQBNFPLKX-UHFFFAOYSA-N 397.519 2.791 0 50 GFAA COc1cncc([C@H](NC(=O)c2cccc(OC(F)F)c2)[C@H]2C[C@@H](O)C2)c1 243893454 ARLMXKXJNIFUJV-HACGYAERSA-N 378.375 2.934 0 50 GFAA CN(CCc1ccccc1)Cc1cc(C(=O)N2CCN3CCCC[C@H]3C2)no1 244678926 IMIZNICXKZGDTL-IBGZPJMESA-N 382.508 2.659 0 50 GFAA COc1cccc(-c2nsc(NC(=O)[C@H]3CCO[C@@H]3c3cnn(C)c3C)n2)c1 275379319 OVTXOUNUVBDKHN-HOCLYGCPSA-N 399.476 2.972 0 50 GFAA Cc1sc(=O)n(CC(=O)N2C[C@H]3CCC[C@@]3(c3nc(C(C)C)no3)C2)c1C 276256390 FEWXWWONZKXQEJ-AUUYWEPGSA-N 390.509 2.613 0 50 GFAA C[C@@H]1c2cccn2CCN1C(=O)/C=C/C=C/C(=O)N1CCn2cccc2[C@H]1C 281176759 NLDLPYVWGSRQKZ-WGXRMQEASA-N 378.476 2.909 0 50 GFAA Cc1ccc(Cl)cc1N1CCN(C(=O)[C@@H]2CCO[C@H]2c2nccn2C)CC1 284735709 MQXQLHKCFAXOPX-SJLPKXTDSA-N 388.899 2.808 0 50 GFAA CC1(C)CN(c2ccc(Cl)cc2)CCN1C(=O)C[C@@H]1CCCS(=O)(=O)C1 294153228 VEKVCRAAPMJFRU-HNNXBMFYSA-N 398.956 2.982 0 50 GFAA COCCN1C(=O)C[C@@H](CN[C@H]2[C@@H]3CCCC[C@@H]3C2(C)C)[C@@H]1c1cnn(C)c1 328635420 URYFRDNELPUNIR-SBPISWGASA-N 388.556 2.761 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCCN(CC(F)(F)F)CC1 363441494 KLKOJCLLWLJAQC-CQSZACIVSA-N 377.451 2.510 0 50 GFAA C[C@@H](C[S@@](C)=O)NC(=O)NCC1(c2ccc(Br)s2)CCC1 376442450 QAZRMVXSAWLPCG-CHNSCGDPSA-N 393.372 2.999 0 50 GFAA COc1ccc(CC(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cc1 378597556 QSVBLURWGZJNOM-KRWDZBQOSA-N 380.423 2.767 0 50 GFAA C[C@@](NC(=O)C[C@@H](O)Cc1ccccc1)(C(N)=O)c1cccc(C(F)(F)F)c1 390832940 XIIDQAHXMGRNRU-LPHOPBHVSA-N 394.393 2.516 0 50 GFAA NC(=O)CCN(Cc1ccccc1)C(=O)NCC[C@@H]1CCCN2CCCC[C@H]12 426707518 WIECNEHZNPIFKS-VQTJNVASSA-N 386.540 2.728 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)NCc1nncn1C1CCCCC1 824536606 VZWXUCBDGWHETH-UHFFFAOYSA-N 378.498 2.887 0 50 GFAA CN(Cc1nccs1)S(=O)(=O)c1cc2c(cc1Cl)CCCC(=O)N2 872458615 LITREVHIPRIBHQ-UHFFFAOYSA-N 385.898 2.892 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)CCN2c3ccccc3CC[C@@H]2C)C1 952852907 ONBXAFBAQQGBRQ-POZUXBRTSA-N 384.480 2.898 0 50 GFAA COc1ccc2c(c1)OC[C@@]1(C(=O)O)CN(CCC(F)(F)C(F)F)C[C@@H]21 1073288756 DEFGJISLFPGCGS-LRDDRELGSA-N 377.334 2.848 0 50 GFAA Cc1noc(C)c1CO[C@H]1COCC[C@@H]1NC(=O)COc1ccc(Cl)cc1 1565507711 CVJXGIRTUYQWJE-ROUUACIJSA-N 394.855 2.814 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(CC(=O)N(C)C3CCCCC3)C1)CC2 1704337077 UDFFEXOMYYKIHV-QFIPXVFZSA-N 385.556 2.614 0 50 GFAA CCCNC(=O)N1C[C@H]2CN(Cc3ncc[nH]3)C[C@]2(CCc2ccccc2)C1 1772810638 NONSMIYTOLYTCV-DENIHFKCSA-N 381.524 2.896 0 50 GFAA CN(C)C(=O)c1cncc(N2CC[C@@]3(NC(=O)CC4(C)CCCC4)CCC[C@@H]23)n1 1775990050 CCFXZCJMIRKOQU-VGSWGCGISA-N 399.539 2.766 0 50 GFAA O=C(c1c(O)cccc1O)N1CCC[C@]2(CCc3c(O)nc(C4CC4)nc32)C1 1857701986 UXTQPLNWJADWOZ-NRFANRHFSA-N 381.432 2.591 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(CCCc3ccccc3)C[C@]23CC[C@H]1O3)c1ccon1 1857729154 KUQLBUZSODSUAX-XHYAQGIWSA-N 381.476 2.517 0 50 GFAA O=C(COc1ccc(Cl)c(Cl)c1)N[C@H]1C[C@H]2CO[C@H](C3CC3)CN2C1 1857734295 HRGAESNIDRHPRQ-DCGLDWPTSA-N 385.291 2.740 0 50 GFAA Cc1ccc(F)cc1C(=O)NC[C@H]1[C@H]2CN(Cc3[nH]cnc3C)C[C@]23CC[C@H]1O3 1857734435 SGSJUZQKMAYIAV-XHYAQGIWSA-N 398.482 2.575 0 50 GFAA CN(Cc1ccnn1C)C(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1875261582 ISPNTJOGIHDXTF-UHFFFAOYSA-N 381.402 2.709 0 50 GFAA CC[C@@H]1CC[C@@](O)(C(=O)N2CCC(S(=O)(=O)c3ccc(C)cc3)CC2)C1 1875271778 SYTDCQSAEPOXSH-UZLBHIALSA-N 379.522 2.701 0 50 GFAA O=C(NC12CCC(C(=O)O)(CC1)CC2)[C@@H]1CC(=O)N(C2CCCCCC2)C1 1875304926 ZPKAXJILPKJDAR-TVRCVXMWSA-N 376.497 2.852 0 50 GFAA CO[C@@H](C(=O)N=[S@@](C)(=O)c1ccnn1C)c1ccccc1C(F)(F)F 1875312201 WUAVLWIJCGKGSF-SHZVTRLKSA-N 375.372 2.810 0 50 GFAA CS(=O)(=O)[C@@H]1CC[C@H](NC(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320343 PQJPZHIIKAAFBW-NWDGAFQWSA-N 376.400 2.673 0 50 GFAA Cc1nc(-c2ccc(NC(=O)c3cccc(NS(=O)(=O)C4CC4)c3)cc2)n[nH]1 1875328473 UDVWMZCKFLARCR-UHFFFAOYSA-N 397.460 2.937 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(F)c(COCC2CC2)c1 1875403320 SSQWEBFTHCCGKG-CDHQVMDDSA-N 387.455 2.518 0 50 GFAA Cc1cccc(Oc2cc(CNC(=O)C(C)(C)[C@@]3(O)CCNC3)ccn2)c1C 2325800744 DOOMETUONVGYDS-JOCHJYFZSA-N 383.492 2.858 0 50 GFAA C[C@H]1Cc2c(Br)cccc2CN1C(=O)[C@H]1CCn2cnnc2C1 2325811646 LUESUTOHVNXSOY-RYUDHWBXSA-N 375.270 2.576 0 50 GFAA CN(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)c1cnc2c(c1)CCNC2 2325856174 DTMGWLCXINVHNL-UHFFFAOYSA-N 389.381 2.895 0 50 GFAA CCc1cc(C)c(C(=O)N[C@H]2CC3(CN(C(=O)[C@H]4CC4(C)C)C3)n3ccnc32)o1 2332237734 JOZVYJZXQRDKJX-CVEARBPZSA-N 396.491 2.805 0 50 GFAA CCC1(C(=O)N[C@@H]2CC3(CN(Cc4cc(C)on4)C3)n3ccnc32)CCCC1 2332237742 JWVSHTBRESOPLV-QGZVFWFLSA-N 383.496 2.922 0 50 GFAA CC(C)N1CCC[C@@]2(CCCN2C(=O)c2cc(-c3ccccc3O)[nH]n2)C1=O 2356135789 SYGGFSGSIFIYGD-OAQYLSRUSA-N 382.464 2.788 0 50 GFAA Cc1ccn2c(C(=O)N3CC[C@@H](O)[C@](CCC(C)C)(C(=O)O)C3)c(C)nc2c1 2356139095 NALINKAWCXVTHL-IIBYNOLFSA-N 387.480 2.665 0 50 GFAA CN(CCC1CCOCC1)C(=O)[C@@H]1C[C@H]2CCCN2[C@]12C(=O)Nc1ccccc12 2356155043 VIOPTMIXEKKKNI-FHJLPGHOSA-N 397.519 2.593 0 50 GFAA O=C(NC[C@H]1CCCO1)c1cc2nc(-c3ccco3)cc(C(F)(F)F)n2n1 721044 XCUDGQITAILRDV-SNVBAGLBSA-N 380.326 2.917 0 50 GFAA CC1CCN(C(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)CC1 878947 NTTROAPPSBOETI-UHFFFAOYSA-N 378.416 2.730 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)Cc2ccc(Cl)cc2)cc(C(=O)OC)c1 1059941 ZSZMRUBWVAIIKL-UHFFFAOYSA-N 397.836 2.855 0 50 GFAA COc1ccccc1[C@H]1CC(c2cccc(NS(C)(=O)=O)c2)=NN1C(C)=O 1077206 BYUPBKBNHSREQZ-GOSISDBHSA-N 387.461 2.764 0 50 GFAA COc1ccc([C@H]2CC(=O)c3cnc(NC[C@H]4CCCO4)nc3C2)cc1OC 2111724 RKRQPQBKWSMWIS-HUUCEWRRSA-N 383.448 2.997 0 50 GFAA biogenic COc1ccc(-c2onc(NCCCN3CCCC[C@H]3CO)c2C(=O)O)cc1 2356140586 NAOKYVNQWORLKB-HNNXBMFYSA-N 389.452 2.697 0 50 GFAA COc1ccc(NC(=O)C(=O)NCCc2ccc(OC)c(OC)c2)cc1Cl 2834826 QYLLLJQODMQAPG-UHFFFAOYSA-N 392.839 2.663 0 50 GFAA biogenic CCCN1C[C@@H](C(=O)N2CCC3(CC2)OCCc2sccc23)CCC1=O 2356165422 HUMNFYLTHOICSQ-HNNXBMFYSA-N 376.522 2.787 0 50 GFAA COc1cc(CN2CCC[C@H](C(=O)N3CCCCC3)C2)cc(OC)c1OC 4745193 RZYNIPPEJBIZJE-KRWDZBQOSA-N 376.497 2.937 0 50 GFAA CCOc1ccc([C@@H]2CC(=O)Nc3c2c(C)nn3CC(=O)O)c(OCC)c1C 65528370 BZBDFMKLGYZGSW-AWEZNQCLSA-N 387.436 2.856 0 50 GFAA Cc1nc2c(C)cccc2cc1C(=O)N1CCC(n2cc([C@@H](C)O)nn2)CC1 20167175 WYRQWJMDVFGCGR-OAHLLOKOSA-N 379.464 2.974 0 50 GFAA CCOc1cc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)ccc1O 23375420 CQDDIGWEODWRDE-FQEVSTJZSA-N 388.483 2.999 0 50 GFAA CC(C)CC(=O)[C@@H]1CCCN(C(=O)c2ccc(NCc3cnn(C)c3)nc2)C1 67846880 GXMJBBBQORTOAM-GOSISDBHSA-N 383.496 2.895 0 50 GFAA O=C(c1csc2nc(-c3ccccc3)cn12)N1CCC(N2CCOCC2)CC1 20601542 VNNBSJSQXPMALO-UHFFFAOYSA-N 396.516 3.000 0 50 GFAA O=C(NCCc1cscn1)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1 252482467 DGJLFYQRHIYXKE-UHFFFAOYSA-N 394.522 2.728 0 50 GFAA CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]1CCC[C@H]1CCO 428792671 IOAROHGXJSVPCV-QKYXUNIQSA-N 385.508 2.519 0 50 GFAA Cn1cnc2c(c1=O)CCN(S(=O)(=O)c1ccc(C3CCCCC3)cc1)C2 328624159 JTGPATWWDKHLIW-UHFFFAOYSA-N 387.505 2.575 0 50 GFAA Cc1ccccc1CN1CCC(N2CCC(C(=O)NC(C)(C)CO)CC2)CC1 71763853 RLCVCXSOEDBAEJ-UHFFFAOYSA-N 387.568 2.559 0 50 GFAA Cc1ccccc1CNC(=O)C[C@@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71479401 KHDDYPLDODBYJN-GOSISDBHSA-N 381.476 2.601 0 50 GFAA C[C@@H]1CCCN1Cc1ccc(C(=O)NCc2cnc3ccccc3c2)c(=O)[nH]1 77358251 UHHWNYKMCFKMOF-OAHLLOKOSA-N 376.460 2.837 0 50 GFAA CN(CC(F)(F)F)C(=O)CN1[C@H](C(=O)OC(C)(C)C)C[C@H]2CCCC[C@H]21 241775959 RQQUCQUINQLJHJ-MCIONIFRSA-N 378.435 2.982 0 50 GFAA O=C(N1CCO[C@]2(CNCCOC2)C1)C1(c2ccc(Cl)cc2)CCCCC1 72140226 DETSQHBZPQGMTK-HXUWFJFHSA-N 392.927 2.759 0 50 GFAA FC(F)(F)CN1CC[C@H](c2nc(-c3cn(Cc4ccccc4)nn3)no2)C1 289919640 YQUXXUMLQXMDCW-ZDUSSCGKSA-N 378.358 2.728 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 130557243 FWBMPMPTVQDYCC-QGZVFWFLSA-N 383.492 2.961 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@H]3CCOC3)csc2C1 426739770 MSBDHJNWCYVUOO-CQSZACIVSA-N 375.494 2.678 0 50 GFAA CCOc1ccccc1C(=O)N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)O)C1 95366571 ITJMUABGWLKEIR-KSFYIVLOSA-N 381.428 2.863 0 50 GFAA NCCCC(=O)N1CCC[C@H]1c1nc(Cc2ccc(Br)cc2)no1 237896206 RVRFRMQXTYZEKJ-AWEZNQCLSA-N 393.285 2.825 0 50 GFAA Cn1ccnc1[C@@H]1CCCN(C(=O)Cc2cc3c(cc2Cl)OCCO3)C1 95523528 SNZMADDZHDWBAY-CYBMUJFWSA-N 375.856 2.793 0 50 GFAA CCCOc1ccc(C(=O)N2C[C@H](CO)[C@H](CN3CCCC3)C2)cc1Cl 91859076 UVOREFQSSLCTTO-IAGOWNOFSA-N 380.916 2.905 0 50 GFAA O=C(Nc1ccc(-c2ccco2)cc1)[C@@H]1CCCN(CCN2CCOCC2)C1 95499946 VDICDXYKIGSEFM-LJQANCHMSA-N 383.492 2.929 0 50 GFAA COc1ccc2c(c1)OC[C@H](C(=O)NCc1nc(Cc3cccs3)no1)C2 95519115 QHWLDQOAKXHTQP-CYBMUJFWSA-N 385.445 2.598 0 50 GFAA CCOC(=O)c1cn(-c2nc(N)c(F)cc2F)c2cc(F)c(F)cc2c1=O 230571888 NRRZTJOORMEAJX-UHFFFAOYSA-N 381.285 2.701 0 50 GFAA Cn1ccnc1[C@H]1CCCN(C(=O)Cc2cc3c(cc2Cl)OCCO3)C1 95523529 SNZMADDZHDWBAY-ZDUSSCGKSA-N 375.856 2.793 0 50 GFAA COc1ccc2[nH]cc(CCNC(=O)[C@@H](C)N3Cc4ccccc4C3=O)c2c1 334161662 GNLUZPYFRMQSGP-CQSZACIVSA-N 377.444 2.880 0 50 GFAA CN(C)c1ccc(CN2CCC3(CCC(=O)N(C[C@@H]4CCCO4)C3)CC2)cn1 91563080 ZADKZHDTKVEEPC-IBGZPJMESA-N 386.540 2.531 0 50 GFAA COCCN1CCC[C@]2(CCN(c3ccnc4c(F)cc(F)cc34)C2)C1=O 95362161 HCUQEANACGFJLN-HXUWFJFHSA-N 375.419 2.978 0 50 GFAA CCN1CC2(CCC1=O)CCN(C(=O)Nc1ccc(OC)cc1OC)CC2 91320678 QJMPDCARBFLPBI-UHFFFAOYSA-N 375.469 2.960 0 50 GFAA Cc1cc(=O)c(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)nn1-c1ccccc1F 299379255 VMACGRPJWUFOTK-UNEWFSDZSA-N 399.422 2.538 0 50 GFAA COc1ccccc1-c1nnc(CNc2ccccc2CN2CCNC2=O)o1 184451195 CFJHPMYDOYUUEC-UHFFFAOYSA-N 379.420 2.883 0 50 GFAA C[C@@H](NC(=O)N1CCN(C(=O)c2cccs2)CC1)c1cn2ccsc2n1 534659594 SXSXMHNGBNZAFZ-GFCCVEGCSA-N 389.506 2.686 0 50 GFAA COC(=O)c1ccc(C)c(NC(=O)N2CCCO[C@H](CN3CCCC3)C2)c1 299798523 QZIYBKQYDFKQQQ-QGZVFWFLSA-N 375.469 2.500 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N[C@H]1CCCN(Cc2cccs2)C1 823724783 KIGLCQUEQBBWTJ-KRWDZBQOSA-N 379.551 2.679 0 50 GFAA CN(C)c1ccc(C(=O)Nc2ccc(NC(=O)CN3CCCCC3)cc2)cn1 828052272 PURUDEFLWZSSEF-UHFFFAOYSA-N 381.480 2.824 0 50 GFAA C[C@@H]1CCN(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)[C@@H]2C(=O)NC[C@H]21 1875304146 BJWLSWNRJIDYTI-RLCCDNCMSA-N 388.468 2.861 0 50 GFAA O=C(O)C[C@H](NS(=O)(=O)c1ccc2c(c1)COCC2)c1ccc(F)cc1F 1875303574 DQXMPMLIKLTKBR-KRWDZBQOSA-N 397.399 2.532 0 50 GFAA O=C(c1cc(=O)c2ccccc2o1)N1C[C@@H]2CC[C@H]1CN(C1CCOCC1)C2 1565515963 SHZWEMDHKCCOSD-WBVHZDCISA-N 382.460 2.508 0 50 GFAA Cc1ccc(S(=O)(=O)CCCN2CCN(c3cccs3)C(=O)C2)cc1 186094504 QLEYRFLVJGBPCS-UHFFFAOYSA-N 378.519 2.569 0 50 GFAA Cc1cc(C(=O)N2CCc3ccc(S(=O)(=O)N(C)C)cc32)c2ccccc2n1 172171903 MOADUCJTDAFWSG-UHFFFAOYSA-N 395.484 2.996 0 50 GFAA C[C@H](Oc1ccc(F)cc1Br)C(=O)NC1(c2nnc[nH]2)CCC1 188759287 XUDUXCYMJYRZPX-VIFPVBQESA-N 383.221 2.669 0 50 GFAA C[C@@H](NS(=O)(=O)CC1CCS(=O)(=O)CC1)c1ccc2ccccc2c1 225832769 HMMJUUFJJXHASQ-CQSZACIVSA-N 381.519 2.645 0 50 GFAA Cc1ccc(NC2(C(=O)N[C@H](C)c3n[nH]c(CC(=O)O)n3)CCCCC2)cc1 1506399310 LWNWPXXGMXZKNF-CQSZACIVSA-N 385.468 2.732 0 50 GFAA Cn1cnc2cc(C(=O)N3CCC4(CC3)OCCc3sccc34)ccc2c1=O 1704338840 HFXIZQBQEIGJNH-UHFFFAOYSA-N 395.484 2.699 0 50 GFAA COc1cc(C(=O)N2CCC[C@]3(CCc4cnc(N(C)C)nc43)C2)ccc1F 1704337884 GRSCKSNYPHKXCK-NRFANRHFSA-N 384.455 2.811 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1c(F)cccc1F)CC2 11813248 ACNBLVAIPYCSQY-OAHLLOKOSA-N 378.419 2.507 0 50 GFAA CN(Cc1ccccc1)C(=O)CCC1CCN(C(=O)CCN2CCCO2)CC1 11843466 QCYFMAUUXKBTLR-UHFFFAOYSA-N 387.524 2.691 0 50 GFAA CN(CC1CCN(CCc2ccccc2F)CC1)C(=O)CCc1cnccn1 12056449 QSRKYTUIGWKIFJ-UHFFFAOYSA-N 384.499 2.961 0 50 GFAA CN(C)c1cccc(C(=O)N2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)c1 12319650 QYBBSODLSKKCEX-FQEVSTJZSA-N 387.524 2.680 0 50 GFAA CCN1C(=O)N(CCc2ccccc2)C2(CCN(Cc3ccccn3)CC2)C1=O 14733588 KBWVJFMZKPZSIQ-UHFFFAOYSA-N 392.503 2.943 0 50 GFAA CCOCCCN[C@H]1CCc2c(c(C(=O)N3CCCC3)nn2CC(C)C)C1 14750615 YYHXRNXEFQBNCR-KRWDZBQOSA-N 376.545 2.649 0 50 GFAA CCCS(=O)(=O)N1CCC[C@](Cc2ccc(F)cc2F)(C(=O)OCC)C1 14950443 UPNUICQUWTYHQN-GOSISDBHSA-N 389.464 2.892 0 50 GFAA CSc1ccc(S(=O)(=O)Nc2ccccc2)cc1C(=O)N1CCOCC1 16649478 TZYVDVPYVLXVBH-UHFFFAOYSA-N 392.502 2.682 0 50 GFAA CCc1ccccc1CN1CC(=O)N2[C@H](C[C@@H](C(=O)NC3CCC3)[C@H]2CC)C1 1857689062 CVNIKEXQBYYESI-NJDAHSKKSA-N 383.536 2.729 0 50 GFAA O=C(O)[C@H]1CN(Cc2cc[nH]n2)CC12CCN(C/C=C/c1ccccc1)CC2 1857707079 YKHIZRHDZJVSQJ-WWPOYFSUSA-N 380.492 2.722 0 50 GFAA Nc1ncccc1CNC(=O)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857726166 HOIQHQBMWHPTAR-ZDUSSCGKSA-N 385.855 2.991 0 50 GFAA Cc1nc(O)c2c(n1)[C@]1(CCCN(C(=O)CCc3ccc4c(c3)OCO4)C1)CC2 1857730676 YRGJAXNQUYMZJK-JOCHJYFZSA-N 395.459 2.659 0 50 GFAA Cn1c([C@@H]2CCCCN2C(=O)c2cccc(OCC(N)=O)c2)nc2ccccc21 115757476 BZLLMYDPLDJJKI-IBGZPJMESA-N 392.459 2.805 0 50 GFAA Cc1c(C(=O)N2CCC[C@H]2C(=O)O)cnn1-c1ccc(Br)cc1 237755537 PEQDZBKWBBYYBS-AWEZNQCLSA-N 378.226 2.632 0 50 GFAA COC[C@@]1(CN2C(=O)CCN(CCc3cccc4cc[nH]c34)C2=O)CCCCO1 2325779884 NAFZNWWKPMSYRL-QFIPXVFZSA-N 399.491 2.950 0 50 GFAA CCSC1CCC(C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)CC1 2325781145 PKGAXHAHRPQRKS-UHFFFAOYSA-N 382.507 2.663 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCC(c2nccc(-c3ccccc3OC)n2)CC1 862249734 APNIVSIDVDXXRP-UHFFFAOYSA-N 394.475 2.503 0 50 GFAA Cn1c(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)nc2ccccc2c1=O 126709381 OBSYZFKTHJKIOL-INIZCTEOSA-N 392.507 2.631 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(NC1CCCCC1)n2CCCc1ccccc1 637113 WTCDOHHWTSBGOP-UHFFFAOYSA-N 381.480 2.801 0 50 GFAA O=C(c1cc(O)no1)N1CCC[C@]2(CCc3cnc(-c4ccccc4)nc32)C1 2356159278 UAGVKHAJFQVKMY-NRFANRHFSA-N 376.416 2.957 0 50 GFAA Cc1ccccc1-c1noc(CCC(=O)N2CCC[C@]23CCCN(C)C3=O)n1 2356166795 ACGKRYJOGKPMEB-NRFANRHFSA-N 382.464 2.591 0 50 GFAA O=C(NCCCn1ccnc1)/C(=C/c1ccc(F)cc1)NC(=O)c1ccccc1 4806086 VBFIQGZPXIDDIZ-HKWRFOASSA-N 392.434 3.000 0 50 GFAA Cc1ccc(C)c(C(=O)N2CCN(c3cc(-n4cccn4)nc(C)n3)CC2)c1 67601850 AIOBRHOKGFEMEQ-UHFFFAOYSA-N 376.464 2.550 0 50 GFAA Cc1ccc2cccnc2c1S(=O)(=O)Nc1ccc(CS(C)(=O)=O)cc1 477323483 XZFCQAYOJPCZEF-UHFFFAOYSA-N 390.486 2.889 0 50 GFAA O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc(OC(F)(F)F)cc1 1089523 CHLDDJHHPUBWRI-UHFFFAOYSA-N 379.298 2.578 0 50 GFAA O=C(Nc1ccc(SC(F)F)nc1)C(=O)N1CCO[C@]2(C[C@H]3CC[C@H]2C3)C1 370169520 ACDZZTWLPPFDAP-OAVHHTNSSA-N 397.447 2.752 0 50 GFAA Cc1cc(-c2cn3cc(C(=O)N[C@@H]4C[C@H]5CC[C@@H]4C5)nc3c(=O)n2C)c(C)o1 72477109 BWPHIGFFQZQVFZ-SQWLQELKSA-N 380.448 2.828 0 50 GFAA COCCC(=O)N1CCN(C(=O)Nc2ccc(C)c(-c3nc(C)co3)c2)CC1 242273698 YFBSNJKVTYJJEF-UHFFFAOYSA-N 386.452 2.671 0 50 GFAA CC(C)[C@H](NC(=O)c1cc(Br)c(O)c(Br)c1)C(=O)O 263577789 RWCLVRLQFBLIHU-VIFPVBQESA-N 395.047 2.756 0 50 GFAA O=C(O)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 226124273 GDCZQRJGPIDFRI-WCVJEAGWSA-N 399.274 2.520 0 50 GFAA CO[C@@]12CC[C@@H](OCC3CC3)C[C@@H]1N(C(=O)c1cnn3cc(C)cnc13)CC2 426545458 SVOVIABMWGXCRM-PLMTUMEDSA-N 384.480 2.617 0 50 GFAA CC(=O)c1c(C)nn([C@H](C)CC(=O)NCc2nc(O)c3ccccc3n2)c1C 426519185 FAZXJXMWFKRGEJ-LLVKDONJSA-N 381.436 2.619 0 50 GFAA CCCC[C@H](C(=O)Nc1nc(-c2ccc[nH]2)cs1)N1CCCS1(=O)=O 179476771 JVCBPBUKFPOOGG-CQSZACIVSA-N 382.511 2.671 0 50 GFAA COc1ccccc1OC1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1 426526445 PMEAMEVUNRGPJW-UHFFFAOYSA-N 396.491 2.527 0 50 GFAA CC[C@H](NC(=O)Nc1cc(OC)cc(-n2nnnc2C)c1)c1ncccc1C 95522419 HXZXVIJSRWBKEP-KRWDZBQOSA-N 381.440 2.956 0 50 GFAA CCc1nn(C)c(NC(=O)NCc2nnc3n2CCC3)c1-c1ccc(F)cc1 96150478 WEHQXXJEIWGVIR-UHFFFAOYSA-N 383.431 2.648 0 50 GFAA CC(C)CN1CCc2[nH]cnc2C12CCN(C(=O)c1cc(C3CC3)no1)CC2 92077589 OMDCXQMPHDKAIK-UHFFFAOYSA-N 383.496 2.921 0 50 GFAA CCn1ccnc1[C@H]1CCCN(C(=O)CCS(=O)(=O)c2ccc(C)cc2)C1 95506902 IDEKFKJLSQEPHG-KRWDZBQOSA-N 389.521 2.781 0 50 GFAA CCc1cnc(C)nc1N1CCC(c2nnc(Cn3ccnc3)n2C2CC2)CC1 91876816 UKNKUXPKQJSNQR-UHFFFAOYSA-N 392.511 2.903 0 50 GFAA O=C(c1cc(O)c2cccc(F)c2n1)N1CCC(N2CCSCC2)CC1 97217718 UJGYXSPIENWCNH-UHFFFAOYSA-N 375.469 2.733 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)Cc3ccc(F)c(C)c3)C[C@H]2NC(C)=O)cc1 95497356 XOFADDLWOPAHKN-PZJWPPBQSA-N 384.451 2.816 0 50 GFAA CCOc1cc(NC2CCN(C(=O)[C@@H]3OCCc4ccccc43)CC2)ncn1 183969911 WGISMWJMFJFGPQ-HXUWFJFHSA-N 382.464 2.592 0 50 GFAA O=C(O)[C@@H]1CN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)CCO1 299748298 GTVGUNGAHKJYRE-SFHVURJKSA-N 378.384 2.934 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccccc2Cl)C1=O)Nc1nccs1 252550543 SRPZCKAMMWIBIS-GFCCVEGCSA-N 378.841 2.840 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263615386 CCTLPPSQOPLORT-IBGZPJMESA-N 380.444 2.517 0 50 GFAA Cc1noc(C)c1CCNC(=O)c1cc2n(n1)C[C@@H](c1ccc(F)cc1)OC2 263616069 GVHXCJPRXLHSRG-IBGZPJMESA-N 384.411 2.871 0 50 GFAA C[C@@H]1N(C(=O)c2cc(-c3ccccc3)nn2C)CCC[C@@]12CCCN(C)C2=O 1940198137 PYUNVXHVUWPFNU-AOMKIAJQSA-N 380.492 2.950 0 50 GFAA O=C1CCN(C(=O)Cc2ccc(F)cc2Cl)CCN1CCN1CCCCC1 299781632 IBHZFJDWQQAIPG-UHFFFAOYSA-N 395.906 2.568 0 50 GFAA Fc1ccc(-n2nc(CCn3ccnc3)nc2CO[C@H]2CCOC2)cc1Cl 1875336327 WUNOSJZPXKQTMD-AWEZNQCLSA-N 391.834 2.805 0 50 GFAA CNC(=O)c1cccc(OCC(=O)N2CC[C@H](Oc3ccccc3Cl)C2)c1 1875390224 ABNPMMHIZPYHGE-INIZCTEOSA-N 388.851 2.758 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccnc(Oc2ccccc2)c1 1875402722 LMFNOZOHRQYHDP-ATZDWAIDSA-N 378.432 2.640 0 50 GFAA Cc1nn(-c2ccc(F)cc2)c(C)c1CNCc1cnc(N2CCOCC2)nc1 952968102 ASWWVLVZPLWJEZ-UHFFFAOYSA-N 396.470 2.545 0 50 GFAA C[C@H]1CN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2cccc(F)c2O1 185984459 LZNFAUXNHIWOMM-AWEZNQCLSA-N 397.450 2.622 0 50 GFAA Cc1cccc2c1N(C(=O)C(=O)N(C[C@H]1CCCO1)c1ccc(N)cc1F)CC2 170603797 TUXGTKZUZIRTTJ-QGZVFWFLSA-N 397.450 2.818 0 50 GFAA O=C(c1cn(-c2cccc(Cl)c2)nn1)N1CCO[C@H](c2nccs2)C1 186810479 PXFRQXDCWJFEKY-AWEZNQCLSA-N 375.841 2.591 0 50 GFAA Cc1ncc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c(C(C)C)n1 188149898 WHLOUFZBZWHDHD-JOCHJYFZSA-N 382.508 2.617 0 50 GFAA Cc1cc(CNC(=O)N2CC[C@H](C)[C@@H](O)C2)ccc1I 408236116 NFFFYKJGXACQTH-HZMBPMFUSA-N 388.249 2.512 0 50 GFAA CCN(Cc1ccc(C(=O)N(C)C)cc1)c1cc(N2CCCC[C@@H]2CO)ncn1 192343057 JXOOYOVEOGRTJX-LJQANCHMSA-N 397.523 2.556 0 50 GFAA CC(C)Cc1cc(C(=O)NC[C@H](c2cccnc2)N2CCCCC2)nc(O)n1 1506421548 IJGXMRQUZRHRSD-LJQANCHMSA-N 383.496 2.733 0 50 GFAA COc1ccc(CN2C[C@@H](O)[C@H](Cc3cc(C)[nH]n3)C2)c2c(OC)cccc12 1529168322 ZWZNMKDHRGIWJL-VQIMIIECSA-N 381.476 2.924 0 50 GFAA Cc1cc(CC(=O)N2CCCN(C(=O)c3ccc4sc(C)nc4c3)CC2)on1 1704327717 HEXIXLIWXXUTRV-UHFFFAOYSA-N 398.488 2.818 0 50 GFAA C[C@@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)C1 1704338489 CWVODWSAQKDMOK-OAHLLOKOSA-N 377.865 2.564 0 50 GFAA O=C(CCc1nc(-c2ccccc2)no1)N1CCC[C@]2(CCc3c[nH]nc32)C1 1775982639 MRLGQEIMYJQSHL-NRFANRHFSA-N 377.448 2.899 0 50 GFAA CCOC(=O)CCNC(=O)N1CCC[C@](Cc2ccccc2)(C(=O)OCC)C1 12581656 WUHIOXYLKFUGIE-OAQYLSRUSA-N 390.480 2.537 0 50 GFAA O=c1cc(CSc2nnnn2-c2ccccc2)nc(Nc2ccc(F)cc2)[nH]1 18266415 SZCZQRMTFOINOL-UHFFFAOYSA-N 395.423 2.921 0 50 GFAA CCOC(=O)c1ccc(OCCCN2CCN3C(=O)OC[C@]3(CC)C2)cc1 1857685598 ZGJPGWWJQNBQNW-FQEVSTJZSA-N 376.453 2.549 0 50 GFAA O=C(CCO)N[C@@H]1CCCC12CCN(C(=O)c1ccc3ncsc3c1)CC2 1857709373 UHLHMIOFZAOWSI-QGZVFWFLSA-N 387.505 2.570 0 50 GFAA COc1ccc(CC(=O)N[C@@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)cc1OC 1857731513 TWWVUAIUCCTYAC-XQBPLPMBSA-N 396.487 2.577 0 50 GFAA COCCCCNC(=O)Nc1ncnc2c1c(C)c(C)n2C[C@@H]1CCCO1 225679446 ILCPVWRNQOAUKM-HNNXBMFYSA-N 375.473 2.775 0 50 GFAA O=C(c1cccc2nccnc12)N1C[C@@H](O)[C@H](Cc2ccc3ccccc3n2)C1 2100555067 LIEDFIDWZSAGGR-IIBYNOLFSA-N 384.439 2.854 0 50 GFAA CCc1ccc(CCCC(=O)N2CCCN(c3ncnc4[nH]cnc34)CC2)cc1 2325791586 USNRAAIFCBGIEW-UHFFFAOYSA-N 392.507 2.977 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@H](Cc2cccc(Cl)c2F)C(=O)O)s1 2325875724 AJUAJEHVOFUTOR-CYBMUJFWSA-N 398.843 2.602 0 50 GFAA C[C@H](O)Cn1cc(-c2nc([C@@H]3COc4ccccc43)nn2C2CCC2)ccc1=O 2325880166 XOVUMWAGLFFPGA-KBXCAEBGSA-N 392.459 2.737 0 50 GFAA Cc1ccn(-c2ccccc2CNC(=O)CCN2C(=O)COc3ccccc32)n1 151944014 SOOIKETVMVDDDJ-UHFFFAOYSA-N 390.443 2.613 0 50 GFAA COC(=O)[C@@H]1CC12CCN(C(=O)CCc1nc(-c3ccccc3C)no1)CC2 2356151260 AIXZTMVJOMKIAJ-INIZCTEOSA-N 383.448 2.779 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@]2(CCN(C(=O)c3ccc[nH]3)C2)c2ccccc21 2356169989 PMSKMYIXRYGKMR-QFIPXVFZSA-N 390.443 2.950 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCCC1)Cc1ccc(Cl)c(Cl)c1 4511448 SNZLDFAHEZBICW-UHFFFAOYSA-N 379.309 2.768 0 50 GFAA C[C@H](NC(=O)N1CCNC(=O)C[C@H]1c1ccccc1)[C@H]1CCCN(C2CCC2)C1 248389659 AZRWXOCRMPWFDK-CUWPLCDZSA-N 398.551 2.912 0 50 GFAA Cc1ccc(N2C(=O)C[C@H](NC3CCN(Cc4ccccc4)CC3)C2=O)cc1 100711019 CBUPVGYWCGHUAN-NRFANRHFSA-N 377.488 2.881 0 50 GFAA O=C(NCCc1nccs1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 116951990 SKAMVQOESXYRLH-LBPRGKRZSA-N 382.436 2.865 0 50 GFAA CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 249131220 SLUKPRKCAOHYLX-VQIMIIECSA-N 379.520 2.879 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(C(=O)N2CCN(C)c3ccc(F)cc32)c1C 136284210 HWPQFJBQIAKZAC-UHFFFAOYSA-N 376.453 2.943 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccccc3Cl)CC2)C1 67541806 MKNPVZPAAGMLNE-SFHVURJKSA-N 393.959 2.779 0 50 GFAA COCc1ncc(CN2CCC[C@@]3(CCN(C(=O)c4ccc(F)cc4)C3)C2)cn1 67514041 BOMHVNNYOUXMIG-JOCHJYFZSA-N 398.482 2.890 0 50 GFAA CCNC(=O)N1CCC(n2cc(CN3CC[C@@H]3c3ccc(F)cc3)nn2)CC1 23430737 JFJBXOVZDMITEI-LJQANCHMSA-N 386.475 2.731 0 50 GFAA O=C(C1CCCCC1)N1CCN([C@@H]2CCN(c3c(F)cccc3F)C2=O)CC1 118960771 VCLSOZNAWHWINJ-GOSISDBHSA-N 391.462 2.795 0 50 GFAA COc1cc(Br)c(CN2CCN(c3ncccn3)CC2)cc1OC 23280530 XSGWLGVVCSPFME-UHFFFAOYSA-N 393.285 2.579 0 50 GFAA O=C(NCc1ccccn1)C1CCN(C[C@]2(c3ccc(F)cc3)CCOC2)CC1 23251326 ZIZVLJMOYHHLFK-HSZRJFAPSA-N 397.494 2.907 0 50 GFAA NC[C@H]1CCN(C(=O)/C=C/c2ccc(-n3cc(Br)cn3)c(F)c2)C1 328596431 PIPGUORJQDZWLL-CXLRFSCWSA-N 393.260 2.594 0 50 GFAA COc1cc(Cl)cc(C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)c1 432005423 FFWHHEKQYJJKLN-CYBMUJFWSA-N 375.856 2.899 0 50 GFAA c1ccc(-c2cnn3cc(CN4CCC(N5CCOCC5)CC4)cnc23)cc1 67714518 OHKNVWRMHOTSEI-UHFFFAOYSA-N 377.492 2.693 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)NCCCN1CCc2ccccc2C1 65362243 BDTDTQPBVKRGJR-UHFFFAOYSA-N 378.469 2.561 0 50 GFAA CCCN1CCC[C@H]1CNC(=O)[C@H](NC(=O)c1c(F)cccc1F)C(C)C 253417566 ARQDAGYTWBDMRO-KBXCAEBGSA-N 381.467 2.710 0 50 GFAA CN(C)c1noc([C@H]2CCCN2CC(=O)Nc2nc(-c3ccco3)cs2)n1 374531649 RVCZSQLKVDYHMI-GFCCVEGCSA-N 388.453 2.628 0 50 GFAA O=C(NCc1ccc(N2CCCS2(=O)=O)c(F)c1)N1CCC[C@@H](C2CC2)C1 377346636 PBZRHGNVIVHBCH-MRXNPFEDSA-N 395.500 2.697 0 50 GFAA CNc1ncc(CN(C)C(=O)c2cc(Cn3ccc4ccccc43)[nH]n2)cn1 71764775 XNTPEFWLRNKXSL-UHFFFAOYSA-N 375.436 2.517 0 50 GFAA Cc1nn(C)cc1C(=O)N1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 72121618 RSQAGBRXVAERES-LJQANCHMSA-N 386.471 2.767 0 50 GFAA Cc1nn(-c2ccccn2)c(C)c1CC(=O)NC[C@@H]1CCCN2CCCC[C@@H]12 226848097 BIYBBESDDGXOLM-ICSRJNTNSA-N 381.524 2.807 0 50 GFAA biogenic Cc1cccn2cc(COc3ccccc3C(=O)N3CC[C@@H](C(=O)O)C3)nc12 178274963 BCFYYNBFVUEQBM-OAHLLOKOSA-N 379.416 2.768 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(Cc4ccncc4)C3)C2)o1 82137798 UTILAHYONRHMSI-NRFANRHFSA-N 383.448 2.728 0 50 GFAA O=C(Nc1ccc2c(c1)S(=O)(=O)CC2)N(Cc1ccco1)C[C@H]1CCCO1 178374803 CIOKAVULUBUYNG-QGZVFWFLSA-N 390.461 2.823 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2c[nH]nc2C2CCCCC2)CC1=O 82138529 CQLAPFAVMJUGMM-UHFFFAOYSA-N 382.464 2.955 0 50 GFAA O=C(CCCN1CCCC1)N1CCC[C@H](c2nccn2Cc2cscn2)C1 95502779 WJMGHBCEHZACSI-KRWDZBQOSA-N 387.553 2.970 0 50 GFAA Cc1ccc(C(=O)N[C@@H](c2cccnc2)C(F)(F)F)cc1N1CCNC1=O 91643451 CJPKEFZMIYFOLS-HNNXBMFYSA-N 378.354 2.953 0 50 GFAA COc1ccc(C(=O)NCc2noc(C)n2)cc1OC1CCN(C(C)C)CC1 95509728 MMEOGTAVLHTFCU-UHFFFAOYSA-N 388.468 2.568 0 50 GFAA COCCN1CC2(CCC1=O)CCN(C(=O)c1ccccc1SC)CC2 91645035 NRQRYBODNVFUJU-UHFFFAOYSA-N 376.522 2.900 0 50 GFAA COc1cc(CN2CCC3(CCC(=O)N(CCN(C)C)C3)CC2)ccc1F 91725408 UIOAERDPZURBSW-UHFFFAOYSA-N 377.504 2.601 0 50 GFAA COc1ccc(CN(C)Cc2ccncc2C)c(OC[C@@H](O)CN2CCCC2)c1 95528269 KXVTWCNPNKINHH-NRFANRHFSA-N 399.535 2.866 0 50 GFAA Cc1ccc2oc(N3CCC[C@H](c4nnc(Cn5ccnc5)n4C)C3)nc2c1 95371819 ATKYOVSQZHARPU-HNNXBMFYSA-N 377.452 2.894 0 50 GFAA O=C(NC[C@@H](c1ccccc1F)N1CCCC1)N1CCC(c2nc[nH]n2)CC1 534669087 DKKQCFFGMPLZQD-SFHVURJKSA-N 386.475 2.670 0 50 GFAA Cc1nc(-c2ccc(NC(=O)CN3C[C@H](c4ccccc4)CC3=O)cc2)n[nH]1 827831072 OGMCMFYMTQELSF-QGZVFWFLSA-N 375.432 2.735 0 50 GFAA Cc1ccc([C@@H](C)CCN2CCC(CNC(=O)Cn3ccccc3=O)CC2)o1 827861521 QGKQKIKIXQLUDK-KRWDZBQOSA-N 385.508 2.772 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)NCc2noc(C3CC3)n2)s1 825306861 XKLMGGKFLVWWEA-UHFFFAOYSA-N 380.451 2.759 0 50 GFAA Cc1cc(N2CCN(C(=O)c3n[nH]c4c3C[C@H](C)O[C@@H]4C)CC2)nc(C(C)C)n1 1875392661 MPBQFIFXUJIHGU-LSDHHAIUSA-N 398.511 2.616 0 50 GFAA CC(C)[C@H](C(=O)N1CC[C@@H]1CN(C)C(=O)c1ccc(O)nc1)c1ccccc1 1875328763 LQJPDKZYMUOCDK-QUCCMNQESA-N 381.476 2.900 0 50 GFAA Cc1ccc(CN(C)CC(=O)Nc2ccc(C)c(NC(=O)CN(C)C)c2)cc1 952967359 ZQNUBPFKJKRCPQ-UHFFFAOYSA-N 382.508 2.874 0 50 GFAA CCNC(=O)c1cccc(NC(=O)C2CCN(C(=O)c3ccccn3)CC2)c1C 952987573 NDSRWIYLHJVIFT-UHFFFAOYSA-N 394.475 2.631 0 50 GFAA COc1ccc2cc(CN[C@@H]3CCCN(C(=O)c4ccco4)C3)c(O)nc2c1 952977538 KDUORJKKNDBPKF-MRXNPFEDSA-N 381.432 2.936 0 50 GFAA CCn1cccc1C(=O)N[C@@H]1CCCCCN(C(=O)C[C@@H]2CCCOC2)C1 1775991561 LBNIBEUJXAVTSX-ZWKOTPCHSA-N 375.513 2.826 0 50 GFAA O=C(N1CCCC1)N1CC[C@@]2(O)CCN(Cc3ccc(Cl)s3)C[C@H]2C1 1565531212 YHLHSYLWSAKFLJ-KSSFIOAISA-N 383.945 2.876 0 50 GFAA Nc1ccc(C(=O)N2CCC3(CCC(=O)N(Cc4ccccc4)C3)CC2)cn1 91526895 DJMHOZVORZOYRG-UHFFFAOYSA-N 378.476 2.709 0 50 GFAA COc1ccc(CN2CC[C@H](NC(=O)c3nccc4ccccc34)C2=O)cc1 172262013 SFXLKGXEUBBHDK-IBGZPJMESA-N 375.428 2.774 0 50 GFAA O=C(Cn1nnc(-c2ccc(Br)o2)n1)N1CCC[C@H]2CCCC[C@H]21 408158837 OOGAGYJAJGFXCB-VXGBXAGGSA-N 394.273 2.877 0 50 GFAA CC[C@@H](C(=O)OC)N(C)CC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccs1 225339190 FBZACFGNGIVXDE-LSDHHAIUSA-N 389.477 2.902 0 50 GFAA CCOC(=O)[C@H](COC)N(C(=O)COc1cc(Cl)ccc1Cl)C1CC1 225563180 BBSLIIJTXBWNQA-AWEZNQCLSA-N 390.263 2.941 0 50 GFAA Cc1cc(S(N)(=O)=O)ccc1CNC(=O)C1(c2ccc(F)cc2F)CCC1 225568173 ULCUTKNICZAHBD-UHFFFAOYSA-N 394.443 2.659 0 50 GFAA COCc1ccccc1CNC(=O)N(C)C[C@]1(O)CCN(Cc2ccccc2)C1 190194013 WWBSHDMHFZNUJH-HSZRJFAPSA-N 397.519 2.611 0 50 GFAA CCC(=O)N1CC[C@@H](C(=O)Nc2cc(C)cc(N3CCN(C(C)C)CC3)c2)C1 190803180 DHJHNKKWVORYSF-GOSISDBHSA-N 386.540 2.722 0 50 GFAA CCc1noc2ncc(C(=O)N3CCN(Cc4cc(F)ccc4OC)CC3)cc12 194679386 QOEKSJOOEULFSF-UHFFFAOYSA-N 398.438 2.891 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2Cc2cc(C(C)(C)C)n[nH]2)cc1OC 1529118977 QUQLSEAJMWDRKP-UYAOXDASSA-N 389.496 2.659 0 50 GFAA Cc1nn(C)c(NC(=O)[C@@H]2CC(=O)N(Cc3cccnc3)C2)c1-c1ccccc1 1529196715 FIPMUBDYVLBWSX-GOSISDBHSA-N 389.459 2.778 0 50 GFAA CCCc1ccc(C(=O)N2CCCN(C(=O)Cc3c(C)n[nH]c3C)CC2)cc1 1529185704 OYWHYAJMUFYDFW-UHFFFAOYSA-N 382.508 2.896 0 50 GFAA Cc1ccc2[nH]c(C3CCN(C(=O)c4cn(C[C@@H]5CCCO5)nn4)CC3)nc2c1 11935416 SCDAZAIHFYUCNI-INIZCTEOSA-N 394.479 2.662 0 50 GFAA CN(Cc1ccccc1)C(=O)c1nc2ccccn2c1CNCCc1c[nH]cn1 11935668 DDBNAKKEVKIRHW-UHFFFAOYSA-N 388.475 2.662 0 50 GFAA Cc1nc(CN(C)C[C@@]2(O)CCCN(Cc3ccccc3F)C2=O)cs1 12205979 POCWMSOBWXTNNV-IBGZPJMESA-N 377.485 2.576 0 50 GFAA COc1cccc2c1OCC(CN1CCO[C@]3(CCN(c4nccs4)C3)C1)=C2 1857693432 WOBLOWLFPLOGQC-OAQYLSRUSA-N 399.516 2.909 0 50 GFAA COc1cc(F)ccc1C(=O)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857733763 XQZJRCOVAZWRGU-KPLVRAHFSA-N 396.418 2.749 0 50 GFAA O=S(=O)(NC1CCCC1)C1CN(c2nnc(-c3ccccc3Cl)s2)C1 333073451 DBXGZVYSDQRBAG-UHFFFAOYSA-N 398.941 2.909 0 50 GFAA Cc1c(NC(=O)c2ccc(CN3CCCCC3)o2)nnn1Cc1ccncc1 820494584 IDBHTLNAKBLCDY-UHFFFAOYSA-N 380.452 2.861 0 50 GFAA CCOc1ccc2nc(NC(=O)CN3C(=O)c4ccccc4C3=O)sc2c1 2857166 OYQSXCPQFVIDNA-UHFFFAOYSA-N 381.413 2.930 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)N[C@H]2COc3cc(F)c(Br)cc32)C1 2325888282 CNGQREYGBVSDPP-HZMBPMFUSA-N 397.244 2.563 0 50 GFAA CCOC(=O)c1cc(CC)sc1NC(=O)CN1C(=O)c2ccccc2C1=O 938588 QOIOUGKPKXRQKU-UHFFFAOYSA-N 386.429 2.722 0 50 GFAA COC(=O)c1c(NC(=O)c2ccc(OC)cc2)sc(C(=O)N(C)C)c1C 1113694 VBWKKXLVTAFYHT-UHFFFAOYSA-N 376.434 2.806 0 50 GFAA O=C(COc1ccccc1)NCC(=O)Nc1nc(COc2ccccc2)cs1 1153647 WDCGOMYCYSCQHL-UHFFFAOYSA-N 397.456 2.856 0 50 GFAA Nc1nc(CN2CCN(c3ccccn3)CC2)nc(Nc2cccc(Cl)c2)n1 4740312 KWLVIBVRWAIIQA-UHFFFAOYSA-N 396.886 2.568 0 50 GFAA COc1ccc(CCNC(=O)c2ccc3c(c2)nc2n3CCOC2)cc1OC 8611816 FXEBIUSMEBIZHT-UHFFFAOYSA-N 381.432 2.556 0 50 GFAA biogenic O=C(NCCOc1cccnc1)c1cn(Cc2cccc(C(F)(F)F)c2)nn1 12449169 CYWTUPOPQNJRJT-UHFFFAOYSA-N 391.353 2.549 0 50 GFAA CCOC(=O)CC1(S(=O)(=O)c2ccc(F)cc2)CCN(C2CCC2)CC1 12746284 CNSQWEQHHRXWEB-UHFFFAOYSA-N 383.485 2.940 0 50 GFAA Cc1cc(C)n(CC(=O)N2CCC[C@@H](N3CCN(c4ccccc4C)CC3)C2)n1 15075444 LEHSSQFEOLPHGL-OAQYLSRUSA-N 395.551 2.622 0 50 GFAA CCOC(=O)c1n[nH]cc1CN1CCc2[nH]nc(-c3cccc(OC)c3)c2C1 15075754 RCWBGMAMGNJZGS-UHFFFAOYSA-N 381.436 2.543 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1 19771656 BSMGGFOLVQBMBH-UHFFFAOYSA-N 380.897 2.855 0 50 GFAA CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)sc2c1CCCC2 19791875 SDXBQENMOLIGQT-CHWSQXEVSA-N 380.510 2.851 0 50 GFAA COc1cc(CN2CCN(Cc3ccsc3)[C@H](CCO)C2)cc(OC)c1 39388358 ZDYQMPNHRQLTIF-GOSISDBHSA-N 376.522 2.834 0 50 GFAA CCSc1nnc(-c2ccccc2NC(=O)COc2cccnc2)c(O)n1 55120446 JKYDOZVUHQCJDZ-UHFFFAOYSA-N 383.433 2.769 0 50 GFAA Cc1ccc(OCC(=O)N2CCC(n3cc(-c4ccccn4)nn3)CC2)cc1 65435614 LHRBIQQZABDOPZ-UHFFFAOYSA-N 377.448 2.891 0 50 GFAA CS(=O)(=O)c1cnc(COc2ccc(Cl)cc2)nc1[C@@H]1CCCNC1 71440108 UFMKQVOCJAXJDF-GFCCVEGCSA-N 381.885 2.580 0 50 GFAA NC(=O)c1nc(CN2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)no1 71662610 SNBWUIKQLFIUFF-SFHVURJKSA-N 392.459 2.592 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2cc(-c3ccc(O)cc3)n[nH]2)CCC(=O)N1CC1CC1 71738537 AALHOVUMWDHLLX-HXUWFJFHSA-N 396.491 2.891 0 50 GFAA CN(Cc1ccc(Oc2ccccc2)cc1)C(=O)[C@H]1CCCN(CC(N)=O)C1 77288014 TVMMBDVGFPDREJ-SFHVURJKSA-N 381.476 2.635 0 50 GFAA CCCc1cc(C(=O)N2CCC3(CC2)CN([C@H](C)CCC)C(=O)O3)n(C)n1 77538605 CCYISDWATRYBGC-OAHLLOKOSA-N 376.501 2.988 0 50 GFAA CCc1cc(N2CCC[C@]3(CCC(=O)N(CCc4c[nH]cn4)C3)C2)nc(C)n1 91493952 ZPNMXFRRYCSUMG-NRFANRHFSA-N 382.512 2.522 0 50 GFAA COc1cccc(-c2n[nH]cc2C(=O)N2CCC(O)(c3cccnc3)CC2)c1 91586043 UASVZCPWDITKRS-UHFFFAOYSA-N 378.432 2.604 0 50 GFAA O=C(c1[nH]c2ccccc2c1Cl)N1C[C@H](CO)C[C@H](CN2CCCC2)C1 91593847 GPOLVAVOXMEDCK-HUUCEWRRSA-N 375.900 2.988 0 50 GFAA CC(C)N1CCC[C@]2(CCN(C(=O)c3cc(=O)[nH]c4ccc(F)cc34)C2)C1=O 91644157 HBCPNGOHYDZPNF-OAQYLSRUSA-N 385.439 2.530 0 50 GFAA COc1cc(N2CCC3(CCC(=O)N(CCc4ccccc4)C3)CC2)nc(N)n1 95365388 LXDSGXFWRHSNMY-UHFFFAOYSA-N 395.507 2.519 0 50 GFAA COc1ccc([C@@H](C)NC(=O)c2ccc(CN3CCN(C)CC3)o2)cc1F 97087827 LEPJYDQPBDIDLJ-CQSZACIVSA-N 375.444 2.666 0 50 GFAA C[C@H]1CCC(=O)N1c1ccc(NC(=O)NCc2nnc3n2CCCCC3)cc1 97323959 JEBMWSHXMKQVHX-AWEZNQCLSA-N 382.468 2.842 0 50 GFAA COc1cc(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)c(C(N)=O)cc1OC 116158706 VDXAOTHWSBQHPN-INIZCTEOSA-N 397.475 2.653 0 50 GFAA CN1CCCN(C[C@H](O)COCc2ccc3c(c2)OCO3)c2cc(F)ccc21 125550160 QTHIBWKFLCFBNZ-KRWDZBQOSA-N 388.439 2.778 0 50 GFAA CCOc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1 125944627 IWGVSNNVVHOBSF-AZUAARDMSA-N 396.487 2.930 0 50 GFAA O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@@H]1CN(Cc2ccccc2)CCO1 156148514 PXDMCLKDBSLMLG-FQEVSTJZSA-N 390.443 2.689 0 50 GFAA Cc1ccc2nc(COc3cccc(C(=O)N4CC[C@H](C(=O)O)C4)c3)cn2c1 178268361 BRKZRXBKAVEZPY-INIZCTEOSA-N 379.416 2.768 0 50 GFAA O=C(CN1CCO[C@@H](c2ccc(F)cc2F)C1)N1CCc2sccc2C1 187269943 JLSXSDFVXWMGFM-QGZVFWFLSA-N 378.444 2.985 0 50 GFAA CC(=O)N1CCN(Cc2ccccc2NCc2cn3c(C)cccc3n2)CC1 187521135 LMTVVUJBMFZXJK-UHFFFAOYSA-N 377.492 2.919 0 50 GFAA Cc1nn(C(C)(C)C)cc1C(=O)N(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 188134057 XHOGSCOLLJYPHJ-QFIPXVFZSA-N 384.524 2.656 0 50 GFAA Cc1ccn2c(C(=O)N3CC[C@H](c4ccc5ccccc5c4)[C@@H](O)C3)nnc2n1 210376151 MURNEEOAEBIGMB-MOPGFXCFSA-N 387.443 2.577 0 50 GFAA O=C([C@H](O)[C@@H](O)c1nc2ccccc2s1)N1CC[C@H](Cc2ccccc2)C1 245642284 AYUNLJBSWADZGP-ATZDWAIDSA-N 382.485 2.782 0 50 GFAA COc1cc2c(cc1CN1C[C@@H]3OC(=O)N(Cc4ccccn4)[C@@H]3C1)CCC2 247917679 BRWKXOJNXJDWDB-CTNGQTDRSA-N 379.460 2.784 0 50 GFAA CC[C@@H](CC(=O)NCc1ccc(S(=O)(=O)CCO)cc1)c1ccccc1 252503904 VHBQFIVEXSGPMV-KRWDZBQOSA-N 375.490 2.653 0 50 GFAA CN1C(=O)N=C2[C@@H]1[C@H](c1ccc3c(c1)OCO3)CC(=O)N2c1ccc(F)cc1 253471126 MDBDCOKNMZIGQV-KSSFIOAISA-N 381.363 2.907 0 50 GFAA Cc1ccc2nc(O)cc(C(=O)N[C@H](Cc3ccccn3)[C@H]3C[C@@H](O)C3)c2c1 253535492 WOMNAYBAGIAGHL-PTSWNOGYSA-N 377.444 2.756 0 50 GFAA COc1cc(C(=O)N2CC[C@](C)(C(=O)O)C2)ccc1OCc1cscn1 269023324 JIKLFQHAOGCTOO-SFHVURJKSA-N 376.434 2.668 0 50 GFAA Cc1nc(Cn2cc(C(=O)NCC(C)(C)c3cccc(Cl)c3F)nn2)no1 278776183 LJPKVMOIIHCTGZ-UHFFFAOYSA-N 392.822 2.518 0 50 GFAA COc1ccc(CNC(=O)[C@@H](C)N2CCC(c3nccc(C)n3)CC2)cc1OC 363772947 AQRAJCHGHCIXRY-MRXNPFEDSA-N 398.507 2.687 0 50 GFAA CCc1noc([C@@]2(O)CCN(C(=O)Nc3cc(C)c(OC)cc3Cl)C2)n1 377364908 ZIDJOJTYDXTJQB-QGZVFWFLSA-N 380.832 2.728 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)N[C@H](CCN)C(F)(F)F)ccc12 423736138 PEZIHTQUAPGBKI-OAHLLOKOSA-N 377.370 2.738 0 50 GFAA CC[C@@H]1[C@@H](CO)CCN1C(=O)Nc1ccc(Cl)c(F)c1N1CCOCC1 455426955 ZRGBQEWWLGPHTM-IUODEOHRSA-N 385.867 2.940 0 50 GFAA Cc1cc2n(n1)CCN(C(=O)NC[C@@H](C)Cn1nc(C)cc1C(F)(F)F)C2 584896468 ZUHOTVTYIKSQIJ-LLVKDONJSA-N 384.406 2.577 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)c2ccc(N3CCC(C)CC3)nc2)C1 779845722 JALCAPGSFVIKKS-IAGOWNOFSA-N 385.468 2.612 0 50 GFAA COc1cc2c(cc1OC)CN(C(=O)CCCCCn1cccc1)[C@H](C(N)=O)C2 824616743 VYSOVNFYICFFTJ-SFHVURJKSA-N 399.491 2.505 0 50 GFAA biogenic O=C(Nc1ccc2ccn(Cc3ccc(CO)cc3)c2c1)[C@@H]1CCS(=O)(=O)C1 871425563 UBTHDXUTBAAELM-GOSISDBHSA-N 398.484 2.555 0 50 GFAA CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2c(C(F)F)nc3cnccn23)C1 897406809 FKCRUQFISMWHOD-NSHDSACASA-N 380.395 2.861 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@H]21 910239212 FMOPREHMNBKVJJ-XUWVNRHRSA-N 385.382 2.711 0 50 GFAA C[C@H]1C[C@H](NC(=O)N2Cc3cnn(-c4ccccn4)c3CC(C)(C)C2)CCN1C 952890935 NYJFMCZBCSULTB-FUHWJXTLSA-N 396.539 2.844 0 50 GFAA CCCc1ncncc1C(=O)NCC1CCN(C(=O)c2cccc(C)c2O)CC1 952973613 HIQFZPNUQMNUEV-UHFFFAOYSA-N 396.491 2.725 0 50 GFAA CCN(Cc1nc(C(C)C)no1)C(=O)CSc1nc(-c2ccco2)n[nH]1 952982465 PQFXWBHZYXJQJZ-UHFFFAOYSA-N 376.442 2.712 0 50 GFAA CN1CCC[C@H]1C(=O)N1CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 952986686 FPZQXQMGOXRGPZ-AWEZNQCLSA-N 390.837 2.887 0 50 GFAA CN(Cc1sc2ccccc2c1Cl)C(=O)CN1C(=O)NC(C)(C)C1=O 1506398120 LTILTAAMFFWFFC-UHFFFAOYSA-N 379.869 2.844 0 50 GFAA Cc1nc(CCNC(=O)CC(=O)Nc2cccc(Cl)c2C)nc2c1CCC2 1506402384 RBAOAMTXMRJPIE-UHFFFAOYSA-N 386.883 2.923 0 50 GFAA Cc1sc(-c2ccno2)cc1S(=O)(=O)N1CC(N2CCCC[C@H]2C)C1 1506419926 MFCDLNYPHAHGFS-GFCCVEGCSA-N 381.523 2.959 0 50 GFAA CCN=c1ccnc(N2CCC[C@@]3(CCc4c(O)nc(C(C)(C)C)nc43)C2)[nH]1 1857686568 BZNMWOGYMFIOGQ-OAQYLSRUSA-N 382.512 2.608 0 50 GFAA COCCC(=O)N[C@@H]1CCC[C@@H](NC(=O)c2ccc(-n3nc(C)cc3C)cc2)C1 1857690720 QEHNPZDUBJSVTN-RTBURBONSA-N 398.507 2.683 0 50 GFAA CCCn1cc(CNC(=O)[C@@H]2CC(=O)N(c3nc4ccccc4s3)C2)cn1 1857727537 SIWUAXUTGCHQHX-CQSZACIVSA-N 383.477 2.572 0 50 GFAA CCOc1ccc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)cc1 1875250579 NPHAYMOUTXZTAB-VIZSFHNOSA-N 392.455 3.000 0 50 GFAA O=C([C@@H]1CC[C@@](O)(c2ccccc2)C1)N1CCN(c2cc(C3CC3)[nH]n2)CC1 1875271634 KZWIZOLCKRSNMR-VGSWGCGISA-N 380.492 2.624 0 50 GFAA C[C@@H]1C[C@@H](O)CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1 1875312019 GFLHHBILDTWDDO-NEPJUHHUSA-N 383.370 2.830 0 50 GFAA C=CC(=O)N[C@@H]1CN(C(=O)C2(C)Cc3ccccc3C2)CC[C@H]1C(F)(F)F 1875386254 LVYGPKPWQXJXED-HZPDHXFCSA-N 380.410 2.873 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cccn2)C[C@H]1O)c1ccc(Nc2cccnc2)cc1 1875400585 FKGMMICNUWXBKO-CWFSZBLJSA-N 377.448 2.591 0 50 GFAA C[C@@H]1CCCCN1C1CN(C(=O)c2c(OCc3ccccc3)c(=O)ccn2C)C1 1940195350 NNOXXGGUNSVYQN-QGZVFWFLSA-N 395.503 2.663 0 50 GFAA Cn1cc(N2C[C@@H](C(=O)OC3CC(c4cc(F)cc(F)c4)C3)CC2=O)cn1 2325779723 ZULWXERLJMDBED-JZLYGMAVSA-N 375.375 2.541 0 50 GFAA Cc1nsc(NC(=O)N[C@@H](C(N)=O)[C@H](C)c2ccccc2)c1Br 2325804040 RBSHCVPXFCXGTD-PRHODGIISA-N 397.298 2.993 0 50 GFAA N[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccc(-c2n[nH]c3c2COCC3)cc1 2325857997 XDUVYQQJKHOEGH-SFHVURJKSA-N 380.423 2.797 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)COc1ccccc1OC 1160416 BCFZWOWTCCUYET-UHFFFAOYSA-N 375.377 2.517 0 50 GFAA COc1ccccc1OS(=O)(=O)CCS(=O)(=O)c1ccc(Cl)cc1 1786822 GUQQBZHWLOYUST-UHFFFAOYSA-N 390.866 2.531 0 50 GFAA COc1ccc(OC)c(NC(=O)C[C@H](NCCC2=CCCCC2)C(=O)O)c1 2856206 AFTBUXCWKWDELU-KRWDZBQOSA-N 376.453 2.966 0 50 GFAA Cc1cn2c(N)c(Cl)cc(C(=O)NCC3CCN(CC(C)C)CC3)c2n1 3820131 ISKHMDNIWXPUGR-UHFFFAOYSA-N 377.920 2.976 0 50 GFAA in-vivo CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1 6196227 ZYEOBQVSQSZZHP-UHFFFAOYSA-N 389.477 2.974 0 50 GFAA Cc1c(NC(=O)COc2ccc3c(c2)CCC3)c(=O)n(-c2ccccc2)n1C 6553423 SBROOFHJNSZHED-UHFFFAOYSA-N 377.444 2.991 0 50 GFAA COc1ccccc1C(=O)Nc1ccnn1C1CCN(C[C@H]2CCOC2)CC1 12315026 JSWGVUIRIZUAPB-MRXNPFEDSA-N 384.480 2.817 0 50 GFAA Cc1cc(C)n2nc(C(=O)N[C@@H]3CCCN(CCc4ccccc4)C3)cc2n1 12713291 YTVQVDUDKKSDHK-LJQANCHMSA-N 377.492 2.783 0 50 GFAA O=C(CCC1CCN(Cc2ccc3nsnc3c2)CC1)NC[C@@H]1CCCO1 20363406 BVSKVKWBPZOLDV-KRWDZBQOSA-N 388.537 2.979 0 50 GFAA CSc1nc2ncc3c(=O)n(-c4ccc(Br)cc4)ccc3n2n1 30875181 ZHOJEMFPDFVXMA-UHFFFAOYSA-N 388.250 2.913 0 50 GFAA O=C(c1c(F)cccc1Cl)N1CCN(c2cc(N3CCCC3)ncn2)CC1 38528222 JZNBSPMQXLVRJV-UHFFFAOYSA-N 389.862 2.832 0 50 GFAA CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)OCc3ccccc3)C[C@]2(C(=O)O)C1 40443106 DYRQRALIILPPRO-YWZLYKJASA-N 390.436 2.577 0 50 GFAA Cc1sc2ncnc(SCCC(=O)N3CCC(C(N)=O)CC3)c2c1C 47302758 IHTIOJIDSIOXGC-UHFFFAOYSA-N 378.523 2.514 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)Nc2ccc(C(C)=O)cc2)n1 49550747 KUMCOPPDBNHSDR-UHFFFAOYSA-N 395.390 2.899 0 50 GFAA COc1cccc(CCNC(=O)[C@@H]2CCCN2C(=O)C2CCCCC2)c1OC 55384972 QIOQMOIYEGUWDO-SFHVURJKSA-N 388.508 2.934 0 50 GFAA CC(C)c1ncc(C(=O)NCc2cccnc2-n2cnc3ccccc32)c(=O)[nH]1 67459100 QDWNBGVJAXXOKV-UHFFFAOYSA-N 388.431 2.557 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3cc(-n4ccnc4)ncn3)CC2)c1 67622151 WNTKKDKNWSEDGC-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CCN(CC)C(=O)N1CCC2(CCN(Cc3cnc(COC)nc3)CC2)CC1 72156075 BVDFESOWXLOGHF-UHFFFAOYSA-N 389.544 2.763 0 50 GFAA COc1cccc(CN2CC3(CCN(C(=O)c4ncoc4C)CC3)CC2=O)c1 77505540 IOQWQKWBGKYRKZ-UHFFFAOYSA-N 383.448 2.647 0 50 GFAA O=C1N(CCO)CCC[C@@]12CCN(c1nc(-c3ccc(F)cc3)cs1)C2 92022798 CJZBBKXDSGKDEH-IBGZPJMESA-N 375.469 2.760 0 50 GFAA O=C([C@@H](c1cccnc1)N1CCCC1)N1CCN(c2nc3ccccc3o2)CC1 95359738 MSRACEHYPTUPRM-HXUWFJFHSA-N 391.475 2.709 0 50 GFAA Cc1noc(C)c1CN1CC2(CCN(c3cccc([C@@H](C)O)n3)CC2)CC1=O 95366232 VAERZPXHEIVFBN-OAHLLOKOSA-N 384.480 2.759 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)Nc2ccc(-c3nnc(C)o3)cc2)on1 97370499 SXJSEQDLNILSGQ-PBHICJAKSA-N 383.408 2.721 0 50 GFAA COC(=O)[C@@H]1[C@@H]2C(=O)N(C(c3ccccc3)c3ccccc3)C[C@@]23C=C[C@H]1O3 100886086 AJYDXIPSQULZLA-KCESLBEFSA-N 375.424 2.731 0 50 GFAA O=C(O)[C@@H]1CCCN(C(=O)C2(c3ccc(Br)cc3)CCOCC2)C1 109621840 QGNCXYLSNKFWOJ-CYBMUJFWSA-N 396.281 2.821 0 50 GFAA COc1ccc(NC(=O)[C@@H](C)N2CCN(c3ncnc4sccc34)CC2)cc1 127566793 PIEUCDKRVTWWTH-CQSZACIVSA-N 397.504 2.849 0 50 GFAA CC(C)=C[C@@H]1[C@H](C(=O)NS(=O)(=O)c2cccc(-c3nnco3)c2)C1(C)C 159041611 TYZXZUYETJRMTI-HUUCEWRRSA-N 375.450 2.780 0 50 GFAA COCCN1Cc2c(-c3ccccc3)nc(N)n2N(Cc2ccc(C)cc2)C1 169681382 KJYGNTCVLJTKSV-UHFFFAOYSA-N 377.492 2.998 0 50 GFAA CCOc1ccc(-c2cc3c(=O)n(CCNC(=O)c4ccoc4)ccn3n2)cc1 169775882 CLUDVMHZRJEDQA-UHFFFAOYSA-N 392.415 2.585 0 50 GFAA CN1CCCN(Cc2cccc(S(=O)(=O)N(C)C)c2)c2cc(F)ccc21 170637226 MXLWIKPWATZPHR-UHFFFAOYSA-N 377.485 2.923 0 50 GFAA CS[C@@H]1CCC[C@@H]1N(C)C(=O)NCc1ccc(CN2CCN(C)CC2)cc1 170690282 LQRLJCKJYVPJTI-VQTJNVASSA-N 390.597 2.860 0 50 GFAA CCCC[C@@H](C(=O)Nc1cc(C)on1)N1CCN(CC2CCOCC2)CC1 172429074 WXKHYOALFAPQCW-SFHVURJKSA-N 378.517 2.525 0 50 GFAA Cc1nn(C)c(C)c1CCNC(=O)C1CCN(c2ccc(Cl)cn2)CC1 193141485 FWCNMGXZXGEWIK-UHFFFAOYSA-N 375.904 2.661 0 50 GFAA C[C@@H](NC(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1)c1cccc(Cl)c1 194092238 GRVVJDNGGXTCCY-LLVKDONJSA-N 382.873 2.868 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O 215628128 QVMLOLULSZCZER-SFHVURJKSA-N 379.460 2.554 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)NCCc1csc(-c2cccnc2)n1 223785719 AEHQQMIKJZTOHG-UHFFFAOYSA-N 383.477 2.609 0 50 GFAA O=C(c1ccccc1)[C@@H]1[C@@H]2C(=O)N(c3ccccc3F)C(=O)[C@H]2[C@@H]2CCCN21 230080618 WRRUROFEEKQBIT-OKYOBFRVSA-N 378.403 2.661 0 50 GFAA O=C(Cc1c[nH]c2ccccc12)N1CCc2nn(Cc3ccccc3)c(=O)cc2C1 263615027 AEPMFJPDUIHQBU-UHFFFAOYSA-N 398.466 2.900 0 50 GFAA COc1ccc(-c2nn3ccn(Cc4cccc(OC)c4)c(=O)c3c2CO)cc1 263616573 JLVFIDYNBGWQJZ-UHFFFAOYSA-N 391.427 2.721 0 50 GFAA COC(=O)[C@]1(N(Cc2ccccc2)C(=O)c2cc(C(C)(C)C)nn2C)CCOC1 328589862 HHRVOAKLUMBNRX-QFIPXVFZSA-N 399.491 2.692 0 50 GFAA O=C(c1cnn(Cc2ccccc2Cl)c1)N1CCOC[C@@H]1[C@H]1CCCO1 376170665 GOQMBSLSTPUUQE-QZTJIDSGSA-N 375.856 2.605 0 50 GFAA COCCn1cc2c(n1)[C@@H](NC(=O)c1cnn(Cc3ccccc3)c1)CCC2 378546665 QTUIJYUJULWQOX-IBGZPJMESA-N 379.464 2.582 0 50 GFAA O=C(NCc1nc2ccc(F)cc2[nH]1)N1CCCN(Cc2ccncc2)CC1 426563026 NVXTVAYCGXKNAH-UHFFFAOYSA-N 382.443 2.515 0 50 GFAA CNc1ccnc(N2CC[C@]3(CCCN(Cc4cc(OC)ccc4F)C3)C2)n1 426615366 DZVPCEOBYDUUPU-NRFANRHFSA-N 385.487 3.159 0 50 GFAA C[C@H](Cc1ccc2c(c1)OCO2)CN1CCC(CNC(=O)c2ccnnc2)CC1 821459953 QBQZGLMDPONPRL-MRXNPFEDSA-N 396.491 2.526 0 50 GFAA COC[C@H](C)N(Cc1cc(F)ccc1F)C(=O)Cn1c(=O)oc2ccccc21 824338479 XYOMXKUTQUSDFW-ZDUSSCGKSA-N 390.386 2.936 0 50 GFAA O=C(c1ccco1)N1CCC[C@H](NS(=O)(=O)Cc2cccc(Cl)c2)C1 885939130 SZLQWRUIGBFYGJ-HNNXBMFYSA-N 382.869 2.657 0 50 GFAA O=C1N[C@@H](Cc2nc(-c3ccc(N4CCOCC4)cc3)no2)c2ccccc21 896037156 QNXOOEXJSCBQBE-SFHVURJKSA-N 376.416 2.600 0 50 GFAA Cc1nc([C@@H](C)NC(=O)[C@@H](Cc2ccccc2)N2Cc3ccccc3C2=O)n[nH]1 908175524 MGEMSFDQMLYVMC-AUUYWEPGSA-N 389.459 2.558 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC[C@@H](c2nnc3ccccn23)C1 1506409341 GPQVXMCPSLCBHO-OAHLLOKOSA-N 378.480 2.670 0 50 GFAA Cc1sc2ncn([C@H]3CCNC[C@@H]3O)c(=O)c2c1-c1cccc(Cl)c1 1565508145 IUUNCBYABTVODG-KBPBESRZSA-N 375.881 2.982 0 50 GFAA Cc1noc(C)c1CN1CC[C@H](NC(=O)c2cccc3ccccc23)[C@@H](O)C1 1565525766 FZOSBTOPTMLCQV-SFTDATJTSA-N 379.460 2.810 0 50 GFAA Nc1ncc2c(n1)[C@]1(CCCN(CCCOc3ccc(C(=O)O)cc3)C1)CC2 1704315281 ZJVXEBMJEKKEGI-OAQYLSRUSA-N 382.464 2.506 0 50 GFAA O=C(N=c1cc2n([nH]1)CCC2)C1(c2ccc(Br)cc2)CCOCC1 1857530821 FHUYAESSDNJVIV-UHFFFAOYSA-N 390.281 2.701 0 50 GFAA Cc1[nH]nc(C(=O)N2CCC[C@@]3(CCc4c(O)nc(C5CC5)nc43)C2)c1Cl 1857697486 BAEAHDLVEVWVAJ-LJQANCHMSA-N 387.871 2.865 0 50 GFAA O=C(c1cccc(Oc2ccccc2)c1)N1C[C@@H](O)[C@H](Cc2cnccn2)C1 1857714648 FTQPRBLXSWVDIY-DYESRHJHSA-N 375.428 2.945 0 50 GFAA Cc1cccc(-c2nc(N[C@@H]3CCC(=O)NC3=O)cc(N3CCC[C@H](C)C3)n2)c1 1857797712 CWCJUMWWFLNQMZ-DOTOQJQBSA-N 393.491 2.905 0 50 GFAA COc1ccc(Cn2cnc(=NC(=O)N[C@@H]3CC=CC[C@H]3C(F)(F)F)[nH]2)cc1 1875270007 BBWPOIQGRKRVNX-HUUCEWRRSA-N 395.385 2.776 0 50 GFAA C[C@](Cc1ccc(F)cc1)(NC(=O)c1cc(C2CC2)nc2ccnn12)C(=O)O 1875277928 OBMIIZYBIHGSQR-HXUWFJFHSA-N 382.395 2.562 0 50 GFAA CCn1c(-c2cc3c(F)c(F)ccc3[nH]2)nnc1N1CC[C@H]2OC(=O)O[C@@H]2C1 1875279269 KOOJKLODQQJFKW-ZIAGYGMSSA-N 389.362 2.839 0 50 GFAA Cc1ccc(OCCC(=O)N[C@@H]2CNC(=O)CC23CCC3)c(Br)c1 1875345087 RMELAUCBZNDBFT-OAHLLOKOSA-N 395.297 2.701 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N2c3cnn(C)c3CC[C@@H]2C(F)(F)F)cc1 1875382446 BIAWOAVKQDDZRY-MRXNPFEDSA-N 392.381 2.746 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)c1ccc(-n2cccn2)cc1 1875389338 KYDAQPPSCQHQPT-OAQYLSRUSA-N 386.455 2.742 0 50 GFAA Cc1occ(C(F)(F)F)c1CNc1cc(N2C[C@H](O)C[C@@H]2CN(C)C)ncn1 1875401888 VCHFRHJAMVVOSX-CHWSQXEVSA-N 399.417 2.510 0 50 GFAA O=C(c1cccc(OC(F)(F)F)c1)N1CC[C@@H](O)[C@](CC2CC2)(C(=O)O)C1 1940193678 GJQHTDKQKOUILL-RHSMWYFYSA-N 387.354 2.663 0 50 GFAA Cc1nc2cc(CNC(=O)c3ccc4nnc([C@H](O)C(C)C)n4c3)ccc2n1C 2100541293 ZUQKPQLCGHRZLJ-LJQANCHMSA-N 392.463 2.544 0 50 GFAA Cc1sc(-c2nc[nH]n2)nc1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1 2325773071 OLKPEDBWQPYKEW-UHFFFAOYSA-N 397.508 2.631 0 50 GFAA NC[C@@H](CC(=O)N[C@H]1CCCc2n[nH]cc21)c1ccc(Br)s1 2325808292 MXNOCUQDRIIIBR-KOLCDFICSA-N 383.315 2.860 0 50 GFAA C[C@H]1[C@@H](C)[C@H](C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)[C@@H]1C(=O)O 2325815736 MSNJXCPBLOZQLZ-LZJQFABFSA-N 399.413 2.788 0 50 GFAA NC[C@@H]1CCN(S(=O)(=O)c2cnn(-c3ccc(F)cc3)c2)c2ccccc21 2325858259 FVPFBUHOCNENAG-AWEZNQCLSA-N 386.452 2.653 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2cc(Br)c3c(c2)OCCO3)C1 2325888560 FGDVKFNXXLGDNB-NSHDSACASA-N 395.253 2.583 0 50 GFAA CN(C)c1ccc(CN2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)cn1 2356166345 ULJOXSFCKDHEBV-JOCHJYFZSA-N 379.508 2.700 0 50 GFAA COC(=O)c1ccc(-n2nnnc2SCC(=O)Nc2c(C)cccc2C)cc1 778712 AKHFJGBXTOFKQF-UHFFFAOYSA-N 397.460 2.797 0 50 GFAA CNC(=O)CN(Cc1ccccc1Cl)S(=O)(=O)c1ccc(Cl)cc1 1145492 RGRFAWGHPKYZNE-UHFFFAOYSA-N 387.288 2.930 0 50 GFAA CCc1ccc(N(CC(=O)NCCSc2ccccc2)S(C)(=O)=O)cc1 2816999 QBEHGMWPPKJYPE-UHFFFAOYSA-N 392.546 2.924 0 50 GFAA CCN(CC(=O)N1CCc2ccccc2C1)S(=O)(=O)c1ccc(Cl)cc1 2879293 SFRSMWKDVQZNNH-UHFFFAOYSA-N 392.908 2.936 0 50 GFAA COc1cnccc1-c1ccc(C(=O)N2CCC[C@H](CS(C)(=O)=O)C2)cc1 2356158665 ULZLKZSJHRDRSL-HNNXBMFYSA-N 388.489 2.654 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)NC2CC2)CC[C@H]1Nc1ncnc2ccc(C)nc12 2356168948 IUXPBBQCSZNMLM-YXJHDRRASA-N 383.496 2.988 0 50 GFAA CCOC(=O)[C@H]1CCCN(C(=S)Nc2cc(OC)c(OC)c(OC)c2)C1 6700940 OTKAFMXBTFTYSN-LBPRGKRZSA-N 382.482 2.684 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N(C)[C@H]1CCc2ccccc2C1 114417542 YPGVQFUPSKCPIQ-IBGZPJMESA-N 388.471 2.699 0 50 GFAA Cc1cc(C)n(-c2ccc(NCCNC(=O)Nc3ccc(F)cc3F)nn2)n1 67603756 JSGUTTLVYKVLJU-UHFFFAOYSA-N 387.394 2.791 0 50 GFAA O=C1[C@H](NC(=O)N2CCCC[C@H]2CCc2ccccc2)CCN1C1CCOCC1 119078907 CYDGFTGUWLNCSO-PZJWPPBQSA-N 399.535 2.963 0 50 GFAA CC(C)c1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cc(Cl)cc2c1OCC2 328610693 IWBOSSKRWCNFRQ-CYBMUJFWSA-N 396.900 2.803 0 50 GFAA CN(C[C@H](O)COc1ccccc1)C[C@H]1CCc2nc(C(F)(F)F)cn2C1 328634357 MQYOQIMFXCIGFB-CABCVRRESA-N 383.414 2.836 0 50 GFAA O=C(NC1(c2nccs2)CCCC1)[C@H]1CCS(=O)(=O)c2ccccc21 284059556 SZLIBHZQVSWLAE-AWEZNQCLSA-N 376.503 2.990 0 50 GFAA Cn1cc(C[C@@H]2CCN(C(=O)NCCc3ccn(-c4ccc(F)cc4)n3)C2)cn1 363115384 ZDMSBRNBFTXZPJ-INIZCTEOSA-N 396.470 2.562 0 50 GFAA Cc1cccc(N2C[C@H](Nc3nccc(-c4cc(C(=O)O)ccn4)n3)CC2=O)c1 72412154 JTVJJUCOFXULAM-OAHLLOKOSA-N 389.415 2.763 0 50 GFAA COc1ccc(C2(C(=O)N[C@@H]3CC(=O)N(Cc4ccc(F)cc4)C3)CC2)cc1 72149083 XEFDTSPMJSUBEB-GOSISDBHSA-N 382.435 2.783 0 50 GFAA O=C1CCCN1C[C@@H]1CCCCN1C(=O)C1CCN(C(=O)c2ccccc2)CC1 363565891 JEERZVOYVGUJFZ-FQEVSTJZSA-N 397.519 2.542 0 50 GFAA Cc1nc2cc(CCC(=O)NCC3(CC(=O)O)CCCCC3)ccc2n(C)c1=O 218294926 HNQBOGKXOSLHAZ-UHFFFAOYSA-N 399.491 2.716 0 50 GFAA O=C(O)CN(C(=O)c1cc2c(F)cc(Br)cc2[nH]1)C1CCOCC1 238112303 BZEYVLNDSPGGPT-UHFFFAOYSA-N 399.216 2.775 0 50 GFAA C[C@H]1CN(Cc2cccc(CNC(=O)N3CCC(c4ccn[nH]4)CC3)c2)CCO1 157706578 DCDAGZANNVOEPL-KRWDZBQOSA-N 397.523 2.720 0 50 GFAA Cc1nnc(-c2cccc(NC(=O)c3cccc(N4C(=O)CCC4=O)c3)c2)n1C 378218734 SASGLJUAVMLLCW-UHFFFAOYSA-N 389.415 2.696 0 50 GFAA CC(C)(C)c1cc(NC(=O)CN2CCC[C@@H](CC(N)=O)C2)n(-c2ccccc2)n1 175254772 AHYRUAWSBHCPQC-INIZCTEOSA-N 397.523 2.696 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@](O)(C(F)(F)F)C2)CC1 175925169 SENWYYZQSAVFAZ-SFHVURJKSA-N 385.430 2.668 0 50 GFAA COC(=O)N1CC(NC(=O)c2cc(-c3cc(C)oc3C)nc3onc(C)c23)C1 178741236 AQGHNXPMUWGFQQ-UHFFFAOYSA-N 384.392 2.588 0 50 GFAA O=C(c1cc2c(nc1O)CCCC2)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 426505939 WBPDQULUAUIADD-JOCHJYFZSA-N 383.492 2.531 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N3CCC[C@@H]3CO)csc2C1 426360022 XHUNJSGVAHDMPH-CQSZACIVSA-N 375.494 2.508 0 50 GFAA CC1=CC(C)(C)N(C(=O)CSc2nncn2C)c2cc3c(cc21)OCCO3 334160738 LFXYHHTZLJSLHY-UHFFFAOYSA-N 386.477 2.907 0 50 GFAA CCN(CC)C(=O)c1ccc(NC(=O)N[C@@H](COC)c2ccnn2C)c(C)c1 97547520 IJKKGQWCVPPQFS-KRWDZBQOSA-N 387.484 2.720 0 50 GFAA O=C(c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)cc1)N1CCCCC1 239439153 ZMTXTZVBIWXYBD-GFLQDLJJSA-N 376.456 2.870 0 50 GFAA O=C1OCc2cc(NC(=O)N3CCC4(CC3)c3ccccc3C[C@@H]4O)ccc21 96133724 BTQSTOJBMJQRKR-IBGZPJMESA-N 378.428 2.840 0 50 GFAA CN1CCN(C[C@H](O)COc2ccc(CN3CCCCCCCC3)cc2)CC1 95522266 XNPXHHCQFBKMQG-QFIPXVFZSA-N 389.584 2.830 0 50 GFAA COCCn1cncc1CN1CCC[C@H](CNC(=O)c2ccccc2Cl)C1 95519041 YXXICICOSANOHV-MRXNPFEDSA-N 390.915 2.825 0 50 GFAA O=C(CN1CCCCCC1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95367970 MALHESIXGOMSAH-MDNUFGMLSA-N 383.536 2.657 0 50 GFAA Cc1ccc([C@@H](CNC(=O)Cc2ccc3c(c2)NC(=O)C3)N2CCCC2)cc1 182324756 SFUVPXXPHAKRPL-OAQYLSRUSA-N 377.488 2.985 0 50 GFAA O=C(N[C@H]1CCCc2c1[nH]c1ccccc21)C1CCN(c2ccc(=O)[nH]n2)CC1 253413533 VAKWSYBHVDKZFX-SFHVURJKSA-N 391.475 2.661 0 50 GFAA O=C(NCc1ccncc1)c1ccc2c(c1)CN(Cc1ccccc1)C(=O)CO2 263619442 YQZVOMPQOZVJSN-UHFFFAOYSA-N 387.439 2.933 0 50 GFAA Cc1ccnc(C[C@H](C)N(C)C(=O)NC2CCN(C(=O)N3CCCC3)CC2)c1 584888598 XUSBKXUNWVESSF-KRWDZBQOSA-N 387.528 2.643 0 50 GFAA COCCCOCC(=O)N1CCC(c2nccc(-c3ccc(OC)cc3)n2)CC1 952893818 WTKSWZYAAVRBMP-UHFFFAOYSA-N 399.491 2.911 0 50 GFAA COc1ccccc1N1CCCN(C(=O)c2n[nH]c3c2C[C@H](C)O[C@@H]3C)CC1 1875396538 LMRTVSFRZTZPEJ-LSDHHAIUSA-N 384.480 2.793 0 50 GFAA CN(C)C(=O)c1ncoc1[C@@H]1[C@H]2C[C@H]1N(C(=O)c1ccc(F)c3ccncc13)C2 1875394656 QTLXSBHUELWNQB-YMRXKLBXSA-N 394.406 2.692 0 50 GFAA O=C(N=c1ccn(Cc2ccc(F)cc2)[nH]1)c1cccc(N=c2cncc[nH]2)c1 1875309919 UXDGVIYERITKAI-UHFFFAOYSA-N 388.406 2.700 0 50 GFAA O=C(NCCc1ccccc1Cl)N1CC[C@@H](C2CC2)[C@@H]1c1nc(O)n[nH]1 1875401771 RJGGXYWMHMKFAA-DZGCQCFKSA-N 375.860 2.889 0 50 GFAA Cc1cc(F)ccc1CN1CCC2(CC1)Cn1nc(C(=O)N(C)C)cc1CO2 1775961844 DOUOCJGGPKUBRK-UHFFFAOYSA-N 386.471 2.597 0 50 GFAA Cn1cc([C@H]2OCCC[C@@H]2NS(=O)(=O)/C=C/c2ccccc2Cl)cn1 275367169 WRJLHXJBUCDRAH-PFSJMHODSA-N 381.885 2.884 0 50 GFAA Cc1c(CNC(=O)N2CCO[C@@H](c3ccnc(N(C)C)n3)C2)oc2ccccc12 275711555 VDCBVUAJCHSJGL-LJQANCHMSA-N 395.463 2.880 0 50 GFAA O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)N[C@@H]1CCCC[C@@H]1CO 170590992 GBYQFLLILXWCIC-TZMCWYRMSA-N 380.901 2.555 0 50 GFAA C[C@@H]1CCc2c(sc3nc(CCC(=O)NO[C@@H]4CCCCO4)[nH]c(=O)c23)C1 170608049 YADUMATZJGCGGN-BDJLRTHQSA-N 391.493 2.616 0 50 GFAA NC(=O)c1ccc(NC(=O)NCC2CCN(Cc3ccccc3)CC2)cc1F 171893598 VHJKGOCJXBCQIQ-UHFFFAOYSA-N 384.455 2.958 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)NC1CCN(Cc2cccnc2)CC1 172243656 NQWSPWSGHAUWRR-UHFFFAOYSA-N 375.476 2.591 0 50 GFAA CN(C(=O)c1cc(O)nc2ccccc12)[C@H]1CCN(Cc2ccccc2)C1=O 189772426 RDZZFVABOYYFTO-IBGZPJMESA-N 375.428 2.814 0 50 GFAA C[C@@H]1CCN(C(=O)NCc2csc(-c3ccccc3)n2)CCS1(=O)=O 190432061 UZTINLWYFXZCFQ-CYBMUJFWSA-N 379.507 2.529 0 50 GFAA CC(=O)N1CCC(C(=O)N2CCCN(CCCCc3ccccc3)CC2)CC1 1772711893 HODCNYJHXFYBDQ-UHFFFAOYSA-N 385.552 2.802 0 50 GFAA CCOc1ccccc1S(=O)(=O)N1CCC(Cc2ccc(O)nc2)CC1 1772819689 ZMJMDTJNMXATGM-UHFFFAOYSA-N 376.478 2.829 0 50 GFAA O=C(NC[C@H]1COCCO1)c1csc2nc(-c3ccccc3Cl)cn12 11664814 GENLQDSGXYIIPM-NSHDSACASA-N 377.853 2.861 0 50 GFAA Cc1ncc(CN2CCC[C@H](C(=O)Nc3cccc(-n4cccn4)c3)C2)n1C 12301374 PARGLWGCCKKSMH-KRWDZBQOSA-N 378.480 2.765 0 50 GFAA O=C(CSc1ccncc1)N[C@H]1CC(=O)N(Cc2ccccc2Cl)C1 12307736 CCLISLAVMOMHKL-AWEZNQCLSA-N 375.881 2.744 0 50 GFAA Cc1cc(C)nc(CCNC(=O)[C@@H]2CCC(=O)N(CCCc3ccccc3)C2)n1 12573017 ZXBJAISPWDOJPJ-HXUWFJFHSA-N 394.519 2.624 0 50 GFAA O=C(N[C@H]1CCCCNC1=O)c1cc(COc2ccc3c(c2)CCCC3)on1 12835130 GQKUMTSCIDPWDF-SFHVURJKSA-N 383.448 2.531 0 50 GFAA Cc1noc(C)c1CO[C@H]1CN(Cc2cccnc2)CC(=O)N(CC(C)C)C1 14747712 UTGZPNTVRMYWSL-IBGZPJMESA-N 386.496 2.572 0 50 GFAA CC1(C)C(=O)NCCN1C(=O)c1ccc2nc(Cc3ccccc3F)oc2c1 14952356 KESDQBVBPCCISF-UHFFFAOYSA-N 381.407 2.908 0 50 GFAA Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC2(CCC(=O)N2C)CC1 14978639 BWIGNJBHSGFGOT-UHFFFAOYSA-N 380.492 2.645 0 50 GFAA COc1c(F)ccc(C(=O)N[C@H]2C[C@H]3CO[C@@H](c4ccccc4)CN3C2)c1F 1857707608 FZRMQEWYUBGYFI-RLFYNMQTSA-N 388.414 2.918 0 50 GFAA CN(C)CC(=O)N1CCC(C2CCN(CC[C@@H](O)c3ccccc3)CC2)CC1 1857712032 DQQXDDNSPJIWQC-JOCHJYFZSA-N 387.568 2.622 0 50 GFAA CC(C)S(=O)(=O)N1C[C@@H]2[C@H](C1)[C@@H]1CC[C@H]2N1[C@@H](C)CCc1ccc(O)cc1 1857731582 KNRWTRLBGPCVDO-FARZLIQASA-N 392.565 2.846 0 50 GFAA CCC(=O)Nc1cc(CNC(=O)c2csc(SC)n2)cc(C(=O)OC)c1 14994005 SXALMYUINJSAQD-UHFFFAOYSA-N 393.490 2.930 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)CN(CCc2ccccc2)C(C)=O)o1 152810609 DSMMJFRZFSFYLT-FQEVSTJZSA-N 384.476 2.833 0 50 GFAA NC(=O)COc1cccc(N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)c1 264965520 PHENOLWWBXVTRL-MRXNPFEDSA-N 393.365 2.787 0 50 GFAA O=S1(=O)Cc2ccc(F)cc2N1Cc1ccc(CN2CCOCC2)cc1 902641481 KMHZRRSOTQPTDC-UHFFFAOYSA-N 376.453 2.508 0 50 GFAA COC(=O)c1cc(NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)nn1C 2325818993 LMRQXHFMXIJRSS-UHFFFAOYSA-N 395.384 2.619 0 50 GFAA CC(C)(O)c1cccc(CNC(=O)c2ccc3c(-c4nn[nH]n4)c[nH]c3c2)c1 2325869525 RRCYBZUJDVMXFE-UHFFFAOYSA-N 376.420 2.505 0 50 GFAA CC(C)C(=O)N1CC2(C[C@H](NC(=O)Cc3ccccc3Cl)c3nccn32)C1 2332237715 ISOAXWNUKQSBKG-INIZCTEOSA-N 386.883 2.534 0 50 GFAA CNCc1cn(C[C@@H]2CCCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)nn1 23581624 GTQWTELXESCALQ-MRXNPFEDSA-N 380.496 2.648 0 50 GFAA CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N2CCCC2)cc1 785717 TWGOLQIDHGWWNS-UHFFFAOYSA-N 387.461 2.682 0 50 GFAA CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccc(OC)cc1 917657 AGMOVMVLXKYHBL-HXUWFJFHSA-N 388.489 2.945 0 50 GFAA COc1ccc(OC[C@H](O)CNC(=O)c2ccc(Br)cc2)cc1 1126909 YFFPOPZKNCSQAI-CQSZACIVSA-N 380.238 2.627 0 50 GFAA COc1ccc(C(=O)NCC(=O)OCc2ccc(Br)cc2)cc1 1140636 GDVHFJQUXZKCPV-UHFFFAOYSA-N 378.222 2.931 0 50 GFAA COc1ccc(C(=O)N/C(=C\c2ccccc2)C(=O)NCCCN(C)C)cc1 2967220 BUQNAGUPWNCAHE-SILNSSARSA-N 381.476 2.534 0 50 GFAA C[C@H](Sc1nnc(COc2ccccc2)n1C)C(=O)Nc1nccs1 4519802 AINDBBWTTBCDGJ-NSHDSACASA-N 375.479 2.970 0 50 GFAA CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987181 KGFLYLCKHGUYDY-ZBFHGGJFSA-N 376.363 2.567 0 50 GFAA CC[C@@H](C(=O)N1N=C(C(F)F)C[C@]1(O)C(F)F)n1nc(C)c(Cl)c1C 6554837 JHZHZDBHJPVTFV-XPTSAGLGSA-N 384.761 2.912 0 50 GFAA Cc1nnc(SCC(=O)Nc2ccccc2I)o1 8375327 SKUFKUFSGFMOPL-UHFFFAOYSA-N 375.191 2.713 0 50 GFAA CCOC(=O)c1cc(C2CC2)nc2c1c(=O)n(Cc1ccccc1C)c(=O)n2C 12410802 FHWZSHSTILDCIY-UHFFFAOYSA-N 393.443 2.506 0 50 GFAA COc1ccc(CC(=O)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)cc1 13688825 YJRUVHUAGJEQLF-UHFFFAOYSA-N 377.444 2.704 0 50 GFAA CN(C)CC(C)(C)CNC(=O)c1cc(-c2ccc(F)cc2)cc(-n2cnnn2)c1 14998022 VUKROIJTHGQFIS-UHFFFAOYSA-N 396.470 2.786 0 50 GFAA CC1CCN(C2=NC(=O)[C@@H](CC(=O)Nc3ccc(Cl)c(Cl)c3)N2)CC1 20028174 GURLTKHUOOYGQR-CQSZACIVSA-N 383.279 2.908 0 50 GFAA COc1ccc(OC)c(CN2CCN(Cc3ccccc3F)[C@H](CCO)C2)c1 22909927 YUORKXZTVCVYTI-LJQANCHMSA-N 388.483 2.912 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN2CCN(c3ccccc3F)CC2)cc1C 55565628 ZGYJUFXPNCBTHV-UHFFFAOYSA-N 384.455 2.853 0 50 GFAA C[C@@H](C(=O)O)n1nc(Br)c(Br)c1Br 59949821 RXLYXRLZUBANRU-REOHCLBHSA-N 376.830 2.816 0 50 GFAA Cc1ccc(-c2nc(CNC(=O)N3CCN(C)CC3)[nH]c2-c2ccccn2)cc1 67896039 YLVVCNOEJBCUKU-UHFFFAOYSA-N 390.491 2.904 0 50 GFAA Cc1nccn1CCN(C)C[C@@]1(O)CCCN(Cc2ccc(C(C)C)cc2)C1=O 67974250 MJQAXTBINLLQKB-QHCPKHFHSA-N 398.551 2.800 0 50 GFAA O=C1CC[C@]2(CCCN(C(=O)Nc3ccccc3)C2)CN1CCc1c[nH]cn1 91270174 PMBLCZSFCMARMA-OAQYLSRUSA-N 381.480 2.889 0 50 GFAA Cc1noc(C)c1CN1C[C@@H]2CC[C@H](C1)N(C(=O)c1cn3ccsc3n1)C2 95353665 AZQRZQULMDLFNZ-LSDHHAIUSA-N 385.493 2.737 0 50 GFAA O=C(c1cnccn1)N1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C1CC1)C2 95378219 YROGQABTBKAWHJ-IBGZPJMESA-N 390.487 2.878 0 50 GFAA CCOc1ccc(NC(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1C(F)(F)F 95530768 PJQFWDXGKDHJHP-JTQLQIEISA-N 380.388 2.660 0 50 GFAA CCOC(=O)N1CCN(C(=O)Nc2ccc(OCc3ccccn3)cc2)CC1 96180315 SOTVFAPRWRSOIM-UHFFFAOYSA-N 384.436 2.967 0 50 GFAA C[C@@H](CN1CCc2ccccc2C1)NC(=O)c1cc(=O)[nH]c2cc(F)ccc12 97696114 LJPCKFHWQDYHOH-AWEZNQCLSA-N 379.435 2.844 0 50 GFAA CSCCC(=O)N1CCC2(CCN(Cc3ccccc3)CC2)[C@H](CO)C1 97717069 NOCBDPOGYIRJSZ-IBGZPJMESA-N 376.566 2.863 0 50 GFAA Cc1cnn(Cc2ccccc2Cl)c1NC(=O)NCc1nnc2n1CCC2 97758020 UDKTZQUYYZKXDW-UHFFFAOYSA-N 385.859 2.753 0 50 GFAA COc1ccc(CN2CCN(c3ncnc4[nH]ccc34)C[C@H]2CCO)c(C)c1C 106962100 PMBDOTLUMQPOBU-GOSISDBHSA-N 395.507 2.657 0 50 GFAA O=C(CN1CCC[C@H]1C(=O)Nc1nccs1)NC1(c2ccccc2)CCC1 114195170 INAIBXSGWLGICJ-INIZCTEOSA-N 384.505 2.742 0 50 GFAA Cc1oncc1CN1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1 128427169 ZKIKSQIIDJXQDI-UHFFFAOYSA-N 375.903 2.595 0 50 GFAA COc1cccc(-c2nc(C(=O)N3CCCC[C@H]3CN3CCOCC3)c(C)[nH]2)c1 133277064 KXKAVHGQPDVJAW-SFHVURJKSA-N 398.507 2.721 0 50 GFAA O=C(NCc1ccnc(-n2ccnc2)c1)c1cccc(OCC(F)(F)F)n1 152031668 VULZGZBCQAUYBB-UHFFFAOYSA-N 377.326 2.533 0 50 GFAA Cc1nc(N2CCN(C(=O)[C@H](C)Oc3ccccc3)CC2)cc(C(F)(F)F)n1 169772312 BBQDRDOKHBRRJC-ZDUSSCGKSA-N 394.397 2.920 0 50 GFAA C[C@@H](Oc1cccnc1)C(=O)Nc1ccc(Cl)c(-n2nnnc2C2CC2)c1 175323885 RKANCRNMWSTUJA-LLVKDONJSA-N 384.827 2.994 0 50 GFAA O=C(Nc1ccc2c(c1)nc1n2CCCCC1)c1cn(C2CCNCC2)nn1 178657685 SVSHXTQBSPFLGJ-UHFFFAOYSA-N 379.468 2.531 0 50 GFAA CN(C(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1)C1CC1 183539894 NZNFSYABPQAOTR-HSZRJFAPSA-N 389.455 2.787 0 50 GFAA CCC[C@]1(C)C(=O)NCCN1CC(=O)Nc1c(C)nn(-c2ccc(C)cc2)c1C 187331405 VRPZZXRSUKRUGH-JOCHJYFZSA-N 397.523 2.727 0 50 GFAA CC1CCC(N2C[C@H](C(=O)N3Cc4cnnn4Cc4ccccc43)CC2=O)CC1 189002003 HYJTXMCIZAQYDU-IIIMJFFVSA-N 393.491 2.600 0 50 GFAA O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N1CCOC[C@@]12CCOC2 194412749 GYLOVFLUVJAOEA-IBGZPJMESA-N 391.855 2.731 0 50 GFAA O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H]1OCCc2ccccc21 237937626 SRZVEVGRLPUBAK-RBUKOAKNSA-N 382.391 2.733 0 50 GFAA CC(C)[C@@H](CNC(=O)Nc1ccc(F)cc1CS(C)(=O)=O)c1ccnn1C 252496436 PICQXLFZYNEEHG-OAHLLOKOSA-N 396.488 2.665 0 50 GFAA O=C(c1cccc(Cn2ccnc2)c1)N1CCC(c2nncn2C2CC2)CC1 264721766 GPGNWQABBIAUNL-UHFFFAOYSA-N 376.464 2.878 0 50 GFAA O=C(c1cnc2n(c1=O)CCS2)N1CCc2cc(Cl)cc(Cl)c2C1 267743749 OKXHAQMZHPCNGE-UHFFFAOYSA-N 382.272 2.854 0 50 GFAA CN1C[C@@]2(CCN(C(=O)Nc3ccccc3OCc3ccccn3)C2)OC1=O 299767667 IPARPLCQYYICRF-HXUWFJFHSA-N 382.420 2.719 0 50 GFAA CCc1cccc(CN2CCC[C@H](n3ncc(N4CCC(O)CC4)cc3=O)C2)c1 328607321 VMUVKBAYMQRDSP-FQEVSTJZSA-N 396.535 2.604 0 50 GFAA Cc1c([C@H]2[C@H](CNCc3cc(F)cc4cccnc34)CC(=O)N2C)cnn1C 328622804 IQUQSMJPGCBFBM-HRAATJIYSA-N 381.455 2.725 0 50 GFAA CC(C)(C(=O)N1CCC(Cc2nc3ccccc3[nH]2)CC1)S(=O)(=O)C1CC1 329467594 WIRJOXHFHOWUHZ-UHFFFAOYSA-N 389.521 2.700 0 50 GFAA O=C(Nc1ccc(OC(F)F)c(F)c1)N1CCC[C@]2(CCS(=O)(=O)C2)C1 333795927 FGXWVFYGDVNJMF-INIZCTEOSA-N 392.399 2.860 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 363233678 MKJRSHNMQVIHIX-OXJNMPFZSA-N 386.471 2.996 0 50 GFAA Cn1nccc1[C@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1 366975241 JYZOJDDMKMAUMP-LBPRGKRZSA-N 383.374 2.556 0 50 GFAA Cc1c(C(=O)N[C@@H](C)CN2CCc3ccccc3C2)cnn1-c1ccccn1 670458650 GGJBCRIDDJAPBC-INIZCTEOSA-N 375.476 2.752 0 50 GFAA Cc1noc(-c2ccc(N3CCN([C@@H](CO)c4ccc(Cl)cc4)CC3)nc2)n1 742407725 WTTCQRXTSNDHOR-SFHVURJKSA-N 399.882 2.949 0 50 GFAA CCOc1ccc(N2C[C@H](C(=O)Nc3cnc4c(c3)COCC4)CC2=O)cc1 777035248 BMPLDNALJIQUIF-CQSZACIVSA-N 381.432 2.545 0 50 GFAA CCN1CCN(CCOc2ccc(CN3Cc4ccccc4[C@H](O)C3)cc2)CC1 823116386 OOYGXPUEAYIIQJ-XMMPIXPASA-N 395.547 2.752 0 50 GFAA COCCn1cnnc1[C@@H](C)NC(=O)c1cccc(N2Cc3ccccc3C2)c1 824466050 DJCAIYIWIQOESO-MRXNPFEDSA-N 391.475 2.936 0 50 GFAA COCCn1ccnc1CN1CCC[C@H](CNC(=O)c2ccc(C)s2)C1 824466133 MCUSKTWOSQRDSI-MRXNPFEDSA-N 376.526 2.541 0 50 GFAA CC(=O)N[C@@]1(c2noc(C)n2)CCN(c2ccnc3ccc(OC(C)C)cc23)C1 827958029 QBODOIBZJRQRJM-NRFANRHFSA-N 395.463 2.955 0 50 GFAA C[C@H]1CN(c2ccc(C(=O)Nc3ccc([C@H](C)CC(N)=O)cc3)cn2)C[C@@H](C)O1 888928584 WPQLPQHVXBVUPC-OAGGEKHMSA-N 396.491 2.926 0 50 GFAA O=C(c1ccco1)N1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2)CC1 952970869 MAONOXIHCZIYGG-UHFFFAOYSA-N 382.869 2.611 0 50 GFAA Nc1nc(N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)cc2nncn12 1529152843 ZKOJGGGFICRJRQ-NRFANRHFSA-N 377.496 2.589 0 50 GFAA CCCc1nc(C(=O)N[C@H]2COCC[C@@H]2Oc2ccc(CO)cc2)cs1 1565511746 JWEGERHBTJSVLI-RDJZCZTQSA-N 376.478 2.554 0 50 GFAA O=C(c1cncc(NC2CCN(CCc3ccccc3)CC2)n1)N1CCCC1 1704331107 OINXGICXEYAZJZ-UHFFFAOYSA-N 379.508 2.832 0 50 GFAA COc1ccc(-c2n[nH]cc2CN2CCC[C@@]3(CCc4cnc(N)nc43)C2)cc1 1704340901 XOKOJYFTRNLZMV-JOCHJYFZSA-N 390.491 2.938 0 50 GFAA COCC(=O)N1C[C@@H]2CN(Cc3scnc3C)C[C@]2(CCc2ccccc2)C1 1772811174 QSVBPKSYJANCLK-SIKLNZKXSA-N 399.560 2.991 0 50 GFAA O=C1CO[C@H](COc2ccc(F)cc2)CN1C1CCN(c2nccs2)CC1 1857672412 BOVNAXQNIDGXON-KRWDZBQOSA-N 391.468 2.557 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CC[C@H](Nc3ncc(Cl)cn3)[C@@H](O)C2)s1 1857687556 YMFUIYCQBGHQMH-CQDKDKBSSA-N 380.901 2.758 0 50 GFAA CCN1CCN(CCOc2ccc(-c3nccn3-c3cn(C)nc3C)cc2)CC1 1857705876 ZEFZIPCVXQYCIH-UHFFFAOYSA-N 394.523 2.598 0 50 GFAA CCCO[C@H]1C[C@@H](C(=O)N2CCCOc3c(cccc3OC)C2)CC[C@@H]1N 1857727230 NCQOHNZOCOUSMN-IEZWGBDMSA-N 376.497 2.729 0 50 GFAA Cc1cncc(CC(=O)N[C@@H]2CCN(C(=O)C3(c4ccccc4F)CC3)C2)c1 1875309435 RXFLYHXBWVIXSG-QGZVFWFLSA-N 381.451 2.521 0 50 GFAA Cn1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3cc(C(F)F)ccc3F)CC1)O2 1875394830 YFMYNVRPQAAJDV-CQSZACIVSA-N 395.381 2.988 0 50 GFAA CC1(C(=O)N2CCN([C@H](COc3ccccc3)c3ccccc3)CC2)COC1 2100555640 ZTOXRJYXNMCEHU-OAQYLSRUSA-N 380.488 2.987 0 50 GFAA CN1C(=O)N(c2cnn(C3COC3)c2)C(=O)[C@@H]1c1cccc(Cl)c1Cl 2325791991 QWWNBLCJBVJATJ-AWEZNQCLSA-N 381.219 2.901 0 50 GFAA Cc1c(C(=O)NCC23CC(CN2C(=O)CSC(C)C)C3)ccc2cncn12 2325794499 DPUYPIROSXOEEA-UHFFFAOYSA-N 386.521 2.505 0 50 GFAA CCc1nocc1C(=O)N1CC[C@@H]([C@H](C)Nc2ncc(Br)cn2)C1 2325841288 MWTUZBHRWCZVPU-WDEREUQCSA-N 394.273 2.752 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NCc2ccccc2C)C[C@H]1NC(=O)NCC 2356137489 MTLNFMWDGGCESC-QXAKKESOSA-N 375.513 2.894 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N3CCC[C@]4(CC3)CNC(=O)O4)cc2)c1C 2356157597 MNIGJLRGZAHAMR-NRFANRHFSA-N 380.448 2.865 0 50 GFAA O=c1c2cc3c(=O)n(C4CCCCC4)c(=O)c3cc2c(=O)n1C1CCCCC1 1469188 CPZQCVWFPKLADR-UHFFFAOYSA-N 380.444 2.923 0 50 GFAA CCNC(=O)C[C@@H]1C(=O)N(c2ccccc2)C(=O)N1Cc1ccc(OC)cc1 4195490 PMPXTBODZUFCFV-GOSISDBHSA-N 381.432 2.559 0 50 GFAA CCn1ccnc1CN(C)C(=O)C1(N2C[C@H](C)O[C@H](C)C2)Cc2ccccc2C1 11664624 OANVFGVWYBPWHL-HDICACEKSA-N 396.535 2.508 0 50 GFAA CC(C)[C@H](O)C1CCN(C(=O)c2cn(Cc3ccccc3Cl)nn2)CC1 11818210 GYBYYWBDYNVUNM-SFHVURJKSA-N 376.888 2.849 0 50 GFAA CCCN(Cc1cnc(S(=O)(=O)CC2CC2)n1C[C@@H]1CCCO1)CC1CC1 11819900 GTMIGVBUHQWFLI-IBGZPJMESA-N 395.569 2.868 0 50 GFAA O=C(N[C@H]1CCCc2ccccc21)c1ccc(CN2CCSCC2)[nH]c1=O 11964230 BTADRUFHGHBEHR-IBGZPJMESA-N 383.517 2.731 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H](NC(=O)COc2ccccc2)C1 12209595 NTAUDYJBYUJWBJ-GOSISDBHSA-N 396.491 2.522 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc(Br)o1 12404464 NEEZJROUMFWOMU-UHFFFAOYSA-N 379.210 2.767 0 50 GFAA Cc1nnc(SCC(=O)N(C)[C@@H]2CCCN(Cc3ccccc3F)C2)o1 12439627 WKIPBUZTWPDLAO-OAHLLOKOSA-N 378.473 2.732 0 50 GFAA CCCc1cn(C[C@@H]2CCCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)nn1 19837874 MUXCNRBYXOTRDU-OAHLLOKOSA-N 379.464 2.625 0 50 GFAA CC(C)S(=O)(=O)c1ncc(CN(C)[C@H]2CCOC2)n1CCc1ccccc1 20449483 NCZXIRHUUATMPA-SFHVURJKSA-N 391.537 2.529 0 50 GFAA Cc1cccn2c(CNCCc3cccc(F)c3)c(C(=O)N3CCOCC3)nc12 20452084 CYTBLRWTMBBJJM-UHFFFAOYSA-N 396.466 2.587 0 50 GFAA CC(C)n1cc(CN[C@H]2CC(C)(C)Cc3nc(N4CCOCC4)ncc32)cn1 55060457 RGHWFGXLJCUAEN-SFHVURJKSA-N 384.528 2.894 0 50 GFAA CNC1CCN(C(=O)C[C@]2(Cc3ccccc3)C(=O)N(C)c3ccccc32)CC1 71751208 YNSXSLIQPUHYEG-DEOSSOPVSA-N 391.515 2.744 0 50 GFAA O=C(c1ccc(Cn2cccn2)o1)N1CCC2(CC1)c1ccccc1C[C@@H]2O 72141814 WPGGUNDDOSGKQF-FQEVSTJZSA-N 377.444 2.615 0 50 GFAA CN(C)Cc1nnc([C@H]2CCCN(c3ccc(-c4ccccc4)nn3)C2)n1C 72435948 YKTWKRFFPYVPRN-KRWDZBQOSA-N 377.496 2.718 0 50 GFAA Cc1nc(C)n(C[C@H](C)C(=O)N2CCCN(CCCc3ccccc3)CC2)n1 77426234 COABUHVPEWTYQL-SFHVURJKSA-N 383.540 2.698 0 50 GFAA COc1cccc(-c2cccc(C(=O)N3C[C@H](CO)C[C@H](CN(C)C)C3)c2)c1 91452580 FWLYGHLHRIRTPP-QZTJIDSGSA-N 382.504 2.994 0 50 GFAA CC(C)(C)c1cc(CNC(=O)[C@@H]2CCC(=O)N(Cc3cccc(F)c3)C2)[nH]n1 91625607 TUEQITHXFZMXTM-OAHLLOKOSA-N 386.471 2.901 0 50 GFAA COc1ccccc1CN(C)C(=O)[C@@H]1CCC(=O)N(CCc2ccccn2)C1 91858991 ZBXOXCUYKCYZKK-GOSISDBHSA-N 381.476 2.530 0 50 GFAA O=C(N1C[C@H](CO)[C@H](CN2CCCC2)C1)C1(c2ccc(Cl)cc2)CCC1 92001896 ZODQNVUEOKUBNP-IAGOWNOFSA-N 376.928 2.924 0 50 GFAA Cn1cccc1C(=O)N1CCC[C@H](C(=O)Nc2ccc(-c3ccn[nH]3)cc2)C1 95509923 XHGGWZVBCSRIDA-INIZCTEOSA-N 377.448 2.906 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(Cc1cccc(N3CCOCC3)c1)CC2 95511799 QFYVDXUYYFJZIO-UHFFFAOYSA-N 395.551 2.616 0 50 GFAA Cc1nc(CNC(=O)Cc2c3c(n(Cc4ccccc4)c2C)CCCC3=O)no1 95516539 YPKLSDILFCYMRS-UHFFFAOYSA-N 392.459 2.914 0 50 GFAA CN(Cc1cccc(OC[C@H](O)CN2CCOCC2)c1)Cc1ccccc1F 95519959 IQFXOOQTOAVLOL-HXUWFJFHSA-N 388.483 2.530 0 50 GFAA O=C(CCC1CCN(C(=O)[C@@H]2C=CCN2)CC1)NCc1cccc(Cl)c1 95529131 WQBHCKMHBBFTNP-SFHVURJKSA-N 375.900 2.503 0 50 GFAA O=C(NCCCc1nc2ccccc2s1)[C@H]1CC(=O)N(Cc2ccncc2)C1 95531031 WFWKRZREIVVHNT-INIZCTEOSA-N 394.500 2.789 0 50 GFAA Cc1sc(NC(=O)CSCC(N)=O)nc1-c1c(F)cc(F)cc1F 118331953 OUVMYUUNUCLOAM-UHFFFAOYSA-N 375.397 2.693 0 50 GFAA NC(=O)[C@H]1CCCCN1C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 120365862 QWIRPGBPLCLBIJ-CQSZACIVSA-N 399.451 2.615 0 50 GFAA CCc1n[nH]c(=O)c(CNC(=O)c2nn(-c3ccccc3Cl)cc2C)c1CC 126667686 RBSGQYQNTDFWIA-UHFFFAOYSA-N 399.882 2.972 0 50 GFAA COc1cccc2c1CC[C@@H]2NC(=O)C1CCN(C(=O)c2ccccn2)CC1 153785105 UIUBPOPZNDHERX-SFHVURJKSA-N 379.460 2.746 0 50 GFAA CC[C@H](C)C(=O)Nc1cccc(CNC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)c1 170600207 LRAMVDKHWQSYRU-YOEHRIQHSA-N 392.521 2.502 0 50 GFAA Cc1cc(C(=O)N2CCC[C@H]2Cc2ccccc2Cl)nc2nc(O)[nH]c(=O)c12 172636472 FORPXISEHDWKTI-ZDUSSCGKSA-N 398.850 2.833 0 50 GFAA C[C@@H]1CN(C)c2ccccc2CN1CC(=O)Nc1cccc(C(=O)N(C)C)c1 177399083 ULTMQAXKMWETIX-MRXNPFEDSA-N 380.492 2.667 0 50 GFAA Cc1nn(-c2ccccc2)cc1NC(=O)N1CCN(Cc2cccnc2)CC1 183721866 FIPBIWPOWSFQEO-UHFFFAOYSA-N 376.464 2.925 0 50 GFAA C[C@@H](O)CN1CCN(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)[C@H](C)C1 225680772 SUFNZSBFNQAHBB-CHWSQXEVSA-N 388.434 2.690 0 50 GFAA CC(C)C(=O)Nc1ccc2c([C@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c[nH]c2c1 227186396 MNRWYFOFRIKXGN-SJKOYZFVSA-N 387.436 2.685 0 50 GFAA COCc1ccc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)cc1 241653358 PULYCYWHMYGRSL-MRXNPFEDSA-N 394.518 2.995 0 50 GFAA Cc1cc(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)c2cnn(C)c2n1 252527948 DUMMDWSZDNAXRD-FUHWJXTLSA-N 377.492 2.917 0 50 GFAA C[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)c1ccc2nnn(C)c2c1 253417886 LRSRRYWARJTRFC-CYBMUJFWSA-N 375.473 2.782 0 50 GFAA O=C(NCc1nc(O)c2ccccc2n1)c1ccc(CSc2ncccn2)o1 253536392 DRTULVVOGKDMCT-UHFFFAOYSA-N 393.428 2.941 0 50 GFAA O=C(CN1C[C@@H](C(=O)O)[C@H](C(F)(F)F)C1)Nc1ccccc1C(F)(F)F 263067949 WDKDSDMOQBOKMN-PSASIEDQSA-N 384.276 2.839 0 50 GFAA COc1ccc(Cc2noc([C@@H](c3cccc(F)c3)N3CCOCC3)n2)cn1 289206707 XYVBGXGBQGGLKG-LJQANCHMSA-N 384.411 2.625 0 50 GFAA COC(=O)[C@@]1(N(Cc2ccccc2)C(=O)Cc2cc(F)ccc2F)CCOC1 328589943 VEQAOIJUGVWYJA-OAQYLSRUSA-N 389.398 2.868 0 50 GFAA CC(C)CO[C@H](C)c1noc(Cn2nc([C@H]3OCC[C@H]3C)n(C(C)C)c2=O)n1 328652596 WMCHKDDYNUQZBX-FMKPAKJESA-N 393.488 2.888 0 50 GFAA Cn1cnc2c(C(=O)N3CCCC[C@@H]3c3nnc(C4CCOCC4)o3)ccnc21 329286606 GYSRBCWYYUWBES-OAHLLOKOSA-N 396.451 2.613 0 50 GFAA O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2c2ncc(C(F)(F)F)cc2Cl)C1 373031803 YNVHVWJXJCWVCM-BXKDBHETSA-N 391.777 2.656 0 50 GFAA CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCC[C@@H]1CCO 428792667 IOAROHGXJSVPCV-MOXGXCLJSA-N 385.508 2.519 0 50 GFAA O=C(Cc1cncn1Cc1ccccc1)NC1CCN(Cc2ccccn2)CC1 431745815 SANOROOROZTJRK-UHFFFAOYSA-N 389.503 2.650 0 50 GFAA C[C@H](NC(=O)C1CCN(C2CCOCC2)CC1)c1ccccc1-n1cccn1 670444943 XQWUXNDDYULYJV-KRWDZBQOSA-N 382.508 2.941 0 50 GFAA O=C(COc1ccc(F)cc1F)NCC1CCN(C[C@H]2CCCOC2)CC1 827841820 UATFLBLHOWXVEW-MRXNPFEDSA-N 382.451 2.598 0 50 GFAA COC(=O)[C@@H]1CC[C@@H]2C(=O)N(c3ccc4cc(OC)c(OC)cc4c3)C(=O)N2C1 864565931 OPIZESBZVRJASQ-CZUORRHYSA-N 398.415 2.577 0 50 GFAA COc1ccc(-c2cc(CNC(=O)Cn3c(=O)oc4ccccc43)no2)cc1 952872554 PATAPPCICQMUSM-UHFFFAOYSA-N 379.372 2.575 0 50 GFAA Cc1nc(N2CCC[C@@H](CNC(=O)c3cc(C)oc3C)C2)c2cnn(C)c2n1 952963172 GBOGAJRCCZFZSU-HNNXBMFYSA-N 382.468 2.528 0 50 GFAA CN1C[C@@H]2C[C@H](N(C)C(=O)c3ccc(-c4noc(C5CC5)n4)cc3)C[C@@H]2CC1=O 1529110520 OFPHZSRABJYRMJ-FGTMMUONSA-N 394.475 2.943 0 50 GFAA C[C@@]1(O)CCOC2(CCN(Cc3ccc(C(F)(F)F)c(F)c3)CC2)[C@H]1O 1704343850 GKWDYFLQPSPGKO-JKSUJKDBSA-N 377.378 2.711 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)NCCc1nccn1C)C2 1772810377 LJPKXGVZGBWIFD-ZDUSSCGKSA-N 385.493 2.612 0 50 GFAA C[C@]12CC[C@H](O)C[C@@H]1CC[C@@H]1[C@@H]2C[C@@H](O)[C@]2(C)[C@H](C3=CC(=O)OC3)CC[C@]12O 1848675484 SHIBSTMRCDJXLN-SJLKERLLSA-N 390.520 2.575 0 50 GFAA biogenic Cc1cc(-c2nc(-c3ccc(C(N)=O)cc3)nn2[C@@H]2CCOC2)nn1C(C)C 1857676234 LYRRQOTVXOUJSL-MRXNPFEDSA-N 380.452 2.758 0 50 GFAA Cc1ccc(CN2CC(=O)N3[C@H](C[C@@H](C(=O)N(C)C)[C@H]3CC(C)C)C2)s1 1857707267 LAUXXHWWIQEAJI-KBAYOESNSA-N 377.554 2.592 0 50 GFAA Cc1cccnc1C(=O)NC[C@H]1[C@H]2CN(CCc3ccccc3)C[C@]23CC[C@H]1O3 1857712541 CSSPJQHZLFRMSG-FBHSLPMESA-N 391.515 2.842 0 50 GFAA O=C(N=c1cc[nH]cc1)C1CCN(C(=O)C[C@H](c2ccc(O)cc2)C2CC2)CC1 1875265945 ZYDXJBGJWUVOBZ-NRFANRHFSA-N 393.487 2.970 0 50 GFAA Cc1ccccc1Nc1scnc1C(=O)N1C[C@H](C)O[C@H](CC(=O)O)C1 1875312514 NGBLJBKUCWDWTE-QWHCGFSZSA-N 375.450 2.899 0 50 GFAA N[C@H](C(=O)N1CCC[C@H](NCC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 1875315034 FSSPCQJURMDKGQ-STQMWFEESA-N 383.336 2.848 0 50 GFAA CCc1cccc2[nH]c(C(=O)N3C[C@H]4C[C@H]3[C@@H]4c3ocnc3C(=O)NC)cc12 1875394761 VZQTYBUSEXXDTA-OAUYIBNBSA-N 378.432 2.706 0 50 GFAA CC(=O)Nc1sc(NC(=O)[C@H]2CCn3ncnc3C2)nc1-c1ccccc1 1940198208 UZTATJUWJOMPEA-ZDUSSCGKSA-N 382.449 2.561 0 50 GFAA O=C(Cc1cccnc1)N1CC[C@@]2(C1)C(=O)N(CC1CCC1)c1ccccc12 1940198239 XERAKQNJHAHFQM-QHCPKHFHSA-N 375.472 2.941 0 50 GFAA CC(C)c1ccc(C(=O)N(C)C2CC(NC(=O)[C@@H](O)c3ccc(F)cc3)C2)o1 2325829202 BVHKRRQXXAIBPN-RJYAGPCLSA-N 388.439 2.995 0 50 GFAA O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)N[C@@H]1CCNC1=O 2325829476 KSVRSUHXYOHWEL-GOSISDBHSA-N 394.862 2.740 0 50 GFAA Cc1ncn(-c2ccc(NC(=O)CN3CCN(c4ccncc4)CC3)cc2)c1C 2325840799 QTTROAWFTYDEGE-UHFFFAOYSA-N 390.491 2.645 0 50 GFAA NC[C@H]1CCN(S(=O)(=O)c2cnn(-c3ccc(F)cc3)c2)c2ccccc21 2325858260 FVPFBUHOCNENAG-CQSZACIVSA-N 386.452 2.653 0 50 GFAA COc1cc(Cl)ccc1C[C@H](NC(=O)[C@H](CC(C)C)n1ccnc1)C(=O)O 2325876111 KVTPOULOIRCMFR-HOTGVXAUSA-N 393.871 2.944 0 50 GFAA Cc1nc(CC(=O)N2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)cs1 2356149820 WNFSAIIEFDFEQH-HXUWFJFHSA-N 384.505 2.573 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1ccc(-c3cncc(N)n3)cc1)C2 2356156800 RRJDHQFWMMKFKC-CQSZACIVSA-N 390.443 2.716 0 50 GFAA CCN1Cc2nnc(-c3ccc(OC)c(OC)c3OC)n2[C@@H](CC(C)C)C1=O 2356139505 ZIFHMJQEKNETDX-AWEZNQCLSA-N 388.468 2.920 0 50 GFAA Nc1cncc(-c2ccc(C(=O)N3CCC[C@@H](c4nnc5ccccn45)C3)cc2)n1 2356166169 WFZSKNNUSVMKEX-QGZVFWFLSA-N 399.458 2.788 0 50 GFAA CCOc1ccc(N(CC(=O)O)S(=O)(=O)c2cc(C)ccc2OC)cc1 4869249 SJGUCVPERIFGKK-UHFFFAOYSA-N 379.434 2.682 0 50 GFAA CS(=O)(=O)N(CCCC(=O)NCc1ccncc1)c1ccc(Cl)cc1 4973701 QQXLQFZEOCYKMY-UHFFFAOYSA-N 381.885 2.598 0 50 GFAA CN1CCC(N2CCN(Cc3ccccc3-c3ccco3)C[C@H]2CCO)CC1 104445768 RXGPNCQDPIHIMH-OAQYLSRUSA-N 383.536 2.909 0 50 GFAA O=C(NC1CCCCC1)N1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2)C1 12579561 RZCWMLNZLACXFX-SFHVURJKSA-N 393.553 2.860 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3c4ccccc4[C@@H]([C@H]4C=CC=C[C@@H]43)[C@H]2C1=O)c1ccncc1 101513214 NVMBSBHKEBHUNI-QYUJZOPQSA-N 397.434 2.581 0 50 GFAA NC(=O)[C@@H]1CCCN(c2ccc(C(=O)N[C@H]3CCOc4ccccc43)cc2)C1 247756535 WPFWNQYXSRKMEU-APWZRJJASA-N 379.460 2.642 0 50 GFAA O=C1N(Cc2cccc(F)c2F)CCC[C@]1(O)CNCc1ccccc1F 12707359 TVYCNJJDKBGVBK-FQEVSTJZSA-N 378.394 2.747 0 50 GFAA CCn1ncc(NC(=O)c2ccc([C@@H]3CCCN3Cc3nc[nH]c3C)s2)n1 23145424 DNBOIMRBZNTNOF-AWEZNQCLSA-N 385.497 2.980 0 50 GFAA O=C1N[C@@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1cncs1 67982891 PUTXBXFHQMRNGL-FQEVSTJZSA-N 384.505 2.566 0 50 GFAA O=C(Cc1ccc(F)cc1)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 67602211 DINFUAIKXBMFRP-UHFFFAOYSA-N 392.438 2.646 0 50 GFAA CCN1CCC[C@@H](CN(C)C[C@@H](O)COc2ccccc2)[C@@H]1c1cnn(C)c1 328630908 JVVAJLVUNUMDHP-CZTZKLFOSA-N 386.540 2.565 0 50 GFAA C[C@H](NC(=O)c1cc(=O)n(-c2ccccc2)[nH]1)c1ccc2c(c1)OCCCO2 222993452 JURIKXFEZIDMST-AWEZNQCLSA-N 379.416 2.818 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(c3nc4ccccc4s3)CC2)cc1 1351303 JJFIJEJMTBQTDX-UHFFFAOYSA-N 389.502 2.816 0 50 GFAA O=C(NCc1ccc(-n2ccnc2)c(F)c1)Nc1cnn(C[C@H]2CCCO2)c1 127645983 LODYMUNHNCQRRK-MRXNPFEDSA-N 384.415 2.709 0 50 GFAA CC[C@H](C)n1cnc(S(=O)(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)c1 252517718 PTJNSSCBYWJWPA-MAUKXSAKSA-N 377.510 2.816 0 50 GFAA O=C(O)CCCc1nnc(C(=O)Nc2nnc(-c3ccccc3)s2)s1 34927218 NMMXKVIZIOHLDF-UHFFFAOYSA-N 375.435 2.716 0 50 GFAA COc1cnc(N2CCC3(CC2)CC(=O)N(Cc2cccc(OC)c2)C3)nc1 77379490 AWDZXWSRDBSNOR-UHFFFAOYSA-N 382.464 2.513 0 50 GFAA Cc1cc(N2CCN(C(=O)N[C@@H]3[C@H]4CCO[C@H]4C3(C)C)CC2)nc(C(C)C)n1 240412900 FOQRJCHCJQVLIA-KBAYOESNSA-N 387.528 2.554 0 50 GFAA CCCCN(C)C[C@@H](C)NC(=O)C1CCN(C(=O)COc2ccccc2)CC1 242047862 VQSFSRMWTCGSFE-GOSISDBHSA-N 389.540 2.541 0 50 GFAA CCCn1nccc1C(=O)N[C@@H]1CC(=O)N(Cc2cccc3ccccc23)C1 72163595 HXEZPZZFUPNIJV-GOSISDBHSA-N 376.460 2.977 0 50 GFAA CCOCCCn1c(Cc2ccccn2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C 460688752 DLIISTKNZIWILW-ROUUACIJSA-N 386.544 2.609 0 50 GFAA CCN(C)C[C@@H]1CCN(C(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)C1 246900183 KEOPJKMORRQBPG-UCLAIMLFSA-N 377.916 2.660 0 50 GFAA CC(=O)N(CCC(=O)N[C@@H](C(=O)O)c1ccc(C)c(C)c1)Cc1ccccc1 262896857 HVHHYDBNDHPVMV-OAQYLSRUSA-N 382.460 2.984 0 50 GFAA Cc1cc(C)nc(N2CCN(c3nc(N4CCCC4)c4ccccc4n3)CC2)n1 41148363 TWNCISPUMVNKDB-UHFFFAOYSA-N 389.507 2.963 0 50 GFAA CCOc1cc(Br)c(CC(=O)N2CC[C@H](CN)C2)cc1OCC 178524372 NGPYDTTWZMHFDJ-GFCCVEGCSA-N 385.302 2.596 0 50 GFAA Cc1c(C(=O)N(Cc2ccccn2)C[C@H]2CCCO2)sc2[nH]cnc(=O)c12 426475571 SALGGBDNCOHMGL-CQSZACIVSA-N 384.461 2.509 0 50 GFAA O=C(CCc1cc2n(n1)CCN(Cc1nc3ccccc3s1)C2)NC1CC1 82167106 NTTDXOZNCFDZFG-UHFFFAOYSA-N 381.505 2.720 0 50 GFAA N=c1cc[nH]cc1-c1cccc(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1 426581358 XKOBSPGKKZPWPC-IBGZPJMESA-N 380.492 2.534 0 50 GFAA Cc1cc(N2CCCN(C(=O)c3cccc(Cn4cccn4)c3)CC2)ccn1 92001463 LOFSTZFOZMPZSF-UHFFFAOYSA-N 375.476 2.987 0 50 GFAA COc1cc2c(cc1OC)[C@H](CC(=O)O)N(C(=O)c1n[nH]c3ccccc13)CC2 294163188 BIKHDLKTKVMQST-INIZCTEOSA-N 395.415 2.794 0 50 GFAA CC1(C)CC(CC(=O)N2CCNC(=O)[C@@H]2c2ccc(F)cc2)CC(C)(C)N1 97797579 BTEICSVJMPWXHZ-SFHVURJKSA-N 375.488 2.772 0 50 GFAA CN(C)C(=O)CCc1cccc(NC(=O)N2CCC[C@H](Cn3ccnc3)C2)c1 96131755 DJUGMMQJGFUIEH-GOSISDBHSA-N 383.496 2.848 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCc1ccncc1 252527766 DHYOBJHUQLSKDI-UHFFFAOYSA-N 379.395 2.680 0 50 GFAA O=C1[C@@H]2[C@@H](OCOCc3ccccc3)[C@@H]3C(=O)[C@@H]4[C@@H]5C=C[C@@H]6[C@@H]1[C@H]1[C@H]([C@H]65)[C@@H]4[C@@H]3[C@@H]12 254380675 IMOUDSNFOYCYFR-SGBNJRJYSA-N 388.463 2.730 0 50 GFAA CN(C)CCn1ccc(NC(=O)N2CCC[C@H](n3ccc(C(F)(F)F)n3)C2)n1 183161147 YSEYZFUVDPZCOK-ZDUSSCGKSA-N 399.421 2.529 0 50 GFAA Cc1nnnn1-c1cccc(NC(=O)c2cccc(NC(=O)[C@H]3C[C@H]3C)c2)c1 298467547 YOXFJKBQUWGPIT-XIKOKIGWSA-N 376.420 2.818 0 50 GFAA Cc1cc(COc2ccc(C(=O)N3CC[C@@H](CN)C3)cc2Br)no1 299739458 OPWSRWSATKYCKX-LBPRGKRZSA-N 394.269 2.745 0 50 GFAA Cc1cc(C(F)(F)F)n(C[C@H](C)CNC(=O)Nc2ccc3[nH]nnc3c2)n1 299793786 HKBRDHLDMWQWQF-SECBINFHSA-N 381.362 2.939 0 50 GFAA CCCc1cc(CNC(=O)c2cccc(OCC(=O)N3CCCCC3)c2)on1 823020294 PCDXCDOLFGOSAZ-UHFFFAOYSA-N 385.464 2.948 0 50 GFAA Cn1nc(-c2cccs2)cc1C(=O)N[C@@H]1CCCN(C(=O)c2ccco2)C1 828188846 BVDLGQSVFRXSFN-CYBMUJFWSA-N 384.461 2.776 0 50 GFAA CNC(=O)[C@H]1CC[C@H](CNC(=O)N2CCC(Oc3ccc(F)cc3)CC2)CC1 584897239 UKJJICHYULQTQM-WKILWMFISA-N 391.487 2.931 0 50 GFAA Cc1nc(C(=O)N2CC(C3CCCCC3)C2)nc(N2CC[C@@H](N(C)C)C2)c1C 1875404181 YIEKECGUPLSPGY-LJQANCHMSA-N 385.556 2.886 0 50 GFAA CC(=O)c1c(C)nn(CCC(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)c1C 952962460 DRGDCFRQZHBNGM-IBGZPJMESA-N 384.480 2.695 0 50 GFAA C[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccnn1CC1CC1)[C@@H]1COc2ccccc21 888101626 KDDIXWHTSWVRLC-MUMXORNYSA-N 396.491 2.987 0 50 GFAA CS[C@H](C)CC(=O)N1CC[C@@]2(NC(=O)Cc3ccn(C(C)C)n3)CCC[C@@H]12 1775991338 KYGMBCHJDWITNY-MDYRTPRTSA-N 392.569 2.788 0 50 GFAA Cn1ncnc1[C@@H]1c2n[nH]c(=O)c3cc(F)cc(c23)N[C@H]1c1ccc(F)cc1 95644684 HWGQMRYQVZSGDQ-HOTGVXAUSA-N 380.358 2.629 0 50 GFAA in-vitro CCN(CC(=O)O)C1CCN(C(=O)[C@H](C)Oc2cc(C)ccc2Cl)CC1 186637761 YXUVHAKVLJGICR-AWEZNQCLSA-N 382.888 2.813 0 50 GFAA Cc1cc(C(=O)N2C[C@H](C(=O)O)[C@H](c3ccccc3)C2)c2c(C)nn(C)c2n1 219322669 JBNPCNQOCKBKBH-IRXDYDNUSA-N 378.432 2.526 0 50 GFAA COc1cc(C)c(C)cc1S(=O)(=O)N1CCCN(c2ccnc(C)c2)CC1 1506431718 WPMLIQJZRIKWCD-UHFFFAOYSA-N 389.521 2.916 0 50 GFAA O=C(CC[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2Cl)C1)N1CCOCC1 12192624 GXHAYSJPMLCUKU-HNNXBMFYSA-N 396.890 2.899 0 50 GFAA Cc1cnc(C)c(-c2cccc(-c3ccn(CC(=O)NC[C@H]4CCCO4)n3)c2)n1 19595518 QFWZAEQUCFYZPX-LJQANCHMSA-N 391.475 2.919 0 50 GFAA CCN1C[C@H](CNC(=O)c2csc3nc(-c4ccc(F)cc4)cn23)CC1=O 19731984 ZNTORYMEWOFYMV-LBPRGKRZSA-N 386.452 2.800 0 50 GFAA CCN=c1ncc(CN2[C@H]3CC[C@@H]2[C@](Cc2ccccc2)(C(=O)OCC)C3)c[nH]1 1857677679 MDYDCVPXKCOALZ-MIZPHKNDSA-N 394.519 2.859 0 50 GFAA O=C(N[C@@H]1[C@H]2CC[C@@H]1CN(Cc1ccc3c(c1)CCO3)C2)[C@H](O)c1ccccc1 1857681488 LAVOILNXFMPGHY-DWQJTFDBSA-N 392.499 2.682 0 50 GFAA Cc1nc(N2CCC3(CC2)CC(=O)N(C/C=C/c2ccccc2)CCO3)no1 1857694673 HTISDFNDABKNFV-VMPITWQZSA-N 382.464 2.679 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2-c2nc3ccccc3nc2C)cn1 1857699333 NHZJKXUSABLMFQ-UHFFFAOYSA-N 375.436 2.514 0 50 GFAA O=C(CCO)N[C@H]1CCCC12CCN(C(=O)c1ccc3ncsc3c1)CC2 1857709372 UHLHMIOFZAOWSI-KRWDZBQOSA-N 387.505 2.570 0 50 GFAA O=S(=O)(N[C@H]1C[C@H]2CO[C@@H](C3CC3)CN2C1)c1cc(Cl)cc(Cl)c1 1857724221 QFGDTBGRJVVUJE-OFQRWUPVSA-N 391.320 2.523 0 50 GFAA CN(Cc1cccnc1)C(=O)[C@@H]1C[C@H](C(=O)O)N(C)[C@@H]1c1cccc(Cl)c1 248015185 GCUXKKHXOZVQPQ-KZNAEPCWSA-N 387.867 2.840 0 50 GFAA O=C(N[C@@H]1COc2cc(F)c(Br)cc21)c1cnc2n1CCCC2 252487652 HYYSOUVHLDNHCI-GFCCVEGCSA-N 380.217 2.985 0 50 GFAA O=C(CSc1nnc2c(n1)[nH]c1ccccc12)NCCOc1ccccc1 3664898 ZSANQZHAGSHOTF-UHFFFAOYSA-N 379.445 2.793 0 50 GFAA Cc1oc2c(c1C(=O)N=c1[nH][nH]c3cc(OCCN(C)C)ccc13)C(=O)CCC2 2100556976 LQZYVEQMEUIUOG-UHFFFAOYSA-N 396.447 2.598 0 50 GFAA COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc2ccccc2oc1=O 1053634 QSXXMJDCILMWLI-UHFFFAOYSA-N 383.356 2.849 0 50 GFAA Cc1ccc(C(C)(C)NC(=O)C[C@H]2CN(C(=O)[C@@H]3C[C@H]3C)C3(CCC3)CO2)cn1 2325785354 RGVZOBXMVCOLNR-AYOQOUSVSA-N 399.535 2.938 0 50 GFAA O=C(CCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H](Cn2cc(Cl)cn2)C[C@H]1O 2325785920 UMHKKRIXBHYTFR-UPRAQXHNSA-N 386.883 2.906 0 50 GFAA CC(C)[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc2c(-c3nn[nH]n3)c[nH]c12 2325807979 PUPZJIRYAKTGPM-RDTXWAMCSA-N 393.495 2.683 0 50 GFAA C/C=C/C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)/C(C)=C/C 2325872487 AACJKVRIFYUMMG-GNGDBHITSA-N 391.512 2.624 0 50 GFAA Cc1cc(C)n(-c2ccc(CNC[C@H](O)COc3ccc4cc[nH]c4c3)cn2)n1 905052137 MGZDNDODYZBXJV-IBGZPJMESA-N 391.475 2.895 0 50 GFAA O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)NCc1cccnc1 875703 YZWFIQJUIGIDTM-UHFFFAOYSA-N 381.457 2.593 0 50 GFAA COC(=O)C1=NN(C(=O)c2cccc(OC)c2)[C@](O)(c2ccc(Cl)cc2)C1 1214570 HIWPQVSPQFVUIQ-LJQANCHMSA-N 388.807 2.569 0 50 GFAA CN(c1ccccc1C(=O)O)S(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2 1926330 TWUJXLORHMDNAN-UHFFFAOYSA-N 382.397 2.929 0 50 GFAA O=C(CF)N[C@@H](NC(=S)Nc1ccc(Cl)cn1)C(Cl)(Cl)Cl 2706938 WSNSZMAMGWQBAI-QMMMGPOBSA-N 394.086 2.803 0 50 GFAA Cc1nc(CN2CCN(Cc3nc(COc4ccccc4)no3)CC2)cs1 20919918 XNYZTCSLEVPIPB-UHFFFAOYSA-N 385.493 2.731 0 50 GFAA COc1ccccc1CCNC(=O)Cn1nc(-c2ccccc2Cl)ccc1=O 61720757 QGNHBJFZLIGEPB-UHFFFAOYSA-N 397.862 2.931 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccccc1C(F)(F)F)NC1CCCCC1 55120177 LCFWTKVXUUNAHU-KRWDZBQOSA-N 397.441 2.845 0 50 GFAA CCOc1cccc2cc([C@H](C)NS(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)oc12 229722975 OPVIUBSWJDKMGC-IHRRRGAJSA-N 382.482 2.836 0 50 GFAA CN(C)CCNC(=O)c1ccccc1SCC(=O)N1CCc2ccccc21 120320374 UUVHOLHFAXUQBY-UHFFFAOYSA-N 383.517 2.659 0 50 GFAA Cc1ccccc1CN1CCC(NC(=O)c2nc3ccccc3c(=O)[nH]2)CC1 122804108 FPQRGNHSZUYIGM-UHFFFAOYSA-N 376.460 2.626 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3ccc(C)c(F)c3)CC2)C1 67562335 MIUBQDRLUSYFQE-IBGZPJMESA-N 391.531 2.573 0 50 GFAA Cc1cc(CNC[C@@]2(O)CCCN(CCCc3ccccc3)C2=O)cnc1C 67947937 KPFJNAZCYIOHEY-QHCPKHFHSA-N 381.520 2.774 0 50 GFAA COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)c1cc(CC(C)C)[nH]n1 409414164 OFLAYJUMVBZROV-FXAWDEMLSA-N 376.545 2.961 0 50 GFAA biogenic CCn1ncc(S(=O)(=O)Nc2cnn(Cc3ccccc3Cl)c2)c1C 2805035 ZDCYZXOJRZNKSE-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA CC(C)c1c(C(=O)N[C@@H](CN)C2CC2)cnn1-c1ccc(C(F)(F)F)cn1 236873959 GYTGYNGZNAAHLA-AWEZNQCLSA-N 381.402 2.877 0 50 GFAA Cc1ccc2c(CC(=O)N3CCOc4ccc(S(C)(=O)=O)cc43)c[nH]c2c1 128546722 KQBDDIQNTFLULY-UHFFFAOYSA-N 384.457 2.848 0 50 GFAA Cc1c(C(=O)N2CCC(c3nc4ccccc4o3)CC2)nnn1C1CCNCC1 237740698 NHOJSKLRNCLUNF-UHFFFAOYSA-N 394.479 2.672 0 50 GFAA CC(C)C[C@H](CNC(=O)N[C@H]1CCOC2(CCCCC2)C1)N1CCOCC1 132238337 UAIMQLSFXVOVLC-RBUKOAKNSA-N 381.561 2.914 0 50 GFAA CN(CCc1ccccc1)C1(C(=O)NCCN2CCCC2)Cc2ccccc2C1 72165183 QVOVNWKETJPBRM-UHFFFAOYSA-N 391.559 2.911 0 50 GFAA COC[C@H](C)n1c(CCCC(=O)N2CCC3(CCO3)CC2)nc2cccnc21 77386842 CIHMVTWJSFJHHL-INIZCTEOSA-N 386.496 2.743 0 50 GFAA Cc1n[nH]c(SCC(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)n1 92106881 WGKHADYIDKBIMK-UHFFFAOYSA-N 384.465 2.661 0 50 GFAA COCCN1C[C@H]2CC[C@@H]1CN(c1ncnc(Oc3cccnc3C)c1C)C2 95367700 CLTIWNKGELBDIN-QZTJIDSGSA-N 383.496 2.828 0 50 GFAA O=C(CSc1ncccn1)N1CCC[C@H](c2nccn2Cc2cccnc2)C1 95374706 IEKIESNEUOSFAL-KRWDZBQOSA-N 394.504 2.615 0 50 GFAA O=C(Cc1ccc(-n2cnnn2)cc1)N(Cc1ccncc1)C1CCCCC1 97360136 HHXLPOSMCIJKOS-UHFFFAOYSA-N 376.464 2.961 0 50 GFAA O=C(NC[C@H]1CCN(c2ccccc2)C1)c1ccc(CSc2nnc[nH]2)o1 244795261 RCSNKZKRWRZHOU-CQSZACIVSA-N 383.477 2.946 0 50 GFAA O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1nc(-c2cccs2)cs1 253397475 BLONSEGVQOKGLC-LBPRGKRZSA-N 398.469 2.951 0 50 GFAA biogenic O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H](c2noc(C3CC3)n2)C1 270483531 AIJKELNXQHEKAZ-MRXNPFEDSA-N 378.436 2.612 0 50 GFAA Cc1cc(C(=O)N2CC[C@H]3[C@H](C2)OCc2cnnn23)c2cccc(Cl)c2n1 299767764 NYPHPRVDYOUJKO-IRXDYDNUSA-N 383.839 2.774 0 50 GFAA O=C(Nc1ccc2c(c1)OC(F)(F)O2)NC1CCN(C[C@H]2CCCO2)CC1 299783952 KPUCBLKWYUJQEE-CQSZACIVSA-N 383.395 2.773 0 50 GFAA Cc1ncc(C(=O)N2CCC(c3[nH]ncc3-c3cccc(F)c3)CC2)c(=O)[nH]1 67713010 BYYWDIRFNDGHFS-UHFFFAOYSA-N 381.411 2.627 0 50 GFAA Cc1cc(S(=O)(=O)N[C@@H]2CCCN(C(=O)C(C)C)C2)c(Cl)cc1F 827927018 QHZQISPTMXXKKS-GFCCVEGCSA-N 376.881 2.713 0 50 GFAA CCOc1cc(S(=O)(=O)NCCCc2csc(N)n2)ccc1Cl 670442326 QFDMTAPRQLVFFS-UHFFFAOYSA-N 375.903 2.689 0 50 GFAA Cc1cc(=O)c(C(=O)N2CCOC[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c[nH]1 952888113 NUEXFIFKPIPSER-LJQANCHMSA-N 392.459 2.700 0 50 GFAA O=C(NC[C@@H]1C[C@@H]2OCC[C@@H]2O1)c1cc(-c2ccc(Br)cc2)[nH]n1 1875308831 ZZTMNCCTUPPLAO-RCBQFDQVSA-N 392.253 2.515 0 50 GFAA CS(=O)(=O)NC(=O)c1cc(-c2ccccc2F)nc2onc(C3CC3)c12 1875390822 QHFSDCVGEVUYOM-UHFFFAOYSA-N 375.381 2.596 0 50 GFAA O=C(CCc1cn[nH]c1)N1CCC[C@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1 952975615 ZYVOJSKAIMFGQW-HYMXPIOVSA-N 398.551 2.914 0 50 GFAA O=C(N1C[C@@H](O)[C@H](F)C1)C1(c2ccccc2)CCN(Cc2ccccc2)CC1 952977496 CMDFSWVJQBBBMO-NHCUHLMSSA-N 382.479 2.762 0 50 GFAA CC[C@@H]1c2cc(F)c(F)cc2CCN1C(=O)c1nnn([C@@H]2CCNC2)c1C 888101948 RIURSXWLIADHBL-CXAGYDPISA-N 375.423 2.549 0 50 GFAA CC1(c2cccc(Cl)c2)CCN(C(=O)CCN2CCCS2(=O)=O)CC1 280693388 WXEKMOWOVJJKAE-UHFFFAOYSA-N 384.929 2.646 0 50 GFAA Cn1cc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(OC(F)(F)F)cc3)CC2)cn1 281462617 LVLUWLIKOHIWQM-DLBZAZTESA-N 394.397 2.771 0 50 GFAA Cc1cc(N2CCN(C3CCN(c4cccc(C)c4C)CC3)CC2)nc(N)n1 1506425798 HEQFCRHYEIHLNP-UHFFFAOYSA-N 380.540 2.775 0 50 GFAA O=C(CCn1c(O)nc2ccccc21)N(Cc1ccncc1)C[C@H]1CCCO1 1506399042 XLHJBOIPGRGKHK-QGZVFWFLSA-N 380.448 2.735 0 50 GFAA Cn1cc(Cl)c(C(=O)NC[C@H]2CCCN(c3cnc4ccccc4n3)C2)n1 1506416578 WWQDVTTXEHPIAV-CYBMUJFWSA-N 384.871 2.663 0 50 GFAA CCCNc1ncc(CN2C[C@@H](O)[C@H](Cc3ccc4ccccc4n3)C2)cn1 1529184722 FTOBCCCNNGQLOY-WIYYLYMNSA-N 377.492 2.882 0 50 GFAA Cc1cc(S(=O)(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)c(C)cc1Cl 1704339908 PZOJSOPUHGEXOW-NVXWUHKLSA-N 380.897 2.888 0 50 GFAA CCOC(=O)[C@@H]1CCCN(C(=O)c2ccccc2I)C1 1182557 IJBXXZJRKLXBFF-LLVKDONJSA-N 387.217 2.707 0 50 GFAA COc1ccc(Oc2ccc(C(=O)N3C[C@@H]4COCC[C@]4(CO)C3)cc2)cc1 1772701686 GSAZGKNJROZSBP-VGOFRKELSA-N 383.444 2.959 0 50 GFAA CC1CCN(C(=O)[C@H]2CC(=O)c3sc(NC(=O)C4CCC4)nc3C2)CC1 12056843 JKFNQRJNBXGGAX-CYBMUJFWSA-N 375.494 2.885 0 50 GFAA CCOc1ccccc1CN1CCNC(=O)[C@H]1CC(=O)NCCC1=CCCCC1 12314750 LNVUEJZDDYOLGD-HXUWFJFHSA-N 399.535 2.783 0 50 GFAA COCCN1C(=O)N(C)C(=O)C12CCN(C/C(Cl)=C/c1ccccc1)CC2 14541083 NWTWKGSFLVSKLA-VKAVYKQESA-N 391.899 2.641 0 50 GFAA CCCc1noc(-c2cn(C3CCN(C(=O)c4ccc(OC)cc4)CC3)nn2)n1 169777405 NHUHOPUOVVDCMH-UHFFFAOYSA-N 396.451 2.767 0 50 GFAA O=S1(=O)CCC(N2CCC(n3ccnc3-c3ccncc3Cl)CC2)CC1 1857731164 MFTGZLAQRWVNIF-UHFFFAOYSA-N 394.928 2.813 0 50 GFAA CCCC[C@@H]1CN(S(=O)(=O)c2cc(C(=O)O)ccc2F)C[C@H](C2CC2)O1 1875245012 GISVRFZQFPCOBO-GDBMZVCRSA-N 385.457 2.882 0 50 GFAA Cc1cc2c(N3CCN(CC(=O)N4C[C@H](C)C[C@@H](C)C4)CC3)ncnc2s1 301868691 ISTXWTYFFUGHTP-HUUCEWRRSA-N 387.553 2.626 0 50 GFAA O=C1CN(C(=O)CN2CCC(Nc3ccccc3F)CC2)c2ccccc2N1 128966677 OFROSUQAGBYKHZ-UHFFFAOYSA-N 382.439 2.687 0 50 GFAA Cc1cc2c(cc1CN1C[C@@H]3CC[C@H]1CN(Cc1[nH]cnc1C)C3)OCCO2 248048076 RHMZZZRNGDTBMG-MJGOQNOKSA-N 382.508 2.894 0 50 GFAA CO[C@@H]1C[C@H](c2nnc(C)o2)N(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C1 779855821 OTSIQWBKSBGJCQ-GUDVDZBRSA-N 384.480 2.579 0 50 GFAA CC1=C(C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)[C@@H](C)n2nnnc2N1C 847563578 LCQYJJSGZXMUHU-LLVKDONJSA-N 392.423 2.524 0 50 GFAA Cc1cc(CN2CC[C@]3(C2)c2ncn(C)c2CCN3C(=O)C[C@H](C)C(C)C)on1 2325776912 NKFJDVIFVBKHLD-AOMKIAJQSA-N 399.539 2.885 0 50 GFAA Cc1nccn1CCC(=O)N1CCN(C(=O)c2cc3sccc3s2)CC1 2325790109 NTLALUJZYOYTTA-UHFFFAOYSA-N 388.518 2.842 0 50 GFAA Cn1ncc(C(=O)N[C@]2(C(=O)O)CCc3ccccc32)c1Cc1ccccc1 2325840679 LCXZGUBAHBJECS-JOCHJYFZSA-N 375.428 2.667 0 50 GFAA O=C(NC[C@H]1CCC2(CCC2)CO1)c1[nH]nc2ncc(Br)cc12 2325853898 GNCXDHRKKIIPAB-LLVKDONJSA-N 379.258 2.800 0 50 GFAA CC[C@H](CC(=O)N1CC2(C[C@H](NC(=O)c3ncoc3C)c3nccn32)C1)C(C)C 2332238089 YOPVIMUBQXDRBC-CVEARBPZSA-N 399.495 2.664 0 50 GFAA COc1ccccc1NC(=O)Cn1cnc2ccc(Br)cc2c1=O 638842 VIMWSVHUDUYYEF-UHFFFAOYSA-N 388.221 2.806 0 50 GFAA CCOc1ccc(NC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 6741690 ZBVCTQBPOZSAOK-UHFFFAOYSA-N 389.477 2.624 0 50 GFAA O=C(NCc1ccccc1F)C1CCN(S(=O)(=O)c2cccs2)CC1 8515504 GVZZWZDOVHBFHT-UHFFFAOYSA-N 382.482 2.604 0 50 GFAA O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)N1c1ccc(OS(=O)(=O)c2ccccc2)cc1 101233157 QZILCGXCVLXCKE-LSOMNZGLSA-N 397.452 2.990 0 50 GFAA O=C1[C@@H]2[C@H](C(=O)N1c1cccc(I)c1)[C@H]1C=C[C@H]2C12CC2 101376627 GVCLEJYIORRMRZ-SYQHCUMBSA-N 391.208 2.993 0 50 GFAA C[C@H](NC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(C(F)(F)F)c1 248379987 OOUAAMBIIJSCJA-AWKHGQQRSA-N 392.377 2.690 0 50 GFAA CC(C)n1nnnc1CN1C[C@H]2CCC[C@@]2(c2nc(Cc3ccccc3)no2)C1 328607162 UYKUNXYXIZIMBN-DYESRHJHSA-N 393.495 2.782 0 50 GFAA CNC(=O)c1ccc([C@H]2CCCCN2C[C@@H](O)c2ccc(F)cc2F)n1C 328625542 DFYRTJJSCBLKCD-IEBWSBKVSA-N 377.435 2.924 0 50 GFAA CN(C)C(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2c2nccs2)c1 175385301 CUUFHVGDDCRFGY-HNNXBMFYSA-N 379.507 2.761 0 50 GFAA NC(=O)[C@@H]1CCCCN1C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 124480607 QNDJCZNHJSVQKX-AWEZNQCLSA-N 399.451 2.615 0 50 GFAA O=C(NCc1cccnc1Oc1cccc(C(F)(F)F)c1)c1cnc[nH]c1=O 67472842 QCSSXFDONIDLGR-UHFFFAOYSA-N 390.321 2.906 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccccc3C)CC2)cc(-n2ccnc2)n1 65362295 XIYZGVVMMYUYNC-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CC(C)c1nccn1Cc1cccc(NC(=O)c2cn(C3CCNCC3)nn2)c1 236832494 VMHJMMJICKFYQF-UHFFFAOYSA-N 393.495 2.823 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCc2nc(C)cs2)C1 77299308 WSKWUMGTUDDAEN-UHFFFAOYSA-N 380.477 2.820 0 50 GFAA Cc1nc(-c2ccc(C)c(NS(=O)(=O)c3ccc(C(=O)O)c(F)c3)c2)n[nH]1 489557279 BYXUOOZYPZRUAI-UHFFFAOYSA-N 390.396 2.727 0 50 GFAA Cc1n[nH]c(CCC(=O)N2CC[C@@]3(CCCN(CCCc4ccccc4)C3)C2)n1 14949393 FFSOSNGOYGXTNN-HSZRJFAPSA-N 395.551 2.993 0 50 GFAA O=C(Cc1ccccc1)N1CCC[C@@H](C(=O)N2CCC(c3cnc[nH]3)CC2)C1 378077143 MMTYKDLPWILCKC-LJQANCHMSA-N 380.492 2.597 0 50 GFAA NC(=O)c1ccc(NC(=O)N2CC[C@]3(CCCN(Cc4ccccc4)C3)C2)cn1 378336236 QZSDNHGEWUJWSI-QFIPXVFZSA-N 393.491 2.701 0 50 GFAA OCc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=N[C@@H]2O 44699478 GBCYZJYLQAYLGN-QGZVFWFLSA-N 375.215 2.908 0 50 GFAA in-vitro CCc1c(C)sc(NC(=O)CCC(=O)O)c1C(=O)NCc1cccnc1 17076788 KRKKALSUHQYMEP-UHFFFAOYSA-N 375.450 2.747 0 50 GFAA CC(=O)N1CCc2cc(C(=O)NC[C@@H]3CCN(c4ccccc4F)C3)ccc21 293227483 JTLTUOIQPCYNIM-INIZCTEOSA-N 381.451 2.991 0 50 GFAA COC(=O)[C@H]1Cc2ccc(OC3CCN(C(=O)OC(C)(C)C)CC3)cc2N1 44138698 UBUUNNDBFFEDOE-QGZVFWFLSA-N 376.453 2.975 0 50 GFAA Cc1noc2nc(C3CC3)cc(C(=O)N[C@@H]3CCCN(c4cnccn4)C3)c12 426525894 JKVTXNMSCYJGIJ-CQSZACIVSA-N 378.436 2.597 0 50 GFAA CNC(=O)c1ccc(OC)c(-c2cccc(C(=O)N3CCCC[C@H]3CN)c2)c1 426726717 GMYRLFNODHDMDE-SFHVURJKSA-N 381.476 2.675 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)N(C)Cc3cnn(C)c3)csc2C1 426678217 WRVFJXYZNCIFDT-UHFFFAOYSA-N 399.520 2.917 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)c1cccc(N(C)C)c1)CC2 95520936 XUZIDCVPYHZZFA-UHFFFAOYSA-N 381.524 2.875 0 50 GFAA COc1ccc(-n2nc(C3CCOCC3)nc2C2CCN(C(C)=O)CC2)cc1 96140430 XXTJJBIWHYUXOV-UHFFFAOYSA-N 384.480 2.896 0 50 GFAA COc1cc(NC(=O)N2CCCC[C@H]2CN2CCOCC2)c2ncccc2c1 96151748 XVJYRYLTFYFLRL-KRWDZBQOSA-N 384.480 2.962 0 50 GFAA O=C(Nc1ccc(OCc2ccccn2)cc1)N[C@H]1COC[C@@H]1N1CCCC1 97179403 HAZBSKDUPBMDMT-PMACEKPBSA-N 382.464 2.645 0 50 GFAA CCc1ocnc1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 91444571 GJHLYPILCNQJIX-UHFFFAOYSA-N 382.464 2.677 0 50 GFAA COc1c(F)cc(-c2cn(CCn3c(C)cc(C)nc3=O)nn2)cc1Cl 91829412 QKTYRMPZHBYKHF-UHFFFAOYSA-N 377.807 2.620 0 50 GFAA CCn1cc(CN2CCC(c3nnc(CN4CCCCCC4)n3C)CC2)cn1 96153452 NTKODJLWAWLMMI-UHFFFAOYSA-N 385.560 2.787 0 50 GFAA O=C(c1cnn(-c2cccc(Cl)c2)c1)N1CCOCC2(CCOCC2)C1 185141338 MCSIPPXSUMXJHN-UHFFFAOYSA-N 375.856 2.795 0 50 GFAA CC(C)n1cnnc1[C@@H](C)NC(=O)c1c(OCc2ccccc2)c(=O)ccn1C 1940197216 ZQWVIHZWTINSKO-OAHLLOKOSA-N 395.463 2.628 0 50 GFAA Cc1cnc(C)c(-c2cccc(C(=O)NCC[C@@H](C)N3CCN(C)CC3)c2)n1 299798978 UAOZTSQEGDDKTR-QGZVFWFLSA-N 381.524 2.516 0 50 GFAA O=C(NC1(C(=O)O)CCCC1)N(CCOc1ccccc1)C[C@@H]1CCCO1 827881125 IEUAMYLEDNYESD-KRWDZBQOSA-N 376.453 2.653 0 50 GFAA OC[C@@H]1CCN(c2ccc3nnc(-c4ccncc4)n3n2)C[C@H]1c1ccccc1 1875307713 SESRGIXBZGCUER-OALUTQOASA-N 386.459 2.789 0 50 GFAA Cc1nnc(C23CC(CN2S(=O)(=O)c2csc(C(F)(F)F)c2)C3)o1 1875393864 NUIPVIKSQLOHTA-UHFFFAOYSA-N 379.385 2.768 0 50 GFAA O=C(c1cc2c(N3CCNCC3)cccc2s1)N1CCC[C@]2(C1)OC[C@@H]1C[C@@H]12 1875394079 UKQPJUCIRCXIPM-GIMINZRKSA-N 397.544 2.952 0 50 GFAA O=C(O)[C@H]1C[C@@H](O)CN1C(=O)CCc1c(-c2ccccc2)[nH]c2ccccc12 1875312879 DUZANTULFOFQDE-DNVCBOLYSA-N 378.428 2.814 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)NC3CCN(Cc4ccccc4F)CC3)n[nH]c21 1875394498 KGFWTZPZEXHDBF-KGLIPLIRSA-N 386.471 2.965 0 50 GFAA CCOc1ccccc1[C@@H](C)N[C@@H]1CCN(c2nc(C(N)=O)nc(C)c2C)C1 1875397750 MHURYILIWZMOMP-HZPDHXFCSA-N 383.496 2.521 0 50 GFAA Cc1cc(-c2ccc(S(=O)(=O)N(C)C[C@@H]3CC(=O)N(C(C)(C)C)C3)o2)on1 952982572 BAOOLCVHTODPDR-ZDUSSCGKSA-N 395.481 2.511 0 50 GFAA COc1ncc(C(=O)NC2(C3CCN(C(=O)CCCC(C)C)CC3)CC2)cn1 1775989993 BNISAYFFBQBFLB-UHFFFAOYSA-N 388.512 2.813 0 50 GFAA CN(C)Cc1ccc(N2CCN(C(=O)c3ccc4c(c3O)CCCC4)CC2)nc1 186373378 GJLAOSNCVGNMKU-UHFFFAOYSA-N 394.519 2.690 0 50 GFAA CN(Cc1nnc[nH]1)C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 172618278 MSBOEVOLXZKNRG-LBPRGKRZSA-N 396.278 2.622 0 50 GFAA COc1ccc(C(C)(C)CNC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)cc1 172908467 ZMMNYZBKBVVTHA-IBGZPJMESA-N 381.476 2.789 0 50 GFAA OC[C@@H]1CCCN(c2cc(NCc3cccnc3OCC(F)(F)F)ncn2)C1 110129170 IBSTVSLIJQXCBZ-CYBMUJFWSA-N 397.401 2.634 0 50 GFAA O=C(NC1CCN(C(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)CC1)C1CC1 195476342 XHOIWMBOMHUOKT-UHFFFAOYSA-N 396.491 2.576 0 50 GFAA Cc1cc(C)n2ncc(CN3CCN4[C@@H](c5ccccc5)COC[C@H]4C3)c2n1 1529172912 SRIBJHPXIYFZEL-NHCUHLMSSA-N 377.492 2.604 0 50 GFAA CC(C)N1C(=O)CO[C@H](C(=O)N2CCc3ccccc3C2)[C@H]1c1ccccc1 1529158385 BLKYLOFMRBLNDT-YADHBBJMSA-N 378.472 2.948 0 50 GFAA CO[C@@H](C(=O)N1CCCN(C(=O)c2cccnc2SC)CC1)c1ccccc1 1704300884 YXTYZLMFEAYDDX-GOSISDBHSA-N 399.516 2.866 0 50 GFAA O=C(Cc1ccccc1)NC[C@@H]1CCC2(CCN(C(=O)c3ccoc3)CC2)O1 11783120 JTRGXBWZCQNWEA-IBGZPJMESA-N 382.460 2.792 0 50 GFAA CC(C)Cn1c(CN(CCO)C(C)C)cnc1S(=O)(=O)Cc1ccccc1 11818038 KQWROOSFBUGBFE-UHFFFAOYSA-N 393.553 2.716 0 50 GFAA CSc1nnc(CNC(=O)[C@H]2CCOC(C)(C)C2)n1-c1ccc(F)cc1 12078030 IGONKDVEXKJREZ-LBPRGKRZSA-N 378.473 2.950 0 50 GFAA COc1ccc(CCN2C[C@H](NCc3ccc(-n4cccn4)cc3)CC2=O)cc1 12454230 AZBNKIPIRWWEHH-HXUWFJFHSA-N 390.487 2.814 0 50 GFAA O=C([C@@H]1CCCN(C2CCN(Cc3ccccc3)CC2)C1)N1CCSCC1 12580971 ZLPHDISBEZUEON-HXUWFJFHSA-N 387.593 2.938 0 50 GFAA CCc1ncc(CN[C@@H]2CC(C)(C)Cc3nc(N4CCC(O)CC4)ncc32)cn1 12718576 REIOUHGJYQWMGJ-GOSISDBHSA-N 396.539 2.593 0 50 GFAA CC(C)S(=O)(=O)c1ncc(CN2CCCCO2)n1CCc1ccccc1 15072944 CBALJHJOEMBDTD-UHFFFAOYSA-N 377.510 2.835 0 50 GFAA O=C(CSc1nc(-c2ccccc2)cc(=O)[nH]1)Nc1ccc2c(c1)OCO2 18163852 OXBOJLBOIHXQEN-UHFFFAOYSA-N 381.413 2.896 0 50 GFAA COCCN1CCN(C(=O)c2csc3nc(-c4cccc(F)c4)cn23)CC1 19595632 ZYYMHQHIGOXUDC-UHFFFAOYSA-N 388.468 2.606 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)Nc1ccn(CCc3ccncc3)n1)CO2 123377077 SVMALFVISPWOEY-KRWDZBQOSA-N 378.432 2.719 0 50 GFAA O=C(N[C@H]1COc2cc(F)c(Br)cc21)c1cnn2c1CCCC2 252484876 GJVZGPZRTKZFPE-ZDUSSCGKSA-N 380.217 2.985 0 50 GFAA Cc1ccccc1C1(C(=O)N2CCN(S(C)(=O)=O)c3ccccc3C2)CC1 362705046 KWUXODHYODJWLS-UHFFFAOYSA-N 384.501 2.835 0 50 GFAA CCOC(=O)C1CCN([C@H]2CC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 18190582 BBUYYEQLPZLOEY-HNNXBMFYSA-N 399.274 2.900 0 50 GFAA CCOC(=O)c1ccn(-c2ccc(NC(=O)N(C)[C@H]3CC[C@@H]3OC)cc2F)n1 932034022 HOQQIOSMPMZHLK-IRXDYDNUSA-N 390.415 2.829 0 50 GFAA COc1ccc(NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1OC 840759 APHUWQJPVHIGRG-UHFFFAOYSA-N 392.477 2.725 0 50 GFAA COc1ccc(OC)c(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(O)cc2)c1 909925 FLXKHQXAGCBRDL-SFHVURJKSA-N 383.404 2.676 0 50 GFAA COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(F)cc2)cc1Cl 1120935 DWDPWPILFUMBRR-UHFFFAOYSA-N 386.832 2.747 0 50 GFAA CCOC(=O)CSc1nc2sc3c(c2c(=O)n1CC)CC(C)(C)OC3 1198692 KYASYDPCOXUDOC-UHFFFAOYSA-N 382.507 2.984 0 50 GFAA Cn1ncc(Cl)c1C(=O)NCCCn1nc(C(F)(F)F)cc1C1CC1 2780690 XAOAGRPQRWMMRP-UHFFFAOYSA-N 375.782 2.986 0 50 GFAA CC(C)(C)OC(=O)N[C@@H](CSCCNC(=O)OCc1ccccc1)C(=O)O 4899646 WOISIWBKIILOSH-AWEZNQCLSA-N 398.481 2.624 0 50 GFAA in-vitro CCOC(=O)C1CCN(C(=O)COCc2cc(-c3ccc(F)cc3)on2)CC1 6876441 YDJIARLABMQDFU-UHFFFAOYSA-N 390.411 2.799 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)Nc1nc(-c2ccccn2)cs1 9658269 GRVNJWDDOACDMK-UHFFFAOYSA-N 377.429 2.944 0 50 GFAA CC(C)CN1CCNC(=O)[C@H]1CC(=O)NC1c2ccccc2-c2ccccc21 11818464 ZZYYVDWNEIINFI-HXUWFJFHSA-N 377.488 2.719 0 50 GFAA CCSc1nnc([C@@H](C)NS(=O)(=O)c2cccc(C(F)(F)F)c2)n1C 12125275 INLRVPQEMNVDJS-SECBINFHSA-N 394.444 2.985 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1cccc3ncccc13)CC2 12149461 BANLHHIJZYMPLN-IBGZPJMESA-N 393.487 2.777 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@](CO)(Cc2cccc(Cl)c2)C1 12717584 WDPKEJJCYDREKG-SFHVURJKSA-N 397.928 2.686 0 50 GFAA Cc1cnc(N2CCC[C@H]2c2nc(-c3cccnc3)no2)nc1-c1ccnn1C 23505286 QUFAOTKAMAJMBU-INIZCTEOSA-N 388.435 2.972 0 50 GFAA O=C(CCn1cnc2ccccc2c1=O)NCCc1nc2ccccc2s1 45570284 MTXJBCJXXKTXHX-UHFFFAOYSA-N 378.457 2.755 0 50 GFAA CC(C)NC(=O)CCN1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 71771863 VYEOTBYUXKRWLS-IBGZPJMESA-N 377.504 2.799 0 50 GFAA CCC[C@@H](C)N1CC2(CCN(C(=O)CCn3nc(C)cc3C)CC2)OC1=O 77535554 ZJOPWEQBNMKJTG-MRXNPFEDSA-N 376.501 2.892 0 50 GFAA CC[C@@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1)n1cccn1 91519242 UMEGZISHOLJPJB-IBGZPJMESA-N 395.507 2.661 0 50 GFAA O=C(O)c1cccc(N2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)n1 95361555 DXWNXAKDRACVHF-UHFFFAOYSA-N 394.475 2.627 0 50 GFAA O=C(c1ccccc1OC1CCN(Cc2ccccn2)CC1)N1CCOCC1 95525176 AFDHUUWUQKMUAC-UHFFFAOYSA-N 381.476 2.597 0 50 GFAA CCNc1ncc(C(=O)N2CCC[C@H](c3nccn3Cc3cscn3)C2)cn1 95528758 YSJDYYFMJZLNHW-AWEZNQCLSA-N 397.508 2.630 0 50 GFAA O=C(NCCCc1ccccc1F)[C@@]12CNC[C@@H]1CN(Cc1ccccc1)C2 96180450 FWJYUMIOSPRPGO-NFBKMPQASA-N 381.495 2.596 0 50 GFAA COc1cccc(N2CCN(C(=O)[C@H]3CCOc4ccccc4C3)CC2=O)c1 97681896 HIBSDRGETAMUNI-KRWDZBQOSA-N 380.444 2.512 0 50 GFAA Cc1nc(N(C)CCN2CCCC[C@H]2C)nc2cc(S(C)(=O)=O)ccc12 106700774 IOWPSRCOURLRMV-CQSZACIVSA-N 376.526 2.652 0 50 GFAA COc1ccc(S(N)(=O)=O)cc1C(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 122077219 VGMFZDCKCSQCSA-QGZVFWFLSA-N 388.489 2.608 0 50 GFAA Cc1cccc2c(CC(=O)N(Cc3cccnc3)[C@@H]3CCS(=O)(=O)C3)c[nH]c12 133877791 UJOABVOONVGSGB-GOSISDBHSA-N 397.500 2.630 0 50 GFAA COc1ccc(CN2CC[C@@H](NC(=O)c3cc4nc(C)ccc4o3)C2=O)cc1 172265861 ZUDUVGHWALARKB-MRXNPFEDSA-N 379.416 2.676 0 50 GFAA CC(C)(C)NC(=O)c1cccc(NC(=O)N2CCN(C3CCOCC3)CC2)c1 175632979 RKLJAWXCQNKKAB-UHFFFAOYSA-N 388.512 2.543 0 50 GFAA CC(=O)N1c2ccc(S(=O)(=O)Nc3nc(C)cc(C4CC4)n3)cc2C[C@H]1C 191807255 BFVMLLMWPBZPBC-GFCCVEGCSA-N 386.477 2.761 0 50 GFAA Cc1oc2ccccc2c1CNC(=O)N1CCC(CN2CCN(C)CC2)CC1 192206853 SYYNCNBPNGWTOL-UHFFFAOYSA-N 384.524 2.910 0 50 GFAA Cn1nccc1CS(=O)(=O)Cc1csc(COc2ccc(F)cc2)n1 194395927 FZQLIRDRXDOMST-UHFFFAOYSA-N 381.454 2.710 0 50 GFAA O=C(c1cccc(CN2CCC(c3ccnn3CCO)CC2)c1)N1CCCCC1 195509517 ISYFLOVKWLXZPH-UHFFFAOYSA-N 396.535 2.881 0 50 GFAA CC(C)C(=O)Nc1ccc2c([C@@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c[nH]c2c1 227186391 MNRWYFOFRIKXGN-PXAZEXFGSA-N 387.436 2.685 0 50 GFAA CCOC(=O)C[C@@H]1C(=O)N[C@@H]2CCCC[C@H]2N1C(=O)Nc1ccc(Cl)cc1 239128678 KPQPVPCXNWMUJO-BZUAXINKSA-N 393.871 2.937 0 50 GFAA O=C(O)c1cccc(NCC2(N3CCN(c4ccccc4)CC3)CCOCC2)n1 263397132 HYDRXWKAWWSQJT-UHFFFAOYSA-N 396.491 2.563 0 50 GFAA Cn1ccnc(N2CCC[C@H](NCc3ccccc3OC3CCCC3)C2)c1=O 275664590 VFPXEZGOGLGKAQ-SFHVURJKSA-N 382.508 2.860 0 50 GFAA Cc1cccc(CNc2ncnc3sc(C(=O)N4CCC[C@H]4CO)c(C)c23)n1 299797186 QAENJIMRJFJZJM-HNNXBMFYSA-N 397.504 2.912 0 50 GFAA Cc1ccc(-n2nnnc2N2CCC3(CC2)C[C@@H]3N(C)Cc2nccs2)cc1 367935293 NHDYHXXOWFJQLM-KRWDZBQOSA-N 395.536 2.918 0 50 GFAA CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)N2CCC[C@H](OC)CC2)c1 376282894 SCQSENRCERKUBV-QAPCUYQASA-N 397.541 2.937 0 50 GFAA Cc1cc(C(F)(F)F)n2ncc(C(=O)N(C)Cc3cc(C4CC4)n[nH]3)c2n1 426438614 KIYPGIUIRVNDCN-UHFFFAOYSA-N 378.358 2.929 0 50 GFAA COC(=O)c1ccc(-c2ccc(C(=O)N3CCN4CCC[C@@H]4C3)cc2)c(O)c1 534670882 UTVBNUWILRUZCY-GOSISDBHSA-N 380.444 2.766 0 50 GFAA CCc1nccn1CCCNS(=O)(=O)c1cccc(OC(F)(F)F)c1 670440455 NCPPKYAOQWNGJZ-UHFFFAOYSA-N 377.388 2.713 0 50 GFAA O=C([C@@H]1CCCO1)N1CCC(NCCCc2nc3ccc(Cl)cc3[nH]2)CC1 825573673 CKSPZLJBNCZVIZ-SFHVURJKSA-N 390.915 2.909 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N[C@H]1CCCN(Cc2ccccc2F)C1 827860876 NBZHVGCSSPXOGT-SFHVURJKSA-N 393.462 2.921 0 50 GFAA C[C@@H](NC(=O)N1CCC[C@](O)(CC(=O)N(C)C)C1)[C@H]1CCCc2ccccc21 888093860 ZYWSUPUYOJJZEF-CDMIOBSGSA-N 387.524 2.510 0 50 GFAA Cc1cnn(CCc2nc(-c3cccc4c3ccn4C)nn2CC(C)(C)O)c1 952871761 AHWAXMMLXCAGKY-UHFFFAOYSA-N 378.480 2.955 0 50 GFAA CCCCS(=O)(=O)N1CCC[C@H](CNC(=O)c2ccc3ccccc3n2)C1 952980689 RPTWQQBHUBHQQR-MRXNPFEDSA-N 389.521 2.807 0 50 GFAA O=C(CCc1nc2ccccc2[nH]c1=O)N1CCC([C@@H](O)c2cccs2)CC1 1506398553 DKTKFWXOSLSIMK-HXUWFJFHSA-N 397.500 2.889 0 50 GFAA Cc1nn(C)c2ncc(C(=O)O)c(N3CCCN(Cc4cccs4)CC3)c12 1529144009 BHWIXVLJXIVYRN-UHFFFAOYSA-N 385.493 2.749 0 50 GFAA CN(C)CC1(CO)CCN(C(=O)c2ccc(N3Cc4ccccc4C3)cc2)CC1 1772705898 KPSCIBAGEYTVHN-UHFFFAOYSA-N 393.531 2.983 0 50 GFAA Cc1coc(C)c1C(=O)N(C)C1CCN(C(=O)CCNC(=O)CC(C)C)CC1 1775997064 TZRLUTZFEHTGJU-UHFFFAOYSA-N 391.512 2.512 0 50 GFAA Cn1cc(C(=O)N2C[C@@H]3CC[C@H](C2)[C@H]3NC(=O)C2CCOCC2)c2ccccc21 1857686262 NTYDWOLJCSYOOD-UPHUGPLXSA-N 395.503 2.572 0 50 GFAA CCN1CCC2(CC1)OCCc1sc(C(=O)NC[C@@H]3CCCOC3)cc12 1857696256 TYVXHPJCLDHYCV-HNNXBMFYSA-N 378.538 2.788 0 50 GFAA CCC(=O)NC[C@H]1[C@H]2CN(Cc3cc4cc(C)ccc4n3C)C[C@]23CC[C@H]1O3 1857710486 ZJLUXVAPICIXSY-KLJZETAQSA-N 381.520 2.992 0 50 GFAA CC(C)=CCN1C[C@@H]2[C@H](CNC(=O)c3ccc4nc[nH]c4c3)[C@H]3CC[C@]2(C1)O3 1857722927 PURQGBUFOLPVKI-VTAPXXACSA-N 380.492 2.738 0 50 GFAA Cc1ccc2nc(SCC(=O)N[C@@H]3C[C@H]4CO[C@@H](C)CN4C3)cc(C)c2c1 1857723753 USGMZKKGOCWYBT-BBWFWOEESA-N 385.533 2.922 0 50 GFAA CSCC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(C)c(F)c3)C[C@]23CC[C@H]1O3 1875239957 BDZUDSOUJRRHQN-IXIUHKBRSA-N 378.513 2.593 0 50 GFAA O=C(NC[C@@H]1CCCN(C[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)C1)c1ccccc1 1875264929 OZUJIHSLKULLRU-FVVMMRJTSA-N 392.543 2.637 0 50 GFAA O=C(NC[C@@H](c1ccccc1)C(F)F)N[C@@H](CCc1ccncc1)C(=O)O 1875291004 LEDVTDYDPXPINH-HOTGVXAUSA-N 377.391 2.816 0 50 GFAA COc1ccccc1C1=CCN(C(=O)C2CCN(c3cc(O)ncn3)CC2)CC1 1875310435 PKXFTAHZNKVQTG-UHFFFAOYSA-N 394.475 2.723 0 50 GFAA CCn1nc2c(c1C(=O)N1CCc3ccnc(N(C)C)c3C1)C[C@H](C)O[C@@H]2C 1875314002 CECGZXDOEFNRTD-UONOGXRCSA-N 383.496 2.585 0 50 GFAA CCC[C@@H](C)N(C)C(=O)c1cncc(-c2cn(-c3cncc(C(=O)O)c3)nn2)c1 1875327569 ZVCYRLVCIFUPGP-CYBMUJFWSA-N 394.435 2.683 0 50 GFAA CCc1cc2c(NC[C@H]3C[C@@H](OC)CN3c3cc(N)ncn3)nc(C)nc2s1 1875341473 USRVOQLRGRXELH-CHWSQXEVSA-N 399.524 2.640 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCC[C@H](n3cccn3)C2)(c2ccccc2)CC1 1875365935 SFPYMIXUJRMKCG-FQEVSTJZSA-N 392.503 2.793 0 50 GFAA O=C(c1cc(O)no1)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100534707 UZQVNIIOMGQEQT-LJQANCHMSA-N 393.443 2.958 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@H]1Cc2cc(Br)ccc2O1)c1nccs1 2325784595 XTPQMLGTBHMVNI-ZYHUDNBSSA-N 397.250 2.541 0 50 GFAA O=C(C[C@@H]1CN(CC2CC=CC2)C2(CCC2)CO1)NC[C@H]1CCCc2nccn21 2325785253 MACVGBYORCFCTO-WOJBJXKFSA-N 398.551 2.857 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3C[C@@H]4CC(=O)N[C@@H]4C3)cc2)c2sccc2n1 2356147365 SRZGETJDLWTHNU-GOEBONIOSA-N 378.457 2.627 0 50 GFAA O=C(Cn1c(=O)oc2ccccc21)Nc1ccc(I)cc1 1071745 QQARNKOYIFMQAL-UHFFFAOYSA-N 394.168 2.838 0 50 GFAA CN1C(=O)c2ccc(NC(=S)NC(=O)c3cc4ccccc4o3)cc2C1=O 1093345 ZZBUMCXKXFZYBU-UHFFFAOYSA-N 379.397 2.785 0 50 GFAA C[C@]1(O)CC2(CCN(C(=O)c3cccc(-c4ccc(F)cc4)c3)CC2)OC[C@@H]1O 2356145664 RLJJIEGFPSSRKU-UNMCSNQZSA-N 399.462 3.000 0 50 GFAA CCOC(=O)c1c(NC(=O)[C@@H]2CCCO2)sc(C(=O)N(CC)CC)c1C 2736897 SMXZARZSSDAHCR-LBPRGKRZSA-N 382.482 2.833 0 50 GFAA Cc1nc(O)nc(C)c1CCC(=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccccc2)C1 2356168836 PGDUVWIJONIRHP-XTQVGHSUSA-N 395.503 2.878 0 50 GFAA COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC(=O)c2ccccc2)cc1 4269610 LPCVKIWIUNFFOA-KRWDZBQOSA-N 382.441 2.872 0 50 GFAA CCNS(=O)(=O)c1ccc(CCC(=O)Nc2ccccc2OCC)cc1 4858718 PUBZYLMJSAVOEQ-UHFFFAOYSA-N 376.478 2.955 0 50 GFAA CC[C@H](C(=O)NCc1cccnc1)n1nc(C)n2c(cc3sccc32)c1=O 4911970 XOVPNCWVQIPPDQ-CQSZACIVSA-N 381.461 2.682 0 50 GFAA CCn1ncc(NC(=O)Cn2ncc3cc(-c4ccccc4OC)ccc32)n1 55255963 OVZRSUURVWWINQ-UHFFFAOYSA-N 376.420 2.962 0 50 GFAA CC(C)(NC(=O)c1cccs1)C(=O)N1CCc2nc[nH]c2[C@H]1c1cccnc1 55226154 ZBIIXAXEGIGHAL-QGZVFWFLSA-N 395.488 2.549 0 50 GFAA O=C(/C=C/c1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1)NCc1ccco1 100938937 BYZGCFBUMIPGGX-CIFLQXQKSA-N 388.423 2.921 0 50 GFAA COc1cccc(CN2CCC[C@@H](NCC(C)(C)CN3CCOCC3)C2)c1 23373147 MKOWBGCIUWBFDJ-HXUWFJFHSA-N 375.557 2.608 0 50 GFAA O=S(=O)(c1cc(Cl)cc2c1OCC2)N1C[C@@H](CO)[C@@H](c2ccsc2)C1 328615719 YXHARBWHWOJXQX-DZGCQCFKSA-N 399.921 2.733 0 50 GFAA CCN(Cc1c(F)cccc1Cl)C(=O)c1cn(C[C@H]2CCCNC2)nn1 67587813 SAWOBYXJVZRSLS-ZDUSSCGKSA-N 379.867 2.733 0 50 GFAA O=C(c1ccncn1)N1CCOc2c(O)cc(-c3ccc(Cl)cn3)cc2C1 67673135 VSGNHNQWIINVHU-UHFFFAOYSA-N 382.807 2.932 0 50 GFAA Cc1cc(C)n(NC(=O)[C@@H](C)n2nc(C(F)(F)F)c(Cl)c2C)c(=O)c1 2786257 AGTCSWBFXINFPM-SNVBAGLBSA-N 376.766 2.974 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cnn(Cc3cccc(Cl)c3)c2)c(C)n1 2793295 BFTPXJBWWNIGCZ-UHFFFAOYSA-N 379.873 2.910 0 50 GFAA C[C@H]1C[C@H](NS(=O)(=O)c2cc(Cl)c(Br)s2)CCN1C 123818105 GERDQMKLTKEWJC-JGVFFNPUSA-N 387.752 2.925 0 50 GFAA Cc1c(C(=O)N2CCO[C@H](CC(=O)O)C2)cnn1-c1cccc(C(F)(F)F)c1 237761327 KESTUDJPQXXUCF-CQSZACIVSA-N 397.353 2.515 0 50 GFAA CCn1cc([C@@H]2CN(C(=O)Nc3ccc(N4CCCC4=O)cc3)CCO2)cn1 252498899 RPJHZXVETKNXFD-SFHVURJKSA-N 383.452 2.635 0 50 GFAA CCN(CC)C(=O)CN1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 71753374 VCQGBLQMRRJHCF-LJQANCHMSA-N 377.504 2.753 0 50 GFAA O=C(c1cc(F)cc2nc(S)[nH]c12)N1CCC([C@@H](O)C(F)(F)F)CC1 131648444 UFAFSLBSNKSWKB-GFCCVEGCSA-N 377.363 2.766 0 50 GFAA O=C(c1cc(N2CCNC2=O)ccc1F)N1CC(Cc2ccc(F)c(F)c2)C1 370310994 CIPCEFBXODDARR-UHFFFAOYSA-N 389.377 2.948 0 50 GFAA O=C(Nc1cccc(C(=O)N[C@H]2COc3ccccc3[C@@H]2O)c1)c1cccnc1 378142010 WPRPDLJNZZPMEE-ICSRJNTNSA-N 389.411 2.558 0 50 GFAA CC(C)Nc1cc(N2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)ncn1 72429244 ZYKWMPLCJPNFJM-MRXNPFEDSA-N 391.466 2.648 0 50 GFAA O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCC(n2cncn2)CC1 194711733 GDSRWDSGTCIWBG-UHFFFAOYSA-N 390.369 2.960 0 50 GFAA CCCc1nc(CN(CC)C(=O)N[C@H](C)c2nc(-c3ccncc3)no2)no1 426530744 DSTDSBMSIUISCJ-GFCCVEGCSA-N 385.428 2.760 0 50 GFAA COc1ccc2cc(C(=O)N3CCN(c4ccc(C)cc4)C(=O)C3)n(C)c2c1 82121100 BCYQQXQIJYNEQL-UHFFFAOYSA-N 377.444 2.984 0 50 GFAA C[C@@H](Nc1nc(N2CCN(CCO)CC2)nc2ccccc12)c1ccccc1 96439036 IRFLIWQODBUWBU-QGZVFWFLSA-N 377.492 2.917 0 50 GFAA COCCN(Cc1ccncc1)C(=O)Nc1cccc(N2CCN(C)C2=O)c1 95526656 CALYHHPAOKEETK-UHFFFAOYSA-N 383.452 2.634 0 50 GFAA Cc1ccc([C@H](CCO)NC(=O)c2cnc(-c3cccc(C)c3)[nH]c2=O)cc1 91679173 FZDIDFQNVCWHBY-IBGZPJMESA-N 377.444 2.907 0 50 GFAA O=C(Nc1ccnn1Cc1ccccn1)N1CCC(OC[C@H]2CCCCO2)CC1 181152459 MQZMKKHPHVSFON-LJQANCHMSA-N 399.495 2.908 0 50 GFAA COc1ccccc1[C@H]1CNC(=O)c2nc(CSc3nccn3C)[nH]c2C1 95385567 MAUIFSQHEIACES-GFCCVEGCSA-N 383.477 2.514 0 50 GFAA C[C@@H](NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1cc(F)cc(F)c1 95372212 BRRHTOBRFYCOOK-LLVKDONJSA-N 380.416 2.897 0 50 GFAA Cc1cnc(C)c(N2CCN(C(=O)Nc3ccc(-n4ccnc4)cc3)CC2)n1 95506538 MTJVTTWSDDLRNG-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA Cc1nc(N2CCN(c3nc4ccccc4s3)CC2)cc([C@H]2C[C@@H](O)C2)n1 252551023 TUYGSLQKLQWNAU-GASCZTMLSA-N 381.505 2.960 0 50 GFAA CC(C)(CN1CCCCCC1)NC(=O)N1CCN(C(=O)c2ccccc2)CC1 534670796 ZGIPUSTVHNSWNJ-UHFFFAOYSA-N 386.540 2.809 0 50 GFAA O=C(N[C@@H]1C2CN3CCN(C2)CC1(c1ccccc1)C3)c1ccc2ncccc2c1 670450642 XYMQRRCPRXFXBT-JKJRPBHFSA-N 398.510 2.532 0 50 GFAA CC(C)=CC(=O)NCc1cn([C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)nn1 1875282098 MOGRKCYKAJQPGD-MRXNPFEDSA-N 391.834 2.631 0 50 GFAA C[C@@H](C(=O)N1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1)S(N)(=O)=O 1875283141 HNKUJTBIWXYKHU-YVEFUNNKSA-N 378.881 2.643 0 50 GFAA Cc1cc(NC(=O)Cn2cnc3cc(F)c(C)cc3c2=O)n(-c2ccccc2)n1 1875259060 SNEWREDCTTYRHE-UHFFFAOYSA-N 391.406 2.977 0 50 GFAA COC(=O)[C@@H](NS(=O)(=O)c1ccc2c(c1)Cc1ccccc1-2)C(F)(F)F 1875333270 LPYBYGIMUIZVGM-OAHLLOKOSA-N 385.363 2.640 0 50 GFAA Cc1nc(C(=O)N2CCc3sc(CN)nc3C2)nn1-c1ccccc1C(C)C 1331402896 DXFRQOJFXUSTJC-UHFFFAOYSA-N 396.520 2.813 0 50 GFAA Cn1c(Cc2ccncc2)nnc1N1CCC(n2c(O)nc3ccccc32)CC1 1355335691 NFBYTLAZEMLEEV-UHFFFAOYSA-N 389.463 2.698 0 50 GFAA Cc1cccc(-c2nnc([C@H]3CC(=O)N(c4ccc5c(c4)OCCO5)C3)o2)n1 1326363365 QMRUTOUTNOALFU-ZDUSSCGKSA-N 378.388 2.732 0 50 GFAA Cn1ccnc1Sc1ccc(NC(=O)[C@@H]2CC23CCS(=O)(=O)CC3)cc1 188122140 AWCSWNONXWHOTC-HNNXBMFYSA-N 391.518 2.725 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCO[C@H]1c1ccnn1C)c1ccc(Br)cn1 225434954 LGMGIXMZQQQAGV-JVLSTEMRSA-N 379.258 2.533 0 50 GFAA Cc1ccc(C(=O)N2CCN([C@@H]3CCc4ccccc4NC3=O)CC2)cc1F 191950762 DLPQKSIVNYSDCH-HXUWFJFHSA-N 381.451 2.845 0 50 GFAA COc1cccc(C2CCN(C(=O)CNC(=O)Cc3cccc(F)c3)CC2)c1 194784169 XVTFWMWMNMCSKA-UHFFFAOYSA-N 384.451 2.899 0 50 GFAA COc1cccc(-c2ncc(CN3C[C@@H](O)[C@H](Cc4cc(C)[nH]n4)C3)s2)c1 1529167863 PTVUWCJZTKAUFS-DNVCBOLYSA-N 384.505 2.886 0 50 GFAA COc1ccc(CNC(=O)C2CCN(c3ncc(C(C)=O)c(C)n3)CC2)cc1 1704311753 BQYANYWWZAGCLU-UHFFFAOYSA-N 382.464 2.529 0 50 GFAA Cc1cc(C[C@@H]2CN(Cc3cccc(OCCN4CCCCC4)c3)C[C@H]2O)n[nH]1 1704354004 QULLAFPLIDPVOI-NFBKMPQASA-N 398.551 2.618 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(C(=O)NC(C)C)C[C@]2(CCc2ccccc2)C1 1772808004 DXUXSRXSUCQVMN-KNQAVFIVSA-N 387.524 2.534 0 50 GFAA CC(C)N(C[C@H]1CCC(=O)N1)C(=O)c1cc(COc2ccc(F)c(F)c2)on1 11874309 NHDMOHPALHSBOC-GFCCVEGCSA-N 393.390 2.661 0 50 GFAA Cc1cccc(CC(=O)N2CCC(=O)N(Cc3cn4cccc(C)c4n3)CC2)c1 11911883 AHUYXMDPPJSITI-UHFFFAOYSA-N 390.487 2.755 0 50 GFAA COc1ccc(-c2noc(CN(C)CC3CCOCC3)n2)c(OC)c1OC 12297152 JSXIHCANKPTUBO-UHFFFAOYSA-N 377.441 2.621 0 50 GFAA COCCN1C[C@H](CNc2nncc(-c3ccc4ccccc4c3)n2)CC1=O 12590588 OCYDMTVINGLICA-HNNXBMFYSA-N 377.448 2.599 0 50 GFAA Cc1nn(C)cc1CN(C)C(=O)c1cc(COc2ccc(F)cc2F)on1 12755960 KKIYWOXDRGDPCJ-UHFFFAOYSA-N 376.363 2.846 0 50 GFAA COc1cc(CC[C@@H](O)C[C@H](O)CCc2ccc(O)c(OC)c2)ccc1O 13377891 OELMAFBLFOKZJD-IAGOWNOFSA-N 376.449 2.792 0 50 GFAA biogenic,in-vitro CCOc1ccc(N2C(=O)C[C@H](N3CCC(N4CCCCC4)CC3)C2=O)cc1 19533460 YSABIJDLIQPKRJ-FQEVSTJZSA-N 385.508 2.668 0 50 GFAA CN(Cc1nc(-c2ccoc2)no1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 155617610 GXLJKJMBETVHIC-CYBMUJFWSA-N 379.825 2.943 0 50 GFAA O=C(c1ccc(Cl)c(O)c1)N1CCN2C(=O)OC[C@]2(Cc2ccccc2)C1 1857678245 KARMCSXJERBNIV-FQEVSTJZSA-N 386.835 2.935 0 50 GFAA CCc1nc(CNC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)no1 1857709336 RQWAKXCFHYDMKR-NSHDSACASA-N 389.843 2.959 0 50 GFAA O=C([C@@H]1CCCNC1)N1CCC2(CCc3c(O)nc(-c4ccccc4)nc32)CC1 1857720145 GMUGTRKCIPPASM-QGZVFWFLSA-N 392.503 2.655 0 50 GFAA O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1875243017 LODIZVIZXXDNGK-IFMALSPDSA-N 388.471 2.975 0 50 GFAA Cc1cccnc1N1C[C@@H]2[C@H](CNC(=O)c3cccc(F)c3)[C@H]3CC[C@]2(C1)O3 1875246683 FFFZJXDHPNJHAU-JZJXAQOMSA-N 381.451 2.943 0 50 GFAA COc1ccc(CCC(=O)N2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2ccccn2)cc1 247917351 MZPHAEJZRQMITA-QUCCMNQESA-N 393.487 2.672 0 50 GFAA O=S(=O)(c1ccc(C(F)(F)F)cc1Cl)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 249515216 IWVVWAVDNJYPHA-OWWTVDFTSA-N 381.803 2.749 0 50 GFAA CC(=O)N1CCCN(c2ccc(F)cc2NC(=O)[C@@H](F)C(F)(F)F)CC1 816527999 IIMCJNQQCAKASP-CQSZACIVSA-N 379.329 2.723 0 50 GFAA CS(=O)(=O)N1CC[C@@]2(C1)C(=O)N(C/C=C/c1ccccc1)c1ccccc12 2100534457 JIFAMDLHSDBXKL-CLNPQZTCSA-N 382.485 2.650 0 50 GFAA CSc1ccc2ncnc(N3CCC4(CC3)C[C@H](O)c3nn(C)cc3O4)c2c1 2325775987 ZKTNEWPGLBNYRX-INIZCTEOSA-N 397.504 2.940 0 50 GFAA O=C(Nc1c[nH]nc1-c1cnccn1)c1ccc2c(Br)cnn2c1 2325840471 BIZKIYZWTUMPQD-UHFFFAOYSA-N 384.197 2.529 0 50 GFAA O=C(Nc1cnn(Cc2ccc(Cl)c(Cl)c2)c1)c1nc2ncccn2n1 924028 SMTJESATASERRK-UHFFFAOYSA-N 388.218 2.928 0 50 GFAA COc1ccc([C@H](C)NC(=O)c2cc3ncc(Br)cn3n2)cc1 2794506 DHWACCWQLJYRRY-JTQLQIEISA-N 375.226 2.991 0 50 GFAA CCN1CCN(C(=S)c2ccc(OCC(=O)NCc3ccccc3)cc2)CC1 5041292 IFUYIHTXPMRRFI-UHFFFAOYSA-N 397.544 2.695 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCC[C@H](OCc2ccccn2)C1 11665364 MQXUACXIKHOIJL-SFHVURJKSA-N 395.438 2.682 0 50 GFAA COc1ccc2c(C)nc(N3CCC[C@@H](C(=O)NCC(F)(F)F)C3)nc2c1 11786958 NERVBYBSAVRBRN-GFCCVEGCSA-N 382.386 2.842 0 50 GFAA Cc1cc(C)c(NC(=O)CSc2nc(C)c(CCO)c(=O)[nH]2)c(Cl)c1 11905802 DJSNOIVTNBPOOZ-UHFFFAOYSA-N 381.885 2.614 0 50 GFAA CC(C)N(C[C@@H]1CCC(=O)N1)C(=O)c1cc(Cn2ccc3ccccc32)[nH]n1 12300937 VCYUSLBFTPNBJO-INIZCTEOSA-N 379.464 2.542 0 50 GFAA Cn1ncc2c(NC(=O)c3cc4c(C(F)(F)F)nn(C)c4s3)ncnc21 20608237 ZTYZBAMZOFYTOB-UHFFFAOYSA-N 381.343 2.583 0 50 GFAA CCOc1ccc(CN2CCN(Cc3cn(CC)nc3C)C[C@@H]2CCO)cc1 22932917 IVWUYTVSAJWEBD-NRFANRHFSA-N 386.540 2.679 0 50 GFAA COc1ccc(CCNC(=O)c2cn3c4c(cccc4c2=O)CC3)cc1OC 33088725 UPUCDFIEFXBNEF-UHFFFAOYSA-N 378.428 2.547 0 50 GFAA biogenic CC1(C)[C@H](C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C[C@H]2[S@]1=O 34575448 AZIUCAWYSMPKQK-QZXAKIBKSA-N 383.469 2.787 0 50 GFAA C[C@@H]1CCN(C(=O)C2=CC(c3ccco3)=NS(=O)(=O)N2C)[C@@H]2CCCC[C@H]12 35312645 RERZDHKTOIPMBG-IIAWOOMASA-N 391.493 2.570 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(C(=O)c3ccccc3SC)C2)CC1 55108253 FLKNJTIDGZBRER-INIZCTEOSA-N 391.537 2.787 0 50 GFAA CC[C@H]1C(=O)N(C)CCN1Cc1ccccc1-c1nc2c(c(=O)[nH]1)CCCCC2 63884481 SKGIMRCBOTUOGZ-FQEVSTJZSA-N 394.519 2.758 0 50 GFAA COCCn1cnnc1CCn1cnc(-c2ccccc2)c1-c1c[nH]c(C)n1 65397521 OKCJIGSGMBVDJN-UHFFFAOYSA-N 377.452 2.729 0 50 GFAA CS(=O)(=O)Nc1ccc2c(c1)NC(=O)C[C@H]2c1coc2ccccc2c1=O 65428750 CFXKSJCTNUGOSW-CQSZACIVSA-N 384.413 2.639 0 50 GFAA CC(C)N(C)C[C@@H](C)C(=O)N1CCc2onc(-c3ccc4c(c3)OCO4)c2C1 67641915 UMAYRYYQJKHKPK-CQSZACIVSA-N 385.464 2.931 0 50 GFAA Cc1ccc(O)c(C(=O)N2CCC[C@H](c3n[nH]c(=O)n3-c3ccccc3)C2)c1 67896230 YCIKCYRSIBAYBL-HNNXBMFYSA-N 378.432 2.594 0 50 GFAA CCc1ccc(-c2cn3c(C(=O)N[C@H]4C=CS(=O)(=O)C4)csc3n2)cc1 67965575 TZQFHTOVZLMYTJ-AWEZNQCLSA-N 387.486 2.666 0 50 GFAA Cc1nc(NCCNC(=O)c2c(F)cccc2F)cc(-n2cnc(C)c2C)n1 77134177 NNLZPIBACRPYPL-UHFFFAOYSA-N 386.406 2.708 0 50 GFAA O=C1CCC2(CCN(C(=O)[C@@H](O)c3ccccc3)CC2)CN1Cc1ccncc1 91586547 PHOAGPNNYILMME-NRFANRHFSA-N 393.487 2.546 0 50 GFAA C[C@@H](N)C(=O)N1CCC(CCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 95508844 AKBVNLZZPCEIHD-GOSISDBHSA-N 385.552 2.834 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(c4cccc(Cl)c4)C(=O)[C@@H]3N3CCCN23)cc1 138542013 VFAYVFVUCGRBEL-IPMKNSEASA-N 397.862 2.884 0 50 GFAA O=C(Cc1cnn(-c2ccccc2)c1)N[C@@H](CN1CCOCC1)c1ccccc1 144160515 YVDQXQBTGLWKSN-QFIPXVFZSA-N 390.487 2.605 0 50 GFAA CC[C@@H]1CN(C(=O)NCC(F)(F)F)C[C@@H]1c1cnc2cnc3[nH]ccc3n12 147180128 WYQFJHHDOKWSHR-MNOVXSKESA-N 380.374 2.908 0 50 GFAA in-man CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C[C@H]1CCCCO1 154496568 OAUJLBKSHWROTF-MRXNPFEDSA-N 380.510 2.565 0 50 GFAA CCNC(=O)c1cccc(NC(=O)CN2CC[C@@H](c3ccccc3OC)C2)c1 158031046 ZLNMUAHNSFCJLE-QGZVFWFLSA-N 381.476 2.873 0 50 GFAA O=C(c1cc(F)ccc1F)N1CCC(c2n[nH]c(=O)n2-c2ccccc2)CC1 169779713 DXCPUCFRNSGTCM-UHFFFAOYSA-N 384.386 2.859 0 50 GFAA CC(C)c1nn(-c2ccccc2)cc1CN[C@H]1CCCC[C@@H]1NS(C)(=O)=O 170085059 XWFUAFXVIYPJLR-OALUTQOASA-N 390.553 2.946 0 50 GFAA COc1cc(C(=O)OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc(OC)c1C 170594561 VLHYHAACEPYYSA-HNNXBMFYSA-N 395.452 2.805 0 50 GFAA CCOC(=O)[C@@H](COC)N(C(=O)/C=C/c1c(Cl)nc2sccn12)C1CC1 170607477 NAVQGBMKELNWHC-KTRBRXNASA-N 397.884 2.632 0 50 GFAA C[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cccc(-n2ccnc2)c1 175054868 BCFJHZZVDSTNBB-MRXNPFEDSA-N 376.464 2.756 0 50 GFAA COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NC[C@@H]2CCCN2)cc1 178775626 RITHHXIRNUGXHM-IBGZPJMESA-N 390.487 2.959 0 50 GFAA COc1ccccc1COC1CCN(C(=O)c2cnc3sccn3c2=O)CC1 180293148 ZBIIPCXQQYZAGJ-UHFFFAOYSA-N 399.472 2.586 0 50 GFAA CCS(=O)(=O)C1CCN(CC(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1 193247247 OGIDVUMQIUSZFI-NRFANRHFSA-N 392.565 2.933 0 50 GFAA C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1CCC[C@H](c2ccnc(N)n2)C1 225674265 MUPOAQNQOQBHTP-PTLNDYHLSA-N 383.540 2.712 0 50 GFAA CCc1ccc(Cn2nnc(C(=O)NC[C@H](O)c3cccc(F)c3)c2C)cc1 242047904 VRAKPZRJWQOSBY-IBGZPJMESA-N 382.439 2.800 0 50 GFAA Cc1nc2c3c(F)cccc3nn2c(O)c1CCC(=O)NCC1CCOCC1 252549703 RSLBNOGMQIFBEO-UHFFFAOYSA-N 386.427 2.511 0 50 GFAA COc1ccc(P2C[C@H]3C[C@H]2CN3S(=O)(=O)c2ccc(C)cc2)cc1 257373230 RMFZMNUGIFSNIE-YNPWLRABSA-N 375.430 2.956 0 50 GFAA C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccnc(-n2ccnc2)c1 267482503 VELUGSFGGNTOHP-YLJYHZDGSA-N 375.476 2.908 0 50 GFAA O=C([C@@H]1CC12CCCC2)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 329393411 USOOAKSFEYCKRH-ROUUACIJSA-N 388.533 2.950 0 50 GFAA Cn1cc([C@H]2CN(C(=O)Nc3nc4c(s3)CCC4(C)C)C[C@@H]2C(=N)O)cn1 333510335 JAJQLFSKYIGVQJ-NEPJUHHUSA-N 388.497 2.883 0 50 GFAA CN(C)c1cnc(-c2noc([C@@H]3CCC(=O)N(C)[C@@H]3c3ccccc3)n2)cn1 350541860 BKOOHMOXZIBIFM-RDTXWAMCSA-N 378.436 2.670 0 50 GFAA COc1cccc(OC[C@@H]2CCCN(C(=O)NCCCN3CCCC3)C2)c1 426627693 LXLWJVTVALRHOL-GOSISDBHSA-N 375.513 2.982 0 50 GFAA O=C(Cn1nc(Cc2ccccc2)c2ccccc2c1=O)NC[C@@H]1CCCCO1 426661188 GLNFYHDWWQVORM-SFHVURJKSA-N 391.471 2.673 0 50 GFAA CCN(CC)[C@@H](CNC(=O)N1CCC(O)(c2cccnc2)CC1)c1ccco1 534578496 BFWZXWUQHAEJGZ-SFHVURJKSA-N 386.496 2.751 0 50 GFAA COC(=O)C1CC2(C1)CN(C(=O)NCc1ccc3ccccc3c1)C[C@H]2C(=O)O 898814744 COCLZIRIMAQDBQ-DKTYTTGXSA-N 396.443 2.635 0 50 GFAA N[C@@H]1CCCCCC[C@@H]1C(=O)N1CCC(c2nccc(-c3cncnc3)n2)CC1 952894174 MRYVULVLPAYMLK-RBUKOAKNSA-N 394.523 2.937 0 50 GFAA C[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H](CC(=O)O)C(=O)N1 958528069 TXUUSELCFZFGJP-DJJJIMSYSA-N 394.427 2.599 0 50 GFAA Cc1noc(C)c1C(=O)N1CCC(CNC(=O)c2ccc3c(c2)CCCO3)CC1 1506399033 WUTHCGIKZOTHEQ-UHFFFAOYSA-N 397.475 2.899 0 50 GFAA CC(C)Oc1cccc(CN2C[C@H]3COC[C@@H]2CN(C(=O)c2cc[nH]c2)C3)c1 1704325808 RWJJFNGGYBBDOY-QUCCMNQESA-N 383.492 2.775 0 50 GFAA CC(C)Cc1nc([C@@H](C)n2cnc3ccccc3c2=O)n(-c2ccnn2C)n1 1772814911 UQQMSZUZTFKORF-CQSZACIVSA-N 377.452 2.519 0 50 GFAA Cc1nn(-c2ccccc2)cc1CN1CCCN(C(=O)C2CCOCC2)CC1 1775980358 ZLERSBPBCFBEBS-UHFFFAOYSA-N 382.508 2.642 0 50 GFAA CCCC1(C(=O)NC[C@]2(C)CN(C(=O)c3cnn(C(C)C)c3)CCO2)CCC1 1775993118 ZRLIYODVXSXNHQ-HXUWFJFHSA-N 390.528 2.782 0 50 GFAA Cc1ccc2nc(C(=O)N3CCO[C@@H](CN(C)C)[C@@H]3c3ccccc3)c(F)n2c1 1857723786 WUAVEHLTLQQPKH-PXNSSMCTSA-N 396.466 2.926 0 50 GFAA C[C@H](NC(=O)N1CCS(=O)(=O)C[C@H](C)C1)c1ncc(-c2ccc(F)cc2)o1 1875301138 BGYVCNGPSVCJFA-OLZOCXBDSA-N 395.456 2.618 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCc2cc3cc(Br)ccc3[nH]2)CC1 2325883865 NEWBMXYMDZFRBY-UHFFFAOYSA-N 390.281 2.971 0 50 GFAA Cc1c(NS(=O)(=O)c2cccc3cccnc23)c(=O)n(-c2ccccc2)n1C 639793 SPXHFUGRVINCDQ-UHFFFAOYSA-N 394.456 2.833 0 50 GFAA CCOC(=O)CCc1c(C)c2ccc(OCC(=O)OC(C)C)cc2oc1=O 1118255 VNJWUIJOBWTVTM-UHFFFAOYSA-N 376.405 2.928 0 50 GFAA biogenic O=C(CCN1C(=O)c2ccccc2C1=O)Nc1ccccc1C(=O)N1CCCC1 1210945 GJZBEUWEUHWVRQ-UHFFFAOYSA-N 391.427 2.547 0 50 GFAA COc1ccc(N2C(=O)N(c3ccc(Cl)cc3)[C@H]3CS(=O)(=O)C[C@H]32)cc1 4475671 CESBMHZTHWVGEY-DLBZAZTESA-N 392.864 2.961 0 50 GFAA COc1cc(C=O)cc(Cl)c1OS(=O)(=O)c1ccc(NC(C)=O)cc1 4618062 JIRKKANIFRTECT-UHFFFAOYSA-N 383.809 2.887 0 50 GFAA COC(=O)CN1C(=O)S/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)C1=O 4873028 XHMQLKBVYZMWMH-RIYZIHGNSA-N 387.369 2.854 0 50 GFAA Cc1c(NC(=O)c2ccc(N3CCOCC3)cc2)c(=O)n(-c2ccccc2)n1C 7504767 QWYUVRLSIUMELI-UHFFFAOYSA-N 392.459 2.573 0 50 GFAA COC(=O)c1ccc(CN(C)Cc2nnc(SC)n2C[C@@H]2CCCO2)cc1 55052964 AIGNRDUZYYGIEO-INIZCTEOSA-N 390.509 2.598 0 50 GFAA Cc1ccc(OC2CCN(S(=O)(=O)c3c(C)nn(C)c3Cl)CC2)cc1 116903384 HUKSKLPHAFYRMC-UHFFFAOYSA-N 383.901 2.922 0 50 GFAA Cc1ccc2[nH]c(C(=O)N3CCC[C@@H](Cn4cc(C(=O)O)nn4)C3)c(C)c2c1 67673145 DBDFHEFLMGVWNT-CQSZACIVSA-N 381.436 2.627 0 50 GFAA CCn1nnnc1-c1cccc(NC(=O)N2CCC[C@@H](n3cc(C)cn3)C2)c1 173446733 ALNHBVNJAIJCPT-QGZVFWFLSA-N 380.456 2.734 0 50 GFAA CN(Cc1cccc(CS(N)(=O)=O)c1)C(=O)c1cc2ccccc2cc1O 328596735 WQBFATMQTWFSKK-UHFFFAOYSA-N 384.457 2.606 0 50 GFAA O=C(c1cn([C@H]2CCOC2)nn1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 330092722 QYMVOLZNLUJLEZ-AAEUAGOBSA-N 397.262 2.840 0 50 GFAA CC(C)C[C@@]1(CO)CCCN1CC(=O)NCCc1nc2ccccc2s1 252482624 DLHWZOCCUNDBRL-HXUWFJFHSA-N 375.538 2.828 0 50 GFAA CCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1ccc(Cl)c2ncccc12 157050198 TVCAKXVTTWCKFK-CYBMUJFWSA-N 391.884 2.856 0 50 GFAA O=C(N[C@@H]1COCC[C@H]1Oc1ccccn1)c1cn[nH]c1-c1cccc(F)c1 221453899 XZLGYISCEQUROD-IAGOWNOFSA-N 382.395 2.577 0 50 GFAA CC[C@@H](O)c1cc2n(n1)CCN(Cc1ccc(OC)c(Cn3cccn3)c1)C2 221435004 ZRZSBAXGEKRMAP-HXUWFJFHSA-N 381.480 2.596 0 50 GFAA Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)Nc2ccc(CN)cc2)cc1 131728974 DZQJKCVYDDDYJI-LJQANCHMSA-N 389.521 2.785 0 50 GFAA CC(C)c1scnc1C(=O)N[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 291038662 YZJPVQCVBVJRGJ-GFCCVEGCSA-N 399.563 2.911 0 50 GFAA COc1ccccc1-c1csc(C2CCN(C(=O)c3ncn(C)n3)CC2)n1 291085043 PVELAZHKIXTOCE-UHFFFAOYSA-N 383.477 2.967 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)N4CCC[C@@H](N)C4)csc3C2)nc1 426433649 LRFYGYIQABMQAZ-MRXNPFEDSA-N 384.549 2.827 0 50 GFAA Cc1cc(O)c2cccc(C(=O)N3CCC[C@@H](C(=O)c4nccn4C)C3)c2n1 426489832 ACMNINBWYUSBHR-CQSZACIVSA-N 378.432 2.717 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3ccc(-c4cc[nH]n4)o3)C2)N1Cc1ccccn1 95523089 VIRQXSUSKNZZJL-DOTOQJQBSA-N 377.448 2.688 0 50 GFAA C[C@H](C(=O)N1CCCC1)N1CCC2(CCC(=O)N(CCc3ccccc3)C2)CC1 91474581 WAWADARTSBAUMZ-HXUWFJFHSA-N 397.563 2.945 0 50 GFAA CN(Cc1ccccc1)[C@H](C(=O)O)c1ccc(NC(=O)N2CCOCC2)cc1 95383628 CZXMGJIPCPEWGI-IBGZPJMESA-N 383.448 2.808 0 50 GFAA COCCN(C)C[C@@H]1CN(C(=O)c2cccc(-c3ccccc3)c2)C[C@@H]1CO 92003852 VQXHXBOLGLCTGG-FGZHOGPDSA-N 382.504 2.612 0 50 GFAA CN(C)C(=O)c1ccc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)nc1 95519520 RQVKDGDOBIBFEE-LJQANCHMSA-N 390.491 2.807 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)Nc1ccc(Cl)cc1Cl 239425681 UZTJJCITPDODGP-YCBBYDHLSA-N 391.254 2.985 0 50 GFAA Cc1cccc(CN2CCN(C(=O)c3cccc([C@@H]4CCCNC4)c3)CC2=O)c1 95382357 XIJYWSPVMWEYSQ-JOCHJYFZSA-N 391.515 2.947 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@H]1CC12CCN(C(=O)NC[C@H]1CCCO1)CC2 298246094 YBMSOGBAJCHMKX-MSOLQXFVSA-N 391.537 2.840 0 50 GFAA Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1NC(=O)Cc1c[nH]c2ccccc12 266370214 RHRXETRAYWTBBT-OAHLLOKOSA-N 386.477 2.522 0 50 GFAA CS(=O)(=O)N1CCC(c2nnc3sc(-c4cccc(Cl)c4)nn23)CC1 825591140 QSWFCKGYOUOTTQ-UHFFFAOYSA-N 397.913 2.645 0 50 GFAA O=C1C[C@H](C(=O)N2CCCN(C3Cc4ccccc4C3)CC2)C2(CCCC2)O1 828244553 MZEMESPBRYNRTI-HXUWFJFHSA-N 382.504 2.564 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2csc(CN(C)C)n2)cc1Cl 952968764 NQUIPVNRXHLCKP-UHFFFAOYSA-N 382.873 2.695 0 50 GFAA N[C@H]1CC[C@@H](n2cc(C(=O)Nc3ccc(OC[C@H]4CCCCO4)cc3)nn2)CC1 952988702 RQXAOHMZENDNSN-HHXXYDBFSA-N 399.495 2.921 0 50 GFAA Cc1ccc(F)cc1CC(=O)N1C[C@@H]2CC[C@H]1CN(C(=O)c1ccccn1)C2 1565513259 KOMFWZPSVLCURD-APWZRJJASA-N 381.451 2.835 0 50 GFAA O=S(=O)(c1cnn(CC(F)F)c1)N(Cc1ccccc1)CC1CCOCC1 186978867 DCXKITSMBCFQRJ-UHFFFAOYSA-N 399.463 2.766 0 50 GFAA CC(C)c1noc(C2CCN(C(=O)CCc3nc4ccccc4[nH]c3=O)CC2)n1 1506402433 OWBWAPLVQJJRGS-UHFFFAOYSA-N 395.463 2.768 0 50 GFAA O=C1CC[C@@H](CN(Cc2ccncc2)C(=O)c2cc(-c3ccccc3F)[nH]n2)N1 1506409864 AITZSZGVAKOSOB-HNNXBMFYSA-N 393.422 2.532 0 50 GFAA COc1cc(-c2onc(N[C@H](C(=O)N(C)C)C(C)C)c2C(=O)O)ccc1F 1704314453 QWYMKYVOTPZUHH-AWEZNQCLSA-N 379.388 2.712 0 50 GFAA CC[C@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC 4097968 DAXYUDFNWXHGBE-KAXDATADSA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro COC[C@H](C)N1CCC(Oc2ccc(C(=O)NCc3ccncc3)cc2)CC1 12203882 WOLUIVUGDGUYQZ-KRWDZBQOSA-N 383.492 2.890 0 50 GFAA CS(=O)(=O)c1ncc(CN2CCCC[C@@H]2CCCO)n1CC1CCCCC1 12445341 NNKSIZYVUNZZPE-GOSISDBHSA-N 397.585 2.994 0 50 GFAA Cc1cnnn1-c1ccc(NC(=O)c2nnn(-c3ccc(F)cc3)c2C)cc1 13720942 VIUMFBFSZWNUJO-UHFFFAOYSA-N 377.383 2.856 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2F)CCCN(C(=O)C2CCOCC2)C1 14971946 ODEYBUAWZNJDDK-OAQYLSRUSA-N 377.456 2.967 0 50 GFAA COCCNC(=O)c1ccc(OC)cc1OC1CCN(Cc2ccoc2)CC1 14978045 JDYYWYYMDHECRT-UHFFFAOYSA-N 388.464 2.708 0 50 GFAA Cc1conc1C(=O)N1CCOC2(CCS(=O)(=Nc3ccccc3)CC2)C1 1857527917 GAZDHPUPXOHXCR-UHFFFAOYSA-N 389.477 2.788 0 50 GFAA CC(=O)N1CC[C@]2(C1)Cn1c(nnc1C(c1ccccc1)c1ccccc1)CO2 1857689672 JLRNIOKPIGVCAC-QHCPKHFHSA-N 388.471 2.980 0 50 GFAA CN(C)c1nc(O)c2c(n1)[C@@]1(CCCN(c3nc(-c4ccccc4)no3)C1)CC2 1857711847 OBRBOYOMNMMSMI-NRFANRHFSA-N 392.463 2.783 0 50 GFAA Cc1cnc(C)c(N2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)n1 1857732897 LYQIQXMDGWBNBW-JZJXAQOMSA-N 378.476 2.507 0 50 GFAA CN(C)c1nc(N[C@H]2C[C@H]3CO[C@@H](c4ccc(Cl)cc4)CN3C2)ncc1F 1857734454 SNIRYOGKGGUCCK-YQQAZPJKSA-N 391.878 2.961 0 50 GFAA Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](c2ccccc2)O3)c(=O)n1C 1857740588 LIZIQZUSGVOYDR-UYAOXDASSA-N 396.487 2.581 0 50 GFAA Cc1noc(C)c1CSc1ccccc1C(=O)NCC(=O)NCC(F)F 225469886 UDQWKYHLUXYBIW-UHFFFAOYSA-N 383.420 2.695 0 50 GFAA Cc1noc(-c2ccc(N3CCN([C@H](CO)c4ccc(Cl)cc4)CC3)nc2)n1 742407724 WTTCQRXTSNDHOR-GOSISDBHSA-N 399.882 2.949 0 50 GFAA CCCN(CCCN(C)C)C(=O)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1 252551868 UILQDBUCBSIMBV-IBGZPJMESA-N 390.528 2.677 0 50 GFAA Cc1ccc(OCc2nc(CC(=O)N[C@@H](CO)c3ccccn3)cs2)cc1 908485940 NFLDBMNDQNUXJT-SFHVURJKSA-N 383.473 2.818 0 50 GFAA Cc1csc([C@@H](C)CNC(=O)C[C@@H]2CN(C(=O)C3CC3)C3(CCC3)CO2)n1 2325785421 XMAFDTWPVOYGNU-XJKSGUPXSA-N 391.537 2.621 0 50 GFAA O=C(c1cc2c(N3CCNCC3)cccc2s1)N1CC[C@@H](c2ncccn2)C1 2325795926 GAKFUKDSYRKJAA-OAHLLOKOSA-N 393.516 2.731 0 50 GFAA N[C@H](C(=O)Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1)C1CCOCC1 2325855786 OQYZCKLYBOZWJY-SFHVURJKSA-N 377.448 2.831 0 50 GFAA COc1ccc2ccnc([C@@H](C)NC(=O)c3cnn4ccc(CN)cc34)c2c1 2325857356 YTGBNUQRBISYAG-CYBMUJFWSA-N 375.432 2.841 0 50 GFAA Cc1ccc(CC(=O)N2CCN([C@H](C)c3nc(-c4cccs4)no3)CC2)cn1 112678505 XEALYNOXHMFLIA-OAHLLOKOSA-N 397.504 2.949 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1cc(OC)c(OC)cc1Br 1080980 SPTYXSCPYMRLLO-LLVKDONJSA-N 398.253 2.907 0 50 GFAA COc1ccccc1CNC(=O)[C@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 2883247 FSHYWYRNHQINPL-INIZCTEOSA-N 390.505 2.783 0 50 GFAA COc1ccc(NC(=O)C2=C(C)Nc3ncnn3[C@@H]2c2cccnc2)c(OC)c1 4414388 YRVUUEATVZKUDS-GOSISDBHSA-N 392.419 2.618 0 50 GFAA Cc1cc(NC(=O)c2cc(S(=O)(=O)NCc3cccs3)cs2)no1 6681828 RMHFCOVMGCMUFX-UHFFFAOYSA-N 383.476 2.837 0 50 GFAA CCOC(=O)Cc1cc(=O)n2nc(COC)c(-c3ccc(Cl)cc3)c2[nH]1 101550596 LJMDZRNXCSMVCB-UHFFFAOYSA-N 375.812 2.595 0 50 GFAA CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(C(=O)Cc3ccc4c(c3)OCO4)C[C@H]21 230246100 XRAXHXIJSUSRBV-ARFHVFGLSA-N 388.464 2.720 0 50 GFAA COc1cc(OC)c(OC)cc1CN1CCN(CC(C)(C)C)[C@H](CCO)C1 104429679 CKWGBYLDZDCPIQ-QGZVFWFLSA-N 380.529 2.627 0 50 GFAA CC1=C(C(=O)NCc2cnc3c(c2)CCC3)[C@@H](c2cccc(C)c2)NC(=O)N1 67867771 RBZAHQBGIWNGED-HXUWFJFHSA-N 376.460 2.823 0 50 GFAA O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)c1cncc2ccccc12 122074597 GGLWGXZRUZJFAW-HNNXBMFYSA-N 396.472 2.921 0 50 GFAA CCCN1CCN(CCNC(=O)Nc2cc(Cl)c(OC)cc2OC)CC1 20725609 BQSRMNLINCFAPR-UHFFFAOYSA-N 384.908 2.506 0 50 GFAA CCC(=O)Nc1ccc(S(=O)(=O)N(CCO)[C@@H]2CCc3ccccc32)cc1 119562604 WPGOMSNFNKXXAF-LJQANCHMSA-N 388.489 2.706 0 50 GFAA CC(C)C(=O)N1CCC(NC(=O)CCc2nc(-c3ccccc3F)no2)CC1 65458786 DQMJWAOVULYCST-UHFFFAOYSA-N 388.443 2.572 0 50 GFAA O=C(c1ccn2ccnc2c1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 328624000 JOUQVAAOUOYDTO-KRWDZBQOSA-N 377.448 2.623 0 50 GFAA c1ccc(Cc2nnc(N3CC[C@@H](C4CCOCC4)C3)n2C[C@H]2CCCO2)nc1 328855921 UCVARPXBYSHWLQ-UYAOXDASSA-N 397.523 2.696 0 50 GFAA O=C(Nc1ncc(Cc2ccccc2)s1)N1CC[C@H](CN2CCOCC2)C1 173230252 IQYFJODBRBTDDR-QGZVFWFLSA-N 386.521 2.920 0 50 GFAA Cc1cc(N2CCC(n3nccc3NC(=O)Cc3ccccc3)CC2)nc(N)n1 67650239 ILDQVWIKVUMAOV-UHFFFAOYSA-N 391.479 2.586 0 50 GFAA CN(C)C(=O)c1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1 140175447 GTVYUKBSRLBHEG-LJQANCHMSA-N 379.460 2.561 0 50 GFAA CCOC(=O)CSC1=N/C(=C/c2cn(C)nc2C)C(=O)N1c1ccccc1 2785726 MHKJYGWOLWLCKR-MHWRWJLKSA-N 384.461 2.769 0 50 GFAA C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)N2CCOC3(CCC3)C2)c1 127841372 XUSHQDRCHDLQGQ-INIZCTEOSA-N 392.521 2.645 0 50 GFAA CNS(=O)(=O)c1ccc(CN2CCC(Oc3ccccc3F)CC2)cc1 71765097 QNWWBZFQIPMTBX-UHFFFAOYSA-N 378.469 2.777 0 50 GFAA CC(C)c1ccc(C[C@H](NC(=O)c2ccccc2)C(=O)N[C@H](C)C(=O)O)cc1 4742773 MUBGUUXDHCFYLH-BEFAXECRSA-N 382.460 2.740 0 50 GFAA CN(CCCN1CC2(CCN([C@H]3CCCNC3)CC2)OC1=O)C1CCCCC1 72477157 QPFFFDPGNRLFDF-FQEVSTJZSA-N 392.588 2.680 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1 237732551 MMTHMLLIMQQASP-VQTJNVASSA-N 394.471 2.546 0 50 GFAA Cc1cc(C)n(Cc2ccc(C(=O)NCCc3noc([C@H]4CCCO4)n3)cc2)n1 216039103 YHFOALQZSYASSB-GOSISDBHSA-N 395.463 2.755 0 50 GFAA COCCNC(=O)c1cccc(OC2CCN([C@H](C)Cc3ccccn3)CC2)c1 11821019 UQMBUEJXQMMGCI-GOSISDBHSA-N 397.519 2.932 0 50 GFAA Cc1cccc(OC2CCN(C(=O)Cc3ccc(-n4cnnn4)cc3)CC2)c1 77486069 JBTFBTJBJPHLIJ-UHFFFAOYSA-N 377.448 2.583 0 50 GFAA Cc1cc(Sc2ccccc2)ccc1NC(=O)C(=O)N1CC(n2ccnn2)C1 253393797 WZQIWITYWYSWRG-UHFFFAOYSA-N 393.472 2.760 0 50 GFAA CCn1cc(CN2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)cn1 72146758 XVFGTUHEGZOHBL-VLCRHTCISA-N 380.492 2.694 0 50 GFAA Cn1ccc(CC(=O)N2CCC[C@@H](N3CCN(c4ccccc4F)CC3)C2)c1 15070374 ICVXQNLENYWVSI-LJQANCHMSA-N 384.499 2.520 0 50 GFAA CCc1nc(CN2CCOC[C@@H]2c2c(C)nn(Cc3ccccc3)c2C)n[nH]1 368433740 LZLYUTNWTMQHIW-GOSISDBHSA-N 380.496 2.802 0 50 GFAA CC(=O)N1CCc2cc(C(=O)Nc3cccc(-c4nnc(C)n4C)c3)ccc21 378215782 CBZVZUYDLPWQDO-UHFFFAOYSA-N 375.432 2.952 0 50 GFAA COC(=O)[C@@H]1C[C@H](NC(=O)c2sccc2C)CN1C1Cc2ccccc2C1 14882243 UYAHEJAXAFQXJL-WMZOPIPTSA-N 384.501 2.570 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4c(-c5cnn(C)c5)nc5ccccn45)[C@H]1[C@H]3C2 288979429 DMHIXAMXFNWOGQ-OIWPKRNSSA-N 392.463 2.622 0 50 GFAA Cc1nn(C)c(C)c1-c1ccnc(N(C)Cc2nc(-c3ccccn3)no2)n1 48482727 NXBYXUQJKMTKBY-UHFFFAOYSA-N 376.424 2.575 0 50 GFAA O=S(=O)(Cc1ccccc1)N1CCN(Cc2ccn(-c3ccccc3)n2)CC1 195407712 DQVCCOYBXHNBNE-UHFFFAOYSA-N 396.516 2.520 0 50 GFAA O=C(CN1CCCCCC1=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 222699909 HCHUROQLZHDNNO-QRFVXNFXSA-N 381.476 2.566 0 50 GFAA CCOc1cc([C@H]2C(C(=O)OC)=C(C)Nc3ncnn32)ccc1OC(F)F 20607938 FHRIITKKIYWVCE-AWEZNQCLSA-N 380.351 2.740 0 50 GFAA CCC(=O)N1CCc2[nH]cnc2C12CCN(C(=O)c1ccc(CC)s1)CC2 91365108 KETRIHLLKDJQCO-UHFFFAOYSA-N 386.521 2.960 0 50 GFAA O=C(c1cnc(Nc2ccccc2)nc1)N1CCCN(Cc2cccnc2)CC1 91452493 BXBHJPBAOHKAEQ-UHFFFAOYSA-N 388.475 2.963 0 50 GFAA Cc1nc(N(C)C2CCCCC2)ncc1[C@H](C)NC(=O)C(=O)c1cccn1C 91586351 MUNSVZYHRHUWQH-AWEZNQCLSA-N 383.496 2.953 0 50 GFAA CCN(CCO)Cc1cc(Cl)ccc1OC[C@H](O)CN1CCCCCC1 95504990 MAXXHYQLGWVKAF-LJQANCHMSA-N 384.948 2.770 0 50 GFAA Cc1ccc(CC(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CC2)cc1 95527019 KUOGXLUZPLHWTP-UHFFFAOYSA-N 392.503 2.573 0 50 GFAA Cc1nccn1CCC(=O)N1CCC(c2nccn2Cc2ccccn2)CC1 95518832 AHGSXFQHPGASTN-UHFFFAOYSA-N 378.480 2.628 0 50 GFAA CNC(=O)c1cc(NC(=O)NCCc2nc3c(s2)CCCC3)ccc1F 97757877 XVWOWJRGHVWEJD-UHFFFAOYSA-N 376.457 2.885 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)CCn2cnc3ccccc32)C1 95530346 GCBDLWPDIMUJDG-KRWDZBQOSA-N 381.480 2.676 0 50 GFAA O=C(c1cccc2c1CCCC2)N1CCOC[C@@H]1c1ncn(CC(F)(F)F)n1 296527300 AKPQVRTVXZJHNV-MRXNPFEDSA-N 394.397 2.933 0 50 GFAA CCc1nc2n(n1)C[C@H](NC(=O)c1ccc(OC)c(OC3CCCC3)c1)CC2 182437838 JFMRJAUXHCVRCV-OAHLLOKOSA-N 384.480 2.915 0 50 GFAA Cc1cc2nc(CCNC(=O)N3CCC[C@@H](c4cc(O)ncn4)C3)[nH]c2cc1C 534647928 CLVNEBWSQKQDHB-OAHLLOKOSA-N 394.479 2.807 0 50 GFAA CCN(CC)C(=O)c1cn(C2CCN(C(=O)c3cc(C)cc(C)c3)CC2)nn1 299778836 HXMAFKFNIWTSJW-UHFFFAOYSA-N 383.496 2.854 0 50 GFAA O=C(NC[C@H]1CCCN(c2ncccn2)C1)Nc1ccccc1-n1cccn1 299766358 NPFCSJDNLGPGIN-MRXNPFEDSA-N 377.452 2.700 0 50 GFAA COc1ccc2c(c1)[C@H](C(=O)Nc1cccc(-c3nncn3C)c1C)CC(=O)N2 824751154 WIGXHCZSFNKKIN-MRXNPFEDSA-N 391.431 2.864 0 50 GFAA O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@H](c2noc(C3CC3)n2)C1 270483528 AIJKELNXQHEKAZ-INIZCTEOSA-N 378.436 2.612 0 50 GFAA O=C(NC[C@@H]1CCCN1c1ccccc1)N1C[C@]2(C(F)(F)F)C[C@]2(CO)C1 1875392398 OTHZOAVDZAIIHH-CGTJXYLNSA-N 383.414 2.612 0 50 GFAA COC(=O)C[C@@H]1CCN(C(=O)c2cc(=O)c3c(OC)cccc3o2)C2(CC2)C1 1875308403 DLUZTLGMZXDLQM-ZDUSSCGKSA-N 385.416 2.750 0 50 GFAA Cc1nc2c(c(=O)n1C)CN(C(=O)c1ccc(CSc3ccccn3)cc1)C2 952860648 QRIPEBZXHRTIRY-UHFFFAOYSA-N 392.484 2.932 0 50 GFAA CCN(Cc1nc(-c2ccc(C)cc2)no1)S(=O)(=O)c1c(C)noc1C 952970359 SSHLOOAIQHCXOR-UHFFFAOYSA-N 376.438 2.861 0 50 GFAA O=C(NCC1CCN(C(=O)CCc2cccc(Cl)c2)CC1)[C@@H]1CCOC1 952989741 OSQQCSMRGLLLGX-QGZVFWFLSA-N 378.900 2.664 0 50 GFAA Cc1ccccc1C(=O)N1NC(=O)C[C@]12CCN(Cc1c(F)cccc1F)C2 888103327 CPDMAXPBMZAMHG-NRFANRHFSA-N 385.414 2.795 0 50 GFAA CSCc1nnc(SCC(=O)N2CCN(Cc3ccccc3F)CC2)o1 170620899 WYVRSKVIEJMFRZ-UHFFFAOYSA-N 396.513 2.508 0 50 GFAA CCc1nc(-c2ccc(C(=O)N[C@H]3CCCO[C@@H]3c3nccn3CC)cc2)n[nH]1 190098146 XYPMRRMUTDUXPZ-WMZOPIPTSA-N 394.479 2.901 0 50 GFAA O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1CCC[C@]2(CCC[C@H]2O)C1 1704297447 SFOHYINXWMLHQO-HUUCEWRRSA-N 379.400 2.901 0 50 GFAA CCc1c2c(nc3ccccc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC 5140293 MYQKIWCVEPUPIL-QFIPXVFZSA-N 376.412 2.642 0 50 GFAA biogenic,in-vitro CCN(CCn1cccn1)Cc1c[nH]nc1-c1cc(OC)c(OC)c(OC)c1 11936539 HVQVOQNXBVQEJZ-UHFFFAOYSA-N 385.468 2.821 0 50 GFAA COc1ccc(OCc2cc(C(=O)N(C)Cc3ccncn3)no2)c(Cl)c1 12111992 NFESRBAJBSYUCU-UHFFFAOYSA-N 388.811 2.978 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)CCc2cnccn2)C1 12590707 COVHKFPDMQLSHG-LJQANCHMSA-N 396.535 2.831 0 50 GFAA CSc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)N2CCN(C)CC2)cc1 13130664 ILGFAGCIZCYDBW-CAPFRKAQSA-N 395.528 2.953 0 50 GFAA CC[C@@H](C)N1CCC2(CC1)C(=O)N(Cc1ccccn1)C(=O)N2CCCOC 14536363 JUSJPSLSIYQKKE-QGZVFWFLSA-N 388.512 2.515 0 50 GFAA Cn1nc(C(=O)N2CCc3ccccc3C2)c2c1CC[C@@H](N1CCSCC1)C2 14543000 UHEMIJUUPCXFFO-GOSISDBHSA-N 396.560 2.525 0 50 GFAA Cc1ccc(CN2CCN3C(=O)[C@H](CC4CCCCC4)NC(=O)[C@H]3C2)s1 14732805 OPZQTAQKVOZZSP-ZWKOTPCHSA-N 375.538 2.538 0 50 GFAA COc1cccc(CCN[C@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)c1 14753420 LWXMWLBLUDXCOW-SFHVURJKSA-N 396.535 2.744 0 50 GFAA COc1ccc(C(=O)NCc2nccn2C)cc1Oc1cccc(OC)c1CN 1857686497 ZBSRDYQUUKFJRI-UHFFFAOYSA-N 396.447 2.618 0 50 GFAA CN(Cc1ccccc1)S(=O)(=O)N1CCc2[nH]nc(-c3ccccc3)c2CC1 1857708524 YENYVTMRPVMXGD-UHFFFAOYSA-N 396.516 2.854 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(S(=O)(=O)c2ccc(C)s2)CC1 1857732934 OBGXWPBGXDZFHW-UHFFFAOYSA-N 379.507 2.529 0 50 GFAA CC(C)(O)[C@H]1CCCN1Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 119067859 SLIZJQXTWKTTLJ-MRXNPFEDSA-N 380.535 2.949 0 50 GFAA CC(C)NS(=O)(=O)c1ccc(NC(=O)c2cc3cc(Cl)ccn3n2)cc1 240668018 HLYJLHKHBNZPCB-UHFFFAOYSA-N 392.868 2.927 0 50 GFAA CC1CCN(C2CCC(NC(=O)N3CCC[C@@H]3[C@@H]3COCC[C@@H]3O)CC2)CC1 369174044 LHQPOGZRMONDKX-BFIYSBSQSA-N 393.572 2.601 0 50 GFAA Cn1ccc(C(=O)N2CCN([C@H](COc3ccccc3)c3ccccc3)CC2)n1 2100555277 OXJKVYDPBBCCQW-JOCHJYFZSA-N 390.487 2.998 0 50 GFAA O=C(c1cccc(Cc2nn[nH]n2)c1)N1CCC[C@@H](c2ccc(F)c(O)c2)C1 2325807972 PIFBODVUPCACER-MRXNPFEDSA-N 381.411 2.655 0 50 GFAA CN1CC[C@@](C)(CNC(=O)C[C@H](NC(=O)c2ccc(O)cc2)c2ccccc2)C1 2325810597 SZSQBJLBQHWFNV-REWPJTCUSA-N 395.503 2.711 0 50 GFAA O=C(CCC(=O)c1cccs1)NCCCNC(=O)c1cccc2c[nH]nc12 2325825934 IKKHKZSMEAQJHU-UHFFFAOYSA-N 384.461 2.524 0 50 GFAA CS(=O)(=O)N1CCN(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CC1 725011 STORRZSGMWBHCX-UHFFFAOYSA-N 399.472 2.767 0 50 GFAA Cc1ccc(-c2cc(C(=O)N3CCN(S(C)(=O)=O)CC3)c3ccccc3n2)o1 2867694 PVVOFPOWWYAHIN-UHFFFAOYSA-N 399.472 2.521 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2cccnc2)cc1 4914348 BNNMYLOUYMKALN-UHFFFAOYSA-N 397.456 2.821 0 50 GFAA Cc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2CCOCC2)c(C)c1 6767791 NTTKQQQIWGAXCY-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA COc1cc(CNS(=O)(=O)c2ccc(SC)cc2)cc(OC)c1OC 10543865 WFHNQKVDHIAJAB-UHFFFAOYSA-N 383.491 2.913 0 50 GFAA COc1ccc(OCc2nc3c4c(C)c(C)n(CCCO)c4ncn3n2)cc1 9418509 PDTRTKGIZRXSIV-UHFFFAOYSA-N 381.436 2.666 0 50 GFAA O=C(Cc1cccnc1)N1CCC[C@@H](N2CCN(c3ccccc3F)CC2)C1 55198538 ZTUBWVPSACWMSM-LJQANCHMSA-N 382.483 2.576 0 50 GFAA O=C(CN1CCC(N2CCC[C@H](CO)C2)CC1)Nc1ccc(Cl)cc1F 65398875 XOFWIGXXNUGWEY-AWEZNQCLSA-N 383.895 2.586 0 50 GFAA CCCN(CCC)c1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 20909640 VYVJGKGACQVZJA-UHFFFAOYSA-N 382.512 2.851 0 50 GFAA C[C@@H](CNC(=O)C1CCN(S(C)(=O)=O)CC1)Cc1cccc2ccccc12 65363465 FYXRUXCNLIETEU-MRXNPFEDSA-N 388.533 2.806 0 50 GFAA Cc1nc2ccccc2n1Cc1cc(C(=O)NCc2cnn(C(C)C)c2)n[nH]1 67935092 SMRLDUKAEAYJHV-UHFFFAOYSA-N 377.452 2.824 0 50 GFAA COc1cc2c(cc1CNC(=O)CC(=O)Nc1cccc(C)c1C)OCCO2 65372236 WCLXZQJQPJOJON-UHFFFAOYSA-N 384.432 2.728 0 50 GFAA CCN(C)c1ccc(CNCc2cccc(OCCN3CCOCC3)c2)cn1 252488178 IMSHSMFUKBKKCI-UHFFFAOYSA-N 384.524 2.539 0 50 GFAA COc1cccc(CN2CCC[C@@](O)(CN3CCC(C)(C)CC3)C2=O)c1OC 67675565 DJHSRIHXJQEWHT-JOCHJYFZSA-N 390.524 2.679 0 50 GFAA CN1CC[C@@H](NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)[C@H]1c1ccccc1 241316708 LUHOKNHAIFXEGW-IAGOWNOFSA-N 394.443 2.858 0 50 GFAA Cc1cc(C(=O)N2CCc3c(nc(-c4ccncc4)nc3N(C)C)C2)ccc1O 72157740 FBAFRKXDHJMVKR-UHFFFAOYSA-N 389.459 2.817 0 50 GFAA CN(c1ccc(C(=O)N2CCOCC2)c(Cl)c1)S(=O)(=O)c1ccccc1 71754843 NZRZTQFKWHWFFP-UHFFFAOYSA-N 394.880 2.638 0 50 GFAA CCN1CCN([C@@H]2CCN(C(=O)N[C@H](C3CCCCC3)C(F)(F)F)C2)CC1 482306892 DSJQGSAOWUSUBE-IAGOWNOFSA-N 390.494 2.919 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)co1 153013134 QTSJUVDOZFMIAM-GXFFZTMASA-N 386.832 2.608 0 50 GFAA CC(C)c1ncc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)cn1 71589513 FGZIWYQVWGRZFK-SFHVURJKSA-N 385.556 2.555 0 50 GFAA CN(CC1(CO)CC1)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71638762 XLUGYQJIBDYPIU-XMMPIXPASA-N 392.499 2.765 0 50 GFAA COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2c1ccnc(N)n1 77342511 OBGMKGJPKOMRAC-WMZOPIPTSA-N 387.443 2.729 0 50 GFAA CN1CCN(C(=O)CC[C@@H]2CCCN(C(=O)c3cc4ccccc4n3C)C2)CC1 19635490 UFGBVTYVNUUBGW-SFHVURJKSA-N 396.535 2.585 0 50 GFAA O=C(NCc1cc(F)ccc1Br)N1CCC[C@@H](Cn2ccnn2)C1 178987879 CPOQPSVLTLYKOO-GFCCVEGCSA-N 396.264 2.802 0 50 GFAA CC(=O)N[C@@H](CC(C)C)C(=O)N1CCC(n2cc(C3CCCC3)nn2)CC1 48224038 ZORAGLCYKZUMTB-SFHVURJKSA-N 375.517 2.650 0 50 GFAA COc1cccc(-n2cc(CNC(=O)N3CC[C@@H](n4nc(C)cc4C)C3)cn2)c1 426547604 JLTXJMYEHLSOQE-LJQANCHMSA-N 394.479 2.851 0 50 GFAA O=C(COc1cccc(Cl)c1)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 91526612 PJEHUZVMSNSKOQ-HXUWFJFHSA-N 376.884 2.970 0 50 GFAA CCCN1C(=O)CCc2cc(NC(=O)c3n[nH]c4ccccc4c3=O)ccc21 181024022 OCJPWCMKZWDZEZ-UHFFFAOYSA-N 376.416 2.865 0 50 GFAA CSc1ccc2c(C)cc(N3CCC4(CC3)NC(=O)C[C@H]4C(=O)O)nc2c1 95386224 GEFFBKUXDDYAOZ-HNNXBMFYSA-N 385.489 2.825 0 50 GFAA COc1ccc(NC(=O)N(C)[C@H](C)c2nccs2)cc1NS(C)(=O)=O 96130378 MFXDNCRYIYVCRO-SNVBAGLBSA-N 384.483 2.748 0 50 GFAA Cc1n[nH]c(C)c1CCN(C)C(=O)N[C@H](CCn1cncn1)c1ccccc1 426613584 HAXYFHQEPOCYLZ-LJQANCHMSA-N 381.484 2.634 0 50 GFAA COc1cccc2c1OC[C@H](C(=O)NCc1nc(Cc3ccccc3)no1)C2 95383388 OUDLWALWKLYDGK-MRXNPFEDSA-N 379.416 2.537 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)Nc1ccccc1C(F)(F)F 239038795 DYHZTLSTMQNXRE-FDJUTITPSA-N 390.361 2.697 0 50 GFAA CC1(C)CC(n2cc(-c3cnc(NC[C@@H]4CCCO4)nc3)nn2)CC(C)(C)N1 91693587 PCMWKOXQGGTLBO-INIZCTEOSA-N 385.516 2.808 0 50 GFAA O=C(CC[C@H]1N=C(O)N(Cc2ccccc2)C1=O)Nc1nc2c(s1)CCC2 253394531 FDCWJYIBWHQZSO-CQSZACIVSA-N 384.461 2.676 0 50 GFAA O=C(O)c1cccc(CN2CCOC3(CCN(C(=O)C4CCCC4)CC3)C2)c1 827921387 RERMDEMSRAJSPO-UHFFFAOYSA-N 386.492 2.768 0 50 GFAA Cc1ccc(S(=O)(=O)NCCCNC(=O)c2ccc3ncsc3c2)cc1 825176939 WMBICNWIYFLTJW-UHFFFAOYSA-N 389.502 2.703 0 50 GFAA CCCc1nc(-c2noc([C@@H]3CCc4nnn(C5CCOCC5)c4C3)n2)co1 952894735 QCANJZDTJITQSX-GFCCVEGCSA-N 384.440 2.893 0 50 GFAA C[C@H](C(=O)N1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1)S(N)(=O)=O 1875283138 HNKUJTBIWXYKHU-PXAZEXFGSA-N 378.881 2.643 0 50 GFAA CO[C@H]1C[C@@H](CN)N(c2cc(NCC3(Cc4ccc(F)cc4)CC3)ncn2)C1 1875394815 XOFHUZPTDJLNHG-ROUUACIJSA-N 385.487 2.603 0 50 GFAA O=C(O)[C@]1(n2cc(CCCO)cn2)CCCc2ccc(Br)cc2C1 1875305508 UJRYZZRQCVVWNB-SFHVURJKSA-N 393.281 2.929 0 50 GFAA Cc1c(CNC(=O)c2cc(O)nc3c2CNCC3)noc1-c1ccc(Cl)cc1 1875360099 YSEDOFVFSHUZBY-UHFFFAOYSA-N 398.850 2.980 0 50 GFAA COC[C@@]1(C)COCCN1C(=O)c1ccn(-c2ccccc2C(F)(F)F)n1 1875311912 DKWWXMXBWJEUDL-KRWDZBQOSA-N 383.370 2.769 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)c1ncc(Cc2ccccc2)o1 1875401645 NNUMUWNDAFCJSV-IRXDYDNUSA-N 393.447 2.713 0 50 GFAA COC(=O)C1CCC(CNC(=O)c2cc(-n3cnnc3)ccc2Cl)CC1 952963868 KWZDGUPOPZHBKR-UHFFFAOYSA-N 376.844 2.630 0 50 GFAA CC(=O)N1C[C@@H]2CN(Cc3ccc(-c4cccc(Cl)c4)o3)C[C@]2(C(=O)O)C1 1565531296 UCFIDPHSEUFEFC-YWZLYKJASA-N 388.851 2.965 0 50 GFAA CSc1ccccc1C(=O)N[C@H]1CCN(Cc2csc(C)n2)C[C@@H]1O 1565510165 IVUKACJBINFNER-HOTGVXAUSA-N 377.535 2.539 0 50 GFAA CO[C@H]1COCC[C@@H]1NC(=O)c1ccccc1-c1nc(-c2ccccc2)no1 1565530119 JRFWZUOVHXGRHB-ROUUACIJSA-N 379.416 2.937 0 50 GFAA O=C(NCC1(c2ccc(F)cc2Cl)CC1)N1CC[C@@H](N2CCCC2=O)C1 276930494 RDTFMKWIBKRWJZ-CQSZACIVSA-N 379.863 2.917 0 50 GFAA CCCN(Cc1ccc(F)cc1)C(=O)c1cnn2c1C[C@H](CNC(C)=O)CC2 276964423 PNRJLRITASYHBL-QGZVFWFLSA-N 386.471 2.773 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 192143087 GOQPYBXEXGMKFX-UHFFFAOYSA-N 375.856 2.899 0 50 GFAA Cc1nc(C)n(CCCNS(=O)(=O)c2ccc(-c3c(C)noc3C)s2)n1 1506415868 DJCPSVCZNBNWPJ-UHFFFAOYSA-N 395.510 2.597 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N[C@@H]2CCC[C@H]2N(C)C)ccc1F 1704313060 LQZOZLQTSADZAL-HUUCEWRRSA-N 390.459 2.768 0 50 GFAA COc1ccc(/C=C2\SC(=O)N(CC(=O)NC(C)(C)C)C2=O)cc1OC 1235720 KQBAVNKTNWKEIJ-ZROIWOOFSA-N 378.450 2.655 0 50 GFAA CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)c1cn(CCN2CCCCC2)nn1 11717445 POMMULQFJJWHDW-UHFFFAOYSA-N 384.459 2.657 0 50 GFAA O=C1NCCN(Cc2ccccc2)[C@@H]1CC(=O)N1CCC(c2ccccc2)CC1 11874642 QRTGJJASECSDGE-JOCHJYFZSA-N 391.515 2.783 0 50 GFAA Cc1cccc(Cn2c(N[C@H](C)c3ccccc3)nc3c2c(=O)[nH]c(=O)n3C)c1 12507797 LACRTZFACIWRLB-OAHLLOKOSA-N 389.459 2.953 0 50 GFAA CC(C)CN1C[C@@H](OCc2cccc(F)c2)CN(C2CCN(C)CC2)CC1=O 14537984 HJNUYZMWEDPHDO-NRFANRHFSA-N 391.531 2.605 0 50 GFAA CCNC(=O)c1cn(CCc2ccccc2)cc(C(=O)N2CCCCCC2)c1=O 14979559 NELZDTMNKDNASH-UHFFFAOYSA-N 395.503 2.857 0 50 GFAA COc1ccccc1-n1c(SCC(=O)Nc2ccccc2C)nc(O)cc1=O 17945661 ULCKPQVNQVQHDI-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA Cc1ccc2nc(C(=O)N3CCC[C@@]4(CCc5c(O)nc(C)nc54)C3)c(F)n2c1 1857670984 KMAXIVUZWQTFHK-OAQYLSRUSA-N 395.438 2.706 0 50 GFAA Cn1nc(-c2ccccc2)c2c1CCN(C(=O)[C@@H]1CC(=O)OC13CCCC3)CC2 1857671720 YXNDPKDTPVMJGM-SFHVURJKSA-N 393.487 2.890 0 50 GFAA CN1CC[C@]2(C(=O)NCC3=CCCCC3)CCCN(CCCn3cccn3)[C@H]2C1 1857677585 IOJUNOQGMKAZSG-JTHBVZDNSA-N 399.583 2.676 0 50 GFAA O=C(N[C@H]1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1)c1ccc(O)nc1 1857687058 JMQBAEIFTDAVCR-CABCVRRESA-N 393.365 2.887 0 50 GFAA Cc1ncsc1CN1C[C@@H]2CC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccc(F)cc1 1857689362 OFMCXIIUNCVCJE-LVFSCSRESA-N 389.496 2.651 0 50 GFAA O=C1C[C@H]2[C@H](CCN2C(=O)c2cccnc2O)N1Cc1c(F)cccc1Cl 1857690823 NFYIQFXUHLYYKT-HOTGVXAUSA-N 389.814 2.595 0 50 GFAA CCc1nc(-c2ncccn2)sc1C(=O)NCCN1CCc2ccccc21 1857698131 FFZDBQRDMQPYEX-UHFFFAOYSA-N 379.489 2.955 0 50 GFAA CCC(=O)N1CCC(C2CCN(C(=O)c3cnc(O)c(Cl)c3)CC2)CC1 1857733192 ZBCCKGSAJIYQBE-UHFFFAOYSA-N 379.888 2.941 0 50 GFAA CC(C)[C@H]1CN2C[C@H](NC(=O)c3cc(-n4cccn4)ccc3Cl)C[C@H]2CO1 1857735607 GTTWDTCDYNEURO-SIXWZSSISA-N 388.899 2.753 0 50 GFAA O=C(c1ccon1)N1CCC[C@]2(CCc3c2nc(C2CC2)[nH]c3=NC2CCC2)C1 1875250154 BOKVLEAVSXKZBL-QFIPXVFZSA-N 393.491 2.849 0 50 GFAA Cc1nn(C)c(C)c1OCC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 121454756 ZSMXNERYCRWBCO-UHFFFAOYSA-N 390.915 2.850 0 50 GFAA O=C(NC[C@@H]1CN(C2CC2)CCO1)c1cc2ccc(OC(F)(F)F)cc2[nH]1 127252987 JYAGZCQZDWLZBZ-CQSZACIVSA-N 383.370 2.660 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CNCc1nccn1C)C1CCCCC1 12316578 QQEQQOYMFALGTB-HXUWFJFHSA-N 386.540 2.714 0 50 GFAA O=c1c(=CC2=Cc3ccccc3OC2)sc2nc(-c3ccc(F)cc3)nn12 254742984 FILZNHBVPHVZEF-UHFFFAOYSA-N 377.400 2.933 0 50 GFAA O=C(NCc1cnc(O)c2ccccc12)N1CC2(CN(Cc3ccccc3)C2)C1 924819231 IGAYYJSPKRPCJR-UHFFFAOYSA-N 388.471 2.968 0 50 GFAA O=C1C[C@@H](Nc2ccc(N3CCOCC3)cc2)C(=O)N1c1ccc(Cl)cc1 639844 SLNRJSZMIORPRD-GOSISDBHSA-N 385.851 2.921 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCCCCC3)CC2)cc1C 667642 HVYFSIMOMBPTGC-UHFFFAOYSA-N 394.537 2.807 0 50 GFAA CC(=O)CCC(=O)N1CCC[C@H](N2CCN(c3cccc(Cl)c3)CC2)C1 55100429 TWMMKFBCXOGANL-IBGZPJMESA-N 377.916 2.822 0 50 GFAA O=C(c1cccc2c1NCCC2)N1CCc2nc(Cc3ccccc3)nn2CC1 2356134529 QWYNIHQOJZZQMP-UHFFFAOYSA-N 387.487 2.926 0 50 GFAA CCC[C@@]1(C(=O)O)CN(Cc2cc3cc(OCC)ccc3nc2O)CC[C@H]1O 2356158180 YWNUZEMYANTGRG-WIYYLYMNSA-N 388.464 2.777 0 50 GFAA COc1ccc(N(CC(=O)NCC(C)C)S(=O)(=O)c2ccccc2)cc1 2900817 ZOTCNZJUYBSUSX-UHFFFAOYSA-N 376.478 2.663 0 50 GFAA O=C(NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCN1S(=O)(=O)c1ccccc1 4450931 ABQQBTUTPYVYQH-ILCGBQQYSA-N 388.533 2.925 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1I)[C@H]1C=C[C@H]2C12CC2 101362606 KXTANTNNZLNZLA-JYILRKAJSA-N 391.208 2.993 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c1 67621947 RNIIKZRXINPFMU-UHFFFAOYSA-N 377.452 2.579 0 50 GFAA CC(C)c1noc2ncc(C(=O)N3CCC[C@@H](c4nn(C)cc4C(=N)O)C3)cc12 328606374 RIEVFXAWJLPKTP-GFCCVEGCSA-N 396.451 2.983 0 50 GFAA Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N2CCC(c3nc(C)no3)CC2)cc1 173703199 XJTWDTHIQQHNBE-SFHVURJKSA-N 382.464 2.584 0 50 GFAA COC(=O)c1c[nH]c(=O)c(NC(=O)c2cnn(-c3cc(C)ccc3C)c2C)c1 120604065 RWEUNMSPQUZUQD-UHFFFAOYSA-N 380.404 2.525 0 50 GFAA COc1ccccc1N1CCN(C(=O)[C@@H]2CC(c3ccc(F)cc3)=NO2)CC1 4904320 FBKXVEHGTDDWMM-FQEVSTJZSA-N 383.423 2.676 0 50 GFAA Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N1CC[S@@](=O)C(C)(C)CC1 333955508 GECKBVDXYZDNBI-XMMPIXPASA-N 385.839 2.623 0 50 GFAA O=C(Cc1ccc(CO)cc1)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 71760729 PSFKVURVOBMRPD-QPTUXGOLSA-N 376.500 2.810 0 50 GFAA Cc1cc(CC(=O)NC2CCN(Cc3coc(-c4ccccc4)n3)CC2)n[nH]1 132494705 HSKRZNGSYJKHHM-UHFFFAOYSA-N 379.464 2.696 0 50 GFAA COc1cc(OC)cc(-c2cc(C(=O)O)cc(S(=O)(=O)NC3CC3)c2)c1 71575703 KSTIQUKMTSSYLV-UHFFFAOYSA-N 377.418 2.510 0 50 GFAA Cc1cccc(C)c1NC(=O)CN(C)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 363299537 NPYSAJGNBMYWBZ-KRWDZBQOSA-N 385.468 2.781 0 50 GFAA Cc1noc(C)c1[C@H](C)CC(=O)N1CCC(CNC(=O)c2ccccn2)CC1 492849748 CYYBJXDFITWFTB-CQSZACIVSA-N 384.480 2.849 0 50 GFAA CC(C)n1ncc2c(C(=O)N3CCO[C@H](C(=O)O)C3)cc(-c3ccccc3)nc21 262898463 PMKJJJUWLXIQGC-SFHVURJKSA-N 394.431 2.605 0 50 GFAA O=C(CC[C@H]1CCCOC1)Nc1ccc2c(ccn2CC(=O)N2CCOCC2)c1 175486402 YPQQUKLSUXKCAC-QGZVFWFLSA-N 399.491 2.645 0 50 GFAA O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 177284148 RFEQMJKBJQKIIY-OAHLLOKOSA-N 391.431 2.942 0 50 GFAA Cc1nsc(N2CCCN(C(=O)N[C@@H]3CCCOc4ccccc43)CC2)n1 176171893 HVBCWTLAQZDMFN-MRXNPFEDSA-N 387.509 2.982 0 50 GFAA Cc1cccc2[nH]cc(CC(=O)N3CCOc4ccc(S(C)(=O)=O)cc43)c12 178131690 WLSLXBYVQIHEAV-UHFFFAOYSA-N 384.457 2.848 0 50 GFAA O=C(c1cc2ncc(CCO)cn2n1)N1CCCC[C@@H]1CCc1cccs1 426628117 DDJOYWLVAFDKLT-MRXNPFEDSA-N 384.505 2.953 0 50 GFAA O=C(NC[C@@H]1CCCCO1)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 95496712 NGIADQASJLGYTO-FQEVSTJZSA-N 386.492 2.765 0 50 GFAA COCCN1C[C@]2(CCCN(C(=O)c3cn(C)c4ccccc34)C2)CCC1=O 91964538 SNBYAVCDQQNHMT-QFIPXVFZSA-N 383.492 2.670 0 50 GFAA Cc1c(C(=O)N2CCc3[nH]c(-c4ccccc4)nc3C2)sc2nc[nH]c(=O)c12 96148875 UNHODSBPBHVRRO-UHFFFAOYSA-N 391.456 2.882 0 50 GFAA O=C(NCc1cnn(Cc2ccccc2)c1)[C@H](c1cccnc1)N1CCCC1 95384740 VTPDJRZTOHHPEY-NRFANRHFSA-N 375.476 2.780 0 50 GFAA O=C([C@@H]1COc2ccccc2C1)N(CCCn1ccnc1)Cc1cccnc1 91625429 RZAKBZYLTGDCIE-FQEVSTJZSA-N 376.460 2.948 0 50 GFAA Cc1cnc(C(=O)N2C[C@H](c3cc(F)cc(F)c3)[C@@H]3[C@H]2C2CCN3CC2)cn1 95506335 CUAIHLWXVRXSMU-MISYRCLQSA-N 384.430 2.766 0 50 GFAA Cn1cc(Cl)c(C(=O)N2C[C@H]3CC[C@@H]2CN(C2Cc4ccccc4C2)C3)n1 95386801 LPSPCJXQIDPBDK-WMLDXEAASA-N 384.911 2.777 0 50 GFAA CCCc1nc(C(=O)N(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)cs1 97480166 UBUYZQHHZCJFLG-OAHLLOKOSA-N 378.519 2.925 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(C(=O)c4ccc(O)cc4)C3)CCC2=O)cn1 92022844 WWKLHWAZCVNDKE-JOCHJYFZSA-N 394.475 2.536 0 50 GFAA COc1ccc([C@H](NC(=O)c2ccccc2OC(F)F)[C@H]2C[C@@H](O)C2)cn1 244795415 RGABOLUYBKSPBJ-AHIWAGSCSA-N 378.375 2.934 0 50 GFAA CCCC(=O)N[C@H]1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1 299589402 BQYVYKOMHRABFN-HOTGVXAUSA-N 391.537 2.650 0 50 GFAA NC(=O)Cn1cc(-c2cccc(C(=O)N(Cc3ccsc3)C3CC3)c2)cn1 534634147 PANHRORDVPJZQG-UHFFFAOYSA-N 380.473 2.902 0 50 GFAA CCO[C@H]1COC[C@@H]1NC(=O)Nc1c(C)cnn1Cc1ccc(Cl)cc1 299783108 WODLLMJCYKBATP-HOTGVXAUSA-N 378.860 2.819 0 50 GFAA COc1ccc(-c2oc3c(=O)cc(C)oc3c2CC(=O)NCCN(C)C)cc1 824692105 KKOGXTGFSZACHN-UHFFFAOYSA-N 384.432 2.590 0 50 GFAA biogenic O=C(N[C@H](Cn1cccn1)c1ccccc1)c1ccccc1N1CCOCC1 670440850 ZQZQLBZUHKCUJI-HXUWFJFHSA-N 376.460 2.891 0 50 GFAA O=C(O)Cc1cccc(CNC(=O)N[C@@H](CCO)c2ccc(Cl)cc2)c1 1875307242 LNJBWTDASMETJH-KRWDZBQOSA-N 376.840 2.890 0 50 GFAA COCCn1nc2c(c1C(=O)NCCCc1c(C)noc1C)C[C@H](C)O[C@@H]2C 1875315950 OSAPLKOXIOAOLA-SWLSCSKDSA-N 390.484 2.519 0 50 GFAA COCc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccn2)C3)s1 1565526573 UXKBUVCSQVFWDR-CABCVRRESA-N 385.489 2.666 0 50 GFAA O=C1O[C@H]2CN(Cc3cccc4c3OCO4)C[C@H]2N1CCc1ccc(F)cc1 1565509547 DJPDCXRSJRNJLV-MJGOQNOKSA-N 384.407 2.802 0 50 GFAA CC(=O)N[C@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)C[C@@H]1c1ccc(C)o1 1565514315 TYOJMCZRDVNXBE-YJBOKZPZSA-N 380.448 2.528 0 50 GFAA COC(=O)c1c[nH]c(S[C@H](C)C(=O)N(C)CCOc2ccc(Cl)cc2)n1 170600446 OOOAEPDZHQRIEB-LLVKDONJSA-N 397.884 2.868 0 50 GFAA COc1ccc(CN2CCCN(C(=O)c3c[nH]c(=O)c4ccccc34)CC2)cc1 189048254 GUFWFYZOWIEMCM-UHFFFAOYSA-N 391.471 2.885 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)N2CCC[C@H](n3nc(C)cc3C)C2)cc1 746024926 YQWPJTUXNZTOOT-SFHVURJKSA-N 385.468 2.954 0 50 GFAA Cc1noc(C)c1-c1ccc(S(=O)(=O)N2CCC[C@@]3(CCNC3)C2)s1 1506428199 YEWLVRBBTBECMU-KRWDZBQOSA-N 381.523 2.784 0 50 GFAA COc1ccc(NC2(C(=O)NC3CCS(=O)(=O)CC3)CCCCC2)cc1 1506414218 PNMBMXALMANBKE-UHFFFAOYSA-N 380.510 2.503 0 50 GFAA CN(Cc1ccc(-n2cccn2)cc1)C(=O)CN1C[C@H](c2ccccc2)CC1=O 1506404099 VGZWXCRRJIVWRG-HXUWFJFHSA-N 388.471 2.847 0 50 GFAA COc1cc(F)ccc1CN1CCO[C@H](CO)[C@H]1c1ccc(OC)c(OC)c1 1529187647 WZGUKNMZVIZHMD-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N2CCC[C@](C)(O)C2)cc1 1704333703 FCTHQIBCQYIJKV-NRFANRHFSA-N 385.464 2.937 0 50 GFAA CC(C)(C(=O)N1CC[C@](Cc2ccccc2)(C(=O)O)[C@@H](O)C1)c1ccccc1 1704343184 AGJXVXVBFFVYSS-WMZHIEFXSA-N 381.472 2.871 0 50 GFAA Cc1[nH]ccc1C(=O)N1CCC[C@@]2(C(=O)NCC3=CCCCC3)CCN(C)C[C@H]12 1775977519 JOXLUYRHULBQDS-NZQKXSOJSA-N 398.551 2.866 0 50 GFAA O=C(Cc1ccsc1)N1C[C@@H]2CN(Cc3ccccc3Cl)C[C@]2(CO)C1 1772816048 FNHXKWBOYIELPX-FXAWDEMLSA-N 390.936 2.897 0 50 GFAA COc1c(C)cc(C(=O)[C@H]2CCCN(C(=O)CCCn3cncn3)C2)cc1C 13636682 NUUAFRXXQIZVMW-KRWDZBQOSA-N 384.480 2.805 0 50 GFAA Cc1nc(N2CCC[C@@H]2C(=O)NCC2(O)CCCCC2)nc2ccc(F)cc12 14879206 LFEOTSCWGVTPDD-GOSISDBHSA-N 386.471 2.858 0 50 GFAA COc1ccc(C(=O)CCC(=O)N2CCC(CCC(=O)NC3CC3)CC2)cc1 15063695 YXGKMJGZSJTJFP-UHFFFAOYSA-N 386.492 2.956 0 50 GFAA COCCN(Cc1cnn(C)c1)CC1CCN(Cc2ccccc2OC)CC1 15079632 NYENUKWPSYZRON-UHFFFAOYSA-N 386.540 2.789 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3cccs3)CC2)c(OC)c1OC 19789344 NEZIKXFDRXMGMM-UHFFFAOYSA-N 376.478 2.732 0 50 GFAA COCCNC(=O)c1cnn(-c2nccc(-c3ccccc3OC)n2)c1C1CC1 19853428 BWGMDBINGFSKLH-UHFFFAOYSA-N 393.447 2.592 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)nn1 1857696571 HNILFZDHXRSEAB-NVXWUHKLSA-N 385.512 2.802 0 50 GFAA CCCO[C@@H]1CC[C@H](C(=O)NC2CC2)C[C@H]1NC(=O)c1ccc(O)cc1F 1857712027 DMGRADVPBAFNDP-JBBXEZCESA-N 378.444 2.504 0 50 GFAA CCCOc1ccc(CN2C[C@H](O)[C@]3(C2)[C@H](c2ccccc2)[C@H]3CO)cc1CO 1857726413 PTJYAHCCWDZQIK-GNLZIIPMSA-N 397.515 2.537 0 50 GFAA Cc1ccnc(N2C[C@@H]3[C@H](CNC(=O)Cc4ccccc4)[C@H]4CC[C@]3(C2)O4)c1 1875246631 SPYQEWDBZQSIBI-DZCCDHAISA-N 377.488 2.733 0 50 GFAA Cc1nn(CC(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)c(C)c1Cl 237915843 CSUJAGQXLJCRDC-UHFFFAOYSA-N 375.856 2.798 0 50 GFAA CNC(=O)c1cn(CCc2ccccc2)cc(C(=O)NC2CCCCC2)c1=O 15071921 XICNGNDFFXUVEM-UHFFFAOYSA-N 381.476 2.513 0 50 GFAA O=C(NCC1(c2ccc(Br)s2)CCC1)N1CCn2cnnc2C1 377203386 IHOLUMVTRAVMQW-UHFFFAOYSA-N 396.314 2.749 0 50 GFAA CN1CCC[C@]2(CO)CCN(C(=O)c3ccc(-c4ccc(O)cc4)cc3)C[C@@H]12 1704302691 RJLARNBRBCRQNW-FYYLOGMGSA-N 380.488 2.978 0 50 GFAA CC(C)N1CCN(CCC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1 912696010 YMNQQJDSUARGRI-QGZVFWFLSA-N 388.339 2.559 0 50 GFAA O=C(NC(=O)c1c(F)cccc1F)Nc1ccccc1S(=O)(=O)C(F)F 4580210 LTAPUDXMECZIFJ-UHFFFAOYSA-N 390.314 2.923 0 50 GFAA CC(C)CC[C@@]1(C(=O)O)CN(C(=O)Cc2ccc(O)c(Cl)c2)CC[C@H]1O 2100556141 DUEHYTHYSNDOKO-VQIMIIECSA-N 383.872 2.689 0 50 GFAA Brc1cc(-c2nc(-c3cc(O[C@H]4CCNC4)ccn3)no2)co1 2325772974 CNYUWGJLTSYLRG-NSHDSACASA-N 377.198 2.895 0 50 GFAA CN(C)CCN1CCN(c2cccc(NC(=O)/C=C/COC(C)(C)C)c2)CC1 2325789703 GXHRGCKHPZENKZ-JXMROGBWSA-N 388.556 2.680 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CSc2nnc(-c3cccnc3)n2C)cc1 779285 JRRQMGGEIXBDBV-UHFFFAOYSA-N 382.449 2.566 0 50 GFAA CCOC(=O)C1CCN(C(=O)C2CCN(Cc3ccccc3OC)CC2)CC1 795511 KYUQQMWSCVAJQU-UHFFFAOYSA-N 388.508 2.709 0 50 GFAA COc1ccc2oc(=O)c(C(=O)N3CCN(c4ccc(F)cc4)CC3)cc2c1 1052542 ZSQVYAHFIPQNHM-UHFFFAOYSA-N 382.391 2.903 0 50 GFAA CCOc1ccc(NC(=O)CN(c2cc(C)ccc2OC)S(C)(=O)=O)cc1 4313879 GWQHGFIRECWBOL-UHFFFAOYSA-N 392.477 2.807 0 50 GFAA COc1ccc(NC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)c(OC)c1 6726842 WKQKVHHUVSEQEU-UHFFFAOYSA-N 385.420 2.820 0 50 GFAA COc1cccc(OC)c1CC(=O)NC[C@H]1CCN(CCc2ccccc2)C1 119065731 CFGFUGJYAQTSQC-LJQANCHMSA-N 382.504 2.927 0 50 GFAA O=C1N[C@](CCc2ccccc2)(C2CCNCC2)C(=O)N1Cc1ccccn1 67909055 YYDSJIUZNHFYIW-JOCHJYFZSA-N 378.476 2.505 0 50 GFAA CC(C)N(C)C(=O)c1coc(CN2CCN(C/C=C/c3ccccc3)CC2)n1 67846987 CTNUIUPZWZYFPC-JXMROGBWSA-N 382.508 2.986 0 50 GFAA Cc1ccc2c(c1)nc(CNC(=O)N1CCO[C@@H](c3nnc(C(C)C)o3)C1)n2C 283497863 YOAPUTXEGCEZEJ-MRXNPFEDSA-N 398.467 2.671 0 50 GFAA CCCc1cc2c(=O)n(NC(=O)c3cc(C(F)(F)F)n(C)n3)c(C)nc2s1 2780528 YXZCEONCNPJCSG-UHFFFAOYSA-N 399.398 2.855 0 50 GFAA O=C([C@H]1CCCN1C(=O)c1ccccc1OC(F)F)N1CCOC2(CCC2)C1 128021625 BUKXDKZSZXDQDE-OAHLLOKOSA-N 394.418 2.674 0 50 GFAA COC(=O)C1=NN(C(=O)c2ccc(Br)cc2)[C@@](O)(C(C)(C)C)C1 5060249 GJJQEHXRLZGZRA-INIZCTEOSA-N 383.242 2.559 0 50 GFAA O=C(NCCNc1cc(-c2ccccc2F)nc2ccnn12)c1cccnc1 72463043 WESVMUDYWZEXHN-UHFFFAOYSA-N 376.395 2.772 0 50 GFAA CN(CC1CCN(Cc2ccccc2)CC1)C(=O)[C@@H](N)Cc1ccc(O)cc1 77426096 AFYMSMPIUOWYJF-QFIPXVFZSA-N 381.520 2.633 0 50 GFAA COc1ccnc(N2CCN(Cc3ccn(-c4c(F)cccc4F)n3)CC2)c1 152490449 VYSMMNDPFMPCIA-UHFFFAOYSA-N 385.418 2.876 0 50 GFAA Cc1cc([C@H]2CCCN2C(=O)NCc2cccc(CN3CCOCC3)c2)no1 363025024 AWIIARYGRFHGFP-HXUWFJFHSA-N 384.480 2.862 0 50 GFAA Cc1cc([C@@H]2CCCN2C(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 363233680 MKJRSHNMQVIHIX-UZLBHIALSA-N 386.471 2.996 0 50 GFAA CCCCCCN1CC2(CCN(C(=O)c3cc(CC)nn3C)CC2)OC1=O 77519776 AWRIOSZHSUFMHG-UHFFFAOYSA-N 376.501 2.990 0 50 GFAA CC1(C)CN(CC2(CN3CC(C)(C)[C@@H]3[C@@H]3CCCO3)COC2)[C@@H]1[C@H]1CCCO1 368076386 VCNOIJRLNLJAHM-FGYAAKKASA-N 392.584 2.782 0 50 GFAA CCC1(CNC(=O)N[C@@H]2CCc3ncnn3C2)CCN(Cc2ccccc2)CC1 378286153 JKYWTTWEMBNVSE-LJQANCHMSA-N 396.539 2.585 0 50 GFAA CC(=O)NCc1ccc(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 378505233 BVFHONGJIDVWJB-HTAPYJJXSA-N 379.504 2.963 0 50 GFAA CC(=O)N1CCc2c(nc(-c3ccccn3)nc2NCc2ccc(O)cc2)C1 77389207 MEDGJDUEKFNDEE-UHFFFAOYSA-N 375.432 2.761 0 50 GFAA O=C(NCCc1ccccc1)c1cc(COc2ccc(-n3cncn3)cc2)on1 14961994 VFPAWBCYURFHBC-UHFFFAOYSA-N 389.415 2.807 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CCCS(=O)(=O)C2)ccc1NC(=O)CC(C)C 286598797 BKJYEXSZPZNUMG-HNNXBMFYSA-N 380.510 2.534 0 50 GFAA C[C@@H]1CCCN(c2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)c3nonc23)C1 17077448 AUBNAXODWVFDHF-ZIAGYGMSSA-N 378.498 2.880 0 50 GFAA Cc1cc(-c2ccc(C(=O)N(C)Cc3snnc3C)cc2)nc(N(C)C)n1 426537451 IRBCMBKFISOQHM-UHFFFAOYSA-N 382.493 2.950 0 50 GFAA Cc1n[nH]c(SCCN2C[C@@](C)(Cc3ccc4c(c3)OCO4)CCC2=O)n1 91646144 YIRZGOFNKAHNGN-LJQANCHMSA-N 388.493 2.805 0 50 GFAA Cc1cc(C)c(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)c(=O)[nH]1 91893836 VJRCRBPHBZYFNM-UHFFFAOYSA-N 397.523 2.657 0 50 GFAA CC(C)(C)OC(=O)N1CCN(c2cc(I)ccn2)CC1 230534085 DXUZSHQMPWBFFB-UHFFFAOYSA-N 389.237 2.743 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccccc2)C3)c(OC)n1 95384862 JUMBOTGEEBWHPK-ZWKOTPCHSA-N 381.476 2.835 0 50 GFAA Cc1c(C(=O)O)cnn1-c1ccc(C(=O)N(C)Cc2ccc3c(c2)OCO3)cc1 299746623 YRSCPBXPSPVJSN-UHFFFAOYSA-N 393.399 2.880 0 50 GFAA COC(=O)c1cn(Cc2ccc(OCC(C)C)c(OC)c2)cc2c(=O)[nH]nc1-2 263588828 YXXZSHORFUVZMP-UHFFFAOYSA-N 385.420 2.555 0 50 GFAA CCCCn1nccc1NC(=O)N1CCCC[C@@H]1CCN1CCN(C)CC1 299767023 ANJKIVUMDZUYFJ-GOSISDBHSA-N 376.549 2.707 0 50 GFAA COCC(=O)Nc1ccc(NC(=O)c2ccc(N3CCCC3=O)cc2)cc1OC 824313021 JMVDWEJDEJZOQL-UHFFFAOYSA-N 397.431 2.659 0 50 GFAA CN(C)c1ncc(/C=C/C(=O)NC[C@@H](c2ccccc2)N2CCCCC2)cn1 823741949 DYRPSUULOUWTFV-SGWGQVFISA-N 379.508 2.899 0 50 GFAA COc1cc2c(cc1OC)[C@@H](c1ccc(O)cc1)N(C(=O)c1ccnn1C)CC2 824619860 YQTJOWQYQLFWMV-OAQYLSRUSA-N 393.443 2.931 0 50 GFAA C[C@H]1c2cc(F)ccc2CCN1C(=O)NCc1csc(N2CCOCC2)n1 584903506 PQXIQIJEUBVTPJ-ZDUSSCGKSA-N 390.484 2.948 0 50 GFAA Cc1ccc(N2CCC(NC(=O)c3csc(N=S(C)(C)=O)n3)CC2)nc1 1875276056 IECAQNCUQVZCJS-UHFFFAOYSA-N 393.538 2.604 0 50 GFAA Cc1nn(C(C)C)cc1C(=O)N1CCC(c2nc(C)n3c2CN(C)CC3)CC1 1875394247 AOQXZSQGUOGBBH-UHFFFAOYSA-N 384.528 2.743 0 50 GFAA COc1cc(Cl)ccc1-c1cccc2c1CN([C@@H]1CCC(=O)NC1=O)C2=O 1875350675 WTMUXJPTETUMAG-MRXNPFEDSA-N 384.819 2.777 0 50 GFAA C=CC(=O)NCCc1ccc(CNC(=O)[C@@H]2CCOc3c(F)cccc32)cc1 1875386250 LVQNGBNUNCZAJY-GOSISDBHSA-N 382.435 2.853 0 50 GFAA C[C@H]1CCN(c2ccc3nnc(Br)n3n2)C[C@@H]1C(=O)OC(C)(C)C 882511689 CXIIJRNYTCQEAE-QWRGUYRKSA-N 396.289 2.691 0 50 GFAA CCc1ncnc(N2CCC3(CC2)CN(C(=O)c2occc2C)CCO3)c1F 952972510 OZZLZNJDKJXURC-UHFFFAOYSA-N 388.443 2.591 0 50 GFAA O=C(N[C@H]1CCc2c[nH]nc2C1)N[C@@H]1CCCc2c1cnn2Cc1ccccc1 1319170020 DRJLBNIICDJAJP-PKOBYXMFSA-N 390.491 2.889 0 50 GFAA Cc1cc(OCCCC(=O)Nc2cn(C)nc2C(=O)N(C)C)ccc1Cl 170603867 PYLIFDJBNJHROW-UHFFFAOYSA-N 378.860 2.881 0 50 GFAA O=C(NCC1CCN(CC(F)(F)F)CC1)N1CCCC[C@@H](N2CCCC2)C1 186731782 RXMOSGYGADJRIS-QGZVFWFLSA-N 390.494 2.921 0 50 GFAA CCOc1ccc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)cc1 187772074 NIYLZQUBRIFSKU-UHFFFAOYSA-N 386.399 2.918 0 50 GFAA COc1ccc(-n2nc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)O)cc2C)cc1 190731397 IAAIYVXPBROLIQ-HXUWFJFHSA-N 391.427 2.841 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N2CCC[C@H](CN)C2)cc1 1704325051 JEYSKISWPSLQGP-OAHLLOKOSA-N 384.480 2.761 0 50 GFAA O=C(NCc1nc2ccccc2o1)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772814545 GIFVZQBZVKVQNI-CYBMUJFWSA-N 398.488 2.542 0 50 GFAA CC1=C(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccc(F)cc2F)OCCO1 12373708 JASKGCLCCSBLCZ-OAHLLOKOSA-N 375.375 2.922 0 50 GFAA COCc1ccc(C(=O)N2CCc3[nH]nc(-c4ccc5c(c4)OCO5)c3C2)o1 12433700 HTMYXLMZMYLRFD-UHFFFAOYSA-N 381.388 2.743 0 50 GFAA O=C(CCc1ccccc1)Nc1ccnn1C1CCN(C(=O)[C@H]2CCOC2)CC1 12597187 ZWZFXWRNUGROGJ-SFHVURJKSA-N 396.491 2.654 0 50 GFAA COC(=O)[C@H]1CCCCN1C(=O)c1cc(COc2ccc(C(C)=O)cc2)on1 12835564 DWKNJBSYDPJBAV-GOSISDBHSA-N 386.404 2.624 0 50 GFAA COC(=O)CCCC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3F)C2)C1 14950742 NIBSOJAHYLSHMH-OAQYLSRUSA-N 376.472 2.984 0 50 GFAA Cc1ccc(CC2(O)CCN(C(=O)c3n[nH]c4c3C[C@@H](C)O[C@H]4C)CC2)cc1 1857529303 LZQXSGUWKZEONP-CVEARBPZSA-N 383.492 2.950 0 50 GFAA CN1CCn2nc(C(=O)N[C@H]3CC4(CCCC4)Oc4ccccc43)cc2C1=O 1857671891 VQTZYSSSJZPNES-INIZCTEOSA-N 380.448 2.535 0 50 GFAA CCN1CCC[C@H](n2ccnc2-c2cc3c(nc2OC)CN(C(C)C)C3=O)C1 1857700651 ZJUBGGSZWKIPJE-HNNXBMFYSA-N 383.496 2.975 0 50 GFAA CCOc1ccc(CC(=O)N[C@H]2CC[C@@H](NC(=O)c3c(C)noc3C)C2)cc1 1857704639 AHJPCSNJYGFWHV-DLBZAZTESA-N 385.464 2.700 0 50 GFAA CC[C@H]1C[C@@H](O)CC2(CCN(C(=O)c3ccc(N4CCCC4=O)cc3)CC2)O1 1857713688 CWCNOQBEPFGYAJ-MOPGFXCFSA-N 386.492 2.738 0 50 GFAA CC(=O)Nc1ccc2nc(CN3C[C@H](O)[C@H](Cc4ccncc4)C3)ccc2c1 1857734117 FHGDINJTMATVGS-GCJKJVERSA-N 376.460 2.624 0 50 GFAA CCc1nc(C)c(CN2CC[C@@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)[nH]1 1875247881 SFMJFHWKYLVCOH-DENIHFKCSA-N 385.508 2.941 0 50 GFAA Cc1cc(C)n(CCC(=O)N2C[C@H](C(C)C)O[C@H](c3ccccc3)C2)c(=O)n1 2100556252 JYLBPNPAMWMJPW-UXHICEINSA-N 383.492 2.875 0 50 GFAA Cc1csc([C@@H](C)N2CCN(c3nnc(-c4ncccc4C)n3C)CC2)n1 2325701374 HWYWQWJLAXFZKW-OAHLLOKOSA-N 383.525 2.834 0 50 GFAA COc1ccc([C@H]2NC(=O)[C@@H](C3CC(C)(C)C3)NC2=O)cc1Br 2325776896 MBCPNAWGMGKBBG-ZIAGYGMSSA-N 381.270 2.550 0 50 GFAA COc1cccc(OC)c1[C@@H]1CCN(C(=O)c2ccc(Cn3cncn3)cc2)C1 2325786706 VYBDVUZVMPABGK-GOSISDBHSA-N 392.459 2.973 0 50 GFAA CCn1cc(C(=O)N[C@@]2(CNC(=O)CCC(C)(F)F)CCCC[C@@H]2C)nn1 2325794280 WTJYTLJWMSUZBJ-SCLBCKFNSA-N 385.459 2.528 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C/C(=O)O[C@H]2CCNC2=O)o1 2325879262 ONCNOGLMUMDYIQ-LNENJAERSA-N 377.400 2.886 0 50 GFAA CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)c2ccccc2)c1 866146 VNNPBQWQWYAHGU-UHFFFAOYSA-N 375.446 2.757 0 50 GFAA CC(=O)N[C@@H](NC(=S)Nc1ccc(C(=O)O)cc1)C(Cl)(Cl)Cl 939611 VZCJBBLUDCCECI-JTQLQIEISA-N 384.672 2.504 0 50 GFAA CCN1CCN(S(=O)(=O)c2ccccc2-c2ccc(OC)c(F)c2)CC1 2356145961 YXJPBIXKZBZRAY-UHFFFAOYSA-N 378.469 2.828 0 50 GFAA O=C(O)Cc1ccc(CN2CCC[C@@]23CCCN(Cc2ccccn2)C3=O)cc1 2356148969 CCJFRZYBZVEXGV-HSZRJFAPSA-N 393.487 2.866 0 50 GFAA O=C(CCc1cccnc1)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356149451 ATBANISOGNIWEF-JOCHJYFZSA-N 378.476 2.593 0 50 GFAA O=C(O)c1cccc(CN2CCC[C@@]23CCCN([C@H]2CC[C@H](O)CC2)C3=O)c1 2356152033 NMYCUJDOBOFMBL-IPJJNNNSSA-N 386.492 2.645 0 50 GFAA O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@H](c1ccc(F)cc1)C1CCCC1 247722686 AMRJONWTBHUORF-KHDMTIDOSA-N 396.462 2.980 0 50 GFAA O=C1Nc2cc(F)ccc2[C@@H]1CC(=O)N1CCC[C@@H](OCc2cccnc2)C1 20993448 WENMNQTXBRSJEW-AEFFLSMTSA-N 383.423 2.854 0 50 GFAA O=C(Nc1cccc(Cl)c1)N1CCN(c2cc(-n3ccnc3)ncn2)CC1 67601990 XOQICVVWKSMNHD-UHFFFAOYSA-N 383.843 2.670 0 50 GFAA Cc1ccc(C)c(C(=O)CCC(=O)NS(=O)(=O)c2cncc(Cl)c2)c1 119303152 CCKPFPDQJQEAQN-UHFFFAOYSA-N 380.853 2.820 0 50 GFAA CN(Cc1ccccc1)C1(CNC(=O)c2ccc[n+]([O-])c2)Cc2ccccc2C1 20454355 MBAQGFVYWXXUTP-UHFFFAOYSA-N 387.483 2.719 0 50 GFAA Cc1nnnn1-c1cc(NC(=O)N2Cc3ccccc3O[C@@H](C)C2)ccc1F 432867863 UKJWVFULZCWEDC-LBPRGKRZSA-N 382.399 2.925 0 50 GFAA O=C(N[C@H]1CCCc2sccc21)N1CCC(S(=O)(=O)N2CCCC2)CC1 283885692 UBNMYNRHZKSKKQ-INIZCTEOSA-N 397.566 2.725 0 50 GFAA Cc1cc(N2CC[C@H](N3CC4(CCOCC4)[C@@H]3c3ccccc3)C2=O)n(C)n1 333194984 VZEJDYVZXQEATD-ICSRJNTNSA-N 380.492 2.688 0 50 GFAA Cc1cc(NC(=O)N2CCC[C@@H](NS(C)(=O)=O)C2)cc(C(F)(F)F)c1 252489163 JIOOTWUAADUTHG-GFCCVEGCSA-N 379.404 2.559 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1)NCC1CC1 72127095 TZTUGGNPEZKWDI-NRFANRHFSA-N 393.487 2.696 0 50 GFAA Cc1cccc(NC(=O)C[C@H]2COc3ccc(C(=O)N(C)C)cc3N2C)c1O 71614472 YCTPZZFNBSAEAI-HNNXBMFYSA-N 383.448 2.628 0 50 GFAA Cc1cnc2c(C(=O)N3CCN(c4nc5ccccc5s4)CC3)cnn2c1 72473811 YIJNNXLBRYRCEQ-UHFFFAOYSA-N 378.461 2.610 0 50 GFAA Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1CN(CCO)CCO 72476353 YRJBBLSPZSYGJM-UHFFFAOYSA-N 387.430 2.913 0 50 GFAA O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2csc(O)n2)CC1 369304122 XYWPIPQXVGSXDD-UHFFFAOYSA-N 380.857 2.882 0 50 GFAA Cc1ccc(C)c(N2CCN(C(=O)C3CCN(c4cnccn4)CC3)CC2)c1 156873818 XHYFZNDAUUVMOL-UHFFFAOYSA-N 379.508 2.659 0 50 GFAA CN(C)CCN(C)C(=O)C1(N(C)CCc2ccccc2)Cc2ccccc2C1 72143672 AFGDUAIBGMBQJH-UHFFFAOYSA-N 379.548 2.719 0 50 GFAA COc1ccc(S(=O)(=O)N2CCN(C34CC5CC(CC(C5)C3)C4)CC2)cc1 17079781 PNBXUXWMCVWYNC-UHFFFAOYSA-N 390.549 2.970 0 50 GFAA CCOc1ccc(S(=O)(=O)NCCCn2nc(C(F)(F)F)cc2C)cc1 17079899 YEJOBQWLUNDGFM-UHFFFAOYSA-N 391.415 2.978 0 50 GFAA NC1=N[C@@]2(c3cc(NC(=O)c4ccc(F)cn4)ccc3F)COC[C@H]2CS1 70466423 NIDRNVHMMDAAIK-YPMLDQLKSA-N 390.415 2.515 0 50 GFAA investigational CNC[C@H]1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)Cc3ccccc3-4)C2)C1 178999498 PEWAMAGHBWDOHE-APWZRJJASA-N 389.499 2.679 0 50 GFAA CN(Cc1nc(-c2ccccn2)no1)C(=O)CN1CC[C@H](c2ccccc2)C1 82126400 DNBKSAYWSVCSNW-KRWDZBQOSA-N 377.448 2.580 0 50 GFAA COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)NCc2ccc(F)cc2)n1 44892805 IMASQUKKTAKJNI-UHFFFAOYSA-N 385.370 2.514 0 50 GFAA CCN(CC)CC(=O)N1CC[C@@]2(CCCN(Cc3cccc(F)c3F)C2=O)C1 426435088 YIXWHADXHOYYPX-NRFANRHFSA-N 393.478 2.648 0 50 GFAA O=C(N=c1cc(-c2ccccc2)[nH]n1[C@H]1CCS(=O)(=O)C1)c1ccccc1F 334157969 CUIJDNCLSWQMOE-HNNXBMFYSA-N 399.447 2.723 0 50 GFAA COc1cc([C@@H](C(=O)O)N2CCN(c3ccccc3)CC2)cc(OC)c1OC 95375428 HPEQVCXWTJBYHS-IBGZPJMESA-N 386.448 2.660 0 50 GFAA O=C(Cn1nccc1[C@H]1CCCNC1)N1CCC(OCc2ccccc2)CC1 426504144 XYDWVDUNWZEABD-IBGZPJMESA-N 382.508 2.558 0 50 GFAA CO[C@@]12CC[C@H](O)C[C@@H]1N(C(=O)Cc1c(C)nn(-c3ccccc3)c1C)CC2 426409183 WCYMSUXQXFHXPF-RCZSKKKRSA-N 383.492 2.563 0 50 GFAA Cc1cn2c(=O)c(C(=O)N3CCN(CC4CC4)c4ccccc43)cnc2s1 180101975 TXVJHHDJTWSMCE-UHFFFAOYSA-N 380.473 2.941 0 50 GFAA O=C1CCC2(CCN(C(=O)c3cccnc3)CC2)CN1CCc1ccncc1 91645995 AHOPSQHNXVJJTB-UHFFFAOYSA-N 378.476 2.564 0 50 GFAA CCCn1ncc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)c1C 91794372 XRUFQZPIABYFDY-UHFFFAOYSA-N 375.517 2.838 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC1CCN(C(=O)c3ccccn3)CC1)C2 91847103 GBYCIFUFZYBXNR-MRXNPFEDSA-N 381.476 2.536 0 50 GFAA CC[C@@H]1CCc2c(sc(NC(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)c2C(N)=O)C1 239164858 NAYFKERATFMCGJ-CDYMVBJSSA-N 388.489 2.823 0 50 GFAA Cc1cc(C(=O)NCCN2C(=O)Cc3ccccc32)nn1-c1c(F)cccc1F 239672612 BUDHNUFAPFKTMS-UHFFFAOYSA-N 396.397 2.778 0 50 GFAA CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@@H](NS(=O)(=O)N2CCCC2)C1 91616321 XNLSSWGCJRDOED-KRWDZBQOSA-N 392.500 2.955 0 50 GFAA Cc1cnc(CN2C[C@]3(CCCN(Cc4noc(C(C)C)n4)C3)CCC2=O)cn1 91849178 XRRKCYQPTWEWFP-OAQYLSRUSA-N 398.511 2.696 0 50 GFAA Cc1ccc2c(c1)SCC(=O)N2CC(=O)N(C)Cc1ccc2nonc2c1 95500507 QBAZMTWHMIUSAP-UHFFFAOYSA-N 382.445 2.629 0 50 GFAA CN1CCN([C@H]2CCN(Cc3ccc(F)c(Cl)c3)C[C@H]2CCCO)CC1 92037247 OLCHKXMGLTVIQO-XLIONFOSSA-N 383.939 2.690 0 50 GFAA Cc1[nH]nc(C(F)(F)F)c1-c1ccc(C(=O)NCCCn2ccnn2)cc1 534667777 WUNMCYHPJJSERI-UHFFFAOYSA-N 378.358 2.816 0 50 GFAA COc1ccccc1N1C[C@@H](C(=O)NCc2ccc3c(c2)nc(C)n3C)CC1=O 824822740 QQKUXDMCIWYAES-INIZCTEOSA-N 392.459 2.560 0 50 GFAA O=C(N[C@@H]1CCCN(Cc2ccccc2F)C1)c1ccc2c(c1)ncn2CCO 670439270 XMZNPAIBSVCXBX-GOSISDBHSA-N 396.466 2.562 0 50 GFAA CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC1CC(Nc2ccccc2)C1 874714921 GPAKGSHCCURVKW-AJTFCVKESA-N 390.487 2.974 0 50 GFAA COc1cccc([C@@H](CN2C(=O)N3CC(F)(F)C[C@@]3(C)C2=O)N2CCCC2)c1 1875291237 SACOLVNKRXRPGO-APWZRJJASA-N 393.434 2.894 0 50 GFAA O=C(O)C[C@H](COCc1ccccc1)NC(=O)C[C@H]1COCc2ccccc21 1875293878 GMHVIMIGMPUEKP-RBUKOAKNSA-N 383.444 2.867 0 50 GFAA C[C@@H](NC(=O)C(=O)N[C@@H]1C[C@H]2C=C[C@H]1CC2)c1ccc(-c2cncnc2)cc1 1875271405 FNOQEZABRPAZKR-HCCHORAYSA-N 376.460 2.792 0 50 GFAA C[C@@H](C1CC1)n1ncc2cc(C(=O)N3Cc4nc(C5CC5)nc(O)c4C3)cnc21 1875283821 DBIMLIYOLASUNP-NSHDSACASA-N 390.447 2.931 0 50 GFAA CCN(Cc1ccoc1)C(=O)[C@@]1(O)CC(=O)Nc2ccc(Br)cc21 1875323271 CZLGNRAUMHNBBF-QGZVFWFLSA-N 393.237 2.621 0 50 GFAA C[C@@H](NC(=O)c1ccnc(O)c1)C1CCN(C(=O)c2ccc(CF)cc2)CC1 1775993027 WVFXZMFRUQHQBJ-CQSZACIVSA-N 385.439 2.927 0 50 GFAA CC[C@@H](C(=O)N[C@H](C)C1CCN(C(=O)CC2=CCOCC2)CC1)N(CC)CC 1775993276 YORCQMBCLOMORV-XLIONFOSSA-N 393.572 2.587 0 50 GFAA CCCOc1ccc(CNC(=O)c2cc3c(cc2Cl)NC(=O)CO3)cn1 1336341757 QHWRYTPDOHIELG-UHFFFAOYSA-N 375.812 2.785 0 50 GFAA CC(C)[C@@H]1OCCC[C@H]1Nc1cc(N2CCC[C@@H](c3nncn3C)C2)ncn1 275653652 KTCAQAKIXNWXDM-MDZRGWNJSA-N 385.516 2.605 0 50 GFAA COc1ccc([C@H]2CC(c3ccc(F)cc3)=NN2S(C)(=O)=O)c(OC)c1 170614098 GIYXFTZEFMXQSK-QGZVFWFLSA-N 378.425 2.954 0 50 GFAA CCOc1ccccc1NC(=O)C(=O)Nc1cc(C(C)C)nn1-c1ncccn1 170609795 OUBLLPVMRHBUHT-UHFFFAOYSA-N 394.435 2.762 0 50 GFAA C[C@H](O)c1ccc(CNC(=O)NCC2(N3CCOCC3)CCCCC2)cc1 170748563 DJUBRVPYBYAMMJ-KRWDZBQOSA-N 375.513 2.574 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@H](c3nc4cc(C)ccc4[nH]3)C2)cn1 192934166 OOPJMXMPDUTZQQ-AWEZNQCLSA-N 386.477 2.843 0 50 GFAA COc1cccc(N2C[C@H](NC(=O)CC(=O)Nc3cccc(C)c3C)CC2=O)c1 1506406270 ZNHVBBWYRRUIGJ-MRXNPFEDSA-N 395.459 2.562 0 50 GFAA CCn1c(N(C)C[C@@H]2Cc3ccccc3CN2C)nc2cc(C(=O)O)cnc21 1529090379 HWCSLZINLSKHBO-KRWDZBQOSA-N 379.464 2.642 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCCN(C)C(C)C)ccc1F 1704305471 JTMQOHMYLDBTKA-UHFFFAOYSA-N 378.448 2.625 0 50 GFAA O=C(Cc1cccs1)N1C[C@@H]2CN(Cc3cc4ccccc4o3)C[C@@]2(CO)C1 1772810314 FXUUJDZRYDNLRH-JTSKRJEESA-N 396.512 2.990 0 50 GFAA O=C(CN1C[C@@H]2CNC[C@]2(CCc2ccccc2)C1)N1CCc2ccccc21 1772804341 MYBBYXLZWSIGAQ-XUZZJYLKSA-N 375.516 2.730 0 50 GFAA COc1cc2c(cc1OC)[C@@H](c1ccccc1)NC(=O)/C2=C\N1CCOCC1 3470601 GJFRUQPNPYEUJG-JOIYNNFJSA-N 380.444 2.596 0 50 GFAA COc1cccc(OCC(=O)N2CCO[C@@H](CN(C)C)[C@@H]2c2ccccc2)c1 1857724961 GYSOGBHMLAADHJ-UNMCSNQZSA-N 384.476 2.604 0 50 GFAA CCn1cc(CNC(=O)C[C@H]2CCCN(c3nc4cc(OC)ccc4o3)C2)cn1 1857739930 ZSRSTQFSJRPFJB-OAHLLOKOSA-N 397.479 2.976 0 50 GFAA CC[C@@H](OC)C(=O)Nc1cc(NC(=O)[C@@H](CC)OC)nc(-c2ccccc2)n1 253630126 IYDCLUZACUBBHS-HUUCEWRRSA-N 386.452 2.871 0 50 GFAA CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc(Br)nc2)CC1 266917428 JDQVKZVMIATPLF-UHFFFAOYSA-N 384.274 2.973 0 50 GFAA CC(C)[C@H]1CC(=O)c2nc(NC(=O)c3ccc(-c4nnn(C)n4)cc3)oc2C1 2100539425 IDZLJMWNZOMHJA-ZDUSSCGKSA-N 380.408 2.519 0 50 GFAA CCOC(=O)C1=C(CN2CCSCC2)NC(=O)N[C@@H]1c1cc(C)ccc1C 20482056 PBDPJZQVQVIBGS-GOSISDBHSA-N 389.521 2.523 0 50 GFAA CN(c1ccccc1)c1ccc(C(=O)N[C@@H]2C[C@@H](Cn3cccn3)C[C@H]2O)cn1 2325785605 FYOHGOMSSCGNJL-NSISKUIASA-N 391.475 2.616 0 50 GFAA Cc1nn(-c2ccccc2)c2nc(C(=O)NCC3(F)CC(C(=O)O)C3)ccc12 2325803507 LGGSLGBXMYEIKL-UHFFFAOYSA-N 382.395 2.662 0 50 GFAA C=CC(=O)N1CCC(C(=O)N2CCc3ccc(F)c(Br)c3C2)CC1 2325884672 PSLBYYZQAASKTR-UHFFFAOYSA-N 395.272 2.898 0 50 GFAA COc1ccc(CC(=O)N2N=C(c3ccncc3)C[C@]2(O)C(F)(F)F)cc1 871855 ZZOOMAJLKRZFMO-KRWDZBQOSA-N 379.338 2.520 0 50 GFAA CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 1131371 AVIIGDFXTKGKAH-CQSZACIVSA-N 376.478 2.953 0 50 GFAA CC(=O)Oc1ccccc1C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 2813120 BLRPCWYLXWPWHF-UHFFFAOYSA-N 390.461 2.941 0 50 GFAA COc1ccc(C)cc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1 2852575 SFEPHRYCVMGGRY-GFCCVEGCSA-N 382.869 2.963 0 50 GFAA CSc1ccc(S(=O)(=O)N2CCC(C(=O)NCc3ccco3)CC2)cc1 4988539 KHOSGAWGUFPBKR-UHFFFAOYSA-N 394.518 2.719 0 50 GFAA COc1ccccc1OCCSc1nnc(CNC(=O)c2ccco2)n1C 4998644 YUKTYLJUMOJRRW-UHFFFAOYSA-N 388.449 2.518 0 50 GFAA COC(=O)c1ccsc1NC(=O)c1ccsc1NC(=O)c1ccnn1C 6827582 CYKPOWVWFNEHPQ-UHFFFAOYSA-N 390.446 2.834 0 50 GFAA O=C(Nc1ccccn1)[C@H]1CCCN(c2ncnc3c2nc2n3CCCCC2)C1 6899824 LQZSOJGMZXTBII-HNNXBMFYSA-N 391.479 2.803 0 50 GFAA Cc1cc(C)nc(-c2cccc3c2O[C@H](CNC(=O)c2snnc2C)C3)n1 12131170 RHBBHMYXMBHHRA-AWEZNQCLSA-N 381.461 2.654 0 50 GFAA Cc1cccc2nc(CNC(=O)[C@@H]3CCC(=O)N(Cc4ccccc4F)C3)cn12 12300512 ZTNRZXNHENMZLL-QGZVFWFLSA-N 394.450 2.837 0 50 GFAA O=C(c1cc[n+]([O-])cc1)N1CC[C@@]2(CCCN(CCCc3ccccc3)C2)C1 12301688 FQQYZOFMQWFVOV-HSZRJFAPSA-N 379.504 2.881 0 50 GFAA CN(C[C@@H](O)c1ccccc1)C(=O)c1cn(Cc2ccc(F)cc2Cl)nn1 12466173 GLGHXLZNBBZLJV-GOSISDBHSA-N 388.830 2.925 0 50 GFAA Cn1nc(C(=O)NCc2ccc(F)cc2)c2c1CC[C@H](NCc1ccccn1)C2 14540569 DPSMAXUEQDNFSA-KRWDZBQOSA-N 393.466 2.531 0 50 GFAA CCN1CCC[C@H]1CN(CC1CCN(CCOC)CC1)C(=O)/C=C/C(C)C 14960946 ADKGLTNAVQDMNV-SHBDEGQCSA-N 379.589 2.870 0 50 GFAA Cc1c(C(=O)NCCc2ccncc2)sc2ncnc(NC[C@@H]3CCCO3)c12 14983856 BPNBJIACNGLHRZ-HNNXBMFYSA-N 397.504 2.958 0 50 GFAA CC(=O)c1cccc(CN2CCC(n3nccc3NC(=O)[C@H]3CCOC3)CC2)c1 19851023 LJNCMOILJSCOKS-IBGZPJMESA-N 396.491 2.898 0 50 GFAA CCN(C)C(=O)C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1 39442837 QUEDRBIEATUGHJ-HXUWFJFHSA-N 381.476 2.648 0 50 GFAA COc1cccc([C@@H]2CNC(=O)c3nc(CC45CCCN4CCC5)[nH]c3C2)c1 65383602 FONNHERJAOPVJT-INIZCTEOSA-N 380.492 2.659 0 50 GFAA Nc1nccc(N2CCC(Cc3ccccc3C(F)(F)F)(C(=O)O)CC2)n1 71730639 QEELUBGFOVJDQI-UHFFFAOYSA-N 380.370 2.992 0 50 GFAA Nc1cc(N2CCC(Cc3ccccc3C(F)(F)F)(C(=O)O)CC2)nc(N)n1 71745610 IFXQVUJANHOYBW-UHFFFAOYSA-N 395.385 2.574 0 50 GFAA O=C([C@H]1CCCO1)N1CCC(c2nn3c(C4CCCC4)nnc3s2)CC1 71747762 BXEBJMXSUOTUMM-CQSZACIVSA-N 375.498 2.728 0 50 GFAA CC(C)[C@H]1CN(C(=O)C2CCOCC2)CCC(=O)N1Cc1ccc(F)cc1 71748011 PXKSZWVRURTXRQ-LJQANCHMSA-N 376.472 2.838 0 50 GFAA CCS(=O)(=O)c1ccc(O)c(-n2ccnc2-c2ccc(NC(C)=O)cc2)c1 77356972 IVRDGMLLOBXGOK-UHFFFAOYSA-N 385.445 2.997 0 50 GFAA Cc1nc(N(C)C)cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)n1 82230323 SVJKNABGJHFIGU-UHFFFAOYSA-N 377.851 2.606 0 50 GFAA Cc1cc(C)nc(N2CCC3(CCC(=O)N(CCc4ccncc4)C3)CC2)n1 91645728 OVZBBUZXMTVGMY-UHFFFAOYSA-N 379.508 2.940 0 50 GFAA CCc1ccc(S(=O)(=O)N2C[C@@H]3CC[C@H](C2)N(CC2CCC2)C3=O)cc1 91892780 BOVCKGKSWSRTKL-ZWKOTPCHSA-N 376.522 2.661 0 50 GFAA CN(CCC(C)(C)O)C(=O)[C@@H]1CCC(=O)N(CCc2ccc(Cl)cc2)C1 91906526 LVFYTNUOAQYNMK-MRXNPFEDSA-N 380.916 2.741 0 50 GFAA O=C1CCC2(CCN(C(=O)NCc3ccco3)CC2)CN1CCc1ccccn1 95371684 RHCPGKDCTWKOAW-UHFFFAOYSA-N 396.491 2.832 0 50 GFAA CCc1ccccc1[C@@H](C(=O)O)N1CCN(Cc2ccc(OC)cc2)C(=O)C1 95521580 SOQCQCZVYVMKLJ-NRFANRHFSA-N 382.460 2.728 0 50 GFAA O=C1CC[C@@H](c2nc(C3CCOCC3)nn2Cc2c(F)cccc2Cl)N1 96149614 NIUXMICQQVVFPX-HNNXBMFYSA-N 378.835 2.964 0 50 GFAA COC(=O)c1ccc(F)c(NC(=O)c2ccc(=O)n(-c3ccccc3F)n2)c1 121388531 ANCPSRGSPSFTCQ-UHFFFAOYSA-N 385.326 2.550 0 50 GFAA COC(=O)C1CCN([C@@H](C)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)CC1 125986909 QDYQKAKENWXHBT-ZETCQYMHSA-N 380.313 2.594 0 50 GFAA O[C@H](COc1ccc(Cl)cc1Cl)CN1CCOC2(CCOCC2)C1 135596824 CGPQPFIQIJHLFL-AWEZNQCLSA-N 376.280 2.615 0 50 GFAA Cc1nc(S)sc1CC(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 155281602 FXTBXCQGEQJLTC-HUUCEWRRSA-N 378.519 2.634 0 50 GFAA Cc1c(C(=O)N2CC(C(C)(C)O)C2)cnn1-c1ccc(Br)cc1 170086771 ABOHWVLBGHWEOR-UHFFFAOYSA-N 378.270 2.786 0 50 GFAA CC1CCN(c2ccc(C(=O)NC3CCN(C4CCN(C)CC4)CC3)cn2)CC1 171404506 NBJFWQZPYDCPDA-UHFFFAOYSA-N 399.583 2.606 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)c1cnn(C3CCOCC3)c1C)C2 179744182 UZTHNBCUICPORD-UHFFFAOYSA-N 382.464 2.700 0 50 GFAA Cc1nc(N[C@H]2CCN(c3ccccc3C(F)(F)F)C2=O)c2cnn(C)c2n1 185782887 YFKRHUNQFIQIJP-ZDUSSCGKSA-N 390.369 2.908 0 50 GFAA O=C(O)CC[C@H](Cc1ccccc1)NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21 191547111 QIHSPMIBZJDZDP-WBVHZDCISA-N 384.407 2.844 0 50 GFAA CCOc1ccccc1[C@H](CC)NC(=O)CN1CCc2ncnc(OC)c2C1 195498831 MSJCTMSUXNUJQM-KRWDZBQOSA-N 384.480 2.510 0 50 GFAA COc1ccc([C@H](NS(=O)(=O)c2cc(C)sc2C)[C@H]2C[C@H](O)C2)cn1 244626737 FRQIQOTVLIMDCE-ZQIUZPCESA-N 382.507 2.559 0 50 GFAA O=C1[C@H]2CC=CC[C@H]2C(=O)N1c1ccc(N2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 249992334 MEXOGPOPICBMII-SLFVNDPXSA-N 390.439 2.678 0 50 GFAA N[C@H]1CC[C@H](C(=O)Nc2cc3c(cc2NC(=O)c2cccs2)OCCO3)C1 262610158 ARPLZXSENRSXJO-RYUDHWBXSA-N 387.461 2.838 0 50 GFAA Cn1cc([C@@H]2NC(=O)CC[C@H]2NCc2ccc(OCc3ccncc3)cc2)cn1 275363009 BHIUIAJMZCXMLS-IRLDBZIGSA-N 391.475 2.504 0 50 GFAA CCN1CCO[C@@H](CNC(=O)Nc2cn(C)nc2C2CC2)[C@@H]1c1ccccc1 292123731 UTQTXPVXGANLSB-ICSRJNTNSA-N 383.496 2.881 0 50 GFAA COc1ccccc1-c1ncc(CN2CC[C@H]3[C@H](C2)OCc2cnnn23)s1 299802080 ZYOCVZYDBPRCEB-WMZOPIPTSA-N 383.477 2.756 0 50 GFAA CCO[C@H]1C[C@H](NC(=O)NC2CCC(c3nc(C)no3)CC2)C12CCOCC2 369650214 VRXCWBYKMUUQRE-GQGLESIBSA-N 392.500 2.678 0 50 GFAA Cc1onc(-c2ccccc2)c1C(=O)N1CCC[C@@H](c2ccnn2CC(=O)O)C1 426441760 LBNDIDKVPBXMOK-MRXNPFEDSA-N 394.431 2.951 0 50 GFAA CN1CCC(N2CCN(C(=O)c3cccc(-c4ccccc4O)c3)CC2)CC1 426489764 QWWIQQBRUNFUIE-UHFFFAOYSA-N 379.504 2.911 0 50 GFAA CCCCN(Cc1cccc(Cl)c1)C(=O)NCCN(C)S(C)(=O)=O 584892740 PGNNYZYQILXTIT-UHFFFAOYSA-N 375.922 2.543 0 50 GFAA Cc1ccccc1CN(C)C(=O)CN1C(=O)O[C@@]2(CCc3ccccc32)C1=O 810014612 MZOCIJWKCYTYCD-JOCHJYFZSA-N 378.428 2.774 0 50 GFAA O=C(NCc1noc(C2CC2)n1)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 827758128 MPZNZNIAXSJKLA-UHFFFAOYSA-N 388.855 2.769 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCc2cccc3c2OCC3)(c2ccccc2)CC1 857814840 PZUPORRQTSLTQU-UHFFFAOYSA-N 390.483 2.984 0 50 GFAA CN1C[C@H](O)C[C@@H]1CNC(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 887602968 NYKUSZPNLGSTIA-QWFCFKBJSA-N 392.503 2.664 0 50 GFAA O=C(CN1CCc2ccccc2C1)N1CCC[C@H]1c1nc(-c2ccncc2)no1 952982165 FOJAZBRYKYMRLO-IBGZPJMESA-N 389.459 2.853 0 50 GFAA COC[C@@H](c1ccccn1)N(C)S(=O)(=O)c1ccc(-c2cc(C)no2)o1 952989909 IXKADTLUFXARKA-AWEZNQCLSA-N 377.422 2.646 0 50 GFAA Cc1c(NC(=O)c2cc(C(C)C)n3ncnc3n2)cccc1-c1nncn1C 952990024 JTPKYDZUOBAZKQ-UHFFFAOYSA-N 376.424 2.604 0 50 GFAA Cc1cc(-c2cc(S(=O)(=O)NCc3ccc(CO)cc3)c(C)s2)n[nH]1 1506402788 PKIJXRCJOAFCQK-UHFFFAOYSA-N 377.491 2.726 0 50 GFAA C[C@@]1(O)CCOC2(CCN(S(=O)(=O)c3ccc(F)cc3Cl)CC2)C1 1704297512 BIGKZTAOMSACKJ-OAHLLOKOSA-N 377.865 2.564 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N(C)C[C@@H]2CCCNC2)ccc1F 1704307573 ALVBVRUXUABJTK-CYBMUJFWSA-N 390.459 2.627 0 50 GFAA Cc1ccccc1CN1CC[C@@H](CNc2cncc(C(=O)N3CCCC3)n2)C1 1704356237 FBOMFKFCHUXZBY-SFHVURJKSA-N 379.508 2.955 0 50 GFAA Cc1onc(-c2c(Cl)cccc2Cl)c1CN1C[C@@H]2CNC[C@]2(CO)C1 1772704341 QRBYRLDRKHHQRD-KPZWWZAWSA-N 382.291 2.971 0 50 GFAA CCCOc1ccccc1-c1nnc(N2CCc3c(c(CO)nn3CC)C2)o1 1772705955 FDCCBXWMFLINDV-UHFFFAOYSA-N 383.452 2.797 0 50 GFAA COc1cc(C(=O)N[C@H]2C[C@H](Cn3cccn3)C[C@@H]2O)ccc1OC1CCCC1 1857532585 VENXKERMXMUPCA-SNRMKQJTSA-N 399.491 2.783 0 50 GFAA CC(C)(C)C(=O)NC[C@H]1[C@H]2CN(Cc3ccncc3Cl)C[C@]23CC[C@H]1O3 1857718669 NROPSXNAKKBDMP-DKYLXPRQSA-N 377.916 2.877 0 50 GFAA CC(=O)NC[C@H]1[C@H]2CN(Cc3ccc(OC(F)(F)F)cc3)C[C@]23CC[C@H]1O3 1857719888 WTINJDLBIWJFTG-BSDSXHPESA-N 384.398 2.701 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3cccc(F)c3)CC(=O)N2[C@H]1c1ccccc1 1857732260 JRRRNLQCKGPFLK-ZJOUEHCJSA-N 382.435 2.773 0 50 GFAA NCc1ccc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)cc1 1857733929 GEKAKEOGHLRQTH-VXKWHMMOSA-N 379.504 2.823 0 50 GFAA Clc1c[nH]ccc1=NC1CCN(c2cc(OC3CCOCC3)ncn2)CC1 1875288284 VTUVSDBXFJSKEM-UHFFFAOYSA-N 389.887 2.586 0 50 GFAA O=C(c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N1CCOC[C@@H](CO)C1 1875297933 IWHGXHRKPGLRDE-LLVKDONJSA-N 386.395 2.910 0 50 GFAA COCCc1nnc(NC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)s1 1875302299 JPOJHFYZTTWMBK-UHFFFAOYSA-N 398.370 2.579 0 50 GFAA C[C@H](CC(=O)N1CC[C@](O)(CNC(=O)CC2(C)CC2)C1)c1cccc(F)c1 1875305023 CLURAUQKXHMIJU-VFNWGFHPSA-N 376.472 2.589 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](NCc3cccc(F)c3C)C2)c1C 1875397767 NCDBVIUJVGJRFO-QGZVFWFLSA-N 385.487 2.611 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](c3ccccn3)C(C)C)C2)c1C 1875397778 NMOXOPIPZYASKA-IEBWSBKVSA-N 396.539 2.756 0 50 GFAA O=C(c1ccncc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2Cc2ccncc2)C1 2325794603 JWHOOCRWEOCCNR-VQTJNVASSA-N 378.476 2.563 0 50 GFAA O=C(O)c1ccc(C(=O)c2ccc3c(c2)C(=O)N(c2nccs2)C3=O)cc1 853021 ZVZRQFUKAUGCLQ-UHFFFAOYSA-N 378.365 2.873 0 50 GFAA CCCN=c1ncc(CN2CCC[C@@]23CCCN(Cc2ccccc2)C3=O)c[nH]1 2356166922 OYXCYNABBXRDEO-HSZRJFAPSA-N 393.535 2.878 0 50 GFAA O=C(C[C@H]1CCOc2ccccc21)N1CCN(C(=O)c2ccccc2O)CC1 117970807 JJRPLUZPJDZEQZ-MRXNPFEDSA-N 380.444 2.633 0 50 GFAA CS(=O)(=O)c1csc(C(=O)NCC2CCN(Cc3cccs3)CC2)c1 119814944 WJUVUMOTDYKYPE-UHFFFAOYSA-N 398.575 2.855 0 50 GFAA CC1(C)SC[C@@H](C(=O)NCc2cccnc2Oc2ccccc2F)NC1=O 67560972 JTWBRTUUZAXKAN-AWEZNQCLSA-N 389.452 2.639 0 50 GFAA CC(C)c1noc(CN(C)C(=O)c2cc(Cn3cnc4ccccc43)[nH]n2)n1 67805863 MYDPFMNFBXPRFZ-UHFFFAOYSA-N 379.424 2.586 0 50 GFAA Cc1cccc(-c2c[nH]nc2C2CCN(C(=O)CN3CCC(O)CC3)CC2)c1 67676183 TXDHOWNRLSISHK-UHFFFAOYSA-N 382.508 2.548 0 50 GFAA CCOC(=O)c1[nH]c(=O)[nH]c1CN(Cc1ccccn1)Cc1sccc1C 63832319 IRIVXOCBPYUYPS-UHFFFAOYSA-N 386.477 2.847 0 50 GFAA Cc1nnnn1-c1cccc(C(=O)N(C)Cc2cc(-c3cccs3)n[nH]2)c1 216421593 QEEQDRUBAIHSIV-UHFFFAOYSA-N 379.449 2.695 0 50 GFAA COc1ccc(CCNC(=O)[C@H]2CC(c3ccccc3OC)=NO2)cc1OC 6738373 KBPOMSHLBANNFA-HXUWFJFHSA-N 384.432 2.564 0 50 GFAA biogenic CCOc1ccc(CN2CCN(Cc3ccccc3C)[C@H](CCO)C2)cc1CO 39371685 SBCZCNHVGUKAAD-HSZRJFAPSA-N 398.547 2.955 0 50 GFAA Cc1cc(S(C)(=O)=O)cc(NC(=O)N2C[C@H](N3CCCC3)C[C@H]2C)c1C 483421703 VFGBHPZTFZXBDJ-GDBMZVCRSA-N 379.526 2.797 0 50 GFAA C[C@H](OC(=O)C1=NN(c2ccccc2)C(=O)CC1)C(=O)N[C@H]1CCCC[C@H]1C 245284856 UKPQPLKFCIELAZ-VYDXJSESSA-N 385.464 2.796 0 50 GFAA CCCN1CC2(CCN(C)CC2)C[C@H]1C(=O)NCCc1ccc(OCC)cc1 72429109 IUXNFBOJPNDKQC-NRFANRHFSA-N 387.568 2.940 0 50 GFAA CCc1ccc([C@@H]2COCCN2C(=O)Cc2csc(N3CCCC3=O)n2)o1 133804564 HWMMVXLKZHQAGE-HNNXBMFYSA-N 389.477 2.568 0 50 GFAA CC(=O)N(Cc1noc(C(C)C)n1)[C@H]1CCN(Cc2ccc3c[nH]nc3c2)C1 371336340 OWFYSPNUYTUJQX-KRWDZBQOSA-N 382.468 2.692 0 50 GFAA Cc1ccc(-c2cc(CNC(=O)CCc3cc4n(n3)CCCNC4)no2)cc1 72410558 BDYPLRGHDOAKNM-UHFFFAOYSA-N 379.464 2.589 0 50 GFAA COc1ccccc1-c1c2c(=O)n(Cc3ccccn3)ccc2nc2ncnn12 40398197 FOBORPBVQOSGAK-UHFFFAOYSA-N 384.399 2.558 0 50 GFAA Cc1nn(CC(=O)N2CCC(n3cc(C(C)(C)C)nn3)CC2)c(C)c1Cl 48282089 CBPBZVQBXPKAPW-UHFFFAOYSA-N 378.908 2.906 0 50 GFAA CN(C(=O)CN1CCN(C(=O)NCCCc2ccccc2)CC1)c1ccccc1 426547662 SOVKCJHLLKSHEG-UHFFFAOYSA-N 394.519 2.609 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NC[C@H]3CCCO3)csc2C1 426621549 DECQUBDTMRARNB-CQSZACIVSA-N 375.494 2.820 0 50 GFAA CC[C@@H]1CN(C(=O)c2ccc(-c3ccc(CC(=O)N(C)C)cc3)cc2)CCN1 426538090 LNPZIYLUQCTPHE-OAQYLSRUSA-N 379.504 2.808 0 50 GFAA O=C1NCCN(C(=O)c2ccn3ccnc3c2)[C@@H]1c1ccccc1C(F)(F)F 180306186 GASISHHMGJPAAU-MRXNPFEDSA-N 388.349 2.666 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1n[nH]c3ccccc13)CC2 294163195 BIKHDLKTKVMQST-MRXNPFEDSA-N 395.415 2.794 0 50 GFAA CCN1CCc2[nH]cnc2C12CCN(C(=O)c1cc(F)c(F)c(F)c1)CC2 91819977 WBXHCZZINQJZBO-UHFFFAOYSA-N 378.398 2.837 0 50 GFAA O=C(c1cccc2nccnc12)N1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1 91964794 SZVPQUIQJDYJOX-QFIPXVFZSA-N 378.476 2.885 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(C(=O)c2ccc(CO)cc2)C3)cc1 91325766 WPDSADKGINLCGU-PZJWPPBQSA-N 380.488 2.924 0 50 GFAA CC(C)Oc1ccc(-c2nc(C(=O)N3CCOC[C@@H]3C(=O)O)cs2)cc1 268970199 GMLRLCFTAGYLTQ-OAHLLOKOSA-N 376.434 2.523 0 50 GFAA Cc1ccc(-c2noc(CNC(=O)N3CCC[C@H](Cn4ccnc4)C3)n2)cc1 534676097 GJKXTONJXNMDCD-MRXNPFEDSA-N 380.452 2.863 0 50 GFAA CCOc1ccc(-c2csc3ncn([C@H](C)c4nc(N)n[nH]4)c(=O)c23)cc1 584889580 IVZZFDCEIHHHIT-SNVBAGLBSA-N 382.449 2.833 0 50 GFAA O=C(Nc1cccc2nn[nH]c12)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1875289441 SJMPAWMFHAKUSF-VFNWGFHPSA-N 391.431 2.945 0 50 GFAA N[C@H](CCNC(=O)NC[C@H](c1cccc(O)c1)N1CCCC1)Cc1ccccc1 1875354573 JMBIBNZUPQDQOG-IFMALSPDSA-N 396.535 2.788 0 50 GFAA Cc1cc(C(=O)N2CC(=C3CC(=O)NC3=O)C2)c(C)n1[C@@H](C)c1ccccc1 1875302039 XTGAHGGCQSLCMB-AWEZNQCLSA-N 377.444 2.513 0 50 GFAA CCCc1noc(CN(C)C(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2C)n1 952962124 ARMWKHXTVVAECK-INIZCTEOSA-N 386.452 2.720 0 50 GFAA O=C(Cc1cccc2ccccc12)N[C@H]1CCN(Cc2cccnc2)C[C@@H]1O 1565506884 XMSABZZYZSVQMQ-VXKWHMMOSA-N 375.472 2.529 0 50 GFAA O=C(c1ccc2[nH]ccc2c1)N1C[C@@H]2CC[C@H](C1)C(=O)N2Cc1cscn1 1565528090 WXLGXIJJTZXUST-WBVHZDCISA-N 380.473 2.888 0 50 GFAA Cc1ccccc1[C@@H]1[C@@H](C(=O)N(C)CCCOc2ccccc2)OCC(=O)N1C 1529161603 LSTDRJYYQSQBNV-YADHBBJMSA-N 396.487 2.821 0 50 GFAA Cc1noc(C)c1CCC(=O)N1C[C@H](Cc2ccc3ccccc3n2)[C@@H](O)C1 1616080348 MRYJINMICHHIBT-UWJYYQICSA-N 379.460 2.834 0 50 GFAA Cc1cc(=O)oc2ccn(CCC(=O)Nc3nc4ccccc4s3)c(=O)c12 1772491408 XXWBQBAYCXNOQO-UHFFFAOYSA-N 381.413 2.902 0 50 GFAA Cc1cc(C(=O)N2CCCN(c3ncccc3C(=O)N3CCCC3)CC2)c(C)o1 1772811820 XZFADXHTSCQVRJ-UHFFFAOYSA-N 396.491 2.880 0 50 GFAA O=C(Nc1ccccc1)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 11697666 MRFAVFPWHCAJGD-UHFFFAOYSA-N 375.436 2.969 0 50 GFAA COc1ccc(N[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)cc1OC 12315168 UQYRGIZGIPCSLL-MRXNPFEDSA-N 376.478 2.969 0 50 GFAA CN(C(=O)c1ccc2c(c1)no[n+]2[O-])[C@H]1CCCN(CCCc2ccccc2)C1 12764214 DXJDSVIQXQJVAA-IBGZPJMESA-N 394.475 2.630 0 50 GFAA COc1cccc(-c2nc3ccc(C(=O)N4CCCN(C=O)CC4)cc3o2)c1 15064307 IUVDNAVETWCQFH-UHFFFAOYSA-N 379.416 2.808 0 50 GFAA CC[C@@H]1CN2CC[C@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC 17149644 DAXYUDFNWXHGBE-XYEDMTIPSA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro CCOc1ccc(CN2CCN(CCc3ccccc3)[C@@H](CCO)C2)cc1CO 19220983 PXNBNBWUKVPWIR-QHCPKHFHSA-N 398.547 2.689 0 50 GFAA COc1ccc(C)cc1NC(=O)CCn1ccn2nc3c(c2c1=O)CCCC3 169760178 NJNVTZAHMJOHIZ-UHFFFAOYSA-N 380.448 2.721 0 50 GFAA Cc1ncn(C)c1C(=O)N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857674254 ZXXCNOOOIPSSKO-OAQYLSRUSA-N 383.496 2.642 0 50 GFAA CN(C)c1ccc(C(=O)N[C@H]2CC[C@@H](NC(=O)CCOc3ccccc3)C2)cc1 1857685914 ZRTCQRGXMBUQJC-MOPGFXCFSA-N 395.503 2.989 0 50 GFAA O=C(c1n[nH]c2c1CCC2)N1CCO[C@@H](CN2CCCC2)[C@@H]1c1ccccc1 1857715308 LUAQMXUBGSNUBK-FPOVZHCZSA-N 380.492 2.577 0 50 GFAA CCC(CC)C(=O)NC[C@H]1[C@H]2CN(C(=O)c3cccs3)C[C@]23CC[C@H]1O3 1857716796 FHSZBEIZMFFXCZ-QCBUCWTNSA-N 376.522 2.920 0 50 GFAA CC(C)(C)OC(=O)N[C@H](Cc1ccc(I)cc1)C(=O)O 2568077 JZLZDBGQWRBTHN-LLVKDONJSA-N 391.205 2.812 0 50 GFAA biogenic,in-vitro CCc1nc2n(n1)C[C@H](NC(=O)c1ccc(-n3nc(C)cc3C)c(F)c1)CC2 114863524 BLMCXSVGUKQTOI-OAHLLOKOSA-N 382.443 2.527 0 50 GFAA O=S(=O)(N[C@@H]1CCCN(c2cccc(F)c2)C1)c1cccc2c1OCCO2 116368177 BVVSTYQZGTZGFP-OAHLLOKOSA-N 392.452 2.544 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)N1CCN(c3ccncc3Cl)CC1)CO2 123297967 KMORVTDSNCBWPG-OAHLLOKOSA-N 387.867 2.644 0 50 GFAA COc1ccc2c(c1)C[C@@H](C(=O)Nc1ccn(CCc3ccncc3)n1)CO2 123377312 SVMALFVISPWOEY-QGZVFWFLSA-N 378.432 2.719 0 50 GFAA C[C@H]1CN(C(=O)Cn2cc(NC(=O)NC(C)(C)c3ccccc3)cn2)C[C@H](C)O1 363311461 XHRAOGOZBCFRMP-HOTGVXAUSA-N 399.495 2.576 0 50 GFAA CCn1cnc2c(NCc3ccc(C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)ncnc21 264655354 JSEUFGUYYNVUAW-HUUCEWRRSA-N 394.479 2.708 0 50 GFAA CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(OC)c1 4156384 XQEPMDYKCGSDGU-MRXNPFEDSA-N 380.466 2.628 0 50 GFAA O=C(CN1CCO[C@H](c2cccc(C(F)(F)F)c2)C1)NCc1ccccn1 2325740887 KDADUIIKUWGCSK-KRWDZBQOSA-N 379.382 2.790 0 50 GFAA CCOc1ccc(C(=O)N2Cc3c[nH]nc3[C@H](c3n[nH]c(CC)n3)C2)cc1C 2325775909 AUWMJRIDUYGKNA-OAHLLOKOSA-N 380.452 2.585 0 50 GFAA CCc1ncnc(N(C)CC[C@@H](NC(=O)c2c(C)nn(C)c2F)C(C)C)c1F 2325794927 XARISGQXSMHPOY-CQSZACIVSA-N 394.470 2.640 0 50 GFAA COc1ccc(CN2CCC[C@]3(CCc4cnc(C)nc43)C2)c(C(=O)O)c1OC 2356143153 WNXNHCGASFKEQQ-QFIPXVFZSA-N 397.475 2.980 0 50 GFAA Cc1c(C(=O)N2CCc3nc(-c4ccccc4)nn3CC2)[nH]c2c1C(=O)CCC2 2356149058 ICJOQKNDGIZUEH-UHFFFAOYSA-N 389.459 2.799 0 50 GFAA COc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)N1CCCC1 8560358 JTKMFZLGRDPSDD-UHFFFAOYSA-N 378.425 2.871 0 50 GFAA CCOC(=O)c1ccc(N2C(=O)C[C@@H](NCc3ccc(Cl)cc3)C2=O)cc1 100570042 MYMWMEKHLYUVLQ-QGZVFWFLSA-N 386.835 2.938 0 50 GFAA CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCN(Cc2csc([C@H]3CCCO3)n2)C1 328606723 SPDDQZIVOIEYTQ-CZUORRHYSA-N 389.525 2.799 0 50 GFAA Cc1nn(C)c2ncc(S(=O)(=O)NC3(c4ccc(F)cc4F)CCC3)cc12 134961213 SWMRUOAJUZHWMQ-UHFFFAOYSA-N 392.431 2.913 0 50 GFAA C[C@@H](CC(C)(C)c1ccccc1)NC(=O)N1CCCN(CC(=O)N(C)C)CC1 69243620 QRBUYQVICUGQFF-SFHVURJKSA-N 388.556 2.548 0 50 GFAA O=C(Cn1cnc2sccc2c1=O)NCCn1ccc2c(Cl)cccc21 170625259 YCDLFUWHCFQIQO-UHFFFAOYSA-N 386.864 2.883 0 50 GFAA COCc1ncsc1C(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1 283282684 DZJWGBYOYJOCQK-MRXNPFEDSA-N 395.912 2.746 0 50 GFAA COc1cccc(OC)c1CN1CCN(Cc2ccc(F)cc2)[C@H](CCO)C1 39445007 MPHSOXDOPBOFID-LJQANCHMSA-N 388.483 2.912 0 50 GFAA C[C@@H](NC(=O)c1ccc(-n2ncc(C(=O)O)c2C(F)(F)F)cc1)[C@@H]1CCOC1 237348370 RMMZKZLMLQWLII-ZYHUDNBSSA-N 397.353 2.744 0 50 GFAA COC(=O)[C@H](CNC(=O)C(C)(C)c1ccc(F)cc1)Oc1ccc(F)cc1 129351795 CYDGQGKWOAPFMK-KRWDZBQOSA-N 377.387 2.979 0 50 GFAA CC(C)Oc1ncccc1C(=O)N1CCOC[C@@H]1c1ncnn1-c1ccccc1 284551952 PZADKOXYHCEONA-GOSISDBHSA-N 393.447 2.663 0 50 GFAA Brc1ccc(-c2nnn(Cc3nc(-c4ccccn4)no3)n2)cc1 362966766 ILEJHMPZMBSFSI-UHFFFAOYSA-N 384.197 2.596 0 50 GFAA O=C(NCCOc1ncccc1C(F)(F)F)c1ccnc(NC(=O)C2CC2)c1 285720566 JIKNGYKJCDEWKH-UHFFFAOYSA-N 394.353 2.653 0 50 GFAA COc1ccccc1O[C@H]1CCCN(C(=O)c2ccc3[nH]c(=O)n(C)c3c2)C1 285922422 UUGVCTXZPGFYAS-HNNXBMFYSA-N 381.432 2.559 0 50 GFAA CCc1cccc(NC(=O)N2CCN(c3cc(-n4ccc(C)n4)ncn3)CC2)c1 72437582 XTBQBERRYJYKLB-UHFFFAOYSA-N 391.479 2.887 0 50 GFAA Cn1nccc1C1=CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)CC1 287575356 FLXBRFCPIHKMPE-QGZVFWFLSA-N 397.454 2.554 0 50 GFAA Cc1nonc1OCCNC(=O)C[C@H](c1ccccc1)c1ccc2c(c1)OCO2 95525068 WUDLLPAOJUNYQH-QGZVFWFLSA-N 395.415 2.824 0 50 GFAA O=C(c1ccccc1-n1cnnc1)N1CCN([C@H]2CCc3ccccc3C2)CC1 426658511 RAFSEULOZPBQLV-FQEVSTJZSA-N 387.487 2.583 0 50 GFAA O=C(Cn1ccnc1-c1ccccc1)NCc1nc(Cc2cccs2)no1 95521628 BPRFYIPBTMKGOJ-UHFFFAOYSA-N 379.445 2.902 0 50 GFAA O=C(NCc1ccco1)c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@@H]45)[C@H]3C2=O)cc1 239174188 PMCXEGKYIKKDNM-GFLQDLJJSA-N 388.423 2.767 0 50 GFAA NCCc1cccc(CN2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)c1 91536478 KCBOQTZSDZYNHX-UHFFFAOYSA-N 392.547 2.988 0 50 GFAA CCn1c(CN2CCCC2)nnc1C1CCN(C(=O)c2cccc(C)n2)CC1 96151786 OUMHAUJPVNGDQI-UHFFFAOYSA-N 382.512 2.617 0 50 GFAA CCOCCn1nc(C)cc1C(=O)N1CCC[C@@H](c2ccc(C(=O)O)cc2)C1 95355004 DBTDBCCVOSVSHE-GOSISDBHSA-N 385.464 2.946 0 50 GFAA Cc1ccc(NC(=O)N2Cc3ccccc3O[C@H](C)C2)cc1N1C(=O)CNC1=O 297660987 YWKZGPPGQCYAPF-CQSZACIVSA-N 394.431 2.866 0 50 GFAA O=C1C[C@H](NC(=O)N2CCCN(c3ccccc3)CC2)CN1Cc1ccccc1 584890158 WLYYXFXQOAYULZ-FQEVSTJZSA-N 392.503 2.709 0 50 GFAA CS(=O)(=O)C[C@@H]1CCCN(C(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320023 CVGXKSMQFRMRSP-LLVKDONJSA-N 390.427 2.875 0 50 GFAA C[C@H](NC(=O)N1CCS(=O)(=O)CC[C@H]1C)c1ncc(-c2ccc(F)cc2)o1 1875300409 BWLLBWVCEYFJNV-OLZOCXBDSA-N 395.456 2.760 0 50 GFAA Cc1noc(C)c1C(=O)NCC1CCN(Cc2nnc(-c3ccccc3)o2)CC1 952974836 CNFUBBATBNXWAL-UHFFFAOYSA-N 395.463 2.983 0 50 GFAA CN(c1ccccc1NC(=O)N[C@H]1CCOc2c(F)cccc21)S(C)(=O)=O 276009205 INBZVDDIUJGEES-AWEZNQCLSA-N 393.440 2.867 0 50 GFAA CN(C)C(=O)[C@H]1CCCN(C(=O)C2=Cc3cc(Br)ccc3OC2)C1 170599190 KBSCPHCCXDMVJS-LBPRGKRZSA-N 393.281 2.552 0 50 GFAA CNC(=O)c1cccc(NC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c1 171509170 DDMPTTBMRDRZBB-GOSISDBHSA-N 380.492 2.732 0 50 GFAA CCN(CC(=O)O)C1CCN(C(=O)c2ccc(Br)cc2F)CC1 186641593 PQQKXAZNJLTMKK-UHFFFAOYSA-N 387.249 2.599 0 50 GFAA COc1cc(N2CCN(C(=O)c3cnccc3Oc3ccccc3)CC2)ncn1 409965245 OSAWAOFEEGXSRE-UHFFFAOYSA-N 391.431 2.635 0 50 GFAA O=C(c1ccccc1)N1CCCN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)CC1 194124030 NOBQLPWYDHUJNY-QGZVFWFLSA-N 397.441 2.635 0 50 GFAA Cc1cccc(OCC(=O)N2CCCN(C(=O)CSC(C)C)CC2)c1C 1704326184 ZXUVIRSGHPKWPG-UHFFFAOYSA-N 378.538 2.885 0 50 GFAA O=C(NCc1ccc(F)cc1F)[C@@H]1CCc2sc(N3CCOCC3)nc2C1 1772807612 ZPLDISJXQIMQFW-GFCCVEGCSA-N 393.459 2.679 0 50 GFAA CCc1c(C(=O)NCCCn2ccnc2)c(=O)cc(C)n1Cc1ccc(C)o1 11912155 RNJTYNFMPWKOLX-UHFFFAOYSA-N 382.464 2.685 0 50 GFAA COc1ccccc1CCN1CCC[C@@H](CN(C)C(=O)c2cc(C)n(C)n2)C1 12438379 YUVLAQSOBQYCDN-SFHVURJKSA-N 384.524 2.764 0 50 GFAA O=C(c1ccc(-c2ccccc2)c(F)c1)[C@H]1CCCN(C(=O)Cn2cnnn2)C1 12442252 UDZBXWYGBASIJS-KRWDZBQOSA-N 393.422 2.601 0 50 GFAA CNc1ncccc1CN1CCC[C@H]1c1ccc(C(=O)NCCN(C)C)s1 19771187 LWDSLZRTIZCDAN-INIZCTEOSA-N 387.553 2.813 0 50 GFAA Cc1ccc(CC(=O)N2CCC(c3n[nH]c(=O)n3-c3ccccc3)CC2)cc1 169780190 ANDJHAZQKSIQQR-UHFFFAOYSA-N 376.460 2.818 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C(=O)c3c(C)nn4c(C)cc(C)nc34)C[C@H]12 1857711273 QZSRNJMBXQDASF-JUKXBJQTSA-N 396.491 2.728 0 50 GFAA Cc1ccsc1C(=O)NC[C@H]1[C@H]2CN(c3nccs3)C[C@]23CC[C@H]1O3 1857718471 VOBMXVYHQWPGLJ-HNSFDTNUSA-N 375.519 2.927 0 50 GFAA COCCC[C@@]1(CO)CN(C(=O)c2ccccc2-c2ccccc2)CC[C@H]1O 1857719971 XYXUTGPRKPFOMX-GGAORHGYSA-N 383.488 2.966 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)N(C)Cc4cc(C)on4)CC3=O)sc2c1 1857731800 PBLABDZEPZDGKF-ZDUSSCGKSA-N 384.461 2.913 0 50 GFAA O=C(c1cccnc1C(F)(F)F)N1CCN2[C@@H](c3ccccc3)COC[C@H]2C1 1875244937 BTQDKBRNZRXEDL-NVXWUHKLSA-N 391.393 2.998 0 50 GFAA CCCCN1CCC[C@]2(CCc3c2nc(C)[nH]c3=NCCCn2ccnc2)C1 1875248572 YEKCVYZMUAXYPW-QFIPXVFZSA-N 382.556 2.986 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCCC2)CC[C@H]1NC(=O)c1cncc(F)c1 1875249940 KVFVSACWZYSGAX-BMGDILEWSA-N 377.460 2.537 0 50 GFAA O=C(Nc1nc2ccc(S(=O)(=O)N3CCCCC3)cc2s1)[C@@H]1CCCO1 1118977 DAMOOGIJYSKQLK-AWEZNQCLSA-N 395.506 2.588 0 50 GFAA COc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)c(OC(C)C)c1 252490605 KXSANDMERBZINZ-UHFFFAOYSA-N 384.480 2.882 0 50 GFAA COc1ccc(C(=O)N2CCCC[C@H]2CCn2cc(C(=O)NC(C)C)nn2)cc1 19809866 ASLIAIVMCSIISY-KRWDZBQOSA-N 399.495 2.510 0 50 GFAA COc1cccc(-c2nc(C(=O)N[C@@H]3CCN(c4ccccn4)C3)c(C)[nH]2)c1 161594327 GDUHOLJKIHRPTG-MRXNPFEDSA-N 377.448 2.797 0 50 GFAA CN1C(=O)CCC[C@H]1C(=O)N1CCC(c2nccc(-c3cccc(F)c3)n2)CC1 912773947 GMFIODUXMWIQJG-IBGZPJMESA-N 396.466 3.000 0 50 GFAA NCC[C@H]1Cc2ccccc2N(S(=O)(=O)c2c[nH]c3nccc(Cl)c23)C1 923748323 LMPMAIRGVJXCFZ-LBPRGKRZSA-N 390.896 2.933 0 50 GFAA Cc1nc2c(C(=O)N3CCC[C@H](c4nc(CC(C)C)no4)C3)ccnc2n1C 2100482453 AIFCGRQIRHVFTE-AWEZNQCLSA-N 382.468 2.878 0 50 GFAA Cc1nn(CC(=O)N[C@@H]2CCC[C@@H](CN3CCCCC3)C2)c(=O)c2ccccc12 2100556399 MILOKOHAYLETBB-RTBURBONSA-N 396.535 2.866 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccc(Oc2ccccc2)cn1 2325786163 JYUMTTHBVHLUCU-CDHQVMDDSA-N 378.432 2.640 0 50 GFAA CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cncc(-c3cnn(C)c3)c1)C2 2325803083 PCXGLTNXOPFXSU-UHFFFAOYSA-N 375.476 2.742 0 50 GFAA O=C(c1nccc2ccsc12)N1C[C@@H]2C[C@H]1CN2C(=O)C1(O)CCCCCC1 2325829851 UPSQVDZIGAUIDS-HOTGVXAUSA-N 399.516 2.807 0 50 GFAA NCc1ccc(NC(=O)C[C@@H]2Cn3nc(-c4ccccc4)cc3NC2=O)cc1F 2325859098 OAZZBXGNYMCDEZ-OAHLLOKOSA-N 393.422 2.745 0 50 GFAA CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1cc2c(c(OC)c1)O[C@H](C)C2 910541073 BEWDTQUMKQKQRF-GFCCVEGCSA-N 386.448 2.582 0 50 GFAA CCC1(C(=O)N[C@H]2CC3(CN(Cc4cc(C)on4)C3)n3ccnc32)CCCC1 2332237741 JWVSHTBRESOPLV-KRWDZBQOSA-N 383.496 2.922 0 50 GFAA O=C1c2ccccc2C(=O)N1Cc1nc2ccccc2c(=O)n1-c1nccs1 715830 LYPBXHUDCVHGIC-UHFFFAOYSA-N 388.408 2.638 0 50 GFAA O=C(NCCCn1cc(Br)cn1)c1ccc(Br)o1 2776655 XVXJLFYKGCXRDH-UHFFFAOYSA-N 377.036 2.821 0 50 GFAA COc1ccc(NC(=O)/C(=C/c2ccc(OC(C)=O)c(OC)c2)NC(C)=O)cc1 4957557 IESFAXYDVGBVIB-WQRHYEAKSA-N 398.415 2.745 0 50 GFAA COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCOC(C)C)cc(Cl)c1O 5008693 OIAHKHLINHADBI-HNNXBMFYSA-N 398.843 2.650 0 50 GFAA O=C(Cc1ccccc1F)Nc1ccc2c(c1)CN(C(=O)[C@H]1CCOC1)CC2 12074271 NQYUNCCSJLMOEO-KRWDZBQOSA-N 382.435 2.928 0 50 GFAA O=C(CN1CCCCCC1)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 12421757 UYHNWMYDZLTADC-UHFFFAOYSA-N 394.522 2.758 0 50 GFAA CCOC(=O)[C@H]1CCCN([C@H]2CCC(=O)N(Cc3cccc(F)c3)CC2)C1 14958100 RKPPZEBBFMRDRW-HKUYNNGSSA-N 376.472 2.982 0 50 GFAA O=C(Nc1cccc(F)c1)N1CCN(c2cc(N3CCCCC3)ncn2)CC1 38528649 GDHVHVPLRUUTMI-UHFFFAOYSA-N 384.459 2.960 0 50 GFAA Cc1nc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc(-n2cccn2)n1 67622990 IAEAFTKRFONGES-UHFFFAOYSA-N 382.855 2.587 0 50 GFAA Cc1cccc(O)c1NC(=O)C[C@@H]1COc2ccc(C(=O)N(C)C)cc2N1C 71750348 DNTFFRMFZGTURG-OAHLLOKOSA-N 383.448 2.628 0 50 GFAA CN(Cc1ccccc1)[C@@H]1CCCN(c2cncc(C(=O)N3CCCC3)n2)C1 72173904 PZVGRDTZSHRGNJ-LJQANCHMSA-N 379.508 2.813 0 50 GFAA O=C(c1scc2c1OCCO2)N1CCC[C@]2(CCC(=O)N(C3CC3)C2)C1 77519031 CKBSIBAYAIJNFJ-IBGZPJMESA-N 376.478 2.527 0 50 GFAA O=C(CCc1ccncc1)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 91663162 JBDPJICDKGJPOT-UHFFFAOYSA-N 392.503 2.841 0 50 GFAA Cc1ccc(-c2ncc(C(=O)NCCc3ccc(N(C)C)cc3)c(=O)[nH]2)cc1 91694858 ZXUKBWJBJWHADA-UHFFFAOYSA-N 376.460 2.784 0 50 GFAA O=C(c1cccs1)[C@@H]1CCCN(C(=O)c2coc(CN3CCOCC3)c2)C1 95383807 YEXWDKAMFFNUFQ-OAHLLOKOSA-N 388.489 2.908 0 50 GFAA CC(C)CN1CCc2nc[nH]c2C12CCN(C(=O)c1cnn(C(C)C)c1)CC2 95502694 NARXGLBUBHMULS-UHFFFAOYSA-N 384.528 2.833 0 50 GFAA Cc1ccc2c(C)c(C(=O)N3CCC[C@@H](c4nccn4CC(N)=O)C3)oc2c1 95503530 KEPAHFJNBONXMS-OAHLLOKOSA-N 380.448 2.751 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1NC(=O)NCCc1nc(C(C)C)cs1 96141976 XBOPQQDLQKOLEK-UHFFFAOYSA-N 382.511 2.587 0 50 GFAA Cc1cccn2c(CC(=O)N3CC[C@@]4(CC(=O)c5ccccc5O4)C3)cnc12 97654086 WWMDZOYZSXOMGF-JOCHJYFZSA-N 375.428 2.822 0 50 GFAA O=C(COc1nnc(-c2ccccc2)o1)NCc1ccc(N2CCCC2=O)cc1 122361007 KUBIJIKPZLNNAW-UHFFFAOYSA-N 392.415 2.559 0 50 GFAA O=C1N[C@H](CCc2ccccc2)C(=O)N1CC(=O)N1CCC[C@@H]2CCCC[C@@H]21 129485225 OKXRFDQHOMIIRC-OTWHNJEPSA-N 383.492 2.721 0 50 GFAA Cc1nnc(-c2ccc(C(=O)N3CC[C@H]4[C@@H](CCC(=O)N4C4CC4)C3)cc2)o1 129710635 SAKOBCFYXBWQKF-WMZOPIPTSA-N 380.448 2.661 0 50 GFAA Cc1noc([C@@H]2CCCN(C(=O)c3cccc(OCc4noc(C)n4)c3)C2)n1 157291858 CSERZBGGWLIYFL-OAHLLOKOSA-N 383.408 2.668 0 50 GFAA CC1(C(=O)N[C@H]2CCCN(c3cccnn3)C2)CCN(Cc2ccccc2)CC1 157950704 YMXLLTPXQAJKIW-FQEVSTJZSA-N 393.535 2.864 0 50 GFAA Cc1cn2nc(C(=O)NCCCc3ccccc3)cc2c(N2CCSCC2)n1 169749788 JFHRBYAEICKLCT-UHFFFAOYSA-N 395.532 2.954 0 50 GFAA CCc1noc(-c2cccn3c(CNC(=O)Cc4ccc(Cl)cc4)nnc23)n1 169781033 ANEXRYUMDUVMBS-UHFFFAOYSA-N 396.838 2.854 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 170620886 FSXSADROSLCJJA-YIOUJQMASA-N 384.464 2.722 0 50 GFAA CCCS(=O)(=O)Nc1cccc(NC(=O)N2CCC(c3ccn[nH]3)CC2)c1 173432545 TUNCHFCLSMYMNR-UHFFFAOYSA-N 391.497 2.973 0 50 GFAA C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCC[C@@H]2CCNC2)cc1 178940581 AFBJFHPFOVQJIM-KURKYZTESA-N 387.524 2.584 0 50 GFAA Cc1cccc(CN[C@@H]2CCc3c(sc4ncn(CCCO)c(=O)c34)C2)c1 200537318 ALFDSSKZNHKQKN-MRXNPFEDSA-N 383.517 2.796 0 50 GFAA O=C(Cc1cccnc1)N1C[C@@H]2OC(=O)N(CCc3cccc(Cl)c3)[C@@H]2C1 216424076 QVFSLLHVBXYXFH-MSOLQXFVSA-N 385.851 2.552 0 50 GFAA Cc1[nH]c2c(C)ccc(C)c2c1CC(=O)N[C@@H](c1cnn(C)c1)C1CC(O)C1 223067702 CLPOVPHFPIGCLX-SGHZUCRHSA-N 380.492 2.998 0 50 GFAA O=C(N[C@@H]1COCC[C@@H]1OCc1ccccc1)c1cc(=O)c2ccccc2o1 223927348 JWSWEFSZYRRYEL-XLIONFOSSA-N 379.412 2.897 0 50 GFAA O=C1[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)N1CCS(=O)(=O)c1ccc(Cl)cc1 225395360 UJOARQYFMKELOE-WQVCFCJDSA-N 396.896 2.709 0 50 GFAA COc1cccc(Cl)c1CNC(=O)N1CCO[C@@](C)(c2cnn(C)c2)C1 239667644 BQZIJIPPJGRNMG-GOSISDBHSA-N 378.860 2.539 0 50 GFAA C[C@@H]1[C@@H](NC(=O)CN2C(=O)N[C@H](Cc3c[nH]c4ccccc34)C2=O)CCC[C@H]1C 241121736 JDPIQTJSTHWUOZ-MCPREKNCSA-N 396.491 2.572 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)C(=O)N3Cc2cscn2)c(F)c1 247879830 IIYUGVTWNKKRCE-ZBFHGGJFSA-N 375.469 2.914 0 50 GFAA CCS(=O)(=O)N1CCC(NC(=O)N[C@@H](c2ccccc2C)C2CC2)CC1 264899328 YRYLOMFUGBWMID-GOSISDBHSA-N 379.526 2.559 0 50 GFAA O=C(c1cc(CCc2ccccc2)no1)N1CCCN(c2ncccn2)CC1 299776746 LHPUXLJVGLZXGG-UHFFFAOYSA-N 377.448 2.602 0 50 GFAA COc1cc(CNC[C@H]2CCc3nc(C(F)(F)F)cn3C2)cc2c1OCO2 328626604 FFWXNDVIZMSWSA-LLVKDONJSA-N 383.370 2.991 0 50 GFAA O=C(c1cccc(CNc2ccncn2)c1)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 329470417 YFBRAYZTDLFMKR-PZJWPPBQSA-N 391.519 3.178 0 50 GFAA O=C(/C=C/c1ccc(S(=O)(=O)NC2CC2)cc1)N1CC2(CCC2)[C@H]1C1CC1 366337411 WBNJBRQWBZGYIV-FTJUBABDSA-N 386.517 2.932 0 50 GFAA Cc1cnc([C@H](C)NC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)s1 367450882 MXRJPCRDRDINQK-AWEZNQCLSA-N 394.518 2.652 0 50 GFAA CC(C)(C)c1nnc(CNC(=O)NCC2(N3CCOCC3)CCCCC2)s1 378114466 KWYQDLDDFLTKPW-UHFFFAOYSA-N 395.573 2.670 0 50 GFAA Cc1nn(C)c(S(=O)(=O)N[C@H]2COc3cccc(Cl)c32)c1C(F)F 416487693 MDKHCXIUJZZHOB-VIFPVBQESA-N 377.800 2.732 0 50 GFAA CC(C)[C@@H](Nc1ncnc2ccccc12)C(=O)NCCCc1csc(N)n1 426399322 BNOCVDKKMLCYFQ-MRXNPFEDSA-N 384.509 2.854 0 50 GFAA COCc1cc(CNC(=O)N2CCC[C@@H](Cc3nc4ccccc4[nH]3)C2)[nH]n1 426489306 CIDJRDVSLSUGHX-AWEZNQCLSA-N 382.468 2.597 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N2CCC[C@H]2Cn2cccn2)cc1 534647825 JKJDRRSVHGSPIA-KRWDZBQOSA-N 380.452 2.656 0 50 GFAA CN(Cc1csc(-c2ccccc2)n1)C(=O)N[C@@]1(C)CCS(=O)(=O)C1 584902052 ZGURJWKAFOZEDI-KRWDZBQOSA-N 379.507 2.529 0 50 GFAA COC(=O)c1ccc(S(=O)(=O)NC(=O)c2cc(F)c(Cl)cc2F)s1 764560384 BBQZWFZMECHWGE-UHFFFAOYSA-N 395.792 2.585 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)Cn3ncc4ccccc4c3=O)cc2)CC1 823765105 VMMAKEIFRRWXRY-UHFFFAOYSA-N 392.459 2.508 0 50 GFAA O=C(O)c1sccc1S(=O)(=O)N[C@H]1CCCN(Cc2ccccc2F)C1 828574611 JTSMWQMFMTYJQN-ZDUSSCGKSA-N 398.481 2.528 0 50 GFAA O=C(O)c1cnc(N2[C@H]3CC[C@H]2CC(O)(Cc2ccc(F)cc2F)C3)nc1 910372526 CXPCTLORIJNCCZ-GJZGRUSLSA-N 375.375 2.558 0 50 GFAA CN(C[C@H]1CCN(c2ccccc2)C1)S(=O)(=O)c1ccc2nc(O)oc2c1 952973762 VLXMCGLCCFZZRB-CQSZACIVSA-N 387.461 2.680 0 50 GFAA CN(C[C@@H]1CCN(c2ccccc2)C1)S(=O)(=O)CCOc1ccc(F)cc1 952981422 MNLVMCTVLUWPIF-KRWDZBQOSA-N 392.496 2.993 0 50 GFAA O=C(C1CCC1)N1CC[C@@]2(O)CCN(Cc3ccccc3OC(F)F)C[C@H]2C1 1073416284 MBTLHHIXQATWOR-UWJYYQICSA-N 394.462 2.873 0 50 GFAA O=C(NCc1ccc(Cn2cncn2)cc1)NC1CCC2(CCOCC2)CC1 1323960664 MZFBBZHCWIJGRQ-UHFFFAOYSA-N 383.496 2.865 0 50 GFAA Cc1c(-c2ccccc2)nn(C)c1NC(=O)[C@H]1CC(=O)N(Cc2ccncc2)C1 1529153387 AVTHFCFQYLYJKJ-SFHVURJKSA-N 389.459 2.778 0 50 GFAA Cc1ccc([C@H]2CN(C(=O)c3ccccc3-c3nc[nH]n3)C[C@@H]2N(C)C)cc1 1565515513 IGNKQOXHXBIQQE-UXHICEINSA-N 375.476 2.950 0 50 GFAA COc1cc2c(cc1OC)C1(CCN(C(=O)c3cncc(O)c3)CC1)OCC2 1704344735 XUTMMOWWIZNERJ-UHFFFAOYSA-N 384.432 2.509 0 50 GFAA Cc1cccc(-c2noc(CCC(=O)N[C@H]3COC[C@H]3Cc3ccncc3)n2)c1 1704352828 ZGISENOBNUVTPJ-MOPGFXCFSA-N 392.459 2.747 0 50 GFAA NC(=O)CN1C[C@@H]2CN(Cc3c(F)cccc3F)C[C@@]2(CCc2ccccc2)C1 1772805086 YGFVMLRSODWZPK-MBSDFSHPSA-N 399.485 2.817 0 50 GFAA CC(C)(CN1CCOCC1)c1nccn1-c1cnn(Cc2ccc(F)cc2)c1 1857689527 GGKHCRBKIGIZOP-UHFFFAOYSA-N 383.471 2.866 0 50 GFAA CSCC(=O)N1CCC[C@@]2(CN(Cc3ccccc3Cl)CC[C@H]2O)C1 1857690224 XCHYDXDBACORKK-IEBWSBKVSA-N 382.957 2.878 0 50 GFAA CC(C)CCC(=O)N1CC[C@H]2[C@@H]1CC(=O)N2CCc1noc(C2CCCC2)n1 1857700469 VDDUJTKIKDTUAM-IRXDYDNUSA-N 388.512 2.908 0 50 GFAA COCCn1ccnc1CN1CCC2(CC1)C[C@@H](O)C[C@H](c1ccccc1)O2 1857701353 SOYFNWYBXDFPCO-VQTJNVASSA-N 385.508 2.777 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)NC[C@H](C)Oc4cccnc4)CC3)nc2n1 1857740771 YXKMSVGPTNVZLX-HNNXBMFYSA-N 395.463 2.726 0 50 GFAA O=C(NC[C@H]1[C@H]2CN(c3ccc4c(n3)CCC4)C[C@]23CC[C@H]1O3)c1ccoc1 1875243126 RHLCCZRTRDNNIE-ODULNIPZSA-N 379.460 2.577 0 50 GFAA O=c1nc(O)ccn1[C@@H]1CCCN(c2nc3ccc(Cl)cc3n3cncc23)C1 2325792907 UJJFWBAQERPCTA-CYBMUJFWSA-N 396.838 2.640 0 50 GFAA O=C(NCCCc1cncnc1)N[C@H]1CCC[C@H]1Oc1cc(F)cc(F)c1 2325799779 XJGMAXOBWWFYCR-ZWKOTPCHSA-N 376.407 2.987 0 50 GFAA Cc1nn(C)c(Cl)c1S(=O)(=O)NCc1noc(-c2ccccc2)c1C 2325812321 GZEIBOQSOFXVJE-UHFFFAOYSA-N 380.857 2.824 0 50 GFAA Cc1ccccc1[C@@H]1CN(C(=O)c2nnn(Cc3ccccc3)c2C)CCN1 2325824758 PHKZOZFIACEWJU-FQEVSTJZSA-N 375.476 2.730 0 50 GFAA CNC(=O)[C@H](NC(=O)CNc1cc(F)c2nc(C)sc2c1)c1ccccc1 2325851321 WIZGPFPDTBRJJQ-QGZVFWFLSA-N 386.452 2.759 0 50 GFAA CN1CCN(Cc2ccc(NC(=O)c3ccc4nc(N(C)C)[nH]c4c3)cc2)CC1 2325859037 LNTVFBAPXDGVJL-UHFFFAOYSA-N 392.507 2.629 0 50 GFAA COc1ccc(-n2nc(C)cc2NC(=O)Cn2nc(C)c(C(C)=O)c2C)cc1 2356139220 FGPXVDIRDJEJAZ-UHFFFAOYSA-N 381.436 2.844 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(NCc1ccccc1)n2Cc1ccccc1Cl 627951 CUTNLKYAARYYTN-UHFFFAOYSA-N 395.850 2.737 0 50 GFAA COc1cc(NC(=O)CSc2nnc(-c3ccncc3)n2C)cc(OC)c1 1077467 BAROIQJQYGSUOH-UHFFFAOYSA-N 385.449 2.625 0 50 GFAA CCC[C@H]1[C@H]2C[C@H](CN(C(=O)c3ccc(C(=O)OC)cn3)C2)c2cccc(=O)n21 2356154026 FLDUEQWIZIIKNT-JZXOWHBKSA-N 395.459 2.631 0 50 GFAA Cc1cc(C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2[C@H]3CCC(C)C)nc(O)n1 2356160372 PJGHCXKVGKKCEH-GJYPPUQNSA-N 396.491 2.889 0 50 GFAA CC(C)CO[C@@H](C)c1noc(Cn2nc([C@H]3OCC[C@H]3C)n(C(C)C)c2=O)n1 328652597 WMCHKDDYNUQZBX-YCPHGPKFSA-N 393.488 2.888 0 50 GFAA COc1ccc(F)cc1S(=O)(=O)N1CCC(C(=O)Nc2ccccc2)CC1 10302874 FLPSKYPYQVAMIS-UHFFFAOYSA-N 392.452 2.874 0 50 GFAA O=C(NS(=O)(=O)Cc1c(F)cccc1F)c1csc([C@@H]2CCCO2)n1 119114323 PNLBPWGGCTWDDU-ZDUSSCGKSA-N 388.417 2.533 0 50 GFAA CC[C@@H]1CN(S(=O)(=O)c2cc(C(=O)O)c(Cl)cc2F)CCN1C(C)C 1506407972 AHXJEMJSPVJEQI-LLVKDONJSA-N 392.880 2.671 0 50 GFAA O=C(CC[C@H]1CCCN(Cc2cnc(N3CCCC3)s2)C1)N1CCOCC1 12478905 XIWFSLPUQWRHQN-QGZVFWFLSA-N 392.569 2.594 0 50 GFAA O=C(C[C@@H]1COCCN1C(=O)c1n[nH]c2ccccc12)NCCC1=CCCCC1 72456719 NEZMXYGRKIAEFQ-QGZVFWFLSA-N 396.491 2.801 0 50 GFAA OCC[C@H]1CN(c2ccc(-c3nc(CCCc4ccccc4)no3)cn2)CCO1 72476045 APDJBZAZQOZSBY-IBGZPJMESA-N 394.475 2.895 0 50 GFAA CN(CC(=O)Nc1ccnc2ccc(Oc3ccccc3)cc12)S(C)(=O)=O 253430031 DOFUKRFXWUNADR-UHFFFAOYSA-N 385.445 2.857 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)c3cc(C(C)C)nc(N)n3)CC2)OC1=O 72473165 NRQGAINAATXMGG-AWEZNQCLSA-N 389.500 2.798 0 50 GFAA CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCC(C(=O)N2CCCCC2)CC1 363274362 KNVIVIQIGAYDIM-SFHVURJKSA-N 391.556 2.665 0 50 GFAA C[C@H](NC(=O)CC(C)(C)C)C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 363781703 QLSLQEHBFFZZSD-KBPBESRZSA-N 381.467 2.848 0 50 GFAA Cn1ccc(CC(=O)N2CCC[C@H](N3CCN(c4ccccc4F)CC3)C2)c1 15070376 ICVXQNLENYWVSI-IBGZPJMESA-N 384.499 2.520 0 50 GFAA Cn1c(-c2ccccc2Cl)nc2cc(C(=O)NCCCn3ccnn3)cnc21 77517945 NXZFHEXCGBLDLR-UHFFFAOYSA-N 395.854 2.700 0 50 GFAA COc1ccccc1[C@@H]1CN(c2ncccc2C(=O)O)[C@@H]2C3CCN(CC3)[C@H]12 72152712 FQZDPSSZQLZQHR-DFQSSKMNSA-N 379.460 2.855 0 50 GFAA CCn1c(O)nnc1C1CCN(C(=O)c2ccc(NC(=O)[C@@H]3C[C@@H]3C)cc2)CC1 378148925 KTEGLMCTYASSDQ-SUMWQHHRSA-N 397.479 2.618 0 50 GFAA O=C(NCCN1CCOCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1 378549037 DTFVAIDPKQLWAO-GOSISDBHSA-N 399.495 2.696 0 50 GFAA Cc1ncc(C(=O)N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)c(=O)[nH]1 72426243 FHNAJDGMFWOASV-QFIPXVFZSA-N 380.492 2.597 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)cc(-n2cccn2)n1 72139192 WOUYFQLRKROUIM-UHFFFAOYSA-N 397.870 2.978 0 50 GFAA COc1ccc([C@@H]2[C@@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3N3CCCN23)cc1 138549166 SCRCIPFKSPGKPH-IPMKNSEASA-N 397.862 2.884 0 50 GFAA NC(=O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)C1 175408702 NTYHEHCJZVYIAI-FQEVSTJZSA-N 386.540 2.860 0 50 GFAA CCN(C[C@@H](O)c1cccc(O)c1)C(=O)NCc1ccc2c(c1)OCCCO2 426632962 YGHVEZHXFMPCJC-GOSISDBHSA-N 386.448 2.819 0 50 GFAA Cc1ccccc1OCC(=O)Nc1nc(S(=O)(=O)c2ccccc2)ns1 227155653 CEKMPSSPDJVYKC-UHFFFAOYSA-N 389.458 2.697 0 50 GFAA CCn1c(C)nnc1SCCNC(=O)Nc1ccc(-c2nnc(C)o2)cc1 96165789 LWZHARQSBHAJJI-UHFFFAOYSA-N 387.469 2.879 0 50 GFAA CCc1nn(C)c(OC)c1CNC(=O)c1nc(C)n(-c2ccccc2C(C)C)n1 180153848 DAZNKOAGGXBDSN-UHFFFAOYSA-N 396.495 2.934 0 50 GFAA CCn1c(Cn2cccn2)nnc1C1CCN(Cc2nc(C)c(C)s2)CC1 96152112 LDVHPLSAIIAYGL-UHFFFAOYSA-N 385.541 2.996 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NC4CCNCC4)csc3C2)nc1 426508105 PHNMEKJJYIZFTJ-UHFFFAOYSA-N 384.549 2.746 0 50 GFAA CC1(C)OC(=O)N(CC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)C1=O 95498636 VCBPLYPXOPQHRU-LBPRGKRZSA-N 387.461 2.760 0 50 GFAA Cc1nsc(C)c1C(=O)N1CCOC[C@@H]1c1ncnn1Cc1ccccc1 294654549 LBNSKACYPONHLT-MRXNPFEDSA-N 383.477 2.613 0 50 GFAA CCN1CCc2nc[nH]c2C12CCN(c1ccc(Cl)c(C(=O)O)n1)CC2 95529047 VSCKRURHHXDHLF-UHFFFAOYSA-N 375.860 2.530 0 50 GFAA Cc1cc(N2CCC(N3CCC(=O)N(C)CC3)CC2)nc(-c2ccccc2)n1 96140910 JCWVKJVQSWMDFS-UHFFFAOYSA-N 379.508 2.585 0 50 GFAA Cn1c(=O)n2n(c1=O)[C@@H]1C(=C3[C@@H]2[C@H]2CC[C@H]4CC[C@@H]3[C@@H]24)[C@@H]2CC[C@@H]3CC[C@H]1[C@H]32 248042630 OQPJCJPJPNWQBN-MXPGSXBMSA-N 379.504 2.873 0 50 GFAA Cc1cc(-c2ccc(C(=O)NC[C@@H]3CC(=O)N(C4CC4)C3)cc2)c(O)nc1C 534654256 FLTMOHZXSXESEO-HNNXBMFYSA-N 379.460 2.812 0 50 GFAA CC(=O)NCCC(=O)Nc1nc(-c2cc3c(cc2Cl)OCCO3)cs1 1940196249 VHADGOWBXXJZET-UHFFFAOYSA-N 381.841 2.699 0 50 GFAA CCCN1CCc2c(C(=O)OC)c(OCc3ccc(F)cc3)cc(=O)n2CC1 299763484 NPYCMAXSIBIVRN-UHFFFAOYSA-N 388.439 2.621 0 50 GFAA O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)c1cccn1C1CCCC1 185394952 NIQPQSDJVMGTQH-HXUWFJFHSA-N 395.503 2.803 0 50 GFAA CC(C)CN(C)C(=O)C[C@]1(c2ccccc2)CC(=O)N(Cc2ccncc2)C1=O 299755146 AQOXFSHHGXOSIW-HSZRJFAPSA-N 393.487 2.783 0 50 GFAA Cc1c(C(=O)NC[C@@H]2CCCN(Cc3ccc(Cl)o3)C2)cnc2ccnn12 825566725 JCDKIMWMOABORD-AWEZNQCLSA-N 387.871 2.926 0 50 GFAA O=C(C1CCCC1)N1CCC2(CC1)CN(Cc1cccc3nonc13)CCO2 827921309 NLSRTSGJAYQXAR-UHFFFAOYSA-N 384.480 2.606 0 50 GFAA Fc1cnc(N2CC[C@](c3nc(-c4ccncc4)no3)(C(F)(F)F)C2)cn1 952894739 QCHHMKUVJIFYKJ-HNNXBMFYSA-N 380.305 2.771 0 50 GFAA c1cc(-c2cncc(N3CCC4(CCNC4)CC3)n2)cc(N2CCOCC2)c1 1875327549 ZALQDAPRZZZCSU-UHFFFAOYSA-N 379.508 2.560 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2ccnc2)C[C@H]1O)c1ccccc1-n1ccc(C2CC2)n1 1875403557 YMBIVCFVYCGXEK-QFIXIFRTSA-N 391.475 2.516 0 50 GFAA COc1ccc(OC)c(S(=O)(=O)N(C)Cc2cccc(-n3cccn3)c2)c1 952987990 PJSPXFUIFGKYIU-UHFFFAOYSA-N 387.461 2.710 0 50 GFAA Cc1cccc(-n2cc(CN(C)C(=O)[C@@H](O)COc3ccccc3C)cn2)c1 952869347 IXFFZPFNNYEHCB-FQEVSTJZSA-N 379.460 2.887 0 50 GFAA Cc1ccc(CCC(=O)N2CCCCC[C@H](NC(=O)c3ccnn3C)C2)s1 1775991143 HQEVUBAOSQGGMG-INIZCTEOSA-N 388.537 2.924 0 50 GFAA CCc1ccc(S(=O)(=O)[C@H]2CS(=O)(=O)C[C@H]2NC2CCCCCC2)cc1 55408880 DJSLMQVHDYKZII-MOPGFXCFSA-N 399.578 2.501 0 50 GFAA Cn1cnc(-c2ccc(NC(=O)N[C@H]3CCCO[C@@H]3c3ccncc3)cc2)n1 275416766 BTLDFBPGFXCMCT-ZWKOTPCHSA-N 378.436 2.919 0 50 GFAA CCc1cc(N(C)Cc2cc(-c3ccccn3)no2)nc(N2CCOCC2)n1 1506418871 UJMNQDDMYALCOA-UHFFFAOYSA-N 380.452 2.562 0 50 GFAA COc1ccc(F)cc1CN1CCO[C@H](CO)[C@H]1c1ccc(OC)c(OC)c1 1529198598 FAPGFBLMXSGSJJ-NHCUHLMSSA-N 391.439 2.786 0 50 GFAA COc1ccc(-c2onc(N3CCCC3)c2C(=O)N2CCC[C@@H](CN)C2)cc1 1704325049 JEYSKISWPSLQGP-HNNXBMFYSA-N 384.480 2.761 0 50 GFAA CC[C@]1(C(=O)N2CCOCC2)C[C@H]2CC[C@@H]1N2C(=O)c1cccc2ncccc12 1704335894 IBZQGEMZDNMVQG-CGYQNGNCSA-N 393.487 2.867 0 50 GFAA CC[C@@H](O)CNC(=O)C1CCN(c2nc(-c3ccccc3)nc3c2CCC3)CC1 11814200 TXGNJHHYZVNFCN-GOSISDBHSA-N 394.519 2.736 0 50 GFAA O=C(NC1CC1)c1cn(CC[C@@H]2CCCCN2C(=O)CCc2ccccc2)nn1 11997809 NLGMWWMRUMYWPF-IBGZPJMESA-N 395.507 2.574 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1CC1CCCCC1)NCc1ccccc1Cl 12593782 KBONJTDBPZSYBU-GOSISDBHSA-N 377.916 2.727 0 50 GFAA COCc1c(C(=O)Nc2cccc(C(=O)OC)c2)nnn1-c1ccc(C)cc1 16623161 IDJICLNEXNHWJC-UHFFFAOYSA-N 380.404 2.761 0 50 GFAA C=CCN1C(=O)C[C@H](C(=O)OC)C12CCN(Cc1nc3ccccc3s1)CC2 19229412 WSZWWCHPCZSSPA-OAHLLOKOSA-N 399.516 2.838 0 50 GFAA NC(=O)c1ccc([C@H]2CCCN2C(=O)Cc2nc(-c3ccccc3)n[nH]2)s1 19642422 YMLFRUYEWAHRRZ-CYBMUJFWSA-N 381.461 2.538 0 50 GFAA Cc1noc(-c2cn([C@H]3CCN(C(=O)c4ccc(F)c(Cl)c4)C3)nn2)n1 169780963 AUZVPINQCOEMRE-NSHDSACASA-N 376.779 2.516 0 50 GFAA Cc1ccccc1C(=O)N1CCO[C@@H](CN2CCCCC2)[C@@H]1c1cnn(C)c1 1857739293 NTGFCCXJJYATKK-SFTDATJTSA-N 382.508 2.797 0 50 GFAA Cc1cncc(C(=O)N2CC[C@H](O)[C@](CCCc3ccccc3)(C(=O)O)C2)c1 1875244875 YFZCOPYMLCYIFV-SIKLNZKXSA-N 382.460 2.691 0 50 GFAA CCOC(=O)c1nc(N2CCC(N(C)c3cccnn3)CC2)cc(C(C)(C)C)n1 225822986 UHZJSJIXEHJQPJ-UHFFFAOYSA-N 398.511 2.846 0 50 GFAA C[C@H](NC(=O)c1cc(O)nc2c1CCCC2)C(=O)N1c2ccccc2C[C@@H]1C 821863326 KXUCMTDSEKLPST-KBPBESRZSA-N 379.460 2.762 0 50 GFAA O=C(c1nc(N2CCOCC2)ncc1Cl)N1CCCc2sccc2C1 2325699977 NJOGEOLHVMYBDB-UHFFFAOYSA-N 378.885 2.617 0 50 GFAA C[C@H]1CC2(CN1)CC(C(=O)N=c1ccn(Cc3cccc4cccnc34)[nH]1)C2 2325788825 JOCAGXVGNWZVES-DBXLBAIQSA-N 375.476 2.618 0 50 GFAA COc1ccc(C2=NO[C@@H](C(=O)Nc3ccc(Br)cn3)C2)cc1 20602419 SXTFYSNJRXUBFY-CQSZACIVSA-N 376.210 2.984 0 50 GFAA NC(=O)NCc1cn(C2CCN(Cc3ccc(Cl)cc3Cl)CC2)nn1 23145824 WFOQGMALOYNEJP-UHFFFAOYSA-N 383.283 2.590 0 50 GFAA Cc1oc(-c2ccc(F)cc2)nc1CN1CCC[C@@]12CCCN(CCO)C2=O 2356144498 APTBTALQAMKIQA-OAQYLSRUSA-N 387.455 2.738 0 50 GFAA O=C(Cc1ccccc1OCc1ccccc1)NC[C@@H](O)c1cccc(O)n1 2356145767 VRWXBBBVDBQISS-LJQANCHMSA-N 378.428 2.759 0 50 GFAA CCOc1ccccc1CCCNC(=O)c1ccc(NS(C)(=O)=O)cc1 10110993 NOGQSRIFYQROIP-UHFFFAOYSA-N 376.478 2.819 0 50 GFAA O=C(NC[C@@H]1CCCO1)C(=O)Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1 9058982 HZPWEALSZGYALZ-XACAWQSSSA-N 389.521 2.845 0 50 GFAA O=C(c1cc2ccccc2o1)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1 9305335 BEUOLPAGIJCHIE-FQEVSTJZSA-N 392.411 2.557 0 50 GFAA biogenic COc1ccc(C(=O)N[C@H](NC[C@@H]2CCCO2)C(Cl)(Cl)Cl)cc1 24302617 UTFWYWCXRCOFDK-JSGCOSHPSA-N 381.687 2.890 0 50 GFAA CCC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3cccnc3NC)n2)C1 23619159 HSYNEOAPPNZECD-UHFFFAOYSA-N 378.436 2.838 0 50 GFAA Cc1ccccc1N1CCN(c2cc(C(=O)N3CCOCC3)ccn2)[C@@H](C)C1 108200081 NTVJUBOBOPTOIR-SFHVURJKSA-N 380.492 2.578 0 50 GFAA CCCN1CCC(N2C[C@H](NC/C(C)=C/c3ccccc3)C[C@H]2C(=O)NC)CC1 23360713 XQFYBBIQVRLKAW-GWNIJSOBSA-N 398.595 2.743 0 50 GFAA O=C(Nc1ccccc1C(=O)NCCCN1CCOCC1)c1cccc(F)c1 20707031 QPUFYZIHOLPWBQ-UHFFFAOYSA-N 385.439 2.530 0 50 GFAA CN(C(=O)Nc1ccc(-n2cnnn2)cc1)C1CCN(CCC(F)(F)F)CC1 454270441 YCDLKEHWCRWAPO-UHFFFAOYSA-N 397.405 2.543 0 50 GFAA COc1ccccc1OCc1ccc(-c2nc3c4cnn(C)c4ncn3n2)o1 2802321 VSVDQVUCTYVYBB-UHFFFAOYSA-N 376.376 2.859 0 50 GFAA C[C@@H](c1nc2c3cnn(C)c3ncn2n1)n1nc(C(F)(F)F)cc1C1CC1 2802898 VZNXXPMDZRZZJI-QMMMGPOBSA-N 376.346 2.713 0 50 GFAA COCCN1C=C(C(=O)OC)C(c2ccc(OC)c(Cl)c2)C(C(=O)OC)=C1 4986998 PHCLEJBQPXMVJM-UHFFFAOYSA-N 395.839 2.508 0 50 GFAA FC(F)(F)c1nnc2n1CCN(Cn1nc(-c3cccs3)[nH]c1=S)C2 131410652 WWFVAKJNYBJLMZ-UHFFFAOYSA-N 387.416 2.753 0 50 GFAA Cc1nc(N2CCN(C(=O)CCCc3ccccc3)CC2)cc(-n2cccn2)n1 35597267 JCUPEYTZDGXCAL-UHFFFAOYSA-N 390.491 2.642 0 50 GFAA CN(C)C1CCN(CCNC(=O)N2CCC(c3cccc(F)c3)CC2)CC1 363162591 MCRALAFQALDNTR-UHFFFAOYSA-N 376.520 2.741 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(c1ncnc3[nH]cnc13)CC2 377150349 MLUVUKCYEJETQQ-OAHLLOKOSA-N 382.493 2.822 0 50 GFAA Cc1c([C@H](C)NC(=O)N2CCc3c(cccc3N3CCOC3=O)C2)cnn1C 175656733 VOZKAGPPWPYJJX-ZDUSSCGKSA-N 383.452 2.514 0 50 GFAA C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCC2CCN(S(C)(=O)=O)CC2)C1 287636871 UGOFMLIWBJOXIS-LPHOPBHVSA-N 393.553 2.841 0 50 GFAA O=C(N[C@H]1CCOC1)c1cccc(-c2cc(C(=O)N3CCCCC3)ccn2)c1 426419812 QFWMTOQAHTVOPF-IBGZPJMESA-N 379.460 2.893 0 50 GFAA O=C(NCCCOc1cccnc1)N1CCN(c2ccc(F)cc2F)CC1 426415707 ZBVHPUZUPMKJHH-UHFFFAOYSA-N 376.407 2.661 0 50 GFAA COc1ccc2c(c1)OC[C@]1(CO)CN(Cc3snnc3C(C)C)C[C@H]21 95519422 OYYOEJHRIJPMSJ-DNVCBOLYSA-N 375.494 2.641 0 50 GFAA COc1ccc2c(c1)C[C@H](C(=O)N(C)Cc1cc(-c3cccnc3)no1)CO2 91445126 NFKUSBMBYLIPIJ-INIZCTEOSA-N 379.416 2.955 0 50 GFAA Cc1noc2ncnc(N3CCC[C@@H](c4nccn4Cc4cccnc4)C3)c12 91908429 WHCQBEHFQXRLIJ-MRXNPFEDSA-N 375.436 2.950 0 50 GFAA CN1C(=O)C[C@H](C(=O)NC2CCC(C(=O)O)CC2)[C@@H]1c1cccc(Cl)c1 299746120 VJVVBLXLRGWOMZ-ZSYHQQOQSA-N 378.856 2.619 0 50 GFAA CN1CCC[C@@H](NC(=O)NC[C@H]2CCN(c3cccc(Br)c3)C2)C1 252458585 VIVJEBCREQPPIC-GDBMZVCRSA-N 395.345 2.669 0 50 GFAA COc1ccc(CN[C@@H]2CNC(=O)c3cc(-c4ccc(OC)cc4)nn32)cc1 263617287 NBKRZGBKXZPFQU-FQEVSTJZSA-N 378.432 2.599 0 50 GFAA O=C(c1ccc(C(=O)N2CCC(c3ccncc3)CC2)cc1)N1CCOCC1 299768793 QEYPPQOAUVHZFN-UHFFFAOYSA-N 379.460 2.574 0 50 GFAA O=S1(=O)CCN(Cc2nc3ccccc3n2Cc2ccccc2Cl)CC1 825596828 UGSVSBMYHDXGRA-UHFFFAOYSA-N 389.908 2.968 0 50 GFAA C[C@@H](Cc1nc(-c2ccccc2)no1)NC(=O)c1cn(C)nc1C(F)(F)F 1875254045 VQGFFZYUCOWLBZ-JTQLQIEISA-N 379.342 2.850 0 50 GFAA C=CC(=O)N1CCCc2cc(C(=O)Nc3ccc4[nH]c(C(N)=O)cc4c3)ccc21 1875372185 YRVCZWIQHZKCCN-UHFFFAOYSA-N 388.427 2.984 0 50 GFAA COc1cccc(C(C)(C)C(=O)N2CCC3(CC2)C[C@H](O)c2nn(C)cc2O3)c1 1875394730 UVGODNOLMXMAGN-KRWDZBQOSA-N 399.491 2.584 0 50 GFAA O=C(O)CNC(=O)Cn1c(C(F)(F)F)cc2ccc(Br)cc21 1875368290 HMPAXCGSJOXBET-UHFFFAOYSA-N 379.132 2.623 0 50 GFAA Cn1cnc2cc(C(=O)Nc3ccccc3OC[C@@H]3CCCO3)ccc2c1=O 952986442 ISQJEMDVUIAHQM-HNNXBMFYSA-N 379.416 2.744 0 50 GFAA COc1ccnc(CN2CCC[C@H](CNC(=O)Cc3cccs3)C2)c1OC 952869875 OCISWZCJRIKFDU-OAHLLOKOSA-N 389.521 2.731 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1OCc1cscn1)c1ccc(-c2cc[nH]n2)cc1 1565511437 QLZLPKUYXCHCSO-ROUUACIJSA-N 384.461 2.637 0 50 GFAA COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3ccc4c(c3)C[C@H](C)O4)C2)c1 1439137799 BGBSBMMDRGJXBA-YEJXKQKISA-N 396.443 2.837 0 50 GFAA COCCN1C(=O)C[C@@H](CNCc2c(C)oc3ccccc23)[C@@H]1c1cnn(C)c1 275320818 OZTDUSRCXWNTHT-KSFYIVLOSA-N 396.491 2.801 0 50 GFAA C[C@@H]1CCc2sc(C(=O)N3CC[C@H](N(C)Cc4nccc(N)n4)C3)cc2C1 276518177 QKNSJZQHIRQANP-HIFRSBDPSA-N 385.537 2.592 0 50 GFAA Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CC(O)(c4ccc(F)cc4)C3)c12 170618599 VAVKNRNVSOMVRX-UHFFFAOYSA-N 380.423 2.637 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)NCCc3ccccc3O)CC2)oc1C 171782757 YJFHZYBKHMNXHW-UHFFFAOYSA-N 386.496 2.751 0 50 GFAA COc1ccc(CC(C)(C)NC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)cc1 187213060 DIGJJIBJTGNGQQ-KRWDZBQOSA-N 385.512 2.718 0 50 GFAA Cc1nc(-c2cccnc2)[nH]c(=O)c1CCC(=O)N(C)Cc1ccccc1F 195454746 SZNWPPSCFKPDHZ-UHFFFAOYSA-N 380.423 2.871 0 50 GFAA COc1cccc(C(=O)N2CCN(C3CCN(Cc4ccco4)CC3)CC2)c1 1506399588 AUEQAVHPHPHPLA-UHFFFAOYSA-N 383.492 2.711 0 50 GFAA Cn1nnc(-c2ccc(C(=O)N3CCC([C@@H](O)c4cccs4)CC3)cc2)n1 1506429145 VPQDELUDEDOCDF-QGZVFWFLSA-N 383.477 2.524 0 50 GFAA COc1ccccc1CN1CCN(C(=O)CC(=O)Nc2cccc(C)c2)CC1 1506428269 PTJKGEUCJKXZQU-UHFFFAOYSA-N 381.476 2.677 0 50 GFAA O=C(c1nc2ccc(Cl)cn2c1F)N1CCO[C@H](CO)[C@H]1c1ccccc1 1529153012 OSBOKYWPFRDKIT-RHSMWYFYSA-N 389.814 2.701 0 50 GFAA CC[C@@H](CNc1noc(-c2ccc(F)c(OC)c2)c1C(=O)O)N1CCOCC1 1704312472 CLHOTJGHIOGVNS-ZDUSSCGKSA-N 393.415 2.710 0 50 GFAA CN(C)CCNC(=O)CCC1CCN(Cc2cc3c(cc2Cl)OCO3)CC1 11816303 ACLQLPOHNLXXNG-UHFFFAOYSA-N 395.931 2.739 0 50 GFAA COc1ccc(N[C@H]2CCCN(C(=O)c3cc(CC(C)C)nc(N)n3)C2)cc1 12436115 JUHOBFAIVDGQKT-INIZCTEOSA-N 383.496 2.983 0 50 GFAA COCCN(C)C(=O)c1sc2ncnc(NCCc3ccccn3)c2c1C 12453714 BEBLDIUYYGLODJ-UHFFFAOYSA-N 385.493 2.768 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccccc2F)CCCN(C(=O)C2=C(C)OCCO2)C1 15080554 MGBLMVKDSBOCBY-OAQYLSRUSA-N 391.439 2.818 0 50 GFAA CCOC(=O)c1sc(C)c2c(=O)n(CC(=O)NCc3ccccc3)c(C)nc12 15724357 KXHMLJSTMHFPRY-UHFFFAOYSA-N 399.472 2.568 0 50 GFAA Cc1cccc(N2C[C@@H]3[C@H](CNC(=O)c4ncccc4C)[C@H]4CC[C@]3(C2)O4)n1 1875246573 RKQAXERDQLRQDX-KCXPTXFHSA-N 378.476 2.507 0 50 GFAA Cc1cc(C(=O)N[C@H]2CCc3nc(C)nn3C2)nc(-c2ccc(Cl)cc2)n1 122445907 KEZJFIKOGQAAER-HNNXBMFYSA-N 382.855 2.750 0 50 GFAA COc1ccc([C@@H]2CCN(C(=O)CN3C(=O)CCCc4ccccc43)C2)cn1 2325750877 QCLJRVMZBPMIIN-GOSISDBHSA-N 379.460 2.776 0 50 GFAA CCOc1ccc(N2C(=S)N(c3ccccc3)[C@H]3CS(=O)(=O)C[C@@H]32)cc1 1077139 TUBWQPMBYMSHSZ-ROUUACIJSA-N 388.514 2.862 0 50 GFAA Cc1[nH]c2ccccc2c1Cc1nnc(SCC(N)=O)n1Cc1ccco1 2864868 GAANCLMUHOVYCH-UHFFFAOYSA-N 381.461 2.877 0 50 GFAA CC(C)(C)SCCNC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 2988790 BCOXFKYXFUKYMM-UHFFFAOYSA-N 378.947 2.754 0 50 GFAA CC[C@@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C[C@@H]1/C(=C/OC)C(=O)OC 4692658 DAXYUDFNWXHGBE-WMLLIFGASA-N 384.476 2.700 0 50 GFAA biogenic,in-vitro CC(C)C[C@@H](NC(=O)/C(=C\c1ccc(F)cc1)NC(=O)c1ccco1)C(=O)O 4976812 WPBSOYMJPUMBJM-RBFDBLARSA-N 388.395 2.805 0 50 GFAA Cc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1C(=O)NCc1ccccn1 4999574 SATDMZGHXFRVMM-UHFFFAOYSA-N 387.505 2.741 0 50 GFAA COc1ccc(NC(=O)CCSc2nnnn2-c2ccccc2OC)cc1 6405585 KPPZPSZTSXBGOZ-UHFFFAOYSA-N 385.449 2.800 0 50 GFAA COc1ccc(Cc2cnc(NC(=O)c3ccc(-n4cnnn4)cc3)s2)cc1 11689899 BAMGPWIGYBAQCH-UHFFFAOYSA-N 392.444 2.971 0 50 GFAA O=C(CC[C@]1(Cc2ccco2)CCC(=O)N1)NCc1cccc(-n2cccn2)c1 11784110 ADZCSLQFFWAGRK-JOCHJYFZSA-N 392.459 2.753 0 50 GFAA COC(=O)[C@@H](C)NC(=O)c1coc(COc2ccc3ccc(OC)cc3c2)n1 12706456 HJGOOKJVTBBUDY-GFCCVEGCSA-N 384.388 2.707 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccnn4C)C3)C2)c1OC 12751927 UZUSPCJABQGYKV-QFIPXVFZSA-N 398.507 2.566 0 50 GFAA O=C(NCc1ccc2c(c1)OCO2)C1CCN(C(=O)c2cccc(F)c2)CC1 12864218 FZNGPZOREHUZKU-UHFFFAOYSA-N 384.407 2.723 0 50 GFAA O=C1C[C@@H](c2ccco2)Cc2nc(N3CCN(c4ccccn4)CC3)ncc21 18172910 YTTVGMMALIOFJZ-HNNXBMFYSA-N 375.432 2.704 0 50 GFAA O=C(C1CCN(C2CCN(CCCC3CCCC3)CC2)CC1)N1CCOCC1 42453691 HNIKOLKYSRVOTR-UHFFFAOYSA-N 391.600 2.992 0 50 GFAA C[C@H](C(=O)N1CCC2(CC1)NCCNC2=O)c1ccc(-c2ccccc2)c(F)c1 67589026 AJMYOGOYMAADTG-INIZCTEOSA-N 395.478 2.677 0 50 GFAA CCn1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(Cc2ccc(F)cc2)C3)cc1=O 95355658 GZDWYDMXMVYPCU-FXAWDEMLSA-N 383.467 2.744 0 50 GFAA CCC[C@H]1C=CCN1C(=O)c1ccccc1OC1CCN(S(C)(=O)=O)CC1 95528081 SANFIGBHTNKCQJ-INIZCTEOSA-N 392.521 2.670 0 50 GFAA CN(C)CCCn1ccnc1[C@@H]1CCCN(C(=O)c2ccccc2N(C)C)C1 95530901 UDGDXVXIBIQJQJ-GOSISDBHSA-N 383.540 2.921 0 50 GFAA CCc1cc(C(=O)N2CCC3(CC2)c2[nH]cnc2CCN3CC=C(C)C)on1 97514190 UHIDOVORVPPEHZ-UHFFFAOYSA-N 383.496 2.916 0 50 GFAA C[C@H](C(=O)NCc1ccc(F)cc1)N1CCC(CN2CCCCC2=O)CC1 118851955 SFGLMQODRKUGHF-MRXNPFEDSA-N 375.488 2.555 0 50 GFAA Cc1ccc2c(c1)C(=O)N(CC(=O)N1CCC[C@H]1CC(=O)c1ccccc1)C2=O 123966719 WFXHIYZOGHFEOY-KRWDZBQOSA-N 390.439 2.855 0 50 GFAA Cc1cc(C(=O)NC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c2cnn(C)c2n1 131256282 KXMFLUSKVDCWHM-SJLPKXTDSA-N 377.492 2.917 0 50 GFAA C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NCc2ccc(CN3CCOCC3)o2)c1 170595048 FJTNXWLLSIWFJC-MGPUTAFESA-N 397.475 2.636 0 50 GFAA O=C(c1ccc(Cl)cc1F)N1CCN(C(=O)c2[nH]nc3c2CCCC3)CC1 171419899 SNJSFVCIVLTVSX-UHFFFAOYSA-N 390.846 2.679 0 50 GFAA O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)[C@H]1CCCN1C(=O)c1ccccc1 177432799 UQTGPTRQBDUFFV-SJLPKXTDSA-N 398.894 2.735 0 50 GFAA C[C@H]1Cc2cc(-c3ccc(CNC(=O)NCCS(C)(=O)=O)cc3)ccc2O1 178963787 SEMRUVNMXFHISV-AWEZNQCLSA-N 388.489 2.521 0 50 GFAA O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc(OCC(F)F)nc1 180945484 KPQDESLYJIGNGU-CQSZACIVSA-N 375.375 2.540 0 50 GFAA C[C@@H]1CN(S(=O)(=O)c2ccc3c(c2)C(=O)NCC3)c2cccc(Cl)c2O1 190411562 IPADDSCSQGTRDR-LLVKDONJSA-N 392.864 2.602 0 50 GFAA C[C@@H](C(=O)NCCc1nc2c(s1)CCCC2)c1n[nH]c(=O)c2ccccc12 215213817 PMZWAZXYJQTTFP-GFCCVEGCSA-N 382.489 2.721 0 50 GFAA O=C(CN1CCCn2nc([C@@H](O)c3ccccc3)cc2C1)N1CCCCCC1 219997736 JZSQWQMLKDTZHP-QFIPXVFZSA-N 382.508 2.573 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C[C@H]2CN(c3ccc(F)cc3)C(=O)O2)CC1 221540686 BISZYWQYJMNIOL-INIZCTEOSA-N 379.432 2.704 0 50 GFAA CC(C)(C)n1ncnc1CNC(=O)c1ccc(F)cc1NC(=O)c1ccoc1 225741353 HWFIVWXRIHTFAJ-UHFFFAOYSA-N 385.399 2.948 0 50 GFAA O=C(NCCc1ccccc1F)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 243932317 BUUBJXLKUJPESA-QAQDUYKDSA-N 397.450 2.917 0 50 GFAA O=C([C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)N(C1CC1)[C@H]1CCS(=O)(=O)C1 249112711 OMEKZOHMKYJEEU-NWANDNLSSA-N 387.423 2.987 0 50 GFAA O=C(O)[C@@H]1CC12CCN(C(=O)C1CCN(C(=O)CCc3ccccc3)CC1)CC2 262374839 BNFDNBCGAAVQPP-IBGZPJMESA-N 398.503 2.571 0 50 GFAA COc1ccc(S(=O)(=O)NC[C@@H]2CCc3nccn3C2)c(Cl)c1Cl 275287518 LHLNWUAVMQSTSA-JTQLQIEISA-N 390.292 2.739 0 50 GFAA Cc1c(NS(=O)(=O)c2ccc(C(=O)O)c(Cl)c2)cnn1C1CCOCC1 296712254 MAKUBJYHJYSCIR-UHFFFAOYSA-N 399.856 2.695 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2ccc(C)cc2)CN1Cc1cccc(OC)c1 299758706 MJFZIVYVTZHWSJ-QUCCMNQESA-N 382.460 2.550 0 50 GFAA Cc1cc(-c2cccc(C(=O)N3CCC[C@@H](c4nccn4C)C3)c2)nc(N)n1 299802418 ZQJXAXRNMBUXND-QGZVFWFLSA-N 376.464 2.788 0 50 GFAA Cc1noc([C@@H]2CC[C@H](CN(CCCc3cccc(F)c3)S(C)(=O)=O)O2)n1 328609771 FUDNNEFYPYOXEQ-SJORKVTESA-N 397.472 2.632 0 50 GFAA COc1cccc([C@H](O)CNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1 363404601 NJVIENZRPPNDPT-DENIHFKCSA-N 397.519 2.940 0 50 GFAA O=C(N[C@@H]1CCCc2c1cnn2CCO)c1occc1COc1ccccc1 372267287 QAEAZFQNSWSTCH-GOSISDBHSA-N 381.432 2.855 0 50 GFAA CCOc1cc2c(cc1NC(=O)N1CCC(n3cnnc3O)CC1)O[C@H](C)C2 375256933 BSQQULWPXAXOAT-GFCCVEGCSA-N 387.440 2.575 0 50 GFAA Cn1nc(C(C)(C)C)cc1C(=O)NS(=O)(=O)C1CCC(C(F)(F)F)CC1 408475938 IMCDIBVMDAHSQB-UHFFFAOYSA-N 395.447 2.898 0 50 GFAA O=C(CC[C@H]1NC(=O)N(c2cccc3ccccc23)C1=O)NCc1ccccn1 409414769 OCPFYKAAGCTCSY-GOSISDBHSA-N 388.427 2.756 0 50 GFAA CN(C)c1ccccc1-c1ccc(C(=O)N2CC[C@@]3(O)CCNC[C@H]3C2)cc1 426656977 QAQSYUWIELTIMQ-CVDCTZTESA-N 379.504 2.606 0 50 GFAA Cc1ccc(C)c([C@@H](NC(=O)N(C)CCN2CCOCC2)c2cccnc2)c1 584893791 FVDWGBKSMJVPGJ-NRFANRHFSA-N 382.508 2.761 0 50 GFAA C[C@H](C(=O)Nc1ccc(NC(=O)Cc2ccc(Cl)cn2)cc1)n1cncn1 785842154 JFFDELJBSPLTJN-GFCCVEGCSA-N 384.827 2.707 0 50 GFAA Cc1cc2nc(O)[nH]c2c(NC(=O)CCc2c(C)nc3ncnn3c2C)c1C 952872034 HHWOBMVENHLXCB-UHFFFAOYSA-N 379.424 2.511 0 50 GFAA COc1ccnc(N2CCC[C@H](CNC(=O)c3cc(Cl)ccc3F)C2)n1 952990998 KXEKTUQLXPWSLL-GFCCVEGCSA-N 378.835 2.924 0 50 GFAA CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@H](c1cccnc1)N1CCOCC1 1506404654 ZQWVOWQITAQIBU-NRFANRHFSA-N 392.459 2.769 0 50 GFAA Cc1ccc(Cl)cc1NC(=O)CC(=O)NCCc1noc(C2CCC2)n1 1506406021 IWILSDANEWXUFT-UHFFFAOYSA-N 376.844 2.986 0 50 GFAA CNC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2CCc2ccccn2)cc1 1506415113 KZZSAMHIUZHRQU-GOSISDBHSA-N 387.505 2.617 0 50 GFAA Fc1cnc(N[C@@H]2CCCN(Cc3cccs3)C2)nc1N1CCOCC1 1529138849 ISJOPHARCFBVGW-CQSZACIVSA-N 377.489 2.590 0 50 GFAA CCOC(=O)N1CCC(N2C[C@H](c3ccc(OC)cc3)[C@@H](N(C)C)C2)CC1 1565528456 QQVAPGXLQFGWTC-UXHICEINSA-N 375.513 2.646 0 50 GFAA O=C(CCCn1cncn1)N1CCC2(CC1)OCCc1c2[nH]c2ccccc12 1704337559 XGQLLMCBUNXAGU-UHFFFAOYSA-N 379.464 2.630 0 50 GFAA O=C(c1ccc(CNc2nccc(N3CCC[C@@H](O)C3)n2)cc1)N1CCCCC1 1704341617 XVIRHAFMEBCNKU-LJQANCHMSA-N 395.507 2.676 0 50 GFAA CN(C)C[C@@]12CNC[C@@H]1CN(C(=O)c1cccc(NCc3cccs3)c1)C2 1772707085 POFFVAMRLIHYQV-DYESRHJHSA-N 384.549 2.583 0 50 GFAA O=C(c1ccccc1Cl)N1CCC(C(=O)N2CCC[C@@H]2C2(O)CC2)CC1 1772813359 YJXAVBUQTGYOCQ-QGZVFWFLSA-N 376.884 2.708 0 50 GFAA CC(C)[C@H](F)C(=O)NCC1(O)CCN(C(=O)c2ccc3c(c2)CCC=C3)CC1 1775991167 JBPAHXFZTGUEMN-IBGZPJMESA-N 388.483 2.723 0 50 GFAA O=C(C1CCN(c2nc3ccc(Cl)cc3o2)CC1)N1CCC[C@@H](CO)C1 1857697313 OXBYYDWDXBAKPL-CYBMUJFWSA-N 377.872 2.929 0 50 GFAA COC(=O)N1CCCC[C@H]1C(=O)N1CCc2c(-c3ccccc3)nn(C)c2CC1 1857709771 QQSDFPJFPNUVBF-IBGZPJMESA-N 396.491 2.635 0 50 GFAA Cc1cc(N2C[C@@H]3[C@H](CNC(=O)c4cccnc4)[C@H]4CC[C@]3(C2)O4)cc(C)n1 1857718943 BAIBCZMVNIDTCY-GPQLQYNLSA-N 378.476 2.507 0 50 GFAA Cc1cccc(-c2nccn2[C@@H]2C[C@H]3CO[C@@H](CC(=O)N(C)C)CN3C2)c1C 1857730624 XRGBPHQVFTYCIT-QYZOEREBSA-N 382.508 2.659 0 50 GFAA C[C@H](OCc1ccc(F)cc1)C(=O)N1CC2(CCSCC2)C[C@H]1C(=O)O 1875305934 NDNHNRHYDKCPTO-BBRMVZONSA-N 381.469 2.930 0 50 GFAA CN1C(=O)N[C@@](C)(c2ccc(NS(=O)(=O)c3cscc3Cl)cc2)C1=O 1875317241 RYWSMPRMFUXEOU-HNNXBMFYSA-N 399.881 2.599 0 50 GFAA C[C@@H](OC1CCCC1)C(=O)NCCCN(C(=O)C1SCCS1)C1CC1 1875347832 TZXPRVMXOUZGJG-CYBMUJFWSA-N 386.583 2.638 0 50 GFAA C=CC(=O)N1CCC[C@H](C(=O)Nc2cc(F)cc(N3C[C@H](C)O[C@H](C)C3)c2)C1 1875371208 SUWHHWOAHOFIGT-XHSDSOJGSA-N 389.471 2.802 0 50 GFAA CCc1cccc2[nH]c(C(=O)N3C[C@H]4C[C@H]3[C@H]4c3ocnc3C(=O)NC)cc12 1875394760 VZQTYBUSEXXDTA-DQYPLSBCSA-N 378.432 2.706 0 50 GFAA COc1c(C)cc(CN(C)C(=O)c2nc(C)c(C)c(N3CC[C@@H](N)C3)n2)cc1C 1875402044 ZTEMYEYICRZSHP-GOSISDBHSA-N 397.523 2.528 0 50 GFAA CCCc1cc(C(=O)N2C[C@@H]3CN(Cc4coc(C5CC5)n4)C[C@@H]3C2)cc(O)n1 2325794250 VYEBGDGVMFISAQ-CALCHBBNSA-N 396.491 2.809 0 50 GFAA CC(C)c1nc(CCNC(=O)c2ccc3nnc([C@@H](O)C(C)C)n3c2)cs1 2356151914 GOLGJNVRZVSEFN-INIZCTEOSA-N 387.509 2.971 0 50 GFAA O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1ccc(NC(=O)c2ccco2)cc1 1010676 WHRUYZHSLLBJGB-UHFFFAOYSA-N 375.340 2.668 0 50 GFAA COc1ccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2Cc2ccccc2)cc1 2837053 IRKBTSCYALYCRK-UHFFFAOYSA-N 375.428 2.763 0 50 GFAA Cc1ccc(C)c(NC(=O)CSc2nnnn2-c2ccc(C(=O)O)cc2)c1 2848310 HZUCHYMJUXVFLK-UHFFFAOYSA-N 383.433 2.708 0 50 GFAA O=C(CN1CCN(c2ccccn2)CC1)Nc1ccc(Br)cc1 4118651 SWPSEYZCRBCPDQ-UHFFFAOYSA-N 375.270 2.605 0 50 GFAA O=C(CSc1ncn(-c2ccccc2)n1)Nc1nnc(C(F)(F)F)s1 4999193 XUHXTLHOGCZMRU-UHFFFAOYSA-N 386.384 2.868 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(OC)c(Cl)c2)C1 9974701 GSZWBUWNKVBXTI-CYBMUJFWSA-N 388.917 2.618 0 50 GFAA CC(C)NC(=O)C1CCN(C2CCN(C(=O)c3ccccc3F)CC2)CC1 11701805 TVXRFDOINQPDSI-UHFFFAOYSA-N 375.488 2.667 0 50 GFAA O=C1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CCN1CCN1CCCCC1 11912041 DSSGFTKCFSBLND-UHFFFAOYSA-N 399.514 2.736 0 50 GFAA CN(Cc1n[nH]c2c1CCCC2)C(=O)c1cn(C/C=C/c2ccccc2)nn1 11935717 PSDGXDYRKQQFMD-JXMROGBWSA-N 376.464 2.866 0 50 GFAA O=C(C[C@H]1C(=O)NCCN1Cc1ccc2ccccc2c1)NCc1ccccc1 11944624 MIGLHMQKVGULPI-QFIPXVFZSA-N 387.483 2.847 0 50 GFAA Cc1ccccc1NC(=O)c1ccc(Cl)c(N2C(=O)CCS2(=O)=O)c1 12003466 LHACJGLDYGEKKF-UHFFFAOYSA-N 378.837 2.967 0 50 GFAA CN(CC(=O)Nc1cc(C(C)(C)C)on1)S(=O)(=O)c1ccc(Cl)cc1 12381582 WHDNPQAUFYERAM-UHFFFAOYSA-N 385.873 2.885 0 50 GFAA CS(=O)(=O)c1ncc(CN2C[C@@H]3CCC[C@H]2C3)n1Cc1ccccc1F 12446735 DVHQTXSVRFOGNW-ZBFHGGJFSA-N 377.485 2.848 0 50 GFAA O=C(O)CCSCC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1 20081174 AVOHBFLEYZUPTI-UHFFFAOYSA-N 379.459 2.878 0 50 GFAA O=C(c1ccon1)N1CCC2(CC1)c1ccccc1[C@@H](N1CC=CCC1)[C@@H]2O 20453734 SEADSMQWGNVSEN-UXHICEINSA-N 379.460 2.526 0 50 GFAA O=C(Cn1nc(-c2ccco2)ccc1=O)N1CCC(Cc2ccccc2)CC1 38827696 QBBFKGRFSWYWSE-UHFFFAOYSA-N 377.444 2.985 0 50 GFAA Cc1ccc(S(C)(=O)=O)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 43831809 SFUQWKHNZKFFIW-KRWDZBQOSA-N 387.505 2.795 0 50 GFAA O=C(O)c1ccc2c(c1)n(CCCCO)c(=O)n2Cc1c(F)cccc1F 55386483 JMGLJHIQBZMMIV-UHFFFAOYSA-N 376.359 2.600 0 50 GFAA Cc1cc(N2CCN(C(=O)c3cccc(F)c3)CC2)nc(N2CCCCC2)n1 64799774 QUGFVHPLIYCVAE-UHFFFAOYSA-N 383.471 2.877 0 50 GFAA Cn1ccnc1-c1ccc(N2CCC[C@](CO)(CCOc3ccccc3)C2)nn1 67886314 PTWBVGATQPUCCA-QFIPXVFZSA-N 393.491 2.925 0 50 GFAA COc1cccc(CN2CCC[C@](O)(CNCc3ccc(C)cc3)C2=O)c1OC 67909515 KVUCKOPRCDJUDU-QHCPKHFHSA-N 398.503 2.656 0 50 GFAA O=C(Nc1ccccc1)C(=O)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1 71756877 QPTLUIBMMKOIFM-NJDAHSKKSA-N 375.472 2.714 0 50 GFAA NC(=O)COc1cccc(C(=O)NCc2ccc3[nH]c4c(c3c2)CCCC4)c1 71756906 UBYJYAZIRJUQBM-UHFFFAOYSA-N 377.444 2.841 0 50 GFAA O=C(O)c1ccnc(-c2ccnc(N3CCN(Cc4ccccc4)CC3)n2)c1 71764588 FXIVOZMZLIQMQK-UHFFFAOYSA-N 375.432 2.559 0 50 GFAA C[C@@H](C1CCN(C(=O)c2cc(-c3ccccc3)n(C)n2)CC1)N1CCOCC1 72456865 VAWFODJZHSWUGE-KRWDZBQOSA-N 382.508 2.660 0 50 GFAA O=C(Cn1c(-c2ccccc2)nn(-c2ccccc2Cl)c1=O)N1CCCC1 77288053 YDXNJWCSVCSASX-UHFFFAOYSA-N 382.851 2.977 0 50 GFAA COC(=O)NC[C@@H]1C[C@H](F)CN1C(=O)CSc1cn(C)c2ccccc12 82120268 KRNDZQKIAVTVRU-STQMWFEESA-N 379.457 2.565 0 50 GFAA Cc1cc(C)c2[nH]c(C(=O)N3CCN(c4cc(C)nc(N)n4)CC3)c(C)c2c1 91416901 ZAZHUFUDTYOTRD-UHFFFAOYSA-N 378.480 2.736 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2CCC[C@@H](c3ccc(C(=O)O)cc3)C2)c1C 95363298 AXMYPMBZYIKQMV-GOSISDBHSA-N 383.448 2.807 0 50 GFAA Cc1nn(C)c(C)c1CN1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95391598 CDTNUDMGOHETBS-WWPVKYPJSA-N 394.519 2.828 0 50 GFAA CCCc1cncnc1N1CCC(NC2CCN(C(=O)OCC)CC2)CC1 95500330 DFZHTQXVKIPPRQ-UHFFFAOYSA-N 375.517 2.608 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)NCCN3CCC[C@@H](C(N)=O)C3)c2)c1 95516452 QXZHJZOCRHJXCV-LJQANCHMSA-N 380.492 2.981 0 50 GFAA Cn1ccc2ccc(C(=O)NCc3noc(-c4ccc5c(c4)OCO5)n3)cc21 95525827 RHHVLYPPBDZLRN-UHFFFAOYSA-N 376.372 2.887 0 50 GFAA COc1cc(NC(=O)N(C)CC2(CO)CCOCC2)cc(C(F)(F)F)c1 96164422 PTUBEJZOSPKPQT-UHFFFAOYSA-N 376.375 2.967 0 50 GFAA C[C@H](CN1CCc2ccccc2C1)NC(=O)Nc1ccc2c(c1)OCC(=O)N2 97532336 TZSQDCRKWDUENV-CQSZACIVSA-N 380.448 2.586 0 50 GFAA COc1ccc2c(c1)C=C(C(=O)NC1CCN(Cc3ccccn3)CC1)CO2 122170464 CCNKRHTVGKRKTM-UHFFFAOYSA-N 379.460 2.647 0 50 GFAA COc1ccc(CN2CCC(N3CCNC3=O)CC2)cc1OCc1cccnc1 127612551 AAOFOVJNADNLEE-UHFFFAOYSA-N 396.491 2.659 0 50 GFAA Cc1nc(S)sc1CC(=O)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 156410298 FFVBXCDQDGMHFB-BLLLJJGKSA-N 379.482 2.510 0 50 GFAA COc1ccc(-c2ccc3nnc(CNC(=O)c4ccccc4OC)n3n2)cc1 169778551 DDUXHYIYFYFOIH-UHFFFAOYSA-N 389.415 2.739 0 50 GFAA Cc1cc(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)nc2nc(O)[nH]c(=O)c12 172636466 FORPXISEHDWKTI-CYBMUJFWSA-N 398.850 2.833 0 50 GFAA CC(=O)N1CCc2cc(S(=O)(=O)N3C[C@@H](C)Oc4c(F)cccc43)ccc21 186865427 GIXUFLPEYYXEMN-GFCCVEGCSA-N 390.436 2.711 0 50 GFAA C[C@@H](C(=O)NCc1ccccc1CN1CCCC1=O)N1CCc2ccccc21 195032996 DSNBXJHMHNXXAJ-KRWDZBQOSA-N 377.488 2.876 0 50 GFAA O=C(c1[nH]c2ccccc2c1Cl)N1C[C@@H](CO)C[C@@H](CN2CCCC2)C1 212782932 GPOLVAVOXMEDCK-GJZGRUSLSA-N 375.900 2.988 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 248033726 LYAIMTZLIIWMKL-KNQAVFIVSA-N 381.520 2.949 0 50 GFAA COC(=O)CC(C)(C)CC(=O)N1CC[C@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 253418570 UKMVHONIOUSOTR-GJZGRUSLSA-N 382.501 2.824 0 50 GFAA C[C@@H](N[C@@H]1CCOC2(CCOCC2)C1)c1cccc(N2CCCS2(=O)=O)c1 329195252 VGWKXFSRUQPTNY-SJLPKXTDSA-N 394.537 2.605 0 50 GFAA Cc1nnc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)CC(C)C)n1C1CC1 375544352 VMZBJHXJDOKXBR-SFHVURJKSA-N 381.480 2.860 0 50 GFAA O=C(O)c1cccc(CNC(=O)[C@@H]2CCCN2c2ncnc3ccccc23)c1 378453031 MEDDLQFSTGHAEY-SFHVURJKSA-N 376.416 2.613 0 50 GFAA NC(=O)NCCCCC(=O)Nc1ccc2c(Cl)ccc(Br)c2n1 412399175 ZBULZQJJIATHSF-UHFFFAOYSA-N 399.676 3.428 0 50 GFAA Cc1ccc(Br)cc1CNC(=O)Cn1ncc(=O)c2ccccc21 438919642 QDWZLHWRCBGNQH-UHFFFAOYSA-N 386.249 2.784 0 50 GFAA CC(C)Oc1cc(-c2ccc(C(=O)N[C@H](C)Cn3cccn3)cc2)nc(N)n1 534587521 RUFWZCJPQCVJCG-CQSZACIVSA-N 380.452 2.528 0 50 GFAA COc1ccc(-c2n[nH]cc2CNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1 534644151 NWJMKOJGLWAWTC-OAHLLOKOSA-N 380.452 2.898 0 50 GFAA CSCc1noc(CNC(=O)N2CCCC[C@H]2CCn2ccnc2C)n1 534645897 PFUMEQFVGRGOQG-AWEZNQCLSA-N 378.502 2.592 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1-c1cccc(C(=O)N[C@@H]2CCNC2=O)c1 534676089 DJTVHFUMBGHTKI-HXUWFJFHSA-N 388.471 2.834 0 50 GFAA CN(C(=O)NCC1(c2ccccc2F)CCCC1)C1CCS(=O)(=O)CC1 534676934 AXUZEROIWSFHFV-UHFFFAOYSA-N 382.501 2.856 0 50 GFAA C[C@@H](NC(=O)Cn1cnc2ccsc2c1=O)c1ccccc1-n1cccn1 670443361 KFQJUWQHXSTBGZ-CYBMUJFWSA-N 379.445 2.521 0 50 GFAA COc1ccccc1S(=O)(=O)NC(=O)Cc1ccc(Br)cc1 744209901 YGKOFJSNLGFUSM-UHFFFAOYSA-N 384.251 2.505 0 50 GFAA Cc1ccc([C@H](C(=O)N2CCN(c3ncnc4ccccc34)CC2)N(C)C)cc1 823646301 OLJHVBUJZRHDBU-OAQYLSRUSA-N 389.503 2.890 0 50 GFAA COc1cccn2ncc(C(=O)N3Cc4ccccc4C4(CCN(C)CC4)C3)c12 827954326 GIIORLBQDVFBON-UHFFFAOYSA-N 390.487 2.962 0 50 GFAA O=C(CCc1n[nH]c2c1CCCC2)N1CCC(c2nnc3n2CCCCC3)CC1 952861019 WLDZYPOLLZDDCV-UHFFFAOYSA-N 396.539 2.945 0 50 GFAA CCN1CCC[C@@H](CN(C)S(=O)(=O)c2cc(-n3cccn3)ccc2C)C1 952968676 KYFIKSOMGIHOJH-KRWDZBQOSA-N 376.526 2.533 0 50 GFAA CCc1nn2c(=O)cc(CN3CCC(c4nc(C(C)C)no4)CC3)nc2s1 1529099679 DTIIBMZVNJSPAA-UHFFFAOYSA-N 388.497 2.599 0 50 GFAA Cc1cc(C)n(-c2cccc(C(=O)N3C[C@H](O)[C@H](Cc4ccncc4)C3)c2)n1 1529181391 NLRVMDZNMUAJCW-CTNGQTDRSA-N 376.460 2.560 0 50 GFAA CCn1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)CCc1n[nH]c2ccccc12 1857527468 PCHDNCBIOYZYRU-IFXJQAMLSA-N 394.479 2.812 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)N4CCc5n[nH]cc5C4)C3)nc2c1 1857668366 ASIIVSFLJLYSLD-CQSZACIVSA-N 395.463 2.751 0 50 GFAA COc1cnc(C)cc1-c1nc(C2CCCC2)nn1[C@H]1CCS(=O)(=O)C1 1857670625 CFZACPVCIFKGFI-AWEZNQCLSA-N 376.482 2.674 0 50 GFAA Cc1cn2cccc(C(=O)N3CCN4C(=O)OC[C@]4(Cc4ccccc4)C3)c2n1 1857678552 MWFIHCSQZYKDOB-QFIPXVFZSA-N 390.443 2.532 0 50 GFAA O=C1C[C@H]2[C@H](CCN2Cc2ncc[nH]2)N1Cc1cccc(OC(F)(F)F)c1 1857682259 HRDOZFXRFVCPLS-GJZGRUSLSA-N 380.370 2.684 0 50 GFAA O=C(O)c1cc2c(s1)C1(CCN(C(=O)c3cncc(F)c3)CC1)OCC2 1857684784 DCUVOGQBJMKLBS-UHFFFAOYSA-N 376.409 2.685 0 50 GFAA O=C1C[C@H]2N(Cc3ccc4c(c3)OCCO4)CC[C@]23O[C@H](c2ccccc2)CN13 1857715501 VBCKGFGXFMYXGS-XJUOHMSHSA-N 392.455 2.732 0 50 GFAA Cc1nc(O)c2c(n1)C1(CC2)CCN(C(=O)CCc2nc3ccccc3[nH]2)CC1 1857722041 ADCLJHRGHGDFAX-UHFFFAOYSA-N 391.475 2.806 0 50 GFAA O=S(=O)(c1ccc(-c2ccccc2)cc1)N1CCN2[C@@H](C3CC3)COC[C@H]2C1 1875247201 FJHJCVPZTBXKOA-IFMALSPDSA-N 398.528 2.837 0 50 GFAA C[C@H]1C[C@@H](O)CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1 1875312023 GFLHHBILDTWDDO-RYUDHWBXSA-N 383.370 2.830 0 50 GFAA NC1CC([C@@H](F)C(=O)NCc2cccc(-c3nc(CC(F)(F)F)no3)c2)C1 1875328514 WOYRQGXTKHSYPP-ORHYLEIMSA-N 386.349 2.533 0 50 GFAA CCc1cc(C(=O)Nc2ccc(OC[C@H](O)CN(C)C)cc2)cc2c[nH]nc12 1875349790 MXQAQWCSPVETMN-GOSISDBHSA-N 382.464 2.679 0 50 GFAA CN(C)C/C=C/C(=O)N(CC(F)(F)F)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1875376759 HOGNHQTYRDJGPY-RCQQVGEISA-N 393.450 2.895 0 50 GFAA Cc1ccc(-n2[nH]c(C(=O)N3CCC[C@@H]3Cn3ccnc3C)cc2=O)cc1C 2325790055 JRRZECDLOLHSGJ-GOSISDBHSA-N 379.464 2.592 0 50 GFAA COCc1ccoc1C(=O)NS(=O)(=O)c1ccc(NC(=O)C(C)(C)C)cc1 2325828081 YJBBJHAPPWSZJZ-UHFFFAOYSA-N 394.449 2.529 0 50 GFAA COCCC1CCN(C(=O)[C@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)CC1 2356162413 JSPRJGLIZHEPMC-BOCKYXSRSA-N 397.519 2.593 0 50 GFAA O=C1CC[C@H](NC(=O)c2ccc3nc(-c4cccc(Cl)c4)oc3c2)C(=O)N1 1857798033 KMNROEDYBGOLNZ-AWEZNQCLSA-N 383.791 2.683 0 50 GFAA Cc1ccccc1OCC(=O)N1N=C(c2cccnc2)C[C@@]1(O)C(F)(F)F 879326 PNJSFRGBXCQBFQ-QGZVFWFLSA-N 379.338 2.656 0 50 GFAA CC(=O)Nc1ccc(NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1 1148066 WLFZZFCXZVCJMG-UHFFFAOYSA-N 389.477 2.667 0 50 GFAA Cn1c(=O)c2c(nc(SCc3c(Cl)cccc3Cl)n2C)n(C)c1=O 1157926 KDYDOUUFFAZKGZ-UHFFFAOYSA-N 385.276 2.570 0 50 GFAA COCCN1CCC[C@@]2(CCCN2C(=O)c2cc(Cl)ccc2OC)C1=O 2356134035 UNFLLJGQYXWQGX-LJQANCHMSA-N 380.872 2.592 0 50 GFAA Cc1cc(C)c(CNC(=O)[C@@H]2C[C@H]3CCCN3[C@]23C(=O)Nc2ccccc23)cn1 2356142830 JSQRNIYBFYDYCT-FHJLPGHOSA-N 390.487 2.647 0 50 GFAA CC(C)(C)C(=O)N[C@@]1(C(F)(F)F)NC(=O)N(c2ccc(Cl)cc2)C1=O 2863461 RKVAUMFCYXURQK-CQSZACIVSA-N 377.750 2.817 0 50 GFAA Cn1c(CC(=O)Nc2ccccc2)nnc1SCC(=O)Nc1cccc(F)c1 2868208 MQBCVJOJVRIZGS-UHFFFAOYSA-N 399.451 2.866 0 50 GFAA CCOc1ccc(N(CC(=O)N[C@@H](C)c2ccccc2)S(C)(=O)=O)cc1 2928341 HJPLQKYSCIREOW-HNNXBMFYSA-N 376.478 2.729 0 50 GFAA COCCNC(=O)c1cnn2c(C(F)(F)F)cc(-c3ccc(F)cc3)nc12 4181645 OWXXUYZMVKEIPO-UHFFFAOYSA-N 382.317 2.930 0 50 GFAA COc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)N1CCCCCC1 6746852 NXIVFMCXUQEYHH-UHFFFAOYSA-N 380.510 2.886 0 50 GFAA COc1cc2c(cc1OC)C(=O)C(C)(C)N(C[C@H](O)COc1ccccc1)C2 55525037 RQMNZRBFBWCSRM-INIZCTEOSA-N 385.460 2.921 0 50 GFAA biogenic COc1ccc(-c2cc(=O)[nH]c(N3CCN(c4ccccc4F)CC3)n2)cc1 9668955 YUOICYSXKMNGHK-UHFFFAOYSA-N 380.423 2.911 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)C1(c2ccc(F)cc2)CCOCC1 57202892 SBUNVVALAXDZTF-UHFFFAOYSA-N 380.423 2.771 0 50 GFAA COc1cccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCC[C@@H](C)C2)c1O 55309073 GQXXGDJAUOOXOA-CYBMUJFWSA-N 383.448 2.988 0 50 GFAA Cc1ccccc1[C@@H](NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 67603470 GVLNCDRTQIJYPW-ICSRJNTNSA-N 386.517 2.872 0 50 GFAA COc1ccc(C)cc1NC(=O)N1CCN(c2cc(N(C)C)nc(C)n2)CC1 65362835 XFSICWDVSZPQKR-UHFFFAOYSA-N 384.484 2.522 0 50 GFAA O=C(CCc1nc2ccccc2[nH]1)N1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 67432820 MJMGITCWOKSMSD-MAUKXSAKSA-N 393.443 2.601 0 50 GFAA COc1ccc(F)c(CN2CCC[C@](O)(CNCC3CCCCC3)C2=O)c1 67804354 HWGWLQJBXHLAGO-NRFANRHFSA-N 378.488 2.858 0 50 GFAA COC[C@H](NC(=O)c1csc2nc(-c3ccccc3)cn12)c1ccnn1C 67821852 VXQHVSHDOLLCSQ-HNNXBMFYSA-N 381.461 2.914 0 50 GFAA O=C(c1ccc([C@H]2CCCN2C(=O)c2ccno2)s1)N1CCCOCC1 20167875 ZENHWLMDBSNACI-CYBMUJFWSA-N 375.450 2.576 0 50 GFAA Cc1nc(-c2c(C)ncc3c2CCN(C(=O)Cn2ncc4ccccc42)C3)no1 23478122 HIYHBPYPWFGYCA-UHFFFAOYSA-N 388.431 2.683 0 50 GFAA CSCC[C@H](CO)NC(=O)c1cc(-c2ccc(Br)s2)[nH]n1 409413404 KXOCQKVSXYYHGU-MRVPVSSYSA-N 390.328 2.745 0 50 GFAA Cn1nc(-c2ccccn2)c2c1NC(=O)C[C@@H]2Cn1c(=O)oc2ccccc21 65383425 VXYTYRXQDFETGR-GFCCVEGCSA-N 375.388 2.516 0 50 GFAA CC1(C)Cc2cccc(S(=O)(=O)Nc3ccc(C4=NNC(=O)CC4)cc3)c2O1 333369083 VWARTOHPZKBVNK-UHFFFAOYSA-N 399.472 2.815 0 50 GFAA CCN(CC)C(=O)[C@@H]1CCCN(C(=O)c2nc3ccc(Cl)cn3c2F)C1 215657779 AHHAITGHAKTHKN-GFCCVEGCSA-N 380.851 2.847 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCCNCC4)nc3)n2)c1OC 72167577 JSLPEFVMEHNNPT-UHFFFAOYSA-N 381.436 2.616 0 50 GFAA O=C(Cc1ccccc1)N1CCC(N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71753166 LWPXCCJFLLJGQP-FQEVSTJZSA-N 383.536 2.555 0 50 GFAA O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@@H](Cc2ccncc2)C1 363703824 VFASTZSAPBJROH-FCHUYYIVSA-N 379.504 2.764 0 50 GFAA CN1CCN(C(=O)c2ccc(-c3noc([C@H]4Cc5ccccc5O4)n3)cc2)CC1 371911140 YIQTYWCMUWTRSR-LJQANCHMSA-N 390.443 2.800 0 50 GFAA NC(=O)c1c(NC(=O)CCN2CC[C@]3(CCCOC3)C2)sc2c1CCCC2 375282862 AMHVXUFJWNWRQV-HXUWFJFHSA-N 391.537 2.557 0 50 GFAA CCC1(CNC(=O)N[C@H]2CCc3ncnn3C2)CCN(Cc2ccccc2)CC1 378286150 JKYWTTWEMBNVSE-IBGZPJMESA-N 396.539 2.585 0 50 GFAA COc1ccc(C(=O)N2CCCCC[C@H]2c2noc(C)n2)cc1N1CCNC1=O 378612966 ZERLYMFNWOEQNM-HNNXBMFYSA-N 399.451 2.674 0 50 GFAA Cn1c(CN2CCCC2)nnc1C1CCN(C(=O)NCc2ccccc2)CC1 77519878 UXYVWWRXMJRUNR-UHFFFAOYSA-N 382.512 2.500 0 50 GFAA CC(C)c1nnc2n1C[C@H](NC(=O)[C@H]1CCCN1Cc1ccc(F)cc1)CC2 176174047 HBGUZINXFYCLAR-QZTJIDSGSA-N 385.487 2.636 0 50 GFAA CCc1cc(N2CCC(NC(=O)C[C@H]3OCCc4ccccc43)CC2)ncn1 177174618 LRVKBJLQEXXZRS-HXUWFJFHSA-N 380.492 2.828 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCCc4ncc[nH]4)csc3C2)nc1 426492735 CEQVAXBYKGDDHW-UHFFFAOYSA-N 395.532 2.959 0 50 GFAA CN(C)[C@H]1CCCCN(C(=O)CCSc2nnc(-c3ccncc3)o2)C1 82161647 OWJWESDWLCBRPB-HNNXBMFYSA-N 375.498 2.557 0 50 GFAA CC1(C)CN(C(=O)c2cccnc2Nc2ccccc2F)CCS1(=O)=O 162882004 PFCXBQIOBAGBHI-UHFFFAOYSA-N 377.441 2.614 0 50 GFAA CCCC(=O)C(=O)N1CCC2(CC1)CC(=O)N(Cc1cc(F)cc(F)c1)C2 91550919 LFXCQKJBHXSKFC-UHFFFAOYSA-N 378.419 2.675 0 50 GFAA CCc1ccc(CN2CCc3c(C(=O)NCCc4cc[nH]n4)csc3C2)nc1 426535881 NGHHTJYJRNEFFT-UHFFFAOYSA-N 395.532 2.959 0 50 GFAA Cc1ccc(CNc2ncc(C(C)(C)C(=O)O)c(N3CCOCC3)n2)cc1C 96141663 PRDPTWUFOLCAPC-UHFFFAOYSA-N 384.480 2.904 0 50 GFAA O=C(NCc1nc(-c2ccncc2)n[nH]1)c1ccc(CN2CCCCC2)cc1 95361313 AZXOFQVYQFYQSH-UHFFFAOYSA-N 376.464 2.783 0 50 GFAA Cc1csc(CCCNC(=O)Nc2cc(NS(C)(=O)=O)ccc2F)n1 97766597 FFYPYZXJVXIVRR-UHFFFAOYSA-N 386.474 2.716 0 50 GFAA COc1ccc(CN2CC(c3cccnc3)C2)cc1OC[C@@H](O)CN(C)C(C)C 95496994 KSMHENKRTHWBAZ-NRFANRHFSA-N 399.535 2.770 0 50 GFAA Nc1nnc(CNC(=O)C[C@@H](c2ccccc2)c2ccc3c(c2)OCO3)s1 95529076 OIYFNCPSGBVIQO-AWEZNQCLSA-N 382.445 2.687 0 50 GFAA Cc1nc(N(C)C2CCCCC2)ncc1[C@@H](C)NC(=O)C(=O)c1cccn1C 91586350 MUNSVZYHRHUWQH-CQSZACIVSA-N 383.496 2.953 0 50 GFAA Cc1cccc(Cl)c1NC(=O)N1CCC2(CC1)[C@@H](C(=O)O)CC(=O)N2C 95383833 JWAZSDQFRWOPQF-GFCCVEGCSA-N 379.844 2.578 0 50 GFAA O=C(NCc1cnc(-c2ccccc2)s1)[C@@H](c1cccnc1)N1CCOCC1 91351069 ROPBRQRMPODWFV-LJQANCHMSA-N 394.500 2.895 0 50 GFAA N[C@H]1C[C@@H](c2cc(N3CCN(C4CCCCC4)CC3)nc(N3CCCC3)n2)C1 244724406 MTGSMGOAVYFVOG-HDICACEKSA-N 384.572 2.736 0 50 GFAA Cn1ncc(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)c1N 183470723 UZQITBUBWDNDIV-CQSZACIVSA-N 396.278 2.943 0 50 GFAA Cc1cc(F)cc(C(=O)N2CCC3(CC2)CN([C@H]2CCSC2)CCO3)c1 825138988 GFOKXMPRCBYYHN-SFHVURJKSA-N 378.513 2.947 0 50 GFAA CC1=C(c2ccccc2)[C@H]1C(=O)NC12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 827688903 SKSYKKZLCAHWPV-VGUSGMIYSA-N 375.476 2.941 0 50 GFAA CC[C@H](C)C(=O)Nc1ccccc1C(=O)N1CCCN(c2ncccn2)CC1 822560166 YCDHPGRHTZKDAN-INIZCTEOSA-N 381.480 2.814 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCc2nc[nH]c2[C@H]1c1ccccn1 827972606 VPVLIZYRQSBGRF-HXUWFJFHSA-N 377.448 2.781 0 50 GFAA O=C(O)c1sccc1S(=O)(=O)NCc1nc(-c2ccccc2Cl)no1 828574605 JPXUCUWTHBRCFM-UHFFFAOYSA-N 399.837 2.628 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1)N1C[C@@H]2C[C@@H](O)[C@H]2C1 1875269558 YWTXDGWBZURJKA-JCGIZDLHSA-N 378.407 2.526 0 50 GFAA CCOc1ccc([C@H](COC)NC(=O)NCc2nc(-c3ccco3)n[nH]2)cc1 1875264871 VHGYWWMWVPAEFT-HNNXBMFYSA-N 385.424 2.650 0 50 GFAA CC(=O)N1CCC[C@@H](CNC(=O)N[C@H](Cc2ccccc2)Cc2cccnc2)C1 1875288942 MECMNZBJYDYRCL-FCHUYYIVSA-N 394.519 2.793 0 50 GFAA CCN(C)C(=O)c1cccc(C(=O)N2CCC[C@@]23CCC[S@](=N)(=O)C3)c1 1875395953 QUDGZUAMLOWHMZ-SIBVEZHUSA-N 377.510 2.594 0 50 GFAA O=C(N=[S@@]1(=O)CCC[C@@]2(CCCN2)C1)c1cccc(Oc2cnccn2)c1 1875392984 CDSHFDCRTBOKIJ-UZTOHYMASA-N 386.477 2.793 0 50 GFAA C[C@@H](NC(=O)c1cc(-c2ccco2)n2cnc(C(N)=O)c2n1)c1cccc(F)c1 1875350610 ULAAWZPEUBCARR-LLVKDONJSA-N 393.378 2.718 0 50 GFAA O[C@H]1CN(Cc2ccc(-c3cccc(Cl)c3)o2)CC[C@@H]1N1CCOCC1 1565507708 YMRCCOOCUUKYNW-OALUTQOASA-N 376.884 2.867 0 50 GFAA CN1C(=O)CC[C@@H](C(=O)NCCc2ccc3c(c2)OCCO3)[C@H]1c1ccccc1 171985700 IKDPWPQBEGQURO-XMSQKQJNSA-N 394.471 2.726 0 50 GFAA CCN(CC)CC[C@H](CO)NC(=O)Nc1cccc(COCCOC(C)C)c1 225524045 WXXZSHIAYQUKGH-HXUWFJFHSA-N 395.544 2.843 0 50 GFAA Nc1nc(N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)cc2nncn12 1529152844 ZKOJGGGFICRJRQ-OAQYLSRUSA-N 377.496 2.589 0 50 GFAA COC(=O)C1CCN(C(=O)CSc2nnc(-c3cccc(Cl)c3)o2)CC1 5391894 YEJDHRXQPYDBEQ-UHFFFAOYSA-N 395.868 2.894 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N(C)Cc2ccncc2C)CCC1=O 11820799 LHWXFNOINQVNCZ-IBGZPJMESA-N 381.476 2.796 0 50 GFAA Cc1ncc(CN2CCC[C@@H](C(=O)Nc3cccc(-n4cccn4)c3)C2)n1C 12301372 PARGLWGCCKKSMH-QGZVFWFLSA-N 378.480 2.765 0 50 GFAA O=C(NCc1ccccc1F)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12387291 RZVKHWLZMNUBAW-GOSISDBHSA-N 387.499 2.555 0 50 GFAA Cc1nnc(SCC(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)s1 12439569 KTCZMEIQBAUYKH-ZDUSSCGKSA-N 386.506 2.713 0 50 GFAA CCc1cc(C(=O)N2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cs1 13331449 BZCJJOXLKWEHNX-UHFFFAOYSA-N 382.482 2.596 0 50 GFAA Cc1ccccc1CC(=O)N1CCC(N2CCC[C@H](C(=O)NC3CC3)C2)CC1 15069311 DHSCFKALVGEVRJ-IBGZPJMESA-N 383.536 2.519 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3nc4ccccc4s3)CC2=O)cc1 19148967 DSRSQOWAFJVHKA-UHFFFAOYSA-N 381.457 2.790 0 50 GFAA Cn1c(CN2CCOCC2)nnc1SCc1ccc(Br)cc1 19799036 MWLPTEBPYCNACJ-UHFFFAOYSA-N 383.315 2.702 0 50 GFAA O=C(CN1C(=O)N[C@H](c2ccc(Cl)cc2)C2=C1COC2=O)Nc1ccccc1 169757859 DTXUZDYVBQCDCM-GOSISDBHSA-N 397.818 2.856 0 50 GFAA Cc1nnc(C2CCN(C(=O)[C@@H](C)NC(=O)c3ccc(Cl)cc3)CC2)o1 1857529951 RDPNTZZPGIGTIC-LLVKDONJSA-N 376.844 2.556 0 50 GFAA O=C(c1ccccn1)N1CCC[C@@]2(CCc3c(O)nc(-c4cccnc4)nc32)C1 1857701188 FYPMUYRLLJXICO-JOCHJYFZSA-N 387.443 2.759 0 50 GFAA CCn1ccc(C(=O)N2CCC(C3CCN(c4nnc(C)s4)CC3)CC2)n1 1857715148 DQKBGAOFAONEEE-UHFFFAOYSA-N 388.541 2.832 0 50 GFAA O=C(c1ccc(F)c(F)c1)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857731765 OJTJFCLHFCKDEH-OPYAIIAOSA-N 384.382 2.879 0 50 GFAA Cc1cccc(Oc2ccc(C(=O)N3CC[C@@]45OCCN4C(=O)C[C@@H]35)cc2)c1 1857737800 DAGMBFQDTOZLAF-KNQAVFIVSA-N 378.428 2.961 0 50 GFAA CCCN=c1[nH]c(-c2cccnc2)nc2c1CC[C@]21CCCN(C(=O)C2CC2)C1 1875250903 POSRWVCFTPUAOL-QHCPKHFHSA-N 391.519 2.999 0 50 GFAA COc1ccc([C@H]2CN(C(=O)c3cc4ccccc4[nH]3)C[C@@H]2NC(C)=O)cc1 222479464 CNQYQKYSDJOKJL-NQIIRXRSSA-N 377.444 2.921 0 50 GFAA Cn1ccnc1C[C@H]1CCCN(S(=O)(=O)Cc2cc(Cl)ccc2F)C1 124894912 FVONUIVPMUQROB-CYBMUJFWSA-N 385.892 2.997 0 50 GFAA COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](C(=O)O)C1 237105108 ZTOFSTFDTSNCPP-KBPBESRZSA-N 384.270 2.577 0 50 GFAA CN(Cc1cccc(-c2nc(C3CCNCC3)cc(=O)[nH]2)c1)C[C@H]1CCCO1 23429188 ZISJTBJCAMRGBX-LJQANCHMSA-N 382.508 2.515 0 50 GFAA Cn1c(O)nnc1C1CCN(C(=O)c2cccc(-c3cccc(CN)c3)c2)CC1 2325786439 LGUYCYAJPOHBGA-UHFFFAOYSA-N 391.475 2.666 0 50 GFAA CC(C)(C)OC(=O)N1CC2(CC[C@@H](COC(=O)c3ccc4n[nH]cc4c3)O2)C1 849614406 UPPLQLDKXQOATQ-HNNXBMFYSA-N 387.436 2.888 0 50 GFAA COC1(C(=O)N2CCN(C(=O)c3cc(C)c(C(F)F)cn3)CC2)CCCC1 2325826772 MGVOHNNFWWHCKK-UHFFFAOYSA-N 381.423 2.571 0 50 GFAA Cc1n[nH]c2nc(O)c(C(=O)NCc3cccc(OCc4ccccn4)c3)cc12 2325869680 XYUPPSHELVPMAA-UHFFFAOYSA-N 389.415 2.876 0 50 GFAA CCOC(=O)N1CCN(C(=O)COc2cc(C)c(Br)c(C)c2)CC1 795566 CTMKYHOYEPGRSS-UHFFFAOYSA-N 399.285 2.745 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)c1ccccc1N(C)S(C)(=O)=O 1131249 ZGPMVHDPLOZMMF-UHFFFAOYSA-N 376.434 2.511 0 50 GFAA Cc1ccc(N(C(=O)COc2ccc(F)cc2)[C@@H]2C=CS(=O)(=O)C2)cc1 4269658 VRNDGBLYKSFISI-QGZVFWFLSA-N 375.421 2.857 0 50 GFAA O=C(NCCCn1nnc2ccccc21)c1cn(Cc2ccccc2Cl)nn1 11706166 WPUJBJOYZQRBLE-UHFFFAOYSA-N 395.854 2.545 0 50 GFAA O=C(CCC1CCN(C(=O)C2CCOCC2)CC1)NCc1ccc(F)cc1 11753401 WYUCQJGBPRBSPC-UHFFFAOYSA-N 376.472 2.887 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)[C@@H]3CCCN3C(=O)CCC(N)=O)c2)c1 12596677 NOSRZHOCQFNXLG-IBGZPJMESA-N 379.460 2.857 0 50 GFAA CCOc1ccc(CNC(=O)c2ccc(N(C)S(=O)(=O)CC)cc2)cc1 13674173 WTIGLDTUDJKJLZ-UHFFFAOYSA-N 376.478 2.801 0 50 GFAA Cc1ccc(CN2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1 14239707 MKPGQCNFPOUXBT-UHFFFAOYSA-N 388.518 2.506 0 50 GFAA CCCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](N(C)Cc1cscn1)C2 14537519 HGJXRFYMPLAIKO-INIZCTEOSA-N 387.553 2.975 0 50 GFAA O=C(CCCn1cncn1)N1CCC([C@H]2CCN(CCc3ccccc3)C2)CC1 15074034 JQHJQBMVQKCVMV-QFIPXVFZSA-N 395.551 2.862 0 50 GFAA CC(=O)Nc1ccc(CN2CCN(Cc3ccc(F)cc3)[C@@H](CCO)C2)cc1 20321272 XEGZQQJQKKAJME-QFIPXVFZSA-N 385.483 2.853 0 50 GFAA OCC[C@@H]1CN(Cc2cccc3nonc23)CCN1CCCc1ccccc1 20598454 BHNQPJPMOXMXMT-HXUWFJFHSA-N 380.492 2.724 0 50 GFAA CCCN(Cc1cccc(OC[C@H](O)CN2CCN(CC)CC2)c1)CC1CC1 20600397 SNGCOBBRQDKPQQ-JOCHJYFZSA-N 389.584 2.686 0 50 GFAA Cc1nnsc1C(=O)N1CCC(CNC(=O)c2ccc(F)cc2Cl)CC1 43986714 FMDRIAVNIHRYFB-UHFFFAOYSA-N 396.875 2.921 0 50 GFAA CC(C)N(CCSc1ccccc1)C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 55359367 DAWPFZCFRDAENS-UHFFFAOYSA-N 383.473 2.859 0 50 GFAA C[C@@H](C(=O)N1CCc2onc(-c3ccc(Cl)cc3)c2C1)N1CCOCC1 67770207 GRFYGMHXDBVMOZ-ZDUSSCGKSA-N 375.856 2.600 0 50 GFAA CN(Cc1cc[nH]n1)C(=O)C[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71479483 ARXHPDUAANHDGG-HSZRJFAPSA-N 388.471 2.915 0 50 GFAA CN1CCN(S(=O)(=O)c2cc(C(=O)Nc3ccccc3)ccc2Cl)CC1 71754850 RYYLZHYTJKCXKS-UHFFFAOYSA-N 393.896 2.528 0 50 GFAA CC(C)[C@@H]1CN(C(=O)c2cc(=O)[nH]c3ccccc23)CCC(=O)N1CC1CC1 71771600 KTXCFOFXTDLMLA-IBGZPJMESA-N 381.476 2.637 0 50 GFAA CCN(CCN1CCCC1)C(=O)[C@H]1CCC(=O)N(Cc2ccccc2F)C1 91445254 OFSKQYHRECARTC-SFHVURJKSA-N 375.488 2.509 0 50 GFAA Cc1ccc(F)cc1CC(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1ccccn1)C2 91625278 KOMFWZPSVLCURD-QFBILLFUSA-N 381.451 2.835 0 50 GFAA COCCN(C)C[C@@H]1CN(c2cc(C)c3cc(Cl)ccc3n2)C[C@@H]1CO 91894533 WKNQVSWYZAQGNE-HZPDHXFCSA-N 377.916 2.820 0 50 GFAA CCn1ncc(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)c1C 91964544 UKMDJFHZCSBEFG-UHFFFAOYSA-N 384.528 2.876 0 50 GFAA Cn1cccc1-c1cc(C(=O)NCCc2csc(-c3cccnc3)n2)[nH]n1 92061527 HTDSKFHMSPCYKH-UHFFFAOYSA-N 378.461 2.906 0 50 GFAA CCn1c(CCNC2CCN(c3cc(C)nc(N)n3)CC2)nc2ccccc21 95357412 CAUJZDRXSRZQLE-UHFFFAOYSA-N 379.512 2.538 0 50 GFAA COCc1noc(CN2CCC[C@H](CNC(=O)c3ccccc3Cl)C2)n1 95497249 NNJKTIADOVIUGF-CYBMUJFWSA-N 378.860 2.511 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)N[C@H](C)COc2ccccc2OC)c1 97527402 ITNSLAJYGLAZIV-CYBMUJFWSA-N 387.436 2.652 0 50 GFAA NS(=O)(=O)N1CCN(Cc2cccc(-c3ccc4ccccc4c3)c2)CC1 97570960 IDJOFRMRNYCMBS-UHFFFAOYSA-N 381.501 2.828 0 50 GFAA Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)CCS(=O)(=O)CC(C)C)C1 117189295 BZXSNMFEZQWRGM-QGZVFWFLSA-N 384.517 2.680 0 50 GFAA CNC(=O)c1cccc(CCNC(=O)NCc2ccccc2OC(F)(F)F)c1 128133674 STHTZWVAVUQFHU-UHFFFAOYSA-N 395.381 2.987 0 50 GFAA O=C(N[C@H]1c2ccccc2C[C@H]1O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 130819089 HMWNQOWDRXIDLH-AHRSYUTCSA-N 379.460 2.705 0 50 GFAA Cc1ccc(N2CC[C@@H](NC(=O)c3sc(-c4cnn(C)c4)nc3C)C2=O)cc1 152896413 LVQPQMOSTJXLBN-MRXNPFEDSA-N 395.488 2.696 0 50 GFAA O=C(c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)N1CC[C@@]2(CCOC2)C1 154947827 BQNAVBWHXRRGSX-MRXNPFEDSA-N 384.333 2.678 0 50 GFAA CC(=O)Nc1ccc(C(=O)N2CCC3(CC2)NC(c2ccccc2)=NO3)cc1 169755020 GVXLINFIVJUQFZ-UHFFFAOYSA-N 378.432 2.559 0 50 GFAA O=C(Cc1cccc(Cl)c1)N1CC[C@@H](n2cc(-c3nc(C4CC4)no3)nn2)C1 169778126 AQVMHOSBTBOHPQ-OAHLLOKOSA-N 398.854 2.875 0 50 GFAA Cc1nc2n(n1)CCC[C@H]2NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 177716999 CLXBWKGUZHWQHB-MRXNPFEDSA-N 385.468 2.967 0 50 GFAA CC(=O)N[C@@H]1CCCN(C(=O)CN2CCc3c(-c4ccccc4)cccc32)C1 184518538 VLXHHQLUIWMPHW-LJQANCHMSA-N 377.488 2.843 0 50 GFAA O=C(O)c1cccc2c1N(S(=O)(=O)c1ccc(Br)cc1)CC2 242389436 ZXGHOLLVRZATML-UHFFFAOYSA-N 382.235 2.899 0 50 GFAA Cc1ccc(C(=O)[C@@H]2[C@@H]3C(=O)N(c4ccc(F)cc4)C(=O)[C@H]3[C@H]3CCCN23)cc1 245329032 WZYOORBBJIMWMJ-WCIQWLHISA-N 392.430 2.969 0 50 GFAA CC[C@H](C)N1C(=O)[C@@H]2[C@H](C(C)C)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C1=O 245329440 YYRKTOXXDWIDNM-HKMBFBJRSA-N 389.883 2.515 0 50 GFAA O=C(CCCCCc1ccc(F)cc1)N[C@H]1CCO[C@]2(CCS(=O)(=O)C2)C1 274989778 AYWCOVIMPQNKAK-AZUAARDMSA-N 397.512 2.781 0 50 GFAA COCc1noc(CN2CCC3(CC2)C[C@@H]3N(Cc2ccsc2)C(C)=O)n1 276421979 LJTOWEYSYGGKFX-INIZCTEOSA-N 390.509 2.681 0 50 GFAA Cn1cc(CNC(=O)N2CCCN3c4ccccc4C[C@@H]3C2)c(C(F)(F)F)n1 292527509 PKKGOLNDRXUWMP-OAHLLOKOSA-N 393.413 2.786 0 50 GFAA COc1cccc([C@@H]2CCCN2C(=O)COc2ccc(N3CCCC3)nn2)c1 299786535 MXMSVAAKRPCCBM-SFHVURJKSA-N 382.464 2.828 0 50 GFAA O=C(CCn1nnc2ccccc21)NC[C@@H](c1ccc(F)cc1)N1CCCC1 299787740 XQEQTHLKJSFIIK-FQEVSTJZSA-N 381.455 2.914 0 50 GFAA Cc1n[nH]c(SCC(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCCC2)n1 299789674 ABHIMXGIPLWNHI-HNNXBMFYSA-N 379.917 2.812 0 50 GFAA CN1C(=O)C[C@@H](CNCc2ccccc2OC(F)(F)F)[C@@H]1c1cnn(C)c1 328633335 SMFVIJFWHUWBCV-SUMWQHHRSA-N 382.386 2.628 0 50 GFAA CCCn1c(CO)nnc1S[C@H]1CCN([C@H]2CCCc3ccccc32)C1=O 375114847 RTNIWMFOMUUCQP-IRXDYDNUSA-N 386.521 2.951 0 50 GFAA C[C@](O)(CCCO)CNC(=O)c1cccc(-c2cccc3c(=N)cc[nH]c23)c1 534590015 ZOICSUCVUBUKTG-QFIPXVFZSA-N 379.460 2.568 0 50 GFAA O=C(c1cccc(-c2ccc(N3CCCCCC3)nn2)c1)N1CCCNCC1 584897957 BXZHGKGQLCGZHD-UHFFFAOYSA-N 379.508 2.960 0 50 GFAA CCOc1cccc(-c2cc(-c3c(C)nn(C)c3C)nc(CC(=O)NC)n2)c1 823391929 ZEHFCHXJDIWVCE-UHFFFAOYSA-N 379.464 2.848 0 50 GFAA CC(C)N1CCNC(=O)[C@H]1CC(=O)Nc1ccc(-c2cccc(F)c2F)cn1 1529126652 LQJQFQQGOMMYIK-MRXNPFEDSA-N 388.418 2.564 0 50 GFAA CCC[C@]1(C(=O)O)CN(C(=O)C(C)(C)Oc2cccc(C)c2C)CC[C@H]1O 1704344170 PTHYJADDHHMYAJ-UTKZUKDTSA-N 377.481 2.925 0 50 GFAA COc1c(N2C[C@H]3CCCN[C@H]3C2)c(C)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 1857526845 AYDPRSBEZLFMKY-DYVFJYSZSA-N 397.475 2.540 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)N1[C@H]2CC[C@@H]1[C@@](CO)(Cc1ccccc1)C2 1857677596 JBIRJKIEBKPYKI-WPYKKVEZSA-N 381.520 2.954 0 50 GFAA CNC(=O)Cc1nc(Cc2ccc3nc(C)[nH]c3c2)n(Cc2ccc(F)cc2)n1 1857683341 ZYUQKTONAFGSGQ-UHFFFAOYSA-N 392.438 2.530 0 50 GFAA Cc1cnc(CN2CCC[C@@]3(CCc4c(O)nc(-c5cccnc5)nc43)C2)[nH]1 1857708901 SUOQVZZFLZJFBA-OAQYLSRUSA-N 376.464 2.756 0 50 GFAA O=C(N[C@@H]1C[C@H]2CO[C@@H](c3ccc(Cl)cc3)CN2C1)[C@H]1CC[C@@H](O)CC1 1857718169 BHXXJGBWCFCYIG-GYFISPQKSA-N 378.900 2.522 0 50 GFAA CC(C)(CO)CC(=O)N1CCC[C@@]2(CCc3c(O)nc(C(C)(C)C)nc32)C1 1857741246 KKFVCDZKBPZRHJ-OAQYLSRUSA-N 375.513 2.695 0 50 GFAA C[C@H](CCNC(=O)c1ccc2[nH]nc(C(=O)O)c2c1)N(C)Cc1ccccc1 1875299919 AUMFGOCYLZWXED-CQSZACIVSA-N 380.448 2.902 0 50 GFAA CC1(C)CC(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(=O)c2ccc3nc(O)[nH]c3c2)C1 1875370720 AOHSGDWLHVGPPJ-CVEARBPZSA-N 396.491 2.910 0 50 GFAA C=CC(=O)NCC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccc(Cl)cc21 1875387251 XJQNKNONLBMZBM-CQSZACIVSA-N 393.871 2.945 0 50 GFAA COc1ccc2ccccc2c1CN[C@@H]1C[C@@H](Cn2cc(C(=O)O)cn2)C[C@H]1O 1875398532 URADIJQKXGRTJU-JSNMRZPZSA-N 395.459 2.672 0 50 GFAA O=C(c1cccc(O)n1)N1CCC[C@@]12CCCN(CCc1ccccc1)C2=O 2100473504 NPNZPTQBJOCWDP-JOCHJYFZSA-N 379.460 2.627 0 50 GFAA COc1ccc2[nH]c(C(=O)N[C@@H]3C[C@@H](Cn4cc(Cl)cn4)C[C@H]3O)cc2c1 2325785809 OIOHVTHSWMPSFM-XNAIMREJSA-N 388.855 2.596 0 50 GFAA CO[C@]1(C(F)(F)F)CN[C@H](C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)C1 2325795575 NQLZJQNCJKFJIV-RDJZCZTQSA-N 382.386 2.737 0 50 GFAA Cn1ccnc1CNc1ccc(C(=O)N2CCOc3ccc(CN)cc32)cc1 2325858354 KAPTUTQJKVJORO-UHFFFAOYSA-N 377.448 2.530 0 50 GFAA CCc1c(C)sc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c1C(N)=O 689250 GUDVXLFOJSOLRX-UHFFFAOYSA-N 378.450 2.996 0 50 GFAA O=S(=O)(c1ccc(Cl)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1 1230565 VGDHKGWZUVGTMO-UHFFFAOYSA-N 385.894 2.957 0 50 GFAA COc1ccccc1N1CCN(S(=O)(=O)c2cccc3cccnc23)CC1 1293604 APHFPWSPWDRGRT-UHFFFAOYSA-N 383.473 2.754 0 50 GFAA CN(Cc1cnn(C)c1)C(=O)c1cnn2c(C(F)(F)F)cc(C3CC3)nc12 2771126 QLDQXJUKJSQQSN-UHFFFAOYSA-N 378.358 2.631 0 50 GFAA CC(C)CCn1c(SCc2ccc(F)cc2)nc2c1c(=O)[nH]c(=O)n2C 4225900 AAVNGHGSLSXGRP-UHFFFAOYSA-N 376.457 2.901 0 50 GFAA C/C(Cl)=C\Cn1c(=O)c2c(nc3n2CCCN3c2ccccc2)n(C)c1=O 4456958 DYQXCUZBZMDMGX-UKTHLTGXSA-N 385.855 2.581 0 50 GFAA CNC(=O)CN(c1cc(C)cc(C)c1)S(=O)(=O)c1cc(C)ccc1OC 4857195 AFUCQJRFQXYEKH-UHFFFAOYSA-N 376.478 2.562 0 50 GFAA COc1ccccc1C1=NO[C@H](C(=O)Nc2cc(OC)c(OC)c(OC)c2)C1 6738308 ATGGDUJQISWANB-SFHVURJKSA-N 386.404 2.853 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C(=O)[C@H]1CCCO1 11949818 WNSFVDYKMLPCMF-OAQYLSRUSA-N 390.524 2.561 0 50 GFAA O=C(NC[C@H]1CCC2(CCN(Cc3cc4ccccc4[nH]3)CC2)O1)[C@H]1CCCO1 11995847 WAPJOWWYILVEMS-TZIWHRDSSA-N 397.519 2.977 0 50 GFAA COc1ccc(CCN2CCC(CN(C)C(=O)C3=C(C)OCCO3)CC2)cc1 12192638 SBDHDIXSMHMHLB-UHFFFAOYSA-N 388.508 2.686 0 50 GFAA O=C(NCc1ccccc1Cl)c1ccc(CN2CCSCC2)[nH]c1=O 14989800 BYVXDSCKXFDZAA-UHFFFAOYSA-N 377.897 2.507 0 50 GFAA Cn1nc(C(=O)N2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)ccc1=O 15063566 GOPIHVOUKXMGNU-CYBMUJFWSA-N 393.365 2.534 0 50 GFAA OCC[C@@H]1CN(Cc2cccc3c2OCO3)CCN1Cc1ccc(F)c(F)c1 20601624 KNPUVGSOOKMXBW-QGZVFWFLSA-N 390.430 2.762 0 50 GFAA Cc1nc(-c2ccc(N3CCC(NCCN4CCNCC4)CC3)cc2)cs1 22892343 QRJBPTARRAUSSL-UHFFFAOYSA-N 385.581 2.582 0 50 GFAA CN(Cc1cccc(-c2nc(O)cc(CCN)n2)c1)Cc1ccc2c(c1)OCO2 23398219 JGPHKPCQMSTSTR-UHFFFAOYSA-N 392.459 2.711 0 50 GFAA O=C(NCc1ccccc1)N1CCC(Cn2cc(-c3ccccn3)nn2)CC1 23505366 JEJUYHBOSFNIRT-UHFFFAOYSA-N 376.464 2.962 0 50 GFAA O=c1cc(Cc2cccc(F)c2)nc(-c2ccc(CN3CCOCC3)cc2)[nH]1 23581310 HGXVNYNCOMKQJU-UHFFFAOYSA-N 379.435 2.999 0 50 GFAA CCNc1cc(N2CCN(C(=O)c3cc(Cl)ccc3OC)CC2)nc(C)n1 67601813 BSQKOPGYMMEVSP-UHFFFAOYSA-N 389.887 2.841 0 50 GFAA O=C(c1ccc(NC[C@@H]2CCCO2)nc1)N1CCC(Oc2cccnc2)CC1 67818878 OYXMAHMUVHOPSD-SFHVURJKSA-N 382.464 2.751 0 50 GFAA CN(C)c1nc(-c2ccccc2)nc2c1CCN(C(=O)[C@@H](O)c1ccccc1)C2 71721342 QGSIEZQYGIEPJC-FQEVSTJZSA-N 388.471 2.828 0 50 GFAA CCN1C[C@@]2(CCCN(C(=O)c3cc(=O)[nH]c4cc(F)ccc34)C2)CCC1=O 82098562 QGOQMVKVKQQCFR-OAQYLSRUSA-N 385.439 2.532 0 50 GFAA Cc1ccccc1C(=O)N1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91664614 BIQNEJZBHMYXIJ-QFIPXVFZSA-N 380.492 2.806 0 50 GFAA Cc1ccc(OCC(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2cccnc2)C3)cc1 91973706 QVVQACFDWPRKQR-PKOBYXMFSA-N 379.460 2.532 0 50 GFAA Cc1cccc2cc(C(=O)NC[C@@H](c3cccnc3)N3CCOCC3)n(C)c12 95379659 IWBSAQRECBCMKK-FQEVSTJZSA-N 378.476 2.685 0 50 GFAA CCc1cc(C(=O)N2CC[C@@]3(CCCN(C4CCOCC4)C3=O)C2)cs1 95383138 VPUOEIHKZAYMRH-FQEVSTJZSA-N 376.522 2.944 0 50 GFAA CCn1c(=O)oc2cc(NC(=O)NC[C@@H](CO)Cc3cccs3)ccc21 96166121 HXJLQFJDCAGZQZ-LBPRGKRZSA-N 375.450 2.649 0 50 GFAA O=C1NCCN(C(=O)c2cc(-c3ccccc3F)n[nH]2)[C@H]1c1ccc(F)cc1 97532874 VDZBVNOJODQTEX-SFHVURJKSA-N 382.370 2.668 0 50 GFAA COc1ccccc1C(=O)N1CCC2(CC1)NC(=O)N(c1cccc(F)c1)N2 169764162 AJGBPCMDUMNWCQ-UHFFFAOYSA-N 384.411 2.501 0 50 GFAA CC1CCC(NS(=O)(=O)CC(=O)N(C)[C@@H]2CCc3ccccc3C2)CC1 170626786 MPMGRMJWKVAFDW-XUJQIHCRSA-N 378.538 2.500 0 50 GFAA O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCN2CCC[C@@H]2C1 187542960 UMSAGAQHKHCVJO-HWOWSKLDSA-N 378.904 2.915 0 50 GFAA NC(=O)[C@H]1CC[C@@H](C(=O)N(Cc2ccccc2Br)C2CCCC2)O1 193587021 AQURQLSFCXFMCF-CVEARBPZSA-N 395.297 2.753 0 50 GFAA COC[C@H]1[C@H]2OCC[C@H]2[C@H]1NC(=O)c1ccccc1OC(F)(F)C(F)F 223118018 SPTCJMQHKJFVNT-UNJBNNCHSA-N 377.334 2.703 0 50 GFAA NC(=O)CNC(=O)Nc1cccc(NC(=O)c2cc3cc(Cl)ccc3o2)c1 240465835 GAQRWAOAFFBFDK-UHFFFAOYSA-N 386.795 2.945 0 50 GFAA CCCn1ccnc1CN1CCC2(CCC(=O)N([C@H]3CC[C@H](O)CC3)C2)CC1 244659703 HHKYQHWZVFKTCW-WGSAOQKQSA-N 388.556 2.801 0 50 GFAA CN1[C@H]2CC[C@H]1CN(C(=O)NCC1CCN(Cc3cccs3)CC1)CC2 246544029 YICHFBBYIYHMQU-ROUUACIJSA-N 376.570 2.838 0 50 GFAA COC(=O)N1CC[C@@H](NC(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)C1 253428594 DSAVKRLZFBROAH-GDBMZVCRSA-N 397.516 2.617 0 50 GFAA C[C@@](NC(=O)C1C[C@@H]2CCC[C@H](C1)C2N)(C(N)=O)c1cccc(C(F)(F)F)c1 262569409 SEXMIEGNTHZQLD-UTUVDLIBSA-N 397.441 2.676 0 50 GFAA Cc1ccc2nccc(NC3CCN(S(=O)(=O)C4CCOCC4)CC3)c2c1 302147218 ILHQYZHJHMGQBF-UHFFFAOYSA-N 389.521 2.928 0 50 GFAA O=S(=O)([C@@H]1C[C@H]1c1ccccc1)N1CCC(c2nnc3n2CCCC3)CC1 333162758 MDHXJWVXWWZKRW-ZWKOTPCHSA-N 386.521 2.680 0 50 GFAA CN1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)C[C@@H]1c1nccn1C 333504683 WFCIDCXIKAPZDD-GOSISDBHSA-N 385.487 2.679 0 50 GFAA CCc1nc(CN2CCOC[C@H]2c2c(C)nn(-c3ccccc3F)c2C)n[nH]1 364283458 ZNZNWCYZAROEFJ-KRWDZBQOSA-N 384.459 2.882 0 50 GFAA O=C(Nc1cc(C(=O)N2CCC(O)(Cc3ccccc3F)CC2)ccn1)C1CC1 367739676 XWQGHOKLEIZCHJ-UHFFFAOYSA-N 397.450 2.779 0 50 GFAA COc1ccc(C(=O)N2CCN(C)CC2)cc1NCc1ccc(-c2cc[nH]n2)o1 433342768 XMECIOWDHOXJQJ-UHFFFAOYSA-N 395.463 2.678 0 50 GFAA CCC1=NO[C@@H](CNC(=O)c2ccc(-c3cc(OC(C)C)nc(N)n3)cc2)C1 534673148 IKGLTKTWDKTFPD-MRXNPFEDSA-N 383.452 2.798 0 50 GFAA O=C(c1cccc(OCC(F)F)n1)N1CC[C@@H](c2ccccc2)S1(=O)=O 814087409 JLLDPAQZGUSPJI-AWEZNQCLSA-N 382.388 2.643 0 50 GFAA Cc1ccc([C@@H](C)CCN2CCOC3(CCN(c4ccnc(N)n4)CC3)C2)o1 827591846 RGCIMEDOFWRVAH-INIZCTEOSA-N 385.512 2.825 0 50 GFAA O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](OCc2cccnc2)C1 828182268 FZKYPQSJRUOFOP-IBGZPJMESA-N 381.476 2.740 0 50 GFAA C=CC(=O)N1CCC(C(=O)NCc2cccc(N(C)C)n2)(c2ccccc2)CC1 847613001 ZGRXRLBQOCLOMS-UHFFFAOYSA-N 392.503 2.510 0 50 GFAA CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1ccc3c(C)cc(O)nc3c1)C2 895223039 YJHIRVLUKQOQDD-CYBMUJFWSA-N 394.431 2.667 0 50 GFAA CC1(C)CN(C(=O)C(C)(C)N2CCNCC2)[C@@H]1c1nccn1-c1cccc(F)c1 952893756 JGBBLVJLEMRHSD-GOSISDBHSA-N 399.514 2.605 0 50 GFAA CN(C[C@@H]1CCN(c2ccccc2)C1)S(=O)(=O)c1ccc2nc(O)oc2c1 952973746 VLXMCGLCCFZZRB-AWEZNQCLSA-N 387.461 2.680 0 50 GFAA CN(CC(=O)N1C[C@@H]2CC[C@H]1CN(Cc1ccc(F)cc1)C2)Cc1cccnc1 1565516789 VGIWKMBGSAKMMP-IRLDBZIGSA-N 396.510 2.776 0 50 GFAA CCCC[C@H]1CN(c2cc(C(=O)N3CCN(C)CC3)ccn2)C[C@@H](C(C)C)O1 1616084927 VLCPIYAVUZASMA-PMACEKPBSA-N 388.556 2.889 0 50 GFAA CCOc1c(Cl)cc(CNC(=O)c2ncoc2[C@@H]2[C@H]3CN[C@H]2C3)cc1OC 1857530429 NLCYYYAJMMSEAS-OSAQELSMSA-N 391.855 2.741 0 50 GFAA O=C(NCc1cc(O)ncn1)[C@H]1CCCN(c2nc3cc(Cl)ccc3o2)C1 1857726782 CCUKDDUPMRVBNL-NSHDSACASA-N 387.827 2.510 0 50 GFAA Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)N[C@H]1CCC(=O)NC1=O 1857797738 IGWVWTGZSYRIGK-HNNXBMFYSA-N 392.242 2.899 0 50 GFAA CC(C)c1ccc(-c2noc(CCC(=O)N3CC[C@H](C)S3(=O)=O)n2)cc1 1875285479 OJNJSVYHLMMFOK-ZDUSSCGKSA-N 377.466 2.743 0 50 GFAA Cn1ncc(C(F)(F)F)c1S(=O)(=O)Nc1cc(O)cc(C(F)(F)F)c1 1875291154 PPAJUEKKHKEWNG-UHFFFAOYSA-N 389.277 2.964 0 50 GFAA O=C(NC[C@H]1CCN(C(=O)c2ccc(F)c3ccccc23)C1)c1ccnnc1 1875328029 VGKDQUOFGRPFGY-CQSZACIVSA-N 378.407 2.661 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N2C[C@H]3C[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1 1875384870 JNEIAIREHYJQQJ-YJBOKZPZSA-N 399.491 2.917 0 50 GFAA C=CC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)C1=NO[C@H](c2ccccc2)C1 1875389513 QYLFLQCJIMFJAO-FPOVZHCZSA-N 389.455 2.760 0 50 GFAA CC(C)n1c(O)nnc1[C@H]1[C@H](C2CC2)CCN1C(=O)c1cnc2c(n1)CCCC2 1875401883 VAYAKGROQMGEQU-KBXCAEBGSA-N 396.495 2.847 0 50 GFAA C[C@@H](c1ccc(Cl)cc1)N1C[C@@H](C(=O)NCc2nc3cccnc3[nH]2)CC1=O 2325780793 PNSOCUJAFPHGRA-JSGCOSHPSA-N 397.866 2.837 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2cc(Cl)cn2)C[C@H]1O)c1cncnc1-c1ccccc1 2325786018 YFVLPFLUSJYIES-MORSLUCNSA-N 397.866 2.563 0 50 GFAA O=c1[nH]c2c(nc1Sc1n[nH]c(=Nc3ccccc3F)s1)CCCC2 2325852128 UGPOWCPSYQURQM-UHFFFAOYSA-N 375.454 2.956 0 50 GFAA O=C(NC[C@@H]1Cc2ccccc2CN1)c1c[nH]c2ncc(Br)cc12 2325854270 VTVKEXVBVQNJLX-AWEZNQCLSA-N 385.265 2.770 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)c3cn4cccnc4n3)C2=O)cc1 2356140011 QAWZULIYMCSNIF-QFIPXVFZSA-N 389.459 2.840 0 50 GFAA CCC[C@@]1(C(=O)O)CN(C(=O)c2cc(-n3cccn3)ccc2Cl)CC[C@H]1O 2356162156 ZZPBAAJZABLMGY-VQIMIIECSA-N 391.855 2.604 0 50 GFAA COc1cccc2c1C1(CCN(C(=O)c3ccnc4c3ncn4C)CC1)OCC2 2356142552 XGGSWAJRKLKZPE-UHFFFAOYSA-N 392.459 2.681 0 50 GFAA COC(=O)c1ccccc1NC(=O)c1cc2ncc(Br)cn2n1 2883244 ONENCKZISJXJPS-UHFFFAOYSA-N 375.182 2.531 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)N3Cc4cnc(C(C)(C)C)nc4C3)cn12 2356150038 JBDRYYIIKSWPIQ-KRWDZBQOSA-N 394.479 2.662 0 50 GFAA CCCCn1nc(CC(C)C)c2c(N3CCC[C@](O)(CN(C)C)C3)ncnc21 2356152887 FZTXSNQYKZVMSK-NRFANRHFSA-N 388.560 2.718 0 50 GFAA COc1ccc(Cl)cc1S(=O)(=O)N1CCN(c2ccc(F)cc2)CC1 2980895 HQTSFMFVFZBTAB-UHFFFAOYSA-N 384.860 2.999 0 50 GFAA O=C(c1nc(=O)c2ccccc2[nH]1)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccccc2)C1 2356168817 OTLZFSISMMSAAT-TUVUNVSASA-N 389.455 2.683 0 50 GFAA CN(Cc1cn(CCC(N)=O)c2ccccc12)C[C@H]1CC(=O)N(C(C)(C)C)C1 55369513 HQVDYKMRPVPMFY-MRXNPFEDSA-N 384.524 2.596 0 50 GFAA O=C(NCC[C@H]1COc2ccccc2O1)c1ccc(N2CCSCC2)nc1 67473092 FGZWOMHIUUOCFM-INIZCTEOSA-N 385.489 2.595 0 50 GFAA C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)CCNC(=O)[C@H]3C[C@@H]3C)cc2)C1 229757587 YOKOGEWFEQKVJU-NYUBLWNDSA-N 385.552 2.943 0 50 GFAA CC(=O)c1cc(C(=O)N[C@@H](C)Cn2ccc(-c3ccc(C#N)c(Cl)c3)n2)n[nH]1 117197765 GMBPVBVTPBWIKC-NSHDSACASA-N 396.838 2.819 0 50 GFAA Cc1noc([C@@H]2CCCN(c3nccc(N[C@@H]4CCCO[C@@H]4C(C)C)n3)C2)n1 328635071 NDIOLGRBYICMAC-JFIYKMOQSA-N 386.500 3.168 0 50 GFAA Cc1nc2ncccn2c1C(=O)N1CCC[C@](CO)(CCc2ccccc2)C1 67772580 KHBOCNGSFUQMGE-QFIPXVFZSA-N 378.476 2.885 0 50 GFAA O=C(N[C@@H]1CCCc2c1cnn2-c1ccccn1)c1scc2c1OCCO2 11937748 WMJMFLAUWQRSKB-CYBMUJFWSA-N 382.445 2.907 0 50 GFAA Cn1c(=O)cc(C(=O)N2CCO[C@@H](Cc3cccc(F)c3)C2)c2ccccc21 71763507 ZOEVIQPZQKCPIV-KRWDZBQOSA-N 380.419 2.761 0 50 GFAA Cc1c(CC(=O)NCc2ccc(-n3ccnc3)c(F)c2)nnn1-c1ccccc1 144394378 DZNJMICDSWQLIJ-UHFFFAOYSA-N 390.422 2.759 0 50 GFAA COc1cc(CN2CCC(N3CCC[C@H](C(=O)NC4CC4)C3)CC2)ccc1F 71479675 MBTBRPCXXGJZBN-KRWDZBQOSA-N 389.515 2.789 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N1CC[C@H]2[C@H](CCCN2C)C1 152583827 UJCDIQWYDBVBOD-AEFFLSMTSA-N 388.512 2.735 0 50 GFAA NC(=O)c1ccc(S(=O)(=O)Nc2cc(Cc3ccccc3)ccc2O)cc1 481967963 LIFLEBYAUNRPNM-UHFFFAOYSA-N 382.441 2.883 0 50 GFAA CCN1CC2(CCN(Cc3ccc(OCCn4ccnc4)cc3)CC2)CC1=O 72428022 QRXAUCODZLKNDQ-UHFFFAOYSA-N 382.508 2.797 0 50 GFAA O=C(c1cn(-c2cccc(C(F)(F)F)c2)nn1)N1CCC[C@H]2CNCCC[C@@H]21 366454526 STFLGQFSNQUTJQ-GUYCJALGSA-N 393.413 2.890 0 50 GFAA O=c1[nH]c2ccccc2cc1-c1nccn1CCc1nc(-c2ccncc2)n[nH]1 71762771 CNDPQMQYHXXUCS-UHFFFAOYSA-N 383.415 2.814 0 50 GFAA CCOc1ccc(CNC(=O)N2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)cc1F 378365769 XGJPVJMJNOIAEN-AEFFLSMTSA-N 390.459 2.756 0 50 GFAA COc1cccc(N2CCN(Cc3cc(F)ccc3-n3cccn3)CC2=O)c1 82096426 CNIBEXPKLSTKMZ-UHFFFAOYSA-N 380.423 2.869 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@]12CCN(Cc1cc(O)nc(O)n1)C2 426526840 HDZJZBYPQQSPMJ-OAQYLSRUSA-N 388.512 2.673 0 50 GFAA CCCN1CCc2[nH]cnc2C12CCN(C(=O)CSc1ccncc1)CC2 96136702 PQLGAOFOXCUVEP-UHFFFAOYSA-N 385.537 2.683 0 50 GFAA CN(C)c1ncc(CN2CCN(Cc3ccc(F)c(F)c3)[C@H](CCO)C2)s1 97474888 YMNWZSAGLHJSIE-OAHLLOKOSA-N 396.507 2.556 0 50 GFAA O=C(O)[C@H](c1ccc(NC(=O)N2CCOCC2)cc1)N1CCc2ccccc2C1 95382277 QMMUEXVNXCJHCV-FQEVSTJZSA-N 395.459 2.735 0 50 GFAA Cc1noc(C)c1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95358547 SVHYAFKWSWUWNK-ZLGUVYLKSA-N 395.459 2.723 0 50 GFAA O=C(NCc1ccnc(O[C@H]2CCOC2)c1)Nc1cnn(-c2ccccc2F)c1 163379329 YFJFWCUSVJAYTL-INIZCTEOSA-N 397.410 2.896 0 50 GFAA Cc1cc(N2CCC(NC[C@@H](O)c3ccccc3)CC2)nc(N2CCCC2)n1 95499195 YBADRDQCCANRAP-HXUWFJFHSA-N 381.524 2.677 0 50 GFAA CCn1c(SCc2ccc(C(=O)OC)c(Cl)c2)nnc1N1CCOCC1 295873682 ZFMUOTTZUDQMNI-UHFFFAOYSA-N 396.900 2.867 0 50 GFAA CCNC(=O)N1CCC(n2cc([C@@H](C)Cc3ccc4c(c3)OCO4)nn2)CC1 91691169 KCTILQZFODTRCS-AWEZNQCLSA-N 385.468 2.719 0 50 GFAA CS(=O)(=O)c1cccc(C(=O)NCCCc2nc3ccc(Cl)cc3[nH]2)c1 825573774 OIJZURLKHSELDL-UHFFFAOYSA-N 391.880 2.982 0 50 GFAA CC1=C(c2ccccc2)[C@H]1C(=O)NCC1CCN(C(=O)c2cncc(O)c2)CC1 827688892 DTSXXFPTNYLNAW-NRFANRHFSA-N 391.471 2.859 0 50 GFAA Cc1nc2ccc(C(=O)NC[C@@H](c3ccccn3)N3CCOCC3)cc2s1 670455794 BDHHDDLHUNDYPY-SFHVURJKSA-N 382.489 2.803 0 50 GFAA O=C(NC1CCN(CC2CCCC2)CC1)N[C@@H](CO)Cc1ccc(F)cc1 271102477 LMWXLLFSXGTEAH-HXUWFJFHSA-N 377.504 2.683 0 50 GFAA Cc1nc(C(=O)N(C)C)nc(N2CC[C@@H](N[C@@H](C)c3ccccc3F)C2)c1C 1875397055 JECHITHBVYDKQU-JKSUJKDBSA-N 385.487 2.864 0 50 GFAA Cc1nc(C(N)=O)nc(N2CC[C@@H](N[C@@H](C)c3ccc4cccnc4c3)C2)c1C 1875397792 NXVMYIMEVPWKAF-MAUKXSAKSA-N 390.491 2.670 0 50 GFAA Cc1cc2c(S(=O)(=O)NC(=O)c3c4ccccc4nn3C)cccc2cn1 1875328037 VPVSOFSYZKJZEK-UHFFFAOYSA-N 380.429 2.549 0 50 GFAA OC[C@@H]1CN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C[C@H]1C1CCOCC1 1875307649 HRZYJTWMWBJBOX-WDSOQIARSA-N 387.442 2.576 0 50 GFAA CCc1ccc([C@H](NC(=O)C[C@H](NC(C)=O)C(=O)O)c2cccc(F)c2)cc1 1875306035 QIWMXKJZNHUYFC-ICSRJNTNSA-N 386.423 2.573 0 50 GFAA COc1ccccc1[C@@H](CNC(=O)c1cnn2ccn(C)c12)N1CCCCC1 1875313959 AIDLAPNINGZUCX-GOSISDBHSA-N 381.480 2.638 0 50 GFAA Cc1nccn1-c1ccc(CNC(=O)c2n[nH]c3c2C[C@@H](C)O[C@H]3C)cc1F 1875394545 MLWNNOIBBRYLCI-NEPJUHHUSA-N 383.427 2.995 0 50 GFAA O=C(Nc1ccc(Oc2nn[nH]n2)cc1)[C@H]1CCCCN1C(=O)c1ccccc1 952871719 CFOJMFOXQDWPRI-QGZVFWFLSA-N 392.419 2.625 0 50 GFAA Cn1ccnc1C(=O)N1CCC[C@@H](CNC(=O)c2cccc(C(F)(F)F)c2)C1 952964241 NGYJHXPFEFOVCA-ZDUSSCGKSA-N 394.397 2.721 0 50 GFAA Cc1sc(S(N)(=O)=O)cc1C(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 1346306460 NAPBGXRSNAWZKL-HNNXBMFYSA-N 394.518 2.525 0 50 GFAA Cc1cc(-c2cn3cc(C(=O)N[C@H]4C[C@@H]5CC[C@H]4C5)nc3c(=O)n2C)c(C)o1 1565529040 BWPHIGFFQZQVFZ-YCPHGPKFSA-N 380.448 2.828 0 50 GFAA CC(=O)N[C@H]1CN(C(=O)c2cc(-c3ccccc3)no2)C[C@@H]1c1ccc(C)o1 1565510531 SBKRPQXKLDRVCL-WMZOPIPTSA-N 379.416 2.987 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)CC1 186653460 HOWFKHRARQQKFK-LBPRGKRZSA-N 387.249 2.599 0 50 GFAA CCN1CCCN(C(=O)c2c(C)nn(Cc3ccc(C)cc3)c2Cl)CC1=O 170605443 ZYGGNVFMEUDEEI-UHFFFAOYSA-N 388.899 2.896 0 50 GFAA O=C(c1ccc(NCC(=O)N2CCCc3ccccc32)cc1F)N1CCOCC1 187354530 IFHYKNBARMVPBY-UHFFFAOYSA-N 397.450 2.689 0 50 GFAA COc1ccc(OC)c(CN2CCN([C@H]3CCc4ccccc4NC3=O)CC2)c1 191916354 NCVZJUOXYPGUSF-NRFANRHFSA-N 395.503 2.775 0 50 GFAA Cc1sc2nc([C@@H](C)N3CCN(C(=O)c4ccccn4)CC3)nc(N)c2c1C 192822814 YPZMYKAOSCLUEY-CYBMUJFWSA-N 396.520 2.804 0 50 GFAA CCc1c(C(=O)N[C@H]2CCCN(c3ncccn3)C2)cnn1Cc1ccccc1 193547702 UZXBNCYJBSHXHL-SFHVURJKSA-N 390.491 2.683 0 50 GFAA COc1cccc2c1CCC[C@H]2NC1CCN(S(=O)(=O)C(F)(F)F)CC1 194912418 VQJQAQNUOCXHLC-OAHLLOKOSA-N 392.443 2.976 0 50 GFAA C[C@](O)(CN1CCc2c(F)cc(F)cc2C1)c1ccc(S(C)(=O)=O)cc1 777605274 OFUSCTQTWBQVDX-IBGZPJMESA-N 381.444 2.634 0 50 GFAA CCC[C@H]1COC[C@H]2CN(Cc3cnc(-c4ccccc4OC)nc3)CCN12 1529112883 ULWAXFCWQHPIOI-RBUKOAKNSA-N 382.508 2.837 0 50 GFAA COc1cccc(CN2C[C@H]3CN(C(=O)Nc4ccccc4C)C[C@@]3(CO)C2)c1 1772816574 VTXKEJKZFYDPOF-WMZHIEFXSA-N 395.503 2.962 0 50 GFAA Cc1cc(F)ccc1NC(=O)CC[C@@H]1CCCN(C(=O)CN2CCCC2=O)C1 12076407 PMUWFEJSHXMCMX-INIZCTEOSA-N 389.471 2.714 0 50 GFAA C[C@@H](CCn1cccn1)NCc1c(C(=O)N2CCCCC2)nc2sccn12 12303029 XFXZWTPLKFOGPE-HNNXBMFYSA-N 386.525 2.787 0 50 GFAA Cc1c(CC(=O)NCCC(N)=O)c2c(n1C1CCCCC1)CC(C)(C)CC2=O 12578705 UENQMZDIXOJGOO-UHFFFAOYSA-N 387.524 2.991 0 50 GFAA CC(=O)NC[C@H]1CCCN(C(=O)c2cc(COc3c(C)cccc3C)on2)C1 12582998 WQMJECJDRMRXPE-QGZVFWFLSA-N 385.464 2.859 0 50 GFAA CCc1ocnc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 14974232 NREFGJDFYGFLGC-LBPRGKRZSA-N 381.354 2.787 0 50 GFAA CCOC(=O)CN(C)Cc1ccccc1OC[C@H](O)CN(C)C1CCCCC1 15069027 SRLBBHOHUQMVAQ-HXUWFJFHSA-N 392.540 2.686 0 50 GFAA COc1ccc(F)c(CN2CCN(C3CCN(C(C)C)CC3)[C@@H](CCO)C2)c1 19730743 CUHJTEVIGVYYIS-FQEVSTJZSA-N 393.547 2.576 0 50 GFAA CCc1[nH]nc(C(=O)N2CCO[C@@H](CN3CCCC3)[C@@H]2c2ccccc2)c1C 1857718741 QWCKHOMSOWGZNO-FPOVZHCZSA-N 382.508 2.959 0 50 GFAA CC(C)[C@H](NC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12)c1ccc2c(c1)OCCO2 252477427 NOPWPXWAUHQABO-ADLFWFRXSA-N 390.505 2.725 0 50 GFAA Cn1cccc1CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 363285966 XPHXLKAWNDZEJF-AWEZNQCLSA-N 391.418 2.795 0 50 GFAA COCCN1CCN(C(=O)NCC2(c3ccc(F)cc3Cl)CC2)C[C@H]1C 499158028 PQNXSPGPKSXTOF-CQSZACIVSA-N 383.895 2.873 0 50 GFAA O=C1C[C@H](Nc2ccc(N3CCOCC3)cc2)C(=O)N1c1cccc(Cl)c1 864997 MVEZEOUOYHGOHS-SFHVURJKSA-N 385.851 2.921 0 50 GFAA Cc1nc(=O)n(C2CCN(C(=O)CO[C@@H]3C[C@H](C)CC[C@H]3C(C)C)CC2)[nH]1 2325783438 ZZKQDJFTCLLXJI-FHLIZLRMSA-N 378.517 2.521 0 50 GFAA O=C(NCc1n[nH]c2ccc(Cl)cc12)C(=O)Nc1ccc2c(c1)CNCCC2 2325783796 BVNOFSLEIWHIHI-UHFFFAOYSA-N 397.866 2.507 0 50 GFAA CC(C)(CN)CC1CN(c2ncc(Cn3cc(Br)cn3)s2)C1 2325812528 IDQQAZVILHHVQC-UHFFFAOYSA-N 384.347 2.962 0 50 GFAA Cc1nn(C)cc1C1=NO[C@H](C(=O)N[C@H](C)c2ccc(Br)cc2)C1 929351681 QXSOXHYNELCKJE-HWPZZCPQSA-N 391.269 2.861 0 50 GFAA COc1cc([C@H]2NC(=S)NC(C)=C2C(=O)Nc2ccccc2OC)ccc1O 1201458 LIMHVRQJQMKQBL-GOSISDBHSA-N 399.472 2.841 0 50 GFAA N=c1nc2c(c[nH]1)CC[C@@]21CCCN(c2cc(C(=O)O)c3ccccc3n2)C1 2356161159 JDLKOLHGYCUSGL-OAQYLSRUSA-N 375.432 2.620 0 50 GFAA CC(C)[C@@H](O)c1nnc2ccc(C(=O)NCCc3nc4ccccc4o3)cn12 2356165615 LGDSJJKTWWUIFA-GOSISDBHSA-N 379.420 2.532 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C(=O)N1CCCC[C@@H]1C 112927726 CAONSSPEGISJCD-LNLFQRSKSA-N 385.508 2.587 0 50 GFAA CCOc1ccc2nc(NC(=O)[C@@H]3CC(=O)N([C@@H](C)COC)C3)sc2c1 8245116 OWCJMHWYAIKMJO-NWDGAFQWSA-N 377.466 2.517 0 50 GFAA CN(CCc1ccccn1)[C@H]1CCCN(Cc2cccn2-c2ncccn2)C1 20914526 RHEXUNVELNDWKN-FQEVSTJZSA-N 376.508 2.801 0 50 GFAA Cc1cccc(-c2ccc(C(=O)NCc3ccon3)c(N3CCC(O)CC3)n2)c1 23153531 QDPHRJSLHKIKSP-UHFFFAOYSA-N 392.459 2.936 0 50 GFAA COc1cccc(C(=O)Nc2ccc(NC(=O)CN3CCOCC3)c(C)c2)c1 20725756 FGCBPKKPNJMSRB-UHFFFAOYSA-N 383.448 2.527 0 50 GFAA Cc1cc(CC(=O)N2C[C@H]3CCC[C@@]3(c3nc(Cc4ccccc4)no3)C2)n[nH]1 328602877 DACWXHWLHQZVDA-VGOFRKELSA-N 391.475 2.815 0 50 GFAA Cc1ccc(OC(F)F)c(CNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1 128696656 CWCJOTZOMQRGSG-LLVKDONJSA-N 380.313 2.623 0 50 GFAA C[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(N)=O)c1ncc(-c2ccccc2)o1 363152394 VPOULRRWIVREHP-WMLDXEAASA-N 378.432 2.798 0 50 GFAA COc1cc(F)c(NC(=O)N2CCN(c3cccs3)C(=O)C2)cc1OC 368427195 RHFCSXCWYFCWJW-UHFFFAOYSA-N 379.413 2.785 0 50 GFAA COc1ccccc1N1CC[C@H](CNC(=O)N(C)C[C@H]2CCCC[C@H]2O)C1 245973608 OIDNBQZLAYUGRP-ZHALLVOQSA-N 375.513 2.714 0 50 GFAA O=C(CCCN1CCCC1=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 222548423 MBKBWZCGPMWKGJ-QRFVXNFXSA-N 381.476 2.566 0 50 GFAA COc1ccccc1C(=O)NCC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 290667298 OIJTUGDLLFNYLR-INIZCTEOSA-N 398.463 2.829 0 50 GFAA Cc1noc(C)c1CN1CCc2c(C(=O)NCCc3ncc[nH]3)csc2C1 426404240 LXHQPXGSTINWCC-UHFFFAOYSA-N 385.493 2.607 0 50 GFAA Cc1c(CC(=O)N[C@H]2CCOC2)c2c(n1Cc1ccccc1F)CCCC2=O 95517894 ALXRUYIJKRRRFO-INIZCTEOSA-N 384.451 2.951 0 50 GFAA CN(C(=O)N1CCC2(CCC(=O)N(CCc3c[nH]cn3)C2)CC1)c1ccccc1 91305349 BXLXSOXIJOGWMQ-UHFFFAOYSA-N 395.507 2.913 0 50 GFAA Cc1nc(CCNC(=O)[C@H]2CC(=O)Nc3ccc(F)cc32)nc2c1CCCC2 91504563 KZPJNWFFLHAQJU-INIZCTEOSA-N 382.439 2.588 0 50 GFAA Cc1cc([C@H]2CCCCN2C(=O)Nc2cc(S(N)(=O)=O)ccc2C)no1 95513324 WKQBOJGIGUJELY-MRXNPFEDSA-N 378.454 2.698 0 50 GFAA CC(C)Cc1ccc(CN2CCC3(CCC(=O)N(CC(N)=O)C3)CC2)s1 91444507 GUXDYKRGEBUSMS-UHFFFAOYSA-N 377.554 2.637 0 50 GFAA Cc1ncccc1C(=O)N1CCC2(CCN(Cc3ccccn3)CC2)[C@@H](CO)C1 97717459 WMHSRMGEIYRAFH-LJQANCHMSA-N 394.519 2.522 0 50 GFAA CC[C@H](C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1)n1cccn1 91677133 XJHQUFZOOMMHKQ-LJQANCHMSA-N 395.507 2.661 0 50 GFAA c1ccc(OCc2nc([C@@H]3CCNC3)n(-c3ccc4c(c3)OCCO4)n2)cc1 96141769 RPQRSVFSPSAANA-OAHLLOKOSA-N 378.432 2.694 0 50 GFAA C[C@H]1CCC(=O)N1c1cccc(NC(=O)N2CCN(C3CCCC3)C(=O)C2)c1 96153557 YFLCUQKFDRNPOB-HNNXBMFYSA-N 384.480 2.821 0 50 GFAA CC[C@@H](C)Oc1cccc(CNC(=O)N2CCN(C(=O)c3ccc[nH]3)CC2)c1 534589007 MPPNDNZVYHVXCK-MRXNPFEDSA-N 384.480 2.860 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)CCc1nc(O)c2ccccc2n1 299754356 CQEABHXMZGKDIQ-LPHOPBHVSA-N 382.508 2.991 0 50 GFAA biogenic Cc1cccnc1CN1CCN(C(=O)c2cccc(-c3cnc(O)nc3)c2)CC1 299781110 LGPUABYKJYIIAS-UHFFFAOYSA-N 389.459 2.511 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCC[C@H](C(=O)c3nccn3C)C2)c1 823531364 BBTULXIXRVGXBZ-KRWDZBQOSA-N 396.491 2.823 0 50 GFAA C=CC(=O)Nc1ccc(C(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)cc1 1298876643 ZXMBXOHKMYZMEB-NHYWBVRUSA-N 390.486 2.910 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3cccc4c3ncn4C)CC2)cc1F 1875289131 UJYNSGFTAREESH-UHFFFAOYSA-N 382.439 2.679 0 50 GFAA CCN=c1[nH]cnc2cc(C(=O)N[C@H]3CCO[C@H](c4ccncc4)C3)ccc12 1875267897 HCSKIWBBLPSXFZ-LPHOPBHVSA-N 377.448 2.529 0 50 GFAA Cc1ccc([C@H](C)[C@H](O)C(=O)N[C@H](C(=O)N2CCCC2)c2ccccc2)cc1 1875254758 IGIYYKDXBKYOQX-YYWHXJBOSA-N 380.488 2.939 0 50 GFAA Cc1ncc(Cc2cccc(C(=O)N3CC(NC(=O)C(F)(F)F)C3)c2)s1 1875298382 YYZZPNUHOQDSKA-UHFFFAOYSA-N 383.395 2.545 0 50 GFAA Cc1cccc(OC[C@@H](O)CNC(=O)[C@H](Cc2ccc(O)cc2)C(F)(F)F)c1 1875318305 FGNYTIHTHABJME-WMZOPIPTSA-N 397.393 2.978 0 50 GFAA C[C@H](NC(=O)[C@@H](O)CN1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1875308681 RLLTZTZEFWETBJ-YWZLYKJASA-N 399.466 2.712 0 50 GFAA Cn1c(O)nnc1[C@@H]1[C@H](C2CC2)CCN1C(=O)NCC1(c2ccccn2)CCC1 1875400652 HYBKEJPRBDPFBS-RDJZCZTQSA-N 396.495 2.520 0 50 GFAA CCn1nc(CC(C)C)cc1C(=O)Nc1ccccc1N1C(=O)N[C@H](C)C1=O 952970684 CUJFRMCPZVYOME-CYBMUJFWSA-N 383.452 2.799 0 50 GFAA CC(C)c1noc([C@@H]2CCCN2S(=O)(=O)c2ccc3c(c2)CCC(=O)N3)n1 952979119 UXJZNKRIXFLKON-HNNXBMFYSA-N 390.465 2.604 0 50 GFAA Cc1ccc(CN2CCNC(=O)[C@H]2CC(=O)Nc2ccc3oc(C)cc3c2)o1 952973942 POBLNIWIMPDSKP-GOSISDBHSA-N 381.432 2.972 0 50 GFAA CCOC(=O)C1([C@H](C)NC(=O)[C@@H]2CC[C@H](C(=O)OC(C)(C)C)C2)CCOCC1 888337499 AERTWQVGDAHKDM-XHSDSOJGSA-N 397.512 2.609 0 50 GFAA CC(=O)N1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CCCCC2)[C@@H](O)C1 1565512823 VDTXTZZVXUVXIX-ROUUACIJSA-N 378.900 2.640 0 50 GFAA CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NCC1(C)CCN(C)CC1 272525588 IKYADQQADPFQRW-SFHVURJKSA-N 387.524 2.538 0 50 GFAA COc1ccc(OC)c2c1CN(C(=O)c1ccc(N3CCC(C)=N3)cc1)C[C@@H]2O 169949751 STJKYGCDSDQPMU-SFHVURJKSA-N 395.459 2.979 0 50 GFAA CC(C)N(C(=O)[C@@H](C)OC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1)C(C)C 170616586 ZTWAKOHPIMUCMT-AEFFLSMTSA-N 389.496 2.511 0 50 GFAA COc1cc([C@@H](C)Nc2cnn(C)c(=O)c2Br)cc(OC)c1OC 170626282 WZBGBHBARBDAAJ-SECBINFHSA-N 398.257 2.742 0 50 GFAA Cc1nsc(NC(=O)[C@@H]2CCN(c3cccc(Br)c3)C2=O)n1 170643521 RUHLTDBQZDOKCC-NSHDSACASA-N 381.255 2.601 0 50 GFAA Cc1noc(C)c1S(=O)(=O)NC(=O)[C@@H](OC1CCCC1)c1ccccc1 170620476 CDQCBQDLOFCMMF-INIZCTEOSA-N 378.450 2.797 0 50 GFAA C[C@@H]1CN(c2ccc(C(=O)Nc3cc([C@@H]4CCCOC4)nn3C)cn2)C[C@@H](C)O1 279356979 PBUORTUJIYWBMB-BFYDXBDKSA-N 399.495 2.575 0 50 GFAA Cc1ccc(NC(=O)Nc2cc(OC(F)F)n(C)n2)c(OCCN(C)C)c1 225681715 SXQONIOUDZHRRZ-UHFFFAOYSA-N 383.399 2.914 0 50 GFAA O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N1CCOC[C@]12CCOC2 194412766 GYLOVFLUVJAOEA-LJQANCHMSA-N 391.855 2.731 0 50 GFAA CCOc1cc(CN2C[C@@H](O)[C@H](Cc3cnccn3)C2)c(Cl)cc1OC 1529095890 YOZVPQWKKRWEJC-RHSMWYFYSA-N 377.872 2.573 0 50 GFAA O=C(N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12)c1cccc2c1OCCO2 1529147366 XXODSJPENXGCPG-OXQOHEQNSA-N 390.439 2.994 0 50 GFAA CC(C)Cc1cc(C(=O)N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)n(C)n1 1615965636 GAUBOBVJXAMAAZ-JTSKRJEESA-N 392.503 2.842 0 50 GFAA COc1ccccc1C(=O)N/C(=C/C=C/c1ccccc1)C(=O)N1CCOCC1 915851 XGYRSVHUTHEEIM-KEPXNORLSA-N 392.455 2.881 0 50 GFAA CCn1c(SCC(=O)Nc2ccc(F)c(F)c2)nnc1-c1cnccn1 5071945 OGLINIWVAJOCLU-UHFFFAOYSA-N 376.392 2.764 0 50 GFAA CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@@H](NC(=O)c2ccc(O)nn2)C1 11842705 XFJURLLPWVLZEJ-INIZCTEOSA-N 381.411 2.951 0 50 GFAA COCCC(=O)N1CCC(C(=O)Nc2cccc(-c3nnc(C)s3)c2)CC1 12206086 BWXPPUTWFSGEGO-UHFFFAOYSA-N 388.493 2.727 0 50 GFAA O=C(NCc1cnc2ccccn12)[C@@H]1CCC(=O)N(Cc2cccc(F)c2)C1 12301007 NYLPKSQSYYZDTO-MRXNPFEDSA-N 380.423 2.528 0 50 GFAA Cc1ccccc1-n1ncc2c1CC(C)(C)C[C@H]2NC(=O)CCn1cncn1 12577718 UVDZAMIMVXCNRM-QGZVFWFLSA-N 378.480 2.992 0 50 GFAA COc1ccccc1C(=O)NCc1nnc2c(-c3nc(C4CC4)no3)cccn12 169776096 APXLGDWPUZJQKU-UHFFFAOYSA-N 390.403 2.595 0 50 GFAA COc1cccc(S(=O)(=O)N2[C@H]3CC[C@@H]2[C@@](CO)(Cc2ccccc2)C3)c1 1857670822 DJWXVROCOSCXOF-WMQCIHAUSA-N 387.501 2.842 0 50 GFAA Cc1cc(C)n(Cc2cccc(C(=O)N[C@H]3COC[C@H]3Cc3ccncc3)c2)n1 1875249517 YOQWWHVPHNEGRP-YADHBBJMSA-N 390.487 2.931 0 50 GFAA CN1C(=O)CC[C@H](C(=O)N2CCC(Cc3ccccc3)CC2)[C@@H]1c1cnn(C)c1 115202146 RTYFSRMFCAAGJO-UNMCSNQZSA-N 394.519 2.811 0 50 GFAA CC[C@H]1CN(C(=O)c2cc(NC(C)=O)ccc2F)[C@H](CC)CN1CC(C)(C)O 230148492 RIBVUFGMGYEQJI-DLBZAZTESA-N 393.503 2.870 0 50 GFAA O=S(=O)(c1ccc(OC[C@@H]2CCOC2)c(F)c1)N1C[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 328868114 XGCZOEWCDMTCPX-MISMHTLLSA-N 395.496 2.908 0 50 GFAA CC1(C)CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC[S@]1=O 459348217 WRGOKDBAXQYYTH-RUZDIDTESA-N 379.404 2.788 0 50 GFAA COc1cc(C(=O)N2CCO[C@H](C(=O)O)C2)cc(Cl)c1OCCC(C)C 262987867 NYVMYPKJCIRGLX-HNNXBMFYSA-N 385.844 2.699 0 50 GFAA NC(=O)c1ccc(NC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)cn1 164361895 CFQDVWGJFZHXRE-UHFFFAOYSA-N 387.871 2.620 0 50 GFAA CC(C)CC(=O)N[C@H](C(=O)NCCc1ccccc1C(=O)O)c1ccccc1 923117991 AQKDDTLQKMECNX-FQEVSTJZSA-N 382.460 2.947 0 50 GFAA CN(C)c1ncc2c(n1)[C@]1(CCCN(C(=O)c3ccc4c(c3)CCCO4)C1)CC2 2356133949 OWFIUSQSYDUUCS-HSZRJFAPSA-N 392.503 2.988 0 50 GFAA Cc1cccnc1C[C@H](C)NC(=O)c1cc2c(s1)CCOC21CCNCC1 2356142804 IQTSSBKWIOQJOY-HNNXBMFYSA-N 385.533 2.964 0 50 GFAA CC(C)c1nc([C@H]2CCCN2C(=O)CCn2cnc3ccccc3c2=O)no1 173080938 ZSVCLZPRJHKTKO-MRXNPFEDSA-N 381.436 2.657 0 50 GFAA Cc1nc(N2CCN(C(=O)Nc3cc(F)cc(F)c3)CC2)cc(-n2cccn2)n1 67603650 LDUJYZWXWDZNBS-UHFFFAOYSA-N 399.405 2.603 0 50 GFAA C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N(C)C[C@@H]1CCCN1c1cccnn1 118742945 HIXFTTBDRPNGFS-KGLIPLIRSA-N 376.407 2.650 0 50 GFAA O=C(c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1)N1CCOCC1 55620094 XUJBEAHYMYNGEV-UHFFFAOYSA-N 380.853 2.613 0 50 GFAA CCOc1cc(-c2nnn(CC(=O)N[C@H](C)c3ccccc3)n2)ccc1OC 10337815 OVJIIKVNROAGRN-CQSZACIVSA-N 381.436 2.625 0 50 GFAA CNC(=O)c1ccc(OC)c(NC(=O)C2CCN(Cc3ccccc3)CC2)c1 65868633 GZHJQAVUZHODEE-UHFFFAOYSA-N 381.476 2.906 0 50 GFAA CCn1c([C@H]2OCC[C@H]2c2ccccc2)nn(Cc2nnc(C(C)C)o2)c1=O 328621450 AMKZLEUQDVQNSN-RDJZCZTQSA-N 383.452 2.865 0 50 GFAA CO[C@H]1C[C@H](c2nc(C3CC3)no2)N(S(=O)(=O)/C=C/c2ccccc2)C1 328631841 RKRKDDFFZZGPGW-DMGQIGSTSA-N 375.450 2.710 0 50 GFAA Cc1ccc(Nc2cc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)nc(C)n2)cc1 67622482 WAVGOWTWKXOQDX-SFHVURJKSA-N 381.480 2.665 0 50 GFAA C[C@H]1CCCc2nc(S(=O)(=O)N3C[C@H](n4cccn4)Cc4ccccc43)cn21 333172245 NZHBTWWHFBMRAF-DOTOQJQBSA-N 397.504 2.970 0 50 GFAA Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@H]1CCc2nnnn2CC1 333679691 FAINMTKTTYDOPH-OLZOCXBDSA-N 377.518 2.669 0 50 GFAA Cn1ncc(I)c1C(=O)NC12CC3CC(CC(C3)C1)C2 4628511 SONRGZROUVIXCF-UHFFFAOYSA-N 385.249 2.723 0 50 GFAA O=C(c1ccccc1F)N1CCC(N2CCC[C@@H](C(=O)N3CCCC3)C2)CC1 71748508 FUVUCOYOLDPXIF-QGZVFWFLSA-N 387.499 2.765 0 50 GFAA Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(CCC(N)=O)Cc1ccccc1 366349111 OHXIIMVKKPPZKG-MRXNPFEDSA-N 387.505 2.863 0 50 GFAA C[C@@H](C(=O)Nc1ccc2sc(C(=O)O)cc2c1)S(=O)(=O)C1CCOCC1 262045729 DRSMZSXENBLBDB-JTQLQIEISA-N 397.474 2.520 0 50 GFAA COC[C@H]1[C@H]2OCC[C@H]2[C@H]1NS(=O)(=O)c1cccc2cccc(Cl)c12 219141094 SVAUFKHWHKRLBM-DECQCQTCSA-N 381.881 2.821 0 50 GFAA C[C@@H](C(=O)N1CCNC[C@H]1c1cccc(Cl)c1)n1nnc(-c2ccccc2)n1 262101060 VBKZKBNQHAPKHS-KSSFIOAISA-N 396.882 2.728 0 50 GFAA CCCN(Cc1ccccc1F)C(=O)C[C@@H]1C(=O)NCCN1CC(C)(C)C 72156197 ALZSWBOBMCUPRH-GOSISDBHSA-N 377.504 2.801 0 50 GFAA CCN1CCN(c2ccc(C(=O)NCc3ccccc3CN(C)C)cc2)CC1 175027794 JWDKPSOHYDAXJZ-UHFFFAOYSA-N 380.536 2.820 0 50 GFAA CC(C)C[C@H](NC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1)C(=O)O 262674767 QSYZGOBOPSCKPM-JSGCOSHPSA-N 376.482 2.523 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)NC3(c4nc(C)no4)CCCCC3)CC2=O)cc1 77197365 WMPLIOPAOSDUHK-HNNXBMFYSA-N 398.463 2.715 0 50 GFAA Cc1cc(C)c2nc(C3CC3)cc(C(=O)NCC3(C(N)=O)CCOCC3)c2c1 175723673 HPAYGPCPIYGNIA-UHFFFAOYSA-N 381.476 2.741 0 50 GFAA CO[C@H]1[C@H](NC(=O)c2onc3c2CCCC3)c2ccccc2C12CCNCC2 426552140 WMVKOTMMESDLLL-QUCCMNQESA-N 381.476 2.674 0 50 GFAA CCc1n[nH]c(C(=O)NCc2cc3n(n2)CCCN(C2CCCCC2)C3)c1C 91756343 QGHSTSXAMBJEKE-UHFFFAOYSA-N 384.528 2.945 0 50 GFAA CCN(C[C@@H]1CCCN(CCc2cccc(F)c2)C1)C(=O)c1ccc(=O)n(C)c1 95498453 IEHUZKGKNWWGRW-LJQANCHMSA-N 399.510 2.941 0 50 GFAA Nc1ncc(-c2cc(C(=O)N3CCCN4CCC[C@@H]4C3)c3ccccc3n2)cn1 23429918 MUHPNZOENVVEPW-MRXNPFEDSA-N 388.475 2.584 0 50 GFAA Cc1cc(COc2ccccc2)oc1C(=O)N1Cc2nc[nH]c2C[C@H]1C(=O)O 95517937 LSDUWIXMTWBCDH-KRWDZBQOSA-N 381.388 2.542 0 50 GFAA CC[C@H](C)NC(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)c(Cl)c1 95512168 DZHJQBIRILZWLQ-LBPRGKRZSA-N 388.917 2.671 0 50 GFAA CN(Cc1nccs1)C(=O)c1ccc2c(c1)[nH]c(=O)n2[C@H]1CC[C@H](O)CC1 244673862 HWYIZFABXXATTN-HDJSIYSDSA-N 386.477 2.534 0 50 GFAA COc1ccc([C@H]2Cn3nnc(C(=O)Nc4ccccc4OC)c3CO2)cc1 263615857 FONDKAZCSGJEDU-GOSISDBHSA-N 380.404 2.819 0 50 GFAA CCc1cccc(NC(=O)CCC(=O)N2CCNC(=O)[C@H]2c2cccc(F)c2)c1 823531412 SZVLMWHPBXQTQN-OAQYLSRUSA-N 397.450 2.807 0 50 GFAA Cn1cnc2cc(C(=O)NCCCc3nc4ccc(Cl)cc4[nH]3)ccc2c1=O 670434627 KOLNLQBZBQBNEU-UHFFFAOYSA-N 395.850 2.826 0 50 GFAA Cc1cc2ncnc(NC[C@@H]3CC(=O)N(C(C)(C)C)[C@H]3c3cnn(C)c3)c2[nH]1 952845427 RHKQBAKMONUGLW-SCLBCKFNSA-N 381.484 2.800 0 50 GFAA Cc1ccc([C@H](C)[C@H](O)C(=O)N[C@@H](C(=O)N2CCCC2)c2ccccc2)cc1 1875254757 IGIYYKDXBKYOQX-WMQCIHAUSA-N 380.488 2.939 0 50 GFAA COC[C@@H](NC(=O)NCc1nc(-c2ccco2)n[nH]1)c1ccc(F)c(F)c1 1875256431 OUGYUGQSLHFSPF-CYBMUJFWSA-N 377.351 2.530 0 50 GFAA CC[C@@H](C)C(=O)Nc1cccc(C(=O)NCc2nnnn2-c2ccccc2)c1 952982648 QJHZCKSIHCCQDB-CQSZACIVSA-N 378.436 2.577 0 50 GFAA CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)NCc1ccccc1-n1ccnc1)C(=O)C2 57020940 PGJKKHGZNVNYRJ-JXFKEZNVSA-N 387.505 2.687 0 50 GFAA CCOC(=O)c1c(NC(=O)CN(C)[C@H](C)c2ccco2)sc(C(N)=O)c1C 411191208 JAMRBRLITRTITM-LLVKDONJSA-N 393.465 2.557 0 50 GFAA Cc1cnn([C@@H]2CCCN(C(=O)CCC(=O)N3CCC(c4ccccc4)=N3)C2)c1 109683380 TYNUSSPOISXUCO-LJQANCHMSA-N 393.491 2.772 0 50 GFAA CCCN1CCCN(C(=O)c2nn(-c3ccc(C)cc3)c3c2CCC3)CC1=O 188164206 ITOVQHBCNSOXQV-UHFFFAOYSA-N 380.492 2.754 0 50 GFAA CCn1c(CCNC2CCN(C(=O)c3ccncc3)CC2)nc2ccccc21 1506402040 HKONBMKOKIUYIV-UHFFFAOYSA-N 377.492 2.888 0 50 GFAA Cc1nc2ncccn2c1C(=O)N[C@H]1COC[C@@H]1Cc1ccnc2ccccc12 1615964793 YPCLKHSRUJULLX-LPHOPBHVSA-N 387.443 2.573 0 50 GFAA O=C(Nc1ccc(I)cc1)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 219628718 RVGHVGYEUBBIMP-WTTBSCSTSA-N 383.185 2.753 0 50 GFAA CCCCCc1nc(CCS(=O)(=O)c2ccccc2)n([C@@H]2CCOC2)n1 1772812019 FPDUBDJLIKDEGX-MRXNPFEDSA-N 377.510 2.989 0 50 GFAA Cc1ccc(CC(=O)N2C[C@H]3CN(Cc4ccoc4)C[C@@]3(CCC(=O)O)C2)cc1 1775984208 KAXWLLLBBVGYRN-OFNKIYASSA-N 396.487 2.956 0 50 GFAA Cc1nn(C)c(Cl)c1CN1CCCN(C(=O)c2cnc3ccccc3n2)CC1 1775984331 OVBOBEYOSCZOOR-UHFFFAOYSA-N 398.898 2.673 0 50 GFAA Cc1c(-c2ccccc2F)[nH]c2ccc(CNC(=O)CCn3cnnn3)cc12 11840095 VASYXOUWFGGFJL-UHFFFAOYSA-N 378.411 2.975 0 50 GFAA COC[C@@H]1CCCN(C(=O)c2cc(Cn3cnc4cc(C)c(C)cc43)[nH]n2)C1 12299738 GWIDHPLPBSKUKX-MRXNPFEDSA-N 381.480 2.923 0 50 GFAA CCN1C[C@H](CN(C)Cc2nc(-c3cccc(OC)c3OC)oc2C)CC1=O 12372761 CMYRNEHOVRQDGX-HNNXBMFYSA-N 387.480 2.967 0 50 GFAA CN(CC1CCN(CCc2ccc(F)cc2)CC1)C(=O)/C=C/c1cnn(C)c1 12430607 UECLFSHBAIZMTR-VMPITWQZSA-N 384.499 2.986 0 50 GFAA COc1cccc(CN2CCC[C@]3(CCN(C(=O)CCc4cnn(C)c4)C3)C2)c1 12591030 BSIFLRKZGYZVQE-QHCPKHFHSA-N 396.535 2.876 0 50 GFAA CCC(=O)NCCc1nc2cc(NC(=O)c3ccc(OC)cc3)ccc2n1C 13152956 HIDGYJNUODLCBQ-UHFFFAOYSA-N 380.448 2.903 0 50 GFAA CCNC(=O)c1cc(S(=O)(=O)NCCSc2ccccc2)ccc1OC 13681504 WKTAJFJPOIWEFG-UHFFFAOYSA-N 394.518 2.516 0 50 GFAA COc1cc(CNCCc2cccc(C)n2)ccc1OC[C@H](O)CN1CCCC1 15068096 CCMWEUZJBFTFHN-OAQYLSRUSA-N 399.535 2.566 0 50 GFAA O=C1CC2(CCN(C(=O)C(c3ccccc3)c3ccccc3)CC2)OCCN1 1857702410 AGSSPZRNALXHIF-UHFFFAOYSA-N 378.472 2.716 0 50 GFAA CCOC(=O)[C@H]1[C@@H](C)C=C[C@H]2CN(C3CCN(C(=O)c4ccncc4)CC3)C[C@H]12 1857719462 LROFHZJPDSWZON-GIUOSPMZSA-N 397.519 2.619 0 50 GFAA Cn1cc(CCn2ccnc2-c2cccc(OCCCN3CCOCC3)c2)cn1 1857720909 PWOQEKXQWQBAJZ-UHFFFAOYSA-N 395.507 2.627 0 50 GFAA CC1=C(C(N)=O)[C@@H](c2ccccc2OCc2ccc(C)cc2)N2NC=NC2=N1 4368722 TTYCIDMCOBWKEO-LJQANCHMSA-N 375.432 2.593 0 50 GFAA Cc1c(C(=O)N(CCC(=O)O)C[C@@H]2CCCO2)cnn1-c1ccccc1Cl 237730883 BWDCGLRUEMSMBO-AWEZNQCLSA-N 391.855 2.930 0 50 GFAA Cc1noc(C)c1CN1C(=O)[C@@H]2CC[C@H]1CN(Cc1cn3ccccc3n1)C2 251976233 DNOCTDWOHZZLKH-AEFFLSMTSA-N 379.464 2.562 0 50 GFAA COc1ccc(NC(=O)CN2CCC(N3CCCCC3=O)CC2)cc1Cl 153043452 HWOJUBAUUDYWOL-UHFFFAOYSA-N 379.888 2.764 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCC(c2ccccc2C(=O)OC(C)(C)C)CC1 861203069 UJRZERPQCUDHJO-UHFFFAOYSA-N 386.492 2.992 0 50 GFAA O=C(O)C[C@@H](NC(=O)[C@@H]1Cc2cc(Br)ccc2O1)c1nccs1 2325784594 XTPQMLGTBHMVNI-PWSUYJOCSA-N 397.250 2.541 0 50 GFAA O=C(c1ccncc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2Cc2ccncc2)C1 2325794604 JWHOOCRWEOCCNR-WOJBJXKFSA-N 378.476 2.563 0 50 GFAA COc1ccc(S(=O)(=O)N(CC(=O)N2CCCC2)c2ccc(C)cc2)cc1 912511 JLBWPEIKKJHQCU-UHFFFAOYSA-N 388.489 2.821 0 50 GFAA COc1ccc(CN2CCC[C@]23CCCN(C(C)C)C3=O)cc1Cn1cncn1 2356139480 YOHAEJRQTOXBES-JOCHJYFZSA-N 397.523 2.700 0 50 GFAA Cc1cnnc(-c2ccc(C(=O)N[C@H]3CCCN(c4ncccn4)C3)cc2)c1C 2356170096 UURIXNABKRWPRY-IBGZPJMESA-N 388.475 2.949 0 50 GFAA Cc1ccc(N(CC(=O)NCc2ccc(Cl)cc2)S(=O)(=O)N(C)C)cc1 8602050 IDSPFHRRAGRKKT-UHFFFAOYSA-N 395.912 2.578 0 50 GFAA aggregator COc1cccc(CN2CCC[C@](O)(CN3CCc4ccccc4C3)C2=O)c1 20536992 CENPXVJKQBLMNM-QHCPKHFHSA-N 380.488 2.607 0 50 GFAA Cc1ccc(-c2cncc(C(=O)N3CCOCC3)n2)c(-n2nc(C)cc2C)c1 67675285 BQKOZQPFIUCYFW-UHFFFAOYSA-N 377.448 2.727 0 50 GFAA CCOc1ccc(CN2CCN(C3CSCCSC3)C[C@@H]2CCO)cc1 23361049 LSMUWNANQPBERN-SFHVURJKSA-N 396.622 2.803 0 50 GFAA Cc1ccc(NC(=O)N2CCN(c3ccc(-n4cccn4)nn3)CC2)c(C)c1 67630111 JWMNSFASUYNLOI-UHFFFAOYSA-N 377.452 2.633 0 50 GFAA CCOC(=O)c1ccc(NC(=S)NC(=O)c2c(Cl)cnn2CC)cc1 649610 CCALJYYMCVUYQH-UHFFFAOYSA-N 380.857 2.860 0 50 GFAA CCn1cc(S(=O)(=O)Nc2cnn(COc3cccc(Cl)c3)c2)cn1 2804329 BWQOVMJJRRCPAL-UHFFFAOYSA-N 381.845 2.590 0 50 GFAA CC1=C(C(=O)OCCOC(C)C)[C@H](c2cc(F)cc(F)c2)n2ncnc2N1 4987011 GVXFRGOAEGOJBH-INIZCTEOSA-N 378.379 2.813 0 50 GFAA CCn1cc(NC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)O)c(C(=O)NCC(C)C)n1 5962263 AYLKFRZVXMXFIJ-GJZGRUSLSA-N 390.484 2.675 0 50 GFAA O=c1n(CCOc2ccc(F)cc2)nc(C2CCNCC2)n1Cc1ccccc1 71755055 GXAPQUHHQRBRGV-UHFFFAOYSA-N 396.466 2.778 0 50 GFAA Cc1cnc([C@@H](C)NC(=O)C2(S(=O)(=O)c3ccccc3)CCOCC2)s1 367450883 MXRJPCRDRDINQK-CQSZACIVSA-N 394.518 2.652 0 50 GFAA C[C@H](c1cn(-c2ccccc2)nn1)S(=O)(=O)Cc1nc(C2CCCC2)no1 154969235 YRBSCOUJEKVASK-CYBMUJFWSA-N 387.465 2.984 0 50 GFAA CC(C)C[C@H](NC(=O)c1cncc(-c2cnn(C)c2)c1)C(=O)Nc1nccs1 378365077 HNOBLZMMPZBOGR-INIZCTEOSA-N 398.492 2.722 0 50 GFAA Cc1ccccc1[C@H](NC(=O)N1CCC2(CC1)CNC(=O)C2)c1ccncc1 426443439 SVFGHKIJMLHJHS-HXUWFJFHSA-N 378.476 2.791 0 50 GFAA Cc1nncn1-c1cccc(NC(=O)c2ccc(N3CCOCC3)c(F)c2)c1 133570452 XLZGOSBEGARXSI-UHFFFAOYSA-N 381.411 2.804 0 50 GFAA Cc1ccc2cc(CN3CCC[C@@H](c4ccn(CC(=O)O)n4)C3)c(O)nc2c1 426478170 UUAXTFLEAYJZPU-MRXNPFEDSA-N 380.448 2.910 0 50 GFAA CN1[C@H]2CC[C@H]1CC(N1CCN(C(=O)c3cnc4ccc(F)cc4c3)CC1)C2 179569764 BGWVHPSWFIPASS-OALUTQOASA-N 382.483 2.757 0 50 GFAA CC(C)c1cc(C(=O)N2C[C@@H](c3cccc(O)c3)[C@@H]3[C@H]2C2CCN3CC2)n[nH]1 95374124 PRNUFWNWRBBBRK-IOMROCGXSA-N 380.492 2.941 0 50 GFAA CCN1CCC[C@@H]1Cn1c(=O)n(Cc2ccccn2)c2cc(C(=O)OC)ccc21 95528825 PAAXIHXJXANBPF-GOSISDBHSA-N 394.475 2.517 0 50 GFAA O=C(c1cccnc1)[C@@H]1CCCN(C(=O)c2cc(-c3ccc(O)cc3)n[nH]2)C1 91893669 JHUVBHAQOKWIEV-MRXNPFEDSA-N 376.416 2.912 0 50 GFAA CCOC(=O)N1CCN([C@@H]2CCCN(Cc3cccn3-c3ccccn3)C2)CC1 96879129 MSFKMTNSYCAMAN-LJQANCHMSA-N 397.523 2.611 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cnc(C)nc2-c2ccccc2)on1 96139007 AHFIOBKTNUDFBW-APWZRJJASA-N 378.432 2.736 0 50 GFAA CN1CCC(Cc2nc(CCc3cnccn3)n(Cc3ccccc3)n2)CC1 96148166 BKNWGJVRQVRYIG-UHFFFAOYSA-N 376.508 2.786 0 50 GFAA COc1ccc(CN(C)C(=O)[C@@H]2Cc3ccccc3C(=O)N2)c2cccnc12 97136910 MOUYRYVWFQIJDL-SFHVURJKSA-N 375.428 2.557 0 50 GFAA Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)NCc2cc(C(N)=O)no2)c1 269114846 YEPPATXGLFNOMG-UHFFFAOYSA-N 396.451 2.887 0 50 GFAA C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C(=O)NCc1ccccc1 299125158 HLUOMMWUMNOPGJ-RDJZCZTQSA-N 399.516 2.564 0 50 GFAA CCOC(=O)c1ccccc1NC(=O)CSc1nccnc1-n1cccn1 263618152 RMNDYAQHIDFSGN-UHFFFAOYSA-N 383.433 2.570 0 50 GFAA CN1CCC(Oc2ccc(NC(=O)Cn3cnc4ccccc4c3=O)cc2)CC1 823765113 VZKVFRYYXFJTKT-UHFFFAOYSA-N 392.459 2.508 0 50 GFAA O=C(NC[C@H]1CCCN(Cc2cccc3nonc23)C1)c1ccc2c(c1)CCO2 828169466 UXNGNJSFAUDWLZ-OAHLLOKOSA-N 392.459 2.800 0 50 GFAA O=C1N[C@H]2CCC[C@@H]1CN(C(=O)NCCSCc1cccc(Cl)c1)C2 584895439 YBMGMVCFUIGGAX-ZBFHGGJFSA-N 381.929 2.883 0 50 GFAA Cc1noc([C@]2(C(F)(F)F)CCN(Cc3ncc(CN(C)C)s3)C2)n1 952893813 WQXQBIZMUMYXOV-AWEZNQCLSA-N 375.420 2.602 0 50 GFAA Cn1cc(-c2ccnc(C3CCN(C(=O)[C@H]4CCCCCC[C@@H]4N)CC3)n2)cn1 952894600 OFFCIDNCZQQCND-OALUTQOASA-N 396.539 2.881 0 50 GFAA CC(C)c1nc([C@H]2COCCN2C(=O)c2ccc(-n3cccc3)cc2O)no1 1875283110 GKXHWPQLKWKDMP-MRXNPFEDSA-N 382.420 2.903 0 50 GFAA C[C@@H]1CN(C(=O)c2cnc3cc[nH]c3c2)CC[C@H]1NC(=O)c1coc(C2CC2)n1 1875333657 GLSBMFSATUDKBC-IUODEOHRSA-N 393.447 2.709 0 50 GFAA C=CC(=O)N1CCN(C(=O)c2ccc(NC(=O)c3cccs3)cc2)[C@@H](C)C1 1875381154 LTHLUOMIABCJDR-AWEZNQCLSA-N 383.473 2.859 0 50 GFAA COC(C)(C)CC(=O)N1CCC2(CC1)C[C@@H](O)c1nn(C3CCCC3)cc1O2 1875394373 HDXWLNWPUORFEK-MRXNPFEDSA-N 391.512 2.990 0 50 GFAA Cc1nc(C(=O)OC[C@H]2CCC3(CCC4(CC3)OCCO4)O2)c2ccnc-2[nH]1 1875311341 VNNRHKNPXUEPHT-CQSZACIVSA-N 387.436 2.610 0 50 GFAA O=C(O)c1cc(C2CCN(C[C@H](O)COCc3ccc(Cl)cc3)CC2)[nH]n1 1875309745 LMJBQLGZDYVABW-INIZCTEOSA-N 393.871 2.518 0 50 GFAA OCc1ccc(CN[C@@H]2C[C@@H](Cn3ccnc3-c3ccccc3)C[C@H]2O)cc1 1875398909 ISQIVRWTRGOPGD-CEMLEFRQSA-N 377.488 2.972 0 50 GFAA C[C@@H]1CCN(c2cc(C(=O)NC3CCSCC3)c(Cl)cn2)C[C@@H]1CO 1875360727 HXRKYGZKVNRSPS-CHWSQXEVSA-N 383.945 2.815 0 50 GFAA CC[C@@H](C)OCC(=O)N1CC2(CCN(C(=O)Cc3cccc4cccnc34)C2)C1 1875305911 MFHVAUNUQMYLLF-QGZVFWFLSA-N 395.503 2.653 0 50 GFAA O=C(Nc1cccc(-c2nnnn2C2CC2)c1)c1ccc2c(c1F)CNCC2 1875304638 QBSVCZMCAQXEMI-UHFFFAOYSA-N 378.411 2.712 0 50 GFAA CN(C)c1ccc(N[C@@H]2CCCN(C(=O)[C@H]3CCCc4n[nH]cc43)CC2)cn1 886055023 GSJWSCNZSLCCMN-WBVHZDCISA-N 382.512 2.784 0 50 GFAA CC1(c2cccc(Cl)c2)CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)CC1 280685210 WMVBXXKRLCWVAI-UHFFFAOYSA-N 398.956 2.892 0 50 GFAA O=C(NC1CCN(CC2CC2)CC1)c1n[nH]c2ccc(Br)cc12 171964820 BUYFUCAPXLEGCH-UHFFFAOYSA-N 377.286 2.930 0 50 GFAA Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1C 172865957 RXQSYRYCTYXBAC-IBGZPJMESA-N 391.464 2.816 0 50 GFAA C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)c1ccc2c(=O)n(C)cnc2c1 1506416544 FATDRNXVPUAVEM-CYBMUJFWSA-N 379.416 2.538 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)NCC(C)(C)N(C)C)ccc1F 1704309339 RGIGOHXLBFQPRX-UHFFFAOYSA-N 378.448 2.625 0 50 GFAA Cc1onc(-c2c(Cl)cccc2Cl)c1CN1C[C@H]2CNC[C@]2(CO)C1 1772704347 QRBYRLDRKHHQRD-KZULUSFZSA-N 382.291 2.971 0 50 GFAA CN(C)C[C@@]12CN(C(=O)C3CCC3)C[C@@H]1CN(c1ccc3ccccc3n1)C2 1772804350 NAYFIFPAGAMKHA-WMZHIEFXSA-N 378.520 2.861 0 50 GFAA C[C@H]1CS(=O)(=O)N(c2cccc(C(=O)Nc3ccc(Cl)cc3)c2)C1=O 12003883 CWXGKLGQFOZXEE-NSHDSACASA-N 378.837 2.905 0 50 GFAA Cc1c(C(=O)NC(C)C)sc2ncnc(NCCCN3CCCC3=O)c12 12053754 SETCNWGSKAQGRX-UHFFFAOYSA-N 375.498 2.562 0 50 GFAA CN(C[C@H](O)COc1ccccc1CNCCn1cccn1)C1CCCCC1 12303355 GGJQXMUREDHOME-NRFANRHFSA-N 386.540 2.677 0 50 GFAA Cc1ccc(C)c(N([C@H](C)C(=O)Nc2ccc3c(c2)OCO3)S(C)(=O)=O)c1 13679247 AAOIXASKWOEWCH-CQSZACIVSA-N 390.461 2.825 0 50 GFAA O=C(c1cccc(C(F)(F)F)c1)[C@H]1CCCN(C(=O)CN2CCOC2=O)C1 14949979 LRNLGFMTBYVIFQ-ZDUSSCGKSA-N 384.354 2.579 0 50 GFAA O=C(NC1(c2ccccc2)CC1)[C@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 14978312 JHLYKAQJAFCLFS-IBGZPJMESA-N 395.547 2.905 0 50 GFAA COc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccccn4)C3)C2=O)c1 15069931 IGKUFJZHOVYCLW-QFIPXVFZSA-N 379.460 2.745 0 50 GFAA COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)COc2ccccc2C)c1 16363022 SWBDXKJHYSDBCT-UHFFFAOYSA-N 397.475 2.551 0 50 GFAA COc1ccccc1NS(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1 16606065 MLHDYKIMCOUZBA-KRWDZBQOSA-N 376.434 2.614 0 50 GFAA COc1ccc(CNC(=O)c2cc3c(N4CCSCC4)nc(C)cn3n2)cc1 169768816 ZZVBPVSHHWCUTL-UHFFFAOYSA-N 397.504 2.530 0 50 GFAA CC[C@@]1(C(=O)NCCCn2cnnc2)C[C@@H]2CC[C@H]1N2Cc1cccc(OC)c1 1857668683 VHUODKFDWCLBIZ-CZTZKLFOSA-N 397.523 2.626 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CCc2[nH]nc(C3CC3)c2CC1 1857675520 BRKDQQUNIZBGGV-UHFFFAOYSA-N 392.463 2.682 0 50 GFAA CCOc1cc(Cl)c(CN2CC[C@@H](O)[C@@]3(CCCNC3=O)C2)cc1OCC 1857694757 WLJJPAHXHXFXCB-UYAOXDASSA-N 396.915 2.600 0 50 GFAA O=C(O)CN1CCC2(CC1)OCCc1cc(C(=O)N[C@@H]3C=CCCC3)sc12 1857703550 MRRMRXWJEXBCQU-OAHLLOKOSA-N 390.505 2.535 0 50 GFAA Cc1cn2cccc(C(=O)N3C[C@@H](O)[C@H](Cc4ccc5ccccc5n4)C3)c2n1 1857725379 TWFCRGNLILMEMK-DYESRHJHSA-N 386.455 2.867 0 50 GFAA CC1CCN(C2CCC(NC(=O)N3CCC[C@@H]3[C@@H]3COCC[C@H]3O)CC2)CC1 369174046 LHQPOGZRMONDKX-JRGKDQQJSA-N 393.572 2.601 0 50 GFAA Cn1ncc2nc(C(F)F)c(C(=O)N[C@H]3CCCC[C@@]34CCCNC4)cc21 2325779207 OENATDZUFKEHNR-KXBFYZLASA-N 377.439 2.948 0 50 GFAA Cc1cc2cc(NC(=O)c3ccc(C4(CN)CCC4)nc3)ccc2n(C)c1=O 2325795953 HOMARRGSRDWBON-UHFFFAOYSA-N 376.460 2.875 0 50 GFAA O=C(NN1C(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C1=O)c1cccnc1 840298 BLZFNNJHAMBXRO-JSRAGOMMSA-N 395.418 2.619 0 50 GFAA COc1ccccc1N1CCN([C@@H]2CC(=O)N(c3ccccc3Cl)C2=O)CC1 1113355 ODZYUIZRXKWSLL-GOSISDBHSA-N 399.878 2.803 0 50 GFAA COC(=O)COc1ccc2c(=O)c(Oc3ccc(C(=O)OC)cc3)coc2c1 1130556 IZVPOVYWCKUQMP-UHFFFAOYSA-N 384.340 2.924 0 50 GFAA biogenic COc1ccc(S(=O)(=O)N(C)CC(=O)NC2CCCCCCC2)cc1C 6700963 DKCCJIPPLZFEBG-UHFFFAOYSA-N 382.526 2.853 0 50 GFAA Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)o1 8209661 GFYZKSQFLTUVPC-UHFFFAOYSA-N 376.478 2.858 0 50 GFAA C[C@@H](CNC(=O)c1ccco1)Oc1cccc(CN(C)Cc2cnccn2)c1 12279670 AEPHCIGNVHIPIJ-INIZCTEOSA-N 380.448 2.899 0 50 GFAA CCOC(=O)N1CCN(C(=O)C[C@@H](c2cccc(O)c2)c2ccccc2O)CC1 12299020 UZZKEWDPEQAYOE-IBGZPJMESA-N 398.459 2.921 0 50 GFAA CC(=O)N[C@@H](CC(C)C)c1nnc2n1CCN(Cc1c(F)cccc1F)CC2 14882224 UTWGPXHZMLOGMG-SFHVURJKSA-N 391.466 2.838 0 50 GFAA COc1ccc(F)c(CN2CCC[C@]3(CCN(C(=O)c4cnccn4)C3)C2)c1 15062901 JJVWDEFIXLYKFB-NRFANRHFSA-N 384.455 2.753 0 50 GFAA CCNC(=O)N1CCc2c(cnc(C)c2-c2noc(-c3scnc3C)n2)C1 19745598 AYTAHVKNSUHTMQ-UHFFFAOYSA-N 384.465 2.960 0 50 GFAA O=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCO[C@@H](c2ccccc2)C1 40266876 ABAXMNQHHLMLFM-HXUWFJFHSA-N 375.428 2.510 0 50 GFAA CCc1nccn1CCCNC(=O)CCc1nc(-c2ccccc2OC)no1 55401572 BNKIPJHZLSDJJF-UHFFFAOYSA-N 383.452 2.643 0 50 GFAA CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)NCc1ccccc1-n1ccnc1)C(=O)C2 57020941 PGJKKHGZNVNYRJ-OXQOHEQNSA-N 387.505 2.687 0 50 GFAA COC(=O)[C@@H]1C[C@@H](NC(=O)c2cccc(OC)c2)CN1Cc1ccc(C)cc1C 64066863 BKWSPQLQSJURQW-CTNGQTDRSA-N 396.487 2.858 0 50 GFAA CNCCN(C)C(=O)CC[C@@]1(Cc2ccccc2)C(=O)N(C)c2ccccc21 71738498 IPBBADHUHUHOLU-QHCPKHFHSA-N 379.504 2.602 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@H](C(=O)c3cccc(OC(C)C)c3)C2)n[nH]1 72129748 SUDIJYXUEXSVMJ-KRWDZBQOSA-N 384.480 2.954 0 50 GFAA Cc1ncc2c(c1CNC(=O)c1cccc(CC3CCNCC3)c1)CCNC2 72170114 YIZRGICFILRZES-UHFFFAOYSA-N 378.520 2.508 0 50 GFAA N[C@H]1C[C@@H](C(=O)O)N(Cc2nc3ccccc3n2Cc2ccccc2Cl)C1 77358887 STGHPWIIXDFTAJ-KSSFIOAISA-N 384.867 2.724 0 50 GFAA Cc1ccn(-c2cc(N3CCN(C(=O)Nc4cccc(F)c4C)CC3)ncn2)n1 91400324 DBSSKEQKNYPBND-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA CCOc1ncccc1C(=O)NCc1cc2n(n1)CCN(C1CCCCC1)C2 91547334 SUEXRNIWSIDVAU-UHFFFAOYSA-N 383.496 2.755 0 50 GFAA Cc1cnc(CN2CC3(CCC2=O)CCN(C(=O)Cc2ccsc2)CC3)cn1 91914981 JCROIFAFBANYPP-UHFFFAOYSA-N 398.532 2.820 0 50 GFAA CCCN1C[C@H]2CC[C@@H]1CN(Cc1ccccc1OCCN1CCOCC1)C2 95355866 LQQWPYGIQCVMFL-RBBKRZOGSA-N 387.568 2.704 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc(F)c(OC)c3)C[C@H]2NC(C)=O)cc1 95515370 BQOSXKQUMMFODD-PKOBYXMFSA-N 386.423 2.587 0 50 GFAA CC(C)NC(=O)[C@@H]1C[C@@H](NC(=O)Cc2ccc(-c3ccccc3)cc2)CN1C 96141370 JGUXYHRCXDVTGY-RTWAWAEBSA-N 379.504 2.610 0 50 GFAA CN(C)c1noc(C2CCN(C(=O)CCOc3cccc(Cl)c3)CC2)n1 170601767 XLLGVBQGWQUZCF-UHFFFAOYSA-N 378.860 2.964 0 50 GFAA COC(=O)c1ccc(NC(=O)NC[C@@H](O)c2ccc(F)cc2)c(N(C)C)c1 170612048 WHNHNOTZQYEZKQ-QGZVFWFLSA-N 375.400 2.533 0 50 GFAA Cc1ccc(C)c(S(=O)(=O)C2(C(=O)N3CCC[C@H]([C@@H](C)N)C3)CCCC2)c1 237331257 BFRVHFVTDLQKSN-MSOLQXFVSA-N 392.565 2.976 0 50 GFAA COc1ccc([C@@H](NC(=O)c2ccccc2OC(F)F)[C@H]2C[C@@H](O)C2)cn1 244795416 RGABOLUYBKSPBJ-IIYDPXPESA-N 378.375 2.934 0 50 GFAA CC(C)NC(=O)Cn1c(=O)c(C(F)(F)F)nc2ccc(C(F)(F)F)cc21 253417815 DEVDQFGKVOCOBD-UHFFFAOYSA-N 381.276 2.959 0 50 GFAA Cc1oc(CN(C)C(=O)c2cc(N3CCNC3=O)ccc2Cl)cc1C(=O)O 268932741 KINNZYVYUPWYBP-UHFFFAOYSA-N 391.811 2.741 0 50 GFAA CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCN(C(=O)CCn1cccn1)CC2 275768463 SCALNSDEDNTRQH-GOSISDBHSA-N 386.521 2.765 0 50 GFAA CC(=O)CCc1ccc(O[C@H](C)C(=O)Nc2cccc3c2OCC(=O)N3)cc1 290717647 XHETZXTZRCEPDW-CQSZACIVSA-N 382.416 2.945 0 50 GFAA O=C(Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)N1CC2(CCOC2)C1 296277426 DMUNEMRSTLNYQR-UHFFFAOYSA-N 390.436 2.913 0 50 GFAA CC(C)[C@H]1OCCC[C@H]1Nc1cc(NC2CCN(c3ncccn3)CC2)ncn1 328638589 PFFHHLWWUPKVHS-YLJYHZDGSA-N 397.527 2.963 0 50 GFAA Cc1cc(C(=O)N2CCC(n3ncc4c3CNC4)CC2)c2c(C(C)C)noc2n1 333640560 XEXWGNYTDRPLET-UHFFFAOYSA-N 394.479 2.932 0 50 GFAA Cc1cnc(OC(C)C)c(NC(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)c1 333703999 RXEDCVFQSGYDAB-SFHVURJKSA-N 381.498 2.610 0 50 GFAA COc1ccc(C(=O)N2CCCCC[C@@H]2c2noc(C)n2)cc1N1CCNC1=O 378612967 ZERLYMFNWOEQNM-OAHLLOKOSA-N 399.451 2.674 0 50 GFAA Cc1cc(C)c(Cn2cncn2)cc1CN1CCC[C@@H](c2ccn(CCO)n2)C1 426421096 IHUNQIOJDCSPIC-LJQANCHMSA-N 394.523 2.512 0 50 GFAA Cc1nc(C2CCN(C(=O)NC3CCN(c4ccc(F)cc4)CC3)CC2)n[nH]1 426505713 HTEPBADEDXRFJP-UHFFFAOYSA-N 386.475 2.810 0 50 GFAA Cc1ccc(NC(=O)CN2CC(=O)NC2=O)cc1OCc1cccc(Cl)c1 428157940 PORNESRXCDMFOI-UHFFFAOYSA-N 387.823 2.718 0 50 GFAA CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2c(c1)nc(C(F)(F)F)n2[C@@H](C)CO 452801936 VNJLOGDIQBCCPT-ZUZCIYMTSA-N 398.385 2.558 0 50 GFAA CO[C@@]12CC[C@@H](NC(=O)c3ccon3)C[C@@H]1N(Cc1cc(F)ccc1F)CC2 534582874 WXWYPVBSHHDOAD-MOXGXCLJSA-N 391.418 2.895 0 50 GFAA CCN(Cc1noc(C2CCC2)n1)C(=O)NC1CCN(C(=O)C(C)C)CC1 534646747 HSIUAXSNJWCRIG-UHFFFAOYSA-N 377.489 2.516 0 50 GFAA CN(Cc1cc(-c2ccccc2)on1)C(=O)NCc1noc([C@H]2CCCO2)n1 534674556 SEUMTSUQMLIEQR-OAHLLOKOSA-N 383.408 2.918 0 50 GFAA Cc1noc(-c2ccc(S(=O)(=O)N[C@@H](C)c3nncn3C(C)C)o2)c1C 670449196 JBZVBTOCTDGXAU-LBPRGKRZSA-N 379.442 2.763 0 50 GFAA CC(C)C(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(OC(F)(F)F)c2)C1 827927051 SPFZGQOPTSQDMV-GFCCVEGCSA-N 394.415 2.511 0 50 GFAA O=C(N[C@@H](CCn1cncn1)c1ccccc1)c1ccccc1N1CCOCC1 828182313 NJAMIQUMMFUGPP-FQEVSTJZSA-N 391.475 2.676 0 50 GFAA CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)N1CCc2cnc(N)nc2C1 857968845 MOXHXYQOZFHFQM-UHFFFAOYSA-N 397.479 2.923 0 50 GFAA Cc1nn(Cc2coc(C3CC3)n2)c(C)c1S(=O)(=O)N(C)Cc1ccco1 871723840 YORLKVFDHIAYKW-UHFFFAOYSA-N 390.465 2.827 0 50 GFAA O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@H]3C2)C1 886091323 POZZXGOCULESEG-YUELXQCFSA-N 394.878 2.828 0 50 GFAA Cc1ccc(Cl)c(C(=O)N[C@H]2CCN(Cc3c(C)noc3C)C[C@@H]2O)c1 1565509281 DZCMFQMDNGJAFM-ROUUACIJSA-N 377.872 2.618 0 50 GFAA CSCCN(C)C(=O)c1cccc(S(=O)(=O)N[C@H]2C[C@@H]3CC[C@H]2C3)c1 1565529175 BZWYZVIJVNJEIL-KEYYUXOJSA-N 382.551 2.589 0 50 GFAA O=S(=O)(c1cccc(OC(F)(F)F)c1)N1CCC[C@]2(CCC[C@H]2O)C1 1704297480 ANJKYVTVXWKQKR-HUUCEWRRSA-N 379.400 2.901 0 50 GFAA CN(C)C[C@@]12CN(C(=O)C3CCC3)C[C@H]1CN(c1ccc3ccccc3n1)C2 1772804348 NAYFIFPAGAMKHA-AUSIDOKSSA-N 378.520 2.861 0 50 GFAA O=C(CCC(F)(F)F)N[C@@H]1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 1857679726 RPWOBFMXAKCICN-CHWSQXEVSA-N 378.416 2.735 0 50 GFAA CNC(=O)CCCn1cc(-n2ccnc2-c2cc3cc(C)ccc3nc2O)cn1 1857688019 PGLXDFBVJYBTAG-UHFFFAOYSA-N 390.447 2.824 0 50 GFAA Cc1cc(CC(=O)N[C@@H]2CC[C@H](NC(=O)c3sc(C(C)C)nc3C)C2)on1 1857693520 ALMUUOSGCYHKFG-KGLIPLIRSA-N 390.509 2.881 0 50 GFAA Oc1nc(-c2cccnc2)nc2c1CC[C@]21CCCN(c2ncnc3[nH]ccc23)C1 1857697732 KHEOZOYLVMQGEJ-QFIPXVFZSA-N 399.458 3.000 0 50 GFAA Oc1nc(C2CC2)nc2c1CCC21CCN(c2cc(-n3cccn3)ncn2)CC1 1857716351 HZZSONNHZBLTNL-UHFFFAOYSA-N 389.463 2.520 0 50 GFAA CC(C)Oc1ccc(C(=O)N2CCC3(CCc4c(O)nc(=N)[nH]c43)CC2)cc1 1857719468 LZNDJERZWIKSNL-UHFFFAOYSA-N 382.464 2.502 0 50 GFAA Cc1ncnc(N2C[C@@H]3[C@H](CNC(=O)c4cccs4)[C@H]4CC[C@]3(C2)O4)c1C 1857722926 PUMCVDQKDPQPOT-QCBUCWTNSA-N 384.505 2.569 0 50 GFAA CCS(=O)(=O)N[C@H]1CCCN(C(=O)C2CCC(c3ccccc3)CC2)C1 1875260780 UYJLINDXBQCMMR-ACBHZAAOSA-N 378.538 2.891 0 50 GFAA O=C(CN[C@@H](CO)[C@@H]1CCc2ccccc21)NCCc1nc2ccccc2s1 1875281511 FEPMONJFHAHUQH-MJGOQNOKSA-N 395.528 2.636 0 50 GFAA Cc1cc(NC(=O)[C@H](N)Cc2cccc(Cl)c2F)ccc1C(=O)N(C)C 1875312988 FIAJQVPMYGOCTM-MRXNPFEDSA-N 377.847 2.998 0 50 GFAA CC(C)Cn1ccc2cc(NC(=O)C(=O)NC[C@]3(CO)C[C@H]4C=C[C@H]3C4)ccc21 1875316668 FZBFHLYIWIPQHC-CEXJFXJFSA-N 395.503 2.927 0 50 GFAA COc1ccc(-c2nc(NC(=O)Cc3cnc4c(C)cccn34)n[nH]2)c(OC)c1 1875332302 VUQWCKVZGRMIJX-UHFFFAOYSA-N 392.419 2.626 0 50 GFAA COc1ccc(C(=O)OCc2ccn(-c3ccc(C)cc3)n2)cc1-n1cnnn1 1875340463 CCALZRCTQQZWAS-UHFFFAOYSA-N 390.403 2.522 0 50 GFAA C[C@@H]1O[C@H](C)Cc2c(C(=O)N3CCC(O)(c4ccc(F)c(F)c4)CC3)n[nH]c21 1875404838 XSIVHLJJJVAQBU-NEPJUHHUSA-N 391.418 2.834 0 50 GFAA O=C(N[C@@H]1C[C@@H](Cn2cccn2)C[C@H]1O)c1ccc(Oc2cccnc2)cc1 2325785906 TWCQFUYQASQGMX-CDHQVMDDSA-N 378.432 2.640 0 50 GFAA CCOC(=O)N1CCN(C(=O)c2cccc(-c3cncc4nc[nH]c34)c2)CC1 2356149552 ICSUBWBDYFSZEA-UHFFFAOYSA-N 379.420 2.539 0 50 GFAA CCCN1CCC[C@]2(CCCN2C(=O)c2c(C)nn3c(C)cc(C)nc23)C1=O 2356164317 OGWLOZURSHHUQX-NRFANRHFSA-N 383.496 2.662 0 50 GFAA COc1ccc(Cl)cc1N(CC(=O)NC(C(C)C)C(C)C)S(C)(=O)=O 2072808 HDMLAKZYCKSKEH-UHFFFAOYSA-N 390.933 2.911 0 50 GFAA CN1CCC(Oc2ccccc2Nc2nccc(N3CCC[C@@H](O)C3)n2)CC1 2356143501 KIWFXUMOTPDKCH-MRXNPFEDSA-N 383.496 2.654 0 50 GFAA CC(C)[C@H](O)c1nnc2ccc(C(=O)NCc3cccc4ncsc34)cn12 2356144355 TWSROQPVIMCCKF-INIZCTEOSA-N 381.461 2.958 0 50 GFAA CCN(CC)C(=O)C(=O)c1cn(CC(=O)NCc2ccco2)c2ccccc12 2878165 MWGOLNPHNHBTBS-UHFFFAOYSA-N 381.432 2.602 0 50 GFAA CNC(=O)/C(=C\c1ccc(OC)cc1)NC(=O)c1ccc(Br)cc1 4756102 CWYWBOGTACCKTG-LFIBNONCSA-N 389.249 2.975 0 50 GFAA CCCCOc1ccccc1[C@H]1NC(=S)NC(C)=C1C(=O)OCCOC 6592714 OFKVNDMJFAHFDV-QGZVFWFLSA-N 378.494 2.848 0 50 GFAA Cn1c(=O)c(Oc2ccc(F)cc2F)cc2cnc(NC3CCOCC3)nc21 58633224 KKKRKRMVJRHDMG-UHFFFAOYSA-N 388.374 2.990 0 50 GFAA in-man CC[C@H](Nc1ccc(Cl)cc1)C(=O)N1CCC2(CC1)CN(C)CCN2C 67726697 GCLUXEZYPBIEFD-SFHVURJKSA-N 378.948 2.769 0 50 GFAA CN(c1ccccc1F)S(=O)(=O)c1cccc(C(=O)NC[C@@H]2CCCO2)c1 67339077 AQUVBAYXLCWHFH-HNNXBMFYSA-N 392.452 2.560 0 50 GFAA Cc1nsc(N2CCCN(C(=O)[C@H]3CCCN3Cc3ccccc3)CC2)n1 173350885 GEUJGXBKPMWAOW-GOSISDBHSA-N 385.537 2.550 0 50 GFAA O=C(Cc1ccc2c(c1)OCO2)N1CCC[C@@H]1c1nc(-c2ccccn2)no1 77406250 VPJZNZOVKNBPLP-OAHLLOKOSA-N 378.388 2.767 0 50 GFAA COc1ccc(CCNC(=O)N2CCC(c3nnc4ccccn34)CC2)cc1 124385160 JQHSSJUDHVHPIJ-UHFFFAOYSA-N 379.464 2.870 0 50 GFAA OC(CN1CCC([C@H]2CCCOC2)CC1)CN1CCC([C@H]2CCCOC2)CC1 373183585 RKKGQTDBZWKYCG-VXKWHMMOSA-N 394.600 2.625 0 50 GFAA O=C(NCc1nccs1)[C@H]1CCCN(C2CCN(Cc3ccncc3)CC2)C1 71758929 NHNBJGZCLUFTDV-SFHVURJKSA-N 399.564 2.531 0 50 GFAA CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4ccc(NS(C)(=O)=O)c(Cl)c4)[C@H]1[C@H]3C2 287339026 YSHQKCDJKQVYID-PXCQPTMHSA-N 399.900 2.599 0 50 GFAA Cc1ccc(S(N)(=O)=O)cc1NC(=O)CN(C1CC1)[C@@H]1CCc2ccccc21 161588590 YCCNWDMDADDBOK-HXUWFJFHSA-N 399.516 2.733 0 50 GFAA O=C(c1cccc(-c2ncc[nH]2)c1)N1CCN(CCOc2ccccc2)CC1 82161827 VOGRPTQFIBMZTO-UHFFFAOYSA-N 376.460 2.914 0 50 GFAA O=C([C@@H](Cc1ccccc1)N1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)N1CCCCC1 197186480 JDDRWAWQYISXHT-UHZRXMQZSA-N 380.488 2.641 0 50 GFAA C[C@H](N)[C@@H]1CCCN(C(=O)c2cccc(COc3ccccc3C(N)=O)c2)C1 237507424 LTYMWWLMUQOUNN-MAUKXSAKSA-N 381.476 2.564 0 50 GFAA CCOC(=O)N1CCN([C@H]2CCCN(Cc3cccn3-c3ccccn3)C2)CC1 96879130 MSFKMTNSYCAMAN-IBGZPJMESA-N 397.523 2.611 0 50 GFAA Cc1oc(C(C)C)cc1C(=O)N1C[C@H]2CC[C@@H]1CN(C(=O)c1cnccn1)C2 95375774 DFHURDOHOXTXFH-JKSUJKDBSA-N 382.464 2.878 0 50 GFAA CCc1nnc(CN(CC)C(=O)[C@H]2CCC(=O)N(Cc3ccccc3F)C2)o1 91526545 PWSJWIJPADBQGF-HNNXBMFYSA-N 388.443 2.558 0 50 GFAA O=C(O)CN1CCC(Oc2ccc(C(=O)NCCc3ccccc3)cc2)CC1 95505744 RBONZTQZVZQDSV-UHFFFAOYSA-N 382.460 2.587 0 50 GFAA CC(C)c1nnc(CN2CCC[C@@]3(CCC(=O)N(Cc4ccccn4)C3)C2)o1 92028839 VCWNCBGYKYVWGH-OAQYLSRUSA-N 383.496 2.993 0 50 GFAA O=C(CCn1cc(Cl)cn1)N1CC[C@@]2(CCCN(CC3CCC3)C2=O)C1 91459261 KMPUGQXVSCXIDG-IBGZPJMESA-N 378.904 2.568 0 50 GFAA CNC(=O)c1ccc(CS(=O)(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1 297021121 KOIJUNOZGAPRQQ-GOSISDBHSA-N 399.516 2.755 0 50 GFAA CCOc1ccccc1NC(=O)CCN1CCN(C2CCSCC2)CC1 244898846 ZCQLCCOACLMOGE-UHFFFAOYSA-N 377.554 2.927 0 50 GFAA C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@@H](CC(=O)O)c2cccs2)C1=O 299744023 NIRFWNHIUQTLBB-STQMWFEESA-N 388.445 2.584 0 50 GFAA CC(=O)N1CCC2(CC1)CC(=O)c1ccc(OC[C@@H]3C[N@]3CC3CC3)cc1O2 1875381616 BDXCQIMAJUUFTI-XDHUDOTRSA-N 384.476 2.506 0 50 GFAA CN(C)C(=O)OC1CN(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)C1 1875311402 XZHGPNUYPINFBU-UHFFFAOYSA-N 398.916 2.808 0 50 GFAA CC(C)n1cc(C[C@H]2NC(=O)N(CCCc3cccc(Cl)c3)C2=O)nn1 1875361003 NDMXAHXUPBSQJM-MRXNPFEDSA-N 375.860 2.608 0 50 GFAA Cc1nc(CN2CCC(C(=O)N3CCCC3(C)C)([S@@](C)=O)CC2)cs1 886088471 HIWQHYMCMLZSTJ-RUZDIDTESA-N 383.583 2.566 0 50 GFAA CCOc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2cccnc2)C3)cc1 1565529020 OVKIFDOABWSDKN-APWZRJJASA-N 379.460 2.857 0 50 GFAA Cc1cc(OC(F)F)c(C(=O)NCc2cccc(N3CCOCC3)n2)s1 274883488 ZUBDRMWNHIENBI-UHFFFAOYSA-N 383.420 2.820 0 50 GFAA C=CC(=O)NCc1ccc(C(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)cc1 277210609 YYLQCWODTFWAOV-IBGZPJMESA-N 383.492 2.542 0 50 GFAA CC(C)N(C(=O)[C@H](C)OC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1)C(C)C 170616585 ZTWAKOHPIMUCMT-FUHWJXTLSA-N 389.496 2.511 0 50 GFAA C[C@@H]1CN(C2CCN(C(=O)c3ccc4c(c3)nc(C(F)F)n4C)CC2)CCO1 407951703 GNWWEKGNISNUJB-CYBMUJFWSA-N 392.450 2.836 0 50 GFAA O=C(NCc1cccnc1-n1cccn1)[C@H]1CCCN(Cc2cccc(F)c2)C1 109348213 LCWNTVVQYLRIMN-IBGZPJMESA-N 393.466 2.935 0 50 GFAA Cc1ccc(-c2ncccc2NC(=O)NC[C@H]2CCCN2S(C)(=O)=O)s1 189467556 BVARRWQHUIDDIT-CYBMUJFWSA-N 394.522 2.664 0 50 GFAA COCCCN(Cc1cccc(OC)c1)C(=O)c1nc(N)nc2c1CCCC2 1506423454 FDHBZWVZRLIYEP-UHFFFAOYSA-N 384.480 2.625 0 50 GFAA CCc1cc(N2CCN([C@@H](C(=O)O)c3cc(Cl)ccc3OC)CC2)ncn1 1506415143 MGKDQFFQTJAVSU-GOSISDBHSA-N 390.871 2.649 0 50 GFAA CCc1cc(N2CCCN(Cc3ccccc3F)CC2)nc(N2CCOCC2)n1 1529167281 HWLDBHOYYMGTGC-UHFFFAOYSA-N 399.514 2.727 0 50 GFAA O=C1Nc2ccc(S(=O)(=O)N3CCC[C@@]4(CCC[C@H]4O)C3)c3cccc1c23 1704297965 YVQFXZIVDYHVQZ-XLIONFOSSA-N 386.473 2.721 0 50 GFAA Cc1ccc(CNC(=O)[C@H]2CCCN(C3CCN(C(=O)C4CC4)CC3)C2)cc1 11763635 GYPXAXBRVXIBDS-FQEVSTJZSA-N 383.536 2.724 0 50 GFAA CCOC(=O)c1[nH]c(C)c(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2)c1C 11821416 BZDWMBUIYSEKGA-KRWDZBQOSA-N 384.480 2.598 0 50 GFAA COC(=O)C1CCN(C(=O)c2cc(COc3ccc(F)c(F)c3)on2)CC1 12228939 JYDQPEZUZMIRLY-UHFFFAOYSA-N 380.347 2.557 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1cc(F)ccc1F)CC2 12281219 NSOMVXQEODWBMK-INIZCTEOSA-N 378.419 2.507 0 50 GFAA Cn1c(CCN2CCOCC2)nc2cc(NC(=O)c3ccc(F)cc3)ccc21 13811613 LLSDYQOMOVQPOZ-UHFFFAOYSA-N 382.439 2.839 0 50 GFAA CCCn1nc(C(=O)N2CCCCC2)c2c1CC[C@@H](N(C)Cc1ccon1)C2 14543488 LXVFOTCOYFDMDJ-QGZVFWFLSA-N 385.512 2.897 0 50 GFAA Cc1ccc(CCC(=O)NCCc2nnc(SC[C@H]3CCCO3)n2C)cc1 14985703 XRMXDFBVUOYJCP-QGZVFWFLSA-N 388.537 2.686 0 50 GFAA COc1ccc(S[C@@H]2C[C@@H](C(=O)NCc3nonc3C)N(C(C)C)C2)cc1 19841746 GVFIXICESVJSAS-AEFFLSMTSA-N 390.509 2.646 0 50 GFAA CCCCCc1nc(-c2nc3ccccn3c2C)n([C@@H]2CCS(=O)(=O)C2)n1 1857675859 GLAIAXVXEIXROX-OAHLLOKOSA-N 387.509 2.994 0 50 GFAA CCOCC(=O)N1C[C@H]2CN(CCC3=C(C)CCCC3(C)C)C[C@]2(CO)C1 1857690037 STCNRXQJVUFBSW-XMSQKQJNSA-N 378.557 2.692 0 50 GFAA COc1ccc(C(=O)NCCc2cnn(C)c2)cc1Oc1ccc(CN)cc1F 1857692712 QGZLUWCYVGRHOG-UHFFFAOYSA-N 398.438 2.791 0 50 GFAA COc1cccc(OCc2nc([C@@H]3CCn4ncnc4C3)n(C(C)(C)C)n2)c1 1857709437 XNONEONSPSHEIZ-CQSZACIVSA-N 382.468 2.942 0 50 GFAA CN(C)C[C@@H]1OCCN(C(=O)c2cccc(Cl)c2Cl)[C@H]1c1cnn(C)c1 1857722664 MQYLJMUHYLKXED-RDJZCZTQSA-N 397.306 2.871 0 50 GFAA Cc1nccc(-c2ccccc2)c1C(=O)N1CC[C@@]23OCCCN2C(=O)C[C@@H]13 1857729898 VOLYOSNUNYOMLK-GCJKJVERSA-N 377.444 2.620 0 50 GFAA O=C([C@H]1CC(=O)N(c2nc3ccccc3s2)C1)N1CCC(c2cc[nH]n2)CC1 1857736673 WBOAIXNYEVQJCW-AWEZNQCLSA-N 395.488 2.779 0 50 GFAA CS(=O)(=O)CC1(CNC(=O)N2C[C@@H]3CCCC[C@@]32c2ccccc2)CC1 361029128 JFEHDUKGIQGAQE-FXAWDEMLSA-N 376.522 2.922 0 50 GFAA O=C1CC[C@@H](CNCc2cc(C(F)(F)F)ccc2Br)C(=O)N1 2325802180 NNNUDEPOYVVTEU-QMMMGPOBSA-N 379.176 2.610 0 50 GFAA Cc1ccc(S(=O)(=O)N(CC(=O)NCc2ccccn2)c2ccccc2)cc1 655816 PCDNTPHKCHRLKI-UHFFFAOYSA-N 395.484 2.902 0 50 GFAA COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccc(Br)cc32)cc1 659163 LUZKTAQYDAYQDL-QGZVFWFLSA-N 376.206 2.870 0 50 GFAA Cc1ccc(C(=O)N/C(=C/c2ccccc2F)C(=O)NCCCN(C)C)cc1 2065390 YJCNSSMOUSTLCC-HMMYKYKNSA-N 383.467 2.973 0 50 GFAA Cc1cc(S(=O)(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)ccc1F 2685065 UTRMGYXFTDOFDK-UHFFFAOYSA-N 375.425 2.733 0 50 GFAA COc1cc(NC(=O)CCN2CCN(c3ccccc3F)CC2)cc(OC)c1 4598945 FQRMNRIBFZUIRQ-UHFFFAOYSA-N 387.455 2.994 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1C(=O)N1CCCCC1 6745556 RAIUMSYBDCNNLN-HNNXBMFYSA-N 380.510 2.742 0 50 GFAA COCc1ccc(C(=O)NC[C@H]2Cc3cc(-c4ccc(OC)nn4)ccc3O2)o1 12150142 LXITWQWDVITZQM-MRXNPFEDSA-N 395.415 2.625 0 50 GFAA CCN(C[C@@H]1CCCO1)C(=O)CCc1nnc(CCc2ccc(OC)cc2)o1 12302482 MUUIXHRYMBXQPX-SFHVURJKSA-N 387.480 2.824 0 50 GFAA O=C(NC[C@H]1OCCc2ccccc21)c1nc(N2CCCC2)nc2c1CCCC2 12581435 UNZUBPCONJSIMD-HXUWFJFHSA-N 392.503 2.999 0 50 GFAA O=C1O[C@@H]2CN(Cc3ccccc3OC(F)F)C[C@@H]2N1CCN1CCCCC1 15068831 HMCWOIDHCAQAJM-FUHWJXTLSA-N 395.450 2.779 0 50 GFAA c1ccc([C@H]2N=C3NCN(Cc4ccco4)CN3c3nc4ccccc4n32)nc1 20101471 CNUDAERKWLQWHO-IBGZPJMESA-N 385.431 2.768 0 50 GFAA COc1ccc(CN2C(=O)COc3ncc(I)cc32)cc1 38534148 WWDPKQHIQKMFLJ-UHFFFAOYSA-N 396.184 2.620 0 50 GFAA Cc1cc(I)c(C(=O)O)cc1I 43214936 JZRQVDCRZBNYHP-UHFFFAOYSA-N 387.942 2.902 0 50 GFAA CCNC(=O)[C@@H](C)N1C(=O)C2(CCN(C[C@@H](C)CC)CC2)Nc2ccccc21 55119624 DZJZLEQTEHVITB-DLBZAZTESA-N 386.540 2.850 0 50 GFAA COC(=O)c1ccc2c(c1)nc(N1CCC(O)(c3ccc(C)cn3)CC1)n2C 67713321 YTOADOOXQRRPGR-UHFFFAOYSA-N 380.448 2.551 0 50 GFAA CC(C)c1ccc(CN2CCC[C@](O)(CN3CCC(CCO)CC3)C2=O)cc1 67856636 DOUOGBSSUAVJQB-QHCPKHFHSA-N 388.552 2.758 0 50 GFAA Cc1ccccc1-c1cn[nH]c1C1CCN(C(=O)c2cccc3nnnn23)CC1 67880333 DSWHUUJOHQLMAS-UHFFFAOYSA-N 387.447 2.843 0 50 GFAA CN1CCN(Cc2c(C(=O)N3CCCCCCC3)nc3sccn23)CC1 71575839 ATJQDUXANAPOTL-UHFFFAOYSA-N 375.542 2.550 0 50 GFAA Cc1cccnc1[C@H](C)Nc1nc(-c2ccc(C(N)=O)cc2)nc2c1CCNC2 71748988 CDENFEPYYGNRNI-AWEZNQCLSA-N 388.475 2.765 0 50 GFAA CC(C)NS(=O)(=O)c1cc(C(=O)O)cc(-n2cnc(-c3ccccc3)c2)c1 72133093 JYTKETCEVKGCCM-UHFFFAOYSA-N 385.445 2.924 0 50 GFAA O=C(C[C@H]1COCCN1C(=O)c1coc2c1C(=O)CCC2)Nc1ccccc1 72475428 OTVMMMXWBISPQK-HNNXBMFYSA-N 382.416 2.668 0 50 GFAA C[C@H](CN1CC2(CCN(C(=O)Cn3cccn3)CC2)OC1=O)c1ccccc1 77376569 LNMLHVRZCIOOGF-QGZVFWFLSA-N 382.464 2.500 0 50 GFAA CCNc1nc(C)cc(NCCNS(=O)(=O)c2c(C)cc(C)cc2C)n1 82230615 ZDWSMOMBYPORKP-UHFFFAOYSA-N 377.514 2.532 0 50 GFAA CN1CCN(C[C@@H]2CN(Cc3ccc(-c4ccccc4)cc3)C[C@@H]2CO)CC1 91829657 RTWODNCKBGVWMH-DNQXCXABSA-N 379.548 2.641 0 50 GFAA COc1ccc(C(=O)N2C[C@H]3CC[C@@H]2CN(C(=O)c2ccncc2)C3)cc1C 91974105 QTVWDWNDRYGXEU-QFBILLFUSA-N 379.460 2.775 0 50 GFAA CN(Cc1nc2ccccc2s1)C(=O)[C@@H]1CC(=O)N(Cc2cccnc2)C1 95391885 KSPKVGINIFKKOL-OAHLLOKOSA-N 380.473 2.698 0 50 GFAA CCn1c(Cn2ccnc2C)nnc1C1CCN(Cc2c(C)noc2C)CC1 96136309 DWRKVDFUDBIYJC-UHFFFAOYSA-N 383.500 2.836 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)[C@@H](c3ccccc3)N(C)C)CC2)oc1C 111154568 AELOKXFJHAHXML-OAQYLSRUSA-N 384.524 2.923 0 50 GFAA Cc1nc2cc(NC(=O)c3ccc(=O)n(-c4ccccc4F)n3)ccc2n1C 156499252 WGDHRDQGTMDRQN-UHFFFAOYSA-N 377.379 2.819 0 50 GFAA COc1ccc(N2C(=O)C[C@H](Nc3ccc(CC(F)(F)F)cc3)C2=O)cn1 170642386 HNPLEAOYZRJSNM-AWEZNQCLSA-N 379.338 2.939 0 50 GFAA CCN1CCN(c2ccccc2NC(=O)N2CCC(n3ccnc3)CC2)CC1 170707683 RUAFWHRMCZPEKY-UHFFFAOYSA-N 382.512 2.894 0 50 GFAA O=C(Nc1cc(F)cc(N2CCOCC2)c1)N1CCC[C@H]1CN1CCCC1 171540135 QMAZFVJVSYRYBP-SFHVURJKSA-N 376.476 2.754 0 50 GFAA CCc1c(C(=O)N2CC[C@H](C(=O)O)C2)cnn1-c1ccc(Br)cc1 178268890 IRSYFNVTTWDWLV-NSHDSACASA-N 392.253 2.744 0 50 GFAA Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N1CCO[C@H](CC(=O)O)C1 237681196 QOKADHJYWLERPZ-SNVBAGLBSA-N 382.775 2.758 0 50 GFAA C[C@H](C(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)n1c(S)nnc1-c1cccs1 239653960 BLWSQEOYKKCFLK-WFFHOREQSA-N 378.523 2.786 0 50 GFAA C[C@H](OC(=O)CCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C 241409073 NEJXFSGIOQYHAZ-XUWVNRHRSA-N 388.464 2.857 0 50 GFAA CC[C@H](C)NC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 248234851 MEFSOWGTCCWCSB-ARFHVFGLSA-N 399.491 2.719 0 50 GFAA COc1ccc(CNC(=O)c2nnn3c2CO[C@@H](c2ccc(F)cc2)C3)cc1 263617815 PTXMKZOYIBNUAO-GOSISDBHSA-N 382.395 2.627 0 50 GFAA CC(=O)NC[C@@H]1CCCN(c2cc(C(F)(F)F)nc(-c3ccncc3)n2)C1 266470955 ZWAXDWCAHYWYFI-ZDUSSCGKSA-N 379.386 2.910 0 50 GFAA CCN1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@H]1c1ncc[nH]1 328625906 LCINWEMJZWTSRX-ZDUSSCGKSA-N 389.308 2.784 0 50 GFAA CCn1cc([C@H]2OCCC[C@@H]2N[C@H](C)Cn2cc(Br)cn2)cn1 328654181 XHMMFDCIJGPSBI-UHOFOFEASA-N 382.306 2.760 0 50 GFAA CN(Cc1nccn1C(F)F)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccn1 363799154 RSDQRTVQQUEJAS-ZNMIVQPWSA-N 390.438 2.864 0 50 GFAA COc1cccc(C2(C(=O)N3CCC(C(=O)Nc4ccccn4)CC3)CC2)c1 367007524 AWHAXJIMIAQJGP-UHFFFAOYSA-N 379.460 2.999 0 50 GFAA O=C(Nc1ccccn1)c1cccc(NC(=O)C2(N3CCOCC3)CCC2)c1 378368918 HXVFDYCBKKFPGW-UHFFFAOYSA-N 380.448 2.527 0 50 GFAA CN(C)C[C@@H]1CCN(C(=O)NCc2nc3cc(C(F)(F)F)ccc3n2C)C1 426475569 RZWQVZPXSRUCEK-LBPRGKRZSA-N 383.418 2.685 0 50 GFAA Cc1cc(O)nc2ccc(S(=O)(=O)NCc3n[nH]c4c3CCCCC4)cc12 670470258 HUALZEDGEOAGAU-UHFFFAOYSA-N 386.477 2.719 0 50 GFAA COc1cc([C@H]2CC(=O)Nc3nc(N4CCCCCC4)nc(O)c32)ccc1O 824596425 RCISBARMEOGGER-CYBMUJFWSA-N 384.436 2.751 0 50 GFAA O=C(NCC1CCN(Cc2nc(C3CC3)no2)CC1)c1ccc(Cl)cn1 952969011 OSNCUYRMOBFGEP-UHFFFAOYSA-N 375.860 2.637 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@H]2c3ccccc3OC[C@@]2(C(=O)O)C1 1565507524 YNHGIJVFBXTWGM-LIRRHRJNSA-N 375.856 2.699 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N[C@H]1COC[C@H]1Cc1ccncc1 1616070726 WCNXMOHDZSAJTF-MJGOQNOKSA-N 378.476 2.758 0 50 GFAA CC(C)C1=NO[C@@H](C(=O)N2CCCN(Cc3cnn(-c4ccccc4)c3)CC2)C1 1772809113 MOHCQDZSWGRIEE-OAQYLSRUSA-N 395.507 2.708 0 50 GFAA Cn1cnc2ccc(-n3ccnc3-c3cnc(NC[C@H]4CCCO4)nc3)cc21 1775977874 MZEVFRFIKUMOBS-MRXNPFEDSA-N 375.436 2.807 0 50 GFAA Cn1nccc1[C@@]12CC[C@@H](C1)[C@@H]2C(=O)NCc1cncc(Br)c1 1857530435 OHCYOSUVZNQERX-XGWLTEMNSA-N 375.270 2.562 0 50 GFAA COc1ccc(-c2nccn2CC2(CO)CCOCC2)cc1Cn1cccn1 1857675368 VHIGWFFOHKVRSP-UHFFFAOYSA-N 382.464 2.593 0 50 GFAA O=C(c1cccc(CN=c2ccnc[nH]2)c1)N1CC[C@H](n2cc3ccccc3n2)C1 1875259790 JPVJPDNRLYXRMT-FQEVSTJZSA-N 398.470 2.948 0 50 GFAA O=C(N=c1ccn(CCc2ccccn2)[nH]1)c1cc(F)ccc1-n1ccnc1 1875261370 IMZSPSMNGVOYTN-UHFFFAOYSA-N 376.395 2.520 0 50 GFAA Cc1ccc(COc2ccc(C[C@H](C)NC(=O)[C@@]3(C(=O)O)CCNC3)cc2)cc1 1875267003 PJHGDMSRTFHOBH-GAJHUEQPSA-N 396.487 2.686 0 50 GFAA O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC2(CC2)C[C@H]1CO 1875307711 SDNRCPKQHIEYNG-ZDUSSCGKSA-N 376.254 2.826 0 50 GFAA O=C(O)[C@@H]1CCCN(S(=O)(=O)c2ccc(-c3ccn4nccc4c3)s2)C1 1875309524 AREVOOXMUXIARI-CYBMUJFWSA-N 391.474 2.548 0 50 GFAA CS(=O)(=O)[C@@H]1CC[C@@H](NC(=O)c2cc(C3CC3)nc(C(F)(F)F)c2)C1 1875320345 PQJPZHIIKAAFBW-VXGBXAGGSA-N 376.400 2.673 0 50 GFAA CC(C)n1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3ccc4cc[nH]c4n3)CC1)O2 1875394442 JBDIDBZRKBCYHP-MRXNPFEDSA-N 395.463 2.831 0 50 GFAA Cc1ccccc1NCCC(=O)N1C[C@H]2C[C@H]1[C@H]2c1ocnc1C(=O)N(C)C 1875394570 NNXLWDVWEYLVQK-HFTRVMKXSA-N 382.464 2.501 0 50 GFAA O=C(N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O)c1occc1COc1ccccc1 1875403088 PSPIDIODXNRRDF-KFKAGJAMSA-N 381.432 2.625 0 50 GFAA O=C(c1cc[nH]n1)N1CCN([C@H](COc2ccccc2)c2ccccc2)CC1 2100482310 PZWAQHXMUIFLQQ-OAQYLSRUSA-N 376.460 2.988 0 50 GFAA CCOC(=O)c1ccc2c(c1)C[C@H](NC(=O)Cc1ccc3oc(O)nc3c1)C2 2325851077 ONURCDIAKXXBDO-MRXNPFEDSA-N 380.400 2.536 0 50 GFAA Cc1ccccc1S(=O)(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356142023 ACYKRBVBBNXMFK-HXUWFJFHSA-N 386.521 2.520 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)CCOc3ccccc3)C1)CC2 2356154020 FCPCXATXZIFFGO-QFIPXVFZSA-N 380.492 2.818 0 50 GFAA O=C(c1cccc2nccnc12)N1CCO[C@@H](CO)[C@@H]1c1ccccc1Cl 2356154080 HOBMDDDIQLMLMO-HKUYNNGSSA-N 383.835 2.858 0 50 GFAA O=C([C@@H](O)c1cccc(Cl)c1)N1CCc2nc(-c3ccccc3)nn2CC1 2356159359 XHCYKAGXFQTLSU-SFHVURJKSA-N 382.851 2.717 0 50 GFAA CS(=O)(=O)N(CC(=O)N1CCCC1)c1ccc(Cl)c(C(F)(F)F)c1 827656 XTRPGBAYLLJVLR-UHFFFAOYSA-N 384.807 2.747 0 50 GFAA O=C(C[C@H]1Sc2ccccc2NC1=O)Nc1ccc(N2CCOCC2)cc1 833986 KCUGCBSATGXGKB-GOSISDBHSA-N 383.473 2.965 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2OC)cc1Cl 1071838 WKHQJWKGBRLTJK-UHFFFAOYSA-N 398.868 2.616 0 50 GFAA O=c1c2ccccc2nnn1Cc1ccc(S(=O)(=O)c2ccccc2)cc1 1079898 XSYRAVUTZZPGLV-UHFFFAOYSA-N 377.425 2.673 0 50 GFAA Cc1nn(C)cc1S(=O)(=O)Nc1ccn(Cc2ccc(F)cc2Cl)n1 2804994 OEDWILUJNKPNEP-UHFFFAOYSA-N 383.836 2.567 0 50 GFAA Cc1c(Cl)cccc1N(CC(=O)Nc1ccccc1C(=O)O)S(C)(=O)=O 4019154 WKBVXASPZDDCLX-UHFFFAOYSA-N 396.852 2.751 0 50 GFAA CCOc1ccccc1NC(=O)CN(CC)S(=O)(=O)c1ccc(OC)cc1 4838675 QWPMTBBWUXUDJJ-UHFFFAOYSA-N 392.477 2.743 0 50 GFAA CC1=NN(C(=O)c2c(Cl)c(C(F)(F)F)nn2C)[C@@](O)(C(F)(F)F)C1 6395027 UOSCQYCGWRMLKX-VIFPVBQESA-N 378.660 2.565 0 50 GFAA Cn1ncc2c1ncn1nc(-c3cc(-c4cccc(Br)c4)[nH]n3)nc21 6447566 OSMGZIYHZXAGJR-UHFFFAOYSA-N 395.224 2.831 0 50 GFAA O=C(C1CC1)N1CCC(N2CCC[C@H](C(=O)N3CCc4ccccc4C3)C2)CC1 11933858 AFEIQTWCTYKYAN-NRFANRHFSA-N 395.547 2.684 0 50 GFAA CN1CCC(Nc2ccc(C(=O)N3CCC(CCn4cccn4)CC3)cn2)CC1 19220124 JQWKSMJFIASMNI-UHFFFAOYSA-N 396.539 2.727 0 50 GFAA CCN(CC1CCN(C2CCN(C)CC2)CC1)C(=O)[C@H]1CCCCCN1C 19223662 HMHAGHVURVZHOS-OAQYLSRUSA-N 378.605 2.516 0 50 GFAA Cc1ccccc1[C@H]1CC(=O)c2cnc(NCCCN3CCOCC3)nc2C1 20101125 IVJXHECEADVLFS-QGZVFWFLSA-N 380.492 2.832 0 50 GFAA Cc1nn(-c2ccc(Cl)nn2)c2c1[C@H](c1ccc3c(c1)OCO3)CC(=O)N2 65363526 ACYXRURFGQRACN-NSHDSACASA-N 383.795 2.827 0 50 GFAA Cc1ccc2nc3c(n2c1)[C@H](c1ccccc1OCCN(C)C)CC(=O)NC3 65531425 VLDPRQLIUUOOSR-KRWDZBQOSA-N 378.476 2.735 0 50 GFAA CC(=O)NCC(=O)N1CCOc2c(O)cc(-c3nc4ccccc4s3)cc2C1 67786484 KATBOZZSUOCFOP-UHFFFAOYSA-N 397.456 2.526 0 50 GFAA O=C(C[C@@H]1C(=O)NCCN1Cc1cccc(Oc2ccccc2)c1)NCC1CC1 72127096 TZTUGGNPEZKWDI-OAQYLSRUSA-N 393.487 2.696 0 50 GFAA Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)N3[C@@H](C)CC[C@H]3C)[C@@H]4C2=O)cc1C 77519700 GRFRXBMIOQVCBE-HRKTWYGZSA-N 394.515 2.985 0 50 GFAA Cc1ccc(CN2CCN(C(=O)CCn3nc(C)c(C)c3C)CC2=O)cc1C 82162093 UUUQLAGSYUZPLS-UHFFFAOYSA-N 382.508 2.686 0 50 GFAA O=C1CCC2(CCN(C(=O)c3ccc(F)cc3)CC2)CN1CCc1c[nH]cn1 91526524 WJFSMOMZEUEVDK-UHFFFAOYSA-N 384.455 2.636 0 50 GFAA Cc1ccccc1-c1ccccc1C(=O)N1CCC2(CC1)NC(=O)C[C@@H]2C(=O)O 95386975 UYBADMCYUHFHRT-LJQANCHMSA-N 392.455 2.858 0 50 GFAA C[C@H](CN1CCc2ccccc2C1)NC(=O)c1cc(=O)[nH]c2cc(F)ccc12 97696115 LJPCKFHWQDYHOH-CQSZACIVSA-N 379.435 2.844 0 50 GFAA O=C(c1ccnc(OCc2ccccc2)c1)N1CCC[C@@H](N2CCCC2=O)C1 111056493 HNCVYLYMEQTYIS-LJQANCHMSA-N 379.460 2.888 0 50 GFAA CNC(=O)[C@@H]1CCCN(CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)C1 111265479 XWYJYUYGGIKVRF-MRXNPFEDSA-N 397.523 2.566 0 50 GFAA CN(C)S(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)co1 153013394 QTSJUVDOZFMIAM-ZWNOBZJWSA-N 386.832 2.608 0 50 GFAA CCc1noc(-c2ccn3c(CNC(=O)c4cccc(Cl)c4)nnc3c2)n1 169776173 XFWNFFRCAGYLNL-UHFFFAOYSA-N 382.811 2.925 0 50 GFAA CCc1noc(-c2cn(C3CCN(C(=O)c4cc5ccccc5[nH]4)CC3)nn2)n1 169780919 UHBSKUZFLXANTC-UHFFFAOYSA-N 391.435 2.849 0 50 GFAA Cc1ccc(Br)nc1C(=O)NCC1(N2CCCCC2)CCOCC1 170605054 FZBQHWYCSABPNI-UHFFFAOYSA-N 396.329 2.917 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)[C@H]1CC(c2cc(F)ccc2F)=NO1 170625822 PUSHAWHIXHUPPN-LJQANCHMSA-N 399.397 2.553 0 50 GFAA Cc1nc(COc2ccc(F)cc2)sc1C(=O)N[C@@H]1CCc2ncnn2C1 172002125 MQBPAIHCNVMJKZ-CYBMUJFWSA-N 387.440 2.506 0 50 GFAA CCc1c(C(=O)N2CC[C@@H](C(=O)O)C2)cnn1-c1ccc(Br)cc1 178268902 IRSYFNVTTWDWLV-LLVKDONJSA-N 392.253 2.744 0 50 GFAA O=C(CCc1ccc2c(c1)OCCO2)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 180024214 GIDVKPWSPYILME-IBGZPJMESA-N 394.471 2.555 0 50 GFAA O=C(Nc1ccc(F)cc1OCC(F)F)N1CCC[C@@H]1CN1CCOCC1 181414152 DFTLWQWDECBOJA-CQSZACIVSA-N 387.402 2.798 0 50 GFAA CN(CC(=O)O)[C@@H]1CCCN(C(=O)c2ccc(Br)cc2F)CC1 186654044 IHBPLEGJMKSVQN-GFCCVEGCSA-N 387.249 2.599 0 50 GFAA CC1(C)Cc2cccc(CNc3ncn(CC(=O)NCc4ccccc4)n3)c2O1 188020839 PJOKXPOJDSOGQM-UHFFFAOYSA-N 391.475 2.920 0 50 GFAA Cc1cccc(N2CCN(CC(=O)N3CCC(c4n[nH]cc4C)CC3)CC2)c1 220157208 WPDVLHAPPSYLDO-UHFFFAOYSA-N 381.524 2.555 0 50 GFAA CN1CC[C@H](NC(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1ccc(F)c(F)c1 245671484 CXFIBYZPQSXPIB-RBUKOAKNSA-N 383.402 2.721 0 50 GFAA CCCn1ncc(CN2C[C@H]3c4ccc(OC)cc4OC[C@@]3(C(=O)O)C2)c1C 247823231 HTOCCFZHSNUQKN-RXVVDRJESA-N 385.464 2.673 0 50 GFAA C[C@@H]1CCc2c(sc3nc(CCC(=O)NCC[C@H]4CCNC4)nc(O)c23)C1 262571220 HIBWUDCNEHCWDG-CHWSQXEVSA-N 388.537 2.570 0 50 GFAA COCCN1Cc2cc(C(=O)NC[C@@H](C)c3ccccc3)ccc2OCC1=O 263615675 DOXUBVYBSMLKDF-MRXNPFEDSA-N 382.460 2.588 0 50 GFAA Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3nc(N)c4ccccc4n3)C2)nc1 267128051 CKNSQBCZPCLHDO-OAHLLOKOSA-N 376.464 2.766 0 50 GFAA Cc1c(C(F)(F)F)nn(C)c1NC(=O)N1CCC[C@H](c2nnc3n2CCC3)C1 287624191 PTUUNTASIBCTJP-NSHDSACASA-N 397.405 2.697 0 50 GFAA O=C1COc2cc(NC(=O)NCCN3CC[C@@H](c4ccccc4)C3)ccc2N1 299799022 UIXFPRJZZZNINA-MRXNPFEDSA-N 380.448 2.629 0 50 GFAA C[C@H]1C[C@H]1c1nnc2ccc(N3CCC(NC(=O)NC4CCCCC4)CC3)nn12 333620541 YIHNCMIIWIYUTM-WMLDXEAASA-N 397.527 2.848 0 50 GFAA O=C(Nc1cnc(-c2ccccc2)nc1)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 333791754 DKSLQGCACGQFAU-LJQANCHMSA-N 386.477 2.576 0 50 GFAA O=C1CCCc2cc(NC(=O)c3cccc(N4C(=O)CCC4=O)c3)ccc2N1 363470960 UHTMFXGLXPLJPC-UHFFFAOYSA-N 377.400 2.867 0 50 GFAA Cn1cc(CCC(=O)Nc2ncccc2CN2CCc3ccccc3CC2)cn1 363729467 OJTSXRJTYVVEAZ-UHFFFAOYSA-N 389.503 2.987 0 50 GFAA O=C(Cn1c(O)nc2ccccc2c1=O)N[C@@H]1CCCc2c1[nH]c1ccccc21 409414269 JYRNGHKMGSISJF-GOSISDBHSA-N 388.427 2.777 0 50 GFAA Cn1nnc(-c2cccc(NC(=O)N3CCCC[C@@H]3CCn3cccn3)c2)n1 426678254 YISDOZQVIMCEMY-QGZVFWFLSA-N 380.456 2.550 0 50 GFAA C[C@H]1CN(C(=O)NCc2cc(Oc3ccc(F)cc3)ccn2)CC[S@@](=O)C1 458368149 QODLDHXCCBYVTO-PGGUUEOZSA-N 391.468 2.923 0 50 GFAA COc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCN3S(C)(=O)=O)cc2)cc1 824684123 XHOHXMCKVURSHN-SFHVURJKSA-N 390.461 2.850 0 50 GFAA CS[C@H](C)C(=O)Nc1ccc(S(=O)(=O)Nc2nc(C)cc(C)n2)cc1 888093308 XEYOIIRPKPVZRA-GFCCVEGCSA-N 380.495 2.584 0 50 GFAA O=C(CCC(=O)N1CCc2sccc2C1)NCc1cc(=O)c2ccccc2[nH]1 913749008 CLXRIONVGLTUCF-UHFFFAOYSA-N 395.484 2.571 0 50 GFAA CCc1nn(C)cc1CNC(=O)C(=O)Nc1ccc(Cl)c(Br)c1 952874679 YHFXOYSZHOLKKA-UHFFFAOYSA-N 399.676 2.653 0 50 GFAA Cn1cccc1-c1cc(C(=O)N2CCC3(CC2)C(=O)Nc2ccccc23)n[nH]1 952985457 HJRXMBNYKBAHIK-UHFFFAOYSA-N 375.432 2.541 0 50 GFAA Cc1cccc(NC(=O)CC(=O)N[C@H](CCn2cncn2)c2ccccc2)c1 952989176 SYDFNTVVCHYKFD-LJQANCHMSA-N 377.448 2.863 0 50 GFAA CN(C)C[C@@H]1C[C@H](CO)CN(C(=O)c2ccccc2OC(F)(F)C(F)F)C1 1073369745 BYYQZLZPTCVHTG-STQMWFEESA-N 392.393 2.556 0 50 GFAA O=C(c1ccccn1)[C@H]1CCCN(C(=O)c2csc(-c3ncccn3)n2)C1 1506417542 NLPDBZCXPSUDDN-ZDUSSCGKSA-N 379.445 2.730 0 50 GFAA CN(C)c1ncc2c(n1)[C@@]1(CCCN(C(=O)C3Cc4ccccc4C3)C1)CC2 1704340873 WEPSWGGPXOIVRZ-QHCPKHFHSA-N 376.504 2.764 0 50 GFAA CCOCC(=O)N1C[C@@H]2CN(C/C(=C\C(C)C)c3ccccc3)C[C@@]2(CO)C1 1772819031 NSSZXSJTSASWTI-ONCLGBAGSA-N 386.536 2.515 0 50 GFAA CCOC(=O)N1CCC(N2CCCN(C(=O)c3ccncc3Cl)CC2)CC1 1800409915 LUPTUQUKVJBIQA-UHFFFAOYSA-N 394.903 2.504 0 50 GFAA CCNC(=O)[C@@H]1C[C@@H]2CN(Cc3ccc(F)cc3)CC(=O)N2[C@@H]1c1ccccc1 1857702561 NUVKFGLUUAEIKT-KCZVDYSFSA-N 395.478 2.736 0 50 GFAA O=C(Cc1ccc(F)c(F)c1)N1CC[C@@]23OC[C@@H](c4ccccc4)N2C(=O)C[C@@H]13 1857708081 UKPRHJLTQKUUCT-JQVVWYNYSA-N 398.409 2.808 0 50 GFAA Cc1ccc2nc(N3C[C@@H](C(=O)NCc4ccncc4C)CC3=O)sc2c1 1857731502 STKLWQLRKHXXNO-HNNXBMFYSA-N 380.473 2.977 0 50 GFAA CC(C)=CCCN1C[C@@H]2[C@H](CNC(=O)CCn3ccc(C)n3)[C@H]3CC[C@]2(C1)O3 1857739876 WYHCYUWFYRSSTO-GPQLQYNLSA-N 386.540 2.534 0 50 GFAA N[C@@H](CC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCCC1)Cc1ccccc1 1875263858 WIWMSPQIMJQPIK-FGZHOGPDSA-N 393.531 2.687 0 50 GFAA CC(C)(C)OC(=O)N1CCn2ncc(CNC(=O)c3nc(Cl)cs3)c2C1 1875278729 ZDEWVOFJZKWVDJ-UHFFFAOYSA-N 397.888 2.674 0 50 GFAA N[C@]1(c2ccccc2)CCN(C(=O)c2ncn3cc(Br)sc23)C1 1875393665 JTZNRYNPQUTDOT-MRXNPFEDSA-N 391.294 2.858 0 50 GFAA NC(=O)[C@H]1CC[C@H]2OCCN(Cc3nc(-c4ccc(F)cc4)cs3)[C@@H]2C1 1940197465 SBTVTLLAHZMDTD-IAOVAPTHSA-N 375.469 2.804 0 50 GFAA COc1ccc(N2C[C@@H](C(=O)Nc3ncc4c(n3)CCC4)CC2=O)cc1Cl 2100545018 FKRBOTRUXSBUTC-LBPRGKRZSA-N 386.839 2.619 0 50 GFAA O=C(Nc1sncc1Br)[C@@H]1CCCN1C(=O)c1ccccc1O 2325803354 BOSWYCZUIQUBPE-NSHDSACASA-N 396.266 2.855 0 50 GFAA Cn1cc(-n2nc(C3CCOCC3)nc2-c2cnc(-c3ccccc3)n2C)cn1 2356135030 MTMSWUGEYDDKID-UHFFFAOYSA-N 389.463 2.962 0 50 GFAA Cc1ccc(N2CCC[C@]3(CCCN3C(=O)CCCn3cncn3)C2=O)cc1 2356166398 WCMMURIUJNLCNM-NRFANRHFSA-N 381.480 2.555 0 50 GFAA CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1cccc(C(F)(F)F)c1 816948 GNGPIIACUDFWRP-UHFFFAOYSA-N 378.416 2.920 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cc(C)ccc2C)cc1C 1122828 DYMZOOOZXODJGI-UHFFFAOYSA-N 376.478 2.880 0 50 GFAA Cn1c(=O)[nH]c(=O)c2c1nc(Sc1ccccc1)n2CCc1ccccc1 1261821 PDOBLNQPGDKFTN-UHFFFAOYSA-N 378.457 2.817 0 50 GFAA NS(=O)(=O)c1ccc(NC(=O)c2ccc(COc3ccc(F)cc3)o2)cc1 2762994 OSWFWXXRJQLRHM-UHFFFAOYSA-N 390.392 2.897 0 50 GFAA COC(=O)c1cc(NC(=O)COc2ccccc2C)ccc1N1CCOCC1 4710829 AXXJNUQFPBUWBC-UHFFFAOYSA-N 384.432 2.636 0 50 GFAA O=C(COc1ccc(S(=O)(=O)Nc2ccccc2)cc1)NCc1ccncc1 6139182 JATCJXRMUCFNQR-UHFFFAOYSA-N 397.456 2.578 0 50 GFAA C[C@H](Cc1ccc(O)cc1)N1CCC(N2CCC(C(=O)NC3CC3)CC2)CC1 11700893 XDQZGQMYGVGZHD-QGZVFWFLSA-N 385.552 2.778 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2C)CCCN(C(=O)CCC(=O)OC)C1 11934107 IPPFMAQPFLSQBQ-NRFANRHFSA-N 375.465 2.663 0 50 GFAA CCc1ccc(CN2CCC3(CC[C@H](CNC(=O)[C@@H]4CCCO4)O3)CC2)o1 11966622 QECGDOWTEFFQFL-MJGOQNOKSA-N 376.497 2.651 0 50 GFAA CC(C)C[C@H](O)C1CCN(C(=O)c2cn(Cc3c(F)cccc3F)nn2)CC1 12057783 KQYDMHVOTGFSTI-IBGZPJMESA-N 392.450 2.864 0 50 GFAA Cc1cc(C)n(-c2cccc(CN(C)C(=O)c3cn(C[C@H]4CCCO4)nn3)c2)n1 12704235 TUKLYNRNLLQOMC-LJQANCHMSA-N 394.479 2.532 0 50 GFAA CCCn1nc(C(=O)N2CCCCCC2)c2c1CC[C@H](NCc1ccon1)C2 14744659 IFSNWVIGEKRLJK-INIZCTEOSA-N 385.512 2.944 0 50 GFAA COc1cccc(N2CCC(N3CCC(n4cc(C(C)(C)N)nn4)CC3)CC2)c1 20706796 UXVSLSPUHPYKPA-UHFFFAOYSA-N 398.555 2.786 0 50 GFAA COc1ccccc1C(=O)N1CCN(C(=O)c2cc3ccccc3n2C)CC1 20745879 FIRXGSNJHMJZKS-UHFFFAOYSA-N 377.444 2.785 0 50 GFAA COc1ccccc1N1CCN(C(=O)c2cn3c4c(cccc4c2=O)CC3)CC1 33088772 LZMQQURUXQDSNH-UHFFFAOYSA-N 389.455 2.529 0 50 GFAA Cc1cc(C(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)ccc1NC(=O)c1ccco1 55109052 HVAWYFBOAWBPKU-AWEZNQCLSA-N 381.432 2.581 0 50 GFAA Cc1ccsc1[C@@H]1CCN(C(=O)CCN2Cc3ccccc3C2=O)C[C@H]1O 65383359 CMUMQEDKPANUPN-QZTJIDSGSA-N 384.501 2.779 0 50 GFAA O=C([C@@H]1COc2ccccc2C1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 70812061 UAIQAQTZWUOYTH-INIZCTEOSA-N 377.444 2.744 0 50 GFAA NS(=O)(=O)CCCC(=O)NCc1ccc2[nH]c3c(c2c1)CCCCCC3 71745298 MUYGOBKKRNJUDR-UHFFFAOYSA-N 377.510 2.512 0 50 GFAA COCCCN1C(=O)CC[C@H]2CN(C(=O)Cc3ccc(F)c(Cl)c3)CC[C@H]21 72431306 DTNFPNWNBAXSHN-MAUKXSAKSA-N 396.890 2.898 0 50 GFAA C[C@H]1CN(c2ccccc2Cl)C(=O)CN1C(=O)c1c[nH]c(=O)c(Cl)c1 82126922 ATCOMTVUYFQRJL-JTQLQIEISA-N 380.231 2.559 0 50 GFAA CCN1C[C@@H](c2ccccc2)CC2(CCN(C(=O)c3cnc[nH]c3=O)CC2)C1 91351065 IHFANAJBLSPIAA-SFHVURJKSA-N 380.492 2.502 0 50 GFAA C[C@@H](C(=O)O)N1CC2(CCC1=O)CCN(C(=O)Nc1ccc(F)cc1)CC2 91691037 FVGFHWDSKSEAJE-ZDUSSCGKSA-N 377.416 2.535 0 50 GFAA CCc1ncc(CN2CCC3(CCC(=O)N(CCc4ccccn4)C3)CC2)cn1 91695392 TVFSZMUSTSIIOG-UHFFFAOYSA-N 393.535 2.881 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3cccnc3SC)C[C@H]2NC(C)=O)cc1 92065729 JMORIRIFGKFIHF-ZWKOTPCHSA-N 385.489 2.556 0 50 GFAA O=C(NC(CO)CO)c1ccc2oc(-c3ccc(C(F)(F)F)cc3)nc2c1 95519487 PGNWWTYUZPHVEQ-UHFFFAOYSA-N 380.322 2.597 0 50 GFAA O=C1CCCCCN1CC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CCN2CC1 95519996 LPPZLZWNYZCVOT-WWPVKYPJSA-N 399.510 2.617 0 50 GFAA O=C(O)CN1CCC(Oc2cccc(C(=O)NCCc3ccccc3)c2)CC1 95528359 LPCIRUOFCNBLCE-UHFFFAOYSA-N 382.460 2.587 0 50 GFAA COc1ccc(C(=O)N2CCN(Cc3ccon3)CC2)cc1-c1ccccn1 122847476 PNHRQZHIDSBQCE-UHFFFAOYSA-N 378.432 2.703 0 50 GFAA Cc1ccsc1-c1nsc(NC(=O)N2CCN(c3cnn(C)c3)CC2)n1 154187441 ZCCHTQQXBUXGOX-UHFFFAOYSA-N 389.510 2.663 0 50 GFAA O=C(CN1CC[C@@H](Oc2cccnc2)C1)Nc1ccc(N2CCCCC2)nc1 154624594 FFADOVUMDWHNBB-LJQANCHMSA-N 381.480 2.559 0 50 GFAA COCc1c(C(=O)N[C@@H](C)CCN2CCN(C)CC2)sc2ccccc12 170598028 WLWKWHALDVBTDW-HNNXBMFYSA-N 375.538 2.804 0 50 GFAA O=C(Nc1cc(F)cc(N2CCOCC2)c1)N1CCC[C@@H]1CN1CCCC1 171540128 QMAZFVJVSYRYBP-GOSISDBHSA-N 376.476 2.754 0 50 GFAA CC(=O)Nc1cccc2c1CCN(C(=O)c1cnn(-c3ccccn3)c1C)C2 194508582 NEMWMZKATXDWHB-UHFFFAOYSA-N 375.432 2.733 0 50 GFAA Cc1nc(CN2CCC(C(=O)Nc3cn(Cc4ccccc4)nn3)CC2)cs1 194533277 RKMGXEWDUVWCFT-UHFFFAOYSA-N 396.520 2.942 0 50 GFAA CCc1nc2ccccc2n1CCC(=O)N[C@H]1CCOC[C@H]1C1CCOCC1 222377515 ZKUYFURQIRSWEY-ROUUACIJSA-N 385.508 2.937 0 50 GFAA CCn1nc(C)c(S(=O)(=O)N2CCN(c3ccc(C)cc3)[C@@H](C)C2)c1C 226420700 YJXDMTLVDDEUMZ-HNNXBMFYSA-N 376.526 2.728 0 50 GFAA CCn1ccnc1CN(C(=O)c1cccc2[nH]ncc12)[C@@H]1CC12CCNCC2 261913491 XXNHNVWIGRQLJN-GOSISDBHSA-N 378.480 2.564 0 50 GFAA CC(C)(C)c1ccc(C(=O)NCC(=O)N2Cc3ccccc3[C@H](C(=O)O)C2)cc1 263023862 YNRJBMKTHUIZDT-LJQANCHMSA-N 394.471 2.925 0 50 GFAA COc1ccc([C@@H]2Cn3nnc(C(=O)Nc4cccc(OC)c4)c3CO2)cc1 263619314 YBSZQGVXXQKHLS-SFHVURJKSA-N 380.404 2.819 0 50 GFAA CN1CCCN(C(=O)Cc2cccc(NS(C)(=O)=O)c2)c2cc(F)ccc21 265890697 PVRRQBDDWIOERF-UHFFFAOYSA-N 391.468 2.613 0 50 GFAA Cc1cc(Br)c2ccccc2c1NC(=O)N1CCO[C@H](C(N)=O)C1 268740379 TVPPEPYPCGSSSI-AWEZNQCLSA-N 392.253 2.629 0 50 GFAA COc1ccc([C@H](CC(=O)O)NC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)cc1OC 268948290 RDTDHBPDGSFUHU-OXJNMPFZSA-N 399.443 2.956 0 50 GFAA Cc1ncsc1CN1C[C@@H](F)C[C@H]1CN(C)[C@@H](C(N)=O)c1ccccc1 275432387 GIYHQJGMHQZYBD-XYJFISCASA-N 376.501 2.522 0 50 GFAA Cc1cc(C)cc([C@H](C)Nc2ccc(C(=O)N3CCS(=O)(=O)CC3)cn2)c1 276214378 KIKQLOJRXYRUFU-INIZCTEOSA-N 387.505 2.742 0 50 GFAA Cc1c(NS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cnn1C1CCCC1 277577109 KBBPKANGPOZPOT-UHFFFAOYSA-N 397.428 2.710 0 50 GFAA COC1(c2nc(CC(F)(F)F)no2)CCN(C(=O)c2c(C)noc2C)CC1 284400047 IMUCAGXOTFXXEV-UHFFFAOYSA-N 388.346 2.557 0 50 GFAA CC(C)C(=O)N1CCC(NC(=O)N2CC[C@H](n3cc4ccccc4n3)C2)CC1 367991139 UOAGLKSGWDAURB-SFHVURJKSA-N 383.496 2.640 0 50 GFAA COc1cc(NC(=O)N[C@H]2CCOc3c(F)cccc32)cc(S(C)(=O)=O)c1 376719085 SWMZRLSAASYUKO-INIZCTEOSA-N 394.424 2.883 0 50 GFAA COc1ccc2c(c1)CCN2C(=O)NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1 377002075 LQQYILRWDMTRKZ-WBVHZDCISA-N 384.436 2.948 0 50 GFAA COC[C@H](c1ccccn1)N(C)C(=O)Nc1cc(-n2cnnn2)cc(C)c1C 426407691 SGOSUKGCTKWWGO-GOSISDBHSA-N 381.440 2.526 0 50 GFAA CSCC[C@H](NC(=O)N(C)Cc1cnn(-c2cccc(C)c2)c1)C(=O)O 426489728 XQHRFPSLKSXKFT-INIZCTEOSA-N 376.482 2.528 0 50 GFAA CC(C)N1C[C@@H](CNC(=O)N2CCC(N(C)Cc3ccccc3)CC2)CC1=O 426497351 ZCVYXSPOERHBJT-LJQANCHMSA-N 386.540 2.549 0 50 GFAA Cc1c(C(=O)N2CCC[C@H](OCc3ccccn3)C2)sc2[nH]cnc(=O)c12 426545253 ZBKPAFQWDRZWHI-AWEZNQCLSA-N 384.461 2.509 0 50 GFAA CC(C)Cc1noc([C@H]2CCCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 952963134 HVINTSDCBKLSJI-INIZCTEOSA-N 380.452 2.869 0 50 GFAA C[C@H](NC(=O)C(=O)NC1Cc2ccccc2C1)c1ccc(C(F)(F)F)nc1 1331146164 LPENCGGUYDNGFD-NSHDSACASA-N 377.366 2.561 0 50 GFAA CN(Cc1cccc(C(F)(F)F)c1)c1cncc(C(=O)N2CCOCC2)n1 1529190218 GQHGWNUVRQMUMI-UHFFFAOYSA-N 380.370 2.604 0 50 GFAA Cc1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(Cc2ccc(F)cc2)C3)c(=O)n1C 1565515488 BYIMXDMKQWMMRS-MJGOQNOKSA-N 383.467 2.569 0 50 GFAA O=C(c1cccnc1N1CCC[C@@H](c2nnc3ccccn23)C1)N1CCCC1 1704298800 NVLQFAHHQIDFOY-MRXNPFEDSA-N 376.464 2.744 0 50 GFAA Cc1cc(C[C@@H]2CN(c3ncnc(Oc4cccnc4C)c3C)C[C@@H]2O)on1 1704330083 WMWHAAXELKGOFF-WBVHZDCISA-N 381.436 2.617 0 50 GFAA COc1ccccc1-c1ncc(CNC(=O)[C@H]2CC[C@H](N)[C@@H](OC)C2)s1 1857714809 MWGWDIAETNGPNX-NUTKFTJISA-N 375.494 2.577 0 50 GFAA CC(C)NC(=O)CNC(=O)C[C@H]1CCCN(c2nc3ccc(Cl)cc3o2)C1 1857723589 MMIYRQQEVGEODS-CYBMUJFWSA-N 392.887 2.729 0 50 GFAA CCCO[C@@H]1C[C@@H](C(=O)N2CCC(OCc3ccccn3)CC2)CC[C@H]1N 1857734226 FRYAWKFREDLXAF-PWIZWCRZSA-N 375.513 2.512 0 50 GFAA COc1ccc([C@H]2C[C@H](C)N(S(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1 1875260150 VECIRGWFAYAGPU-BBRMVZONSA-N 375.446 2.960 0 50 GFAA O=C(O)c1n[nH]cc1[C@@H]1CCCN(Cc2cc(CO)cc(C(F)(F)F)c2)C1 1875310011 ZCXBGSOOZRDFDE-CYBMUJFWSA-N 383.370 2.999 0 50 GFAA C=CC(=O)N1CCC(C(=O)Nc2ccc(N3CCOC[C@H]3C)c(Cl)c2)CC1 1875366271 IYEKCQSIZQRVAN-CQSZACIVSA-N 391.899 2.928 0 50 GFAA CC(C)(C)OC(=O)N1CCc2sc(CN3CCOCCOCC3)cc2C1 2325784263 NSCBTAOCUCKARE-UHFFFAOYSA-N 382.526 2.890 0 50 GFAA CCN(CC(=O)NCC(C)(C)CN(C)C(=O)c1nocc1C)c1ccccc1 2325793753 GUSPHPFVBOTNFS-UHFFFAOYSA-N 386.496 2.724 0 50 GFAA CCc1nnc(N2C[C@@H](C)[C@H](CNC(=O)C3(C)CC(F)(F)C3)C2)nc1CC 2325793918 LOMGWFGPRSCNAF-CHWSQXEVSA-N 381.471 2.620 0 50 GFAA CC(C)C(C)(C)C(=O)N[C@H]1CC12CCN(C(=O)[C@H]1CN3CCC1CC3)CC2 2325794135 RMXAVGCUBLUECW-ROUUACIJSA-N 375.557 2.508 0 50 GFAA CCCc1ccc(C(=O)N2CC[C@@H](CNC(=O)[C@H]3CCCC(=O)N3)[C@H](C)C2)cc1 2325826436 BDOAHIBLSKJEDV-LSTHTHJFSA-N 399.535 2.522 0 50 GFAA O=C(c1cncc(Cl)c1)N1CCC[C@@]12CCCN([C@H]1CC[C@H](O)CC1)C2=O 2356165831 QCYRTDRUJMKTII-MBOZVWFJSA-N 391.899 2.636 0 50 GFAA CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnnn2-c2ccccc2)c1C 628632 AIQXDIVCWNHJEF-UHFFFAOYSA-N 385.449 2.759 0 50 GFAA CCNC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2583334 AEOWYLMRDPXICX-IBGZPJMESA-N 396.443 2.895 0 50 GFAA O=C1CCN(S(=O)(=O)c2ccc(OCc3cnc(Cl)s3)cc2)CC1 4073066 HEHFJBQHMCUYRP-UHFFFAOYSA-N 386.882 2.729 0 50 GFAA CCCn1c(C)c(CC(=O)N[C@@H](C)Cn2cncn2)c2c1CC(C)(C)CC2=O 11662128 RIEQMXLEFVXPNN-AWEZNQCLSA-N 385.512 2.701 0 50 GFAA NC(=O)CCC(=O)N1CCC[C@H]1C(=O)Nc1cccc(-c2ccc(F)cc2)c1 11842826 AMLDLUQWDKXMLF-SFHVURJKSA-N 383.423 2.688 0 50 GFAA O=C(c1cccnc1)[C@@H]1CCCN(C(=O)c2cn(CC3CCCCC3)nn2)C1 11874527 QLSMJZHKASBRPB-GOSISDBHSA-N 381.480 2.989 0 50 GFAA CN(C[C@H]1CCCN(CCc2ccccc2F)C1)C(=O)CCN1CCCO1 12198916 RDOJQTRZDVSBIH-GOSISDBHSA-N 377.504 2.566 0 50 GFAA Cc1nn(C)c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)c2cccc(Cl)c2)C1 12587641 ZGDMNRZGZWPTHR-HNNXBMFYSA-N 395.912 2.974 0 50 GFAA CCOC(=O)[C@]1(Cc2ccccc2F)CCCN(C(=O)c2cc(C)nn2C)C1 12755955 QLZNHJCMKVIBLQ-NRFANRHFSA-N 387.455 2.896 0 50 GFAA CCN1C(=O)N(Cc2cccc3ccccc23)C(=O)C12CCN([C@H](C)CO)CC2 14732366 IJLUWFBXYSUCER-QGZVFWFLSA-N 395.503 2.839 0 50 GFAA CC[C@H](COC)Nc1ncnc2sc(C(=O)N(CCO)C(C)C)c(C)c12 15002952 RUPCGYPMTNHSFA-CYBMUJFWSA-N 380.514 2.680 0 50 GFAA Cc1c(Br)c(C(F)(F)F)nn1CCC(=O)N1C[C@H](C)O[C@H](C)C1 18068375 AFZHWEXTWFUTEK-DTORHVGOSA-N 398.223 2.999 0 50 GFAA COc1cccc(-c2noc(-c3ccc(N4CCN(C)[C@@H](C)C4)nc3)n2)c1OC 39413292 WJEXUZBZQMVNLE-AWEZNQCLSA-N 395.463 2.956 0 50 GFAA O=C(NCCc1ccc2c(c1)OCO2)N1CCCN(Cc2cccs2)CC1 43888390 HEPFLNWNKNBEBM-UHFFFAOYSA-N 387.505 2.937 0 50 GFAA CCc1nccn1CCC(=O)N1CCC(Cc2nncn2-c2ccccc2)CC1 55168226 LNMQKDNNFJGXPZ-UHFFFAOYSA-N 392.507 2.898 0 50 GFAA COCCN(Cc1sccc1C)C(=O)CCn1cnc2ccccc2c1=O 55357668 UHFNYPRYOGRSGI-UHFFFAOYSA-N 385.489 2.832 0 50 GFAA COc1ccc(F)cc1[C@H](C(=O)O)N1CC=C(n2c(=O)[nH]c3ccccc32)CC1 55414375 ZCKLDAKUXZLQPO-LJQANCHMSA-N 397.406 2.850 0 50 GFAA COCCNC(=O)[C@H]1CCCN(C2CCN(Cc3cc(C)cc(C)c3)CC2)C1 67947985 JZBXAICFWYDLQN-NRFANRHFSA-N 387.568 2.742 0 50 GFAA O=C(O)[C@H]1CC2(CCN(CCSc3ccccc3)CC2)CN1C(=O)C1CC1 72122379 NCYQPQCXOQBDDG-GOSISDBHSA-N 388.533 2.956 0 50 GFAA Cc1ccc(CN2CCC(N3CCC[C@H](C(=O)N4CCOCC4)C3)CC2)cc1 82092022 RLXPLFLBDODVMY-NRFANRHFSA-N 385.552 2.530 0 50 GFAA Cc1cnc(CN2C[C@@]3(CCCN(C(=O)c4cccc(O)c4)C3)CCC2=O)cn1 91574271 PQBXIJZZWKWRKG-QFIPXVFZSA-N 394.475 2.536 0 50 GFAA Cc1ncccc1C(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95500973 KKTGNICXPXYIJV-VLCRHTCISA-N 391.471 2.821 0 50 GFAA COc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@](C)(c2ccccc2)C1 95528563 KDWUCCONIFGKNH-FQEVSTJZSA-N 388.489 2.537 0 50 GFAA O=C(c1csc(C2CC2)n1)N1CCN([C@@H]2CCN(c3ccccc3)C2=O)CC1 112622806 PAFYHUOYPRPJHG-GOSISDBHSA-N 396.516 2.584 0 50 GFAA O=C(CN1CCC[C@@H]1C(=O)Nc1nccs1)NC1(c2ccccc2)CCC1 114195167 INAIBXSGWLGICJ-MRXNPFEDSA-N 384.505 2.742 0 50 GFAA C[C@H](C(=O)NC1CCCCC1)S(=O)(=O)Cc1nnc(-c2ccccc2)s1 122433464 PMPYFZBEVGJQEQ-CYBMUJFWSA-N 393.534 2.957 0 50 GFAA CC(C)[C@H](CNC(=O)Nc1nnc(-c2ccsc2)s1)N1CCN(C)CC1 131521034 OXOKVXSKIYPZGJ-AWEZNQCLSA-N 394.570 2.660 0 50 GFAA C[C@@](O)(CNC(=O)NC1CCN(CC(F)(F)F)CC1)c1ccccc1Cl 184054194 NUGVVVOCOYKMQO-MRXNPFEDSA-N 393.837 2.873 0 50 GFAA Cc1ccc([C@@H](CNC(=O)c2cn3ccnc3s2)N2CCOCC2)s1 188484697 IKEZTLZCVWSWIC-CYBMUJFWSA-N 376.507 2.569 0 50 GFAA O=C(O)c1ccc(CCC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cc1 191647743 FPLACMDAQPBDSS-GOSISDBHSA-N 386.835 2.671 0 50 GFAA C[C@@H]1CCC[C@H](N2C(=O)[C@@](NC(=O)c3ccco3)(C(F)(F)F)N=C2O)[C@@H]1C 227082713 DPNUGJSSHMLGNP-UDKBDQPSSA-N 387.358 2.849 0 50 GFAA CCOc1ccccc1CN[C@H]1CNC(=O)c2cc(-c3cccc(OC)c3)nn21 263619605 ZNMNAAXHPQURLR-OAQYLSRUSA-N 392.459 2.989 0 50 GFAA CCOc1cc(C(=O)N[C@@H]2C[C@H](OCC)C23CCC3)ccc1OCC(=O)O 268939148 IRPYGNMPBMJQTN-SJORKVTESA-N 377.437 2.626 0 50 GFAA COc1cc2c(cc1OC)[C@@H](CC(=O)O)N(C(=O)c1sc(C)nc1C)CC2 299271466 NHILTUFWJMZDSU-CQSZACIVSA-N 390.461 2.991 0 50 GFAA CCOc1c(Br)cc(C(=O)N2CC[C@](C)(C(=O)O)C2)cc1OC 299745627 RMNGQJZREHAVJZ-INIZCTEOSA-N 386.242 2.793 0 50 GFAA CN(C[C@H]1CCc2nccn2C1)S(=O)(=O)Cc1ccccc1C(F)(F)F 328618898 FDPXXYZGTXTLIS-CYBMUJFWSA-N 387.427 2.926 0 50 GFAA O=C(CSCc1ccc(Cl)cc1Cl)N1CCN2C(=O)N=C(O)[C@H]2C1 329461399 SQVUSZJEJKTTPZ-GFCCVEGCSA-N 388.276 2.830 0 50 GFAA C[C@H]1CN(C(=O)Nc2cccc(OCc3cscn3)c2)CCS(=O)(=O)C1 333406419 GFHBLETVCVIDAJ-ZDUSSCGKSA-N 395.506 2.621 0 50 GFAA COc1ccc(NC(=O)CN2C[C@@H](C)C(=O)N(C)c3ccccc32)cc1OC 363583427 ROLZRUNIJKXOJI-CQSZACIVSA-N 383.448 2.761 0 50 GFAA CCOc1cc(CNC(=O)[C@H]2COCCN2CC2CCC2)ccc1OC(F)F 483730668 JFONMMROCKBUGJ-MRXNPFEDSA-N 398.450 2.804 0 50 GFAA O=C1C[C@@H](C(=O)N2CCC[C@H]2c2nc(C(=O)O)cs2)c2ccc(F)cc2N1 828317499 DWXXGZALOLHLIA-RISCZKNCSA-N 389.408 2.770 0 50 GFAA Cc1cc(S(=O)(=O)N[C@H]2COC[C@H]2Cc2ccncc2)c(C)cc1Cl 1704332149 PZOJSOPUHGEXOW-WBVHZDCISA-N 380.897 2.888 0 50 GFAA CN1CCCC[C@H]1C(=O)N1CCCN(CCCOc2ccc(F)cc2)CC1 1772706395 CHGOLHWWBISUCU-FQEVSTJZSA-N 377.504 2.613 0 50 GFAA COc1nc2c(cc1CN(C)CCn1cnc3ccccc31)C(=O)N(C(C)C)C2 1857679910 ACOXGKHOUYDTBA-UHFFFAOYSA-N 393.491 2.936 0 50 GFAA NCc1ccnc(CNC(=O)[C@H]2CCCN(c3nc4cc(Cl)ccc4o3)C2)c1 1857738031 ONTRVHFKXUOJJU-AWEZNQCLSA-N 399.882 2.868 0 50 GFAA O=C1CC[C@@H](NC(=O)c2cccc(-c3nc4cc(Cl)ccc4o3)c2)C(=O)N1 1857798095 OROSIRKZRXOJEF-CYBMUJFWSA-N 383.791 2.683 0 50 GFAA CC(C)c1noc(CC2CCN(C(=O)c3ccc4c(c3)NC(=O)CN4C)CC2)n1 1875266568 GFWYOUKAAWORMQ-UHFFFAOYSA-N 397.479 2.676 0 50 GFAA COc1ccccc1[C@H](CNC(=O)c1cnn2ccn(C)c12)N1CCCCC1 1875313961 AIDLAPNINGZUCX-SFHVURJKSA-N 381.480 2.638 0 50 GFAA Cc1cc(CCCC(=O)N[C@@H](C)Cn2cc([C@@H](O)C3CC3)nn2)c(C)s1 1875338514 ZYIFPQOAAWPJQD-BUXKBTBVSA-N 376.526 2.927 0 50 GFAA C[C@@H]1CCC[C@@H](C)N(C(=O)c2cc(-c3ccco3)n3cnc(C(N)=O)c3n2)C1 1875350719 YIVPWAHLMJNPKY-CHWSQXEVSA-N 381.436 2.739 0 50 GFAA C=CC(=O)N(C)c1ccc(C(=O)N[C@H]2COc3ccc(Cl)cc3C2=O)cc1 1875373576 GQLZOFZHGZBUBD-INIZCTEOSA-N 384.819 2.863 0 50 GFAA CCc1c(C(=O)N=[S@]2(=O)CCC[C@@]3(CCCN3)C2)cnn1-c1ccccc1 1875393340 KTDMZVAADZWJFF-DCFHFQCYSA-N 386.521 2.959 0 50 GFAA CN(C)C(=O)C[C@@H]1CN(Cc2ccc(-c3cccc4cccnc34)o2)C[C@H]1O 1875398608 YGUUVUUWSMBAEF-VQIMIIECSA-N 379.460 2.766 0 50 GFAA O=C1CCN(C[C@]23C[C@H]2COC32CCC2)C(=O)[C@@H](Cc2cc3ccccc3o2)N1 1875404476 KHETZGLBNCHAML-AQOAWAETSA-N 394.471 2.652 0 50 GFAA CC(C)n1cc(CNCc2ccccc2OCc2cccnc2)c(O)nc1=O 2325774328 KJKKBXZLDRSLJR-UHFFFAOYSA-N 380.448 2.794 0 50 GFAA Cc1ccc(F)c2c1CCN(C(=O)N=c1ccn(CCCn3ccnc3)[nH]1)C2 2325781316 DCKKNECBUIPNCB-UHFFFAOYSA-N 382.443 2.630 0 50 GFAA CCn1nc(C(=O)N2CCCN[C@@H](c3ccccc3)C2)c(=O)c2ccccc21 2325783365 STPSOMQBTZNDQX-GOSISDBHSA-N 376.460 2.593 0 50 GFAA CCC[C@H](OC)C(=O)NC1(C)CCN(C(=O)CC[C@@H]2CC(C)(C)CO2)CC1 2325793686 DHUKGPOINKRWCP-SJORKVTESA-N 382.545 2.894 0 50 GFAA Cc1ccc(CCC(=O)N2CC[C@@H](O)[C@](Cc3ccccc3)(C(=O)O)C2)cc1 2356159932 WLWROGBLKSNESF-NFBKMPQASA-N 381.472 2.835 0 50 GFAA c1ccc(-c2nc3ncccn3c2CN2CCc3nc(C4CC4)nn3CC2)cc1 2356166871 CPEHVINVGKOPLI-UHFFFAOYSA-N 385.475 2.924 0 50 GFAA O=C(O)[C@]1(CC2CC2)CN(Cc2nc(-c3ccccc3Cl)no2)CC[C@@H]1O 2356166925 PAWFMGIMHUFDSS-HNAYVOBHSA-N 391.855 2.828 0 50 GFAA O=C(c1cc(=O)n2c(nc3ccccc32)s1)N1CCN(c2ccccc2)CC1 1123840 NXONNUYCCDLGTR-UHFFFAOYSA-N 390.468 2.872 0 50 GFAA CC(=O)c1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1 1124662 NJYSWFQCWYXKKB-UHFFFAOYSA-N 380.853 2.802 0 50 GFAA O=C(CNC(=O)c1ccccc1)OCc1ccc(I)cc1 1136805 NALVETHFNSRCAN-UHFFFAOYSA-N 395.196 2.764 0 50 GFAA O=C(CCCCCN1C(=O)c2cccc3cccc(c23)C1=O)N1CCOCC1 4006204 FMNQOZWAIXCPQI-UHFFFAOYSA-N 380.444 2.855 0 50 GFAA CCCCn1c(C)cn2c3c(=O)n(CCc4ccccc4)c(=O)n(C)c3nc12 4251000 VVNBCUJTJPQMPD-UHFFFAOYSA-N 379.464 2.501 0 50 GFAA CCc1nc(C)c(CN2CCN(Cc3ccc(OC)c(C)c3)[C@H](CCO)C2)[nH]1 55327811 BQJGSMKTNGAARS-LJQANCHMSA-N 386.540 2.666 0 50 GFAA COc1ccccc1-c1cc(C(=O)N2C[C@H]3CC[C@H]2C3)cc(-n2cnnn2)c1 102316013 YNDSONNANZQAFC-YOEHRIQHSA-N 375.432 2.962 0 50 GFAA O=C(Nc1cccc(C(=O)N2CCN(c3ncccn3)CC2)c1)C1CCCC1 55054002 BHISONCSOXQYGH-UHFFFAOYSA-N 379.464 2.568 0 50 GFAA COC(=O)c1cc(NC(=O)CN2C(=O)COc3ccc(C)cc32)ccc1Cl 10682538 VNKTVQCCNUTQSU-UHFFFAOYSA-N 388.807 2.799 0 50 GFAA NC(=O)c1cc2c(cc1N1CCCC1)NC(=O)C[C@H]2c1cccc2nsnc12 65371133 XSBYVWYTWTULMQ-LBPRGKRZSA-N 393.472 2.865 0 50 GFAA CN1Cc2ccccc2C[C@@H]1C(=O)NCCc1csc(-c2cccnc2)n1 65376100 GNTXZHVDODZSJX-LJQANCHMSA-N 378.501 2.921 0 50 GFAA CCOc1ccc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1OC 229687870 QNBZUBSKBSLJER-XYJFISCASA-N 376.497 2.808 0 50 GFAA CC1CCN(C2=NC(=O)[C@H](CC(=O)Nc3ccc(Cl)c(Cl)c3)N2)CC1 20028173 GURLTKHUOOYGQR-AWEZNQCLSA-N 383.279 2.908 0 50 GFAA CN(c1ccccc1F)S(=O)(=O)c1cccc(C(=O)NC[C@H]2CCCO2)c1 67339083 AQUVBAYXLCWHFH-OAHLLOKOSA-N 392.452 2.560 0 50 GFAA Cc1ccn2c(C(=O)N3CC[C@@H](c4ccc5ccccc5c4)[C@H](O)C3)nnc2n1 65509300 MURNEEOAEBIGMB-RBUKOAKNSA-N 387.443 2.577 0 50 GFAA Cc1ccnc(NCCNC2CCN(c3cccc(N4CCNC4=O)c3)CC2)c1 20209165 JVDOUCCNSXMFSL-UHFFFAOYSA-N 394.523 2.590 0 50 GFAA O=S(=O)(c1csc2ccccc12)N1CCC(n2ncc3c2CNC3)CC1 333593615 PLWZLODRVGHGAP-UHFFFAOYSA-N 388.518 2.727 0 50 GFAA O=C1N(CCC2CCCCC2)CCC[C@@]1(O)CNCc1ccc2c(c1)OCO2 67975081 NESJWWZCYBCZOG-JOCHJYFZSA-N 388.508 2.829 0 50 GFAA CCn1cc(NC(=O)[C@@H](C)n2ncc(Cl)c2C)c(C(=O)NCC(C)C)n1 2800039 XTFUZXGOTAEFEW-GFCCVEGCSA-N 380.880 2.647 0 50 GFAA COc1ccc(NC(=O)CN2C(=O)OC3(CCCCC3)[C@@]2(C)O)cc1OC 4727298 SHWBMYCBDJXYCD-GOSISDBHSA-N 378.425 2.506 0 50 GFAA Cc1nc(COc2ccccc2C(=O)NC[C@@](C)(CO)Cc2ccccc2)no1 252497945 QRRMISSXXNKPHK-QFIPXVFZSA-N 395.459 2.928 0 50 GFAA CCC(=O)N1CC[C@H](NC(=O)N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)C1 152838481 RMMLCACMIFSMMB-QHAWAJNXSA-N 398.551 2.693 0 50 GFAA COc1ccc(S(=O)(=O)N2CCC[C@](CO)(c3ccccc3)C2)cc1F 374621707 WYAFOUUPZAMZHV-IBGZPJMESA-N 379.453 2.549 0 50 GFAA CCc1nc(N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)ncc1C 71422270 MMKPIVSEOFTURB-SFHVURJKSA-N 385.556 2.651 0 50 GFAA O=C(O)[C@@H]1CC2(CCN(CCCOc3ccccc3)CC2)CN1C(=O)C1CC1 72171628 LICYMXPKBWPFEN-IBGZPJMESA-N 386.492 2.633 0 50 GFAA CN(CCCN1CC2(CCN([C@@H]3CCCNC3)CC2)OC1=O)C1CCCCC1 72477156 QPFFFDPGNRLFDF-HXUWFJFHSA-N 392.588 2.680 0 50 GFAA CN1C(=O)[C@@](CC(=O)NCCn2cccn2)(Cc2ccccc2)c2ccccc21 71589515 RBWUPRPKQMDBAQ-HSZRJFAPSA-N 388.471 2.547 0 50 GFAA CC(C)[C@H]1CN(C(=O)CCC(=O)N(C)C)CCCN1Cc1ccc(F)cc1 72144722 LAHVPDOJEWDUML-LJQANCHMSA-N 377.504 2.753 0 50 GFAA Cc1nc2sccn2c1C(=O)N1CCN(c2ncnc3ccccc23)CC1 72480743 GNSKQXHHAMTNMU-UHFFFAOYSA-N 378.461 2.610 0 50 GFAA COc1cccc(CN2CCN(C(=O)Nc3ccc4c(c3)OCCO4)CC2)c1 17078286 CBWXQMQFKHWUCI-UHFFFAOYSA-N 383.448 2.816 0 50 GFAA O=C(CCc1cnn(-c2ccccc2)c1)NCc1ccnc(O[C@@H]2CCOC2)c1 162916503 MMENAXLPCHTIFV-HXUWFJFHSA-N 392.459 2.684 0 50 GFAA CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccc(OCC(F)(F)F)nn1 182115329 MYSKBBKNZUCLOD-OAHLLOKOSA-N 383.370 2.922 0 50 GFAA COc1nc2c(cc1C(=O)N[C@@H](c1ccccc1)c1nnc(N)s1)CCC2 91416455 ZKVZOHAMMVBKCI-HNNXBMFYSA-N 381.461 2.532 0 50 GFAA COc1ccc([C@H](NC(=O)NC2(C(N)=O)CCCCC2)c2ccncc2)cc1 426653003 RYIAPDXBWHSWBG-SFHVURJKSA-N 382.464 2.667 0 50 GFAA O=C(CN1C[C@H]2CC[C@@H]1CN(Cc1cscn1)C2)N1CCc2ccccc21 91593696 NJTJUDGJQHFSNG-QFBILLFUSA-N 382.533 2.629 0 50 GFAA CC(C)c1noc(CN2CCC3(CCC(=O)N(C[C@H]4CCCO4)C3)CC2)n1 91755286 JZGUZKDBPRPKDC-MRXNPFEDSA-N 376.501 2.577 0 50 GFAA COc1ccc([C@@H]2CN(C(=O)c3ccc4cc[nH]c4c3)C[C@H]2NC(C)=O)cc1 95519467 VCQXCSXZWNWTPO-PZJWPPBQSA-N 377.444 2.921 0 50 GFAA CCc1cnc(C)nc1N1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1 91390987 OTBJHNKHPVBJRZ-NRFANRHFSA-N 382.512 2.522 0 50 GFAA O=C(c1ccc(O)cc1)N1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1 95353464 GRDNPXSEHSLKIP-VLCRHTCISA-N 392.455 2.823 0 50 GFAA COc1ccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)o1 95374537 MBDOFIVUDWKCCE-IWMITWMQSA-N 396.443 2.719 0 50 GFAA O=C(c1ccc([C@H]2CCCNC2)cc1)N1CCN(Cc2cccc(O)c2)CC1 95358878 AHUACIWHRISORN-NRFANRHFSA-N 379.504 2.817 0 50 GFAA CC[C@H](NS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)[nH]n2)o1)[C@H]1C[C@@H](O)C1 244874932 XJVNEPNWUNTXQU-AEJSXWLSSA-N 393.387 2.516 0 50 GFAA O=S(=O)(c1nc(C(F)(F)F)n[nH]1)c1ncc(C(F)(F)F)cc1Cl 261494824 KDCVKRAHYQFKJR-UHFFFAOYSA-N 380.657 2.724 0 50 GFAA O=C(NCc1ccc(C(F)(F)F)cc1F)[C@H]1CC(=O)N(Cc2cccnc2)C1 827696398 KTGWUWSTEOCSEO-AWEZNQCLSA-N 395.356 2.904 0 50 GFAA Cc1cc(C)cc(OCCCN(C)C(=O)[C@@H]2CC(=O)N(Cc3ccncc3)C2)c1 825139002 DJMQHDLYLZULII-HXUWFJFHSA-N 395.503 2.974 0 50 GFAA Cc1nc2ccc(CNC(=O)N3CCC([C@@H](O)c4ccccn4)CC3)cc2[nH]1 584901516 MSUWRMSARCGSEZ-HXUWFJFHSA-N 379.464 2.922 0 50 GFAA Cc1cc(S(=O)(=O)NCC2CCN(C(=O)C(C)C)CC2)c(Cl)cc1F 670444433 QTKWMZPBRWCGCZ-UHFFFAOYSA-N 390.908 2.960 0 50 GFAA CNC(=O)[C@H]1CN(C[C@@H]2CCCO[C@H]2c2ccc(C(F)(F)F)cc2)CCO1 953030359 QKLINOTVEGQIAW-UAGQMJEPSA-N 386.414 2.620 0 50 GFAA CN1CC[C@@H](N(C)C(=O)c2nn(-c3ccc(F)cc3)c3c2CCCCC3)C1=O 1875256616 DKSYHACSJUBLSW-GOSISDBHSA-N 384.455 2.583 0 50 GFAA CCC[C@@H]1CCCN(C(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)CC1 1875252851 CVAYMOQQWLUUCG-VFNWGFHPSA-N 386.496 2.853 0 50 GFAA CC(C)n1cc2c(n1)[C@@H](O)CC1(CCN(C(=O)c3cc(C4CC4)n(C)n3)CC1)O2 1875394433 IXBOYRVJSBAIMD-KRWDZBQOSA-N 399.495 2.566 0 50 GFAA CCn1nc2c(c1C(=O)NCc1nc3cc(OC)ccc3n1C)C[C@H](C)O[C@@H]2C 1875314406 WGSUBGSXNUDTDU-QWHCGFSZSA-N 397.479 2.751 0 50 GFAA COC[C@H]1CCCN(S(=O)(=O)N(C)CCCOc2ccccc2Cl)C1 952973007 RADLAJLEYBJFQQ-HNNXBMFYSA-N 390.933 2.644 0 50 GFAA Cc1ccc(NC(=O)CN(C)C)cc1NC(=O)C1CCN(Cc2ccco2)CC1 952970811 DNZDZILUVWSTRR-UHFFFAOYSA-N 398.507 2.939 0 50 GFAA CN1CCCC[C@H]1CCN1CCN(CC(=O)Nc2ccccc2Cl)CC1 272436660 BMGSNOWIAZZGLK-KRWDZBQOSA-N 378.948 2.771 0 50 GFAA CC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]2CN(C(=O)c2ccccn2)C3)s1 1565516337 SHWIILJPHMWZIR-CABCVRRESA-N 383.473 2.723 0 50 GFAA C[C@H](O)[C@@](C)(CNC(=O)CCN1C(=O)COc2ccccc21)Cc1ccccc1 170611686 IXROESUSKBHBAA-GAJHUEQPSA-N 396.487 2.548 0 50 GFAA O=C(NCc1cccc(CO)c1)NC1CCN(Cc2ccc(F)c(F)c2)CC1 171648625 CICZPLPGZWRFOR-UHFFFAOYSA-N 389.446 2.921 0 50 GFAA Cc1cc(C(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)ccc1-n1cncn1 173088410 FCWNFSFMNIDBGB-INIZCTEOSA-N 395.507 2.686 0 50 GFAA CCc1nc(CN2CCC(CNC(=O)[C@H](C)n3cnc4ccccc43)CC2)no1 1506410795 XKTILUDEPIIKPK-HNNXBMFYSA-N 396.495 2.571 0 50 GFAA O=C(c1cccnc1)N1CCC(NC[C@H]2CCN(c3ccc(F)cc3)C2)CC1 1506398367 YUIIGYFVDUOVTR-QGZVFWFLSA-N 382.483 2.941 0 50 GFAA COc1cc(OC)c2nc(N3C[C@@H](O)[C@H](Cc4ccccn4)C3)cc(C)c2c1 1529178086 HQFXTCRPTRKZQU-DNVCBOLYSA-N 379.460 2.995 0 50 GFAA COc1ccc(CCCN2C(=O)O[C@H]3CN(C(=O)NC(C)(C)C)C[C@H]32)cc1 205927234 VWQHYHDIGROZCW-SJORKVTESA-N 375.469 2.641 0 50 GFAA CC[C@@H]1CN(C(=O)CCSc2nnc(-c3ccncc3)o2)CC[C@]1(C)O 211454005 ZVISOOVXCMJEMI-KDOFPFPSSA-N 376.482 2.623 0 50 GFAA COc1cc(-c2onc(N(C)C)c2C(=O)N2CCC(C)(CO)CC2)ccc1F 1704313641 LBYULQDKYDRJGU-UHFFFAOYSA-N 391.443 2.790 0 50 GFAA Cc1noc(C)c1-c1nc2c(s1)CC[C@H](C(=O)N[C@H]1CC[C@H](O)CC1)C2 1772807083 IUQNWTSKWLGDEU-IHRRRGAJSA-N 375.494 2.940 0 50 GFAA CN(CC1CCN(CCc2cccc(F)c2)CC1)C(=O)CCN1CCCO1 12455544 MYCKWYHZBFYVMP-UHFFFAOYSA-N 377.504 2.566 0 50 GFAA CN1CCC[C@H](CN(CCc2ccccc2)C(=O)Cn2nc3ccccc3n2)C1 12709464 KVSVHNIJNAHQPJ-FQEVSTJZSA-N 391.519 2.844 0 50 GFAA CN1CCN(C(=O)c2cnn3c2N[C@H](c2ccccc2)C[C@H]3C(F)(F)F)CC1 13124601 YHYMFGJYGJMYJJ-HOTGVXAUSA-N 393.413 2.931 0 50 GFAA COc1cc(CNC2CCCCCC2)ccc1OC[C@H](O)CN1CCOCC1 15069516 CKKZUHJILSPZKK-HXUWFJFHSA-N 392.540 2.580 0 50 GFAA CCc1ccccc1N1C[C@H](c2nnc(NC(=O)[C@H]3CCCO3)s2)CC1=O 16626079 NUGYZFQAWNKKRT-UKRRQHHQSA-N 386.477 2.739 0 50 GFAA CCOC(=O)CCNC(=O)C1CCN(c2nc3ccc(Cl)cc3o2)CC1 1857671648 NKKQWKUJSDGJNA-UHFFFAOYSA-N 379.844 2.767 0 50 GFAA CCCCN1CCOC2(CCN(C(=O)c3nn(C)c4ccccc34)CC2)CC1=O 1857682690 YXLRZZJEGNUHGX-UHFFFAOYSA-N 398.507 2.597 0 50 GFAA Cc1cc(C(=O)N2CCC3(CC2)CC(=O)N(CCC(C)(C)C)CCO3)no1 1857685071 BKVUAALIVZFLRJ-UHFFFAOYSA-N 377.485 2.643 0 50 GFAA Cc1ccc(C(=O)N2CCC[C@]3(C2)CN(c2nccc(C)n2)CC[C@H]3O)cc1 1857699103 HTQLYVHGQDWCSY-KNQAVFIVSA-N 380.492 2.587 0 50 GFAA COc1ccc2oc(N3CCC[C@H](CC(=O)NCC(C)(C)CO)C3)nc2c1 1857726642 ASWDFTCMOLUJKM-CQSZACIVSA-N 375.469 2.578 0 50 GFAA COc1ccc([C@H]2[C@H](CO)OCCN2CC2=Cc3ccccc3OC2)cc1OC 1875245643 JYFAVFCGCAYRCU-GOTSBHOMSA-N 397.471 2.914 0 50 GFAA Cc1cc(C)c(CN2CC[C@@H](O)[C@](CC3CC3)(C(=O)O)C2)c(-n2cccn2)c1 1875250028 RYWFCCAUMSSBOP-IFMALSPDSA-N 383.492 2.927 0 50 GFAA NC(=O)c1ccc(C(=O)N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)cn1 125123342 LEMUJKJFMHMPGZ-LBPRGKRZSA-N 380.231 2.781 0 50 GFAA Cc1ccc(N2CCCN([C@@H]3CCCN(c4ccccc4F)C3=O)CC2)nn1 156964798 NABIVNGEABECFE-LJQANCHMSA-N 383.471 2.632 0 50 GFAA CCOC(=O)c1nn(Cc2ccncc2)c2c1CN(C(=O)c1cccs1)CC2 14530444 IFHYKWFMCCBDDY-UHFFFAOYSA-N 396.472 2.763 0 50 GFAA NC[C@H](NC(=O)c1cnc2c(c1)NC(=O)CS2)c1ccc2ccccc2c1 2325857145 QSVHNNWFUAKZLV-KRWDZBQOSA-N 378.457 2.709 0 50 GFAA N[C@@H]1CCc2nc(C(=O)Nc3nccc4ccc(Br)cc34)cn2C1 2325857264 VNZXJEDMXFNRTF-GFCCVEGCSA-N 386.253 2.720 0 50 GFAA C[C@@H](CNC(=O)c1cc2ccc(Br)cc2c(O)n1)c1ncc[nH]1 2325857346 YIFRHEUOSNBQSZ-VIFPVBQESA-N 375.226 2.960 0 50 GFAA C=CC(=O)N(C)CC(=O)N1CCc2nc(-c3ccccc3Cl)sc2C1 2325884681 LUSZJYFLNIAUES-UHFFFAOYSA-N 375.881 2.993 0 50 GFAA Cc1nn(C(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)c(C)c1Br 827997 ZPKBAFZZJJOWFU-JTQLQIEISA-N 376.210 2.587 0 50 GFAA Cc1ccc(C(=O)N2CCOCC2)cc1S(=O)(=O)Nc1cccc(C)c1C 1072713 MBLNGRIBJFYYBR-UHFFFAOYSA-N 388.489 2.885 0 50 GFAA COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2SC)cc1C 2879041 LZCDFZFPUFVWDN-UHFFFAOYSA-N 394.518 2.985 0 50 GFAA O=C(NC[C@@H]1CCCO1)c1ccc2c(=O)n(-c3ccccc3)c(S)nc2c1 3630361 CPMUAWDJQQAPHB-HNNXBMFYSA-N 381.457 2.583 0 50 GFAA CCN1CCC[C@H]1CNC(=O)c1c(O)c2cc(F)cc3c2n(c1=O)[C@H](C)CC3 4310745 IZCPPOVZLXYGBM-DOMZBBRYSA-N 387.455 2.568 0 50 GFAA CCCOc1ccc([C@@H](CC(=O)O)NS(=O)(=O)c2ccc(OC)cc2)cc1 4593251 JEPWZBLHBHKGDY-GOSISDBHSA-N 393.461 2.978 0 50 GFAA Cc1cc(C)cc(N(CC(=O)NCCSc2ccccc2)S(C)(=O)=O)c1 5853887 QKQCYSLLLSZNKN-UHFFFAOYSA-N 392.546 2.978 0 50 GFAA Cc1cccc(NC(=O)N2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)c1 9876008 QXGZSUUAWHJXLT-LJQANCHMSA-N 381.432 2.511 0 50 GFAA CN(C[C@@H](O)COc1ccccc1CNCCc1c[nH]cn1)C1CCCCC1 11935574 GQEITRZCGSXUMW-OAQYLSRUSA-N 386.540 2.746 0 50 GFAA CC(C)N(Cc1nccn1C)C(=O)[C@@H]1CCC(=O)N(CCc2ccccc2)C1 12441722 VRAOPXIQMSWBFW-LJQANCHMSA-N 382.508 2.638 0 50 GFAA COc1ccc(OC)c(CC(=O)N[C@H]2CCCN(C3Cc4ccccc4C3)C2)c1 12456221 PZELYTSMHONUSS-FQEVSTJZSA-N 394.515 2.994 0 50 GFAA COc1cccc(CN2C[C@H](OCC3CC3)CN(C(=O)c3ccoc3)CC2=O)c1 14539622 IAZFTXNOVWXCHR-FQEVSTJZSA-N 398.459 2.568 0 50 GFAA CCOC(=O)N1CCN(C[C@@H](O)COc2ccc(OC)cc2C(C)(C)C)CC1 19809548 UTLRJQAYMIBHKS-MRXNPFEDSA-N 394.512 2.507 0 50 GFAA CNC(=O)[C@@H]1C[C@H](NC2C3CC4CC(C3)CC2C4)CN1C1Cc2ccccc2C1 20234191 DRDCAZBCYKNDES-LIKWVBFBSA-N 393.575 2.757 0 50 GFAA CC(C)CN1C[C@@H](OCc2ccncc2)CN(Cc2ccc(O)cc2)CC1=O 20856172 RPJOKTVVMITWNO-NRFANRHFSA-N 383.492 2.673 0 50 GFAA COC(=O)c1ccc(CN2CCN(CCCc3ccccc3)[C@@H](CCO)C2)cc1 22932701 GZNTUQIPBYHOHS-QHCPKHFHSA-N 396.531 2.975 0 50 GFAA COc1ccc(C(=O)Cn2nc(-c3ccc(OC)c(OC)c3)ccc2=O)cc1 38790929 XVVCDRMFCGHTTN-UHFFFAOYSA-N 380.400 2.819 0 50 GFAA COc1ccccc1NC(=O)N1CCN(c2cc(C)nc(N3CCCC3)n2)CC1 64800052 IWQHHLSFBLHRAD-UHFFFAOYSA-N 396.495 2.748 0 50 GFAA O=C(NC1CC1)[C@H]1CCCN(C2CCN(Cc3c(F)cccc3F)CC2)C1 67434158 COQOYXKUBGUZGC-HNNXBMFYSA-N 377.479 2.920 0 50 GFAA COCc1ncc(CN2CCC[C@]3(CCN(C(=O)c4ccc(F)cc4)C3)C2)cn1 67514038 BOMHVNNYOUXMIG-QFIPXVFZSA-N 398.482 2.890 0 50 GFAA Cc1nc(CCC(=O)N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)n[nH]1 72419966 QARVQWUWVGVXPO-JOCHJYFZSA-N 381.524 2.951 0 50 GFAA COc1ccc2c(c1)OC[C@@H](CNC(=O)c1cccc(Cn3cccn3)c1)C2 91444491 HDEPIBRSSVKQCA-QGZVFWFLSA-N 377.444 2.921 0 50 GFAA COc1ccc(-c2cc(C(=O)N(CCC(N)=O)Cc3ccccc3)[nH]n2)cc1 91680128 LVRAFUIRHPUSHR-UHFFFAOYSA-N 378.432 2.603 0 50 GFAA Cc1oc(-c2cccc(F)c2)nc1CN1CCN(C)[C@]2(CCNC(=O)CC2)C1 107410459 GJJXEEPZNDHDJU-OAQYLSRUSA-N 386.471 2.575 0 50 GFAA Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C[C@H]2OCCc3ccccc32)cc1 129658202 DMDPXNGJHNGCKK-OXJNMPFZSA-N 387.501 2.978 0 50 GFAA Cc1nc(-c2c3n(c(=O)n(Cc4ccccc4Cl)c2=O)CCCCC3)no1 169771817 MLHFNFQGAPIUGZ-UHFFFAOYSA-N 386.839 2.797 0 50 GFAA O=C(Cc1ccc2c(c1)CCC2)N1CCN(C(=O)c2ccc(F)cc2F)CC1 170712511 AYRRBETYWVGZLQ-UHFFFAOYSA-N 384.426 2.981 0 50 GFAA CCN1CCN(c2ccccc2NC(=O)N2CCC[C@H](c3ccn[nH]3)C2)CC1 171138068 RQTFIRVMRXHKEL-KRWDZBQOSA-N 382.512 2.963 0 50 GFAA COc1ccc(CN2CC[C@@H](NC(=O)c3nccc4ccccc34)C2=O)cc1 172262017 SFXLKGXEUBBHDK-LJQANCHMSA-N 375.428 2.774 0 50 GFAA C[C@H](Cc1ccsc1)N(C)C(=O)c1ccc(N2CCCS2(=O)=O)cc1 175101128 OTRBNJQAZCZSOV-CQSZACIVSA-N 378.519 2.991 0 50 GFAA O=C(O)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CCO1 178279956 RZJPYJQNPCVHPT-LJQANCHMSA-N 380.375 2.967 0 50 GFAA CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)C(=O)Nc1nnc(C(F)F)s1 188741418 USYCDWJIXALWTI-KRWDZBQOSA-N 397.451 2.576 0 50 GFAA CN(Cc1cccnc1)C[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)s2)C1 192936833 CMDFIQMAPYCTAX-AWEZNQCLSA-N 385.942 2.939 0 50 GFAA Cc1cc(C)nc(NC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2C)n1 225492332 FIXMJVNENGBNHZ-UHFFFAOYSA-N 388.493 2.829 0 50 GFAA CCN1C(=O)c2ccc(C(=O)N[C@H]3C[C@H]4CC[C@@]3(C)C4(C)C)cc2S1(=O)=O 229864045 BEQTYKPGLOADGY-JOTOCRJQSA-N 390.505 2.796 0 50 GFAA C[C@@H]1[C@@H](NC(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)CCC[C@H]1C 248166824 RXYOYKPUJVQAKL-QMERHICCSA-N 393.434 2.673 0 50 GFAA CC[C@@H]1CCCCN1C(=O)[C@@H](C)N1CCCN(Cc2nc(C)c(C)o2)CC1 370812318 VBXQGDPXKIHVBE-IEBWSBKVSA-N 376.545 2.979 0 50 GFAA O=C(NCc1ccc(-n2cccn2)cc1)N1CCC(N2CCSCC2)CC1 426368250 JBZZOWRWWZCOHQ-UHFFFAOYSA-N 385.537 2.595 0 50 GFAA Cc1noc(C)c1CN1CC[C@@H](NC(=O)c2cccc3ccccc23)[C@H](O)C1 426578547 FZOSBTOPTMLCQV-NHCUHLMSSA-N 379.460 2.810 0 50 GFAA Cc1cc(C)c(C[C@@H](C(=O)N2CCn3c(O)nnc3C2)C(F)(F)F)c(C)c1 438430471 NLEUGIDNMFNBDU-AWEZNQCLSA-N 382.386 2.672 0 50 GFAA CCCc1nc(CN(CC)C(=O)NC2CCN(C(=O)CC(C)C)CC2)no1 584899109 MUHIEJDJRGJMLF-UHFFFAOYSA-N 379.505 2.591 0 50 GFAA Cc1c(NC(=O)C2CCN(C(=O)c3cccnc3)CC2)n[nH]c1C(F)(F)F 746399535 YSYLXWICGIDDAI-UHFFFAOYSA-N 381.358 2.623 0 50 GFAA O=C1CCCCN1CCCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1 825584045 YBGGPLVNFLQPPM-UHFFFAOYSA-N 377.916 2.777 0 50 GFAA Cc1cc(CC(=O)NCC2CCN(Cc3cnn(-c4ccccc4)c3)CC2)on1 827861474 HQSWYNNCDXGABR-UHFFFAOYSA-N 393.491 2.740 0 50 GFAA C[C@@H]1CN(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)C[C@]1(C)CO 888101908 KEPBDPOZULKPLC-AUUYWEPGSA-N 382.526 2.882 0 50 GFAA Cc1nc(-c2cccc(NC(=O)C(=O)NCCSc3ccccc3F)c2)n[nH]1 952874848 BZTOMTHESFEDLT-UHFFFAOYSA-N 399.451 2.766 0 50 GFAA Cc1nn(Cc2ccccc2)c(C)c1[C@@H]1COCCN1C(=O)C=C1CCNCC1 952895020 QNHRHIYWPTTYHW-NRFANRHFSA-N 394.519 2.758 0 50 GFAA Cc1cc(CC(C)C)nc(N2CC[C@H](NCC3CCN(C(=O)C4CC4)CC3)C2)n1 952984056 ZKQJFROFKFQNHL-FQEVSTJZSA-N 399.583 2.800 0 50 GFAA CC(=O)c1cc2c(cc1NC(=O)[C@H]1CC(=O)Nc3ccc(F)cc31)OCCO2 952989523 RSKGIBFPNULCBW-AWEZNQCLSA-N 384.363 2.864 0 50 GFAA CCN(CC)Cc1cc(CN2CCN3[C@@H](C4CC4)COC[C@H]3C2)ccc1OC 1529120536 ADCAQZJZFCPBFJ-FGZHOGPDSA-N 387.568 2.832 0 50 GFAA NC(=O)[C@H]1CC=CC[C@@H]1NCc1cc(-c2cccs2)ccc1OCC(=O)O 1616094793 VNEMPIBVAZNTEA-HOTGVXAUSA-N 386.473 2.788 0 50 GFAA Cc1ccc(CN2C[C@H]3CN(C4CCOCC4)C[C@@]3(CCC(=O)O)C2)s1 1772703342 ZSTCMDBAWGYLOX-OXJNMPFZSA-N 378.538 2.834 0 50 GFAA CCOc1ccc(-c2nccn2-c2ccc(N3CCN(C)CC3)nc2)cc1CO 1772807358 UDLBWQXWCPJCKB-UHFFFAOYSA-N 393.491 2.577 0 50 GFAA O=C(C[C@@H]1CCCN(c2nc3ncccc3o2)C1)NCCCc1ccccn1 1857667308 KKTYSDRQKSWEHZ-INIZCTEOSA-N 379.464 2.973 0 50 GFAA O=C(c1n[nH]c2ccccc12)N1CC[C@H]2[C@@H]1CC(=O)N2C1Cc2ccccc2C1 1857687706 AQJRBNAVPOLHMT-PMACEKPBSA-N 386.455 2.546 0 50 GFAA O=C(c1cnc[nH]1)N1CCC[C@@]2(CCc3c2nc(C2CC2)[nH]c3=NC2CCC2)C1 1875242817 CXYUFKOFZZWPID-JOCHJYFZSA-N 392.507 2.584 0 50 GFAA Cc1ccc(N2CCC(C(=O)N[C@](C)(Cc3ccccc3)C(=O)O)CC2)nc1 1875270925 JANCAQIBXMQDSP-JOCHJYFZSA-N 381.476 2.809 0 50 GFAA O=C(N[C@@H]1CCCN(c2cc(C(F)(F)F)cc(CO)n2)C1)c1ccccc1 1875287089 UYVPSMZSZARLJK-OAHLLOKOSA-N 379.382 2.992 0 50 GFAA COCCOc1ccc(Cl)cc1S(=O)(=O)NC(=O)c1ccc(F)s1 1875312497 FDFCOOJVDNTVTJ-UHFFFAOYSA-N 393.845 2.685 0 50 GFAA NC[C@@H](NC(=O)NCc1cc2cc(Br)ccc2o1)C(F)(F)F 1875320131 HWWGNKXPCFNIHR-LLVKDONJSA-N 380.164 2.884 0 50 GFAA CCc1ccccc1NC(=O)c1cc(-c2ccco2)n2cnc(C(N)=O)c2n1 1875350236 FVMURRGVWNVANZ-UHFFFAOYSA-N 375.388 2.903 0 50 GFAA O=c1c(Br)c(NC2CC(c3ncc[nH]3)C2)cnn1CC(F)(F)F 1875404380 HJPZMWYJAHYYJH-UHFFFAOYSA-N 392.179 2.649 0 50 GFAA O=C(C[C@H]1CN(C(=O)C2=CCCC2)C2(CCC2)CO1)N1CCC[C@@H]1c1ncc[nH]1 2325785068 AAXKKCHMJPLLRO-ZWKOTPCHSA-N 398.507 2.724 0 50 GFAA C[C@](NC(=O)c1ccc2c(n1)CCOC2)(C(=O)O)c1ccc(C(F)(F)F)cc1 2325798821 BXYZAOBKZPVSCB-GOSISDBHSA-N 394.349 2.903 0 50 GFAA C[C@@]1(CO)COCCN(C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)C1 2325800910 MJUFTLSUIVXVCP-OAQYLSRUSA-N 389.398 2.667 0 50 GFAA Cn1cncc1C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2392285 UEDYXEZHNPXCFB-FQEVSTJZSA-N 391.427 2.955 0 50 GFAA Cc1[nH]nc(-c2ccccc2)c1C(=O)N1CCC[C@@]2(CCc3c[nH]c(=N)nc32)C1 2356162203 BTXYPPDRBYHCIV-JOCHJYFZSA-N 388.475 2.708 0 50 GFAA CCc1ccc(NC(=O)[C@H]2CCCN2c2nn3c(=O)cc(C)nc3s2)cc1 6807221 DODDANQDTHKCBE-OAHLLOKOSA-N 383.477 2.629 0 50 GFAA COc1ccc(-n2c(SCC(=O)Nc3ccc(C)cc3)nc(O)cc2=O)cc1 8571888 BEYNICTVNKGFPB-UHFFFAOYSA-N 397.456 2.986 0 50 GFAA COc1ccc(-c2cc(=O)[nH]c(N3CCN(c4ccc(F)cc4)CC3)n2)cc1 9096600 MSOWLEQFGHORJR-UHFFFAOYSA-N 380.423 2.911 0 50 GFAA C[C@H](NC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)[C@H]1C[C@H]2CC[C@H]1C2 248266896 TVCGGRWCWYNRMB-YXISZKLHSA-N 384.476 2.752 0 50 GFAA O=C1CC[C@H](C(=O)N2CCN(Cc3cccnc3)CC2)CN1CC1CCCCC1 20774860 DSSQJSMZDCVTAK-NRFANRHFSA-N 398.551 2.545 0 50 GFAA Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)N[C@H](C)CCO)cc1 864097599 YEGJROFIKRQTHU-OAHLLOKOSA-N 391.493 2.997 0 50 GFAA O=C(NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1cnc(OCC2CC2)c(Cl)c1 242263443 XZEXWJRVTHPPNJ-WMLDXEAASA-N 394.899 2.821 0 50 GFAA Cc1ccccc1-c1nc(CN2CCN(c3ncccc3C(N)=O)CC2)c(C)o1 67886059 FZCJDCLMFRYPLF-UHFFFAOYSA-N 391.475 2.775 0 50 GFAA CN(C)C(=O)[C@@H]1C[C@@H](Sc2nccn2C)CN1Cc1ccccc1Cl 11789317 NRNFOBPVDUFNFQ-ZBFHGGJFSA-N 378.929 2.897 0 50 GFAA CCc1nc(-c2ccc(C(=O)N[C@H]3CCN(c4ncccc4F)C3)cc2)n[nH]1 129821044 OGHCYHKWRNWSDF-HNNXBMFYSA-N 380.427 2.577 0 50 GFAA COCCc1nc2ccc(C(=O)NCCCn3nnc4ccccc43)cc2o1 11814169 VBOUKEVMNINKDC-UHFFFAOYSA-N 379.420 2.582 0 50 GFAA Nc1nc(CC(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)cs1 1996784 PBAPPPCECJKMCM-IBGZPJMESA-N 396.516 2.772 0 50 GFAA biogenic,fda O=C(NC1=NCCS1)c1ccn(COc2ccc(Br)cc2)n1 2787723 BXRVRKUQIHPBOJ-UHFFFAOYSA-N 381.255 2.515 0 50 GFAA O=C(NCC1CCN(Cc2cccs2)CC1)c1ccc(N2CCNC2=O)cc1 145757815 JWEXHRAZWWSBPZ-UHFFFAOYSA-N 398.532 2.920 0 50 GFAA COc1ccc(CN2CCN(C(=O)c3ccc(F)c(F)c3F)CC2=O)cc1 77519753 MWXAPXZWMLKAAC-UHFFFAOYSA-N 378.350 2.597 0 50 GFAA Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)NC2CCN(c3cccnn3)CC2)cc1 373787333 NRDPHQPHZIGLJI-FPOVZHCZSA-N 395.507 2.973 0 50 GFAA CC(=O)Nc1ccc(F)c(C(=O)N2CCn3c(Cc4ccccc4)nnc3C2)c1 377814478 OLNGYLAELOUYBA-UHFFFAOYSA-N 393.422 2.622 0 50 GFAA Cc1oc(-c2ccccc2Cl)nc1CN1CCCN(S(C)(=O)=O)CC1 72453468 PZUSNLRBOCWFNX-UHFFFAOYSA-N 383.901 2.771 0 50 GFAA COc1ccccc1O[C@@H](C)C(=O)NCc1ccccc1CN1CCOCC1 72119189 RTIBSAQXOWSMSC-KRWDZBQOSA-N 384.476 2.611 0 50 GFAA COc1cccc(N2CCN(Cc3cn(C)nc3-c3ccccc3)CC2=O)c1 82156883 LOAZTXQZWQXLDG-UHFFFAOYSA-N 376.460 2.945 0 50 GFAA Cc1cnc(-c2ccc(C(=O)N[C@H](C)Cc3cnccn3)cc2)nc1N(C)C 426690785 YIAORMNETZIXKS-OAHLLOKOSA-N 376.464 2.669 0 50 GFAA COCCn1ccnc1[C@H]1CCCN(C(=O)Cc2csc(C(C)=O)c2)C1 95499670 IDTQYJYCGIACCI-INIZCTEOSA-N 375.494 2.742 0 50 GFAA Cc1cc(C[C@@H]2COC[C@@H]2NC(=O)c2cccc(-n3nc(C)cc3C)c2)on1 95363867 VRSITECQFRYOIG-XLIONFOSSA-N 380.448 2.773 0 50 GFAA COc1ccc([C@H](C(=O)O)N2CCC(C(=O)N3CCCCC3)CC2)cc1F 95371851 IRNVBZMFYFTFOG-GOSISDBHSA-N 378.444 2.685 0 50 GFAA Cc1nc(CN(C)C(=O)c2ccc(-c3ccc(C(=O)NC4CC4)o3)cc2)no1 426487946 HVCQNCFFMZUJTJ-UHFFFAOYSA-N 380.404 2.802 0 50 GFAA CN(Cc1noc2c1CCCC2)C(=O)NCC1(N2CCOCC2)CCCCC1 426618334 MPWQIQMNZRRMKW-UHFFFAOYSA-N 390.528 2.730 0 50 GFAA CCn1ncc(C(=O)N2CCC[C@H](c3nccn3Cc3ccncc3)C2)c1C 95503362 YTUOOWPZKVNPDC-SFHVURJKSA-N 378.480 2.871 0 50 GFAA CC(=O)c1cc(C(=O)N2CCC[C@@H](c3nccn3CC3CC3)C2)c(=O)[nH]c1C 95520186 OCVNXILBMXMASX-MRXNPFEDSA-N 382.464 2.512 0 50 GFAA Nc1ncccc1CN1CCC2(CC1)CCN(Cc1ccccc1)C[C@@H]2CO 97179405 NVEQHRHIDLDHGI-OAQYLSRUSA-N 380.536 2.760 0 50 GFAA CN(C)Cc1nnc(C2CCN(Cc3cc(-c4ccccc4)no3)CC2)n1C 96164137 JLYGIVIIUODTNB-UHFFFAOYSA-N 380.496 2.911 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(C(=O)c1cccc(F)c1F)CC2 91679259 FJOLLUHJUSJALP-UHFFFAOYSA-N 380.435 2.846 0 50 GFAA COCC1(c2nc(-c3ccc(C(N)=O)cc3)nn2-c2ccc(OC)cc2)CC1 96132350 KZDDXPOHLFIFPN-UHFFFAOYSA-N 378.432 2.720 0 50 GFAA CCC(=O)Nc1cc(NC(=O)N2CCN(c3ccncc3)CC2)ccc1OC 96164974 JNPGOGDXOJKQAD-UHFFFAOYSA-N 383.452 2.793 0 50 GFAA COc1cccc(NC(=O)CCC2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)c1 95511350 WHGNUEFVMBFBGM-UHFFFAOYSA-N 383.448 2.655 0 50 GFAA O=C(NC[C@@H](c1cccnc1)N1CCCCC1)c1cc(=O)[nH]c2ccccc12 97610119 MWFHXWMIZGKGNY-FQEVSTJZSA-N 376.460 2.880 0 50 GFAA COc1cccc(-c2cc3c(=O)n(C[C@H](O)c4cccc(OC)c4)ccn3n2)c1 263619153 XFTDEBPFQFHUOO-NRFANRHFSA-N 391.427 2.914 0 50 GFAA C[C@@H](NC(=O)N1CCc2nnc(Cc3cccnc3)n2CC1)C1CCCCC1 534588184 QDFBPCBIWFZCRD-MRXNPFEDSA-N 382.512 2.800 0 50 GFAA CN(Cc1nnc(-c2ccccc2)o1)C(=O)NCCc1noc(C2CCC2)n1 584903484 CHOLVXPOJAFVDE-UHFFFAOYSA-N 382.424 2.771 0 50 GFAA CN[C@@H](Cc1ccccc1)C(=O)N1CCC2(CC1)C[C@@H](N)c1ccccc1O2 1875276706 ROOBXCKYCKLHOK-UXHICEINSA-N 379.504 2.661 0 50 GFAA CCc1cn2c(C(=O)Nc3nc(-c4ccc(OC)cc4OC)n[nH]3)cccc2n1 1875332184 JXHPCZAQBQLKGU-UHFFFAOYSA-N 392.419 2.951 0 50 GFAA COc1cc(C)cc(C)c1[C@@H](C)NC(=O)C1CCN(c2cc(O)ncn2)CC1 1875309854 QPTQZEDKCIHMFH-OAHLLOKOSA-N 384.480 2.901 0 50 GFAA Cc1c(C(=O)N2CCC[C@@H](CN)C2)sc2nc(Cc3ccccc3)nc(N)c12 1875311858 CORLDABMVLPXPP-HNNXBMFYSA-N 395.532 2.984 0 50 GFAA CCn1c(C)cc2cc(NC(=O)CN3CCN(c4ncccn4)CC3)ccc21 952974562 VBIJPFLUHMTQDN-UHFFFAOYSA-N 378.480 2.520 0 50 GFAA CCCCO[C@@H]1C[C@H](NC(=O)C(=O)Nc2ccc3c(c2)nc(C)n3C)C1(C)C 170652252 XDQKDQDJIDTESQ-ZWKOTPCHSA-N 386.496 2.920 0 50 GFAA O=C1Cc2ccccc2N1CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1 171110105 WQNMGWMEUSYVCN-UHFFFAOYSA-N 398.406 2.714 0 50 GFAA CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)C(C)(C)C)C(C)C)[C@@H]1Oc1ccccc1 409948578 BSSGKOHVPZVPCR-RDGPPVDQSA-N 390.524 2.915 0 50 GFAA CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N(C)Cc1nc2ccccc2n1C 111098185 XFZGQVGFDCAUKG-HXUWFJFHSA-N 376.460 2.505 0 50 GFAA O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1CCC(c2ccncc2)CC1 190587259 OLMHBNYTXHVNLZ-SFTDATJTSA-N 386.540 2.739 0 50 GFAA Cc1nc2cc(C(=O)N3CCOC[C@@]34CCOC4)ccc2n1-c1ccccc1 194428193 QNXQOZBSIHVXGD-QFIPXVFZSA-N 377.444 2.965 0 50 GFAA COc1cccc(N2CCN(c3cncc(C(=O)N4CCCC4)n3)CC2(C)C)c1 1529153553 FUMRKISGVIDWEY-UHFFFAOYSA-N 395.507 2.826 0 50 GFAA O=C(c1ccccc1NCc1ccccn1)N1C[C@@H](O)[C@H](Cc2ccccn2)C1 1704297333 MZPRBEIILOABJK-VGOFRKELSA-N 388.471 2.764 0 50 GFAA Cc1c(Cl)cccc1NC(=O)CC(=O)N1CCC2(CC1)C[C@](C)(O)CCO2 1704297238 SEKDDUPEEFNUBZ-LJQANCHMSA-N 394.899 2.900 0 50 GFAA O=C(c1cc(-c2cccnc2)nc2ccccc12)N1CCC([C@@H](O)CO)CC1 1772710968 VAKVUWSBDWBSBQ-NRFANRHFSA-N 377.444 2.502 0 50 GFAA Cc1c([C@H](C)NC(=O)c2ccccc2N2CCOCC2)cnn1-c1ccccn1 11818439 IBDBGQAKMHGOIV-INIZCTEOSA-N 391.475 2.903 0 50 GFAA CCc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4F)CC3)C2=O)cc1 19808833 GRDUOYWBTUCWBY-HXUWFJFHSA-N 381.451 2.842 0 50 GFAA COc1ccc(C(=O)N[C@H]2C[C@@H](Cn3cccn3)C[C@@H]2O)cc1OC1CCCC1 1857532806 AKRIGRCZHOPJNN-MNEFBYGVSA-N 399.491 2.783 0 50 GFAA CCc1nnc(N2C[C@H](C(=O)N(C)Cc3cccc4cccnc34)CC2=O)s1 1857667747 ILCVLFAINYEOJF-OAHLLOKOSA-N 395.488 2.660 0 50 GFAA Cc1ccc2oc(N3CCC(C(=O)N4CCC[C@@H](c5cc[nH]n5)C4)CC3)nc2n1 1857708227 WOABLCWPPRGZHY-MRXNPFEDSA-N 394.479 2.877 0 50 GFAA CCCn1cc(C(=O)N2CC[C@@]34O[C@@H](c5ccccc5)CN3C(=O)C[C@@H]24)c(C)n1 1857731216 CTRAQKPEYVMDIO-KNKQGSTJSA-N 394.475 2.516 0 50 GFAA CCNC(=O)c1ccc(N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)nn1 413187708 VVEVJXNGJVGJHS-OAHLLOKOSA-N 380.370 2.823 0 50 GFAA O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)[C@H]1CCCN(CC(F)(F)F)C1 246552085 MQSQVDCJPFAJJB-QWHCGFSZSA-N 390.837 2.704 0 50 GFAA Cc1ccc(CN2CC[C@H](N3CCN(c4ccccc4F)CC3)[C@@H](O)C2)s1 248048187 AJGKQLJLEPUZPS-SFTDATJTSA-N 389.540 2.953 0 50 GFAA CC1=C(CN2C[C@@H]3[C@H](CNS(C)(=O)=O)[C@H]4CC[C@]3(C2)O4)C(C)(C)CCC1 1704338596 WBWNOQYHAANWKS-ZCDKGFTFSA-N 382.570 2.542 0 50 GFAA COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(=O)[C@@]1(C)CC1(F)F 817731165 WRMMGFSKIHJZIV-LKFCYVNXSA-N 397.827 2.604 0 50 GFAA Cc1nc(N)nc(NC2CCN(C(=O)OC(C)(C)C)CC2)c1Br 1565504966 FORHHEQKZPRTPQ-UHFFFAOYSA-N 386.294 2.941 0 50 GFAA O=C(N=c1ccn(-c2ccc(Cl)cc2Cl)[nH]1)c1c[nH]nc1[C@H]1CCNC1 2325857657 KJLODGXCAAGKDQ-JTQLQIEISA-N 391.262 2.653 0 50 GFAA CC(C)(Oc1ccc(Cl)cc1)c1nn2c(CN3CCOCC3)nnc2s1 67622951 YPMSZYBEFRWJAP-UHFFFAOYSA-N 393.900 2.986 0 50 GFAA Cn1cc(CNc2ccc(C(=O)NCc3ccc(N4CCCC4)nc3)cc2)cn1 900113525 ABWAWJSQIDUMJH-UHFFFAOYSA-N 390.491 2.957 0 50 GFAA CS(=O)(=O)N(Cc1ccc(C(=O)NCc2ccccn2)cc1)c1ccccc1 839618 IJLRRGZTBUBIJD-UHFFFAOYSA-N 395.484 2.978 0 50 GFAA Cc1cccc(NC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1C 1119255 YDUIVMIRRYLSCR-UHFFFAOYSA-N 397.294 2.983 0 50 GFAA COc1ccc2cc(S(=O)(=O)N3CCC[C@@]34CCCN(C)C4=O)ccc2c1 2356152463 KREJIZLEXDYEGH-HXUWFJFHSA-N 388.489 2.624 0 50 GFAA c1ccc(CN2CCC(N3CCc4nc(C5CCOCC5)nn4CC3)CC2)cc1 2356167706 YZQVTNHJNJFGPM-UHFFFAOYSA-N 395.551 2.695 0 50 GFAA CC(C)(C)c1ccc(-n2ncc3c2CCC[C@H]3NC(=O)C2=NNC(=O)CC2)cc1 12595654 NFIQNGYHVQYLHW-QGZVFWFLSA-N 393.491 2.929 0 50 GFAA COc1cc(C2(C(=O)N3CCCN(c4ccc(C)nn4)CC3)CC2)ccc1C 109634821 RHNSRBBMPKHEAS-UHFFFAOYSA-N 380.492 2.873 0 50 GFAA CC(=O)Nc1cc(NC(=O)C(=O)N2Cc3ccc(O)cc3C3(CC3)C2)ccc1C 464159141 QZZJJSDLHMXPCT-UHFFFAOYSA-N 393.443 2.672 0 50 GFAA CC(C)N1CCC(N2CCN(Cc3ccc(F)cc3F)C[C@H]2CCO)CC1 104414286 GAPQAKLBBWOITG-HXUWFJFHSA-N 381.511 2.706 0 50 GFAA O=C(c1ccccc1)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)CC1 55269749 OZMHDJIBZCLBHO-UHFFFAOYSA-N 387.439 2.640 0 50 GFAA O=C(NC[C@H]1CCCC[C@H]1O)c1cc2n(n1)CCCN(Cc1ccccc1)C2 65532893 AQHRNNJTJBMTOF-WIYYLYMNSA-N 382.508 2.570 0 50 GFAA O=C1N[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2cccs2)[C@](O)(C(F)(F)F)N1 170595631 DJGDSNJZNRODIA-ZOWXZIJZSA-N 388.342 2.991 0 50 GFAA O=C(NCc1nc2c(s1)CCCC2)[C@H]1CC(Cc2ccc3c(c2)OCO3)=NO1 12279756 FGBXTGZHUBASFB-QGZVFWFLSA-N 399.472 2.754 0 50 GFAA O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1CC[C@@]2(CN=C(O)C2)C1 329886924 WUKKSOFYBMADRS-OWBJNKTJSA-N 399.535 2.773 0 50 GFAA C[C@H](NC(=O)CN1CCC[C@@H]1CN1CCC[C@H]1CO)c1ccc2c(c1)CCCC2 252674792 SNUYKGVHEPXUIG-NMNUPHIUSA-N 399.579 2.664 0 50 GFAA COc1nc2c(cc1CNC(=O)CC(C)(C)C)C(=O)N(CCc1ccccn1)C2 71747508 YDQSGSXMTVRCQY-UHFFFAOYSA-N 396.491 2.736 0 50 GFAA CC(=O)N1CCCN(C(=O)C[C@H](c2cccc(O)c2)c2ccccc2O)CC1 12716528 CSBIBMMAVUUMRA-HXUWFJFHSA-N 382.460 2.701 0 50 GFAA COCc1nc2n(n1)C[C@@H](NC(=O)NC1(c3ccccc3)CCCCC1)CC2 151175283 GTFQCIPEPMKZEO-KRWDZBQOSA-N 383.496 2.898 0 50 GFAA Cc1c(CC(=O)N2CCC[C@H](O)C2)c2c(n1Cc1ccccc1)CCCC2=O 39445424 KJJKUTCTUWDCSL-SFHVURJKSA-N 380.488 2.890 0 50 GFAA Cc1oc(C(=O)N2CCC[C@H]2[C@H]2CCCc3ccccc32)cc1S(N)(=O)=O 370394719 LXDCLZBPJWYJRE-IRXDYDNUSA-N 388.489 2.960 0 50 GFAA CC(C)c1ccc(-n2nnnc2S[C@H]2CCCN(c3cnn(C)c3)C2=O)cc1 133876882 KMPROLPFVORYGX-KRWDZBQOSA-N 397.508 2.807 0 50 GFAA O=C(Cc1n[nH]c(-c2cncc(Br)c2)n1)NCCc1ccccc1 32605330 BTIXCORBMZLHRE-UHFFFAOYSA-N 386.253 2.531 0 50 GFAA CCC[C@H](C)N1CC2(CCN(C(=O)CCc3n[nH]c(C)c3C)CC2)OC1=O 72448233 PQUDGJAXMYGGJT-AWEZNQCLSA-N 376.501 2.961 0 50 GFAA O=C1NC(=O)[C@@H](Cc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)cc2)N1 180066509 JSVBRMXPZCRCNI-GVDBMIGSSA-N 383.835 2.833 0 50 GFAA O=C(c1cccc(-c2cccc(O)n2)c1)N1CCC[C@H](C(=O)N2CCCC2)C1 426525774 BCYROIAIMLQPHQ-SFHVURJKSA-N 379.460 2.929 0 50 GFAA CCc1nn(C)c(OC)c1CNC(=O)NCc1csc(-c2ccco2)n1 180392919 BCWVIZIBIAIEKX-UHFFFAOYSA-N 375.454 2.707 0 50 GFAA CC(=O)N[C@@H]1CN(Cc2cc3cc(C)ccc3[nH]c2=O)C[C@H]1c1ccc(C)o1 91326896 UEWQKUIVWHEHFO-UYAOXDASSA-N 379.460 2.842 0 50 GFAA Cc1ncsc1C(=O)N1CCC[C@]2(CCC(=O)N(CCc3ccccn3)C2)C1 95506398 ZYZLDRYELUWEBF-OAQYLSRUSA-N 398.532 2.934 0 50 GFAA CC(=O)c1cc(CN2CCC[C@H](c3nnc(Cn4ccnc4)n3C)C2)cs1 95368903 HESBWIDBFGOUGM-INIZCTEOSA-N 384.509 2.704 0 50 GFAA CN1CCC(Cc2nc(-c3ccc(=O)[nH]c3)n(CCc3ccccc3)n2)CC1 95519683 DLMPCQPOGJWWIG-UHFFFAOYSA-N 377.492 2.760 0 50 GFAA CC(C)c1nccn1CCCNC(=O)c1ccc(N[C@H]2CC[C@H](O)CC2)nc1 244795428 RGGANVPBPKFMLE-IYARVYRRSA-N 385.512 2.937 0 50 GFAA Cc1cc(C)n(-c2ccc(NC(=O)N3CC[S@](=O)C[C@H](C)C3)cc2F)n1 297640771 IJPGVXMQPYKFGG-RYZVSIALSA-N 378.473 2.861 0 50 GFAA CC[C@@H](NS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)[nH]n2)o1)[C@H]1C[C@@H](O)C1 244874933 XJVNEPNWUNTXQU-KXUCPTDWSA-N 393.387 2.516 0 50 GFAA CCc1cc(=O)oc2cc(O[C@H](C)C(=O)NCc3noc(C4CC4)n3)ccc12 823498917 XGSKWQTWCBOSLG-LLVKDONJSA-N 383.404 2.700 0 50 GFAA Cc1ccc(-c2cc(C(=O)NC[C@H](c3cccnc3)N3CCOCC3)n[nH]2)cc1 825180626 OIPSEUBCOBYCKN-OAQYLSRUSA-N 391.475 2.583 0 50 GFAA O=C(N[C@H]1CCCN(Cc2cccs2)C1)c1cnc(-c2ccccn2)nc1 828199586 JWVCWFMWLKKEHU-INIZCTEOSA-N 379.489 2.995 0 50 GFAA COc1cc2c(cc1F)CC[C@H]2NC(=O)[C@H](c1ccccc1)n1nnnc1C 1875294451 SHTGLQUSIQOYJC-MJGOQNOKSA-N 381.411 2.522 0 50 GFAA COc1ccc(C)cc1NC(=O)Cn1c(C)cc2nc3n(c(=O)c21)CCCC3 169778391 NSRMULGAAPZWJU-UHFFFAOYSA-N 380.448 2.798 0 50 GFAA NC(=O)COc1cccc(C(=O)Nc2ccc(OC[C@H]3CCCCO3)cc2)c1 952968844 LUVZJTWQHDZAEJ-LJQANCHMSA-N 384.432 2.751 0 50 GFAA COCCNC(=O)c1cccc(NC(=O)[C@H](C)N(C)C2CCCCC2)c1C 952986306 GTQDKQZXSPWJLJ-INIZCTEOSA-N 375.513 2.963 0 50 GFAA COCCCN1CC[C@@H](CNCc2ccccc2OCCCn2ccnc2)C1 952982197 JWSDAYFWHRWHHZ-FQEVSTJZSA-N 386.540 2.800 0 50 GFAA CS(=O)(=O)c1ccc(CNC(=O)NC2CCC3(CCOCC3)CC2)s1 1343413197 CCJZLBSMQNOMDO-UHFFFAOYSA-N 386.539 2.690 0 50 GFAA COc1cc(CN2C[C@@H]3CC[C@H]2CN(C(=O)c2ccncc2)C3)cc(OC)c1 1565525706 BFUDRXJLAOGMCQ-LPHOPBHVSA-N 381.476 2.835 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCCN(c3cccnn3)CC2)ncn1 275700896 NMUVZWAVWGEZBA-UWJYYQICSA-N 397.527 2.599 0 50 GFAA CC(C)[C@@H]1OCCC[C@@H]1Nc1cc(N2CCC[C@@H](Cn3ccnn3)C2)ncn1 275707936 NYRQANWLMXJKPJ-UWVAXJGDSA-N 385.516 2.600 0 50 GFAA COC(=O)[C@H]1CCN2C(=O)N(c3ccc(OC(C)C)c(Cl)c3)C(=O)[C@H]2C1 277948522 CJEMQBWHXRPTRT-SMDDNHRTSA-N 380.828 2.847 0 50 GFAA COc1c(F)c(F)c(CN2C[C@@H]3CC[C@H]2CN(C(=O)N(C)C)C3)c(F)c1F 1073403770 HWHUNDDYPHZEHQ-QWRGUYRKSA-N 389.393 2.829 0 50 GFAA COC1CCC(CC(=O)NS(=O)(=O)c2ccc(C(F)(F)F)cn2)CC1 170590991 HHBWHWKPVWWESX-UHFFFAOYSA-N 380.388 2.501 0 50 GFAA O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)c1ccc(Cl)c(Cl)c1 195316731 YEFCTMCIJSAHED-JSBGKLSNSA-N 377.227 2.691 0 50 GFAA CCN(C[C@H](O)c1cccc(O)c1)S(=O)(=O)c1cc(C)c(C)cc1OC 1506400069 HSADNLUSBVKUAC-KRWDZBQOSA-N 379.478 2.762 0 50 GFAA Cc1ccc2oc(N3CCC(CNC(=O)c4cc5ncccn5n4)CC3)nc2c1 1506416972 HFFLCOQBUPMVFW-UHFFFAOYSA-N 390.447 2.825 0 50 GFAA CC[C@]1(C(=O)NCc2ccc3c(c2)CCCC3)C[C@H]2CC[C@@H]1N2C(=O)COC 1704339535 LHJBUVGJBCBQQR-QTEQDKRBSA-N 384.520 2.988 0 50 GFAA CC(=O)N1C[C@H]2CN(CCn3cc(Cl)cn3)C[C@]2(CCc2ccccc2)C1 1772705389 HHYSOZAVDCTKGX-TZIWHRDSSA-N 386.927 2.950 0 50 GFAA COCCN(CC1CCN(Cc2ccccc2OC)CC1)C(=O)CSC 11814127 BTAKFIGCRMTGJW-UHFFFAOYSA-N 380.554 2.745 0 50 GFAA CCN(CC)C[C@@H](O)COc1ccc(CN(C)Cc2nccs2)cc1OC 11839324 KPCKNVPZBCRJAA-QGZVFWFLSA-N 393.553 2.865 0 50 GFAA O=C(Cc1ccccn1)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 11937190 OHLFRRXBRJKPCF-HNNXBMFYSA-N 377.366 2.560 0 50 GFAA Cc1cccc(-c2cccc(NC(=O)[C@@H]3CCCN3C(=O)C3(C(N)=O)CC3)c2)c1 12200166 NGLNJHWJWSUBPU-IBGZPJMESA-N 391.471 2.857 0 50 GFAA COc1ccc(NC(=O)CCC2CCN(C(=O)[C@H]3CCCO3)CC2)c(OC)c1 12438903 NARZDSOBKSCJGT-GOSISDBHSA-N 390.480 2.840 0 50 GFAA CC1=C(C(=O)N2CC[C@@]3(CCCN(Cc4cccc(C)c4)C3=O)C2)OCCO1 12465338 JRGQNFOMHLWEPW-QFIPXVFZSA-N 384.476 2.614 0 50 GFAA Cc1csc(CN(C)[C@H]2CCc3c(c(C(=O)N4CCCCC4)nn3C)C2)n1 14533327 XPCPMAYVCCRNLG-HNNXBMFYSA-N 387.553 2.800 0 50 GFAA COc1ccc(/C=C/C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2)cc1OC 15066197 BRLKAFZGBPNKQW-SINXNMPMSA-N 381.476 2.893 0 50 GFAA c1ccc(-c2noc(-c3ccn4c(CN5CCSCC5)nnc4c3)n2)cc1 169780613 AABVPHWHUJXFHC-UHFFFAOYSA-N 378.461 2.995 0 50 GFAA CCn1nccc1-c1nc(-c2nnn3c2CO[C@@H](c2ccc(C)cc2)C3)no1 169781401 ZVIMEEVKVMZPFJ-MRXNPFEDSA-N 377.408 2.791 0 50 GFAA COc1cc(Oc2cc(C(=O)N3CC[C@@H]4NCC[C@@H]43)ccc2OC)ccc1CN 1857691804 YHODCYATRBWFMQ-ROUUACIJSA-N 397.475 2.531 0 50 GFAA O=C([C@@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2[nH]nc(C3CC3)c2CC1 1857698053 UQUBWOGSLXJVMX-KRWDZBQOSA-N 379.382 2.967 0 50 GFAA CN(C)Cc1nc(C(=O)N2CCC3(CC2)C[C@H](O)C[C@H](C(C)(C)C)O3)cs1 1857700668 ZWXGLMTXJUYAPU-GDBMZVCRSA-N 395.569 2.766 0 50 GFAA CC(C)c1nc(CCNC(=O)[C@@H]2CC(=O)N(c3nc4ccccc4s3)C2)no1 1857736046 NNHHLSUSMRGRGU-GFCCVEGCSA-N 399.476 2.515 0 50 GFAA CN(C)c1cc(C(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)c2ccccc2n1 1875247697 OPKLFHAKRFCKGS-OXQOHEQNSA-N 376.460 2.683 0 50 GFAA Cc1ccc([C@@H](O)c2ccccn2)cc1NC(=O)C1(N2CCOCC2)CCC1 848041817 IQLQPVPPSCZOCP-HXUWFJFHSA-N 381.476 2.665 0 50 GFAA Cc1c(C(=O)N2CCC(NC(=O)c3ccccn3)CC2)oc2ccccc2c1=O 2325776058 CHQDDRTUKDBIMY-UHFFFAOYSA-N 391.427 2.531 0 50 GFAA C[C@H]1[C@H](C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)[C@H](C(=O)O)[C@@H]1C 2325815737 MSNJXCPBLOZQLZ-NSLUBLRVSA-N 399.413 2.788 0 50 GFAA COc1ccc(OC)c(NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)c1 1134583 UZGZMXHQPJWNGR-UHFFFAOYSA-N 392.477 2.546 0 50 GFAA Cc1cc(CN2CCC(C)CC2)c(C)c(CN2CCO[C@H](c3nnnn3C)C2)c1 2356139193 NXEZNEIIEZRVOD-NRFANRHFSA-N 398.555 2.632 0 50 GFAA CCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2)cc1Cl 4850883 LDHIUGRQEUXZBC-UHFFFAOYSA-N 382.869 2.998 0 50 GFAA Cc1cc(C)nc(N2CCC3(CC2)c2ccccc2[C@@H](n2ccnc2)[C@@H]3O)n1 23368784 BJRQTNQJHONYSP-UXHICEINSA-N 375.476 2.792 0 50 GFAA COc1ccccc1N1CCN([C@H]2CC(=O)N(c3cccc(Cl)c3)C2=O)CC1 100118668 IVJGVNZZTSPELE-SFHVURJKSA-N 399.878 2.803 0 50 GFAA Cc1ccc(C)c(OC[C@H](O)CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 22147866 JUCJMPNFIKVJKG-HXUWFJFHSA-N 398.503 2.590 0 50 GFAA COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@@H](O)c2cccc(C)c2)C1 119226721 HURYVJHBZFYOCF-FXAWDEMLSA-N 383.492 2.863 0 50 GFAA O=C(NCCc1cscn1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 120315091 HLYXYZSNDYPULC-LBPRGKRZSA-N 382.436 2.865 0 50 GFAA O=C(CCN1Cc2ccccc2C1=O)N[C@H]1CCCN(CCc2ccccc2)C1 67674928 VRNRBPUVRHNYNJ-NRFANRHFSA-N 391.515 2.856 0 50 GFAA CCc1n[nH]c2c1[C@@H](c1ccc(OCCN3CCCC3)c(OC)c1)CC(=O)N2 67974813 CSTANZBKKHIWDH-OAHLLOKOSA-N 384.480 2.929 0 50 GFAA O=c1[nH]nc([C@H]2CCCN(Cc3nnc(-c4cc5c(s4)CCCC5)o3)C2)o1 284267839 MPJYBUNZSBIYCG-LBPRGKRZSA-N 387.465 2.733 0 50 GFAA Cc1nnnn1-c1ccc(C(=O)N2CC[C@](F)(c3ccccc3F)C2)c(F)c1 451538040 UYOZXDDQKGYCMJ-LJQANCHMSA-N 387.365 2.960 0 50 GFAA CC1CCC(NC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 16281609 RNBWBAVVIDZOAQ-UHFFFAOYSA-N 397.566 2.573 0 50 GFAA Cc1ccc(C(=O)NCC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)cc1C 363296062 RHOKVQGIHZOBSB-UHFFFAOYSA-N 397.494 2.953 0 50 GFAA O=C(NCC(=O)N1CCC[C@@H]1[C@H]1CCCCC1=O)c1ccccc1OC(F)F 155240806 TXJHSLAVDNPKGA-UKRRQHHQSA-N 394.418 2.768 0 50 GFAA Cc1ccn(-c2ccc(N3CCN(C(=O)Nc4ccc(C)c(F)c4)CC3)nn2)n1 72437646 AYEXWXKIXASHHM-UHFFFAOYSA-N 395.442 2.772 0 50 GFAA CCNC(=O)C(C)(C)CNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 378200228 LAJFOMRGSWIWRZ-CQSZACIVSA-N 380.920 2.628 0 50 GFAA CC(C)[C@H]1CN(C(=O)c2ccc(-c3nc[nH]n3)cc2)CCC(=O)N1CC1CC1 71764538 GFZNSBCSWADECZ-GOSISDBHSA-N 381.480 2.581 0 50 GFAA Cc1cccc(OC[C@H]2CCCN(C(=O)c3cnc4sccn4c3=O)C2)c1 77505777 MADMGCMQSOKKJN-HNNXBMFYSA-N 383.473 2.996 0 50 GFAA CCn1ncc2c(C(=O)N[C@H]3CCCC[C@H]3C(N)=O)cc(-c3ccccc3)nc21 177705832 CJXAOZXXPBTMBU-QAPCUYQASA-N 391.475 2.892 0 50 GFAA Cc1ccc(N2C[C@H](Cc3ccccc3)N(C(=O)c3cnccn3)CC2=O)cc1 82137386 WOLJUKUORNMTHG-FQEVSTJZSA-N 386.455 2.885 0 50 GFAA Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1CC(=O)N(C)c2ccccc21 178190461 HIILSGZWUIFZBN-UHFFFAOYSA-N 381.823 2.852 0 50 GFAA CCN1CCN(C(=O)c2csc3c2CCN(Cc2c(C)noc2C)C3)CC1 426678104 LUXNPVNSIQGESV-UHFFFAOYSA-N 388.537 2.689 0 50 GFAA COCCN1C[C@@]2(CCCN(C(=O)Cc3ccccc3Cl)C2)CCC1=O 91575440 MWYKQSKVBJIUSK-FQEVSTJZSA-N 378.900 2.760 0 50 GFAA Cc1nc(C(C)C)cc(N2CCN(C)[C@@]3(CCC(=O)N(CC4CC4)CC3)C2)n1 230188211 KTRQEVZUUCPYOO-JOCHJYFZSA-N 385.556 2.822 0 50 GFAA CCCSCC(=O)N1CCC2(CCC(=O)N(Cc3ccccn3)C2)CC1 91625754 FTFFAVGPAYNDGF-UHFFFAOYSA-N 375.538 2.956 0 50 GFAA Cc1cc(N2CCC(N(C)Cc3cnccn3)CC2)nc(N2CCCCC2)n1 95511084 QYEAUPOKWYRNOK-UHFFFAOYSA-N 381.528 2.666 0 50 GFAA COc1ccc(CN2C[C@@H]3CC[C@H](C2)N(Cc2cscn2)C3=O)cc1F 95510036 NEQJSFXNYKUTIW-GOEBONIOSA-N 375.469 2.914 0 50 GFAA COCCCN1CC2(CCC1=O)CCN(c1nccc(C(F)(F)F)n1)CC2 91656473 XKDFGYGUGXAICS-UHFFFAOYSA-N 386.418 2.741 0 50 GFAA Cc1cc(C(=O)N2CCC(N3CCSCC3)CC2)cc2sc(N)nc12 97742910 COAFUHZEQIOBLN-UHFFFAOYSA-N 376.551 2.840 0 50 GFAA COCc1nc(NCCCn2nc(C)c(Cl)c2C)cc([C@H]2C[C@H](N)C2)n1 252572235 ZAGVFEFVDTYJNE-HDJSIYSDSA-N 378.908 2.797 0 50 GFAA Cn1cc(CCCNC(=O)N2CCC(c3nc4ccc(F)cc4[nH]3)CC2)cn1 534587140 DNFHVRVCEOPBDA-UHFFFAOYSA-N 384.459 2.957 0 50 GFAA O=C(c1cc(Oc2ccccc2)ccc1O)N1CCCC[C@H]1Cc1nn[nH]n1 1875336195 VKHHRBPCIYWTCZ-AWEZNQCLSA-N 379.420 2.935 0 50 GFAA O=C(NCCOc1ccc(C(F)(F)F)cc1)c1ncoc1[C@@H]1[C@H]2CN[C@H]1C2 1875393599 QCABEYCIDFLHDG-DDTOSNHZSA-N 381.354 2.578 0 50 GFAA Cc1ccc(C(=O)NC(C)C)cc1NC(=O)c1ccc2c(=O)n(C)cnc2c1 952975602 SLDSONHIGAFGIG-UHFFFAOYSA-N 378.432 2.632 0 50 GFAA Cc1cc(CC(=O)N2CCC([C@H]3CCCN(c4ncccn4)CC3)CC2)n(C)n1 1775993062 XHZGPDQQHQEMTQ-SFHVURJKSA-N 396.539 2.606 0 50 GFAA O=C1O[C@H]2CN(c3ncccc3C(F)(F)F)C[C@H]2N1CCN1CCCCC1 1565514226 NBSYZHUFPUUBKO-CABCVRRESA-N 384.402 2.596 0 50 GFAA CC(C)(C(=O)NCc1cccc(-n2cncn2)c1)c1ccc2c(c1)OCCO2 172096397 RSXVHQPSQPFGDF-UHFFFAOYSA-N 378.432 2.633 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)[C@@H](C)NC(=O)CC(C)(C)C)CC2)oc1C 189443925 FSHGLRSOSZAIKP-OAHLLOKOSA-N 392.544 2.561 0 50 GFAA Cc1nc2ccccc2n1CCC(=O)N1CCCN(C(=O)c2ccco2)CC1 1506428536 XPMUQUJGRNAECJ-UHFFFAOYSA-N 380.448 2.703 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)c2cc(C)cc(F)c2)cc1OC 1529100461 UMAGMYYERUXDFN-WOJBJXKFSA-N 389.423 2.726 0 50 GFAA COc1cc(-c2onc(N(C)C[C@]3(C)CCN(C)C3)c2C(=O)O)ccc1F 1704303840 JQZMHWLAYDWQHB-LJQANCHMSA-N 377.416 2.966 0 50 GFAA CO[C@H]1CN(C(=O)c2ccccc2-c2nccn2C)C[C@H]1Cc1cc(C)no1 1704279502 UYUQKKVNYLGJTI-BEFAXECRSA-N 380.448 2.713 0 50 GFAA CCOC(=O)N1CCC(NCc2c[nH]nc2-c2ccc(OC)cc2F)CC1 11664471 MZIYSTCUNGTIEW-UHFFFAOYSA-N 376.432 2.935 0 50 GFAA C=CCN1C(=O)C[C@@H](C(=O)OC)C12CCN(Cc1c(F)cccc1F)CC2 11813246 ACNBLVAIPYCSQY-HNNXBMFYSA-N 378.419 2.507 0 50 GFAA CN1CCC[C@@H]1CCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1 11874298 KCQIBVCCGHXMSH-LJQANCHMSA-N 399.535 2.681 0 50 GFAA CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H](NC(=O)CCc2ccco2)C1 12195679 VEJFQXYXVOEBSM-KRWDZBQOSA-N 384.480 2.669 0 50 GFAA COc1cc(C(=O)NCc2ccncc2C)ccc1OC1CCN(C(C)=O)CC1 12306259 QMRLBVJZQITNKB-UHFFFAOYSA-N 397.475 2.718 0 50 GFAA Cc1ccc(CNC(=O)[C@@H]2C[C@H](CN3CCOCC3)CN(CC(C)C)C2)cc1 14742766 KIOLRDNSVGLQNF-FGZHOGPDSA-N 387.568 2.538 0 50 GFAA Cc1cccc(C)c1CN1CCC2(CC1)CN(Cc1cnc[nH]1)C[C@@H]2C(=O)O 1857683037 QFGLZGCKJIILFW-HXUWFJFHSA-N 382.508 2.825 0 50 GFAA COc1nccnc1N1CCC(C2CCN(Cc3ccnc(C)n3)CC2)CC1 1857718317 SQTHKDKYFOKOGK-UHFFFAOYSA-N 382.512 2.712 0 50 GFAA O=C1CCO[C@H]2CN(C3CCC4(CCNCC4)CC3)C[C@@H]2N1Cc1ccccc1 1857734796 RUKSNVBAGBTAHG-VXKWHMMOSA-N 397.563 2.801 0 50 GFAA CC(C)(C)OC(=O)N[C@H]1CCCN(C(=O)c2ccc(Br)nc2)C1 746513559 QFXMSBRSSCPLDC-LBPRGKRZSA-N 384.274 2.973 0 50 GFAA O=C(O)CN(C(=O)c1cc(Br)ccc1Cl)C1CCOCC1 238107522 PORAVMLBILGEEA-UHFFFAOYSA-N 376.634 2.808 0 50 GFAA CCCCOc1c(Cl)cc(C(=O)N2CCO[C@H](C(=O)O)C2)cc1OCC 262926766 FTGLUCJBKHADLC-HNNXBMFYSA-N 385.844 2.843 0 50 GFAA COc1cc(C(=O)C[C@]2(O)C(=O)Nc3c(Cl)cccc32)cc(OC)c1OC 4776121 XVORIIURXCETGO-LJQANCHMSA-N 391.807 2.779 0 50 GFAA O=S(=O)(Cc1ccccc1Cl)N1CCO[C@H](COc2ccccc2)C1 4727773 UBMLZHSCPHUAGR-KRWDZBQOSA-N 381.881 2.950 0 50 GFAA Cn1nccc1C(=O)N1CCN([C@@H](COc2ccccc2)c2ccccc2)CC1 2100537455 NPIYBAMTLWHKQL-QFIPXVFZSA-N 390.487 2.998 0 50 GFAA O=C(NC[C@H]1NCCc2ccccc21)c1nnn(-c2ccc(F)cc2)c1C1CC1 2325721708 ALVSGWGSSGONAC-LJQANCHMSA-N 391.450 2.901 0 50 GFAA CCOc1ccc([C@H](COC)NC(=O)/C=C/c2ccc3c(c2)NC(=O)CO3)cc1 2325766458 YEXYFEIWMKEXPQ-RXERPNITSA-N 396.443 2.933 0 50 GFAA FC(F)C[C@@H]1CN(c2ccnc(-c3cncc(Br)c3)n2)CCN1 2325800223 YJHPXZDPUFRFBF-GFCCVEGCSA-N 384.228 2.735 0 50 GFAA Cn1cnc(CNC(=O)N2CCc3[nH]c4c(Br)cccc4c3C2)c1 898632387 YKOYXAQVTQLWAB-UHFFFAOYSA-N 388.269 2.932 0 50 GFAA CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1I 831843 BMAYXBZBSAWBFN-LLVKDONJSA-N 385.201 2.732 0 50 GFAA COc1cc(C(=O)NC(=S)Nc2ccc(N(C)C)cc2)cc(OC)c1OC 881797 FWLSGHHJIJBXFO-UHFFFAOYSA-N 389.477 2.905 0 50 GFAA COc1ccc(N(CC(=O)NC2CCCCCC2)S(C)(=O)=O)cc1Cl 1142751 ROGMANSBRQYGKR-UHFFFAOYSA-N 388.917 2.954 0 50 GFAA CC(=O)c1cccc(NC(=O)Nc2ccc(N3CCOCC3)c3nonc23)c1 5041614 NCWIMJYWEFSLAH-UHFFFAOYSA-N 381.392 2.906 0 50 GFAA O=C(c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC2(CC1)OCCO2 8782927 JNPMJXQMRWLALD-UHFFFAOYSA-N 390.443 2.913 0 50 GFAA CSCCC(=O)N1CCC2(CC[C@H](CNC(=O)c3ccccc3F)O2)CC1 11881268 DDTGCEIEQTYCKT-OAHLLOKOSA-N 394.512 2.849 0 50 GFAA O=C(NCc1ccc(-n2cncn2)cc1)[C@H]1CCC(=O)N(CC2CCCCC2)C1 12442268 CCZGDGQNQODAQP-IBGZPJMESA-N 395.507 2.702 0 50 GFAA CC[C@@H](COC)Nc1ncnc2sc(C(=O)NCC(C)(C)CO)c(C)c12 12456382 HMQGKELMBJKIHB-LBPRGKRZSA-N 380.514 2.585 0 50 GFAA CN(C)c1nc(-c2cccc(-c3ccn(C[C@@H]4COCCO4)n3)c2)ncc1F 20109502 ABVZXNOVSVFJLD-MRXNPFEDSA-N 383.427 2.628 0 50 GFAA CCCc1cc(NCCCN2CCOCC2)n2nc3nc(C)cc(C)c3c2n1 20548591 YBVHMPQREAWLJT-UHFFFAOYSA-N 382.512 2.981 0 50 GFAA Cc1ccc(N2C[C@@H](C)N(C(=O)c3cc(C)n4nc(C)cc4n3)CC2=O)cc1 82116275 BHMKRAWDPMVPBE-MRXNPFEDSA-N 377.448 2.532 0 50 GFAA CCNc1ncc(CN2CCC3(CCC(=O)N(Cc4ccncc4)C3)CC2)cn1 91934635 ORQOCDLDUUZZCO-UHFFFAOYSA-N 394.523 2.708 0 50 GFAA CCn1ccc(C(=O)N2C[C@@H](c3cccc(F)c3F)[C@@H]3[C@H]2C2CCN3CC2)n1 95372873 BTLLQYMGTGTRIF-CWFSZBLJSA-N 386.446 2.884 0 50 GFAA COc1cccc(CCC(=O)N2C[C@H]3CC[C@@H]2CN(Cc2[nH]cnc2C)C3)c1 95385413 LTLPJEWRYZOKBK-RBUKOAKNSA-N 382.508 2.782 0 50 GFAA Cc1nnc([C@H](C)NC(=O)c2cccc(OC3CCN(C(=O)C4CC4)CC3)c2)o1 95498288 BOPKLIKPAAPAHP-ZDUSSCGKSA-N 398.463 2.649 0 50 GFAA CCc1ccc(C(=O)N2CCC(CCC(=O)NC[C@@H]3CCCN3CC)CC2)[nH]1 95508930 IPPNCAICYNRHFV-IBGZPJMESA-N 388.556 2.810 0 50 GFAA COc1cccc(Cn2nc(-c3ccc(C(N)=O)cc3)nc2[C@H]2CCOC2)c1 95524712 SJNCZRCMZOUIHW-KRWDZBQOSA-N 378.432 2.605 0 50 GFAA CCn1c(CN(C)C)nnc1C1CCN(C(=O)c2ccccc2C(C)=O)CC1 96150906 PUGFQPATRQEYME-UHFFFAOYSA-N 383.496 2.582 0 50 GFAA Cc1ccc(NC(=O)N[C@H]2C=CS(=O)(=O)C2)cc1NC(=O)C1CCCC1 97655360 FWUTWURSVNOPAU-HNNXBMFYSA-N 377.466 2.556 0 50 GFAA C[C@@H](C(=O)N1CCC[C@H](c2nncn2C)C1)N1CCC(Cc2ccccc2)CC1 110627556 ZBAUGVKVBCALNK-RXVVDRJESA-N 395.551 2.864 0 50 GFAA O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)[C@@H]1CCc2cn[nH]c2C1 134316482 AAZOLZAEBRUKNP-XMSQKQJNSA-N 391.471 2.943 0 50 GFAA CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N1CC[C@@H]2[C@@H](CCCN2C)C1 152583921 UJCDIQWYDBVBOD-FUHWJXTLSA-N 388.512 2.735 0 50 GFAA Cc1noc(-c2cn(C3CCN(C(=O)c4cccc5[nH]ccc45)CC3)nn2)n1 169777321 WHXPRLPSKXESGZ-UHFFFAOYSA-N 377.408 2.595 0 50 GFAA COc1cc(OC)cc(N2CC[C@@H](N(C)c3ncc(C(N)=O)cc3Cl)C2)c1 170651620 DEJWZWKVYJIEGQ-CYBMUJFWSA-N 390.871 2.566 0 50 GFAA O=S(=O)(N[C@H]1CCOc2ccccc21)c1ccc(OCC(F)(F)F)nc1 182581715 LZOGMJMTPKQZKA-ZDUSSCGKSA-N 388.367 2.825 0 50 GFAA O=C(Cc1cn2ccccc2n1)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 182877941 PGIMGAGMUVXSFA-CQSZACIVSA-N 377.370 2.956 0 50 GFAA CC(=O)c1ccccc1NC(=O)[C@H](C)N1CCC(CC(=O)N2CCCC2)CC1 194280519 PHJSKAVURPWXOF-INIZCTEOSA-N 385.508 2.941 0 50 GFAA CC(=O)c1c(C)nn(CC(=O)N2C[C@H](c3ccc(C)cc3)[C@@H](N(C)C)C2)c1C 216496130 WCENXBDZRHPPHW-UXHICEINSA-N 382.508 2.567 0 50 GFAA CCn1c(C)ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N(Cc2ccccc2)C3)c1=O 222153341 CKDOLWNYQXOYOO-PMACEKPBSA-N 379.504 2.913 0 50 GFAA COCCN1CCN(C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)CC1 225522026 SHPPERBVKGDKTE-KRWDZBQOSA-N 383.439 2.639 0 50 GFAA CNC1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)CC1 237142333 WSTBGZJDOPHRLZ-UHFFFAOYSA-N 377.286 2.767 0 50 GFAA O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(N3C(=O)[C@H]4CCCC[C@H]4C3=O)cc1)[C@H]1C=C[C@H]2C1 239173578 OFDYCTCARALERY-NNKBLXFJSA-N 390.439 2.678 0 50 GFAA CCCOc1c(Cl)cc(C(=O)N2CCO[C@@H](CC(=O)O)C2)cc1OCC 262706001 DFAKFKBYEMRBDV-ZDUSSCGKSA-N 385.844 2.843 0 50 GFAA Cc1nc2c(c(N3CCC[C@@H](c4[nH]ncc4CN4CCOCC4)C3)n1)CCCC2 275562432 IHUYXGIZPGHPBU-QGZVFWFLSA-N 396.539 2.603 0 50 GFAA O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CC[C@@H](n2cc(Cl)cn2)C1 291049760 VKLPJGOUPDHRPF-CABCVRRESA-N 376.844 2.598 0 50 GFAA COc1ccccc1CCCN(Cc1cn2c(n1)CCCC2)S(C)(=O)=O 328620884 HIAFHMKHEXUHIL-UHFFFAOYSA-N 377.510 2.622 0 50 GFAA Cn1ccnc(N2CCC[C@@H](NCc3ccc(Oc4ccccc4)o3)C2)c1=O 328629437 IFJSIGGSSJTQSR-MRXNPFEDSA-N 380.448 2.924 0 50 GFAA Cn1c([C@@H]2CCCN2CCN2C(=O)C3(CCCC3)N=C2O)nc2c1CCCC2 328650654 VQGHEIBTJSQDTO-KRWDZBQOSA-N 385.512 2.505 0 50 GFAA Cc1cnc(N2CCC[C@]3(CN=C(O)C3)C2)nc1N1CCC[C@]2(CN=C(O)C2)C1 329805987 NOBGXZWHFGNRGZ-SFTDATJTSA-N 398.511 2.679 0 50 GFAA O=C(c1nccc2ccccc12)N1CCOC[C@@H]1c1ncn(CC(F)(F)F)n1 368606971 XUQCHVTXOORMML-CQSZACIVSA-N 391.353 2.602 0 50 GFAA CC1CCC(N2CCC(N(C)C(=O)[C@H]3CC34CCS(=O)(=O)CC4)CC2)CC1 375131296 LOKLJCUREHYFOS-NKELODKYSA-N 396.597 2.703 0 50 GFAA CCS(=O)(=O)c1ccccc1C(=O)Nc1cccc(-c2nnc(C)n2C)c1 378215857 AANWMTRHVNEUGO-UHFFFAOYSA-N 384.461 2.836 0 50 GFAA Cc1ccc2cc(-c3ccc(C(=O)N4C[C@@H](CO)[C@H](CO)C4)cc3)ccc2n1 426594754 AOXCZSCZFAXXIT-SFTDATJTSA-N 376.456 2.883 0 50 GFAA CSCc1nc(CNC(=O)N2CCC(Oc3ncccn3)CC2)cs1 584892758 SLZKLSHTEBVYDG-UHFFFAOYSA-N 379.511 2.549 0 50 GFAA CN(Cc1ccccc1)[C@@H]1CCN(Cn2cc(I)cn2)C1 743375624 JAGRYPMETIBKOO-MRXNPFEDSA-N 396.276 2.652 0 50 GFAA O=C(c1ccc(CN2CCCC2)o1)N1CCN(c2ncnc3ccccc23)CC1 828166339 BWKGQUSNCQYKGK-UHFFFAOYSA-N 391.475 2.781 0 50 GFAA Cc1noc([C@@H](C)N(C)S(=O)(=O)c2cc(-c3cc(C)[nH]n3)sc2C)n1 1506419324 AJJXWRLIAGMHNW-SECBINFHSA-N 381.483 2.828 0 50 GFAA COc1ccc([C@@H]2[C@@H](CO)OCCN2C(=O)CCc2ccccc2C)cc1OC 1529091936 SEQKLZPTECEQKI-FYYLOGMGSA-N 399.487 2.906 0 50 GFAA COc1cc(CN2CC[C@@H](O)[C@@H](C(=O)O)C2)ccc1OCc1cccc(F)c1 1529158938 KMRVJOYHITWVTG-ZWKOTPCHSA-N 389.423 2.681 0 50 GFAA O=C(CCCn1ccnc1)N1C[C@@H]2CC[C@H]1CN(C1Cc3ccccc3C1)C2 1565514580 MYRLKKLVMQXCRZ-NQIIRXRSSA-N 378.520 2.754 0 50 GFAA CCOC(=O)N1CCC(N2C[C@H](Cc3ccnc4ccccc34)[C@@H](O)C2)CC1 1616074910 XACRNWBFAOZNFE-UWJYYQICSA-N 383.492 2.691 0 50 GFAA O=C(c1cc[nH]c1)N1C[C@@H]2CN(Cc3cnc[nH]3)C[C@@]2(CCc2ccccc2)C1 1772814720 PKCHJJKTNCSCCR-REWPJTCUSA-N 389.503 2.945 0 50 GFAA CC(=O)N1[C@H]2CC[C@@H]1[C@](Cc1ccccc1)(C(=O)NCCN1CCCCC1)C2 1857667224 PIQHYBWKHVDJTH-QZNHQXDQSA-N 383.536 2.601 0 50 GFAA O=C1CC2(CCN(c3ncccn3)CC2)OCCN1C/C=C/c1ccccc1 1857684053 XHNFGXMIADMGLO-XBXARRHUSA-N 378.476 2.778 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(C(=O)CCC3(C)CC3)CC(=O)N2[C@H]1c1ccccc1 1857730486 UCLSYIHXYQJKIT-ZWOKBUDYSA-N 384.476 2.540 0 50 GFAA Cc1nc2nc(C)c(NC(=O)[C@H]3CCCc4c3[nH]c3ccccc43)c(=O)n2[nH]1 1875250910 BDISVPZYXSJJMN-AWEZNQCLSA-N 376.420 2.574 0 50 GFAA CCc1n[nH]cc1-c1nnc(N2CCc3cc(C(=O)OC)ccc3C2)n1CC 1875280779 VKMSVFQJHNRLRP-UHFFFAOYSA-N 380.452 2.600 0 50 GFAA O=C(Cc1ccc(Br)cc1Cl)NS(=O)(=O)c1cccnc1 1875350498 PMFVDVICJDDIAO-UHFFFAOYSA-N 389.658 2.545 0 50 GFAA O=C(NCc1cn(C[C@@H]2CCCN2)nn1)c1cc2c(s1)-c1ccccc1CC2 2325786518 TUGUGMIVSUOVMQ-INIZCTEOSA-N 393.516 2.787 0 50 GFAA O=C(N1CCOCc2ccc(Br)cc21)C(F)(F)c1cnccn1 2325806532 LOCKXPHPFSWBTJ-UHFFFAOYSA-N 384.180 2.894 0 50 GFAA COC(=O)c1c(NC(=O)COc2ccccc2)sc2c1[C@@H](C(=O)OC)CC2 622257 ZFCDARHBQUEBBZ-LBPRGKRZSA-N 389.429 2.755 0 50 GFAA COc1ccc(C)cc1N(CC(=O)N(C)C)S(=O)(=O)c1ccc(C)cc1 816927 GKLQKZRTJJQXFC-UHFFFAOYSA-N 376.478 2.596 0 50 GFAA C[C@]1(C(=O)N2CCN(C(=O)[C@@]3(C)CC3(Cl)Cl)CC2)CC1(Cl)Cl 2771552 ZLVDTBFMMHRPBA-VXGBXAGGSA-N 388.122 2.825 0 50 GFAA CC(=O)c1cccc(N(CC(=O)Nc2ccc(F)c(F)c2)S(C)(=O)=O)c1 2884235 RPKGESOGNXJRMT-UHFFFAOYSA-N 382.388 2.572 0 50 GFAA CSCC[C@@H](NC(C)=O)C(=O)Oc1ccc2c3c(c(=O)oc2c1)CCCC3 2998132 VWRFWVKNUVYEDF-QGZVFWFLSA-N 389.473 2.835 0 50 GFAA O=C(c1cn(Cc2ccccc2F)nn1)N1CCC[C@@H](OCc2ccccn2)C1 11665365 MQXUACXIKHOIJL-GOSISDBHSA-N 395.438 2.682 0 50 GFAA COc1ccc(CNCCCSC)cc1OC[C@@H](O)CN1CCCCC1 12112255 FSHBQUZVZFBDIE-SFHVURJKSA-N 382.570 2.764 0 50 GFAA Cc1cc(-c2ccnc(-n3ncc(C(=O)NC[C@@H](C)O)c3C3CC3)n2)c(C)s1 12245132 SATSVXMFGUPWIB-LLVKDONJSA-N 397.504 2.996 0 50 GFAA COc1cc(CNC2CCCCC2)ccc1OC[C@H](O)CN1CCSCC1 12458560 GRGSXZODDOLPME-LJQANCHMSA-N 394.581 2.906 0 50 GFAA CCn1nc(C(=O)N2CCCC2)c2c1CC[C@H](NCc1ccccc1OC)C2 14743096 DRYZUZGCBLZQQW-KRWDZBQOSA-N 382.508 2.795 0 50 GFAA O=C(Cc1cccnc1)N[C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1 15079880 OHCCSNNFPATTBX-HNNXBMFYSA-N 377.366 2.560 0 50 GFAA COc1cccc(NC(=O)CSc2nc(O)cc(=O)n2-c2ccccc2)c1 15836521 NHWUPNMSKRQMCW-UHFFFAOYSA-N 383.429 2.678 0 50 GFAA CCN1CCN(C[C@@H](O)CN2CCn3c4c(c5cc(C)ccc53)CCC[C@@H]42)CC1 19706625 HFDBNPIDCZKBSN-XXBNENTESA-N 396.579 2.641 0 50 GFAA Cc1nn(C)c(C)c1CCC(=O)NCc1noc(-c2c(F)cccc2F)n1 65461176 ANZJEPDDEUSNTF-UHFFFAOYSA-N 375.379 2.614 0 50 GFAA CC(=O)c1ccc(OCc2cc(C(=O)N3CCN4CCCC[C@@H]4C3)no2)cc1 67674871 LZLGVDMLANJYST-QGZVFWFLSA-N 383.448 2.767 0 50 GFAA CC(C)NC(=O)[C@@H](C)N1CCC(n2nccc2NC(=O)C2CCCC2)CC1 67677143 OVXHWIYMSGVRJJ-OAHLLOKOSA-N 375.517 2.562 0 50 GFAA CCCOc1ccc2ccccc2c1CN1CCN(C)[C@@H]2CS(=O)(=O)C[C@@H]21 72421457 ZJSFXTXQASIXIN-UXHICEINSA-N 388.533 2.542 0 50 GFAA O=C(Cn1ccc(=O)cc1)N1CCC[C@H](c2[nH]ncc2Cc2ccccc2)C1 77319822 DGLDCVQEFKVIDB-SFHVURJKSA-N 376.460 2.568 0 50 GFAA Cc1ccccc1-c1cn[nH]c1C1CCN(C(=O)CCCn2cnnn2)CC1 77387691 XFQAXHLHEVAYQL-UHFFFAOYSA-N 379.468 2.558 0 50 GFAA Cn1cccc1C(=O)C(=O)N1CCC[C@H](c2nccn2Cc2ccccc2)C1 82097067 WLSWTZBTJLJBFL-SFHVURJKSA-N 376.460 2.859 0 50 GFAA COc1ccccc1CCN1CCC[C@H](CN(C)C(=O)c2cnc(C)nc2)C1 95507994 ASPXURIXXPKZJK-GOSISDBHSA-N 382.508 2.820 0 50 GFAA c1ccc(-n2nnnc2N2CCC[C@H](c3nccn3Cc3cccnc3)C2)cc1 95529387 WGGUUGURQAKPBX-SFHVURJKSA-N 386.463 2.686 0 50 GFAA COc1ccccc1Cn1nccc1NC(=O)NCCc1nc(C)cc(C)n1 96132602 QDTVHNYLIQZNMJ-UHFFFAOYSA-N 380.452 2.711 0 50 GFAA CC(C)[C@@H](NC(=O)CN1CCN(C[C@H]2CCCCN2C)CC1)c1ccccc1 109752138 QJZDVBLBKOSPOY-FYYLOGMGSA-N 386.584 2.602 0 50 GFAA CCCc1noc(-c2cccn3c(CNC(=O)c4ccc(OC)cc4)nnc23)n1 169776059 AFPFHIKVZUZMMS-UHFFFAOYSA-N 392.419 2.670 0 50 GFAA COc1cccc(NC(=O)Cn2c(C)cc3nc4n(c(=O)c32)CCCCC4)c1 169777263 VATVFBXMZLGGPE-UHFFFAOYSA-N 380.448 2.880 0 50 GFAA COc1cc(OC)cc(S(=O)(=O)N2C[C@H](n3ccnc3)Cc3ccccc32)c1 178331068 DILYVWQTGNZQBW-MRXNPFEDSA-N 399.472 2.893 0 50 GFAA CC(C)(C)OCc1cc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)no1 186473916 RWQCQYOTSDHMDR-CQSZACIVSA-N 375.473 2.601 0 50 GFAA CN(CC(=O)O)[C@H]1CCCN(C(=O)c2ccc(Br)cc2F)CC1 186654069 IHBPLEGJMKSVQN-LBPRGKRZSA-N 387.249 2.599 0 50 GFAA O=C(Nc1ccc(OCC(F)(F)F)nc1)N1CCC(Cn2cncn2)CC1 188572050 AFZGQLXPSUAOQQ-UHFFFAOYSA-N 384.362 2.558 0 50 GFAA CCN(CC)C(=O)C1(N[C@@H]2CCN(c3ccccc3OC)C2=O)CCCCC1 192674755 FDRGZIXFZLIKDZ-QGZVFWFLSA-N 387.524 2.961 0 50 GFAA O=C(c1cc(-n2cccn2)ccc1Cl)N1CCN(Cc2cccnc2)CC1 215818007 NVIPTLRYBJPYLK-UHFFFAOYSA-N 381.867 2.879 0 50 GFAA CN(Cc1c(F)cccc1Cl)S(=O)(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 246758174 GFQIIPWDTGTLMN-COLVAYQJSA-N 376.881 2.559 0 50 GFAA CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 253414789 YPVITGAHYZKTAX-PCCBWWKXSA-N 383.536 2.758 0 50 GFAA biogenic CN1CCC([C@H]2CCN(C(=O)NCc3ccc(-n4ccnc4)c(F)c3)C2)CC1 270301766 YNEZDDPEOQLKPK-SFHVURJKSA-N 385.487 2.885 0 50 GFAA O=S(=O)(NC[C@H]1CCc2nc(C(F)(F)F)cn2C1)c1cccc(F)c1 328625298 KQTZSJRPXAQVRE-SNVBAGLBSA-N 377.363 2.582 0 50 GFAA CC(C)Cn1ncc(C(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1C1CC1 362380869 RMMDIBSLBAMZGV-MRXNPFEDSA-N 395.507 2.524 0 50 GFAA CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)CC2(CCCC(=O)N2)C1 498051083 NDYQOJJWTIXXAM-UHFFFAOYSA-N 383.489 2.513 0 50 GFAA O=C(NCC1(COc2ccccc2)CC1)N1CCN(c2ccccc2)C(=O)C1 534587138 CNWRAZOKKHQPOE-UHFFFAOYSA-N 379.460 2.904 0 50 GFAA CC[C@@H](C(=O)NCCn1c(C)cc(C)nc1=O)n1cc(C(C)=O)c2ccccc21 822668413 SYQFDKYTIWIKSG-IBGZPJMESA-N 394.475 2.785 0 50 GFAA O=C(NC[C@@H]1CCCN(Cc2cnn(-c3ccccc3)c2)C1)c1cncs1 828206420 RDNRTWPKAHXQGZ-INIZCTEOSA-N 381.505 2.971 0 50 GFAA Cn1ccc(S(=O)(=O)N2CC=C(c3cccc(OC(F)(F)F)c3)CC2)n1 888092717 CFOIPIUVWFTHIZ-UHFFFAOYSA-N 387.383 2.797 0 50 GFAA C[C@H](C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)Cc1cccc(F)c1F 912934643 ULNVGBQUIGXFBG-MLGOLLRUSA-N 395.427 2.908 0 50 GFAA Cc1cnc(C(=O)NCC2CCN(C(=O)c3cc4ccccc4o3)CC2)cn1 952989942 IZSBKUOZMMJJEK-UHFFFAOYSA-N 378.432 2.813 0 50 GFAA COc1cccc2c1NC(=O)C[C@@H]2C(=O)N1CCCN(Cc2cccs2)CC1 1506397117 NLEZDBVNYQYDQR-KRWDZBQOSA-N 399.516 2.917 0 50 GFAA Cc1ccc(C)c(OCC(=O)N2CC[C@H](O)[C@](CO)(Cc3ccccc3)C2)c1C 1529187203 POZBMDXDZZPGSW-XUZZJYLKSA-N 397.515 2.805 0 50 GFAA CCc1ccc(CN2CC[C@H](N3CCN(c4ccccc4F)CC3)[C@@H](O)C2)o1 1565530208 HUZLWCBXDRWMDR-VXKWHMMOSA-N 387.499 2.739 0 50 GFAA Cc1nc[nH]c1CN(CCN(C)C)C(=O)Cc1nc(-c2ccccc2)oc1C 1704307772 DVRVYPLYTJUANW-UHFFFAOYSA-N 381.480 2.814 0 50 GFAA COc1ccccc1CN1C[C@@H](C(=O)N2CCC3(C=C(C)CCO3)CC2)CC1=O 1704345522 ZHMWDSRJABMZNJ-IBGZPJMESA-N 398.503 2.772 0 50 GFAA Cc1ccc(CC(=O)N2CCN(C(=O)C3CC3)C3(CCOCC3)CC2)s1 1775962904 UUAZUKNCWQZLPX-UHFFFAOYSA-N 376.522 2.619 0 50 GFAA C[C@@H](O)c1nc2cc(-n3ccnc3-c3ccc(OCC(=O)O)cc3)ccc2n1C 1775978908 XLMKWGSSMASEFS-CYBMUJFWSA-N 392.415 2.943 0 50 GFAA CCOC(=O)[C@]1(CC)C[C@@H]2CC[C@H]1N2S(=O)(=O)c1cc(OC)ccc1OC 1857676447 HGSRZUIKRGCMKJ-BOFPYLFWSA-N 397.493 2.589 0 50 GFAA Cc1nnc(N2C[C@H](C(=O)NCc3ccccc3C(F)(F)F)CC2=O)s1 1857677448 CEJMLBZEQSUJCI-LLVKDONJSA-N 384.383 2.535 0 50 GFAA O=C(CC1=CCCC1)N1CC[C@]2(C1)Cn1c(nnc1-c1ccc(O)cc1)CO2 1857707304 MTFCBYMAJVCZQL-NRFANRHFSA-N 380.448 2.652 0 50 GFAA Cc1cccc(C(=O)N2CCO[C@@H](CN3CCOCC3)[C@@H]2c2cccnc2)c1C 1857710497 ZVRGJLDFUNBQIU-VXKWHMMOSA-N 395.503 2.613 0 50 GFAA CC[C@@]1(C(=O)NCCn2cncn2)C[C@@H]2CC[C@H]1N2Cc1ccccc1Cl 1857711147 JVQLSFXXACCFLQ-ILZDJORESA-N 387.915 2.881 0 50 GFAA Cc1cccc(CN2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)n1 1857735792 BHGNPWHGXILUCH-ZZLPTCMGSA-N 377.488 2.799 0 50 GFAA N[C@@H]1C[C@@H](c2nc(-c3ccc(F)c(F)c3)nn2CC(F)(F)F)CC[C@H]1O 1857738700 UISOYCSIKVGZNP-ZWKOPEQDSA-N 376.329 2.741 0 50 GFAA COC(=O)[C@H]1C[C@H]2CN(Cc3ccc(C)cc3)CC(=O)N2[C@H]1c1ccccc1 1857739927 ZQMWGLBZSICCEZ-ONTIZHBOSA-N 378.472 2.942 0 50 GFAA COCCOC[C@@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1 1875294188 CUNQJHWKSYKYHM-KRWDZBQOSA-N 380.448 2.560 0 50 GFAA O=C(NC[C@@H]1C[C@@H](CO)CO1)[C@@]1(Cc2ccccc2)CCc2ccccc2C1 1875299623 QAFDZURJQMMOTC-NGYIFUPDSA-N 379.500 2.918 0 50 GFAA C[C@H]1CCC[C@@H](C)CN1C(=O)c1cc(-c2ccco2)n2cnc(C(N)=O)c2n1 1875350720 YIVPWAHLMJNPKY-OLZOCXBDSA-N 381.436 2.739 0 50 GFAA CNC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2cccc3ccncc23)c1 1875359335 ASMNDHJSWSWSDZ-ZDUSSCGKSA-N 377.400 2.778 0 50 GFAA COc1ccc([C@H](C)N[C@@H]2CCN(c3nc(C(=O)N(C)C)nc(C)c3C)C2)cc1 1875397510 CJOUZNDBHNOSPN-FUHWJXTLSA-N 397.523 2.733 0 50 GFAA Cc1[nH]nc2ccc(NC(=O)C(=O)N[C@H](CN3CCCC3)c3ccccc3)cc12 2325767241 PDTZJEQJTMFCJF-HXUWFJFHSA-N 391.475 2.763 0 50 GFAA Cc1cc(C(=O)NC2CC3(CCNC3=O)C2)nn1-c1ccc(Cl)c(Cl)c1 2325793535 YZVJVNFSWKWRTA-UHFFFAOYSA-N 393.274 2.886 0 50 GFAA COc1ccc2c(ccn2CC(=O)NS(=O)(=O)c2ccsc2Cl)c1 2325877591 VLFSBMDFRYJBNC-UHFFFAOYSA-N 384.866 2.870 0 50 GFAA COC(=O)COc1ccc(CN2CCC(OC(F)(F)F)CC2)cc1OC 2356142495 UYZOHKZMYSDDKK-UHFFFAOYSA-N 377.359 2.748 0 50 GFAA COCCN1CCC[C@]2(CCCN2C(=O)c2cccc(C(F)(F)F)c2)C1=O 2356162561 FEBKBIVASHXTRO-SFHVURJKSA-N 384.398 2.949 0 50 GFAA CN(C[C@@H]1Cc2ccccc2O1)C(=O)c1cc2c(s1)C1(CCNCC1)OCC2 2356163397 BEIOLKOPJMRKFG-KRWDZBQOSA-N 398.528 2.975 0 50 GFAA O=C(CCCc1nc(-c2cccnc2)no1)N1CC[C@H](c2ccccc2)[C@H](O)C1 2356167135 IWBCQJVPUASFBN-RTBURBONSA-N 392.459 2.831 0 50 GFAA O=C(NCc1ccco1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 791977 BVPGOXBDAZGAKJ-CYBMUJFWSA-N 382.869 2.650 0 50 GFAA NC(=O)C1CCN(C(=O)COc2ccc3ccccc3c2Br)CC1 1124149 NULWVCNDKYCFPH-UHFFFAOYSA-N 391.265 2.705 0 50 GFAA COc1ccc(OC[C@H](O)CN(C)C(=O)c2ccc(Br)cc2)cc1 1134995 MSEWZXYUFWEVKN-OAHLLOKOSA-N 394.265 2.970 0 50 GFAA CCCCNS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(OC)cc2)cc1 2190801 XDERCQGCQNTCPH-UHFFFAOYSA-N 398.506 2.574 0 50 GFAA O=c1cc(CN2C[C@@H]3[C@@H](CCC[C@@]3(O)c3ccccc3)C2)nc2c(O)cccn12 2356139958 NVDLSVYCWKVCLH-XKDCRVNJSA-N 391.471 2.520 0 50 GFAA O=C(N[C@@H](O)C(Cl)(Cl)Cl)c1ccc(I)cc1 3051322 RZMYARORPGMOFJ-QMMMGPOBSA-N 394.423 2.710 0 50 GFAA CN(C)c1ccc(CN2CCC[C@]23CCCN(Cc2ccccn2)C3=O)cn1 2356166346 ULJOXSFCKDHEBV-QFIPXVFZSA-N 379.508 2.700 0 50 GFAA COc1ccc(Cl)cc1N([C@@H](C)C(=O)N1CCC[C@H](C)C1)S(C)(=O)=O 10541645 PRYJNAMQTUHASP-STQMWFEESA-N 388.917 2.762 0 50 GFAA CC(C)N1CC[C@@H](NC(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)C1=O 114835666 HOKUKWAUNXHNKR-HZPDHXFCSA-N 383.851 2.571 0 50 GFAA O=C1C[C@@H](N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1Cc1cccs1 22972305 ZZSYGCAGGUDIEK-BTZGUFSASA-N 395.528 2.707 0 50 GFAA CC(=O)N(Cc1cncnc1)[C@@H]1CCCN([C@@H](C(=N)O)c2ccccc2)CC1 328632916 LOYKXKXXMKEUQS-WOJBJXKFSA-N 381.480 2.956 0 50 GFAA CCn1nccc1C1CCN(C(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)CC1 434169245 HMBWGMHPYMXJEB-AWEZNQCLSA-N 397.479 2.884 0 50 GFAA CN(CCc1ccccn1)[C@@H]1CCN(Cc2ccc3c(c2)CC(C)(C)O3)C[C@H]1O 20204093 FRCKIZFTWLYEKD-FGZHOGPDSA-N 395.547 2.905 0 50 GFAA Cc1nc(CN2CCC(CNC(=O)c3cnc(C(F)(F)F)nc3)CC2)oc1C 127059355 PWXAADUAZWIFHW-UHFFFAOYSA-N 397.401 2.742 0 50 GFAA CC(C)c1ccc(N2CCC[C@H](n3cc(C(=O)NC4CCCC4)nn3)C2)nn1 67871443 NPWHLDHJXHKRRO-INIZCTEOSA-N 383.500 2.705 0 50 GFAA COc1ccccc1[C@H](NC(=O)CCc1c(C)nc(C)[nH]c1=O)c1ccco1 128918435 ZBGMPLOJZAENDY-FQEVSTJZSA-N 381.432 2.827 0 50 GFAA C[C@H](NC(=O)c1cnc([C@@H](C)O)s1)c1cc(F)ccc1N1CCN(C)CC1 241862555 SRARNODOLXSHSZ-QWHCGFSZSA-N 392.500 2.578 0 50 GFAA O=C(NCc1cccnc1-n1ccnc1)N[C@@H]1CCN(c2c(F)cccc2F)C1 152694801 OUNWJKUCIKGSPS-OAHLLOKOSA-N 398.417 2.624 0 50 GFAA Cc1nn(C)c(OCC(F)(F)F)c1CN[C@H]1CCO[C@]2(CCSC2)C1 151354176 HLSPSFNTYGPQFF-SWLSCSKDSA-N 379.448 2.814 0 50 GFAA O=C(Nc1cccc(S(=O)(=O)C(F)F)c1)N1CCC(c2ccn[nH]2)CC1 153480896 ZSPUINYBISCVKH-UHFFFAOYSA-N 384.408 2.818 0 50 GFAA COC(=O)c1sc(I)cc1NC(=O)C(F)(F)F 82048835 WYGAZUSVRUWTGD-UHFFFAOYSA-N 379.097 2.640 0 50 GFAA C[C@@H]1CCc2c(sc(NC(=O)COCC(=O)O)c2C(=O)NC2CCCC2)C1 17080622 MHEFNRBBYXDBKZ-LLVKDONJSA-N 394.493 2.585 0 50 GFAA NC(=O)[C@@H](NC(=O)[C@H]1CCN(c2ccccc2Cl)C1)c1ccc(F)cc1 290637360 DJPBVOGFGKZWTO-GUYCJALGSA-N 375.831 2.648 0 50 GFAA NC[C@@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Br)o2)C1 178541010 KDBJAMQJNONJRS-LBPRGKRZSA-N 378.270 2.844 0 50 GFAA NC(=O)C1CCN(C(=O)c2csc(NCc3ccccc3Cl)n2)CC1 40288040 YXHRFGZVRWXUPY-UHFFFAOYSA-N 378.885 2.746 0 50 GFAA Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N[C@H](C)c2nc(N)n[nH]2)cc1 426396651 RIABMEWGIVLFAA-CQSZACIVSA-N 387.447 3.039 0 50 GFAA COc1ccc(NC(=O)N2CCCC[C@@H]2CCN2CCN(C)CC2)c(F)c1 426433937 BZEIZCAJACTOJV-MRXNPFEDSA-N 378.492 2.858 0 50 GFAA O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCCC[C@H]1CCO 180426708 USBBLQMSSUBPDH-KRWDZBQOSA-N 381.467 2.876 0 50 GFAA COC(=O)c1ccc(OC)c(NC(=O)N2CCN(c3cccc(C)n3)CC2)c1 95530022 WSXCPUCPJYYLCO-UHFFFAOYSA-N 384.436 2.539 0 50 GFAA O=C1CCC2(CCN(C(=O)NCc3ccccc3)CC2)CN1CCc1c[nH]cn1 92046376 GHAIYOMCAGJQCD-UHFFFAOYSA-N 395.507 2.567 0 50 GFAA CC(C)O[C@@H](C)C(=O)N1CCC2(CCC(=O)N(CCc3ccncc3)C2)CC1 91468484 NRAOHLBJIYYNOH-SFHVURJKSA-N 387.524 2.669 0 50 GFAA O=C1[C@H]2CC[C@H](CN(Cc3cnn(-c4ccccc4)c3)C2)N1Cc1cscn1 95503413 VGEDBKTUSMUQKU-FXAWDEMLSA-N 393.516 2.952 0 50 GFAA COc1cc(CN(C)CC(C)C)ccc1OC[C@@H](O)CN1CCSCC1 95529584 TVXLLPZKSCWDAK-SFHVURJKSA-N 382.570 2.572 0 50 GFAA Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1 298618451 VCHGGTMDKPDHGA-LJQANCHMSA-N 382.464 2.867 0 50 GFAA O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1ccc(C(F)(F)F)cn1 298657199 ULLLEXUAOUOJNB-UHFFFAOYSA-N 379.338 2.825 0 50 GFAA O=C(CCc1ccc(O)cc1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1 183966435 HRTFIXQBSWEECU-JOCHJYFZSA-N 382.504 2.887 0 50 GFAA CCN1CCN(C(=O)c2cccc(-c3cccc4c(=O)cc(C)[nH]c34)c2)CC1=O 534656863 XELMNFXTPZXTEI-UHFFFAOYSA-N 389.455 2.808 0 50 GFAA CCN(C)C(=O)c1ccc(-c2cccc(C(=O)N(C)[C@H]3CCN(C)C3)c2)nc1 534632968 CNBJTVONUQLUJR-IBGZPJMESA-N 380.492 2.617 0 50 GFAA CNC(=O)[C@@H]1CCCN1C(=O)c1ccc(-c2cccc3c(=O)cc(C)[nH]c23)cc1 534675002 BDPADWUNZTYENZ-IBGZPJMESA-N 389.455 2.854 0 50 GFAA CN1C(=O)COc2cc(NC(=O)N3CCO[C@H](c4ccc(F)cc4)C3)ccc21 374181662 COYZGJZOSMMEPC-SFHVURJKSA-N 385.395 2.786 0 50 GFAA Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N[C@H](c1ncnn1C)C(C)C 299786138 MCJCHHUZKIEJOL-KRWDZBQOSA-N 384.484 2.878 0 50 GFAA Cc1nc([C@H](C)N(C)C(=O)NCCn2ncc3ccccc3c2=O)c(C)s1 584899732 FJKYGRMRFOZZRT-LBPRGKRZSA-N 385.493 2.872 0 50 GFAA c1ccc(N2CCC3(CC2)N=C(c2ccnc(N4CCCCC4)c2)NO3)nc1 1875276782 BTNLYJRXKSFVIK-UHFFFAOYSA-N 378.480 2.745 0 50 GFAA CC1(C)CCCc2c1nc(Cl)[nH]c2=NC[C@@H]1CC12CCS(=O)(=O)CC2 1875329658 BMSRENGSGGGYTI-LBPRGKRZSA-N 383.945 2.793 0 50 GFAA O[C@@H]1C[C@H](Cn2cccn2)C[C@H]1NCc1ccc(OCc2cccnc2)cc1 1875399572 DBQXIGRHOAEANO-CEMLEFRQSA-N 378.476 2.786 0 50 GFAA CC(C)n1cc2c(n1)[C@H](O)CC1(CCN(C(=O)c3ccnn3C(F)F)CC1)O2 1875394860 ZBQWHAWSUZHFDY-CYBMUJFWSA-N 395.410 2.547 0 50 GFAA CCCN(C(=O)[C@H]1CCn2nccc2C1)C1CCN(c2cc(C)nc(C)n2)CC1 1875306433 FZDDBVCCHPUDNT-SFHVURJKSA-N 396.539 2.760 0 50 GFAA CN(Cc1ccc([S@](C)=O)cc1)C(=O)N[C@H]1COc2c(F)cc(F)cc2C1 1351563583 KONMKHPIFOBNHN-RXAIFQJESA-N 394.443 2.847 0 50 GFAA O=C1[C@@H]2CC[C@@H](CN(CCOc3ccc(F)cc3)C2)N1Cc1cscn1 1565526716 RAVZUTFOTKFJHO-PBHICJAKSA-N 375.469 2.784 0 50 GFAA O[C@H]1CN(Cc2c[nH]nc2-c2ccc(Cl)cc2)CC[C@@H]1Nc1ncccn1 1565510942 FYVPHBGMNWDXIL-IRXDYDNUSA-N 384.871 2.567 0 50 GFAA CC(C)COc1ccc(C(C)(C)C(=O)N2CCS(=O)(=O)C[C@H](C)C2)cc1 191903641 IJJFALKJSUYGJH-MRXNPFEDSA-N 381.538 2.892 0 50 GFAA CN1C(=O)COc2ccc(NC(=O)NC[C@@H](O)c3cc(F)cc(Cl)c3)cc21 785838618 OUYHGWWFQZUIRZ-OAHLLOKOSA-N 393.802 2.689 0 50 GFAA CO[C@H](C(=O)N1CCCN(Cc2n[nH]c(C)c2Cl)CC1)c1ccccc1 1775979107 XSZGQDXYCVGPOW-SFHVURJKSA-N 376.888 2.794 0 50 GFAA CCOC(=O)[C@@]1(Cc2ccc(F)cc2)CCCN(C(=O)CCn2cccn2)C1 11815277 OWSPJDRQTHAKCW-OAQYLSRUSA-N 387.455 2.827 0 50 GFAA Cc1cc(C(=O)N2CCC(=O)N(Cc3ccc4ccccc4c3)CC2)n(C)n1 12331731 ALDJGDJYQGDDGR-UHFFFAOYSA-N 376.460 2.756 0 50 GFAA COc1ccc(C(=O)NCc2ncccc2C)cc1OC1CCN(C(C)=O)CC1 15069898 QBUABGNOEMBZLQ-UHFFFAOYSA-N 397.475 2.718 0 50 GFAA CN(C)CCCN(C)[C@H]1CCCN(C(=O)CCc2nc(-c3ccccc3)no2)C1 19112607 ABSZHPWOLIPJNV-IBGZPJMESA-N 399.539 2.544 0 50 GFAA COC(=O)c1c(NC(=O)CN2CCOCC2)sc2c1CC[C@@H](C(C)(C)C)C2 19902722 KPLLQTTXOQHOPX-CYBMUJFWSA-N 394.537 2.956 0 50 GFAA COC(=O)C[C@@H](c1cc(F)c(F)c(F)c1)c1c(O)n2ccccc2nc1=O 205971046 OIGMVHDJTNTRMJ-JTQLQIEISA-N 378.306 2.512 0 50 GFAA O=C(N[C@H]1C[C@H](Cn2cccn2)C[C@@H]1O)c1ccc(Nc2cccnc2)cc1 1857532682 FKGMMICNUWXBKO-YSSFQJQWSA-N 377.448 2.591 0 50 GFAA CC1(C(=O)N2CCC3(CC2)CN(Cc2cccnc2)C[C@@H]3C(=O)O)CCCC1 1857685503 LKSUAISCSYCIMI-GOSISDBHSA-N 385.508 2.787 0 50 GFAA CCOC(=O)CCNC(=O)C[C@@H]1CCCN(c2nc3cc(OC)ccc3o2)C1 1857718097 NSJJMXKXHKTLKB-AWEZNQCLSA-N 389.452 2.512 0 50 GFAA COc1ccc(Cl)cc1C(=O)N1C[C@H](O)[C@]2(C1)[C@H](c1ccccc1)[C@H]2CO 1857721107 ZCJFPZHBSBXJSW-WQZMEWCLSA-N 387.863 2.558 0 50 GFAA O=C1CC[C@]2(C(=O)N3CCC[C@H]4C(O)=NC[C@H]43)Sc3ccc(Cl)cc3N12 328586494 MKDIFABUYIRXDR-AEDCBLDQSA-N 391.880 2.846 0 50 GFAA CN(C)C(=O)CN1C[C@@H]2CC[C@H](C1)CN2Cc1csc(-c2ccccc2)n1 248063277 ZJKDMPYLCKZDRC-APWZRJJASA-N 384.549 2.795 0 50 GFAA CC(=O)N1CCCCC[C@H]1C1CCN(C(=O)c2cccc(-n3cncn3)c2)CC1 363585023 GAHLKHKAXMUQON-NRFANRHFSA-N 395.507 2.911 0 50 GFAA Oc1cc(C(F)(F)C(F)(F)F)nc(-c2cccc(CN3CC(O)C3)c2)n1 23312350 WOLXZLMXMQMWJY-UHFFFAOYSA-N 375.297 2.680 0 50 GFAA O=C(c1cn(Cc2cccc(F)c2)nn1)N1CC2(CCN2Cc2ccccc2)C1 910780341 BWCYWAWSMAZUNY-UHFFFAOYSA-N 391.450 2.566 0 50 GFAA COc1ccccc1[C@H](O)C(=O)N[C@@H](C)[C@@H](O)c1ccc(Br)cc1 2325762358 XRYMIIFZPRUIER-JECHBYEQSA-N 394.265 2.729 0 50 GFAA COCC(C)(C)C(=O)N[C@@H](CCN(C)C(=O)c1ccc2[nH]ccc2n1)C(C)C 2325793079 DYZSQLOSFMSVHR-HNNXBMFYSA-N 388.512 2.838 0 50 GFAA CC(=O)CCCCCCC(=O)N1C[C@@H](n2cc(-c3ccc(N)cn3)nn2)[C@H](C)C1 2325872258 OZGPLZVSYRWKSW-FOIQADDNSA-N 398.511 2.871 0 50 GFAA CC(C)c1nocc1C(=O)N1CC2(C[C@@H](NC(=O)CC3(C)CC3)c3nccn32)C1 2332237615 DSHLLABEDZWVGI-OAHLLOKOSA-N 397.479 2.597 0 50 GFAA COc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)O)cc1Cl 1050729 FVSDFHKTRXNTNX-UHFFFAOYSA-N 383.853 2.667 0 50 GFAA CCOC(=O)COc1cc(N2C(=O)CSCC2=O)c(Cl)cc1Cl 1397925 XMCSJCZMJXHRNV-UHFFFAOYSA-N 378.233 2.542 0 50 GFAA Cc1cc(C)n2c(SCC(C)(C)NS(=O)(=O)c3ccccc3)nnc2n1 2708596 CVTABZPBMKBFCL-UHFFFAOYSA-N 391.522 2.590 0 50 GFAA CCCCN1C(=O)c2ccc(C(=O)Nc3ccc(OCC(=O)O)cc3)cc2C1=O 2850425 ADAVNFGGVYLKJM-UHFFFAOYSA-N 396.399 2.798 0 50 GFAA COc1ccc(N2C(=O)N(c3cccc(Cl)c3)[C@@H]3CS(=O)(=O)C[C@H]32)cc1 4199470 PONLFMUXXVZTLB-IAGOWNOFSA-N 392.864 2.961 0 50 GFAA C[C@H](Sc1nnc(-c2ccncc2)n1C)C(=O)Nc1ccc2c(c1)OCO2 4736161 NWHBXPRKURQKEI-NSHDSACASA-N 383.433 2.725 0 50 GFAA C[C@@H](Oc1ccccc1)C(=O)N1CCCN(C(=O)[C@@H](C)Oc2ccccc2)CC1 8567355 ZFWHFIKEVJKILW-RTBURBONSA-N 396.487 2.982 0 50 GFAA CCN(CC)CCC(=O)NC[C@H]1Cc2cc(Cl)cc(-c3ncccn3)c2O1 11838674 YVZGQXXDSMRERY-MRXNPFEDSA-N 388.899 2.949 0 50 GFAA COc1cc(N2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3=O)C2)ncn1 11842073 MTZYZSKUYPOTHQ-FQEVSTJZSA-N 388.418 2.783 0 50 GFAA CCOC(=O)c1cnn(-c2nc3ccccc3s2)c1CN1CCC[C@H](O)C1 11980140 TZGKHCSOQRHYEA-ZDUSSCGKSA-N 386.477 2.615 0 50 GFAA CCOC(=O)N1CCC(NC(=O)[C@H]2CCC(=O)N(C3CCCCCC3)C2)CC1 12051489 NENMWOMEOVATSE-INIZCTEOSA-N 393.528 2.685 0 50 GFAA Cc1n[nH]c(C)c1S(=O)(=O)N1CCc2onc(-c3ccc(F)c(F)c3)c2C1 12091246 YZYWTEHCQVEGBJ-UHFFFAOYSA-N 394.403 2.707 0 50 GFAA O=C(NCCc1cccs1)[C@@H]1CCCN(C2CCN(C(=O)C3CC3)CC2)C1 12200787 MUEVSCTUDWYWKL-QGZVFWFLSA-N 389.565 2.520 0 50 GFAA COCCN(C[C@H]1CCCN(C2Cc3ccccc3C2)C1)C(=O)CCC(C)=O 12431240 OJPPUOOZXSETBC-IBGZPJMESA-N 386.536 2.710 0 50 GFAA COc1ccc(Cc2noc(CN(CCO)Cc3ccccc3)n2)cc1OC 12580658 HFJQNVWKIXMOII-UHFFFAOYSA-N 383.448 2.672 0 50 GFAA CC(=O)Nc1ccc(CN2CCC(CCC(=O)NC[C@@H]3CCCO3)CC2)cc1 12594409 WINVKXZYWFOFDL-NRFANRHFSA-N 387.524 2.932 0 50 GFAA COc1ccc(Cn2cc(C(=O)N(C)C3CC(C)(C)NC(C)(C)C3)nn2)cc1 12708545 GSICQCMBEOGIES-UHFFFAOYSA-N 385.512 2.716 0 50 GFAA CCN(c1ccc(C(=O)NCCSc2ccccc2)cc1)S(C)(=O)=O 13681548 DNTANNKNVMUYAQ-UHFFFAOYSA-N 378.519 2.995 0 50 GFAA COC(=O)c1c(NC(C)=O)c2cc(N[C@H](C)CO)cnc2n1CCC(C)C 14533358 OWCPASVNHJHRJA-GFCCVEGCSA-N 376.457 2.620 0 50 GFAA O=C(NCCN1CCCCC1=O)c1cc(COc2ccc3ncccc3c2)on1 15073941 UFYUJUSWTJBGBI-UHFFFAOYSA-N 394.431 2.544 0 50 GFAA Cc1nc(N(C)C2CCCCC2)ncc1[C@@H](C)NC(=O)CCC(=O)N(C)C 15076172 BRIZVTGBKOWEJU-CQSZACIVSA-N 375.517 2.600 0 50 GFAA C[C@]1(C(=O)NCCCn2cc(Cl)cn2)CC1(Br)Br 17081732 OEFFEJJDPZVYOR-SNVBAGLBSA-N 399.514 2.939 0 50 GFAA Cc1ncc2c(c1-c1noc([C@@H]3CC(=O)Nc4ccc(F)cc43)n1)CCNC2 20539093 UIAXSPIAYCKHHN-OAHLLOKOSA-N 379.395 2.699 0 50 GFAA c1cncc(CN2CCCN(Cc3c[nH]nc3-c3ccc4c(c3)OCO4)CC2)c1 23095255 KVPNTCWQHAZDFN-UHFFFAOYSA-N 391.475 2.908 0 50 GFAA OCc1ccccc1CN1CCN(Cc2cccc(Cn3cccn3)c2)CC1 55405098 PPKOMGLOOLGMFQ-UHFFFAOYSA-N 376.504 2.742 0 50 GFAA COc1ccccc1NC(=O)CCNC(=O)[C@@H]1CCCN(Cc2ccco2)C1 55414281 YMCPLNSRJCQOJF-MRXNPFEDSA-N 385.464 2.645 0 50 GFAA Cc1[nH]c2c(C(=O)N3CCC[C@@H](Cn4cc(C(=O)O)nn4)C3)cccc2c1C 67769674 PWGWTNRQOFNISF-CQSZACIVSA-N 381.436 2.627 0 50 GFAA CN1C(=O)[C@](CC(=O)NCc2ccno2)(Cc2ccccc2)c2ccccc21 71498607 ZMVLNELDVBIJSC-QFIPXVFZSA-N 375.428 2.838 0 50 GFAA COc1nc2c(cc1CNC(=O)CCC(F)(F)F)C(=O)N(C1CCCC1)C2 71764159 YMTMOZPQXGNTCI-UHFFFAOYSA-N 385.386 2.947 0 50 GFAA Cc1cccc(C(=O)N2CCC(N3CCC[C@H](C(=O)N4CCCC4)C3)CC2)c1 71774434 NXBMAYALIWIOAA-FQEVSTJZSA-N 383.536 2.934 0 50 GFAA COc1ccc2cc(CN3C[C@@H](C(=O)O)C[C@@H](C(=O)NC4CC4)C3)ccc2c1 72153543 ZOIYNZSIPXVANP-MSOLQXFVSA-N 382.460 2.650 0 50 GFAA Cc1nc([C@@H]2CCCN(c3ncc(C)c(N(C)C)n3)C2)cc(N2CCCC2)n1 72439771 MXJLAQYEOAQBDK-QGZVFWFLSA-N 381.528 2.934 0 50 GFAA CCc1nn(C)c(Cl)c1CN1C[C@H]2CC[C@@H]1CN(C(=O)c1ccncc1)C2 95362978 IGCQMPSRJUOVJI-GDBMZVCRSA-N 387.915 2.768 0 50 GFAA O=C(Cc1cccc(O)c1)N1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1 95378901 UHVOENIDYJKJMB-MDNUFGMLSA-N 378.472 2.729 0 50 GFAA COCCn1ccnc1[C@@H]1CCCN(C(=O)c2c(C)nc3cc(C)ccn23)C1 95496588 XWRRYHPUILECCT-QGZVFWFLSA-N 381.480 2.814 0 50 GFAA COc1ccc(C(=O)N2CCC[C@]3(CCC(=O)N(CCc4ccccn4)C3)C2)o1 95525204 YCMXSLGJEWCMQA-JOCHJYFZSA-N 397.475 2.771 0 50 GFAA CN(CC(=O)N1CCC[C@H](c2nccn2Cc2cscn2)C1)C1CCCC1 95527533 ZPZRCGBRCMHGRB-INIZCTEOSA-N 387.553 2.968 0 50 GFAA COc1cccc2c1NC(=O)C[C@H]2C(=O)N(C)Cc1ccc2nsnc2c1 97323875 IVMNTACVAFRNDK-CYBMUJFWSA-N 382.445 2.784 0 50 GFAA O=C1CCCCCN1CCC(=O)N1CCn2nc(Cc3ccccc3)cc2C1 97492550 ARUXODXPFRCOBK-UHFFFAOYSA-N 380.492 2.609 0 50 GFAA CC(C)OC(=O)c1ccc(NC(=O)CCN2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 101464570 CLGNYRFBYDAFII-ILRDRHFLSA-N 398.459 2.612 0 50 GFAA O=C(c1ccc(-n2cncn2)nc1)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 109693209 WZQMPONROFCKAS-LJQANCHMSA-N 397.866 2.902 0 50 GFAA O=C(Cc1ccc(F)cc1)NCc1nnc2c(-c3nc(C4CC4)no3)cccn12 169776077 CLKKHQFNTJOLIK-UHFFFAOYSA-N 392.394 2.655 0 50 GFAA COC(=O)[C@](C)(NC(=O)Cn1cc(C2CC2)nn1)c1ccc(Cl)c(Cl)c1 170599522 MTXPQBCVEGUSEG-QGZVFWFLSA-N 397.262 2.667 0 50 GFAA O=C(Cc1ccccc1OC(F)F)N[C@@H]1CCS(=O)(=O)c2ccccc21 172373743 WACQLWRQUJRMIM-CQSZACIVSA-N 381.400 2.865 0 50 GFAA O=C(NCC(=O)N1CCCc2ccccc21)c1cnc(-c2ccncc2)s1 172801806 NONVZFFQYOFWON-UHFFFAOYSA-N 378.457 2.914 0 50 GFAA Cc1nc2n(n1)CCC[C@H]2NS(=O)(=O)/C=C/c1cccc(Br)c1 177006142 IIYIYEOBYOIFAT-RCQQVGEISA-N 397.298 2.774 0 50 GFAA CN1CCN(c2ccc(C(=O)NCc3nc(C4CCCCC4)no3)cc2)CC1 223248260 KUXFPBHRUGRLHU-UHFFFAOYSA-N 383.496 2.799 0 50 GFAA C[C@@H]1CN(C[C@H]2CCCN2S(=O)(=O)C2=Cc3ccccc3CC2)C[C@@H](C)O1 229656583 DJZWGVVBQSVULJ-MBOZVWFJSA-N 390.549 2.877 0 50 GFAA Cc1cc(C)n(-c2ccc(C(=O)N(CCC(=O)O)C[C@@H]3CCCO3)cc2F)n1 237679878 OIUDUGSVGMXEEE-INIZCTEOSA-N 389.427 2.724 0 50 GFAA O=C(Cn1ccc(=O)c2ccccc21)N1CCC(C(=O)O)(c2ccccc2)CC1 238063217 ZNZBJPAPPGVWFY-UHFFFAOYSA-N 390.439 2.647 0 50 GFAA Cc1cccc(N2C[C@@H](NC(=O)c3cc(=O)c4ccc(C)cc4o3)CC2=O)c1 244652026 GYLIAFZZQWDHIL-HNNXBMFYSA-N 376.412 2.945 0 50 GFAA CCN1CCC[C@@H]1CNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 249694253 ORKFZFIDOVTHAI-LSDHHAIUSA-N 384.446 2.917 0 50 GFAA O=C1N[C@@H]2CS[C@@H](CCCCC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)[C@H]2N1 252513321 YGNSTQMBYJBWHB-XYHNHIMXSA-N 377.554 2.749 0 50 GFAA CCc1ccc(CNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 252569116 WBLUMGRRBHSACX-UHFFFAOYSA-N 386.517 2.939 0 50 GFAA CSc1ccc(Cl)c(C(=O)N2CC[C@H](N(C)Cc3nccc(N)n3)C2)c1 275620234 JDHXFTOOGGPTPF-LBPRGKRZSA-N 391.928 2.781 0 50 GFAA CCCc1sc(C(=O)N2CC[C@@H](N(C)Cc3nccc(N)n3)C2)cc1CC 275709942 NZQKWLLCOWLWAZ-OAHLLOKOSA-N 387.553 2.982 0 50 GFAA Cc1ccc2c(c1)CN(C(=O)N[C@H]1CCS(=O)(=O)c3ccccc31)CCO2 289031913 JJGKYYVEKCEROB-KRWDZBQOSA-N 386.473 2.818 0 50 GFAA Cn1nnc2c1C[C@@H](C(=O)N1CCN(Cc3ccccc3)c3ccccc31)CC2 291649239 GWGJTNAKJNDOBM-SFHVURJKSA-N 387.487 2.973 0 50 GFAA Cc1ccc(S[C@H](C)C(=O)N2CCN(c3ccc4nccn4n3)CC2)cc1 299791072 CICVGOZHKGNHGD-MRXNPFEDSA-N 381.505 2.867 0 50 GFAA COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)Cc2c(C)nn(C)c2C)cc1 363253298 LFUYVDLJTYLQFJ-VLIAUNLRSA-N 398.507 2.854 0 50 GFAA C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)c1ccc(CS(C)(=O)=O)o1 363350557 ZWXQQCWFAKBBDX-INIZCTEOSA-N 390.505 2.561 0 50 GFAA O=C(NCc1ccccc1Cn1ccnc1)Nc1cnn(C[C@@H]2CCCO2)c1 363435780 XAQVKWKSYTWMPK-IBGZPJMESA-N 380.452 2.629 0 50 GFAA Cc1cc(CCNC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)on1 376487535 MBMZNXOLLDWSAQ-ZDUSSCGKSA-N 382.386 2.972 0 50 GFAA COc1cc(S(=O)(=O)Nc2cc(C)n(C(C)C)n2)c(Cl)cc1C(=O)O 421188509 XZWJOUUXZWSVIY-UHFFFAOYSA-N 387.845 2.933 0 50 GFAA Cc1cc(C)n(C[C@@H](C)NC(=O)N2CCC3(CC2)C(=O)Nc2ccccc23)n1 426382783 OJAQPWYGMIBOKH-OAHLLOKOSA-N 381.480 2.584 0 50 GFAA Cc1ccc(-n2cc(NC(=O)N3CCCC[C@@H]3CS(C)(=O)=O)cn2)c(C)c1 455250482 JXMWPEFSZUZANZ-QGZVFWFLSA-N 390.509 2.920 0 50 GFAA Cn1cc(-c2noc(Cc3cnn(-c4ccccc4)n3)n2)c(C(F)(F)F)n1 752900934 RMYQMFUYIPCHEP-UHFFFAOYSA-N 375.314 2.660 0 50 GFAA Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc3c(c2)S(=O)(=O)CC(=O)N3)cc1 880985265 USIRVMXVDNGWIH-ZDUSSCGKSA-N 387.461 2.946 0 50 GFAA COc1ccc(C(=O)N2CCC(NC(=O)N[C@]34CCC[C@@H]3C4)CC2)c(OC)c1 888101726 NBHXQDXNLGMFLY-SZNDQCEHSA-N 387.480 2.550 0 50 GFAA CC(C)(C)OC(=O)N1CCn2nc(NC(=O)c3nc(Cl)cs3)cc2C1 888873803 RJFWQKFSTXQPSW-UHFFFAOYSA-N 383.861 2.996 0 50 GFAA COc1ccc([C@@H](O)CNC(=O)C2(N3CCCC3)CCCCC2)cc1OC 952872739 SQLQZPSGYGVUDY-KRWDZBQOSA-N 376.497 2.652 0 50 GFAA CN(C)CC(=O)Nc1ccccc1NC(=O)c1cc(-c2ccccc2)n(C)n1 952977620 NSQPRXODHCYYLI-UHFFFAOYSA-N 377.448 2.840 0 50 GFAA COc1cccc([C@H]2CCN(C3CCN(C(=O)c4cnccn4)CC3)C2)c1OC 952977723 KVCOIPFSAWGOPM-INIZCTEOSA-N 396.491 2.588 0 50 GFAA O=C(c1ccc2c3c([nH]c2c1)CCCC3)N1CCC(C(=O)N2CCOCC2)CC1 1506420142 VYQJCYSYIMBOFY-UHFFFAOYSA-N 395.503 2.758 0 50 GFAA O=C(N[C@H]1CCOC[C@@H]1Oc1cccc(F)c1)C1(N2CCCC2)CCCC1 1565531022 HKSCTZRAQQNIJU-OALUTQOASA-N 376.472 2.887 0 50 GFAA CCOc1cc(CN2C[C@H](Cc3cnccn3)[C@@H](O)C2)c(Cl)cc1OC 1616078503 YOZVPQWKKRWEJC-YOEHRIQHSA-N 377.872 2.573 0 50 GFAA Cc1cc(C(=O)N2CCCN(C(=O)c3snnc3C(C)C)CC2)cnc1C 1772712972 XFRAZVDZCSGLRK-UHFFFAOYSA-N 387.509 2.662 0 50 GFAA CCc1ccccc1CN1C[C@@H](C(=O)O)C2(CCN(Cc3ncc[nH]3)CC2)C1 1857684144 AOYMLUWMTFWCHI-IBGZPJMESA-N 382.508 2.771 0 50 GFAA O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@H]2CO[C@@H](CCO)CN2C1 1857727475 SZLDRXMMFLSITJ-HKBOAZHASA-N 381.476 2.699 0 50 GFAA Cc1noc(C)c1CCC(=O)N1CC[C@@]23O[C@@H](c4ccccc4)CN2C(=O)C[C@@H]13 1857733235 AVHJSQJSLGGOKV-KNKQGSTJSA-N 395.459 2.525 0 50 GFAA CC/C(C)=C/CCN1C[C@@H]2[C@H](CNC(=O)C3(COC)CC3)[C@H]3CC[C@]2(C1)O3 1857733816 ZXVMEVCSAMHLGM-MINDVARLSA-N 376.541 2.755 0 50 GFAA CC(=O)c1ccnc(N2C[C@@H]3[C@H](CNC(=O)c4ccccc4)[C@H]4CC[C@]3(C2)O4)c1 1857738120 RUJBREHIXFTEOA-DZCCDHAISA-N 391.471 2.698 0 50 GFAA CN(C)C[C@H](O)Cn1cc(NC(=O)C(C)(C)c2cccc3ccccc23)cn1 1875266102 RIADWTJTWAUVMJ-SFHVURJKSA-N 380.492 2.875 0 50 GFAA O=C(c1nc(-c2cccs2)n(-c2cccc(F)c2)n1)N1C[C@@H]2C[C@@H](O)[C@H]2C1 1875268048 COLYPVMBKVZAFP-TUKIKUTGSA-N 384.436 2.588 0 50 GFAA O=C(c1ccc2c(O)ncnc2c1)N1CC[C@@](O)(Cc2ccc(Cl)cc2)C1 1875297307 KNCKKFLWLWWRLF-HXUWFJFHSA-N 383.835 2.809 0 50 GFAA C[C@H](NC(=O)[C@H](O)CN1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1875308679 RLLTZTZEFWETBJ-MGPUTAFESA-N 399.466 2.712 0 50 GFAA CCn1ccc(C(=O)N2CCC[C@@H]([C@H]3CCCCN3c3ncc(F)cn3)C2)n1 1875312492 MZQWPSSIJDGHNP-CRAIPNDOSA-N 386.475 2.743 0 50 GFAA CCCc1cc(C(=O)N[C@H]2CCN(c3ncnc(CC)c3F)C[C@@H]2CC)n[nH]1 1875334105 YHIUTHXQBSFVCN-BBRMVZONSA-N 388.491 2.889 0 50 GFAA CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)[C@@H]3CCCc4nc(C)[nH]c43)C2)ccn1 2325806419 SBISGPOZESQSOO-RTBURBONSA-N 397.523 2.665 0 50 GFAA Cc1c(O)c(=O)ccn1CC(=O)N[C@H](COc1ccccc1)c1ccc(F)cc1 2325876477 WPTZBIDRLYGUST-LJQANCHMSA-N 396.418 2.938 0 50 GFAA COc1ccccc1CCC(=O)N1CCC[C@@]2(CCc3cnc(N(C)C)nc32)C1 2356137135 GRIOWXRTSYDJES-HSZRJFAPSA-N 394.519 2.990 0 50 GFAA Cc1nc(-c2ccc(C(=O)N3CCCN(C(=O)C4CC4)CC3)cc2)ccc1O 2356150101 LULBIKMRBQWESB-UHFFFAOYSA-N 379.460 2.847 0 50 GFAA O=C(c1cc2c(s1)CCOC21CCNCC1)N1CCC[C@@H](c2ncc[nH]2)C1 2356156046 SXSUPGYRRATOQI-CQSZACIVSA-N 386.521 2.642 0 50 GFAA CN1CC[C@H](O)[C@@]2(CCCN(C(=O)c3cc4cccc(Cl)c4n3C)C2)C1 2356158027 BBLWVCCEZRULEI-PXNSSMCTSA-N 375.900 2.751 0 50 GFAA COc1cnc(C)cc1C(=O)N1CCC[C@@]12CCCN(Cc1ccccn1)C2=O 2356158915 DVNJWJIOBXPDCL-JOCHJYFZSA-N 394.475 2.591 0 50 GFAA COc1cc(Nc2nccc(N3CCC[C@H](O)C3)n2)c(Cl)cc1C(=O)O 2356167876 GYSPSGWXHGMVGD-JTQLQIEISA-N 378.816 2.542 0 50 GFAA